data_6YXM
# 
_entry.id   6YXM 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.342 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
PDB   6YXM         
WWPDB D_1292108467 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        6YXM 
_pdbx_database_status.recvd_initial_deposition_date   2020-05-03 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Ge, C.'       1 ? 
'Holmdahl, R.' 2 ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
'N-linked glycosylation of the immunoglobulin variable domain affects antigen binding and autoreactive B cell activation' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Ge, C.'       1 ? 
primary 'Holmdahl, R.' 2 ? 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     6YXM 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     53.010 
_cell.length_a_esd                 ? 
_cell.length_b                     89.650 
_cell.length_b_esd                 ? 
_cell.length_c                     118.680 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
# 
_symmetry.entry_id                         6YXM 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                19 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 21 21 21' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man CII-C-39-CIT 1187.374  1  ? ? ? ? 
2 polymer     man 'ACPA 1F2 Fab fragment - heavy chain' 23550.391 1  ? ? ? ? 
3 polymer     man 'ACPA 1F2 Fab fragment - light chain' 23044.248 1  ? ? ? ? 
4 branched    man 
;beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose
;
732.682   1  ? ? ? ? 
5 non-polymer syn CITRULLINE 175.186   1  ? ? ? ? 
6 non-polymer man 'ZINC ION' 65.409    4  ? ? ? ? 
7 water       nat water 18.015    33 ? ? ? ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no no LPGQCIRGERG LPGQCIRGERG BBB ? 
2 'polypeptide(L)' no no 
;QVHLEQSGSELKKPGASVTISCKTSGYNFSHFAINWVRQAPGQGLQWMGWINTKTANLTYAQTFTGRFVFSFDTSVSTAY
LHIHGLKTEDTAMYYCVRGGSLGIFGGSVGYWGQGALVSVSSAKTTPPSVYPLAPGCGDTTGSSVTLGCLVKGYFPESVT
VTWNSGSLSSSVHTFPALLQSGLYTMSSSVTVPSSTWPSQTVTCSVAHPASSTTVDKKIEPR
;
;QVHLEQSGSELKKPGASVTISCKTSGYNFSHFAINWVRQAPGQGLQWMGWINTKTANLTYAQTFTGRFVFSFDTSVSTAY
LHIHGLKTEDTAMYYCVRGGSLGIFGGSVGYWGQGALVSVSSAKTTPPSVYPLAPGCGDTTGSSVTLGCLVKGYFPESVT
VTWNSGSLSSSVHTFPALLQSGLYTMSSSVTVPSSTWPSQTVTCSVAHPASSTTVDKKIEPR
;
HHH ? 
3 'polypeptide(L)' no no 
;NLTLIQSRSVSGSPGQTVSISCTANGAHIGDSYVQWFQQRPGSAPRSVIFEDDKRPSGVPDRLSGSTDFSSNSASLTISG
LESEDEADYYCQSYYRGDWVLGGGTKLTVLGQPKSSPSVTLFPPSSEELETNKATLVCTITDFYPGVVTVDWKVDGTPVT
QGMETTQPSKQSNNKYMASSYLTLTARAWERHSSYSCQVTHEGHTVEKSLSR
;
;NLTLIQSRSVSGSPGQTVSISCTANGAHIGDSYVQWFQQRPGSAPRSVIFEDDKRPSGVPDRLSGSTDFSSNSASLTISG
LESEDEADYYCQSYYRGDWVLGGGTKLTVLGQPKSSPSVTLFPPSSEELETNKATLVCTITDFYPGVVTVDWKVDGTPVT
QGMETTQPSKQSNNKYMASSYLTLTARAWERHSSYSCQVTHEGHTVEKSLSR
;
LLL ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   LEU n 
1 2   PRO n 
1 3   GLY n 
1 4   GLN n 
1 5   CYS n 
1 6   ILE n 
1 7   ARG n 
1 8   GLY n 
1 9   GLU n 
1 10  ARG n 
1 11  GLY n 
2 1   GLN n 
2 2   VAL n 
2 3   HIS n 
2 4   LEU n 
2 5   GLU n 
2 6   GLN n 
2 7   SER n 
2 8   GLY n 
2 9   SER n 
2 10  GLU n 
2 11  LEU n 
2 12  LYS n 
2 13  LYS n 
2 14  PRO n 
2 15  GLY n 
2 16  ALA n 
2 17  SER n 
2 18  VAL n 
2 19  THR n 
2 20  ILE n 
2 21  SER n 
2 22  CYS n 
2 23  LYS n 
2 24  THR n 
2 25  SER n 
2 26  GLY n 
2 27  TYR n 
2 28  ASN n 
2 29  PHE n 
2 30  SER n 
2 31  HIS n 
2 32  PHE n 
2 33  ALA n 
2 34  ILE n 
2 35  ASN n 
2 36  TRP n 
2 37  VAL n 
2 38  ARG n 
2 39  GLN n 
2 40  ALA n 
2 41  PRO n 
2 42  GLY n 
2 43  GLN n 
2 44  GLY n 
2 45  LEU n 
2 46  GLN n 
2 47  TRP n 
2 48  MET n 
2 49  GLY n 
2 50  TRP n 
2 51  ILE n 
2 52  ASN n 
2 53  THR n 
2 54  LYS n 
2 55  THR n 
2 56  ALA n 
2 57  ASN n 
2 58  LEU n 
2 59  THR n 
2 60  TYR n 
2 61  ALA n 
2 62  GLN n 
2 63  THR n 
2 64  PHE n 
2 65  THR n 
2 66  GLY n 
2 67  ARG n 
2 68  PHE n 
2 69  VAL n 
2 70  PHE n 
2 71  SER n 
2 72  PHE n 
2 73  ASP n 
2 74  THR n 
2 75  SER n 
2 76  VAL n 
2 77  SER n 
2 78  THR n 
2 79  ALA n 
2 80  TYR n 
2 81  LEU n 
2 82  HIS n 
2 83  ILE n 
2 84  HIS n 
2 85  GLY n 
2 86  LEU n 
2 87  LYS n 
2 88  THR n 
2 89  GLU n 
2 90  ASP n 
2 91  THR n 
2 92  ALA n 
2 93  MET n 
2 94  TYR n 
2 95  TYR n 
2 96  CYS n 
2 97  VAL n 
2 98  ARG n 
2 99  GLY n 
2 100 GLY n 
2 101 SER n 
2 102 LEU n 
2 103 GLY n 
2 104 ILE n 
2 105 PHE n 
2 106 GLY n 
2 107 GLY n 
2 108 SER n 
2 109 VAL n 
2 110 GLY n 
2 111 TYR n 
2 112 TRP n 
2 113 GLY n 
2 114 GLN n 
2 115 GLY n 
2 116 ALA n 
2 117 LEU n 
2 118 VAL n 
2 119 SER n 
2 120 VAL n 
2 121 SER n 
2 122 SER n 
2 123 ALA n 
2 124 LYS n 
2 125 THR n 
2 126 THR n 
2 127 PRO n 
2 128 PRO n 
2 129 SER n 
2 130 VAL n 
2 131 TYR n 
2 132 PRO n 
2 133 LEU n 
2 134 ALA n 
2 135 PRO n 
2 136 GLY n 
2 137 CYS n 
2 138 GLY n 
2 139 ASP n 
2 140 THR n 
2 141 THR n 
2 142 GLY n 
2 143 SER n 
2 144 SER n 
2 145 VAL n 
2 146 THR n 
2 147 LEU n 
2 148 GLY n 
2 149 CYS n 
2 150 LEU n 
2 151 VAL n 
2 152 LYS n 
2 153 GLY n 
2 154 TYR n 
2 155 PHE n 
2 156 PRO n 
2 157 GLU n 
2 158 SER n 
2 159 VAL n 
2 160 THR n 
2 161 VAL n 
2 162 THR n 
2 163 TRP n 
2 164 ASN n 
2 165 SER n 
2 166 GLY n 
2 167 SER n 
2 168 LEU n 
2 169 SER n 
2 170 SER n 
2 171 SER n 
2 172 VAL n 
2 173 HIS n 
2 174 THR n 
2 175 PHE n 
2 176 PRO n 
2 177 ALA n 
2 178 LEU n 
2 179 LEU n 
2 180 GLN n 
2 181 SER n 
2 182 GLY n 
2 183 LEU n 
2 184 TYR n 
2 185 THR n 
2 186 MET n 
2 187 SER n 
2 188 SER n 
2 189 SER n 
2 190 VAL n 
2 191 THR n 
2 192 VAL n 
2 193 PRO n 
2 194 SER n 
2 195 SER n 
2 196 THR n 
2 197 TRP n 
2 198 PRO n 
2 199 SER n 
2 200 GLN n 
2 201 THR n 
2 202 VAL n 
2 203 THR n 
2 204 CYS n 
2 205 SER n 
2 206 VAL n 
2 207 ALA n 
2 208 HIS n 
2 209 PRO n 
2 210 ALA n 
2 211 SER n 
2 212 SER n 
2 213 THR n 
2 214 THR n 
2 215 VAL n 
2 216 ASP n 
2 217 LYS n 
2 218 LYS n 
2 219 ILE n 
2 220 GLU n 
2 221 PRO n 
2 222 ARG n 
3 1   ASN n 
3 2   LEU n 
3 3   THR n 
3 4   LEU n 
3 5   ILE n 
3 6   GLN n 
3 7   SER n 
3 8   ARG n 
3 9   SER n 
3 10  VAL n 
3 11  SER n 
3 12  GLY n 
3 13  SER n 
3 14  PRO n 
3 15  GLY n 
3 16  GLN n 
3 17  THR n 
3 18  VAL n 
3 19  SER n 
3 20  ILE n 
3 21  SER n 
3 22  CYS n 
3 23  THR n 
3 24  ALA n 
3 25  ASN n 
3 26  GLY n 
3 27  ALA n 
3 28  HIS n 
3 29  ILE n 
3 30  GLY n 
3 31  ASP n 
3 32  SER n 
3 33  TYR n 
3 34  VAL n 
3 35  GLN n 
3 36  TRP n 
3 37  PHE n 
3 38  GLN n 
3 39  GLN n 
3 40  ARG n 
3 41  PRO n 
3 42  GLY n 
3 43  SER n 
3 44  ALA n 
3 45  PRO n 
3 46  ARG n 
3 47  SER n 
3 48  VAL n 
3 49  ILE n 
3 50  PHE n 
3 51  GLU n 
3 52  ASP n 
3 53  ASP n 
3 54  LYS n 
3 55  ARG n 
3 56  PRO n 
3 57  SER n 
3 58  GLY n 
3 59  VAL n 
3 60  PRO n 
3 61  ASP n 
3 62  ARG n 
3 63  LEU n 
3 64  SER n 
3 65  GLY n 
3 66  SER n 
3 67  THR n 
3 68  ASP n 
3 69  PHE n 
3 70  SER n 
3 71  SER n 
3 72  ASN n 
3 73  SER n 
3 74  ALA n 
3 75  SER n 
3 76  LEU n 
3 77  THR n 
3 78  ILE n 
3 79  SER n 
3 80  GLY n 
3 81  LEU n 
3 82  GLU n 
3 83  SER n 
3 84  GLU n 
3 85  ASP n 
3 86  GLU n 
3 87  ALA n 
3 88  ASP n 
3 89  TYR n 
3 90  TYR n 
3 91  CYS n 
3 92  GLN n 
3 93  SER n 
3 94  TYR n 
3 95  TYR n 
3 96  ARG n 
3 97  GLY n 
3 98  ASP n 
3 99  TRP n 
3 100 VAL n 
3 101 LEU n 
3 102 GLY n 
3 103 GLY n 
3 104 GLY n 
3 105 THR n 
3 106 LYS n 
3 107 LEU n 
3 108 THR n 
3 109 VAL n 
3 110 LEU n 
3 111 GLY n 
3 112 GLN n 
3 113 PRO n 
3 114 LYS n 
3 115 SER n 
3 116 SER n 
3 117 PRO n 
3 118 SER n 
3 119 VAL n 
3 120 THR n 
3 121 LEU n 
3 122 PHE n 
3 123 PRO n 
3 124 PRO n 
3 125 SER n 
3 126 SER n 
3 127 GLU n 
3 128 GLU n 
3 129 LEU n 
3 130 GLU n 
3 131 THR n 
3 132 ASN n 
3 133 LYS n 
3 134 ALA n 
3 135 THR n 
3 136 LEU n 
3 137 VAL n 
3 138 CYS n 
3 139 THR n 
3 140 ILE n 
3 141 THR n 
3 142 ASP n 
3 143 PHE n 
3 144 TYR n 
3 145 PRO n 
3 146 GLY n 
3 147 VAL n 
3 148 VAL n 
3 149 THR n 
3 150 VAL n 
3 151 ASP n 
3 152 TRP n 
3 153 LYS n 
3 154 VAL n 
3 155 ASP n 
3 156 GLY n 
3 157 THR n 
3 158 PRO n 
3 159 VAL n 
3 160 THR n 
3 161 GLN n 
3 162 GLY n 
3 163 MET n 
3 164 GLU n 
3 165 THR n 
3 166 THR n 
3 167 GLN n 
3 168 PRO n 
3 169 SER n 
3 170 LYS n 
3 171 GLN n 
3 172 SER n 
3 173 ASN n 
3 174 ASN n 
3 175 LYS n 
3 176 TYR n 
3 177 MET n 
3 178 ALA n 
3 179 SER n 
3 180 SER n 
3 181 TYR n 
3 182 LEU n 
3 183 THR n 
3 184 LEU n 
3 185 THR n 
3 186 ALA n 
3 187 ARG n 
3 188 ALA n 
3 189 TRP n 
3 190 GLU n 
3 191 ARG n 
3 192 HIS n 
3 193 SER n 
3 194 SER n 
3 195 TYR n 
3 196 SER n 
3 197 CYS n 
3 198 GLN n 
3 199 VAL n 
3 200 THR n 
3 201 HIS n 
3 202 GLU n 
3 203 GLY n 
3 204 HIS n 
3 205 THR n 
3 206 VAL n 
3 207 GLU n 
3 208 LYS n 
3 209 SER n 
3 210 LEU n 
3 211 SER n 
3 212 ARG n 
# 
loop_
_entity_src_gen.entity_id 
_entity_src_gen.pdbx_src_id 
_entity_src_gen.pdbx_alt_source_flag 
_entity_src_gen.pdbx_seq_type 
_entity_src_gen.pdbx_beg_seq_num 
_entity_src_gen.pdbx_end_seq_num 
_entity_src_gen.gene_src_common_name 
_entity_src_gen.gene_src_genus 
_entity_src_gen.pdbx_gene_src_gene 
_entity_src_gen.gene_src_species 
_entity_src_gen.gene_src_strain 
_entity_src_gen.gene_src_tissue 
_entity_src_gen.gene_src_tissue_fraction 
_entity_src_gen.gene_src_details 
_entity_src_gen.pdbx_gene_src_fragment 
_entity_src_gen.pdbx_gene_src_scientific_name 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 
_entity_src_gen.pdbx_gene_src_variant 
_entity_src_gen.pdbx_gene_src_cell_line 
_entity_src_gen.pdbx_gene_src_atcc 
_entity_src_gen.pdbx_gene_src_organ 
_entity_src_gen.pdbx_gene_src_organelle 
_entity_src_gen.pdbx_gene_src_cell 
_entity_src_gen.pdbx_gene_src_cellular_location 
_entity_src_gen.host_org_common_name 
_entity_src_gen.pdbx_host_org_scientific_name 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 
_entity_src_gen.host_org_genus 
_entity_src_gen.pdbx_host_org_gene 
_entity_src_gen.pdbx_host_org_organ 
_entity_src_gen.host_org_species 
_entity_src_gen.pdbx_host_org_tissue 
_entity_src_gen.pdbx_host_org_tissue_fraction 
_entity_src_gen.pdbx_host_org_strain 
_entity_src_gen.pdbx_host_org_variant 
_entity_src_gen.pdbx_host_org_cell_line 
_entity_src_gen.pdbx_host_org_atcc 
_entity_src_gen.pdbx_host_org_culture_collection 
_entity_src_gen.pdbx_host_org_cell 
_entity_src_gen.pdbx_host_org_organelle 
_entity_src_gen.pdbx_host_org_cellular_location 
_entity_src_gen.pdbx_host_org_vector_type 
_entity_src_gen.pdbx_host_org_vector 
_entity_src_gen.host_org_details 
_entity_src_gen.expression_system_id 
_entity_src_gen.plasmid_name 
_entity_src_gen.plasmid_details 
_entity_src_gen.pdbx_description 
1 1 sample 'Biological sequence' 1 11  ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? 
? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 222 ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? 
? ? ? ? ? ? ? ? ? ? ? ? 
3 1 sample 'Biological sequence' 1 212 ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? 
? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 PDB 6YXM 6YXM ? 1 ? 1 
2 PDB 6YXM 6YXM ? 2 ? 1 
3 PDB 6YXM 6YXM ? 3 ? 1 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 6YXM BBB 1 ? 11  ? 6YXM 597 ? 605 ? 597 605 
2 2 6YXM HHH 1 ? 222 ? 6YXM 1   ? 222 ? 1   222 
3 3 6YXM LLL 1 ? 212 ? 6YXM 1   ? 212 ? 1   212 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking'           y ALANINE                                  ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking'           y ARGININE                                 ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking'           y ASPARAGINE                               ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking'           y 'ASPARTIC ACID'                          ? 'C4 H7 N O4'     133.103 
BMA 'D-saccharide, beta linking'  . beta-D-mannopyranose                     'beta-D-mannose; D-mannose; mannose' 'C6 H12 O6'      
180.156 
CIR 'L-peptide linking'           n CITRULLINE                               ? 'C6 H13 N3 O3'   175.186 
CYS 'L-peptide linking'           y CYSTEINE                                 ? 'C3 H7 N O2 S'   121.158 
FUC 'L-saccharide, alpha linking' . alpha-L-fucopyranose                     
'alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose; L-fucose; fucose' 'C6 H12 O5'      164.156 
GLN 'L-peptide linking'           y GLUTAMINE                                ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking'           y 'GLUTAMIC ACID'                          ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'             y GLYCINE                                  ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking'           y HISTIDINE                                ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer                   . WATER                                    ? 'H2 O'           18.015  
ILE 'L-peptide linking'           y ISOLEUCINE                               ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking'           y LEUCINE                                  ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking'           y LYSINE                                   ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking'           y METHIONINE                               ? 'C5 H11 N O2 S'  149.211 
NAG 'D-saccharide, beta linking'  . 2-acetamido-2-deoxy-beta-D-glucopyranose 
;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE
;
'C8 H15 N O6'    221.208 
PHE 'L-peptide linking'           y PHENYLALANINE                            ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking'           y PROLINE                                  ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking'           y SERINE                                   ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking'           y THREONINE                                ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking'           y TRYPTOPHAN                               ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking'           y TYROSINE                                 ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking'           y VALINE                                   ? 'C5 H11 N O2'    117.146 
ZN  non-polymer                   . 'ZINC ION'                               ? 'Zn 2'           65.409  
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   6YXM 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                      ? 
_exptl_crystal.density_diffrn              ? 
_exptl_crystal.density_Matthews            2.95 
_exptl_crystal.density_method              ? 
_exptl_crystal.density_percent_sol         58.32 
_exptl_crystal.description                 ? 
_exptl_crystal.F_000                       ? 
_exptl_crystal.id                          1 
_exptl_crystal.preparation                 ? 
_exptl_crystal.size_max                    ? 
_exptl_crystal.size_mid                    ? 
_exptl_crystal.size_min                    ? 
_exptl_crystal.size_rad                    ? 
_exptl_crystal.colour_lustre               ? 
_exptl_crystal.colour_modifier             ? 
_exptl_crystal.colour_primary              ? 
_exptl_crystal.density_meas                ? 
_exptl_crystal.density_meas_esd            ? 
_exptl_crystal.density_meas_gt             ? 
_exptl_crystal.density_meas_lt             ? 
_exptl_crystal.density_meas_temp           ? 
_exptl_crystal.density_meas_temp_esd       ? 
_exptl_crystal.density_meas_temp_gt        ? 
_exptl_crystal.density_meas_temp_lt        ? 
_exptl_crystal.pdbx_crystal_image_url      ? 
_exptl_crystal.pdbx_crystal_image_format   ? 
_exptl_crystal.pdbx_mosaicity              ? 
_exptl_crystal.pdbx_mosaicity_esd          ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp            293 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '20mM Tris pH 7.4, 20mMNaCl, 20% (w/v) PEG 6000, 0.1M HEPES 7.0 pH 7.0, 0.01M zinc chloride.' 
_exptl_crystal_grow.pdbx_pH_range   ? 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     210 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2018-03-07 
_diffrn_detector.pdbx_frequency               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97662 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'DIAMOND BEAMLINE I03' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97662 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I03 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate            ? 
_reflns.entry_id                         6YXM 
_reflns.data_reduction_details           ? 
_reflns.data_reduction_method            ? 
_reflns.d_resolution_high                2.85 
_reflns.d_resolution_low                 118.75 
_reflns.details                          ? 
_reflns.limit_h_max                      ? 
_reflns.limit_h_min                      ? 
_reflns.limit_k_max                      ? 
_reflns.limit_k_min                      ? 
_reflns.limit_l_max                      ? 
_reflns.limit_l_min                      ? 
_reflns.number_all                       ? 
_reflns.number_obs                       13893 
_reflns.observed_criterion               ? 
_reflns.observed_criterion_F_max         ? 
_reflns.observed_criterion_F_min         ? 
_reflns.observed_criterion_I_max         ? 
_reflns.observed_criterion_I_min         ? 
_reflns.observed_criterion_sigma_F       ? 
_reflns.observed_criterion_sigma_I       ? 
_reflns.percent_possible_obs             99.9 
_reflns.R_free_details                   ? 
_reflns.Rmerge_F_all                     ? 
_reflns.Rmerge_F_obs                     ? 
_reflns.Friedel_coverage                 ? 
_reflns.number_gt                        ? 
_reflns.threshold_expression             ? 
_reflns.pdbx_redundancy                  8.8 
_reflns.pdbx_Rmerge_I_obs                0.146 
_reflns.pdbx_Rmerge_I_all                ? 
_reflns.pdbx_Rsym_value                  ? 
_reflns.pdbx_netI_over_av_sigmaI         ? 
_reflns.pdbx_netI_over_sigmaI            9.9 
_reflns.pdbx_res_netI_over_av_sigmaI_2   ? 
_reflns.pdbx_res_netI_over_sigmaI_2      ? 
_reflns.pdbx_chi_squared                 ? 
_reflns.pdbx_scaling_rejects             ? 
_reflns.pdbx_d_res_high_opt              ? 
_reflns.pdbx_d_res_low_opt               ? 
_reflns.pdbx_d_res_opt_method            ? 
_reflns.phase_calculation_details        ? 
_reflns.pdbx_Rrim_I_all                  0.165 
_reflns.pdbx_Rpim_I_all                  0.076 
_reflns.pdbx_d_opt                       ? 
_reflns.pdbx_number_measured_all         ? 
_reflns.pdbx_diffrn_id                   1 
_reflns.pdbx_ordinal                     1 
_reflns.pdbx_CC_half                     0.993 
_reflns.pdbx_CC_star                     ? 
_reflns.pdbx_R_split                     ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_all 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_Rsym_value 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
9.01 118.75 ? ? ? ? ? ? 515  ? ? ? ? ? 0.074 ? ? ? ? ? ? ? ? 7.7 ? ? ? ? 0.084 0.039 ? 1 1 0.996 ? ? 
2.85 3.00   ? ? ? ? ? ? 1976 ? ? ? ? ? 0.501 ? ? ? ? ? ? ? ? 8.7 ? ? ? ? 0.569 0.267 ? 2 1 0.914 ? ? 
# 
_refine.aniso_B[1][1]                            -0.810 
_refine.aniso_B[1][2]                            0.000 
_refine.aniso_B[1][3]                            -0.000 
_refine.aniso_B[2][2]                            0.630 
_refine.aniso_B[2][3]                            0.000 
_refine.aniso_B[3][3]                            0.180 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               39.044 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.922 
_refine.correlation_coeff_Fo_to_Fc_free          0.877 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 6YXM 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.850 
_refine.ls_d_res_low                             36.219 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     13539 
_refine.ls_number_reflns_R_free                  638 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    98.137 
_refine.ls_percent_reflns_R_free                 4.712 
_refine.ls_R_factor_all                          0.213 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2762 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2098 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      5ocx 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  0.412 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             30.017 
_refine.overall_SU_ML                            0.283 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.850 
_refine_hist.d_res_low                        36.219 
_refine_hist.number_atoms_solvent             33 
_refine_hist.number_atoms_total               3372 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        3275 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         64 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.004  0.013  3425 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.017  3009 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.333  1.669  4660 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 1.122  1.593  7023 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 8.123  5.000  427  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 33.407 22.448 143  ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 16.446 15.000 512  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 17.154 15.000 14   ? r_dihedral_angle_4_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.044  0.200  467  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.004  0.020  3790 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  706  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.185  0.200  489  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.174  0.200  2648 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.159  0.200  1588 ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.078  0.200  1678 ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.117  0.200  78   ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.107  0.200  5    ? r_metal_ion_refined            ? ? 
'X-RAY DIFFRACTION' ? 0.267  0.200  18   ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.273  0.200  21   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.118  0.200  2    ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 0.112  0.200  3    ? r_symmetry_metal_ion_refined   ? ? 
'X-RAY DIFFRACTION' ? 0.646  2.972  1726 ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 0.645  2.972  1725 ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 1.143  4.457  2147 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 1.143  4.457  2148 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 0.656  3.049  1699 ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 0.656  3.049  1700 ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 1.045  4.544  2513 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 1.044  4.544  2514 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 2.348  33.489 3441 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 2.345  33.474 3440 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
'X-RAY DIFFRACTION' 2.850  2.924  . . 54 939 98.6097 . . . 0.357 . 0.259 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.924  3.004  . . 45 905 98.9583 . . . 0.313 . 0.276 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.004  3.091  . . 44 916 99.4819 . . . 0.252 . 0.251 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.091  3.186  . . 38 856 98.7845 . . . 0.299 . 0.239 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.186  3.290  . . 38 851 98.8876 . . . 0.444 . 0.242 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.290  3.405  . . 33 811 98.3683 . . . 0.294 . 0.217 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.405  3.533  . . 46 793 98.5899 . . . 0.276 . 0.217 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.533  3.677  . . 34 740 98.2234 . . . 0.244 . 0.207 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.677  3.840  . . 35 732 98.3333 . . . 0.270 . 0.210 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.840  4.027  . . 41 700 98.2759 . . . 0.358 . 0.212 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 4.027  4.244  . . 25 675 98.3146 . . . 0.267 . 0.190 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 4.244  4.501  . . 35 630 98.8113 . . . 0.199 . 0.173 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 4.501  4.810  . . 32 604 97.6959 . . . 0.210 . 0.157 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 4.810  5.194  . . 33 535 97.7625 . . . 0.252 . 0.172 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 5.194  5.686  . . 27 516 97.4865 . . . 0.312 . 0.201 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 5.686  6.352  . . 19 462 96.3928 . . . 0.249 . 0.211 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 6.352  7.326  . . 19 416 97.0982 . . . 0.398 . 0.196 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 7.326  8.949  . . 15 373 97.2431 . . . 0.221 . 0.175 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 8.949  12.557 . . 15 276 94.7883 . . . 0.226 . 0.205 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 12.557 36.219 . . 10 171 90.5000 . . . 0.342 . 0.334 . . . . . . . . . . . 
# 
_struct.entry_id                     6YXM 
_struct.title                        'Crystal structure of ACPA 1F2 in complex with CII-C-39-CIT' 
_struct.pdbx_descriptor              'CII-C-39-CIT, ACPA 1F2 Fab fragment - heavy chain, ACPA 1F2 Fab fragment - light chain' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        6YXM 
_struct_keywords.text            'anti-citrullinated protein antibody, collagen type II, IMMUNE SYSTEM' 
_struct_keywords.pdbx_keywords   'IMMUNE SYSTEM' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
E N N 5 ? 
F N N 6 ? 
G N N 6 ? 
H N N 6 ? 
I N N 6 ? 
J N N 7 ? 
K N N 7 ? 
L N N 7 ? 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 ASN B 28  ? SER B 30  ? ASN HHH 28  SER HHH 30  5 ? 3 
HELX_P HELX_P2 AA2 GLN B 62  ? THR B 65  ? GLN HHH 62  THR HHH 65  5 ? 4 
HELX_P HELX_P3 AA3 THR B 74  ? VAL B 76  ? THR HHH 74  VAL HHH 76  5 ? 3 
HELX_P HELX_P4 AA4 LYS B 87  ? THR B 91  ? LYS HHH 87  THR HHH 91  5 ? 5 
HELX_P HELX_P5 AA5 HIS C 28  ? SER C 32  ? HIS LLL 28  SER LLL 32  5 ? 5 
HELX_P HELX_P6 AA6 GLU C 82  ? GLU C 86  ? GLU LLL 82  GLU LLL 86  5 ? 5 
HELX_P HELX_P7 AA7 SER C 125 ? GLU C 130 ? SER LLL 125 GLU LLL 130 1 ? 6 
HELX_P HELX_P8 AA8 ALA C 186 ? HIS C 192 ? ALA LLL 186 HIS LLL 192 1 ? 7 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1  disulf ?    ? B CYS 22  SG  ? ? ? 1_555 B CYS 96  SG  ? ? HHH CYS 22  HHH CYS 96  1_555 ? ? ? ? ? ? ? 2.030 ? ? 
disulf2  disulf ?    ? B CYS 149 SG  ? ? ? 1_555 B CYS 204 SG  ? ? HHH CYS 149 HHH CYS 204 1_555 ? ? ? ? ? ? ? 2.025 ? ? 
disulf3  disulf ?    ? C CYS 22  SG  ? ? ? 1_555 C CYS 91  SG  ? ? LLL CYS 22  LLL CYS 91  1_555 ? ? ? ? ? ? ? 2.079 ? ? 
disulf4  disulf ?    ? C CYS 138 SG  ? ? ? 1_555 C CYS 197 SG  ? ? LLL CYS 138 LLL CYS 197 1_555 ? ? ? ? ? ? ? 2.075 ? ? 
covale1  covale both ? A GLN 4   C   ? ? ? 1_555 E CIR .   N2  ? ? BBB GLN 600 BBB CIR 701 1_555 ? ? ? ? ? ? ? 1.312 ? ? 
covale2  covale both ? A GLY 8   N   ? ? ? 1_555 E CIR .   C1  ? ? BBB GLY 602 BBB CIR 701 1_555 ? ? ? ? ? ? ? 1.330 ? ? 
covale3  covale one  ? B ASN 28  ND2 ? ? ? 1_555 D NAG .   C1  ? ? HHH ASN 28  A   NAG 1   1_555 ? ? ? ? ? ? ? 1.426 ? 
N-Glycosylation 
covale4  covale both ? D NAG .   O4  ? ? ? 1_555 D NAG .   C1  ? ? A   NAG 1   A   NAG 2   1_555 ? ? ? ? ? ? ? 1.362 ? ? 
covale5  covale both ? D NAG .   O6  ? ? ? 1_555 D FUC .   C1  ? ? A   NAG 1   A   FUC 4   1_555 ? ? ? ? ? ? ? 1.376 ? ? 
covale6  covale both ? D NAG .   O4  ? ? ? 1_555 D BMA .   C1  ? ? A   NAG 2   A   BMA 3   1_555 ? ? ? ? ? ? ? 1.383 ? ? 
metalc1  metalc ?    ? A GLU 9   OE1 ? ? ? 1_555 F ZN  .   ZN  ? ? BBB GLU 603 BBB ZN  702 1_555 ? ? ? ? ? ? ? 2.427 ? ? 
metalc2  metalc ?    ? A GLU 9   OE2 ? ? ? 1_555 F ZN  .   ZN  ? ? BBB GLU 603 BBB ZN  702 1_555 ? ? ? ? ? ? ? 2.412 ? ? 
metalc3  metalc ?    ? F ZN  .   ZN  ? ? ? 1_555 C ASP 31  OD1 ? ? BBB ZN  702 LLL ASP 31  1_555 ? ? ? ? ? ? ? 1.977 ? ? 
metalc4  metalc ?    ? F ZN  .   ZN  ? ? ? 1_555 C ASP 31  OD2 ? ? BBB ZN  702 LLL ASP 31  1_555 ? ? ? ? ? ? ? 2.668 ? ? 
metalc5  metalc ?    ? F ZN  .   ZN  ? ? ? 3_655 C ASP 155 OD2 ? ? BBB ZN  702 LLL ASP 155 1_555 ? ? ? ? ? ? ? 2.006 ? ? 
metalc6  metalc ?    ? B HIS 3   NE2 ? ? ? 1_555 I ZN  .   ZN  ? ? HHH HIS 3   HHH ZN  307 1_555 ? ? ? ? ? ? ? 1.913 ? ? 
metalc7  metalc ?    ? B GLU 5   OE1 ? ? ? 1_555 I ZN  .   ZN  ? ? HHH GLU 5   HHH ZN  307 1_555 ? ? ? ? ? ? ? 2.600 ? ? 
metalc8  metalc ?    ? B HIS 82  NE2 ? ? ? 1_555 G ZN  .   ZN  ? ? HHH HIS 82  HHH ZN  305 1_555 ? ? ? ? ? ? ? 1.966 ? ? 
metalc9  metalc ?    ? B HIS 84  ND1 ? ? ? 1_555 G ZN  .   ZN  ? ? HHH HIS 84  HHH ZN  305 1_555 ? ? ? ? ? ? ? 1.966 ? ? 
metalc10 metalc ?    ? B HIS 173 NE2 ? ? ? 1_555 H ZN  .   ZN  ? ? HHH HIS 173 HHH ZN  306 1_555 ? ? ? ? ? ? ? 1.934 ? ? 
metalc11 metalc ?    ? G ZN  .   ZN  ? ? ? 1_555 K HOH .   O   ? ? HHH ZN  305 HHH HOH 408 1_555 ? ? ? ? ? ? ? 1.958 ? ? 
metalc12 metalc ?    ? G ZN  .   ZN  ? ? ? 3_555 C GLU 130 OE2 ? ? HHH ZN  305 LLL GLU 130 1_555 ? ? ? ? ? ? ? 1.838 ? ? 
metalc13 metalc ?    ? H ZN  .   ZN  ? ? ? 1_555 K HOH .   O   ? ? HHH ZN  306 HHH HOH 415 1_555 ? ? ? ? ? ? ? 2.699 ? ? 
metalc14 metalc ?    ? H ZN  .   ZN  ? ? ? 1_555 C ASP 142 OD1 ? ? HHH ZN  306 LLL ASP 142 1_555 ? ? ? ? ? ? ? 2.484 ? ? 
metalc15 metalc ?    ? H ZN  .   ZN  ? ? ? 1_555 L HOH .   O   ? ? HHH ZN  306 LLL HOH 303 1_555 ? ? ? ? ? ? ? 2.134 ? ? 
metalc16 metalc ?    ? I ZN  .   ZN  ? ? ? 1_555 K HOH .   O   ? ? HHH ZN  307 HHH HOH 401 1_555 ? ? ? ? ? ? ? 2.267 ? ? 
metalc17 metalc ?    ? I ZN  .   ZN  ? ? ? 4_555 C ASP 61  OD1 ? ? HHH ZN  307 LLL ASP 61  1_555 ? ? ? ? ? ? ? 2.130 ? ? 
metalc18 metalc ?    ? I ZN  .   ZN  ? ? ? 4_555 C ASP 61  OD2 ? ? HHH ZN  307 LLL ASP 61  1_555 ? ? ? ? ? ? ? 2.479 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
metalc ? ? 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 PHE 155 B . ? PHE 155 HHH PRO 156 B ? PRO 156 HHH 1 -12.10 
2 TRP 197 B . ? TRP 197 HHH PRO 198 B ? PRO 198 HHH 1 4.19   
3 TYR 144 C . ? TYR 144 LLL PRO 145 C ? PRO 145 LLL 1 -4.76  
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 4 ? 
AA2 ? 6 ? 
AA3 ? 4 ? 
AA4 ? 4 ? 
AA5 ? 3 ? 
AA6 ? 4 ? 
AA7 ? 5 ? 
AA8 ? 4 ? 
AA9 ? 4 ? 
AB1 ? 4 ? 
AB2 ? 4 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA2 5 6 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA3 2 3 ? anti-parallel 
AA3 3 4 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA4 2 3 ? anti-parallel 
AA4 3 4 ? anti-parallel 
AA5 1 2 ? anti-parallel 
AA5 2 3 ? anti-parallel 
AA6 1 2 ? anti-parallel 
AA6 2 3 ? anti-parallel 
AA6 3 4 ? anti-parallel 
AA7 1 2 ? parallel      
AA7 2 3 ? anti-parallel 
AA7 3 4 ? anti-parallel 
AA7 4 5 ? anti-parallel 
AA8 1 2 ? parallel      
AA8 2 3 ? anti-parallel 
AA8 3 4 ? anti-parallel 
AA9 1 2 ? anti-parallel 
AA9 2 3 ? anti-parallel 
AA9 3 4 ? anti-parallel 
AB1 1 2 ? anti-parallel 
AB1 2 3 ? anti-parallel 
AB1 3 4 ? anti-parallel 
AB2 1 2 ? anti-parallel 
AB2 2 3 ? anti-parallel 
AB2 3 4 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 HIS B 3   ? GLN B 6   ? HIS HHH 3   GLN HHH 6   
AA1 2 VAL B 18  ? SER B 25  ? VAL HHH 18  SER HHH 25  
AA1 3 THR B 78  ? ILE B 83  ? THR HHH 78  ILE HHH 83  
AA1 4 PHE B 68  ? ASP B 73  ? PHE HHH 68  ASP HHH 73  
AA2 1 GLU B 10  ? LYS B 12  ? GLU HHH 10  LYS HHH 12  
AA2 2 ALA B 116 ? VAL B 120 ? ALA HHH 116 VAL HHH 120 
AA2 3 ALA B 92  ? SER B 101 ? ALA HHH 92  SER HHH 101 
AA2 4 PHE B 32  ? GLN B 39  ? PHE HHH 32  GLN HHH 39  
AA2 5 GLN B 46  ? ILE B 51  ? GLN HHH 46  ILE HHH 51  
AA2 6 LEU B 58  ? TYR B 60  ? LEU HHH 58  TYR HHH 60  
AA3 1 SER B 129 ? LEU B 133 ? SER HHH 129 LEU HHH 133 
AA3 2 SER B 144 ? TYR B 154 ? SER HHH 144 TYR HHH 154 
AA3 3 LEU B 183 ? PRO B 193 ? LEU HHH 183 PRO HHH 193 
AA3 4 VAL B 172 ? THR B 174 ? VAL HHH 172 THR HHH 174 
AA4 1 SER B 129 ? LEU B 133 ? SER HHH 129 LEU HHH 133 
AA4 2 SER B 144 ? TYR B 154 ? SER HHH 144 TYR HHH 154 
AA4 3 LEU B 183 ? PRO B 193 ? LEU HHH 183 PRO HHH 193 
AA4 4 LEU B 178 ? GLN B 180 ? LEU HHH 178 GLN HHH 180 
AA5 1 THR B 160 ? ASN B 164 ? THR HHH 160 ASN HHH 164 
AA5 2 THR B 203 ? HIS B 208 ? THR HHH 203 HIS HHH 208 
AA5 3 THR B 213 ? LYS B 218 ? THR HHH 213 LYS HHH 218 
AA6 1 THR C 3   ? GLN C 6   ? THR LLL 3   GLN LLL 6   
AA6 2 VAL C 18  ? ASN C 25  ? VAL LLL 18  ASN LLL 25  
AA6 3 SER C 73  ? ILE C 78  ? SER LLL 73  ILE LLL 78  
AA6 4 LEU C 63  ? ASP C 68  ? LEU LLL 63  ASP LLL 68  
AA7 1 SER C 9   ? GLY C 12  ? SER LLL 9   GLY LLL 12  
AA7 2 THR C 105 ? VAL C 109 ? THR LLL 105 VAL LLL 109 
AA7 3 ALA C 87  ? TYR C 95  ? ALA LLL 87  TYR LLL 95  
AA7 4 GLN C 35  ? GLN C 39  ? GLN LLL 35  GLN LLL 39  
AA7 5 ARG C 46  ? ILE C 49  ? ARG LLL 46  ILE LLL 49  
AA8 1 SER C 9   ? GLY C 12  ? SER LLL 9   GLY LLL 12  
AA8 2 THR C 105 ? VAL C 109 ? THR LLL 105 VAL LLL 109 
AA8 3 ALA C 87  ? TYR C 95  ? ALA LLL 87  TYR LLL 95  
AA8 4 ASP C 98  ? LEU C 101 ? ASP LLL 98  LEU LLL 101 
AA9 1 SER C 118 ? PHE C 122 ? SER LLL 118 PHE LLL 122 
AA9 2 LYS C 133 ? PHE C 143 ? LYS LLL 133 PHE LLL 143 
AA9 3 TYR C 176 ? THR C 185 ? TYR LLL 176 THR LLL 185 
AA9 4 MET C 163 ? THR C 165 ? MET LLL 163 THR LLL 165 
AB1 1 SER C 118 ? PHE C 122 ? SER LLL 118 PHE LLL 122 
AB1 2 LYS C 133 ? PHE C 143 ? LYS LLL 133 PHE LLL 143 
AB1 3 TYR C 176 ? THR C 185 ? TYR LLL 176 THR LLL 185 
AB1 4 SER C 169 ? LYS C 170 ? SER LLL 169 LYS LLL 170 
AB2 1 THR C 157 ? PRO C 158 ? THR LLL 157 PRO LLL 158 
AB2 2 THR C 149 ? VAL C 154 ? THR LLL 149 VAL LLL 154 
AB2 3 SER C 194 ? HIS C 201 ? SER LLL 194 HIS LLL 201 
AB2 4 HIS C 204 ? SER C 211 ? HIS LLL 204 SER LLL 211 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N GLU B 5   ? N GLU HHH 5   O LYS B 23  ? O LYS HHH 23  
AA1 2 3 N ILE B 20  ? N ILE HHH 20  O LEU B 81  ? O LEU HHH 81  
AA1 3 4 O TYR B 80  ? O TYR HHH 80  N SER B 71  ? N SER HHH 71  
AA2 1 2 N LYS B 12  ? N LYS HHH 12  O SER B 119 ? O SER HHH 119 
AA2 2 3 O VAL B 118 ? O VAL HHH 118 N ALA B 92  ? N ALA HHH 92  
AA2 3 4 O GLY B 99  ? O GLY HHH 99  N ALA B 33  ? N ALA HHH 33  
AA2 4 5 N ARG B 38  ? N ARG HHH 38  O GLN B 46  ? O GLN HHH 46  
AA2 5 6 N TRP B 50  ? N TRP HHH 50  O THR B 59  ? O THR HHH 59  
AA3 1 2 N LEU B 133 ? N LEU HHH 133 O GLY B 148 ? O GLY HHH 148 
AA3 2 3 N TYR B 154 ? N TYR HHH 154 O TYR B 184 ? O TYR HHH 184 
AA3 3 4 O SER B 189 ? O SER HHH 189 N HIS B 173 ? N HIS HHH 173 
AA4 1 2 N LEU B 133 ? N LEU HHH 133 O GLY B 148 ? O GLY HHH 148 
AA4 2 3 N TYR B 154 ? N TYR HHH 154 O TYR B 184 ? O TYR HHH 184 
AA4 3 4 O THR B 185 ? O THR HHH 185 N LEU B 178 ? N LEU HHH 178 
AA5 1 2 N THR B 160 ? N THR HHH 160 O ALA B 207 ? O ALA HHH 207 
AA5 2 3 N VAL B 206 ? N VAL HHH 206 O VAL B 215 ? O VAL HHH 215 
AA6 1 2 N ILE C 5   ? N ILE LLL 5   O THR C 23  ? O THR LLL 23  
AA6 2 3 N ILE C 20  ? N ILE LLL 20  O LEU C 76  ? O LEU LLL 76  
AA6 3 4 O SER C 73  ? O SER LLL 73  N ASP C 68  ? N ASP LLL 68  
AA7 1 2 N VAL C 10  ? N VAL LLL 10  O LYS C 106 ? O LYS LLL 106 
AA7 2 3 O THR C 105 ? O THR LLL 105 N TYR C 89  ? N TYR LLL 89  
AA7 3 4 O TYR C 90  ? O TYR LLL 90  N PHE C 37  ? N PHE LLL 37  
AA7 4 5 N TRP C 36  ? N TRP LLL 36  O ILE C 49  ? O ILE LLL 49  
AA8 1 2 N VAL C 10  ? N VAL LLL 10  O LYS C 106 ? O LYS LLL 106 
AA8 2 3 O THR C 105 ? O THR LLL 105 N TYR C 89  ? N TYR LLL 89  
AA8 3 4 N SER C 93  ? N SER LLL 93  O VAL C 100 ? O VAL LLL 100 
AA9 1 2 N PHE C 122 ? N PHE LLL 122 O VAL C 137 ? O VAL LLL 137 
AA9 2 3 N LEU C 136 ? N LEU LLL 136 O LEU C 182 ? O LEU LLL 182 
AA9 3 4 O TYR C 181 ? O TYR LLL 181 N GLU C 164 ? N GLU LLL 164 
AB1 1 2 N PHE C 122 ? N PHE LLL 122 O VAL C 137 ? O VAL LLL 137 
AB1 2 3 N LEU C 136 ? N LEU LLL 136 O LEU C 182 ? O LEU LLL 182 
AB1 3 4 O MET C 177 ? O MET LLL 177 N SER C 169 ? N SER LLL 169 
AB2 1 2 O THR C 157 ? O THR LLL 157 N VAL C 154 ? N VAL LLL 154 
AB2 2 3 N THR C 149 ? N THR LLL 149 O THR C 200 ? O THR LLL 200 
AB2 3 4 N CYS C 197 ? N CYS LLL 197 O LYS C 208 ? O LYS LLL 208 
# 
_atom_sites.entry_id                    6YXM 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.fract_transf_matrix[1][1]   0.018864 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.011154 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.008426 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C  2.310  20.844 1.020 10.208 1.589 0.569  0.865 51.651 0.216   
H  0.493  10.511 0.323 26.126 0.140 3.142  0.041 57.800 0.003   
N  12.222 0.006  3.135 9.893  2.014 28.997 1.167 0.583  -11.538 
O  3.049  13.277 2.287 5.701  1.546 0.324  0.867 32.909 0.251   
S  6.905  1.468  5.203 22.215 1.438 0.254  1.586 56.172 1.056   
ZN 14.081 3.266  7.035 0.233  5.168 10.316 2.411 58.710 0.909   
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N  N    . LEU A 1 1   ? 27.483  6.918  25.261 1.000 55.006 ? 597 LEU BBB N    1 
ATOM   2    C  CA   . LEU A 1 1   ? 28.446  7.751  26.054 1.000 54.668 ? 597 LEU BBB CA   1 
ATOM   3    C  C    . LEU A 1 1   ? 27.796  9.111  26.355 1.000 53.694 ? 597 LEU BBB C    1 
ATOM   4    O  O    . LEU A 1 1   ? 27.241  9.264  27.444 1.000 53.242 ? 597 LEU BBB O    1 
ATOM   5    C  CB   . LEU A 1 1   ? 29.788  7.821  25.303 1.000 55.500 ? 597 LEU BBB CB   1 
ATOM   6    C  CG   . LEU A 1 1   ? 30.901  8.659  25.942 1.000 55.769 ? 597 LEU BBB CG   1 
ATOM   7    C  CD1  . LEU A 1 1   ? 31.459  7.979  27.190 1.000 55.874 ? 597 LEU BBB CD1  1 
ATOM   8    C  CD2  . LEU A 1 1   ? 32.021  8.938  24.942 1.000 56.027 ? 597 LEU BBB CD2  1 
ATOM   9    H  H1   . LEU A 1 1   ? 27.858  6.676  24.467 1.000 55.391 ? 597 LEU BBB H1   1 
ATOM   10   H  H2   . LEU A 1 1   ? 26.678  7.414  25.092 1.000 54.604 ? 597 LEU BBB H2   1 
ATOM   11   H  H3   . LEU A 1 1   ? 27.267  6.127  25.761 1.000 55.218 ? 597 LEU BBB H3   1 
ATOM   12   H  HA   . LEU A 1 1   ? 28.594  7.294  26.913 1.000 54.752 ? 597 LEU BBB HA   1 
ATOM   13   H  HB2  . LEU A 1 1   ? 30.121  6.907  25.206 1.000 56.068 ? 597 LEU BBB HB2  1 
ATOM   14   H  HB3  . LEU A 1 1   ? 29.623  8.161  24.403 1.000 55.547 ? 597 LEU BBB HB3  1 
ATOM   15   H  HG   . LEU A 1 1   ? 30.514  9.527  26.215 1.000 55.104 ? 597 LEU BBB HG   1 
ATOM   16   H  HD11 . LEU A 1 1   ? 30.759  7.910  27.863 1.000 55.525 ? 597 LEU BBB HD11 1 
ATOM   17   H  HD12 . LEU A 1 1   ? 32.197  8.505  27.544 1.000 55.853 ? 597 LEU BBB HD12 1 
ATOM   18   H  HD13 . LEU A 1 1   ? 31.777  7.089  26.961 1.000 56.443 ? 597 LEU BBB HD13 1 
ATOM   19   H  HD21 . LEU A 1 1   ? 32.378  8.096  24.611 1.000 56.712 ? 597 LEU BBB HD21 1 
ATOM   20   H  HD22 . LEU A 1 1   ? 32.729  9.441  25.380 1.000 56.115 ? 597 LEU BBB HD22 1 
ATOM   21   H  HD23 . LEU A 1 1   ? 31.669  9.455  24.197 1.000 56.019 ? 597 LEU BBB HD23 1 
ATOM   22   N  N    . PRO A 1 2   ? 27.765  10.119 25.436 1.000 52.548 ? 598 PRO BBB N    1 
ATOM   23   C  CA   . PRO A 1 2   ? 27.250  11.450 25.781 1.000 50.823 ? 598 PRO BBB CA   1 
ATOM   24   C  C    . PRO A 1 2   ? 25.745  11.452 26.089 1.000 49.132 ? 598 PRO BBB C    1 
ATOM   25   O  O    . PRO A 1 2   ? 24.991  10.945 25.285 1.000 49.383 ? 598 PRO BBB O    1 
ATOM   26   C  CB   . PRO A 1 2   ? 27.540  12.309 24.537 1.000 51.039 ? 598 PRO BBB CB   1 
ATOM   27   C  CG   . PRO A 1 2   ? 27.588  11.307 23.406 1.000 52.007 ? 598 PRO BBB CG   1 
ATOM   28   C  CD   . PRO A 1 2   ? 28.170  10.047 24.020 1.000 52.793 ? 598 PRO BBB CD   1 
ATOM   29   H  HA   . PRO A 1 2   ? 27.756  11.806 26.552 1.000 50.688 ? 598 PRO BBB HA   1 
ATOM   30   H  HB2  . PRO A 1 2   ? 26.830  12.969 24.390 1.000 50.785 ? 598 PRO BBB HB2  1 
ATOM   31   H  HB3  . PRO A 1 2   ? 28.397  12.778 24.625 1.000 51.239 ? 598 PRO BBB HB3  1 
ATOM   32   H  HG2  . PRO A 1 2   ? 26.691  11.138 23.053 1.000 51.851 ? 598 PRO BBB HG2  1 
ATOM   33   H  HG3  . PRO A 1 2   ? 28.157  11.632 22.678 1.000 52.242 ? 598 PRO BBB HG3  1 
ATOM   34   H  HD2  . PRO A 1 2   ? 27.807  9.249  23.592 1.000 53.046 ? 598 PRO BBB HD2  1 
ATOM   35   H  HD3  . PRO A 1 2   ? 29.141  10.041 23.934 1.000 53.111 ? 598 PRO BBB HD3  1 
ATOM   36   N  N    . GLY A 1 3   ? 25.354  12.030 27.229 1.000 47.323 ? 599 GLY BBB N    1 
ATOM   37   C  CA   . GLY A 1 3   ? 23.957  12.062 27.701 1.000 46.133 ? 599 GLY BBB CA   1 
ATOM   38   C  C    . GLY A 1 3   ? 23.383  13.470 27.788 1.000 44.977 ? 599 GLY BBB C    1 
ATOM   39   O  O    . GLY A 1 3   ? 22.403  13.644 28.536 1.000 44.344 ? 599 GLY BBB O    1 
ATOM   40   H  H    . GLY A 1 3   ? 25.942  12.444 27.788 1.000 47.371 ? 599 GLY BBB H    1 
ATOM   41   H  HA2  . GLY A 1 3   ? 23.398  11.522 27.089 1.000 46.324 ? 599 GLY BBB HA2  1 
ATOM   42   H  HA3  . GLY A 1 3   ? 23.915  11.641 28.596 1.000 46.192 ? 599 GLY BBB HA3  1 
ATOM   43   N  N    . GLN A 1 4   ? 23.938  14.443 27.054 1.000 44.221 ? 600 GLN BBB N    1 
ATOM   44   C  CA   . GLN A 1 4   ? 23.475  15.861 27.085 1.000 43.181 ? 600 GLN BBB CA   1 
ATOM   45   C  C    . GLN A 1 4   ? 23.276  16.370 25.655 1.000 42.353 ? 600 GLN BBB C    1 
ATOM   46   O  O    . GLN A 1 4   ? 24.308  16.642 25.023 1.000 42.864 ? 600 GLN BBB O    1 
ATOM   47   C  CB   . GLN A 1 4   ? 24.477  16.740 27.829 1.000 43.079 ? 600 GLN BBB CB   1 
ATOM   48   C  CG   . GLN A 1 4   ? 24.064  18.203 27.915 1.000 42.883 ? 600 GLN BBB CG   1 
ATOM   49   C  CD   . GLN A 1 4   ? 24.838  18.947 28.976 1.000 42.774 ? 600 GLN BBB CD   1 
ATOM   50   O  OE1  . GLN A 1 4   ? 25.734  19.730 28.678 1.000 42.785 ? 600 GLN BBB OE1  1 
ATOM   51   N  NE2  . GLN A 1 4   ? 24.516  18.680 30.232 1.000 42.427 ? 600 GLN BBB NE2  1 
ATOM   52   H  H    . GLN A 1 4   ? 24.634  14.297 26.485 1.000 44.404 ? 600 GLN BBB H    1 
ATOM   53   H  HA   . GLN A 1 4   ? 22.611  15.898 27.557 1.000 42.991 ? 600 GLN BBB HA   1 
ATOM   54   H  HB2  . GLN A 1 4   ? 24.588  16.385 28.735 1.000 43.050 ? 600 GLN BBB HB2  1 
ATOM   55   H  HB3  . GLN A 1 4   ? 25.344  16.678 27.376 1.000 43.283 ? 600 GLN BBB HB3  1 
ATOM   56   H  HG2  . GLN A 1 4   ? 24.214  18.635 27.047 1.000 42.963 ? 600 GLN BBB HG2  1 
ATOM   57   H  HG3  . GLN A 1 4   ? 23.106  18.258 28.117 1.000 42.740 ? 600 GLN BBB HG3  1 
ATOM   58   H  HE21 . GLN A 1 4   ? 24.966  19.156 30.849 0.000 30.000 ? 600 GLN BBB HE21 1 
ATOM   59   H  HE22 . GLN A 1 4   ? 23.873  18.169 30.432 0.000 30.000 ? 600 GLN BBB HE22 1 
ATOM   60   N  N    . GLY A 1 8   ? 23.719  17.994 22.347 1.000 41.903 ? 602 GLY BBB N    1 
ATOM   61   C  CA   . GLY A 1 8   ? 24.624  18.967 21.704 1.000 42.754 ? 602 GLY BBB CA   1 
ATOM   62   C  C    . GLY A 1 8   ? 26.064  18.821 22.160 1.000 43.429 ? 602 GLY BBB C    1 
ATOM   63   O  O    . GLY A 1 8   ? 26.938  19.347 21.455 1.000 43.284 ? 602 GLY BBB O    1 
ATOM   64   H  H    . GLY A 1 8   ? 22.881  18.087 22.005 1.000 41.951 ? 602 GLY BBB H    1 
ATOM   65   H  HA2  . GLY A 1 8   ? 24.579  18.846 20.723 1.000 42.857 ? 602 GLY BBB HA2  1 
ATOM   66   H  HA3  . GLY A 1 8   ? 24.313  19.876 21.913 1.000 42.599 ? 602 GLY BBB HA3  1 
ATOM   67   N  N    . GLU A 1 9   ? 26.294  18.140 23.291 1.000 44.249 ? 603 GLU BBB N    1 
ATOM   68   C  CA   . GLU A 1 9   ? 27.631  17.887 23.891 1.000 45.696 ? 603 GLU BBB CA   1 
ATOM   69   C  C    . GLU A 1 9   ? 28.302  16.737 23.148 1.000 47.785 ? 603 GLU BBB C    1 
ATOM   70   O  O    . GLU A 1 9   ? 27.938  15.583 23.428 1.000 48.582 ? 603 GLU BBB O    1 
ATOM   71   C  CB   . GLU A 1 9   ? 27.511  17.504 25.367 1.000 45.059 ? 603 GLU BBB CB   1 
ATOM   72   C  CG   . GLU A 1 9   ? 28.812  17.010 25.976 1.000 45.039 ? 603 GLU BBB CG   1 
ATOM   73   C  CD   . GLU A 1 9   ? 29.976  17.964 25.807 1.000 45.210 ? 603 GLU BBB CD   1 
ATOM   74   O  OE1  . GLU A 1 9   ? 29.771  19.170 25.992 1.000 45.317 ? 603 GLU BBB OE1  1 
ATOM   75   O  OE2  . GLU A 1 9   ? 31.075  17.505 25.484 1.000 45.997 ? 603 GLU BBB OE2  1 
ATOM   76   H  H    . GLU A 1 9   ? 25.622  17.777 23.780 1.000 44.020 ? 603 GLU BBB H    1 
ATOM   77   H  HA   . GLU A 1 9   ? 28.180  18.700 23.803 1.000 45.901 ? 603 GLU BBB HA   1 
ATOM   78   H  HB2  . GLU A 1 9   ? 27.202  18.287 25.869 1.000 44.880 ? 603 GLU BBB HB2  1 
ATOM   79   H  HB3  . GLU A 1 9   ? 26.833  16.803 25.456 1.000 44.915 ? 603 GLU BBB HB3  1 
ATOM   80   H  HG2  . GLU A 1 9   ? 28.675  16.859 26.935 1.000 44.864 ? 603 GLU BBB HG2  1 
ATOM   81   H  HG3  . GLU A 1 9   ? 29.052  16.148 25.576 1.000 45.302 ? 603 GLU BBB HG3  1 
ATOM   82   N  N    . ARG A 1 10  ? 29.250  17.037 22.263 1.000 50.240 ? 604 ARG BBB N    1 
ATOM   83   C  CA   . ARG A 1 10  ? 29.953  16.029 21.430 1.000 53.013 ? 604 ARG BBB CA   1 
ATOM   84   C  C    . ARG A 1 10  ? 31.219  16.704 20.876 1.000 53.726 ? 604 ARG BBB C    1 
ATOM   85   O  O    . ARG A 1 10  ? 31.899  17.361 21.675 1.000 55.436 ? 604 ARG BBB O    1 
ATOM   86   C  CB   . ARG A 1 10  ? 28.984  15.496 20.363 1.000 55.334 ? 604 ARG BBB CB   1 
ATOM   87   C  CG   . ARG A 1 10  ? 27.813  14.646 20.862 1.000 56.295 ? 604 ARG BBB CG   1 
ATOM   88   C  CD   . ARG A 1 10  ? 26.431  15.320 20.864 1.000 56.340 ? 604 ARG BBB CD   1 
ATOM   89   N  NE   . ARG A 1 10  ? 25.391  14.576 21.583 1.000 56.637 ? 604 ARG BBB NE   1 
ATOM   90   C  CZ   . ARG A 1 10  ? 24.068  14.672 21.385 1.000 56.600 ? 604 ARG BBB CZ   1 
ATOM   91   N  NH1  . ARG A 1 10  ? 23.563  15.488 20.471 1.000 56.663 ? 604 ARG BBB NH1  1 
ATOM   92   N  NH2  . ARG A 1 10  ? 23.244  13.934 22.111 1.000 56.724 ? 604 ARG BBB NH2  1 
ATOM   93   H  H    . ARG A 1 10  ? 29.523  17.894 22.113 1.000 50.354 ? 604 ARG BBB H    1 
ATOM   94   H  HA   . ARG A 1 10  ? 30.225  15.282 22.012 1.000 53.080 ? 604 ARG BBB HA   1 
ATOM   95   H  HB2  . ARG A 1 10  ? 28.623  16.264 19.877 1.000 54.964 ? 604 ARG BBB HB2  1 
ATOM   96   H  HB3  . ARG A 1 10  ? 29.498  14.958 19.728 1.000 55.538 ? 604 ARG BBB HB3  1 
ATOM   97   H  HG2  . ARG A 1 10  ? 27.755  13.845 20.298 1.000 56.372 ? 604 ARG BBB HG2  1 
ATOM   98   H  HG3  . ARG A 1 10  ? 28.011  14.338 21.769 1.000 55.974 ? 604 ARG BBB HG3  1 
ATOM   99   H  HD2  . ARG A 1 10  ? 26.513  16.212 21.260 1.000 56.106 ? 604 ARG BBB HD2  1 
ATOM   100  H  HD3  . ARG A 1 10  ? 26.142  15.438 19.938 1.000 56.404 ? 604 ARG BBB HD3  1 
ATOM   101  H  HE   . ARG A 1 10  ? 25.658  14.020 22.200 1.000 56.653 ? 604 ARG BBB HE   1 
ATOM   102  H  HH11 . ARG A 1 10  ? 24.093  15.986 19.980 1.000 56.743 ? 604 ARG BBB HH11 1 
ATOM   103  H  HH12 . ARG A 1 10  ? 22.692  15.534 20.359 1.000 56.400 ? 604 ARG BBB HH12 1 
ATOM   104  H  HH21 . ARG A 1 10  ? 23.566  13.387 22.722 1.000 56.705 ? 604 ARG BBB HH21 1 
ATOM   105  H  HH22 . ARG A 1 10  ? 22.373  13.993 21.985 1.000 56.448 ? 604 ARG BBB HH22 1 
ATOM   106  N  N    . GLY A 1 11  ? 31.521  16.565 19.578 1.000 53.681 ? 605 GLY BBB N    1 
ATOM   107  C  CA   . GLY A 1 11  ? 32.611  17.281 18.881 1.000 53.323 ? 605 GLY BBB CA   1 
ATOM   108  C  C    . GLY A 1 11  ? 32.100  18.506 18.139 1.000 52.193 ? 605 GLY BBB C    1 
ATOM   109  O  O    . GLY A 1 11  ? 32.292  18.635 16.932 1.000 50.832 ? 605 GLY BBB O    1 
ATOM   110  H  H    . GLY A 1 11  ? 31.070  15.992 19.036 1.000 53.588 ? 605 GLY BBB H    1 
ATOM   111  H  HA2  . GLY A 1 11  ? 33.294  17.558 19.543 1.000 53.475 ? 605 GLY BBB HA2  1 
ATOM   112  H  HA3  . GLY A 1 11  ? 33.041  16.663 18.237 1.000 53.847 ? 605 GLY BBB HA3  1 
ATOM   113  N  N    . GLN B 2 1   ? 11.339  11.709 3.680  1.000 59.847 ? 1   GLN HHH N    1 
ATOM   114  C  CA   . GLN B 2 1   ? 11.857  13.002 4.241  1.000 58.510 ? 1   GLN HHH CA   1 
ATOM   115  C  C    . GLN B 2 1   ? 11.045  13.370 5.495  1.000 55.694 ? 1   GLN HHH C    1 
ATOM   116  O  O    . GLN B 2 1   ? 10.260  12.510 5.945  1.000 56.102 ? 1   GLN HHH O    1 
ATOM   117  C  CB   . GLN B 2 1   ? 11.843  14.083 3.158  1.000 59.959 ? 1   GLN HHH CB   1 
ATOM   118  C  CG   . GLN B 2 1   ? 10.473  14.353 2.554  1.000 61.970 ? 1   GLN HHH CG   1 
ATOM   119  C  CD   . GLN B 2 1   ? 10.534  15.377 1.443  1.000 64.244 ? 1   GLN HHH CD   1 
ATOM   120  O  OE1  . GLN B 2 1   ? 11.604  15.714 0.934  1.000 65.690 ? 1   GLN HHH OE1  1 
ATOM   121  N  NE2  . GLN B 2 1   ? 9.377   15.893 1.059  1.000 64.891 ? 1   GLN HHH NE2  1 
ATOM   122  H  H1   . GLN B 2 1   ? 11.646  11.599 2.830  1.000 60.951 ? 1   GLN HHH H1   1 
ATOM   123  H  H2   . GLN B 2 1   ? 10.379  11.717 3.675  1.000 59.911 ? 1   GLN HHH H2   1 
ATOM   124  H  H3   . GLN B 2 1   ? 11.646  10.981 4.225  1.000 59.684 ? 1   GLN HHH H3   1 
ATOM   125  H  HA   . GLN B 2 1   ? 12.791  12.856 4.516  1.000 58.277 ? 1   GLN HHH HA   1 
ATOM   126  H  HB2  . GLN B 2 1   ? 12.191  14.914 3.543  1.000 59.217 ? 1   GLN HHH HB2  1 
ATOM   127  H  HB3  . GLN B 2 1   ? 12.455  13.808 2.444  1.000 61.158 ? 1   GLN HHH HB3  1 
ATOM   128  H  HG2  . GLN B 2 1   ? 10.104  13.517 2.199  1.000 62.894 ? 1   GLN HHH HG2  1 
ATOM   129  H  HG3  . GLN B 2 1   ? 9.867   14.676 3.255  1.000 60.996 ? 1   GLN HHH HG3  1 
ATOM   130  H  HE21 . GLN B 2 1   ? 9.293   16.421 0.384  0.000 30.000 ? 1   GLN HHH HE21 1 
ATOM   131  H  HE22 . GLN B 2 1   ? 8.533   15.585 1.417  0.000 30.000 ? 1   GLN HHH HE22 1 
ATOM   132  N  N    . VAL B 2 2   ? 11.261  14.571 6.058  1.000 52.406 ? 2   VAL HHH N    1 
ATOM   133  C  CA   . VAL B 2 2   ? 10.737  15.012 7.392  1.000 49.087 ? 2   VAL HHH CA   1 
ATOM   134  C  C    . VAL B 2 2   ? 9.914   16.288 7.204  1.000 46.769 ? 2   VAL HHH C    1 
ATOM   135  O  O    . VAL B 2 2   ? 10.391  17.188 6.496  1.000 46.001 ? 2   VAL HHH O    1 
ATOM   136  C  CB   . VAL B 2 2   ? 11.871  15.259 8.411  1.000 48.209 ? 2   VAL HHH CB   1 
ATOM   137  C  CG1  . VAL B 2 2   ? 11.385  16.023 9.636  1.000 46.922 ? 2   VAL HHH CG1  1 
ATOM   138  C  CG2  . VAL B 2 2   ? 12.557  13.970 8.836  1.000 48.589 ? 2   VAL HHH CG2  1 
ATOM   139  H  H    . VAL B 2 2   ? 11.763  15.212 5.651  1.000 52.525 ? 2   VAL HHH H    1 
ATOM   140  H  HA   . VAL B 2 2   ? 10.155  14.316 7.739  1.000 49.140 ? 2   VAL HHH HA   1 
ATOM   141  H  HB   . VAL B 2 2   ? 12.549  15.821 7.961  1.000 48.345 ? 2   VAL HHH HB   1 
ATOM   142  H  HG11 . VAL B 2 2   ? 11.351  16.975 9.435  1.000 46.656 ? 2   VAL HHH HG11 1 
ATOM   143  H  HG12 . VAL B 2 2   ? 11.997  15.872 10.377 1.000 46.591 ? 2   VAL HHH HG12 1 
ATOM   144  H  HG13 . VAL B 2 2   ? 10.497  15.712 9.883  1.000 46.929 ? 2   VAL HHH HG13 1 
ATOM   145  H  HG21 . VAL B 2 2   ? 11.939  13.430 9.359  1.000 48.437 ? 2   VAL HHH HG21 1 
ATOM   146  H  HG22 . VAL B 2 2   ? 13.339  14.180 9.376  1.000 48.232 ? 2   VAL HHH HG22 1 
ATOM   147  H  HG23 . VAL B 2 2   ? 12.833  13.473 8.047  1.000 49.477 ? 2   VAL HHH HG23 1 
ATOM   148  N  N    . HIS B 2 3   ? 8.752   16.367 7.857  1.000 44.900 ? 3   HIS HHH N    1 
ATOM   149  C  CA   . HIS B 2 3   ? 7.828   17.531 7.801  1.000 43.837 ? 3   HIS HHH CA   1 
ATOM   150  C  C    . HIS B 2 3   ? 7.364   17.882 9.217  1.000 41.902 ? 3   HIS HHH C    1 
ATOM   151  O  O    . HIS B 2 3   ? 6.885   16.974 9.919  1.000 41.341 ? 3   HIS HHH O    1 
ATOM   152  C  CB   . HIS B 2 3   ? 6.649   17.241 6.861  1.000 44.755 ? 3   HIS HHH CB   1 
ATOM   153  C  CG   . HIS B 2 3   ? 5.943   18.465 6.386  1.000 44.920 ? 3   HIS HHH CG   1 
ATOM   154  N  ND1  . HIS B 2 3   ? 6.478   19.288 5.413  1.000 45.966 ? 3   HIS HHH ND1  1 
ATOM   155  C  CD2  . HIS B 2 3   ? 4.753   19.005 6.732  1.000 44.877 ? 3   HIS HHH CD2  1 
ATOM   156  C  CE1  . HIS B 2 3   ? 5.652   20.288 5.181  1.000 46.059 ? 3   HIS HHH CE1  1 
ATOM   157  N  NE2  . HIS B 2 3   ? 4.584   20.138 5.983  1.000 45.768 ? 3   HIS HHH NE2  1 
ATOM   158  H  H    . HIS B 2 3   ? 8.436   15.699 8.391  1.000 45.023 ? 3   HIS HHH H    1 
ATOM   159  H  HA   . HIS B 2 3   ? 8.329   18.301 7.443  1.000 43.586 ? 3   HIS HHH HA   1 
ATOM   160  H  HB2  . HIS B 2 3   ? 6.980   16.743 6.081  1.000 45.666 ? 3   HIS HHH HB2  1 
ATOM   161  H  HB3  . HIS B 2 3   ? 6.004   16.666 7.330  1.000 44.949 ? 3   HIS HHH HB3  1 
ATOM   162  H  HD1  . HIS B 2 3   ? 7.217   19.242 5.022  0.000 30.000 ? 3   HIS HHH HD1  1 
ATOM   163  H  HD2  . HIS B 2 3   ? 4.153   18.671 7.372  1.000 44.979 ? 3   HIS HHH HD2  1 
ATOM   164  H  HE1  . HIS B 2 3   ? 5.790   20.985 4.562  1.000 46.336 ? 3   HIS HHH HE1  1 
ATOM   165  H  HE2  . HIS B 2 3   ? 3.823   20.724 5.993  0.000 30.000 ? 3   HIS HHH HE2  1 
ATOM   166  N  N    . LEU B 2 4   ? 7.539   19.145 9.617  1.000 40.563 ? 4   LEU HHH N    1 
ATOM   167  C  CA   . LEU B 2 4   ? 6.915   19.743 10.827 1.000 39.924 ? 4   LEU HHH CA   1 
ATOM   168  C  C    . LEU B 2 4   ? 5.793   20.666 10.359 1.000 39.972 ? 4   LEU HHH C    1 
ATOM   169  O  O    . LEU B 2 4   ? 6.084   21.570 9.557  1.000 40.365 ? 4   LEU HHH O    1 
ATOM   170  C  CB   . LEU B 2 4   ? 7.965   20.513 11.637 1.000 39.084 ? 4   LEU HHH CB   1 
ATOM   171  C  CG   . LEU B 2 4   ? 8.823   19.672 12.585 1.000 38.333 ? 4   LEU HHH CG   1 
ATOM   172  C  CD1  . LEU B 2 4   ? 9.717   18.719 11.808 1.000 38.887 ? 4   LEU HHH CD1  1 
ATOM   173  C  CD2  . LEU B 2 4   ? 9.658   20.555 13.496 1.000 37.346 ? 4   LEU HHH CD2  1 
ATOM   174  H  H    . LEU B 2 4   ? 8.064   19.730 9.157  1.000 40.658 ? 4   LEU HHH H    1 
ATOM   175  H  HA   . LEU B 2 4   ? 6.533   19.022 11.378 1.000 39.987 ? 4   LEU HHH HA   1 
ATOM   176  H  HB2  . LEU B 2 4   ? 8.558   20.976 11.012 1.000 38.969 ? 4   LEU HHH HB2  1 
ATOM   177  H  HB3  . LEU B 2 4   ? 7.503   21.196 12.164 1.000 38.605 ? 4   LEU HHH HB3  1 
ATOM   178  H  HG   . LEU B 2 4   ? 8.217   19.133 13.150 1.000 38.453 ? 4   LEU HHH HG   1 
ATOM   179  H  HD11 . LEU B 2 4   ? 9.187   17.974 11.477 1.000 39.399 ? 4   LEU HHH HD11 1 
ATOM   180  H  HD12 . LEU B 2 4   ? 10.418  18.382 12.393 1.000 38.727 ? 4   LEU HHH HD12 1 
ATOM   181  H  HD13 . LEU B 2 4   ? 10.119  19.189 11.058 1.000 39.054 ? 4   LEU HHH HD13 1 
ATOM   182  H  HD21 . LEU B 2 4   ? 10.497  20.773 13.056 1.000 37.460 ? 4   LEU HHH HD21 1 
ATOM   183  H  HD22 . LEU B 2 4   ? 9.841   20.083 14.327 1.000 37.350 ? 4   LEU HHH HD22 1 
ATOM   184  H  HD23 . LEU B 2 4   ? 9.173   21.375 13.689 1.000 37.190 ? 4   LEU HHH HD23 1 
ATOM   185  N  N    . GLU B 2 5   ? 4.560   20.415 10.802 1.000 40.708 ? 5   GLU HHH N    1 
ATOM   186  C  CA   . GLU B 2 5   ? 3.352   21.163 10.358 1.000 41.986 ? 5   GLU HHH CA   1 
ATOM   187  C  C    . GLU B 2 5   ? 2.713   21.825 11.581 1.000 40.943 ? 5   GLU HHH C    1 
ATOM   188  O  O    . GLU B 2 5   ? 2.581   21.148 12.619 1.000 40.895 ? 5   GLU HHH O    1 
ATOM   189  C  CB   . GLU B 2 5   ? 2.371   20.237 9.638  1.000 43.706 ? 5   GLU HHH CB   1 
ATOM   190  C  CG   . GLU B 2 5   ? 1.189   20.962 9.020  1.000 45.652 ? 5   GLU HHH CG   1 
ATOM   191  C  CD   . GLU B 2 5   ? 1.428   21.575 7.648  1.000 47.274 ? 5   GLU HHH CD   1 
ATOM   192  O  OE1  . GLU B 2 5   ? 2.190   22.565 7.569  1.000 46.191 ? 5   GLU HHH OE1  1 
ATOM   193  O  OE2  . GLU B 2 5   ? 0.842   21.058 6.654  1.000 49.938 ? 5   GLU HHH OE2  1 
ATOM   194  H  H    . GLU B 2 5   ? 4.382   19.763 11.413 1.000 40.804 ? 5   GLU HHH H    1 
ATOM   195  H  HA   . GLU B 2 5   ? 3.635   21.868 9.732  1.000 41.758 ? 5   GLU HHH HA   1 
ATOM   196  H  HB2  . GLU B 2 5   ? 2.853   19.757 8.933  1.000 44.186 ? 5   GLU HHH HB2  1 
ATOM   197  H  HB3  . GLU B 2 5   ? 2.038   19.575 10.279 1.000 43.964 ? 5   GLU HHH HB3  1 
ATOM   198  H  HG2  . GLU B 2 5   ? 0.441   20.331 8.945  1.000 46.588 ? 5   GLU HHH HG2  1 
ATOM   199  H  HG3  . GLU B 2 5   ? 0.904   21.677 9.626  1.000 45.236 ? 5   GLU HHH HG3  1 
ATOM   200  N  N    . GLN B 2 6   ? 2.330   23.095 11.445 1.000 39.717 ? 6   GLN HHH N    1 
ATOM   201  C  CA   . GLN B 2 6   ? 1.885   23.950 12.573 1.000 38.670 ? 6   GLN HHH CA   1 
ATOM   202  C  C    . GLN B 2 6   ? 0.436   24.397 12.358 1.000 38.646 ? 6   GLN HHH C    1 
ATOM   203  O  O    . GLN B 2 6   ? 0.008   24.534 11.198 1.000 38.270 ? 6   GLN HHH O    1 
ATOM   204  C  CB   . GLN B 2 6   ? 2.819   25.155 12.729 1.000 37.746 ? 6   GLN HHH CB   1 
ATOM   205  C  CG   . GLN B 2 6   ? 3.919   24.946 13.761 1.000 36.656 ? 6   GLN HHH CG   1 
ATOM   206  C  CD   . GLN B 2 6   ? 4.929   26.065 13.745 1.000 35.425 ? 6   GLN HHH CD   1 
ATOM   207  O  OE1  . GLN B 2 6   ? 5.835   26.094 12.922 1.000 35.195 ? 6   GLN HHH OE1  1 
ATOM   208  N  NE2  . GLN B 2 6   ? 4.790   26.992 14.675 1.000 35.009 ? 6   GLN HHH NE2  1 
ATOM   209  H  H    . GLN B 2 6   ? 2.313   23.515 10.639 1.000 40.104 ? 6   GLN HHH H    1 
ATOM   210  H  HA   . GLN B 2 6   ? 1.925   23.416 13.395 1.000 38.439 ? 6   GLN HHH HA   1 
ATOM   211  H  HB2  . GLN B 2 6   ? 3.228   25.347 11.859 1.000 37.715 ? 6   GLN HHH HB2  1 
ATOM   212  H  HB3  . GLN B 2 6   ? 2.284   25.935 12.986 1.000 37.766 ? 6   GLN HHH HB3  1 
ATOM   213  H  HG2  . GLN B 2 6   ? 3.517   24.887 14.654 1.000 36.625 ? 6   GLN HHH HG2  1 
ATOM   214  H  HG3  . GLN B 2 6   ? 4.376   24.097 13.579 1.000 36.611 ? 6   GLN HHH HG3  1 
ATOM   215  H  HE21 . GLN B 2 6   ? 5.450   27.711 14.552 0.000 30.000 ? 6   GLN HHH HE21 1 
ATOM   216  H  HE22 . GLN B 2 6   ? 4.203   27.065 15.160 0.000 30.000 ? 6   GLN HHH HE22 1 
ATOM   217  N  N    . SER B 2 7   ? -0.261  24.626 13.471 1.000 38.314 ? 7   SER HHH N    1 
ATOM   218  C  CA   . SER B 2 7   ? -1.579  25.301 13.561 1.000 39.097 ? 7   SER HHH CA   1 
ATOM   219  C  C    . SER B 2 7   ? -1.582  26.581 12.721 1.000 39.046 ? 7   SER HHH C    1 
ATOM   220  O  O    . SER B 2 7   ? -0.487  27.119 12.439 1.000 37.716 ? 7   SER HHH O    1 
ATOM   221  C  CB   . SER B 2 7   ? -1.899  25.606 14.995 1.000 39.073 ? 7   SER HHH CB   1 
ATOM   222  O  OG   . SER B 2 7   ? -1.660  24.471 15.811 1.000 39.082 ? 7   SER HHH OG   1 
ATOM   223  H  H    . SER B 2 7   ? 0.040   24.369 14.291 1.000 37.973 ? 7   SER HHH H    1 
ATOM   224  H  HA   . SER B 2 7   ? -2.272  24.684 13.201 1.000 40.137 ? 7   SER HHH HA   1 
ATOM   225  H  HB2  . SER B 2 7   ? -1.342  26.357 15.303 1.000 38.319 ? 7   SER HHH HB2  1 
ATOM   226  H  HB3  . SER B 2 7   ? -2.843  25.874 15.070 1.000 40.004 ? 7   SER HHH HB3  1 
ATOM   227  H  HG   . SER B 2 7   ? -1.704  24.670 16.534 0.000 30.000 ? 7   SER HHH HG   1 
ATOM   228  N  N    . GLY B 2 8   ? -2.779  27.065 12.375 1.000 40.244 ? 8   GLY HHH N    1 
ATOM   229  C  CA   . GLY B 2 8   ? -2.983  28.350 11.684 1.000 40.757 ? 8   GLY HHH CA   1 
ATOM   230  C  C    . GLY B 2 8   ? -2.625  29.538 12.563 1.000 40.383 ? 8   GLY HHH C    1 
ATOM   231  O  O    . GLY B 2 8   ? -2.232  29.345 13.731 1.000 39.355 ? 8   GLY HHH O    1 
ATOM   232  H  H    . GLY B 2 8   ? -3.550  26.614 12.552 1.000 41.238 ? 8   GLY HHH H    1 
ATOM   233  H  HA2  . GLY B 2 8   ? -2.425  28.367 10.867 1.000 40.577 ? 8   GLY HHH HA2  1 
ATOM   234  H  HA3  . GLY B 2 8   ? -3.931  28.419 11.410 1.000 42.003 ? 8   GLY HHH HA3  1 
ATOM   235  N  N    . SER B 2 9   ? -2.765  30.739 12.004 1.000 41.896 ? 9   SER HHH N    1 
ATOM   236  C  CA   . SER B 2 9   ? -2.655  32.045 12.703 1.000 42.378 ? 9   SER HHH CA   1 
ATOM   237  C  C    . SER B 2 9   ? -3.636  32.111 13.880 1.000 43.521 ? 9   SER HHH C    1 
ATOM   238  O  O    . SER B 2 9   ? -4.741  31.560 13.761 1.000 44.700 ? 9   SER HHH O    1 
ATOM   239  C  CB   . SER B 2 9   ? -2.905  33.178 11.744 1.000 43.131 ? 9   SER HHH CB   1 
ATOM   240  O  OG   . SER B 2 9   ? -1.948  33.167 10.700 1.000 42.969 ? 9   SER HHH OG   1 
ATOM   241  H  H    . SER B 2 9   ? -2.945  30.844 11.117 1.000 42.334 ? 9   SER HHH H    1 
ATOM   242  H  HA   . SER B 2 9   ? -1.732  32.126 13.058 1.000 41.273 ? 9   SER HHH HA   1 
ATOM   243  H  HB2  . SER B 2 9   ? -3.808  33.092 11.364 1.000 44.322 ? 9   SER HHH HB2  1 
ATOM   244  H  HB3  . SER B 2 9   ? -2.855  34.034 12.228 1.000 42.874 ? 9   SER HHH HB3  1 
ATOM   245  H  HG   . SER B 2 9   ? -2.321  33.756 10.109 0.000 30.000 ? 9   SER HHH HG   1 
ATOM   246  N  N    . GLU B 2 10  ? -3.230  32.763 14.973 1.000 43.602 ? 10  GLU HHH N    1 
ATOM   247  C  CA   . GLU B 2 10  ? -4.116  33.132 16.108 1.000 45.221 ? 10  GLU HHH CA   1 
ATOM   248  C  C    . GLU B 2 10  ? -4.182  34.662 16.178 1.000 44.884 ? 10  GLU HHH C    1 
ATOM   249  O  O    . GLU B 2 10  ? -3.184  35.290 16.589 1.000 44.131 ? 10  GLU HHH O    1 
ATOM   250  C  CB   . GLU B 2 10  ? -3.609  32.548 17.429 1.000 45.645 ? 10  GLU HHH CB   1 
ATOM   251  C  CG   . GLU B 2 10  ? -3.246  31.075 17.378 1.000 46.134 ? 10  GLU HHH CG   1 
ATOM   252  C  CD   . GLU B 2 10  ? -4.396  30.081 17.329 1.000 48.271 ? 10  GLU HHH CD   1 
ATOM   253  O  OE1  . GLU B 2 10  ? -5.549  30.463 17.641 1.000 48.750 ? 10  GLU HHH OE1  1 
ATOM   254  O  OE2  . GLU B 2 10  ? -4.119  28.908 16.987 1.000 49.834 ? 10  GLU HHH OE2  1 
ATOM   255  H  H    . GLU B 2 10  ? -2.366  33.025 15.089 1.000 42.638 ? 10  GLU HHH H    1 
ATOM   256  H  HA   . GLU B 2 10  ? -5.019  32.783 15.930 1.000 46.304 ? 10  GLU HHH HA   1 
ATOM   257  H  HB2  . GLU B 2 10  ? -2.818  33.054 17.709 1.000 44.742 ? 10  GLU HHH HB2  1 
ATOM   258  H  HB3  . GLU B 2 10  ? -4.301  32.680 18.110 1.000 46.456 ? 10  GLU HHH HB3  1 
ATOM   259  H  HG2  . GLU B 2 10  ? -2.681  30.920 16.592 1.000 45.495 ? 10  GLU HHH HG2  1 
ATOM   260  H  HG3  . GLU B 2 10  ? -2.702  30.864 18.167 1.000 45.635 ? 10  GLU HHH HG3  1 
ATOM   261  N  N    . LEU B 2 11  ? -5.300  35.240 15.744 1.000 45.958 ? 11  LEU HHH N    1 
ATOM   262  C  CA   . LEU B 2 11  ? -5.603  36.687 15.893 1.000 46.455 ? 11  LEU HHH CA   1 
ATOM   263  C  C    . LEU B 2 11  ? -6.531  36.836 17.104 1.000 47.063 ? 11  LEU HHH C    1 
ATOM   264  O  O    . LEU B 2 11  ? -7.708  36.476 16.984 1.000 48.912 ? 11  LEU HHH O    1 
ATOM   265  C  CB   . LEU B 2 11  ? -6.229  37.194 14.590 1.000 47.842 ? 11  LEU HHH CB   1 
ATOM   266  C  CG   . LEU B 2 11  ? -5.344  37.035 13.349 1.000 47.666 ? 11  LEU HHH CG   1 
ATOM   267  C  CD1  . LEU B 2 11  ? -6.161  36.603 12.139 1.000 49.182 ? 11  LEU HHH CD1  1 
ATOM   268  C  CD2  . LEU B 2 11  ? -4.572  38.314 13.049 1.000 46.873 ? 11  LEU HHH CD2  1 
ATOM   269  H  H    . LEU B 2 11  ? -5.958  34.773 15.321 1.000 46.944 ? 11  LEU HHH H    1 
ATOM   270  H  HA   . LEU B 2 11  ? -4.764  37.172 16.069 1.000 45.367 ? 11  LEU HHH HA   1 
ATOM   271  H  HB2  . LEU B 2 11  ? -7.066  36.710 14.441 1.000 49.068 ? 11  LEU HHH HB2  1 
ATOM   272  H  HB3  . LEU B 2 11  ? -6.450  38.140 14.700 1.000 48.209 ? 11  LEU HHH HB3  1 
ATOM   273  H  HG   . LEU B 2 11  ? -4.684  36.323 13.536 1.000 46.717 ? 11  LEU HHH HG   1 
ATOM   274  H  HD11 . LEU B 2 11  ? -6.531  35.717 12.296 1.000 49.631 ? 11  LEU HHH HD11 1 
ATOM   275  H  HD12 . LEU B 2 11  ? -5.589  36.580 11.352 1.000 48.667 ? 11  LEU HHH HD12 1 
ATOM   276  H  HD13 . LEU B 2 11  ? -6.886  37.236 11.993 1.000 50.161 ? 11  LEU HHH HD13 1 
ATOM   277  H  HD21 . LEU B 2 11  ? -5.193  39.012 12.778 1.000 47.692 ? 11  LEU HHH HD21 1 
ATOM   278  H  HD22 . LEU B 2 11  ? -3.937  38.149 12.330 1.000 46.293 ? 11  LEU HHH HD22 1 
ATOM   279  H  HD23 . LEU B 2 11  ? -4.092  38.599 13.845 1.000 46.155 ? 11  LEU HHH HD23 1 
ATOM   280  N  N    . LYS B 2 12  ? -5.995  37.297 18.237 1.000 46.031 ? 12  LYS HHH N    1 
ATOM   281  C  CA   . LYS B 2 12  ? -6.643  37.204 19.574 1.000 46.975 ? 12  LYS HHH CA   1 
ATOM   282  C  C    . LYS B 2 12  ? -6.751  38.589 20.218 1.000 46.884 ? 12  LYS HHH C    1 
ATOM   283  O  O    . LYS B 2 12  ? -6.098  39.526 19.724 1.000 46.464 ? 12  LYS HHH O    1 
ATOM   284  C  CB   . LYS B 2 12  ? -5.823  36.281 20.482 1.000 46.391 ? 12  LYS HHH CB   1 
ATOM   285  C  CG   . LYS B 2 12  ? -5.818  34.813 20.084 1.000 46.357 ? 12  LYS HHH CG   1 
ATOM   286  C  CD   . LYS B 2 12  ? -7.210  34.257 19.872 1.000 48.292 ? 12  LYS HHH CD   1 
ATOM   287  C  CE   . LYS B 2 12  ? -7.263  32.747 19.879 1.000 48.379 ? 12  LYS HHH CE   1 
ATOM   288  N  NZ   . LYS B 2 12  ? -8.661  32.270 19.770 1.000 50.725 ? 12  LYS HHH NZ   1 
ATOM   289  H  H    . LYS B 2 12  ? -5.182  37.707 18.258 1.000 45.094 ? 12  LYS HHH H    1 
ATOM   290  H  HA   . LYS B 2 12  ? -7.548  36.834 19.465 1.000 48.182 ? 12  LYS HHH HA   1 
ATOM   291  H  HB2  . LYS B 2 12  ? -4.898  36.603 20.494 1.000 45.234 ? 12  LYS HHH HB2  1 
ATOM   292  H  HB3  . LYS B 2 12  ? -6.175  36.354 21.394 1.000 47.181 ? 12  LYS HHH HB3  1 
ATOM   293  H  HG2  . LYS B 2 12  ? -5.302  34.709 19.256 1.000 45.471 ? 12  LYS HHH HG2  1 
ATOM   294  H  HG3  . LYS B 2 12  ? -5.370  34.296 20.786 1.000 46.017 ? 12  LYS HHH HG3  1 
ATOM   295  H  HD2  . LYS B 2 12  ? -7.800  34.598 20.578 1.000 49.320 ? 12  LYS HHH HD2  1 
ATOM   296  H  HD3  . LYS B 2 12  ? -7.554  34.579 19.012 1.000 48.523 ? 12  LYS HHH HD3  1 
ATOM   297  H  HE2  . LYS B 2 12  ? -6.745  32.395 19.131 1.000 47.579 ? 12  LYS HHH HE2  1 
ATOM   298  H  HE3  . LYS B 2 12  ? -6.874  32.408 20.707 1.000 48.178 ? 12  LYS HHH HE3  1 
ATOM   299  H  HZ1  . LYS B 2 12  ? -9.136  32.544 20.493 1.000 51.573 ? 12  LYS HHH HZ1  1 
ATOM   300  H  HZ2  . LYS B 2 12  ? -8.675  31.364 19.732 1.000 50.731 ? 12  LYS HHH HZ2  1 
ATOM   301  H  HZ3  . LYS B 2 12  ? -9.042  32.606 19.019 1.000 51.041 ? 12  LYS HHH HZ3  1 
ATOM   302  N  N    . LYS B 2 13  ? -7.545  38.692 21.287 1.000 47.606 ? 13  LYS HHH N    1 
ATOM   303  C  CA   . LYS B 2 13  ? -7.595  39.874 22.186 1.000 47.704 ? 13  LYS HHH CA   1 
ATOM   304  C  C    . LYS B 2 13  ? -6.629  39.648 23.345 1.000 46.301 ? 13  LYS HHH C    1 
ATOM   305  O  O    . LYS B 2 13  ? -6.359  38.511 23.725 1.000 45.960 ? 13  LYS HHH O    1 
ATOM   306  C  CB   . LYS B 2 13  ? -9.019  40.121 22.688 1.000 50.321 ? 13  LYS HHH CB   1 
ATOM   307  C  CG   . LYS B 2 13  ? -9.957  40.724 21.654 1.000 51.850 ? 13  LYS HHH CG   1 
ATOM   308  C  CD   . LYS B 2 13  ? -11.000 41.651 22.243 1.000 54.500 ? 13  LYS HHH CD   1 
ATOM   309  C  CE   . LYS B 2 13  ? -12.227 41.795 21.366 1.000 56.547 ? 13  LYS HHH CE   1 
ATOM   310  N  NZ   . LYS B 2 13  ? -11.863 42.118 19.965 1.000 55.604 ? 13  LYS HHH NZ   1 
ATOM   311  H  H    . LYS B 2 13  ? -8.113  38.024 21.534 1.000 48.546 ? 13  LYS HHH H    1 
ATOM   312  H  HA   . LYS B 2 13  ? -7.300  40.659 21.675 1.000 47.153 ? 13  LYS HHH HA   1 
ATOM   313  H  HB2  . LYS B 2 13  ? -9.395  39.269 22.992 1.000 51.047 ? 13  LYS HHH HB2  1 
ATOM   314  H  HB3  . LYS B 2 13  ? -8.977  40.722 23.461 1.000 50.872 ? 13  LYS HHH HB3  1 
ATOM   315  H  HG2  . LYS B 2 13  ? -9.425  41.223 20.997 1.000 50.775 ? 13  LYS HHH HG2  1 
ATOM   316  H  HG3  . LYS B 2 13  ? -10.411 39.996 21.178 1.000 52.289 ? 13  LYS HHH HG3  1 
ATOM   317  H  HD2  . LYS B 2 13  ? -11.275 41.307 23.120 1.000 55.366 ? 13  LYS HHH HD2  1 
ATOM   318  H  HD3  . LYS B 2 13  ? -10.601 42.537 22.378 1.000 54.012 ? 13  LYS HHH HD3  1 
ATOM   319  H  HE2  . LYS B 2 13  ? -12.737 40.963 21.378 1.000 57.346 ? 13  LYS HHH HE2  1 
ATOM   320  H  HE3  . LYS B 2 13  ? -12.798 42.505 21.716 1.000 57.836 ? 13  LYS HHH HE3  1 
ATOM   321  H  HZ1  . LYS B 2 13  ? -11.148 42.676 19.952 1.000 54.380 ? 13  LYS HHH HZ1  1 
ATOM   322  H  HZ2  . LYS B 2 13  ? -12.561 42.523 19.552 1.000 56.710 ? 13  LYS HHH HZ2  1 
ATOM   323  H  HZ3  . LYS B 2 13  ? -11.656 41.357 19.517 1.000 54.932 ? 13  LYS HHH HZ3  1 
ATOM   324  N  N    . PRO B 2 14  ? -6.042  40.719 23.919 1.000 45.545 ? 14  PRO HHH N    1 
ATOM   325  C  CA   . PRO B 2 14  ? -5.082  40.574 25.013 1.000 45.062 ? 14  PRO HHH CA   1 
ATOM   326  C  C    . PRO B 2 14  ? -5.725  40.029 26.296 1.000 46.515 ? 14  PRO HHH C    1 
ATOM   327  O  O    . PRO B 2 14  ? -6.692  40.608 26.749 1.000 48.090 ? 14  PRO HHH O    1 
ATOM   328  C  CB   . PRO B 2 14  ? -4.556  42.000 25.248 1.000 45.116 ? 14  PRO HHH CB   1 
ATOM   329  C  CG   . PRO B 2 14  ? -4.922  42.757 23.983 1.000 44.807 ? 14  PRO HHH CG   1 
ATOM   330  C  CD   . PRO B 2 14  ? -6.208  42.118 23.502 1.000 45.935 ? 14  PRO HHH CD   1 
ATOM   331  H  HA   . PRO B 2 14  ? -4.337  39.989 24.725 1.000 43.882 ? 14  PRO HHH HA   1 
ATOM   332  H  HB2  . PRO B 2 14  ? -4.981  42.409 26.032 1.000 46.302 ? 14  PRO HHH HB2  1 
ATOM   333  H  HB3  . PRO B 2 14  ? -3.585  41.996 25.382 1.000 44.109 ? 14  PRO HHH HB3  1 
ATOM   334  H  HG2  . PRO B 2 14  ? -5.057  43.707 24.174 1.000 45.310 ? 14  PRO HHH HG2  1 
ATOM   335  H  HG3  . PRO B 2 14  ? -4.217  42.667 23.309 1.000 43.526 ? 14  PRO HHH HG3  1 
ATOM   336  H  HD2  . PRO B 2 14  ? -6.986  42.523 23.929 1.000 47.283 ? 14  PRO HHH HD2  1 
ATOM   337  H  HD3  . PRO B 2 14  ? -6.296  42.195 22.535 1.000 45.448 ? 14  PRO HHH HD3  1 
ATOM   338  N  N    . GLY B 2 15  ? -5.158  38.948 26.843 1.000 45.677 ? 15  GLY HHH N    1 
ATOM   339  C  CA   . GLY B 2 15  ? -5.668  38.243 28.033 1.000 46.797 ? 15  GLY HHH CA   1 
ATOM   340  C  C    . GLY B 2 15  ? -6.193  36.862 27.684 1.000 46.571 ? 15  GLY HHH C    1 
ATOM   341  O  O    . GLY B 2 15  ? -6.383  36.055 28.615 1.000 47.532 ? 15  GLY HHH O    1 
ATOM   342  H  H    . GLY B 2 15  ? -4.403  38.576 26.496 1.000 44.430 ? 15  GLY HHH H    1 
ATOM   343  H  HA2  . GLY B 2 15  ? -4.937  38.158 28.696 1.000 46.590 ? 15  GLY HHH HA2  1 
ATOM   344  H  HA3  . GLY B 2 15  ? -6.395  38.776 28.443 1.000 48.246 ? 15  GLY HHH HA3  1 
ATOM   345  N  N    . ALA B 2 16  ? -6.419  36.595 26.393 1.000 45.388 ? 16  ALA HHH N    1 
ATOM   346  C  CA   . ALA B 2 16  ? -6.810  35.268 25.860 1.000 45.525 ? 16  ALA HHH CA   1 
ATOM   347  C  C    . ALA B 2 16  ? -5.643  34.283 25.997 1.000 44.278 ? 16  ALA HHH C    1 
ATOM   348  O  O    . ALA B 2 16  ? -4.541  34.688 26.413 1.000 43.691 ? 16  ALA HHH O    1 
ATOM   349  C  CB   . ALA B 2 16  ? -7.254  35.392 24.422 1.000 45.038 ? 16  ALA HHH CB   1 
ATOM   350  H  H    . ALA B 2 16  ? -6.356  37.223 25.736 1.000 44.952 ? 16  ALA HHH H    1 
ATOM   351  H  HA   . ALA B 2 16  ? -7.566  34.930 26.395 1.000 46.988 ? 16  ALA HHH HA   1 
ATOM   352  H  HB1  . ALA B 2 16  ? -7.558  34.527 24.099 1.000 45.265 ? 16  ALA HHH HB1  1 
ATOM   353  H  HB2  . ALA B 2 16  ? -7.982  36.033 24.361 1.000 46.097 ? 16  ALA HHH HB2  1 
ATOM   354  H  HB3  . ALA B 2 16  ? -6.509  35.696 23.877 1.000 43.716 ? 16  ALA HHH HB3  1 
ATOM   355  N  N    . SER B 2 17  ? -5.879  33.021 25.654 1.000 44.486 ? 17  SER HHH N    1 
ATOM   356  C  CA   . SER B 2 17  ? -4.860  31.944 25.691 1.000 43.467 ? 17  SER HHH CA   1 
ATOM   357  C  C    . SER B 2 17  ? -4.932  31.139 24.392 1.000 42.495 ? 17  SER HHH C    1 
ATOM   358  O  O    . SER B 2 17  ? -6.052  30.943 23.882 1.000 44.263 ? 17  SER HHH O    1 
ATOM   359  C  CB   . SER B 2 17  ? -5.044  31.077 26.913 1.000 44.971 ? 17  SER HHH CB   1 
ATOM   360  O  OG   . SER B 2 17  ? -4.680  31.787 28.092 1.000 45.933 ? 17  SER HHH OG   1 
ATOM   361  H  H    . SER B 2 17  ? -6.693  32.721 25.374 1.000 45.369 ? 17  SER HHH H    1 
ATOM   362  H  HA   . SER B 2 17  ? -3.965  32.370 25.741 1.000 42.430 ? 17  SER HHH HA   1 
ATOM   363  H  HB2  . SER B 2 17  ? -5.984  30.795 26.975 1.000 46.238 ? 17  SER HHH HB2  1 
ATOM   364  H  HB3  . SER B 2 17  ? -4.486  30.272 26.829 1.000 44.259 ? 17  SER HHH HB3  1 
ATOM   365  H  HG   . SER B 2 17  ? -4.744  31.300 28.801 0.000 30.000 ? 17  SER HHH HG   1 
ATOM   366  N  N    . VAL B 2 18  ? -3.779  30.708 23.875 1.000 40.216 ? 18  VAL HHH N    1 
ATOM   367  C  CA   . VAL B 2 18  ? -3.668  29.939 22.602 1.000 39.231 ? 18  VAL HHH CA   1 
ATOM   368  C  C    . VAL B 2 18  ? -2.790  28.708 22.828 1.000 38.030 ? 18  VAL HHH C    1 
ATOM   369  O  O    . VAL B 2 18  ? -1.872  28.768 23.665 1.000 36.801 ? 18  VAL HHH O    1 
ATOM   370  C  CB   . VAL B 2 18  ? -3.116  30.803 21.452 1.000 38.422 ? 18  VAL HHH CB   1 
ATOM   371  C  CG1  . VAL B 2 18  ? -4.180  31.744 20.911 1.000 39.587 ? 18  VAL HHH CG1  1 
ATOM   372  C  CG2  . VAL B 2 18  ? -1.862  31.571 21.851 1.000 37.260 ? 18  VAL HHH CG2  1 
ATOM   373  H  H    . VAL B 2 18  ? -2.977  30.854 24.282 1.000 39.670 ? 18  VAL HHH H    1 
ATOM   374  H  HA   . VAL B 2 18  ? -4.558  29.633 22.353 1.000 40.212 ? 18  VAL HHH HA   1 
ATOM   375  H  HB   . VAL B 2 18  ? -2.866  30.187 20.720 1.000 37.917 ? 18  VAL HHH HB   1 
ATOM   376  H  HG11 . VAL B 2 18  ? -4.803  31.244 20.354 1.000 40.119 ? 18  VAL HHH HG11 1 
ATOM   377  H  HG12 . VAL B 2 18  ? -3.758  32.441 20.379 1.000 38.841 ? 18  VAL HHH HG12 1 
ATOM   378  H  HG13 . VAL B 2 18  ? -4.663  32.150 21.651 1.000 40.363 ? 18  VAL HHH HG13 1 
ATOM   379  H  HG21 . VAL B 2 18  ? -2.083  32.222 22.539 1.000 37.790 ? 18  VAL HHH HG21 1 
ATOM   380  H  HG22 . VAL B 2 18  ? -1.503  32.033 21.073 1.000 36.591 ? 18  VAL HHH HG22 1 
ATOM   381  H  HG23 . VAL B 2 18  ? -1.195  30.951 22.194 1.000 36.815 ? 18  VAL HHH HG23 1 
ATOM   382  N  N    . THR B 2 19  ? -3.079  27.637 22.091 1.000 38.105 ? 19  THR HHH N    1 
ATOM   383  C  CA   . THR B 2 19  ? -2.241  26.418 22.016 1.000 37.692 ? 19  THR HHH CA   1 
ATOM   384  C  C    . THR B 2 19  ? -1.882  26.172 20.552 1.000 36.571 ? 19  THR HHH C    1 
ATOM   385  O  O    . THR B 2 19  ? -2.731  25.653 19.821 1.000 37.931 ? 19  THR HHH O    1 
ATOM   386  C  CB   . THR B 2 19  ? -2.941  25.214 22.656 1.000 39.467 ? 19  THR HHH CB   1 
ATOM   387  O  OG1  . THR B 2 19  ? -3.324  25.578 23.985 1.000 40.681 ? 19  THR HHH OG1  1 
ATOM   388  C  CG2  . THR B 2 19  ? -2.057  23.984 22.671 1.000 38.938 ? 19  THR HHH CG2  1 
ATOM   389  H  H    . THR B 2 19  ? -3.827  27.577 21.573 1.000 38.836 ? 19  THR HHH H    1 
ATOM   390  H  HA   . THR B 2 19  ? -1.411  26.591 22.514 1.000 37.040 ? 19  THR HHH HA   1 
ATOM   391  H  HB   . THR B 2 19  ? -3.754  25.014 22.134 1.000 40.160 ? 19  THR HHH HB   1 
ATOM   392  H  HG1  . THR B 2 19  ? -3.710  24.865 24.312 0.000 30.000 ? 19  THR HHH HG1  1 
ATOM   393  H  HG21 . THR B 2 19  ? -2.083  23.553 21.799 1.000 38.669 ? 19  THR HHH HG21 1 
ATOM   394  H  HG22 . THR B 2 19  ? -2.376  23.363 23.349 1.000 39.668 ? 19  THR HHH HG22 1 
ATOM   395  H  HG23 . THR B 2 19  ? -1.141  24.244 22.877 1.000 38.036 ? 19  THR HHH HG23 1 
ATOM   396  N  N    . ILE B 2 20  ? -0.674  26.566 20.156 1.000 35.071 ? 20  ILE HHH N    1 
ATOM   397  C  CA   . ILE B 2 20  ? -0.065  26.252 18.830 1.000 34.611 ? 20  ILE HHH CA   1 
ATOM   398  C  C    . ILE B 2 20  ? 0.417   24.800 18.861 1.000 34.465 ? 20  ILE HHH C    1 
ATOM   399  O  O    . ILE B 2 20  ? 1.103   24.425 19.826 1.000 33.875 ? 20  ILE HHH O    1 
ATOM   400  C  CB   . ILE B 2 20  ? 1.092   27.223 18.530 1.000 33.362 ? 20  ILE HHH CB   1 
ATOM   401  C  CG1  . ILE B 2 20  ? 0.590   28.663 18.415 1.000 33.531 ? 20  ILE HHH CG1  1 
ATOM   402  C  CG2  . ILE B 2 20  ? 1.883   26.789 17.303 1.000 32.407 ? 20  ILE HHH CG2  1 
ATOM   403  C  CD1  . ILE B 2 20  ? 1.610   29.686 18.839 1.000 33.037 ? 20  ILE HHH CD1  1 
ATOM   404  H  H    . ILE B 2 20  ? -0.130  27.066 20.688 1.000 34.783 ? 20  ILE HHH H    1 
ATOM   405  H  HA   . ILE B 2 20  ? -0.745  26.348 18.140 1.000 35.033 ? 20  ILE HHH HA   1 
ATOM   406  H  HB   . ILE B 2 20  ? 1.707   27.187 19.303 1.000 33.011 ? 20  ILE HHH HB   1 
ATOM   407  H  HG12 . ILE B 2 20  ? 0.336   28.836 17.483 1.000 33.693 ? 20  ILE HHH HG12 1 
ATOM   408  H  HG13 . ILE B 2 20  ? -0.212  28.767 18.970 1.000 34.343 ? 20  ILE HHH HG13 1 
ATOM   409  H  HG21 . ILE B 2 20  ? 2.544   26.122 17.559 1.000 32.213 ? 20  ILE HHH HG21 1 
ATOM   410  H  HG22 . ILE B 2 20  ? 2.337   27.559 16.919 1.000 32.078 ? 20  ILE HHH HG22 1 
ATOM   411  H  HG23 . ILE B 2 20  ? 1.279   26.408 16.642 1.000 33.021 ? 20  ILE HHH HG23 1 
ATOM   412  H  HD11 . ILE B 2 20  ? 2.354   29.245 19.284 1.000 32.586 ? 20  ILE HHH HD11 1 
ATOM   413  H  HD12 . ILE B 2 20  ? 1.199   30.319 19.452 1.000 33.337 ? 20  ILE HHH HD12 1 
ATOM   414  H  HD13 . ILE B 2 20  ? 1.940   30.161 18.056 1.000 32.560 ? 20  ILE HHH HD13 1 
ATOM   415  N  N    . SER B 2 21  ? 0.081   24.025 17.835 1.000 35.244 ? 21  SER HHH N    1 
ATOM   416  C  CA   . SER B 2 21  ? 0.468   22.601 17.716 1.000 36.249 ? 21  SER HHH CA   1 
ATOM   417  C  C    . SER B 2 21  ? 1.552   22.461 16.646 1.000 36.455 ? 21  SER HHH C    1 
ATOM   418  O  O    . SER B 2 21  ? 1.629   23.340 15.755 1.000 35.921 ? 21  SER HHH O    1 
ATOM   419  C  CB   . SER B 2 21  ? -0.724  21.739 17.414 1.000 37.347 ? 21  SER HHH CB   1 
ATOM   420  O  OG   . SER B 2 21  ? -1.197  21.999 16.107 1.000 38.291 ? 21  SER HHH OG   1 
ATOM   421  H  H    . SER B 2 21  ? -0.414  24.313 17.127 1.000 35.715 ? 21  SER HHH H    1 
ATOM   422  H  HA   . SER B 2 21  ? 0.852   22.310 18.586 1.000 36.039 ? 21  SER HHH HA   1 
ATOM   423  H  HB2  . SER B 2 21  ? -0.473  20.791 17.492 1.000 37.576 ? 21  SER HHH HB2  1 
ATOM   424  H  HB3  . SER B 2 21  ? -1.437  21.925 18.066 1.000 38.155 ? 21  SER HHH HB3  1 
ATOM   425  H  HG   . SER B 2 21  ? -1.785  21.583 15.958 0.000 30.000 ? 21  SER HHH HG   1 
ATOM   426  N  N    . CYS B 2 22  ? 2.338   21.382 16.749 1.000 37.412 ? 22  CYS HHH N    1 
ATOM   427  C  CA   . CYS B 2 22  ? 3.383   20.965 15.780 1.000 37.824 ? 22  CYS HHH CA   1 
ATOM   428  C  C    . CYS B 2 22  ? 3.320   19.450 15.551 1.000 37.206 ? 22  CYS HHH C    1 
ATOM   429  O  O    . CYS B 2 22  ? 3.859   18.710 16.388 1.000 36.327 ? 22  CYS HHH O    1 
ATOM   430  C  CB   . CYS B 2 22  ? 4.758   21.353 16.297 1.000 39.376 ? 22  CYS HHH CB   1 
ATOM   431  S  SG   . CYS B 2 22  ? 6.088   21.085 15.100 1.000 41.731 ? 22  CYS HHH SG   1 
ATOM   432  H  H    . CYS B 2 22  ? 2.284   20.808 17.454 1.000 37.507 ? 22  CYS HHH H    1 
ATOM   433  H  HA   . CYS B 2 22  ? 3.222   21.428 14.929 1.000 37.963 ? 22  CYS HHH HA   1 
ATOM   434  H  HB2  . CYS B 2 22  ? 4.750   22.301 16.543 1.000 39.100 ? 22  CYS HHH HB2  1 
ATOM   435  H  HB3  . CYS B 2 22  ? 4.956   20.837 17.104 1.000 39.385 ? 22  CYS HHH HB3  1 
ATOM   436  N  N    . LYS B 2 23  ? 2.683   19.030 14.454 1.000 37.474 ? 23  LYS HHH N    1 
ATOM   437  C  CA   . LYS B 2 23  ? 2.610   17.624 13.974 1.000 37.986 ? 23  LYS HHH CA   1 
ATOM   438  C  C    . LYS B 2 23  ? 3.901   17.311 13.215 1.000 36.229 ? 23  LYS HHH C    1 
ATOM   439  O  O    . LYS B 2 23  ? 4.246   18.089 12.311 1.000 35.817 ? 23  LYS HHH O    1 
ATOM   440  C  CB   . LYS B 2 23  ? 1.389   17.442 13.060 1.000 40.673 ? 23  LYS HHH CB   1 
ATOM   441  C  CG   . LYS B 2 23  ? 1.101   16.019 12.582 1.000 42.644 ? 23  LYS HHH CG   1 
ATOM   442  C  CD   . LYS B 2 23  ? -0.066  15.354 13.297 1.000 44.551 ? 23  LYS HHH CD   1 
ATOM   443  C  CE   . LYS B 2 23  ? -0.186  13.864 13.036 1.000 46.363 ? 23  LYS HHH CE   1 
ATOM   444  N  NZ   . LYS B 2 23  ? -0.884  13.567 11.760 1.000 48.299 ? 23  LYS HHH NZ   1 
ATOM   445  H  H    . LYS B 2 23  ? 2.235   19.610 13.912 1.000 37.798 ? 23  LYS HHH H    1 
ATOM   446  H  HA   . LYS B 2 23  ? 2.531   17.024 14.750 1.000 38.107 ? 23  LYS HHH HA   1 
ATOM   447  H  HB2  . LYS B 2 23  ? 0.600   17.771 13.538 1.000 40.884 ? 23  LYS HHH HB2  1 
ATOM   448  H  HB3  . LYS B 2 23  ? 1.513   18.010 12.271 1.000 40.541 ? 23  LYS HHH HB3  1 
ATOM   449  H  HG2  . LYS B 2 23  ? 0.912   16.043 11.620 1.000 43.231 ? 23  LYS HHH HG2  1 
ATOM   450  H  HG3  . LYS B 2 23  ? 1.905   15.473 12.714 1.000 42.201 ? 23  LYS HHH HG3  1 
ATOM   451  H  HD2  . LYS B 2 23  ? 0.032   15.496 14.262 1.000 44.053 ? 23  LYS HHH HD2  1 
ATOM   452  H  HD3  . LYS B 2 23  ? -0.899  15.790 13.015 1.000 45.235 ? 23  LYS HHH HD3  1 
ATOM   453  H  HE2  . LYS B 2 23  ? 0.706   13.467 13.006 1.000 45.706 ? 23  LYS HHH HE2  1 
ATOM   454  H  HE3  . LYS B 2 23  ? -0.676  13.445 13.768 1.000 46.679 ? 23  LYS HHH HE3  1 
ATOM   455  H  HZ1  . LYS B 2 23  ? -1.727  13.902 11.786 1.000 48.811 ? 23  LYS HHH HZ1  1 
ATOM   456  H  HZ2  . LYS B 2 23  ? -0.925  12.669 11.634 1.000 48.741 ? 23  LYS HHH HZ2  1 
ATOM   457  H  HZ3  . LYS B 2 23  ? -0.436  13.944 11.068 1.000 47.893 ? 23  LYS HHH HZ3  1 
ATOM   458  N  N    . THR B 2 24  ? 4.577   16.218 13.573 1.000 35.129 ? 24  THR HHH N    1 
ATOM   459  C  CA   . THR B 2 24  ? 5.819   15.729 12.919 1.000 34.693 ? 24  THR HHH CA   1 
ATOM   460  C  C    . THR B 2 24  ? 5.491   14.505 12.058 1.000 35.300 ? 24  THR HHH C    1 
ATOM   461  O  O    . THR B 2 24  ? 4.427   13.911 12.270 1.000 36.159 ? 24  THR HHH O    1 
ATOM   462  C  CB   . THR B 2 24  ? 6.894   15.384 13.954 1.000 34.028 ? 24  THR HHH CB   1 
ATOM   463  O  OG1  . THR B 2 24  ? 6.325   14.423 14.839 1.000 34.917 ? 24  THR HHH OG1  1 
ATOM   464  C  CG2  . THR B 2 24  ? 7.385   16.576 14.743 1.000 32.978 ? 24  THR HHH CG2  1 
ATOM   465  H  H    . THR B 2 24  ? 4.317   15.682 14.262 1.000 35.466 ? 24  THR HHH H    1 
ATOM   466  H  HA   . THR B 2 24  ? 6.162   16.442 12.335 1.000 34.460 ? 24  THR HHH HA   1 
ATOM   467  H  HB   . THR B 2 24  ? 7.656   14.974 13.485 1.000 34.211 ? 24  THR HHH HB   1 
ATOM   468  H  HG1  . THR B 2 24  ? 6.795   14.107 15.345 0.000 30.000 ? 24  THR HHH HG1  1 
ATOM   469  H  HG21 . THR B 2 24  ? 8.047   17.062 14.220 1.000 32.822 ? 24  THR HHH HG21 1 
ATOM   470  H  HG22 . THR B 2 24  ? 7.789   16.272 15.575 1.000 32.881 ? 24  THR HHH HG22 1 
ATOM   471  H  HG23 . THR B 2 24  ? 6.636   17.165 14.944 1.000 32.994 ? 24  THR HHH HG23 1 
ATOM   472  N  N    . SER B 2 25  ? 6.382   14.147 11.132 1.000 35.369 ? 25  SER HHH N    1 
ATOM   473  C  CA   . SER B 2 25  ? 6.230   12.995 10.207 1.000 36.654 ? 25  SER HHH CA   1 
ATOM   474  C  C    . SER B 2 25  ? 7.579   12.636 9.569  1.000 37.015 ? 25  SER HHH C    1 
ATOM   475  O  O    . SER B 2 25  ? 8.362   13.564 9.276  1.000 36.618 ? 25  SER HHH O    1 
ATOM   476  C  CB   . SER B 2 25  ? 5.199   13.296 9.155  1.000 37.578 ? 25  SER HHH CB   1 
ATOM   477  O  OG   . SER B 2 25  ? 5.689   14.257 8.229  1.000 37.508 ? 25  SER HHH OG   1 
ATOM   478  H  H    . SER B 2 25  ? 7.163   14.597 10.997 1.000 35.022 ? 25  SER HHH H    1 
ATOM   479  H  HA   . SER B 2 25  ? 5.918   12.213 10.738 1.000 36.888 ? 25  SER HHH HA   1 
ATOM   480  H  HB2  . SER B 2 25  ? 4.969   12.468 8.677  1.000 38.521 ? 25  SER HHH HB2  1 
ATOM   481  H  HB3  . SER B 2 25  ? 4.383   13.640 9.584  1.000 37.539 ? 25  SER HHH HB3  1 
ATOM   482  H  HG   . SER B 2 25  ? 5.164   14.470 7.633  0.000 30.000 ? 25  SER HHH HG   1 
ATOM   483  N  N    . GLY B 2 26  ? 7.827   11.339 9.360  1.000 38.124 ? 26  GLY HHH N    1 
ATOM   484  C  CA   . GLY B 2 26  ? 8.968   10.814 8.579  1.000 38.880 ? 26  GLY HHH CA   1 
ATOM   485  C  C    . GLY B 2 26  ? 10.171  10.468 9.444  1.000 38.260 ? 26  GLY HHH C    1 
ATOM   486  O  O    . GLY B 2 26  ? 11.284  10.400 8.899  1.000 38.712 ? 26  GLY HHH O    1 
ATOM   487  H  H    . GLY B 2 26  ? 7.286   10.688 9.696  1.000 38.386 ? 26  GLY HHH H    1 
ATOM   488  H  HA2  . GLY B 2 26  ? 8.675   10.004 8.091  1.000 39.787 ? 26  GLY HHH HA2  1 
ATOM   489  H  HA3  . GLY B 2 26  ? 9.234   11.490 7.910  1.000 38.977 ? 26  GLY HHH HA3  1 
ATOM   490  N  N    . TYR B 2 27  ? 9.954   10.244 10.743 1.000 37.470 ? 27  TYR HHH N    1 
ATOM   491  C  CA   . TYR B 2 27  ? 11.005  10.002 11.765 1.000 37.068 ? 27  TYR HHH CA   1 
ATOM   492  C  C    . TYR B 2 27  ? 10.307  9.692  13.098 1.000 37.230 ? 27  TYR HHH C    1 
ATOM   493  O  O    . TYR B 2 27  ? 9.215   10.237 13.351 1.000 36.466 ? 27  TYR HHH O    1 
ATOM   494  C  CB   . TYR B 2 27  ? 11.959  11.204 11.861 1.000 36.064 ? 27  TYR HHH CB   1 
ATOM   495  C  CG   . TYR B 2 27  ? 11.514  12.303 12.795 1.000 34.851 ? 27  TYR HHH CG   1 
ATOM   496  C  CD1  . TYR B 2 27  ? 11.846  12.258 14.136 1.000 34.480 ? 27  TYR HHH CD1  1 
ATOM   497  C  CD2  . TYR B 2 27  ? 10.745  13.374 12.361 1.000 34.353 ? 27  TYR HHH CD2  1 
ATOM   498  C  CE1  . TYR B 2 27  ? 11.424  13.235 15.024 1.000 34.076 ? 27  TYR HHH CE1  1 
ATOM   499  C  CE2  . TYR B 2 27  ? 10.321  14.366 13.235 1.000 33.568 ? 27  TYR HHH CE2  1 
ATOM   500  C  CZ   . TYR B 2 27  ? 10.660  14.300 14.577 1.000 33.389 ? 27  TYR HHH CZ   1 
ATOM   501  O  OH   . TYR B 2 27  ? 10.271  15.255 15.479 1.000 32.447 ? 27  TYR HHH OH   1 
ATOM   502  H  H    . TYR B 2 27  ? 9.118   10.215 11.102 1.000 37.440 ? 27  TYR HHH H    1 
ATOM   503  H  HA   . TYR B 2 27  ? 11.528  9.205  11.494 1.000 37.711 ? 27  TYR HHH HA   1 
ATOM   504  H  HB2  . TYR B 2 27  ? 12.834  10.877 12.158 1.000 36.216 ? 27  TYR HHH HB2  1 
ATOM   505  H  HB3  . TYR B 2 27  ? 12.074  11.583 10.966 1.000 36.391 ? 27  TYR HHH HB3  1 
ATOM   506  H  HD1  . TYR B 2 27  ? 12.359  11.536 14.457 1.000 34.838 ? 27  TYR HHH HD1  1 
ATOM   507  H  HD2  . TYR B 2 27  ? 10.500  13.428 11.451 1.000 34.845 ? 27  TYR HHH HD2  1 
ATOM   508  H  HE1  . TYR B 2 27  ? 11.667  13.183 15.933 1.000 33.755 ? 27  TYR HHH HE1  1 
ATOM   509  H  HE2  . TYR B 2 27  ? 9.802   15.086 12.916 1.000 33.473 ? 27  TYR HHH HE2  1 
ATOM   510  H  HH   . TYR B 2 27  ? 10.969  15.568 15.996 0.000 30.000 ? 27  TYR HHH HH   1 
ATOM   511  N  N    . ASN B 2 28  ? 10.918  8.839  13.922 1.000 38.638 ? 28  ASN HHH N    1 
ATOM   512  C  CA   . ASN B 2 28  ? 10.473  8.544  15.309 1.000 39.462 ? 28  ASN HHH CA   1 
ATOM   513  C  C    . ASN B 2 28  ? 10.529  9.837  16.135 1.000 38.417 ? 28  ASN HHH C    1 
ATOM   514  O  O    . ASN B 2 28  ? 11.636  10.328 16.418 1.000 37.863 ? 28  ASN HHH O    1 
ATOM   515  C  CB   . ASN B 2 28  ? 11.320  7.431  15.925 1.000 41.354 ? 28  ASN HHH CB   1 
ATOM   516  C  CG   . ASN B 2 28  ? 10.875  7.019  17.313 1.000 43.086 ? 28  ASN HHH CG   1 
ATOM   517  O  OD1  . ASN B 2 28  ? 10.350  7.831  18.077 1.000 42.666 ? 28  ASN HHH OD1  1 
ATOM   518  N  ND2  . ASN B 2 28  ? 11.091  5.754  17.642 1.000 45.847 ? 28  ASN HHH ND2  1 
ATOM   519  H  H    . ASN B 2 28  ? 11.664  8.377  13.674 1.000 38.941 ? 28  ASN HHH H    1 
ATOM   520  H  HA   . ASN B 2 28  ? 9.540   8.229  15.274 1.000 39.776 ? 28  ASN HHH HA   1 
ATOM   521  H  HB2  . ASN B 2 28  ? 11.285  6.649  15.337 1.000 42.026 ? 28  ASN HHH HB2  1 
ATOM   522  H  HB3  . ASN B 2 28  ? 12.250  7.732  15.968 1.000 41.259 ? 28  ASN HHH HB3  1 
ATOM   523  H  HD21 . ASN B 2 28  ? 11.420  5.242  17.121 0.000 30.000 ? 28  ASN HHH HD21 1 
ATOM   524  N  N    . PHE B 2 29  ? 9.364   10.351 16.524 1.000 38.038 ? 29  PHE HHH N    1 
ATOM   525  C  CA   . PHE B 2 29  ? 9.185   11.612 17.292 1.000 37.485 ? 29  PHE HHH CA   1 
ATOM   526  C  C    . PHE B 2 29  ? 10.182  11.691 18.462 1.000 36.983 ? 29  PHE HHH C    1 
ATOM   527  O  O    . PHE B 2 29  ? 10.677  12.802 18.736 1.000 36.756 ? 29  PHE HHH O    1 
ATOM   528  C  CB   . PHE B 2 29  ? 7.731   11.697 17.764 1.000 37.919 ? 29  PHE HHH CB   1 
ATOM   529  C  CG   . PHE B 2 29  ? 7.331   12.988 18.428 1.000 37.433 ? 29  PHE HHH CG   1 
ATOM   530  C  CD1  . PHE B 2 29  ? 7.370   14.184 17.731 1.000 37.327 ? 29  PHE HHH CD1  1 
ATOM   531  C  CD2  . PHE B 2 29  ? 6.884   13.002 19.739 1.000 37.503 ? 29  PHE HHH CD2  1 
ATOM   532  C  CE1  . PHE B 2 29  ? 6.991   15.371 18.339 1.000 37.276 ? 29  PHE HHH CE1  1 
ATOM   533  C  CE2  . PHE B 2 29  ? 6.502   14.188 20.344 1.000 37.636 ? 29  PHE HHH CE2  1 
ATOM   534  C  CZ   . PHE B 2 29  ? 6.553   15.369 19.644 1.000 37.498 ? 29  PHE HHH CZ   1 
ATOM   535  H  H    . PHE B 2 29  ? 8.569   9.949  16.339 1.000 38.498 ? 29  PHE HHH H    1 
ATOM   536  H  HA   . PHE B 2 29  ? 9.360   12.374 16.685 1.000 37.100 ? 29  PHE HHH HA   1 
ATOM   537  H  HB2  . PHE B 2 29  ? 7.149   11.555 16.988 1.000 38.183 ? 29  PHE HHH HB2  1 
ATOM   538  H  HB3  . PHE B 2 29  ? 7.571   10.960 18.390 1.000 38.279 ? 29  PHE HHH HB3  1 
ATOM   539  H  HD1  . PHE B 2 29  ? 7.671   14.190 16.838 1.000 37.254 ? 29  PHE HHH HD1  1 
ATOM   540  H  HD2  . PHE B 2 29  ? 6.843   12.194 20.225 1.000 38.131 ? 29  PHE HHH HD2  1 
ATOM   541  H  HE1  . PHE B 2 29  ? 7.029   16.180 17.855 1.000 36.811 ? 29  PHE HHH HE1  1 
ATOM   542  H  HE2  . PHE B 2 29  ? 6.205   14.183 21.239 1.000 37.962 ? 29  PHE HHH HE2  1 
ATOM   543  H  HZ   . PHE B 2 29  ? 6.296   16.177 20.059 1.000 37.210 ? 29  PHE HHH HZ   1 
ATOM   544  N  N    . SER B 2 30  ? 10.472  10.558 19.116 1.000 36.971 ? 30  SER HHH N    1 
ATOM   545  C  CA   . SER B 2 30  ? 11.267  10.460 20.371 1.000 36.713 ? 30  SER HHH CA   1 
ATOM   546  C  C    . SER B 2 30  ? 12.779  10.490 20.108 1.000 36.383 ? 30  SER HHH C    1 
ATOM   547  O  O    . SER B 2 30  ? 13.542  10.479 21.093 1.000 36.431 ? 30  SER HHH O    1 
ATOM   548  C  CB   . SER B 2 30  ? 10.895  9.224  21.134 1.000 37.567 ? 30  SER HHH CB   1 
ATOM   549  O  OG   . SER B 2 30  ? 9.530   9.263  21.508 1.000 38.354 ? 30  SER HHH OG   1 
ATOM   550  H  H    . SER B 2 30  ? 10.180  9.742  18.837 1.000 37.421 ? 30  SER HHH H    1 
ATOM   551  H  HA   . SER B 2 30  ? 11.039  11.247 20.933 1.000 36.483 ? 30  SER HHH HA   1 
ATOM   552  H  HB2  . SER B 2 30  ? 11.062  8.431  20.576 1.000 38.006 ? 30  SER HHH HB2  1 
ATOM   553  H  HB3  . SER B 2 30  ? 11.455  9.155  21.940 1.000 37.934 ? 30  SER HHH HB3  1 
ATOM   554  H  HG   . SER B 2 30  ? 9.536   8.499  21.891 0.000 30.000 ? 30  SER HHH HG   1 
ATOM   555  N  N    . HIS B 2 31  ? 13.210  10.518 18.847 1.000 35.942 ? 31  HIS HHH N    1 
ATOM   556  C  CA   . HIS B 2 31  ? 14.649  10.464 18.471 1.000 36.240 ? 31  HIS HHH CA   1 
ATOM   557  C  C    . HIS B 2 31  ? 15.270  11.870 18.542 1.000 35.707 ? 31  HIS HHH C    1 
ATOM   558  O  O    . HIS B 2 31  ? 16.491  11.966 18.768 1.000 36.006 ? 31  HIS HHH O    1 
ATOM   559  C  CB   . HIS B 2 31  ? 14.821  9.769  17.111 1.000 36.608 ? 31  HIS HHH CB   1 
ATOM   560  C  CG   . HIS B 2 31  ? 14.848  8.277  17.203 1.000 37.381 ? 31  HIS HHH CG   1 
ATOM   561  N  ND1  . HIS B 2 31  ? 15.571  7.493  16.323 1.000 38.025 ? 31  HIS HHH ND1  1 
ATOM   562  C  CD2  . HIS B 2 31  ? 14.271  7.428  18.081 1.000 37.572 ? 31  HIS HHH CD2  1 
ATOM   563  C  CE1  . HIS B 2 31  ? 15.420  6.225  16.646 1.000 38.878 ? 31  HIS HHH CE1  1 
ATOM   564  N  NE2  . HIS B 2 31  ? 14.635  6.159  17.728 1.000 38.541 ? 31  HIS HHH NE2  1 
ATOM   565  H  H    . HIS B 2 31  ? 12.660  10.571 18.125 1.000 35.900 ? 31  HIS HHH H    1 
ATOM   566  H  HA   . HIS B 2 31  ? 15.106  9.910  19.145 1.000 36.685 ? 31  HIS HHH HA   1 
ATOM   567  H  HB2  . HIS B 2 31  ? 14.086  10.038 16.517 1.000 36.364 ? 31  HIS HHH HB2  1 
ATOM   568  H  HB3  . HIS B 2 31  ? 15.661  10.075 16.703 1.000 36.806 ? 31  HIS HHH HB3  1 
ATOM   569  H  HD1  . HIS B 2 31  ? 15.955  7.670  15.624 0.000 30.000 ? 31  HIS HHH HD1  1 
ATOM   570  H  HD2  . HIS B 2 31  ? 13.721  7.663  18.805 1.000 37.353 ? 31  HIS HHH HD2  1 
ATOM   571  H  HE1  . HIS B 2 31  ? 15.809  5.492  16.199 1.000 39.486 ? 31  HIS HHH HE1  1 
ATOM   572  H  HE2  . HIS B 2 31  ? 14.372  5.404  18.252 0.000 30.000 ? 31  HIS HHH HE2  1 
ATOM   573  N  N    . PHE B 2 32  ? 14.468  12.925 18.393 1.000 34.580 ? 32  PHE HHH N    1 
ATOM   574  C  CA   . PHE B 2 32  ? 14.966  14.320 18.316 1.000 33.967 ? 32  PHE HHH CA   1 
ATOM   575  C  C    . PHE B 2 32  ? 14.084  15.250 19.154 1.000 33.213 ? 32  PHE HHH C    1 
ATOM   576  O  O    . PHE B 2 32  ? 12.833  15.184 19.062 1.000 32.877 ? 32  PHE HHH O    1 
ATOM   577  C  CB   . PHE B 2 32  ? 15.028  14.787 16.860 1.000 33.831 ? 32  PHE HHH CB   1 
ATOM   578  C  CG   . PHE B 2 32  ? 15.952  13.985 15.980 1.000 34.446 ? 32  PHE HHH CG   1 
ATOM   579  C  CD1  . PHE B 2 32  ? 17.310  14.254 15.947 1.000 34.983 ? 32  PHE HHH CD1  1 
ATOM   580  C  CD2  . PHE B 2 32  ? 15.461  12.968 15.176 1.000 34.653 ? 32  PHE HHH CD2  1 
ATOM   581  C  CE1  . PHE B 2 32  ? 18.157  13.518 15.131 1.000 35.832 ? 32  PHE HHH CE1  1 
ATOM   582  C  CE2  . PHE B 2 32  ? 16.310  12.233 14.365 1.000 35.439 ? 32  PHE HHH CE2  1 
ATOM   583  C  CZ   . PHE B 2 32  ? 17.655  12.509 14.343 1.000 35.973 ? 32  PHE HHH CZ   1 
ATOM   584  H  H    . PHE B 2 32  ? 13.562  12.870 18.319 1.000 34.423 ? 32  PHE HHH H    1 
ATOM   585  H  HA   . PHE B 2 32  ? 15.883  14.346 18.689 1.000 34.329 ? 32  PHE HHH HA   1 
ATOM   586  H  HB2  . PHE B 2 32  ? 14.123  14.749 16.485 1.000 33.576 ? 32  PHE HHH HB2  1 
ATOM   587  H  HB3  . PHE B 2 32  ? 15.315  15.724 16.848 1.000 33.539 ? 32  PHE HHH HB3  1 
ATOM   588  H  HD1  . PHE B 2 32  ? 17.662  14.945 16.485 1.000 34.809 ? 32  PHE HHH HD1  1 
ATOM   589  H  HD2  . PHE B 2 32  ? 14.537  12.773 15.186 1.000 34.467 ? 32  PHE HHH HD2  1 
ATOM   590  H  HE1  . PHE B 2 32  ? 19.081  13.708 15.120 1.000 36.320 ? 32  PHE HHH HE1  1 
ATOM   591  H  HE2  . PHE B 2 32  ? 15.962  11.542 13.824 1.000 35.843 ? 32  PHE HHH HE2  1 
ATOM   592  H  HZ   . PHE B 2 32  ? 18.233  12.008 13.790 1.000 36.777 ? 32  PHE HHH HZ   1 
ATOM   593  N  N    . ALA B 2 33  ? 14.749  16.113 19.925 1.000 32.817 ? 33  ALA HHH N    1 
ATOM   594  C  CA   . ALA B 2 33  ? 14.150  17.213 20.706 1.000 32.363 ? 33  ALA HHH CA   1 
ATOM   595  C  C    . ALA B 2 33  ? 13.393  18.138 19.754 1.000 31.750 ? 33  ALA HHH C    1 
ATOM   596  O  O    . ALA B 2 33  ? 13.798  18.246 18.588 1.000 32.210 ? 33  ALA HHH O    1 
ATOM   597  C  CB   . ALA B 2 33  ? 15.224  17.964 21.449 1.000 32.667 ? 33  ALA HHH CB   1 
ATOM   598  H  H    . ALA B 2 33  ? 15.654  16.078 20.028 1.000 33.264 ? 33  ALA HHH H    1 
ATOM   599  H  HA   . ALA B 2 33  ? 13.513  16.831 21.354 1.000 32.527 ? 33  ALA HHH HA   1 
ATOM   600  H  HB1  . ALA B 2 33  ? 14.847  18.774 21.831 1.000 32.449 ? 33  ALA HHH HB1  1 
ATOM   601  H  HB2  . ALA B 2 33  ? 15.581  17.407 22.160 1.000 33.242 ? 33  ALA HHH HB2  1 
ATOM   602  H  HB3  . ALA B 2 33  ? 15.938  18.202 20.834 1.000 32.717 ? 33  ALA HHH HB3  1 
ATOM   603  N  N    . ILE B 2 34  ? 12.318  18.749 20.246 1.000 31.522 ? 34  ILE HHH N    1 
ATOM   604  C  CA   . ILE B 2 34  ? 11.546  19.821 19.558 1.000 30.678 ? 34  ILE HHH CA   1 
ATOM   605  C  C    . ILE B 2 34  ? 11.898  21.137 20.260 1.000 30.361 ? 34  ILE HHH C    1 
ATOM   606  O  O    . ILE B 2 34  ? 11.771  21.203 21.498 1.000 30.488 ? 34  ILE HHH O    1 
ATOM   607  C  CB   . ILE B 2 34  ? 10.030  19.522 19.597 1.000 30.735 ? 34  ILE HHH CB   1 
ATOM   608  C  CG1  . ILE B 2 34  ? 9.667   18.238 18.845 1.000 30.781 ? 34  ILE HHH CG1  1 
ATOM   609  C  CG2  . ILE B 2 34  ? 9.227   20.711 19.092 1.000 30.622 ? 34  ILE HHH CG2  1 
ATOM   610  C  CD1  . ILE B 2 34  ? 9.911   18.300 17.357 1.000 30.747 ? 34  ILE HHH CD1  1 
ATOM   611  H  H    . ILE B 2 34  ? 11.977  18.541 21.065 1.000 31.667 ? 34  ILE HHH H    1 
ATOM   612  H  HA   . ILE B 2 34  ? 11.833  19.871 18.630 1.000 30.590 ? 34  ILE HHH HA   1 
ATOM   613  H  HB   . ILE B 2 34  ? 9.786   19.383 20.545 1.000 30.990 ? 34  ILE HHH HB   1 
ATOM   614  H  HG12 . ILE B 2 34  ? 10.189  17.497 19.217 1.000 31.123 ? 34  ILE HHH HG12 1 
ATOM   615  H  HG13 . ILE B 2 34  ? 8.718   18.043 18.999 1.000 31.061 ? 34  ILE HHH HG13 1 
ATOM   616  H  HG21 . ILE B 2 34  ? 9.095   21.348 19.816 1.000 30.531 ? 34  ILE HHH HG21 1 
ATOM   617  H  HG22 . ILE B 2 34  ? 8.360   20.407 18.770 1.000 30.721 ? 34  ILE HHH HG22 1 
ATOM   618  H  HG23 . ILE B 2 34  ? 9.706   21.145 18.364 1.000 30.312 ? 34  ILE HHH HG23 1 
ATOM   619  H  HD11 . ILE B 2 34  ? 9.405   19.037 16.972 1.000 30.543 ? 34  ILE HHH HD11 1 
ATOM   620  H  HD12 . ILE B 2 34  ? 9.626   17.466 16.946 1.000 31.058 ? 34  ILE HHH HD12 1 
ATOM   621  H  HD13 . ILE B 2 34  ? 10.859  18.435 17.186 1.000 30.668 ? 34  ILE HHH HD13 1 
ATOM   622  N  N    . ASN B 2 35  ? 12.352  22.125 19.492 1.000 29.819 ? 35  ASN HHH N    1 
ATOM   623  C  CA   . ASN B 2 35  ? 12.703  23.481 19.978 1.000 29.780 ? 35  ASN HHH CA   1 
ATOM   624  C  C    . ASN B 2 35  ? 11.620  24.457 19.540 1.000 29.702 ? 35  ASN HHH C    1 
ATOM   625  O  O    . ASN B 2 35  ? 11.052  24.269 18.467 1.000 30.075 ? 35  ASN HHH O    1 
ATOM   626  C  CB   . ASN B 2 35  ? 14.047  23.967 19.435 1.000 29.616 ? 35  ASN HHH CB   1 
ATOM   627  C  CG   . ASN B 2 35  ? 15.204  23.193 20.015 1.000 29.707 ? 35  ASN HHH CG   1 
ATOM   628  O  OD1  . ASN B 2 35  ? 16.010  23.742 20.757 1.000 29.584 ? 35  ASN HHH OD1  1 
ATOM   629  N  ND2  . ASN B 2 35  ? 15.265  21.909 19.710 1.000 30.057 ? 35  ASN HHH ND2  1 
ATOM   630  H  H    . ASN B 2 35  ? 12.477  22.023 18.595 1.000 29.791 ? 35  ASN HHH H    1 
ATOM   631  H  HA   . ASN B 2 35  ? 12.751  23.468 20.963 1.000 30.077 ? 35  ASN HHH HA   1 
ATOM   632  H  HB2  . ASN B 2 35  ? 14.052  23.871 18.462 1.000 29.423 ? 35  ASN HHH HB2  1 
ATOM   633  H  HB3  . ASN B 2 35  ? 14.154  24.916 19.650 1.000 29.479 ? 35  ASN HHH HB3  1 
ATOM   634  H  HD21 . ASN B 2 35  ? 15.894  21.434 19.944 0.000 30.000 ? 35  ASN HHH HD21 1 
ATOM   635  H  HD22 . ASN B 2 35  ? 14.609  21.594 19.127 0.000 30.000 ? 35  ASN HHH HD22 1 
ATOM   636  N  N    . TRP B 2 36  ? 11.374  25.472 20.354 1.000 30.586 ? 36  TRP HHH N    1 
ATOM   637  C  CA   . TRP B 2 36  ? 10.449  26.583 20.040 1.000 30.936 ? 36  TRP HHH CA   1 
ATOM   638  C  C    . TRP B 2 36  ? 11.261  27.873 19.921 1.000 32.373 ? 36  TRP HHH C    1 
ATOM   639  O  O    . TRP B 2 36  ? 12.076  28.153 20.826 1.000 33.378 ? 36  TRP HHH O    1 
ATOM   640  C  CB   . TRP B 2 36  ? 9.361   26.674 21.109 1.000 30.883 ? 36  TRP HHH CB   1 
ATOM   641  C  CG   . TRP B 2 36  ? 8.374   25.558 21.030 1.000 30.312 ? 36  TRP HHH CG   1 
ATOM   642  C  CD1  . TRP B 2 36  ? 8.356   24.418 21.774 1.000 30.670 ? 36  TRP HHH CD1  1 
ATOM   643  C  CD2  . TRP B 2 36  ? 7.258   25.476 20.132 1.000 30.070 ? 36  TRP HHH CD2  1 
ATOM   644  N  NE1  . TRP B 2 36  ? 7.300   23.633 21.401 1.000 31.012 ? 36  TRP HHH NE1  1 
ATOM   645  C  CE2  . TRP B 2 36  ? 6.606   24.257 20.399 1.000 30.567 ? 36  TRP HHH CE2  1 
ATOM   646  C  CE3  . TRP B 2 36  ? 6.742   26.317 19.139 1.000 29.900 ? 36  TRP HHH CE3  1 
ATOM   647  C  CZ2  . TRP B 2 36  ? 5.464   23.857 19.709 1.000 30.848 ? 36  TRP HHH CZ2  1 
ATOM   648  C  CZ3  . TRP B 2 36  ? 5.617   25.920 18.454 1.000 30.514 ? 36  TRP HHH CZ3  1 
ATOM   649  C  CH2  . TRP B 2 36  ? 4.987   24.707 18.739 1.000 30.936 ? 36  TRP HHH CH2  1 
ATOM   650  H  H    . TRP B 2 36  ? 11.766  25.554 21.172 1.000 30.821 ? 36  TRP HHH H    1 
ATOM   651  H  HA   . TRP B 2 36  ? 10.017  26.392 19.178 1.000 30.860 ? 36  TRP HHH HA   1 
ATOM   652  H  HB2  . TRP B 2 36  ? 9.786   26.673 21.991 1.000 31.123 ? 36  TRP HHH HB2  1 
ATOM   653  H  HB3  . TRP B 2 36  ? 8.894   27.515 20.999 1.000 30.742 ? 36  TRP HHH HB3  1 
ATOM   654  H  HD1  . TRP B 2 36  ? 8.980   24.195 22.447 1.000 30.961 ? 36  TRP HHH HD1  1 
ATOM   655  H  HE1  . TRP B 2 36  ? 7.097   22.859 21.751 1.000 31.305 ? 36  TRP HHH HE1  1 
ATOM   656  H  HE3  . TRP B 2 36  ? 7.161   27.140 18.943 1.000 29.706 ? 36  TRP HHH HE3  1 
ATOM   657  H  HZ2  . TRP B 2 36  ? 5.041   23.037 19.898 1.000 31.332 ? 36  TRP HHH HZ2  1 
ATOM   658  H  HZ3  . TRP B 2 36  ? 5.261   26.479 17.781 1.000 30.402 ? 36  TRP HHH HZ3  1 
ATOM   659  H  HH2  . TRP B 2 36  ? 4.220   24.462 18.252 1.000 31.267 ? 36  TRP HHH HH2  1 
ATOM   660  N  N    . VAL B 2 37  ? 11.046  28.607 18.832 1.000 33.215 ? 37  VAL HHH N    1 
ATOM   661  C  CA   . VAL B 2 37  ? 11.792  29.841 18.466 1.000 33.925 ? 37  VAL HHH CA   1 
ATOM   662  C  C    . VAL B 2 37  ? 10.767  30.869 17.983 1.000 34.816 ? 37  VAL HHH C    1 
ATOM   663  O  O    . VAL B 2 37  ? 9.927   30.498 17.148 1.000 34.784 ? 37  VAL HHH O    1 
ATOM   664  C  CB   . VAL B 2 37  ? 12.826  29.506 17.379 1.000 34.391 ? 37  VAL HHH CB   1 
ATOM   665  C  CG1  . VAL B 2 37  ? 13.353  30.751 16.682 1.000 34.883 ? 37  VAL HHH CG1  1 
ATOM   666  C  CG2  . VAL B 2 37  ? 13.962  28.666 17.937 1.000 35.035 ? 37  VAL HHH CG2  1 
ATOM   667  H  H    . VAL B 2 37  ? 10.405  28.388 18.222 1.000 32.997 ? 37  VAL HHH H    1 
ATOM   668  H  HA   . VAL B 2 37  ? 12.248  30.184 19.253 1.000 34.283 ? 37  VAL HHH HA   1 
ATOM   669  H  HB   . VAL B 2 37  ? 12.363  28.960 16.697 1.000 34.362 ? 37  VAL HHH HB   1 
ATOM   670  H  HG11 . VAL B 2 37  ? 12.715  31.041 16.007 1.000 34.561 ? 37  VAL HHH HG11 1 
ATOM   671  H  HG12 . VAL B 2 37  ? 14.204  30.549 16.255 1.000 34.994 ? 37  VAL HHH HG12 1 
ATOM   672  H  HG13 . VAL B 2 37  ? 13.480  31.461 17.334 1.000 34.798 ? 37  VAL HHH HG13 1 
ATOM   673  H  HG21 . VAL B 2 37  ? 14.401  29.152 18.656 1.000 35.189 ? 37  VAL HHH HG21 1 
ATOM   674  H  HG22 . VAL B 2 37  ? 14.606  28.480 17.232 1.000 35.132 ? 37  VAL HHH HG22 1 
ATOM   675  H  HG23 . VAL B 2 37  ? 13.608  27.828 18.281 1.000 34.983 ? 37  VAL HHH HG23 1 
ATOM   676  N  N    . ARG B 2 38  ? 10.810  32.103 18.487 1.000 36.001 ? 38  ARG HHH N    1 
ATOM   677  C  CA   . ARG B 2 38  ? 9.853   33.152 18.053 1.000 36.341 ? 38  ARG HHH CA   1 
ATOM   678  C  C    . ARG B 2 38  ? 10.603  34.264 17.319 1.000 35.792 ? 38  ARG HHH C    1 
ATOM   679  O  O    . ARG B 2 38  ? 11.832  34.401 17.503 1.000 34.920 ? 38  ARG HHH O    1 
ATOM   680  C  CB   . ARG B 2 38  ? 9.027   33.666 19.233 1.000 37.879 ? 38  ARG HHH CB   1 
ATOM   681  C  CG   . ARG B 2 38  ? 9.647   34.827 19.991 1.000 39.806 ? 38  ARG HHH CG   1 
ATOM   682  C  CD   . ARG B 2 38  ? 8.595   35.545 20.809 1.000 41.996 ? 38  ARG HHH CD   1 
ATOM   683  N  NE   . ARG B 2 38  ? 9.125   36.746 21.443 1.000 44.040 ? 38  ARG HHH NE   1 
ATOM   684  C  CZ   . ARG B 2 38  ? 8.516   37.421 22.413 1.000 45.689 ? 38  ARG HHH CZ   1 
ATOM   685  N  NH1  . ARG B 2 38  ? 7.341   37.020 22.880 1.000 46.730 ? 38  ARG HHH NH1  1 
ATOM   686  N  NH2  . ARG B 2 38  ? 9.097   38.492 22.922 1.000 46.283 ? 38  ARG HHH NH2  1 
ATOM   687  H  H    . ARG B 2 38  ? 11.416  32.372 19.112 1.000 36.028 ? 38  ARG HHH H    1 
ATOM   688  H  HA   . ARG B 2 38  ? 9.231   32.740 17.412 1.000 36.317 ? 38  ARG HHH HA   1 
ATOM   689  H  HB2  . ARG B 2 38  ? 8.149   33.943 18.897 1.000 38.002 ? 38  ARG HHH HB2  1 
ATOM   690  H  HB3  . ARG B 2 38  ? 8.886   32.925 19.857 1.000 38.145 ? 38  ARG HHH HB3  1 
ATOM   691  H  HG2  . ARG B 2 38  ? 10.350  34.494 20.587 1.000 40.016 ? 38  ARG HHH HG2  1 
ATOM   692  H  HG3  . ARG B 2 38  ? 10.051  35.460 19.361 1.000 39.650 ? 38  ARG HHH HG3  1 
ATOM   693  H  HD2  . ARG B 2 38  ? 7.844   35.792 20.228 1.000 41.849 ? 38  ARG HHH HD2  1 
ATOM   694  H  HD3  . ARG B 2 38  ? 8.256   34.936 21.499 1.000 42.264 ? 38  ARG HHH HD3  1 
ATOM   695  H  HE   . ARG B 2 38  ? 9.900   37.041 21.170 1.000 43.854 ? 38  ARG HHH HE   1 
ATOM   696  H  HH11 . ARG B 2 38  ? 6.950   36.309 22.547 1.000 46.236 ? 38  ARG HHH HH11 1 
ATOM   697  H  HH12 . ARG B 2 38  ? 6.949   37.476 23.521 1.000 46.961 ? 38  ARG HHH HH12 1 
ATOM   698  H  HH21 . ARG B 2 38  ? 9.878   38.758 22.614 1.000 46.033 ? 38  ARG HHH HH21 1 
ATOM   699  H  HH22 . ARG B 2 38  ? 8.698   38.944 23.565 1.000 46.679 ? 38  ARG HHH HH22 1 
ATOM   700  N  N    . GLN B 2 39  ? 9.857   35.000 16.495 1.000 35.861 ? 39  GLN HHH N    1 
ATOM   701  C  CA   . GLN B 2 39  ? 10.325  36.171 15.717 1.000 35.695 ? 39  GLN HHH CA   1 
ATOM   702  C  C    . GLN B 2 39  ? 9.284   37.287 15.829 1.000 35.989 ? 39  GLN HHH C    1 
ATOM   703  O  O    . GLN B 2 39  ? 8.243   37.204 15.137 1.000 34.901 ? 39  GLN HHH O    1 
ATOM   704  C  CB   . GLN B 2 39  ? 10.553  35.778 14.258 1.000 35.599 ? 39  GLN HHH CB   1 
ATOM   705  C  CG   . GLN B 2 39  ? 11.178  36.893 13.434 1.000 35.749 ? 39  GLN HHH CG   1 
ATOM   706  C  CD   . GLN B 2 39  ? 11.916  36.349 12.239 1.000 36.169 ? 39  GLN HHH CD   1 
ATOM   707  O  OE1  . GLN B 2 39  ? 11.357  35.608 11.436 1.000 36.529 ? 39  GLN HHH OE1  1 
ATOM   708  N  NE2  . GLN B 2 39  ? 13.186  36.705 12.123 1.000 36.856 ? 39  GLN HHH NE2  1 
ATOM   709  H  H    . GLN B 2 39  ? 8.975   34.813 16.354 1.000 35.811 ? 39  GLN HHH H    1 
ATOM   710  H  HA   . GLN B 2 39  ? 11.175  36.487 16.102 1.000 35.824 ? 39  GLN HHH HA   1 
ATOM   711  H  HB2  . GLN B 2 39  ? 11.138  34.992 14.235 1.000 35.651 ? 39  GLN HHH HB2  1 
ATOM   712  H  HB3  . GLN B 2 39  ? 9.694   35.526 13.862 1.000 35.657 ? 39  GLN HHH HB3  1 
ATOM   713  H  HG2  . GLN B 2 39  ? 10.475  37.505 13.129 1.000 35.828 ? 39  GLN HHH HG2  1 
ATOM   714  H  HG3  . GLN B 2 39  ? 11.801  37.402 13.995 1.000 35.831 ? 39  GLN HHH HG3  1 
ATOM   715  H  HE21 . GLN B 2 39  ? 13.717  36.381 11.523 0.000 30.000 ? 39  GLN HHH HE21 1 
ATOM   716  H  HE22 . GLN B 2 39  ? 13.580  37.227 12.792 0.000 30.000 ? 39  GLN HHH HE22 1 
ATOM   717  N  N    . ALA B 2 40  ? 9.553   38.286 16.674 1.000 36.795 ? 40  ALA HHH N    1 
ATOM   718  C  CA   . ALA B 2 40  ? 8.741   39.520 16.778 1.000 37.746 ? 40  ALA HHH CA   1 
ATOM   719  C  C    . ALA B 2 40  ? 8.939   40.334 15.499 1.000 38.246 ? 40  ALA HHH C    1 
ATOM   720  O  O    . ALA B 2 40  ? 9.944   40.172 14.817 1.000 37.383 ? 40  ALA HHH O    1 
ATOM   721  C  CB   . ALA B 2 40  ? 9.105   40.288 18.024 1.000 38.053 ? 40  ALA HHH CB   1 
ATOM   722  H  H    . ALA B 2 40  ? 10.258  38.278 17.250 1.000 36.897 ? 40  ALA HHH H    1 
ATOM   723  H  HA   . ALA B 2 40  ? 7.794   39.258 16.836 1.000 37.778 ? 40  ALA HHH HA   1 
ATOM   724  H  HB1  . ALA B 2 40  ? 8.916   41.233 17.892 1.000 38.205 ? 40  ALA HHH HB1  1 
ATOM   725  H  HB2  . ALA B 2 40  ? 8.581   39.958 18.774 1.000 38.230 ? 40  ALA HHH HB2  1 
ATOM   726  H  HB3  . ALA B 2 40  ? 10.050  40.173 18.217 1.000 38.088 ? 40  ALA HHH HB3  1 
ATOM   727  N  N    . PRO B 2 41  ? 7.984   41.209 15.106 1.000 40.010 ? 41  PRO HHH N    1 
ATOM   728  C  CA   . PRO B 2 41  ? 8.045   41.876 13.803 1.000 40.422 ? 41  PRO HHH CA   1 
ATOM   729  C  C    . PRO B 2 41  ? 9.362   42.635 13.576 1.000 41.071 ? 41  PRO HHH C    1 
ATOM   730  O  O    . PRO B 2 41  ? 9.685   43.503 14.375 1.000 41.503 ? 41  PRO HHH O    1 
ATOM   731  C  CB   . PRO B 2 41  ? 6.857   42.846 13.837 1.000 40.661 ? 41  PRO HHH CB   1 
ATOM   732  C  CG   . PRO B 2 41  ? 5.908   42.224 14.833 1.000 41.074 ? 41  PRO HHH CG   1 
ATOM   733  C  CD   . PRO B 2 41  ? 6.800   41.602 15.886 1.000 40.365 ? 41  PRO HHH CD   1 
ATOM   734  H  HA   . PRO B 2 41  ? 7.906   41.208 13.085 1.000 40.485 ? 41  PRO HHH HA   1 
ATOM   735  H  HB2  . PRO B 2 41  ? 7.136   43.739 14.132 1.000 40.863 ? 41  PRO HHH HB2  1 
ATOM   736  H  HB3  . PRO B 2 41  ? 6.437   42.919 12.953 1.000 41.003 ? 41  PRO HHH HB3  1 
ATOM   737  H  HG2  . PRO B 2 41  ? 5.325   42.904 15.229 1.000 41.221 ? 41  PRO HHH HG2  1 
ATOM   738  H  HG3  . PRO B 2 41  ? 5.351   41.542 14.404 1.000 41.006 ? 41  PRO HHH HG3  1 
ATOM   739  H  HD2  . PRO B 2 41  ? 7.033   42.247 16.579 1.000 40.572 ? 41  PRO HHH HD2  1 
ATOM   740  H  HD3  . PRO B 2 41  ? 6.372   40.829 16.298 1.000 40.453 ? 41  PRO HHH HD3  1 
ATOM   741  N  N    . GLY B 2 42  ? 10.096  42.266 12.520 1.000 41.243 ? 42  GLY HHH N    1 
ATOM   742  C  CA   . GLY B 2 42  ? 11.369  42.898 12.127 1.000 41.732 ? 42  GLY HHH CA   1 
ATOM   743  C  C    . GLY B 2 42  ? 12.493  42.611 13.112 1.000 42.696 ? 42  GLY HHH C    1 
ATOM   744  O  O    . GLY B 2 42  ? 13.517  43.328 13.052 1.000 45.217 ? 42  GLY HHH O    1 
ATOM   745  H  H    . GLY B 2 42  ? 9.842   41.584 11.973 1.000 41.280 ? 42  GLY HHH H    1 
ATOM   746  H  HA2  . GLY B 2 42  ? 11.628  42.567 11.230 1.000 42.132 ? 42  GLY HHH HA2  1 
ATOM   747  H  HA3  . GLY B 2 42  ? 11.233  43.876 12.064 1.000 42.098 ? 42  GLY HHH HA3  1 
ATOM   748  N  N    . GLN B 2 43  ? 12.335  41.601 13.977 1.000 41.582 ? 43  GLN HHH N    1 
ATOM   749  C  CA   . GLN B 2 43  ? 13.361  41.168 14.967 1.000 40.869 ? 43  GLN HHH CA   1 
ATOM   750  C  C    . GLN B 2 43  ? 14.074  39.919 14.442 1.000 39.372 ? 43  GLN HHH C    1 
ATOM   751  O  O    . GLN B 2 43  ? 13.564  39.305 13.488 1.000 38.006 ? 43  GLN HHH O    1 
ATOM   752  C  CB   . GLN B 2 43  ? 12.733  40.834 16.325 1.000 41.698 ? 43  GLN HHH CB   1 
ATOM   753  C  CG   . GLN B 2 43  ? 11.978  41.987 16.971 1.000 42.218 ? 43  GLN HHH CG   1 
ATOM   754  C  CD   . GLN B 2 43  ? 12.885  43.158 17.241 1.000 43.386 ? 43  GLN HHH CD   1 
ATOM   755  O  OE1  . GLN B 2 43  ? 13.761  43.104 18.103 1.000 44.227 ? 43  GLN HHH OE1  1 
ATOM   756  N  NE2  . GLN B 2 43  ? 12.687  44.226 16.484 1.000 44.330 ? 43  GLN HHH NE2  1 
ATOM   757  H  H    . GLN B 2 43  ? 11.580  41.094 14.003 1.000 41.337 ? 43  GLN HHH H    1 
ATOM   758  H  HA   . GLN B 2 43  ? 14.020  41.890 15.081 1.000 41.288 ? 43  GLN HHH HA   1 
ATOM   759  H  HB2  . GLN B 2 43  ? 12.120  40.079 16.205 1.000 41.267 ? 43  GLN HHH HB2  1 
ATOM   760  H  HB3  . GLN B 2 43  ? 13.446  40.543 16.931 1.000 41.770 ? 43  GLN HHH HB3  1 
ATOM   761  H  HG2  . GLN B 2 43  ? 11.247  42.270 16.381 1.000 42.135 ? 43  GLN HHH HG2  1 
ATOM   762  H  HG3  . GLN B 2 43  ? 11.586  41.685 17.816 1.000 42.295 ? 43  GLN HHH HG3  1 
ATOM   763  H  HE21 . GLN B 2 43  ? 13.170  44.716 16.483 0.000 30.000 ? 43  GLN HHH HE21 1 
ATOM   764  H  HE22 . GLN B 2 43  ? 12.138  43.869 15.734 0.000 30.000 ? 43  GLN HHH HE22 1 
ATOM   765  N  N    . GLY B 2 44  ? 15.190  39.552 15.080 1.000 38.825 ? 44  GLY HHH N    1 
ATOM   766  C  CA   . GLY B 2 44  ? 15.887  38.269 14.871 1.000 38.579 ? 44  GLY HHH CA   1 
ATOM   767  C  C    . GLY B 2 44  ? 15.141  37.115 15.524 1.000 37.540 ? 44  GLY HHH C    1 
ATOM   768  O  O    . GLY B 2 44  ? 14.064  37.342 16.098 1.000 37.500 ? 44  GLY HHH O    1 
ATOM   769  H  H    . GLY B 2 44  ? 15.591  40.091 15.695 1.000 39.238 ? 44  GLY HHH H    1 
ATOM   770  H  HA2  . GLY B 2 44  ? 15.965  38.102 13.900 1.000 38.621 ? 44  GLY HHH HA2  1 
ATOM   771  H  HA3  . GLY B 2 44  ? 16.799  38.330 15.250 1.000 39.039 ? 44  GLY HHH HA3  1 
ATOM   772  N  N    . LEU B 2 45  ? 15.697  35.908 15.437 1.000 37.184 ? 45  LEU HHH N    1 
ATOM   773  C  CA   . LEU B 2 45  ? 15.122  34.672 16.027 1.000 36.177 ? 45  LEU HHH CA   1 
ATOM   774  C  C    . LEU B 2 45  ? 15.453  34.636 17.521 1.000 35.766 ? 45  LEU HHH C    1 
ATOM   775  O  O    . LEU B 2 45  ? 16.631  34.742 17.858 1.000 35.365 ? 45  LEU HHH O    1 
ATOM   776  C  CB   . LEU B 2 45  ? 15.709  33.451 15.313 1.000 36.459 ? 45  LEU HHH CB   1 
ATOM   777  C  CG   . LEU B 2 45  ? 15.496  33.409 13.803 1.000 36.768 ? 45  LEU HHH CG   1 
ATOM   778  C  CD1  . LEU B 2 45  ? 16.218  32.215 13.194 1.000 37.511 ? 45  LEU HHH CD1  1 
ATOM   779  C  CD2  . LEU B 2 45  ? 14.014  33.382 13.462 1.000 35.911 ? 45  LEU HHH CD2  1 
ATOM   780  H  H    . LEU B 2 45  ? 16.491  35.771 15.011 1.000 37.538 ? 45  LEU HHH H    1 
ATOM   781  H  HA   . LEU B 2 45  ? 14.144  34.690 15.912 1.000 35.808 ? 45  LEU HHH HA   1 
ATOM   782  H  HB2  . LEU B 2 45  ? 16.670  33.423 15.492 1.000 36.993 ? 45  LEU HHH HB2  1 
ATOM   783  H  HB3  . LEU B 2 45  ? 15.313  32.647 15.704 1.000 36.320 ? 45  LEU HHH HB3  1 
ATOM   784  H  HG   . LEU B 2 45  ? 15.885  34.230 13.414 1.000 36.960 ? 45  LEU HHH HG   1 
ATOM   785  H  HD11 . LEU B 2 45  ? 17.171  32.281 13.382 1.000 37.905 ? 45  LEU HHH HD11 1 
ATOM   786  H  HD12 . LEU B 2 45  ? 16.078  32.206 12.232 1.000 37.604 ? 45  LEU HHH HD12 1 
ATOM   787  H  HD13 . LEU B 2 45  ? 15.869  31.393 13.580 1.000 37.198 ? 45  LEU HHH HD13 1 
ATOM   788  H  HD21 . LEU B 2 45  ? 13.562  32.732 14.027 1.000 35.801 ? 45  LEU HHH HD21 1 
ATOM   789  H  HD22 . LEU B 2 45  ? 13.899  33.134 12.528 1.000 36.204 ? 45  LEU HHH HD22 1 
ATOM   790  H  HD23 . LEU B 2 45  ? 13.630  34.264 13.611 1.000 35.875 ? 45  LEU HHH HD23 1 
ATOM   791  N  N    . GLN B 2 46  ? 14.436  34.491 18.370 1.000 35.804 ? 46  GLN HHH N    1 
ATOM   792  C  CA   . GLN B 2 46  ? 14.575  34.380 19.845 1.000 36.086 ? 46  GLN HHH CA   1 
ATOM   793  C  C    . GLN B 2 46  ? 14.258  32.932 20.228 1.000 35.643 ? 46  GLN HHH C    1 
ATOM   794  O  O    . GLN B 2 46  ? 13.205  32.429 19.773 1.000 35.357 ? 46  GLN HHH O    1 
ATOM   795  C  CB   . GLN B 2 46  ? 13.635  35.375 20.529 1.000 36.250 ? 46  GLN HHH CB   1 
ATOM   796  C  CG   . GLN B 2 46  ? 14.074  35.802 21.923 1.000 37.226 ? 46  GLN HHH CG   1 
ATOM   797  C  CD   . GLN B 2 46  ? 13.095  36.774 22.542 1.000 37.471 ? 46  GLN HHH CD   1 
ATOM   798  O  OE1  . GLN B 2 46  ? 12.174  37.271 21.892 1.000 36.787 ? 46  GLN HHH OE1  1 
ATOM   799  N  NE2  . GLN B 2 46  ? 13.275  37.038 23.825 1.000 38.241 ? 46  GLN HHH NE2  1 
ATOM   800  H  H    . GLN B 2 46  ? 13.571  34.449 18.087 1.000 35.346 ? 46  GLN HHH H    1 
ATOM   801  H  HA   . GLN B 2 46  ? 15.504  34.586 20.095 1.000 36.534 ? 46  GLN HHH HA   1 
ATOM   802  H  HB2  . GLN B 2 46  ? 13.563  36.170 19.961 1.000 36.096 ? 46  GLN HHH HB2  1 
ATOM   803  H  HB3  . GLN B 2 46  ? 12.744  34.970 20.587 1.000 35.990 ? 46  GLN HHH HB3  1 
ATOM   804  H  HG2  . GLN B 2 46  ? 14.151  35.010 22.497 1.000 37.463 ? 46  GLN HHH HG2  1 
ATOM   805  H  HG3  . GLN B 2 46  ? 14.958  36.224 21.870 1.000 37.592 ? 46  GLN HHH HG3  1 
ATOM   806  H  HE21 . GLN B 2 46  ? 12.654  37.528 24.177 0.000 30.000 ? 46  GLN HHH HE21 1 
ATOM   807  H  HE22 . GLN B 2 46  ? 13.880  36.612 24.233 0.000 30.000 ? 46  GLN HHH HE22 1 
ATOM   808  N  N    . TRP B 2 47  ? 15.147  32.291 20.997 1.000 34.807 ? 47  TRP HHH N    1 
ATOM   809  C  CA   . TRP B 2 47  ? 14.978  30.902 21.500 1.000 34.023 ? 47  TRP HHH CA   1 
ATOM   810  C  C    . TRP B 2 47  ? 14.203  30.919 22.819 1.000 34.335 ? 47  TRP HHH C    1 
ATOM   811  O  O    . TRP B 2 47  ? 14.570  31.706 23.717 1.000 35.537 ? 47  TRP HHH O    1 
ATOM   812  C  CB   . TRP B 2 47  ? 16.329  30.204 21.667 1.000 34.086 ? 47  TRP HHH CB   1 
ATOM   813  C  CG   . TRP B 2 47  ? 16.198  28.750 21.999 1.000 33.557 ? 47  TRP HHH CG   1 
ATOM   814  C  CD1  . TRP B 2 47  ? 15.796  27.753 21.158 1.000 32.608 ? 47  TRP HHH CD1  1 
ATOM   815  C  CD2  . TRP B 2 47  ? 16.456  28.127 23.270 1.000 34.035 ? 47  TRP HHH CD2  1 
ATOM   816  N  NE1  . TRP B 2 47  ? 15.794  26.553 21.813 1.000 32.875 ? 47  TRP HHH NE1  1 
ATOM   817  C  CE2  . TRP B 2 47  ? 16.196  26.749 23.108 1.000 33.668 ? 47  TRP HHH CE2  1 
ATOM   818  C  CE3  . TRP B 2 47  ? 16.888  28.591 24.519 1.000 34.668 ? 47  TRP HHH CE3  1 
ATOM   819  C  CZ2  . TRP B 2 47  ? 16.355  25.838 24.148 1.000 33.958 ? 47  TRP HHH CZ2  1 
ATOM   820  C  CZ3  . TRP B 2 47  ? 17.043  27.690 25.548 1.000 35.113 ? 47  TRP HHH CZ3  1 
ATOM   821  C  CH2  . TRP B 2 47  ? 16.776  26.333 25.361 1.000 35.035 ? 47  TRP HHH CH2  1 
ATOM   822  H  H    . TRP B 2 47  ? 15.928  32.674 21.268 1.000 35.422 ? 47  TRP HHH H    1 
ATOM   823  H  HA   . TRP B 2 47  ? 14.458  30.398 20.830 1.000 33.603 ? 47  TRP HHH HA   1 
ATOM   824  H  HB2  . TRP B 2 47  ? 16.836  30.302 20.835 1.000 34.018 ? 47  TRP HHH HB2  1 
ATOM   825  H  HB3  . TRP B 2 47  ? 16.827  30.655 22.380 1.000 34.699 ? 47  TRP HHH HB3  1 
ATOM   826  H  HD1  . TRP B 2 47  ? 15.555  27.868 20.252 1.000 32.243 ? 47  TRP HHH HD1  1 
ATOM   827  H  HE1  . TRP B 2 47  ? 15.571  25.787 21.460 1.000 32.713 ? 47  TRP HHH HE1  1 
ATOM   828  H  HE3  . TRP B 2 47  ? 17.073  29.507 24.651 1.000 34.873 ? 47  TRP HHH HE3  1 
ATOM   829  H  HZ2  . TRP B 2 47  ? 16.173  24.925 24.024 1.000 34.041 ? 47  TRP HHH HZ2  1 
ATOM   830  H  HZ3  . TRP B 2 47  ? 17.333  27.993 26.394 1.000 36.111 ? 47  TRP HHH HZ3  1 
ATOM   831  H  HH2  . TRP B 2 47  ? 16.889  25.739 26.083 1.000 35.667 ? 47  TRP HHH HH2  1 
ATOM   832  N  N    . MET B 2 48  ? 13.200  30.046 22.934 1.000 33.795 ? 48  MET HHH N    1 
ATOM   833  C  CA   . MET B 2 48  ? 12.229  30.016 24.056 1.000 34.124 ? 48  MET HHH CA   1 
ATOM   834  C  C    . MET B 2 48  ? 12.491  28.812 24.962 1.000 34.441 ? 48  MET HHH C    1 
ATOM   835  O  O    . MET B 2 48  ? 12.265  28.940 26.176 1.000 35.528 ? 48  MET HHH O    1 
ATOM   836  C  CB   . MET B 2 48  ? 10.805  29.932 23.514 1.000 34.288 ? 48  MET HHH CB   1 
ATOM   837  C  CG   . MET B 2 48  ? 10.519  30.977 22.460 1.000 34.437 ? 48  MET HHH CG   1 
ATOM   838  S  SD   . MET B 2 48  ? 8.746   31.253 22.274 1.000 35.760 ? 48  MET HHH SD   1 
ATOM   839  C  CE   . MET B 2 48  ? 8.278   29.778 21.377 1.000 35.495 ? 48  MET HHH CE   1 
ATOM   840  H  H    . MET B 2 48  ? 13.038  29.411 22.302 1.000 33.490 ? 48  MET HHH H    1 
ATOM   841  H  HA   . MET B 2 48  ? 12.333  30.839 24.585 1.000 34.595 ? 48  MET HHH HA   1 
ATOM   842  H  HB2  . MET B 2 48  ? 10.664  29.043 23.131 1.000 34.109 ? 48  MET HHH HB2  1 
ATOM   843  H  HB3  . MET B 2 48  ? 10.177  30.043 24.256 1.000 34.732 ? 48  MET HHH HB3  1 
ATOM   844  H  HG2  . MET B 2 48  ? 10.951  31.821 22.711 1.000 34.742 ? 48  MET HHH HG2  1 
ATOM   845  H  HG3  . MET B 2 48  ? 10.891  30.686 21.601 1.000 34.204 ? 48  MET HHH HG3  1 
ATOM   846  H  HE1  . MET B 2 48  ? 7.524   29.970 20.812 1.000 35.335 ? 48  MET HHH HE1  1 
ATOM   847  H  HE2  . MET B 2 48  ? 9.020   29.488 20.834 1.000 35.161 ? 48  MET HHH HE2  1 
ATOM   848  H  HE3  . MET B 2 48  ? 8.043   29.084 22.005 1.000 35.773 ? 48  MET HHH HE3  1 
ATOM   849  N  N    . GLY B 2 49  ? 12.944  27.690 24.399 1.000 33.719 ? 49  GLY HHH N    1 
ATOM   850  C  CA   . GLY B 2 49  ? 13.183  26.440 25.147 1.000 33.752 ? 49  GLY HHH CA   1 
ATOM   851  C  C    . GLY B 2 49  ? 13.021  25.218 24.262 1.000 32.568 ? 49  GLY HHH C    1 
ATOM   852  O  O    . GLY B 2 49  ? 12.807  25.397 23.042 1.000 31.247 ? 49  GLY HHH O    1 
ATOM   853  H  H    . GLY B 2 49  ? 13.127  27.630 23.510 1.000 33.215 ? 49  GLY HHH H    1 
ATOM   854  H  HA2  . GLY B 2 49  ? 14.096  26.458 25.523 1.000 34.264 ? 49  GLY HHH HA2  1 
ATOM   855  H  HA3  . GLY B 2 49  ? 12.544  26.389 25.897 1.000 34.147 ? 49  GLY HHH HA3  1 
ATOM   856  N  N    . TRP B 2 50  ? 13.123  24.019 24.848 1.000 32.586 ? 50  TRP HHH N    1 
ATOM   857  C  CA   . TRP B 2 50  ? 12.985  22.729 24.121 1.000 32.154 ? 50  TRP HHH CA   1 
ATOM   858  C  C    . TRP B 2 50  ? 12.200  21.700 24.936 1.000 33.255 ? 50  TRP HHH C    1 
ATOM   859  O  O    . TRP B 2 50  ? 12.134  21.805 26.173 1.000 33.858 ? 50  TRP HHH O    1 
ATOM   860  C  CB   . TRP B 2 50  ? 14.345  22.165 23.696 1.000 31.661 ? 50  TRP HHH CB   1 
ATOM   861  C  CG   . TRP B 2 50  ? 15.307  21.865 24.803 1.000 32.226 ? 50  TRP HHH CG   1 
ATOM   862  C  CD1  . TRP B 2 50  ? 15.895  22.762 25.647 1.000 32.922 ? 50  TRP HHH CD1  1 
ATOM   863  C  CD2  . TRP B 2 50  ? 15.862  20.582 25.139 1.000 32.682 ? 50  TRP HHH CD2  1 
ATOM   864  N  NE1  . TRP B 2 50  ? 16.756  22.126 26.497 1.000 33.925 ? 50  TRP HHH NE1  1 
ATOM   865  C  CE2  . TRP B 2 50  ? 16.760  20.788 26.208 1.000 33.859 ? 50  TRP HHH CE2  1 
ATOM   866  C  CE3  . TRP B 2 50  ? 15.687  19.284 24.649 1.000 32.600 ? 50  TRP HHH CE3  1 
ATOM   867  C  CZ2  . TRP B 2 50  ? 17.473  19.744 26.794 1.000 34.656 ? 50  TRP HHH CZ2  1 
ATOM   868  C  CZ3  . TRP B 2 50  ? 16.395  18.253 25.225 1.000 33.437 ? 50  TRP HHH CZ3  1 
ATOM   869  C  CH2  . TRP B 2 50  ? 17.272  18.483 26.285 1.000 34.519 ? 50  TRP HHH CH2  1 
ATOM   870  H  H    . TRP B 2 50  ? 13.283  23.917 25.739 1.000 33.328 ? 50  TRP HHH H    1 
ATOM   871  H  HA   . TRP B 2 50  ? 12.476  22.914 23.298 1.000 31.585 ? 50  TRP HHH HA   1 
ATOM   872  H  HB2  . TRP B 2 50  ? 14.185  21.342 23.189 1.000 31.565 ? 50  TRP HHH HB2  1 
ATOM   873  H  HB3  . TRP B 2 50  ? 14.760  22.808 23.086 1.000 31.441 ? 50  TRP HHH HB3  1 
ATOM   874  H  HD1  . TRP B 2 50  ? 15.722  23.687 25.661 1.000 32.699 ? 50  TRP HHH HD1  1 
ATOM   875  H  HE1  . TRP B 2 50  ? 17.220  22.512 27.128 1.000 34.649 ? 50  TRP HHH HE1  1 
ATOM   876  H  HE3  . TRP B 2 50  ? 15.102  19.122 23.931 1.000 31.997 ? 50  TRP HHH HE3  1 
ATOM   877  H  HZ2  . TRP B 2 50  ? 18.060  19.898 27.515 1.000 35.667 ? 50  TRP HHH HZ2  1 
ATOM   878  H  HZ3  . TRP B 2 50  ? 16.281  17.374 24.901 1.000 33.443 ? 50  TRP HHH HZ3  1 
ATOM   879  H  HH2  . TRP B 2 50  ? 17.735  17.756 26.665 1.000 35.252 ? 50  TRP HHH HH2  1 
ATOM   880  N  N    . ILE B 2 51  ? 11.644  20.731 24.215 1.000 34.453 ? 51  ILE HHH N    1 
ATOM   881  C  CA   . ILE B 2 51  ? 10.970  19.516 24.750 1.000 35.958 ? 51  ILE HHH CA   1 
ATOM   882  C  C    . ILE B 2 51  ? 11.908  18.328 24.517 1.000 36.360 ? 51  ILE HHH C    1 
ATOM   883  O  O    . ILE B 2 51  ? 12.344  18.138 23.366 1.000 35.484 ? 51  ILE HHH O    1 
ATOM   884  C  CB   . ILE B 2 51  ? 9.607   19.333 24.056 1.000 35.963 ? 51  ILE HHH CB   1 
ATOM   885  C  CG1  . ILE B 2 51  ? 8.744   20.583 24.226 1.000 36.488 ? 51  ILE HHH CG1  1 
ATOM   886  C  CG2  . ILE B 2 51  ? 8.899   18.085 24.553 1.000 36.724 ? 51  ILE HHH CG2  1 
ATOM   887  C  CD1  . ILE B 2 51  ? 7.596   20.685 23.250 1.000 36.726 ? 51  ILE HHH CD1  1 
ATOM   888  H  H    . ILE B 2 51  ? 11.643  20.755 23.304 1.000 33.830 ? 51  ILE HHH H    1 
ATOM   889  H  HA   . ILE B 2 51  ? 10.825  19.628 25.706 1.000 36.428 ? 51  ILE HHH HA   1 
ATOM   890  H  HB   . ILE B 2 51  ? 9.778   19.218 23.089 1.000 35.587 ? 51  ILE HHH HB   1 
ATOM   891  H  HG12 . ILE B 2 51  ? 8.382   20.588 25.137 1.000 37.060 ? 51  ILE HHH HG12 1 
ATOM   892  H  HG13 . ILE B 2 51  ? 9.310   21.376 24.125 1.000 36.168 ? 51  ILE HHH HG13 1 
ATOM   893  H  HG21 . ILE B 2 51  ? 9.343   17.294 24.200 1.000 36.697 ? 51  ILE HHH HG21 1 
ATOM   894  H  HG22 . ILE B 2 51  ? 7.974   18.093 24.255 1.000 36.706 ? 51  ILE HHH HG22 1 
ATOM   895  H  HG23 . ILE B 2 51  ? 8.924   18.061 25.525 1.000 37.296 ? 51  ILE HHH HG23 1 
ATOM   896  H  HD11 . ILE B 2 51  ? 7.944   20.734 22.342 1.000 36.062 ? 51  ILE HHH HD11 1 
ATOM   897  H  HD12 . ILE B 2 51  ? 7.077   21.484 23.440 1.000 36.578 ? 51  ILE HHH HD12 1 
ATOM   898  H  HD13 . ILE B 2 51  ? 7.024   19.903 23.334 1.000 36.935 ? 51  ILE HHH HD13 1 
ATOM   899  N  N    . ASN B 2 52  ? 12.234  17.591 25.579 1.000 37.614 ? 52  ASN HHH N    1 
ATOM   900  C  CA   . ASN B 2 52  ? 12.918  16.278 25.481 1.000 38.219 ? 52  ASN HHH CA   1 
ATOM   901  C  C    . ASN B 2 52  ? 11.838  15.209 25.300 1.000 38.563 ? 52  ASN HHH C    1 
ATOM   902  O  O    . ASN B 2 52  ? 11.353  14.682 26.312 1.000 39.414 ? 52  ASN HHH O    1 
ATOM   903  C  CB   . ASN B 2 52  ? 13.823  16.011 26.685 1.000 39.085 ? 52  ASN HHH CB   1 
ATOM   904  C  CG   . ASN B 2 52  ? 14.623  14.737 26.528 1.000 39.531 ? 52  ASN HHH CG   1 
ATOM   905  O  OD1  . ASN B 2 52  ? 14.321  13.913 25.670 1.000 39.327 ? 52  ASN HHH OD1  1 
ATOM   906  N  ND2  . ASN B 2 52  ? 15.641  14.564 27.352 1.000 40.827 ? 52  ASN HHH ND2  1 
ATOM   907  H  H    . ASN B 2 52  ? 12.056  17.852 26.434 1.000 38.054 ? 52  ASN HHH H    1 
ATOM   908  H  HA   . ASN B 2 52  ? 13.489  16.286 24.677 1.000 37.842 ? 52  ASN HHH HA   1 
ATOM   909  H  HB2  . ASN B 2 52  ? 14.438  16.765 26.794 1.000 39.178 ? 52  ASN HHH HB2  1 
ATOM   910  H  HB3  . ASN B 2 52  ? 13.272  15.948 27.492 1.000 39.622 ? 52  ASN HHH HB3  1 
ATOM   911  H  HD21 . ASN B 2 52  ? 16.141  13.860 27.202 0.000 30.000 ? 52  ASN HHH HD21 1 
ATOM   912  H  HD22 . ASN B 2 52  ? 15.890  15.232 27.833 0.000 30.000 ? 52  ASN HHH HD22 1 
ATOM   913  N  N    . THR B 2 53  ? 11.500  14.893 24.050 1.000 38.484 ? 53  THR HHH N    1 
ATOM   914  C  CA   . THR B 2 53  ? 10.398  13.967 23.671 1.000 39.298 ? 53  THR HHH CA   1 
ATOM   915  C  C    . THR B 2 53  ? 10.695  12.529 24.121 1.000 40.586 ? 53  THR HHH C    1 
ATOM   916  O  O    . THR B 2 53  ? 9.850   11.662 23.844 1.000 41.033 ? 53  THR HHH O    1 
ATOM   917  C  CB   . THR B 2 53  ? 10.157  13.985 22.158 1.000 38.706 ? 53  THR HHH CB   1 
ATOM   918  O  OG1  . THR B 2 53  ? 11.376  13.604 21.523 1.000 38.610 ? 53  THR HHH OG1  1 
ATOM   919  C  CG2  . THR B 2 53  ? 9.713   15.335 21.643 1.000 38.205 ? 53  THR HHH CG2  1 
ATOM   920  H  H    . THR B 2 53  ? 11.940  15.223 23.324 1.000 38.106 ? 53  THR HHH H    1 
ATOM   921  H  HA   . THR B 2 53  ? 9.577   14.272 24.122 1.000 39.419 ? 53  THR HHH HA   1 
ATOM   922  H  HB   . THR B 2 53  ? 9.462   13.318 21.943 1.000 38.985 ? 53  THR HHH HB   1 
ATOM   923  H  HG1  . THR B 2 53  ? 11.285  13.574 20.710 0.000 30.000 ? 53  THR HHH HG1  1 
ATOM   924  H  HG21 . THR B 2 53  ? 8.948   15.645 22.160 1.000 38.310 ? 53  THR HHH HG21 1 
ATOM   925  H  HG22 . THR B 2 53  ? 9.460   15.259 20.705 1.000 37.972 ? 53  THR HHH HG22 1 
ATOM   926  H  HG23 . THR B 2 53  ? 10.443  15.974 21.729 1.000 37.927 ? 53  THR HHH HG23 1 
ATOM   927  N  N    . LYS B 2 54  ? 11.837  12.281 24.772 1.000 41.572 ? 54  LYS HHH N    1 
ATOM   928  C  CA   . LYS B 2 54  ? 12.257  10.931 25.241 1.000 43.106 ? 54  LYS HHH CA   1 
ATOM   929  C  C    . LYS B 2 54  ? 12.105  10.823 26.766 1.000 44.092 ? 54  LYS HHH C    1 
ATOM   930  O  O    . LYS B 2 54  ? 11.525  9.820  27.234 1.000 44.316 ? 54  LYS HHH O    1 
ATOM   931  C  CB   . LYS B 2 54  ? 13.701  10.662 24.808 1.000 43.424 ? 54  LYS HHH CB   1 
ATOM   932  C  CG   . LYS B 2 54  ? 14.255  9.300  25.199 1.000 44.356 ? 54  LYS HHH CG   1 
ATOM   933  C  CD   . LYS B 2 54  ? 15.762  9.261  25.216 1.000 44.978 ? 54  LYS HHH CD   1 
ATOM   934  C  CE   . LYS B 2 54  ? 16.313  7.915  25.634 1.000 46.287 ? 54  LYS HHH CE   1 
ATOM   935  N  NZ   . LYS B 2 54  ? 17.771  7.843  25.387 1.000 47.158 ? 54  LYS HHH NZ   1 
ATOM   936  H  H    . LYS B 2 54  ? 12.450  12.924 24.951 1.000 41.520 ? 54  LYS HHH H    1 
ATOM   937  H  HA   . LYS B 2 54  ? 11.672  10.259 24.820 1.000 43.026 ? 54  LYS HHH HA   1 
ATOM   938  H  HB2  . LYS B 2 54  ? 13.753  10.750 23.833 1.000 42.881 ? 54  LYS HHH HB2  1 
ATOM   939  H  HB3  . LYS B 2 54  ? 14.274  11.353 25.199 1.000 43.447 ? 54  LYS HHH HB3  1 
ATOM   940  H  HG2  . LYS B 2 54  ? 13.920  9.061  26.088 1.000 44.922 ? 54  LYS HHH HG2  1 
ATOM   941  H  HG3  . LYS B 2 54  ? 13.925  8.630  24.563 1.000 44.285 ? 54  LYS HHH HG3  1 
ATOM   942  H  HD2  . LYS B 2 54  ? 16.098  9.477  24.320 1.000 44.596 ? 54  LYS HHH HD2  1 
ATOM   943  H  HD3  . LYS B 2 54  ? 16.092  9.945  25.836 1.000 45.210 ? 54  LYS HHH HD3  1 
ATOM   944  H  HE2  . LYS B 2 54  ? 16.142  7.771  26.584 1.000 46.872 ? 54  LYS HHH HE2  1 
ATOM   945  H  HE3  . LYS B 2 54  ? 15.867  7.206  25.133 1.000 46.184 ? 54  LYS HHH HE3  1 
ATOM   946  H  HZ1  . LYS B 2 54  ? 17.937  7.922  24.499 1.000 46.683 ? 54  LYS HHH HZ1  1 
ATOM   947  H  HZ2  . LYS B 2 54  ? 18.093  7.047  25.679 1.000 47.820 ? 54  LYS HHH HZ2  1 
ATOM   948  H  HZ3  . LYS B 2 54  ? 18.191  8.514  25.829 1.000 47.278 ? 54  LYS HHH HZ3  1 
ATOM   949  N  N    . THR B 2 55  ? 12.643  11.797 27.510 1.000 44.642 ? 55  THR HHH N    1 
ATOM   950  C  CA   . THR B 2 55  ? 12.605  11.862 29.000 1.000 45.319 ? 55  THR HHH CA   1 
ATOM   951  C  C    . THR B 2 55  ? 11.318  12.565 29.447 1.000 44.675 ? 55  THR HHH C    1 
ATOM   952  O  O    . THR B 2 55  ? 10.845  12.246 30.546 1.000 45.741 ? 55  THR HHH O    1 
ATOM   953  C  CB   . THR B 2 55  ? 13.859  12.541 29.581 1.000 46.076 ? 55  THR HHH CB   1 
ATOM   954  O  OG1  . THR B 2 55  ? 13.898  13.931 29.247 1.000 44.507 ? 55  THR HHH OG1  1 
ATOM   955  C  CG2  . THR B 2 55  ? 15.146  11.899 29.110 1.000 46.610 ? 55  THR HHH CG2  1 
ATOM   956  H  H    . THR B 2 55  ? 13.087  12.502 27.147 1.000 43.979 ? 55  THR HHH H    1 
ATOM   957  H  HA   . THR B 2 55  ? 12.579  10.937 29.336 1.000 45.975 ? 55  THR HHH HA   1 
ATOM   958  H  HB   . THR B 2 55  ? 13.816  12.460 30.564 1.000 46.904 ? 55  THR HHH HB   1 
ATOM   959  H  HG1  . THR B 2 55  ? 14.706  14.334 29.633 0.000 30.000 ? 55  THR HHH HG1  1 
ATOM   960  H  HG21 . THR B 2 55  ? 15.139  10.952 29.337 1.000 47.064 ? 55  THR HHH HG21 1 
ATOM   961  H  HG22 . THR B 2 55  ? 15.903  12.330 29.544 1.000 47.058 ? 55  THR HHH HG22 1 
ATOM   962  H  HG23 . THR B 2 55  ? 15.227  11.999 28.145 1.000 45.690 ? 55  THR HHH HG23 1 
ATOM   963  N  N    . ALA B 2 56  ? 10.788  13.475 28.618 1.000 43.359 ? 56  ALA HHH N    1 
ATOM   964  C  CA   . ALA B 2 56  ? 9.617   14.349 28.886 1.000 43.271 ? 56  ALA HHH CA   1 
ATOM   965  C  C    . ALA B 2 56  ? 10.045  15.602 29.661 1.000 43.815 ? 56  ALA HHH C    1 
ATOM   966  O  O    . ALA B 2 56  ? 9.145   16.358 30.057 1.000 44.123 ? 56  ALA HHH O    1 
ATOM   967  C  CB   . ALA B 2 56  ? 8.529   13.599 29.622 1.000 44.047 ? 56  ALA HHH CB   1 
ATOM   968  H  H    . ALA B 2 56  ? 11.133  13.633 27.791 1.000 42.696 ? 56  ALA HHH H    1 
ATOM   969  H  HA   . ALA B 2 56  ? 9.254   14.641 28.017 1.000 42.485 ? 56  ALA HHH HA   1 
ATOM   970  H  HB1  . ALA B 2 56  ? 7.671   14.021 29.449 1.000 44.012 ? 56  ALA HHH HB1  1 
ATOM   971  H  HB2  . ALA B 2 56  ? 8.502   12.677 29.314 1.000 44.192 ? 56  ALA HHH HB2  1 
ATOM   972  H  HB3  . ALA B 2 56  ? 8.709   13.615 30.577 1.000 45.022 ? 56  ALA HHH HB3  1 
ATOM   973  N  N    . ASN B 2 57  ? 11.355  15.819 29.861 1.000 44.884 ? 57  ASN HHH N    1 
ATOM   974  C  CA   . ASN B 2 57  ? 11.907  17.015 30.561 1.000 45.369 ? 57  ASN HHH CA   1 
ATOM   975  C  C    . ASN B 2 57  ? 11.722  18.221 29.626 1.000 44.103 ? 57  ASN HHH C    1 
ATOM   976  O  O    . ASN B 2 57  ? 12.044  18.111 28.421 1.000 42.135 ? 57  ASN HHH O    1 
ATOM   977  C  CB   . ASN B 2 57  ? 13.352  16.808 31.048 1.000 45.932 ? 57  ASN HHH CB   1 
ATOM   978  C  CG   . ASN B 2 57  ? 13.903  17.977 31.849 1.000 46.977 ? 57  ASN HHH CG   1 
ATOM   979  O  OD1  . ASN B 2 57  ? 14.112  17.886 33.061 1.000 47.835 ? 57  ASN HHH OD1  1 
ATOM   980  N  ND2  . ASN B 2 57  ? 14.152  19.091 31.179 1.000 46.467 ? 57  ASN HHH ND2  1 
ATOM   981  H  H    . ASN B 2 57  ? 11.997  15.246 29.569 1.000 44.625 ? 57  ASN HHH H    1 
ATOM   982  H  HA   . ASN B 2 57  ? 11.355  17.167 31.363 1.000 46.073 ? 57  ASN HHH HA   1 
ATOM   983  H  HB2  . ASN B 2 57  ? 13.382  16.002 31.603 1.000 46.874 ? 57  ASN HHH HB2  1 
ATOM   984  H  HB3  . ASN B 2 57  ? 13.927  16.658 30.270 1.000 45.441 ? 57  ASN HHH HB3  1 
ATOM   985  H  HD21 . ASN B 2 57  ? 14.395  19.937 31.747 0.000 30.000 ? 57  ASN HHH HD21 1 
ATOM   986  H  HD22 . ASN B 2 57  ? 13.900  19.239 30.478 0.000 30.000 ? 57  ASN HHH HD22 1 
ATOM   987  N  N    . LEU B 2 58  ? 11.167  19.306 30.173 1.000 44.934 ? 58  LEU HHH N    1 
ATOM   988  C  CA   . LEU B 2 58  ? 10.881  20.584 29.471 1.000 44.632 ? 58  LEU HHH CA   1 
ATOM   989  C  C    . LEU B 2 58  ? 11.817  21.649 30.044 1.000 45.288 ? 58  LEU HHH C    1 
ATOM   990  O  O    . LEU B 2 58  ? 11.872  21.776 31.280 1.000 46.419 ? 58  LEU HHH O    1 
ATOM   991  C  CB   . LEU B 2 58  ? 9.406   20.958 29.676 1.000 44.857 ? 58  LEU HHH CB   1 
ATOM   992  C  CG   . LEU B 2 58  ? 8.392   19.831 29.446 1.000 44.981 ? 58  LEU HHH CG   1 
ATOM   993  C  CD1  . LEU B 2 58  ? 7.014   20.203 29.980 1.000 45.319 ? 58  LEU HHH CD1  1 
ATOM   994  C  CD2  . LEU B 2 58  ? 8.309   19.458 27.971 1.000 43.920 ? 58  LEU HHH CD2  1 
ATOM   995  H  H    . LEU B 2 58  ? 10.921  19.327 31.050 1.000 45.859 ? 58  LEU HHH H    1 
ATOM   996  H  HA   . LEU B 2 58  ? 11.067  20.470 28.511 1.000 43.686 ? 58  LEU HHH HA   1 
ATOM   997  H  HB2  . LEU B 2 58  ? 9.297   21.289 30.590 1.000 45.742 ? 58  LEU HHH HB2  1 
ATOM   998  H  HB3  . LEU B 2 58  ? 9.190   21.695 29.070 1.000 44.155 ? 58  LEU HHH HB3  1 
ATOM   999  H  HG   . LEU B 2 58  ? 8.703   19.035 29.943 1.000 45.539 ? 58  LEU HHH HG   1 
ATOM   1000 H  HD11 . LEU B 2 58  ? 7.027   20.184 30.953 1.000 46.461 ? 58  LEU HHH HD11 1 
ATOM   1001 H  HD12 . LEU B 2 58  ? 6.355   19.566 29.653 1.000 45.453 ? 58  LEU HHH HD12 1 
ATOM   1002 H  HD13 . LEU B 2 58  ? 6.779   21.097 29.677 1.000 45.033 ? 58  LEU HHH HD13 1 
ATOM   1003 H  HD21 . LEU B 2 58  ? 8.026   20.233 27.456 1.000 43.319 ? 58  LEU HHH HD21 1 
ATOM   1004 H  HD22 . LEU B 2 58  ? 7.666   18.738 27.854 1.000 44.069 ? 58  LEU HHH HD22 1 
ATOM   1005 H  HD23 . LEU B 2 58  ? 9.183   19.164 27.661 1.000 43.564 ? 58  LEU HHH HD23 1 
ATOM   1006 N  N    . THR B 2 59  ? 12.549  22.351 29.177 1.000 45.001 ? 59  THR HHH N    1 
ATOM   1007 C  CA   . THR B 2 59  ? 13.472  23.454 29.546 1.000 45.634 ? 59  THR HHH CA   1 
ATOM   1008 C  C    . THR B 2 59  ? 12.959  24.742 28.907 1.000 44.864 ? 59  THR HHH C    1 
ATOM   1009 O  O    . THR B 2 59  ? 12.740  24.730 27.686 1.000 43.554 ? 59  THR HHH O    1 
ATOM   1010 C  CB   . THR B 2 59  ? 14.906  23.140 29.109 1.000 46.195 ? 59  THR HHH CB   1 
ATOM   1011 O  OG1  . THR B 2 59  ? 15.213  21.816 29.549 1.000 48.019 ? 59  THR HHH OG1  1 
ATOM   1012 C  CG2  . THR B 2 59  ? 15.923  24.113 29.663 1.000 47.322 ? 59  THR HHH CG2  1 
ATOM   1013 H  H    . THR B 2 59  ? 12.533  22.199 28.279 1.000 44.092 ? 59  THR HHH H    1 
ATOM   1014 H  HA   . THR B 2 59  ? 13.456  23.557 30.525 1.000 46.728 ? 59  THR HHH HA   1 
ATOM   1015 H  HB   . THR B 2 59  ? 14.941  23.167 28.125 1.000 45.396 ? 59  THR HHH HB   1 
ATOM   1016 H  HG1  . THR B 2 59  ? 15.969  21.641 29.390 0.000 30.000 ? 59  THR HHH HG1  1 
ATOM   1017 H  HG21 . THR B 2 59  ? 15.853  24.962 29.192 1.000 46.688 ? 59  THR HHH HG21 1 
ATOM   1018 H  HG22 . THR B 2 59  ? 16.819  23.750 29.544 1.000 47.615 ? 59  THR HHH HG22 1 
ATOM   1019 H  HG23 . THR B 2 59  ? 15.755  24.254 30.612 1.000 48.183 ? 59  THR HHH HG23 1 
ATOM   1020 N  N    . TYR B 2 60  ? 12.760  25.789 29.711 1.000 46.118 ? 60  TYR HHH N    1 
ATOM   1021 C  CA   . TYR B 2 60  ? 12.352  27.147 29.268 1.000 45.838 ? 60  TYR HHH CA   1 
ATOM   1022 C  C    . TYR B 2 60  ? 13.546  28.100 29.381 1.000 46.334 ? 60  TYR HHH C    1 
ATOM   1023 O  O    . TYR B 2 60  ? 14.221  28.099 30.424 1.000 47.178 ? 60  TYR HHH O    1 
ATOM   1024 C  CB   . TYR B 2 60  ? 11.180  27.658 30.109 1.000 47.117 ? 60  TYR HHH CB   1 
ATOM   1025 C  CG   . TYR B 2 60  ? 9.999   26.723 30.165 1.000 48.046 ? 60  TYR HHH CG   1 
ATOM   1026 C  CD1  . TYR B 2 60  ? 8.999   26.774 29.203 1.000 47.510 ? 60  TYR HHH CD1  1 
ATOM   1027 C  CD2  . TYR B 2 60  ? 9.889   25.773 31.169 1.000 49.220 ? 60  TYR HHH CD2  1 
ATOM   1028 C  CE1  . TYR B 2 60  ? 7.918   25.906 29.240 1.000 47.678 ? 60  TYR HHH CE1  1 
ATOM   1029 C  CE2  . TYR B 2 60  ? 8.813   24.901 31.221 1.000 49.892 ? 60  TYR HHH CE2  1 
ATOM   1030 C  CZ   . TYR B 2 60  ? 7.825   24.967 30.252 1.000 49.102 ? 60  TYR HHH CZ   1 
ATOM   1031 O  OH   . TYR B 2 60  ? 6.764   24.109 30.297 1.000 49.986 ? 60  TYR HHH OH   1 
ATOM   1032 H  H    . TYR B 2 60  ? 12.865  25.742 30.615 1.000 47.061 ? 60  TYR HHH H    1 
ATOM   1033 H  HA   . TYR B 2 60  ? 12.069  27.104 28.319 1.000 44.929 ? 60  TYR HHH HA   1 
ATOM   1034 H  HB2  . TYR B 2 60  ? 11.500  27.817 31.021 1.000 48.267 ? 60  TYR HHH HB2  1 
ATOM   1035 H  HB3  . TYR B 2 60  ? 10.886  28.518 29.741 1.000 46.773 ? 60  TYR HHH HB3  1 
ATOM   1036 H  HD1  . TYR B 2 60  ? 9.058   27.408 28.508 1.000 46.688 ? 60  TYR HHH HD1  1 
ATOM   1037 H  HD2  . TYR B 2 60  ? 10.559  25.719 31.831 1.000 50.153 ? 60  TYR HHH HD2  1 
ATOM   1038 H  HE1  . TYR B 2 60  ? 7.247   25.956 28.579 1.000 47.208 ? 60  TYR HHH HE1  1 
ATOM   1039 H  HE2  . TYR B 2 60  ? 8.754   24.262 31.912 1.000 50.662 ? 60  TYR HHH HE2  1 
ATOM   1040 H  HH   . TYR B 2 60  ? 6.804   23.676 29.549 0.000 30.000 ? 60  TYR HHH HH   1 
ATOM   1041 N  N    . ALA B 2 61  ? 13.789  28.896 28.338 1.000 45.825 ? 61  ALA HHH N    1 
ATOM   1042 C  CA   . ALA B 2 61  ? 14.667  30.086 28.379 1.000 46.725 ? 61  ALA HHH CA   1 
ATOM   1043 C  C    . ALA B 2 61  ? 14.249  30.966 29.565 1.000 49.416 ? 61  ALA HHH C    1 
ATOM   1044 O  O    . ALA B 2 61  ? 13.117  30.798 30.060 1.000 49.247 ? 61  ALA HHH O    1 
ATOM   1045 C  CB   . ALA B 2 61  ? 14.581  30.833 27.075 1.000 45.008 ? 61  ALA HHH CB   1 
ATOM   1046 H  H    . ALA B 2 61  ? 13.429  28.759 27.514 1.000 44.947 ? 61  ALA HHH H    1 
ATOM   1047 H  HA   . ALA B 2 61  ? 15.597  29.788 28.519 1.000 47.358 ? 61  ALA HHH HA   1 
ATOM   1048 H  HB1  . ALA B 2 61  ? 15.158  31.615 27.109 1.000 45.484 ? 61  ALA HHH HB1  1 
ATOM   1049 H  HB2  . ALA B 2 61  ? 14.866  30.253 26.348 1.000 44.644 ? 61  ALA HHH HB2  1 
ATOM   1050 H  HB3  . ALA B 2 61  ? 13.664  31.116 26.922 1.000 44.715 ? 61  ALA HHH HB3  1 
ATOM   1051 N  N    . GLN B 2 62  ? 15.138  31.860 30.003 1.000 52.730 ? 62  GLN HHH N    1 
ATOM   1052 C  CA   . GLN B 2 62  ? 14.932  32.781 31.155 1.000 55.668 ? 62  GLN HHH CA   1 
ATOM   1053 C  C    . GLN B 2 62  ? 13.630  33.576 30.967 1.000 55.744 ? 62  GLN HHH C    1 
ATOM   1054 O  O    . GLN B 2 62  ? 12.720  33.430 31.810 1.000 55.575 ? 62  GLN HHH O    1 
ATOM   1055 C  CB   . GLN B 2 62  ? 16.134  33.724 31.282 1.000 57.970 ? 62  GLN HHH CB   1 
ATOM   1056 C  CG   . GLN B 2 62  ? 16.150  34.564 32.554 1.000 60.407 ? 62  GLN HHH CG   1 
ATOM   1057 C  CD   . GLN B 2 62  ? 16.420  33.732 33.785 1.000 62.766 ? 62  GLN HHH CD   1 
ATOM   1058 O  OE1  . GLN B 2 62  ? 17.528  33.716 34.320 1.000 64.115 ? 62  GLN HHH OE1  1 
ATOM   1059 N  NE2  . GLN B 2 62  ? 15.401  33.019 34.240 1.000 62.740 ? 62  GLN HHH NE2  1 
ATOM   1060 H  H    . GLN B 2 62  ? 15.950  31.962 29.603 1.000 52.483 ? 62  GLN HHH H    1 
ATOM   1061 H  HA   . GLN B 2 62  ? 14.858  32.240 31.973 1.000 56.697 ? 62  GLN HHH HA   1 
ATOM   1062 H  HB2  . GLN B 2 62  ? 16.953  33.186 31.249 1.000 58.125 ? 62  GLN HHH HB2  1 
ATOM   1063 H  HB3  . GLN B 2 62  ? 16.141  34.322 30.506 1.000 56.942 ? 62  GLN HHH HB3  1 
ATOM   1064 H  HG2  . GLN B 2 62  ? 16.843  35.254 32.476 1.000 60.838 ? 62  GLN HHH HG2  1 
ATOM   1065 H  HG3  . GLN B 2 62  ? 15.286  35.017 32.655 1.000 60.190 ? 62  GLN HHH HG3  1 
ATOM   1066 H  HE21 . GLN B 2 62  ? 15.472  32.466 34.703 0.000 30.000 ? 62  GLN HHH HE21 1 
ATOM   1067 H  HE22 . GLN B 2 62  ? 14.685  33.018 33.512 0.000 30.000 ? 62  GLN HHH HE22 1 
ATOM   1068 N  N    . THR B 2 63  ? 13.538  34.352 29.880 1.000 55.731 ? 63  THR HHH N    1 
ATOM   1069 C  CA   . THR B 2 63  ? 12.528  35.429 29.662 1.000 56.421 ? 63  THR HHH CA   1 
ATOM   1070 C  C    . THR B 2 63  ? 11.127  34.854 29.384 1.000 55.360 ? 63  THR HHH C    1 
ATOM   1071 O  O    . THR B 2 63  ? 10.166  35.655 29.416 1.000 55.699 ? 63  THR HHH O    1 
ATOM   1072 C  CB   . THR B 2 63  ? 12.941  36.357 28.509 1.000 56.220 ? 63  THR HHH CB   1 
ATOM   1073 O  OG1  . THR B 2 63  ? 12.900  35.602 27.298 1.000 56.124 ? 63  THR HHH OG1  1 
ATOM   1074 C  CG2  . THR B 2 63  ? 14.319  36.960 28.686 1.000 57.177 ? 63  THR HHH CG2  1 
ATOM   1075 H  H    . THR B 2 63  ? 14.099  34.258 29.168 1.000 55.105 ? 63  THR HHH H    1 
ATOM   1076 H  HA   . THR B 2 63  ? 12.481  35.965 30.486 1.000 57.325 ? 63  THR HHH HA   1 
ATOM   1077 H  HB   . THR B 2 63  ? 12.280  37.088 28.450 1.000 56.252 ? 63  THR HHH HB   1 
ATOM   1078 H  HG1  . THR B 2 63  ? 13.071  36.036 26.616 0.000 30.000 ? 63  THR HHH HG1  1 
ATOM   1079 H  HG21 . THR B 2 63  ? 14.415  37.291 29.596 1.000 58.230 ? 63  THR HHH HG21 1 
ATOM   1080 H  HG22 . THR B 2 63  ? 14.434  37.697 28.060 1.000 56.674 ? 63  THR HHH HG22 1 
ATOM   1081 H  HG23 . THR B 2 63  ? 14.996  36.281 28.514 1.000 57.097 ? 63  THR HHH HG23 1 
ATOM   1082 N  N    . PHE B 2 64  ? 11.009  33.545 29.115 1.000 53.976 ? 64  PHE HHH N    1 
ATOM   1083 C  CA   . PHE B 2 64  ? 9.760   32.868 28.661 1.000 51.556 ? 64  PHE HHH CA   1 
ATOM   1084 C  C    . PHE B 2 64  ? 9.192   31.937 29.743 1.000 52.659 ? 64  PHE HHH C    1 
ATOM   1085 O  O    . PHE B 2 64  ? 8.139   31.338 29.471 1.000 52.878 ? 64  PHE HHH O    1 
ATOM   1086 C  CB   . PHE B 2 64  ? 10.011  32.102 27.357 1.000 48.747 ? 64  PHE HHH CB   1 
ATOM   1087 C  CG   . PHE B 2 64  ? 10.214  32.986 26.150 1.000 46.574 ? 64  PHE HHH CG   1 
ATOM   1088 C  CD1  . PHE B 2 64  ? 9.136   33.617 25.544 1.000 45.659 ? 64  PHE HHH CD1  1 
ATOM   1089 C  CD2  . PHE B 2 64  ? 11.479  33.200 25.628 1.000 45.413 ? 64  PHE HHH CD2  1 
ATOM   1090 C  CE1  . PHE B 2 64  ? 9.317   34.441 24.444 1.000 44.659 ? 64  PHE HHH CE1  1 
ATOM   1091 C  CE2  . PHE B 2 64  ? 11.659  34.018 24.523 1.000 45.076 ? 64  PHE HHH CE2  1 
ATOM   1092 C  CZ   . PHE B 2 64  ? 10.579  34.638 23.934 1.000 44.568 ? 64  PHE HHH CZ   1 
ATOM   1093 H  H    . PHE B 2 64  ? 11.705  32.963 29.176 1.000 53.844 ? 64  PHE HHH H    1 
ATOM   1094 H  HA   . PHE B 2 64  ? 9.082   33.567 28.478 1.000 51.519 ? 64  PHE HHH HA   1 
ATOM   1095 H  HB2  . PHE B 2 64  ? 10.804  31.539 27.475 1.000 48.928 ? 64  PHE HHH HB2  1 
ATOM   1096 H  HB3  . PHE B 2 64  ? 9.247   31.512 27.190 1.000 48.650 ? 64  PHE HHH HB3  1 
ATOM   1097 H  HD1  . PHE B 2 64  ? 8.268   33.486 25.891 1.000 46.057 ? 64  PHE HHH HD1  1 
ATOM   1098 H  HD2  . PHE B 2 64  ? 12.225  32.781 26.027 1.000 46.140 ? 64  PHE HHH HD2  1 
ATOM   1099 H  HE1  . PHE B 2 64  ? 8.573   34.859 24.041 1.000 44.620 ? 64  PHE HHH HE1  1 
ATOM   1100 H  HE2  . PHE B 2 64  ? 12.526  34.154 24.176 1.000 44.947 ? 64  PHE HHH HE2  1 
ATOM   1101 H  HZ   . PHE B 2 64  ? 10.704  35.194 23.181 1.000 44.136 ? 64  PHE HHH HZ   1 
ATOM   1102 N  N    . THR B 2 65  ? 9.826   31.825 30.919 1.000 54.125 ? 65  THR HHH N    1 
ATOM   1103 C  CA   . THR B 2 65  ? 9.320   31.006 32.060 1.000 54.838 ? 65  THR HHH CA   1 
ATOM   1104 C  C    . THR B 2 65  ? 8.154   31.740 32.735 1.000 54.922 ? 65  THR HHH C    1 
ATOM   1105 O  O    . THR B 2 65  ? 8.349   32.901 33.155 1.000 54.624 ? 65  THR HHH O    1 
ATOM   1106 C  CB   . THR B 2 65  ? 10.408  30.674 33.091 1.000 56.210 ? 65  THR HHH CB   1 
ATOM   1107 O  OG1  . THR B 2 65  ? 11.497  30.039 32.418 1.000 55.755 ? 65  THR HHH OG1  1 
ATOM   1108 C  CG2  . THR B 2 65  ? 9.906   29.772 34.200 1.000 57.354 ? 65  THR HHH CG2  1 
ATOM   1109 H  H    . THR B 2 65  ? 10.613  32.242 31.109 1.000 54.254 ? 65  THR HHH H    1 
ATOM   1110 H  HA   . THR B 2 65  ? 8.980   30.159 31.690 1.000 54.283 ? 65  THR HHH HA   1 
ATOM   1111 H  HB   . THR B 2 65  ? 10.727  31.520 33.488 1.000 56.862 ? 65  THR HHH HB   1 
ATOM   1112 H  HG1  . THR B 2 65  ? 12.024  29.808 33.116 0.000 30.000 ? 65  THR HHH HG1  1 
ATOM   1113 H  HG21 . THR B 2 65  ? 9.413   30.300 34.853 1.000 58.445 ? 65  THR HHH HG21 1 
ATOM   1114 H  HG22 . THR B 2 65  ? 10.662  29.342 34.637 1.000 58.094 ? 65  THR HHH HG22 1 
ATOM   1115 H  HG23 . THR B 2 65  ? 9.319   29.091 33.825 1.000 56.895 ? 65  THR HHH HG23 1 
ATOM   1116 N  N    . GLY B 2 66  ? 7.002   31.070 32.845 1.000 54.271 ? 66  GLY HHH N    1 
ATOM   1117 C  CA   . GLY B 2 66  ? 5.771   31.607 33.455 1.000 54.081 ? 66  GLY HHH CA   1 
ATOM   1118 C  C    . GLY B 2 66  ? 4.564   31.356 32.572 1.000 51.990 ? 66  GLY HHH C    1 
ATOM   1119 O  O    . GLY B 2 66  ? 3.910   30.309 32.754 1.000 52.810 ? 66  GLY HHH O    1 
ATOM   1120 H  H    . GLY B 2 66  ? 6.913   30.216 32.540 1.000 53.735 ? 66  GLY HHH H    1 
ATOM   1121 H  HA2  . GLY B 2 66  ? 5.632   31.176 34.335 1.000 55.336 ? 66  GLY HHH HA2  1 
ATOM   1122 H  HA3  . GLY B 2 66  ? 5.876   32.581 33.600 1.000 54.357 ? 66  GLY HHH HA3  1 
ATOM   1123 N  N    . ARG B 2 67  ? 4.305   32.258 31.619 1.000 48.724 ? 67  ARG HHH N    1 
ATOM   1124 C  CA   . ARG B 2 67  ? 3.065   32.272 30.798 1.000 46.964 ? 67  ARG HHH CA   1 
ATOM   1125 C  C    . ARG B 2 67  ? 3.177   31.322 29.602 1.000 44.673 ? 67  ARG HHH C    1 
ATOM   1126 O  O    . ARG B 2 67  ? 2.159   31.134 28.921 1.000 45.366 ? 67  ARG HHH O    1 
ATOM   1127 C  CB   . ARG B 2 67  ? 2.773   33.690 30.307 1.000 46.283 ? 67  ARG HHH CB   1 
ATOM   1128 C  CG   . ARG B 2 67  ? 2.409   34.655 31.421 1.000 47.558 ? 67  ARG HHH CG   1 
ATOM   1129 C  CD   . ARG B 2 67  ? 1.969   35.984 30.854 1.000 47.202 ? 67  ARG HHH CD   1 
ATOM   1130 N  NE   . ARG B 2 67  ? 2.959   36.550 29.943 1.000 45.527 ? 67  ARG HHH NE   1 
ATOM   1131 C  CZ   . ARG B 2 67  ? 2.825   36.679 28.623 1.000 44.020 ? 67  ARG HHH CZ   1 
ATOM   1132 N  NH1  . ARG B 2 67  ? 1.728   36.274 28.002 1.000 44.316 ? 67  ARG HHH NH1  1 
ATOM   1133 N  NH2  . ARG B 2 67  ? 3.803   37.225 27.925 1.000 42.581 ? 67  ARG HHH NH2  1 
ATOM   1134 H  H    . ARG B 2 67  ? 4.888   32.928 31.413 1.000 48.465 ? 67  ARG HHH H    1 
ATOM   1135 H  HA   . ARG B 2 67  ? 2.316   31.975 31.365 1.000 48.083 ? 67  ARG HHH HA   1 
ATOM   1136 H  HB2  . ARG B 2 67  ? 3.565   34.028 29.839 1.000 45.375 ? 67  ARG HHH HB2  1 
ATOM   1137 H  HB3  . ARG B 2 67  ? 2.036   33.655 29.664 1.000 46.010 ? 67  ARG HHH HB3  1 
ATOM   1138 H  HG2  . ARG B 2 67  ? 1.682   34.276 31.960 1.000 48.698 ? 67  ARG HHH HG2  1 
ATOM   1139 H  HG3  . ARG B 2 67  ? 3.186   34.793 32.004 1.000 47.938 ? 67  ARG HHH HG3  1 
ATOM   1140 H  HD2  . ARG B 2 67  ? 1.117   35.869 30.387 1.000 47.190 ? 67  ARG HHH HD2  1 
ATOM   1141 H  HD3  . ARG B 2 67  ? 1.820   36.612 31.593 1.000 48.301 ? 67  ARG HHH HD3  1 
ATOM   1142 H  HE   . ARG B 2 67  ? 3.701   36.842 30.296 1.000 45.584 ? 67  ARG HHH HE   1 
ATOM   1143 H  HH11 . ARG B 2 67  ? 1.070   35.912 28.452 1.000 45.048 ? 67  ARG HHH HH11 1 
ATOM   1144 H  HH12 . ARG B 2 67  ? 1.661   36.366 27.131 1.000 43.445 ? 67  ARG HHH HH12 1 
ATOM   1145 H  HH21 . ARG B 2 67  ? 4.536   37.497 28.332 1.000 42.847 ? 67  ARG HHH HH21 1 
ATOM   1146 H  HH22 . ARG B 2 67  ? 3.728   37.311 27.057 1.000 41.952 ? 67  ARG HHH HH22 1 
ATOM   1147 N  N    . PHE B 2 68  ? 4.356   30.751 29.347 1.000 42.552 ? 68  PHE HHH N    1 
ATOM   1148 C  CA   . PHE B 2 68  ? 4.610   29.812 28.224 1.000 40.277 ? 68  PHE HHH CA   1 
ATOM   1149 C  C    . PHE B 2 68  ? 4.748   28.392 28.784 1.000 40.307 ? 68  PHE HHH C    1 
ATOM   1150 O  O    . PHE B 2 68  ? 5.468   28.206 29.786 1.000 41.713 ? 68  PHE HHH O    1 
ATOM   1151 C  CB   . PHE B 2 68  ? 5.831   30.275 27.430 1.000 38.726 ? 68  PHE HHH CB   1 
ATOM   1152 C  CG   . PHE B 2 68  ? 5.689   31.673 26.884 1.000 38.243 ? 68  PHE HHH CG   1 
ATOM   1153 C  CD1  . PHE B 2 68  ? 5.772   32.776 27.721 1.000 39.125 ? 68  PHE HHH CD1  1 
ATOM   1154 C  CD2  . PHE B 2 68  ? 5.435   31.887 25.539 1.000 37.257 ? 68  PHE HHH CD2  1 
ATOM   1155 C  CE1  . PHE B 2 68  ? 5.622   34.061 27.218 1.000 38.856 ? 68  PHE HHH CE1  1 
ATOM   1156 C  CE2  . PHE B 2 68  ? 5.286   33.171 25.038 1.000 36.955 ? 68  PHE HHH CE2  1 
ATOM   1157 C  CZ   . PHE B 2 68  ? 5.381   34.256 25.877 1.000 37.684 ? 68  PHE HHH CZ   1 
ATOM   1158 H  H    . PHE B 2 68  ? 5.101   30.896 29.849 1.000 42.836 ? 68  PHE HHH H    1 
ATOM   1159 H  HA   . PHE B 2 68  ? 3.826   29.830 27.620 1.000 40.123 ? 68  PHE HHH HA   1 
ATOM   1160 H  HB2  . PHE B 2 68  ? 6.617   30.236 28.012 1.000 39.113 ? 68  PHE HHH HB2  1 
ATOM   1161 H  HB3  . PHE B 2 68  ? 5.975   29.654 26.686 1.000 38.124 ? 68  PHE HHH HB3  1 
ATOM   1162 H  HD1  . PHE B 2 68  ? 5.939   32.652 28.640 1.000 39.959 ? 68  PHE HHH HD1  1 
ATOM   1163 H  HD2  . PHE B 2 68  ? 5.368   31.148 24.956 1.000 36.859 ? 68  PHE HHH HD2  1 
ATOM   1164 H  HE1  . PHE B 2 68  ? 5.691   34.803 27.797 1.000 39.395 ? 68  PHE HHH HE1  1 
ATOM   1165 H  HE2  . PHE B 2 68  ? 5.122   33.301 24.117 1.000 36.426 ? 68  PHE HHH HE2  1 
ATOM   1166 H  HZ   . PHE B 2 68  ? 5.283   35.130 25.535 1.000 37.558 ? 68  PHE HHH HZ   1 
ATOM   1167 N  N    . VAL B 2 69  ? 4.050   27.428 28.176 1.000 39.088 ? 69  VAL HHH N    1 
ATOM   1168 C  CA   . VAL B 2 69  ? 3.999   26.014 28.644 1.000 39.233 ? 69  VAL HHH CA   1 
ATOM   1169 C  C    . VAL B 2 69  ? 4.165   25.083 27.438 1.000 38.285 ? 69  VAL HHH C    1 
ATOM   1170 O  O    . VAL B 2 69  ? 3.376   25.209 26.478 1.000 37.948 ? 69  VAL HHH O    1 
ATOM   1171 C  CB   . VAL B 2 69  ? 2.694   25.717 29.406 1.000 40.781 ? 69  VAL HHH CB   1 
ATOM   1172 C  CG1  . VAL B 2 69  ? 2.785   24.405 30.176 1.000 41.538 ? 69  VAL HHH CG1  1 
ATOM   1173 C  CG2  . VAL B 2 69  ? 2.299   26.862 30.330 1.000 41.923 ? 69  VAL HHH CG2  1 
ATOM   1174 H  H    . VAL B 2 69  ? 3.554   27.579 27.426 1.000 38.813 ? 69  VAL HHH H    1 
ATOM   1175 H  HA   . VAL B 2 69  ? 4.748   25.867 29.249 1.000 39.602 ? 69  VAL HHH HA   1 
ATOM   1176 H  HB   . VAL B 2 69  ? 1.978   25.618 28.733 1.000 40.561 ? 69  VAL HHH HB   1 
ATOM   1177 H  HG11 . VAL B 2 69  ? 2.412   23.686 29.637 1.000 41.352 ? 69  VAL HHH HG11 1 
ATOM   1178 H  HG12 . VAL B 2 69  ? 2.285   24.477 31.007 1.000 42.778 ? 69  VAL HHH HG12 1 
ATOM   1179 H  HG13 . VAL B 2 69  ? 3.716   24.207 30.377 1.000 41.292 ? 69  VAL HHH HG13 1 
ATOM   1180 H  HG21 . VAL B 2 69  ? 3.062   27.118 30.876 1.000 42.051 ? 69  VAL HHH HG21 1 
ATOM   1181 H  HG22 . VAL B 2 69  ? 1.569   26.579 30.907 1.000 43.055 ? 69  VAL HHH HG22 1 
ATOM   1182 H  HG23 . VAL B 2 69  ? 2.011   27.625 29.798 1.000 41.500 ? 69  VAL HHH HG23 1 
ATOM   1183 N  N    . PHE B 2 70  ? 5.164   24.193 27.492 1.000 37.784 ? 70  PHE HHH N    1 
ATOM   1184 C  CA   . PHE B 2 70  ? 5.426   23.153 26.466 1.000 36.730 ? 70  PHE HHH CA   1 
ATOM   1185 C  C    . PHE B 2 70  ? 4.741   21.849 26.886 1.000 37.794 ? 70  PHE HHH C    1 
ATOM   1186 O  O    . PHE B 2 70  ? 4.662   21.534 28.098 1.000 38.188 ? 70  PHE HHH O    1 
ATOM   1187 C  CB   . PHE B 2 70  ? 6.925   22.910 26.267 1.000 36.088 ? 70  PHE HHH CB   1 
ATOM   1188 C  CG   . PHE B 2 70  ? 7.760   24.110 25.896 1.000 35.430 ? 70  PHE HHH CG   1 
ATOM   1189 C  CD1  . PHE B 2 70  ? 7.290   25.080 25.024 1.000 34.948 ? 70  PHE HHH CD1  1 
ATOM   1190 C  CD2  . PHE B 2 70  ? 9.046   24.247 26.398 1.000 35.562 ? 70  PHE HHH CD2  1 
ATOM   1191 C  CE1  . PHE B 2 70  ? 8.077   26.170 24.684 1.000 34.433 ? 70  PHE HHH CE1  1 
ATOM   1192 C  CE2  . PHE B 2 70  ? 9.830   25.339 26.063 1.000 35.086 ? 70  PHE HHH CE2  1 
ATOM   1193 C  CZ   . PHE B 2 70  ? 9.345   26.297 25.204 1.000 34.747 ? 70  PHE HHH CZ   1 
ATOM   1194 H  H    . PHE B 2 70  ? 5.763   24.159 28.177 1.000 38.155 ? 70  PHE HHH H    1 
ATOM   1195 H  HA   . PHE B 2 70  ? 5.036   23.450 25.607 1.000 36.325 ? 70  PHE HHH HA   1 
ATOM   1196 H  HB2  . PHE B 2 70  ? 7.281   22.528 27.097 1.000 36.706 ? 70  PHE HHH HB2  1 
ATOM   1197 H  HB3  . PHE B 2 70  ? 7.027   22.236 25.568 1.000 35.718 ? 70  PHE HHH HB3  1 
ATOM   1198 H  HD1  . PHE B 2 70  ? 6.422   25.001 24.662 1.000 34.932 ? 70  PHE HHH HD1  1 
ATOM   1199 H  HD2  . PHE B 2 70  ? 9.384   23.596 26.992 1.000 36.094 ? 70  PHE HHH HD2  1 
ATOM   1200 H  HE1  . PHE B 2 70  ? 7.742   26.826 24.095 1.000 34.088 ? 70  PHE HHH HE1  1 
ATOM   1201 H  HE2  . PHE B 2 70  ? 10.696  25.422 26.421 1.000 35.472 ? 70  PHE HHH HE2  1 
ATOM   1202 H  HZ   . PHE B 2 70  ? 9.880   27.040 24.972 1.000 34.394 ? 70  PHE HHH HZ   1 
ATOM   1203 N  N    . SER B 2 71  ? 4.246   21.115 25.888 1.000 37.634 ? 71  SER HHH N    1 
ATOM   1204 C  CA   . SER B 2 71  ? 3.768   19.718 26.017 1.000 38.289 ? 71  SER HHH CA   1 
ATOM   1205 C  C    . SER B 2 71  ? 3.861   19.013 24.662 1.000 37.755 ? 71  SER HHH C    1 
ATOM   1206 O  O    . SER B 2 71  ? 4.128   19.666 23.637 1.000 36.381 ? 71  SER HHH O    1 
ATOM   1207 C  CB   . SER B 2 71  ? 2.379   19.664 26.580 1.000 39.534 ? 71  SER HHH CB   1 
ATOM   1208 O  OG   . SER B 2 71  ? 1.554   20.633 25.961 1.000 39.936 ? 71  SER HHH OG   1 
ATOM   1209 H  H    . SER B 2 71  ? 4.160   21.430 25.037 1.000 37.017 ? 71  SER HHH H    1 
ATOM   1210 H  HA   . SER B 2 71  ? 4.377   19.247 26.649 1.000 38.573 ? 71  SER HHH HA   1 
ATOM   1211 H  HB2  . SER B 2 71  ? 1.999   18.768 26.436 1.000 40.054 ? 71  SER HHH HB2  1 
ATOM   1212 H  HB3  . SER B 2 71  ? 2.412   19.831 27.549 1.000 40.327 ? 71  SER HHH HB3  1 
ATOM   1213 H  HG   . SER B 2 71  ? 0.880   20.534 26.315 0.000 30.000 ? 71  SER HHH HG   1 
ATOM   1214 N  N    . PHE B 2 72  ? 3.683   17.699 24.684 1.000 38.815 ? 72  PHE HHH N    1 
ATOM   1215 C  CA   . PHE B 2 72  ? 3.683   16.831 23.486 1.000 38.777 ? 72  PHE HHH CA   1 
ATOM   1216 C  C    . PHE B 2 72  ? 2.722   15.674 23.730 1.000 40.086 ? 72  PHE HHH C    1 
ATOM   1217 O  O    . PHE B 2 72  ? 2.381   15.403 24.889 1.000 40.558 ? 72  PHE HHH O    1 
ATOM   1218 C  CB   . PHE B 2 72  ? 5.097   16.328 23.180 1.000 38.211 ? 72  PHE HHH CB   1 
ATOM   1219 C  CG   . PHE B 2 72  ? 5.697   15.438 24.239 1.000 38.525 ? 72  PHE HHH CG   1 
ATOM   1220 C  CD1  . PHE B 2 72  ? 6.282   15.982 25.371 1.000 38.547 ? 72  PHE HHH CD1  1 
ATOM   1221 C  CD2  . PHE B 2 72  ? 5.676   14.059 24.105 1.000 38.933 ? 72  PHE HHH CD2  1 
ATOM   1222 C  CE1  . PHE B 2 72  ? 6.838   15.165 26.342 1.000 39.134 ? 72  PHE HHH CE1  1 
ATOM   1223 C  CE2  . PHE B 2 72  ? 6.236   13.244 25.076 1.000 39.455 ? 72  PHE HHH CE2  1 
ATOM   1224 C  CZ   . PHE B 2 72  ? 6.817   13.800 26.191 1.000 39.625 ? 72  PHE HHH CZ   1 
ATOM   1225 H  H    . PHE B 2 72  ? 3.551   17.229 25.454 1.000 39.420 ? 72  PHE HHH H    1 
ATOM   1226 H  HA   . PHE B 2 72  ? 3.355   17.356 22.716 1.000 38.470 ? 72  PHE HHH HA   1 
ATOM   1227 H  HB2  . PHE B 2 72  ? 5.070   15.836 22.333 1.000 37.992 ? 72  PHE HHH HB2  1 
ATOM   1228 H  HB3  . PHE B 2 72  ? 5.680   17.105 23.054 1.000 37.564 ? 72  PHE HHH HB3  1 
ATOM   1229 H  HD1  . PHE B 2 72  ? 6.305   16.919 25.479 1.000 38.328 ? 72  PHE HHH HD1  1 
ATOM   1230 H  HD2  . PHE B 2 72  ? 5.283   13.671 23.339 1.000 38.906 ? 72  PHE HHH HD2  1 
ATOM   1231 H  HE1  . PHE B 2 72  ? 7.236   15.549 27.108 1.000 39.504 ? 72  PHE HHH HE1  1 
ATOM   1232 H  HE2  . PHE B 2 72  ? 6.217   12.306 24.972 1.000 39.802 ? 72  PHE HHH HE2  1 
ATOM   1233 H  HZ   . PHE B 2 72  ? 7.192   13.244 26.856 1.000 40.179 ? 72  PHE HHH HZ   1 
ATOM   1234 N  N    . ASP B 2 73  ? 2.301   15.038 22.642 1.000 41.087 ? 73  ASP HHH N    1 
ATOM   1235 C  CA   . ASP B 2 73  ? 1.615   13.725 22.640 1.000 42.565 ? 73  ASP HHH CA   1 
ATOM   1236 C  C    . ASP B 2 73  ? 2.413   12.817 21.702 1.000 42.490 ? 73  ASP HHH C    1 
ATOM   1237 O  O    . ASP B 2 73  ? 2.370   13.063 20.481 1.000 42.195 ? 73  ASP HHH O    1 
ATOM   1238 C  CB   . ASP B 2 73  ? 0.152   13.902 22.232 1.000 43.754 ? 73  ASP HHH CB   1 
ATOM   1239 C  CG   . ASP B 2 73  ? -0.716  12.702 22.543 1.000 45.407 ? 73  ASP HHH CG   1 
ATOM   1240 O  OD1  . ASP B 2 73  ? -0.184  11.577 22.518 1.000 46.235 ? 73  ASP HHH OD1  1 
ATOM   1241 O  OD2  . ASP B 2 73  ? -1.918  12.902 22.796 1.000 47.128 ? 73  ASP HHH OD2  1 
ATOM   1242 H  H    . ASP B 2 73  ? 2.410   15.386 21.807 1.000 40.482 ? 73  ASP HHH H    1 
ATOM   1243 H  HA   . ASP B 2 73  ? 1.647   13.350 23.551 1.000 43.085 ? 73  ASP HHH HA   1 
ATOM   1244 H  HB2  . ASP B 2 73  ? -0.216  14.678 22.702 1.000 43.925 ? 73  ASP HHH HB2  1 
ATOM   1245 H  HB3  . ASP B 2 73  ? 0.105   14.077 21.271 1.000 43.461 ? 73  ASP HHH HB3  1 
ATOM   1246 N  N    . THR B 2 74  ? 3.150   11.846 22.247 1.000 43.066 ? 74  THR HHH N    1 
ATOM   1247 C  CA   . THR B 2 74  ? 3.903   10.840 21.449 1.000 43.516 ? 74  THR HHH CA   1 
ATOM   1248 C  C    . THR B 2 74  ? 2.923   10.071 20.554 1.000 44.512 ? 74  THR HHH C    1 
ATOM   1249 O  O    . THR B 2 74  ? 3.312   9.771  19.413 1.000 45.433 ? 74  THR HHH O    1 
ATOM   1250 C  CB   . THR B 2 74  ? 4.747   9.909  22.331 1.000 43.969 ? 74  THR HHH CB   1 
ATOM   1251 O  OG1  . THR B 2 74  ? 5.826   10.678 22.862 1.000 44.156 ? 74  THR HHH OG1  1 
ATOM   1252 C  CG2  . THR B 2 74  ? 5.326   8.731  21.580 1.000 43.948 ? 74  THR HHH CG2  1 
ATOM   1253 H  H    . THR B 2 74  ? 3.246   11.729 23.146 1.000 43.414 ? 74  THR HHH H    1 
ATOM   1254 H  HA   . THR B 2 74  ? 4.519   11.337 20.863 1.000 42.762 ? 74  THR HHH HA   1 
ATOM   1255 H  HB   . THR B 2 74  ? 4.185   9.579  23.073 1.000 44.781 ? 74  THR HHH HB   1 
ATOM   1256 H  HG1  . THR B 2 74  ? 6.414   10.128 23.289 0.000 30.000 ? 74  THR HHH HG1  1 
ATOM   1257 H  HG21 . THR B 2 74  ? 4.656   8.028  21.509 1.000 44.701 ? 74  THR HHH HG21 1 
ATOM   1258 H  HG22 . THR B 2 74  ? 6.102   8.390  22.059 1.000 43.964 ? 74  THR HHH HG22 1 
ATOM   1259 H  HG23 . THR B 2 74  ? 5.596   9.014  20.688 1.000 43.549 ? 74  THR HHH HG23 1 
ATOM   1260 N  N    . SER B 2 75  ? 1.698   9.804  21.025 1.000 45.188 ? 75  SER HHH N    1 
ATOM   1261 C  CA   . SER B 2 75  ? 0.671   8.998  20.303 1.000 46.599 ? 75  SER HHH CA   1 
ATOM   1262 C  C    . SER B 2 75  ? 0.274   9.668  18.977 1.000 47.042 ? 75  SER HHH C    1 
ATOM   1263 O  O    . SER B 2 75  ? -0.158  8.933  18.077 1.000 48.340 ? 75  SER HHH O    1 
ATOM   1264 C  CB   . SER B 2 75  ? -0.545  8.719  21.166 1.000 47.103 ? 75  SER HHH CB   1 
ATOM   1265 O  OG   . SER B 2 75  ? -1.478  9.784  21.106 1.000 46.673 ? 75  SER HHH OG   1 
ATOM   1266 H  H    . SER B 2 75  ? 1.400   10.098 21.834 1.000 45.602 ? 75  SER HHH H    1 
ATOM   1267 H  HA   . SER B 2 75  ? 1.090   8.124  20.080 1.000 46.609 ? 75  SER HHH HA   1 
ATOM   1268 H  HB2  . SER B 2 75  ? -0.976  7.889  20.859 1.000 47.976 ? 75  SER HHH HB2  1 
ATOM   1269 H  HB3  . SER B 2 75  ? -0.260  8.586  22.099 1.000 47.150 ? 75  SER HHH HB3  1 
ATOM   1270 H  HG   . SER B 2 75  ? -2.206  9.595  21.576 0.000 30.000 ? 75  SER HHH HG   1 
ATOM   1271 N  N    . VAL B 2 76  ? 0.411   10.996 18.854 1.000 46.639 ? 76  VAL HHH N    1 
ATOM   1272 C  CA   . VAL B 2 76  ? 0.031   11.776 17.631 1.000 46.827 ? 76  VAL HHH CA   1 
ATOM   1273 C  C    . VAL B 2 76  ? 1.270   12.478 17.048 1.000 44.601 ? 76  VAL HHH C    1 
ATOM   1274 O  O    . VAL B 2 76  ? 1.091   13.283 16.103 1.000 44.042 ? 76  VAL HHH O    1 
ATOM   1275 C  CB   . VAL B 2 76  ? -1.085  12.805 17.924 1.000 48.265 ? 76  VAL HHH CB   1 
ATOM   1276 C  CG1  . VAL B 2 76  ? -2.009  12.989 16.725 1.000 49.637 ? 76  VAL HHH CG1  1 
ATOM   1277 C  CG2  . VAL B 2 76  ? -1.896  12.445 19.160 1.000 49.588 ? 76  VAL HHH CG2  1 
ATOM   1278 H  H    . VAL B 2 76  ? 0.730   11.519 19.527 1.000 46.079 ? 76  VAL HHH H    1 
ATOM   1279 H  HA   . VAL B 2 76  ? -0.301  11.150 16.964 1.000 47.497 ? 76  VAL HHH HA   1 
ATOM   1280 H  HB   . VAL B 2 76  ? -0.646  13.674 18.099 1.000 47.367 ? 76  VAL HHH HB   1 
ATOM   1281 H  HG11 . VAL B 2 76  ? -1.492  13.282 15.956 1.000 48.943 ? 76  VAL HHH HG11 1 
ATOM   1282 H  HG12 . VAL B 2 76  ? -2.684  13.659 16.935 1.000 49.894 ? 76  VAL HHH HG12 1 
ATOM   1283 H  HG13 . VAL B 2 76  ? -2.446  12.144 16.519 1.000 50.459 ? 76  VAL HHH HG13 1 
ATOM   1284 H  HG21 . VAL B 2 76  ? -2.164  11.511 19.114 1.000 50.257 ? 76  VAL HHH HG21 1 
ATOM   1285 H  HG22 . VAL B 2 76  ? -2.689  13.007 19.203 1.000 50.088 ? 76  VAL HHH HG22 1 
ATOM   1286 H  HG23 . VAL B 2 76  ? -1.356  12.588 19.955 1.000 48.931 ? 76  VAL HHH HG23 1 
ATOM   1287 N  N    . SER B 2 77  ? 2.469   12.202 17.579 1.000 42.386 ? 77  SER HHH N    1 
ATOM   1288 C  CA   . SER B 2 77  ? 3.753   12.816 17.146 1.000 40.491 ? 77  SER HHH CA   1 
ATOM   1289 C  C    . SER B 2 77  ? 3.644   14.346 17.107 1.000 38.848 ? 77  SER HHH C    1 
ATOM   1290 O  O    . SER B 2 77  ? 4.176   14.940 16.157 1.000 38.483 ? 77  SER HHH O    1 
ATOM   1291 C  CB   . SER B 2 77  ? 4.167   12.272 15.803 1.000 40.776 ? 77  SER HHH CB   1 
ATOM   1292 O  OG   . SER B 2 77  ? 4.733   10.981 15.937 1.000 41.834 ? 77  SER HHH OG   1 
ATOM   1293 H  H    . SER B 2 77  ? 2.590   11.599 18.247 1.000 42.731 ? 77  SER HHH H    1 
ATOM   1294 H  HA   . SER B 2 77  ? 4.450   12.571 17.813 1.000 40.145 ? 77  SER HHH HA   1 
ATOM   1295 H  HB2  . SER B 2 77  ? 3.382   12.227 15.211 1.000 41.563 ? 77  SER HHH HB2  1 
ATOM   1296 H  HB3  . SER B 2 77  ? 4.823   12.871 15.392 1.000 40.355 ? 77  SER HHH HB3  1 
ATOM   1297 H  HG   . SER B 2 77  ? 4.999   10.876 15.008 0.000 30.000 ? 77  SER HHH HG   1 
ATOM   1298 N  N    . THR B 2 78  ? 2.985   14.962 18.091 1.000 38.137 ? 78  THR HHH N    1 
ATOM   1299 C  CA   . THR B 2 78  ? 2.660   16.416 18.090 1.000 37.648 ? 78  THR HHH CA   1 
ATOM   1300 C  C    . THR B 2 78  ? 3.199   17.082 19.360 1.000 36.855 ? 78  THR HHH C    1 
ATOM   1301 O  O    . THR B 2 78  ? 2.857   16.614 20.460 1.000 37.508 ? 78  THR HHH O    1 
ATOM   1302 C  CB   . THR B 2 78  ? 1.152   16.649 17.926 1.000 38.258 ? 78  THR HHH CB   1 
ATOM   1303 O  OG1  . THR B 2 78  ? 0.768   16.057 16.687 1.000 39.804 ? 78  THR HHH OG1  1 
ATOM   1304 C  CG2  . THR B 2 78  ? 0.755   18.107 17.899 1.000 37.650 ? 78  THR HHH CG2  1 
ATOM   1305 H  H    . THR B 2 78  ? 2.689   14.536 18.840 1.000 38.712 ? 78  THR HHH H    1 
ATOM   1306 H  HA   . THR B 2 78  ? 3.113   16.818 17.319 1.000 37.103 ? 78  THR HHH HA   1 
ATOM   1307 H  HB   . THR B 2 78  ? 0.679   16.197 18.664 1.000 39.027 ? 78  THR HHH HB   1 
ATOM   1308 H  HG1  . THR B 2 78  ? -0.004  16.261 16.496 0.000 30.000 ? 78  THR HHH HG1  1 
ATOM   1309 H  HG21 . THR B 2 78  ? 1.037   18.540 18.724 1.000 37.416 ? 78  THR HHH HG21 1 
ATOM   1310 H  HG22 . THR B 2 78  ? -0.213  18.179 17.811 1.000 38.567 ? 78  THR HHH HG22 1 
ATOM   1311 H  HG23 . THR B 2 78  ? 1.180   18.546 17.142 1.000 37.281 ? 78  THR HHH HG23 1 
ATOM   1312 N  N    . ALA B 2 79  ? 3.993   18.146 19.199 1.000 35.750 ? 79  ALA HHH N    1 
ATOM   1313 C  CA   . ALA B 2 79  ? 4.409   19.065 20.290 1.000 35.223 ? 79  ALA HHH CA   1 
ATOM   1314 C  C    . ALA B 2 79  ? 3.446   20.259 20.346 1.000 34.475 ? 79  ALA HHH C    1 
ATOM   1315 O  O    . ALA B 2 79  ? 2.746   20.521 19.355 1.000 34.221 ? 79  ALA HHH O    1 
ATOM   1316 C  CB   . ALA B 2 79  ? 5.841   19.502 20.095 1.000 34.372 ? 79  ALA HHH CB   1 
ATOM   1317 H  H    . ALA B 2 79  ? 4.341   18.389 18.393 1.000 35.425 ? 79  ALA HHH H    1 
ATOM   1318 H  HA   . ALA B 2 79  ? 4.346   18.580 21.144 1.000 35.480 ? 79  ALA HHH HA   1 
ATOM   1319 H  HB1  . ALA B 2 79  ? 6.103   20.092 20.822 1.000 34.292 ? 79  ALA HHH HB1  1 
ATOM   1320 H  HB2  . ALA B 2 79  ? 6.421   18.722 20.087 1.000 34.415 ? 79  ALA HHH HB2  1 
ATOM   1321 H  HB3  . ALA B 2 79  ? 5.924   19.975 19.249 1.000 34.068 ? 79  ALA HHH HB3  1 
ATOM   1322 N  N    . TYR B 2 80  ? 3.406   20.949 21.480 1.000 34.194 ? 80  TYR HHH N    1 
ATOM   1323 C  CA   . TYR B 2 80  ? 2.440   22.039 21.763 1.000 34.368 ? 80  TYR HHH CA   1 
ATOM   1324 C  C    . TYR B 2 80  ? 3.170   23.188 22.453 1.000 33.431 ? 80  TYR HHH C    1 
ATOM   1325 O  O    . TYR B 2 80  ? 4.078   22.937 23.260 1.000 33.554 ? 80  TYR HHH O    1 
ATOM   1326 C  CB   . TYR B 2 80  ? 1.279   21.504 22.608 1.000 35.992 ? 80  TYR HHH CB   1 
ATOM   1327 C  CG   . TYR B 2 80  ? 0.457   20.446 21.914 1.000 37.031 ? 80  TYR HHH CG   1 
ATOM   1328 C  CD1  . TYR B 2 80  ? -0.380  20.777 20.861 1.000 37.210 ? 80  TYR HHH CD1  1 
ATOM   1329 C  CD2  . TYR B 2 80  ? 0.523   19.112 22.292 1.000 37.703 ? 80  TYR HHH CD2  1 
ATOM   1330 C  CE1  . TYR B 2 80  ? -1.134  19.818 20.203 1.000 38.075 ? 80  TYR HHH CE1  1 
ATOM   1331 C  CE2  . TYR B 2 80  ? -0.225  18.138 21.644 1.000 38.447 ? 80  TYR HHH CE2  1 
ATOM   1332 C  CZ   . TYR B 2 80  ? -1.058  18.493 20.596 1.000 38.670 ? 80  TYR HHH CZ   1 
ATOM   1333 O  OH   . TYR B 2 80  ? -1.790  17.554 19.927 1.000 39.355 ? 80  TYR HHH OH   1 
ATOM   1334 H  H    . TYR B 2 80  ? 3.974   20.797 22.176 1.000 34.209 ? 80  TYR HHH H    1 
ATOM   1335 H  HA   . TYR B 2 80  ? 2.078   22.369 20.905 1.000 34.276 ? 80  TYR HHH HA   1 
ATOM   1336 H  HB2  . TYR B 2 80  ? 1.644   21.131 23.436 1.000 36.201 ? 80  TYR HHH HB2  1 
ATOM   1337 H  HB3  . TYR B 2 80  ? 0.697   22.255 22.847 1.000 36.372 ? 80  TYR HHH HB3  1 
ATOM   1338 H  HD1  . TYR B 2 80  ? -0.439  21.676 20.583 1.000 36.986 ? 80  TYR HHH HD1  1 
ATOM   1339 H  HD2  . TYR B 2 80  ? 1.088   18.860 23.003 1.000 37.547 ? 80  TYR HHH HD2  1 
ATOM   1340 H  HE1  . TYR B 2 80  ? -1.695  20.065 19.488 1.000 38.464 ? 80  TYR HHH HE1  1 
ATOM   1341 H  HE2  . TYR B 2 80  ? -0.164  17.236 21.914 1.000 38.742 ? 80  TYR HHH HE2  1 
ATOM   1342 H  HH   . TYR B 2 80  ? -1.495  17.586 19.033 0.000 30.000 ? 80  TYR HHH HH   1 
ATOM   1343 N  N    . LEU B 2 81  ? 2.796   24.417 22.105 1.000 33.181 ? 81  LEU HHH N    1 
ATOM   1344 C  CA   . LEU B 2 81  ? 3.186   25.651 22.834 1.000 32.923 ? 81  LEU HHH CA   1 
ATOM   1345 C  C    . LEU B 2 81  ? 1.907   26.373 23.265 1.000 33.590 ? 81  LEU HHH C    1 
ATOM   1346 O  O    . LEU B 2 81  ? 1.209   26.916 22.393 1.000 33.608 ? 81  LEU HHH O    1 
ATOM   1347 C  CB   . LEU B 2 81  ? 4.050   26.533 21.927 1.000 31.849 ? 81  LEU HHH CB   1 
ATOM   1348 C  CG   . LEU B 2 81  ? 4.280   27.960 22.424 1.000 31.879 ? 81  LEU HHH CG   1 
ATOM   1349 C  CD1  . LEU B 2 81  ? 4.894   27.959 23.814 1.000 32.218 ? 81  LEU HHH CD1  1 
ATOM   1350 C  CD2  . LEU B 2 81  ? 5.154   28.735 21.450 1.000 31.252 ? 81  LEU HHH CD2  1 
ATOM   1351 H  H    . LEU B 2 81  ? 2.267   24.577 21.381 1.000 33.215 ? 81  LEU HHH H    1 
ATOM   1352 H  HA   . LEU B 2 81  ? 3.698   25.398 23.636 1.000 33.045 ? 81  LEU HHH HA   1 
ATOM   1353 H  HB2  . LEU B 2 81  ? 4.919   26.100 21.816 1.000 31.500 ? 81  LEU HHH HB2  1 
ATOM   1354 H  HB3  . LEU B 2 81  ? 3.627   26.576 21.046 1.000 31.782 ? 81  LEU HHH HB3  1 
ATOM   1355 H  HG   . LEU B 2 81  ? 3.404   28.415 22.475 1.000 32.324 ? 81  LEU HHH HG   1 
ATOM   1356 H  HD11 . LEU B 2 81  ? 4.202   27.777 24.474 1.000 32.982 ? 81  LEU HHH HD11 1 
ATOM   1357 H  HD12 . LEU B 2 81  ? 5.293   28.828 23.996 1.000 32.142 ? 81  LEU HHH HD12 1 
ATOM   1358 H  HD13 . LEU B 2 81  ? 5.578   27.271 23.866 1.000 32.084 ? 81  LEU HHH HD13 1 
ATOM   1359 H  HD21 . LEU B 2 81  ? 5.948   28.214 21.241 1.000 30.886 ? 81  LEU HHH HD21 1 
ATOM   1360 H  HD22 . LEU B 2 81  ? 5.419   29.581 21.852 1.000 31.201 ? 81  LEU HHH HD22 1 
ATOM   1361 H  HD23 . LEU B 2 81  ? 4.656   28.907 20.632 1.000 31.098 ? 81  LEU HHH HD23 1 
ATOM   1362 N  N    . HIS B 2 82  ? 1.610   26.350 24.562 1.000 34.090 ? 82  HIS HHH N    1 
ATOM   1363 C  CA   . HIS B 2 82  ? 0.495   27.101 25.186 1.000 35.227 ? 82  HIS HHH CA   1 
ATOM   1364 C  C    . HIS B 2 82  ? 1.021   28.452 25.678 1.000 35.617 ? 82  HIS HHH C    1 
ATOM   1365 O  O    . HIS B 2 82  ? 2.080   28.477 26.315 1.000 35.327 ? 82  HIS HHH O    1 
ATOM   1366 C  CB   . HIS B 2 82  ? -0.116  26.270 26.312 1.000 36.193 ? 82  HIS HHH CB   1 
ATOM   1367 C  CG   . HIS B 2 82  ? -1.237  26.947 27.013 1.000 37.390 ? 82  HIS HHH CG   1 
ATOM   1368 N  ND1  . HIS B 2 82  ? -2.477  27.108 26.427 1.000 38.128 ? 82  HIS HHH ND1  1 
ATOM   1369 C  CD2  . HIS B 2 82  ? -1.319  27.488 28.245 1.000 38.224 ? 82  HIS HHH CD2  1 
ATOM   1370 C  CE1  . HIS B 2 82  ? -3.278  27.719 27.273 1.000 39.467 ? 82  HIS HHH CE1  1 
ATOM   1371 N  NE2  . HIS B 2 82  ? -2.592  27.963 28.396 1.000 39.590 ? 82  HIS HHH NE2  1 
ATOM   1372 H  H    . HIS B 2 82  ? 2.082   25.863 25.169 1.000 34.319 ? 82  HIS HHH H    1 
ATOM   1373 H  HA   . HIS B 2 82  ? -0.191  27.261 24.500 1.000 35.375 ? 82  HIS HHH HA   1 
ATOM   1374 H  HB2  . HIS B 2 82  ? -0.441  25.420 25.939 1.000 36.354 ? 82  HIS HHH HB2  1 
ATOM   1375 H  HB3  . HIS B 2 82  ? 0.586   26.059 26.967 1.000 36.206 ? 82  HIS HHH HB3  1 
ATOM   1376 H  HD1  . HIS B 2 82  ? -2.645  26.900 25.654 0.000 30.000 ? 82  HIS HHH HD1  1 
ATOM   1377 H  HD2  . HIS B 2 82  ? -0.634  27.527 28.886 1.000 38.277 ? 82  HIS HHH HD2  1 
ATOM   1378 H  HE1  . HIS B 2 82  ? -4.177  27.950 27.112 1.000 40.349 ? 82  HIS HHH HE1  1 
ATOM   1379 H  HE2  . HIS B 2 82  ? -2.783  28.363 29.182 0.000 30.000 ? 82  HIS HHH HE2  1 
ATOM   1380 N  N    . ILE B 2 83  ? 0.304   29.535 25.381 1.000 36.834 ? 83  ILE HHH N    1 
ATOM   1381 C  CA   . ILE B 2 83  ? 0.600   30.911 25.874 1.000 37.195 ? 83  ILE HHH CA   1 
ATOM   1382 C  C    . ILE B 2 83  ? -0.615  31.385 26.669 1.000 39.294 ? 83  ILE HHH C    1 
ATOM   1383 O  O    . ILE B 2 83  ? -1.706  31.418 26.093 1.000 40.354 ? 83  ILE HHH O    1 
ATOM   1384 C  CB   . ILE B 2 83  ? 0.928   31.850 24.699 1.000 36.254 ? 83  ILE HHH CB   1 
ATOM   1385 C  CG1  . ILE B 2 83  ? 2.152   31.350 23.927 1.000 34.928 ? 83  ILE HHH CG1  1 
ATOM   1386 C  CG2  . ILE B 2 83  ? 1.100   33.281 25.191 1.000 36.670 ? 83  ILE HHH CG2  1 
ATOM   1387 C  CD1  . ILE B 2 83  ? 2.502   32.173 22.719 1.000 34.185 ? 83  ILE HHH CD1  1 
ATOM   1388 H  H    . ILE B 2 83  ? -0.430  29.499 24.843 1.000 36.916 ? 83  ILE HHH H    1 
ATOM   1389 H  HA   . ILE B 2 83  ? 1.371   30.874 26.466 1.000 37.174 ? 83  ILE HHH HA   1 
ATOM   1390 H  HB   . ILE B 2 83  ? 0.157   31.834 24.080 1.000 36.459 ? 83  ILE HHH HB   1 
ATOM   1391 H  HG12 . ILE B 2 83  ? 2.922   31.340 24.533 1.000 34.890 ? 83  ILE HHH HG12 1 
ATOM   1392 H  HG13 . ILE B 2 83  ? 1.986   30.428 23.638 1.000 34.933 ? 83  ILE HHH HG13 1 
ATOM   1393 H  HG21 . ILE B 2 83  ? 0.240   33.636 25.475 1.000 37.489 ? 83  ILE HHH HG21 1 
ATOM   1394 H  HG22 . ILE B 2 83  ? 1.452   33.835 24.473 1.000 35.900 ? 83  ILE HHH HG22 1 
ATOM   1395 H  HG23 . ILE B 2 83  ? 1.719   33.296 25.941 1.000 36.760 ? 83  ILE HHH HG23 1 
ATOM   1396 H  HD11 . ILE B 2 83  ? 1.687   32.490 22.292 1.000 34.453 ? 83  ILE HHH HD11 1 
ATOM   1397 H  HD12 . ILE B 2 83  ? 3.006   31.629 22.089 1.000 33.545 ? 83  ILE HHH HD12 1 
ATOM   1398 H  HD13 . ILE B 2 83  ? 3.042   32.936 22.990 1.000 33.980 ? 83  ILE HHH HD13 1 
ATOM   1399 N  N    . HIS B 2 84  ? -0.425  31.726 27.943 1.000 40.948 ? 84  HIS HHH N    1 
ATOM   1400 C  CA   . HIS B 2 84  ? -1.509  32.074 28.897 1.000 43.275 ? 84  HIS HHH CA   1 
ATOM   1401 C  C    . HIS B 2 84  ? -1.542  33.591 29.097 1.000 44.590 ? 84  HIS HHH C    1 
ATOM   1402 O  O    . HIS B 2 84  ? -0.450  34.185 29.213 1.000 43.781 ? 84  HIS HHH O    1 
ATOM   1403 C  CB   . HIS B 2 84  ? -1.318  31.319 30.220 1.000 44.112 ? 84  HIS HHH CB   1 
ATOM   1404 C  CG   . HIS B 2 84  ? -2.545  31.313 31.060 1.000 46.100 ? 84  HIS HHH CG   1 
ATOM   1405 N  ND1  . HIS B 2 84  ? -3.508  30.339 30.939 1.000 46.913 ? 84  HIS HHH ND1  1 
ATOM   1406 C  CD2  . HIS B 2 84  ? -2.987  32.176 32.000 1.000 47.961 ? 84  HIS HHH CD2  1 
ATOM   1407 C  CE1  . HIS B 2 84  ? -4.489  30.589 31.781 1.000 49.413 ? 84  HIS HHH CE1  1 
ATOM   1408 N  NE2  . HIS B 2 84  ? -4.194  31.713 32.445 1.000 49.988 ? 84  HIS HHH NE2  1 
ATOM   1409 H  H    . HIS B 2 84  ? 0.400   31.772 28.326 1.000 40.581 ? 84  HIS HHH H    1 
ATOM   1410 H  HA   . HIS B 2 84  ? -2.364  31.796 28.501 1.000 43.749 ? 84  HIS HHH HA   1 
ATOM   1411 H  HB2  . HIS B 2 84  ? -1.059  30.391 30.025 1.000 43.709 ? 84  HIS HHH HB2  1 
ATOM   1412 H  HB3  . HIS B 2 84  ? -0.586  31.737 30.725 1.000 44.105 ? 84  HIS HHH HB3  1 
ATOM   1413 H  HD1  . HIS B 2 84  ? -3.353  29.608 30.403 0.000 30.000 ? 84  HIS HHH HD1  1 
ATOM   1414 H  HD2  . HIS B 2 84  ? -2.547  32.949 32.299 1.000 47.922 ? 84  HIS HHH HD2  1 
ATOM   1415 H  HE1  . HIS B 2 84  ? -5.263  30.065 31.897 1.000 50.407 ? 84  HIS HHH HE1  1 
ATOM   1416 H  HE2  . HIS B 2 84  ? -4.831  32.105 32.881 0.000 30.000 ? 84  HIS HHH HE2  1 
ATOM   1417 N  N    . GLY B 2 85  ? -2.744  34.182 29.132 1.000 47.194 ? 85  GLY HHH N    1 
ATOM   1418 C  CA   . GLY B 2 85  ? -3.002  35.620 29.411 1.000 48.508 ? 85  GLY HHH CA   1 
ATOM   1419 C  C    . GLY B 2 85  ? -2.169  36.492 28.462 1.000 46.676 ? 85  GLY HHH C    1 
ATOM   1420 O  O    . GLY B 2 85  ? -1.276  37.227 28.941 1.000 46.034 ? 85  GLY HHH O    1 
ATOM   1421 H  H    . GLY B 2 85  ? -3.517  33.724 28.981 1.000 47.640 ? 85  GLY HHH H    1 
ATOM   1422 H  HA2  . GLY B 2 85  ? -3.953  35.800 29.235 1.000 49.301 ? 85  GLY HHH HA2  1 
ATOM   1423 N  N    . LEU B 2 86  ? -2.467  36.401 27.163 1.000 46.313 ? 86  LEU HHH N    1 
ATOM   1424 C  CA   . LEU B 2 86  ? -1.692  37.036 26.061 1.000 45.161 ? 86  LEU HHH CA   1 
ATOM   1425 C  C    . LEU B 2 86  ? -1.519  38.532 26.341 1.000 45.419 ? 86  LEU HHH C    1 
ATOM   1426 O  O    . LEU B 2 86  ? -2.464  39.154 26.861 1.000 47.311 ? 86  LEU HHH O    1 
ATOM   1427 C  CB   . LEU B 2 86  ? -2.416  36.816 24.728 1.000 44.928 ? 86  LEU HHH CB   1 
ATOM   1428 C  CG   . LEU B 2 86  ? -2.053  35.538 23.970 1.000 44.198 ? 86  LEU HHH CG   1 
ATOM   1429 C  CD1  . LEU B 2 86  ? -3.079  35.237 22.886 1.000 44.856 ? 86  LEU HHH CD1  1 
ATOM   1430 C  CD2  . LEU B 2 86  ? -0.668  35.638 23.358 1.000 42.513 ? 86  LEU HHH CD2  1 
ATOM   1431 H  H    . LEU B 2 86  ? -3.183  35.920 26.869 1.000 46.715 ? 86  LEU HHH H    1 
ATOM   1432 H  HA   . LEU B 2 86  ? -0.803  36.616 26.026 1.000 44.226 ? 86  LEU HHH HA   1 
ATOM   1433 H  HB2  . LEU B 2 86  ? -3.380  36.812 24.897 1.000 46.075 ? 86  LEU HHH HB2  1 
ATOM   1434 H  HB3  . LEU B 2 86  ? -2.226  37.580 24.147 1.000 44.457 ? 86  LEU HHH HB3  1 
ATOM   1435 H  HG   . LEU B 2 86  ? -2.054  34.787 24.613 1.000 44.579 ? 86  LEU HHH HG   1 
ATOM   1436 H  HD11 . LEU B 2 86  ? -3.941  35.052 23.296 1.000 45.939 ? 86  LEU HHH HD11 1 
ATOM   1437 H  HD12 . LEU B 2 86  ? -2.792  34.461 22.373 1.000 44.170 ? 86  LEU HHH HD12 1 
ATOM   1438 H  HD13 . LEU B 2 86  ? -3.160  36.004 22.293 1.000 44.589 ? 86  LEU HHH HD13 1 
ATOM   1439 H  HD21 . LEU B 2 86  ? -0.620  36.426 22.790 1.000 42.226 ? 86  LEU HHH HD21 1 
ATOM   1440 H  HD22 . LEU B 2 86  ? -0.491  34.843 22.824 1.000 42.039 ? 86  LEU HHH HD22 1 
ATOM   1441 H  HD23 . LEU B 2 86  ? -0.004  35.707 24.065 1.000 42.418 ? 86  LEU HHH HD23 1 
ATOM   1442 N  N    . LYS B 2 87  ? -0.343  39.066 26.010 1.000 44.447 ? 87  LYS HHH N    1 
ATOM   1443 C  CA   . LYS B 2 87  ? -0.043  40.519 25.993 1.000 45.227 ? 87  LYS HHH CA   1 
ATOM   1444 C  C    . LYS B 2 87  ? 0.331   40.914 24.560 1.000 44.384 ? 87  LYS HHH C    1 
ATOM   1445 O  O    . LYS B 2 87  ? 0.677   40.017 23.777 1.000 43.572 ? 87  LYS HHH O    1 
ATOM   1446 C  CB   . LYS B 2 87  ? 1.064   40.825 27.004 1.000 45.532 ? 87  LYS HHH CB   1 
ATOM   1447 C  CG   . LYS B 2 87  ? 0.641   40.660 28.454 1.000 47.520 ? 87  LYS HHH CG   1 
ATOM   1448 C  CD   . LYS B 2 87  ? 1.781   40.558 29.437 1.000 48.445 ? 87  LYS HHH CD   1 
ATOM   1449 C  CE   . LYS B 2 87  ? 1.341   39.897 30.729 1.000 51.188 ? 87  LYS HHH CE   1 
ATOM   1450 N  NZ   . LYS B 2 87  ? 2.260   40.183 31.857 1.000 52.419 ? 87  LYS HHH NZ   1 
ATOM   1451 H  H    . LYS B 2 87  ? 0.369   38.553 25.768 1.000 43.735 ? 87  LYS HHH H    1 
ATOM   1452 H  HA   . LYS B 2 87  ? -0.855  41.011 26.253 1.000 46.186 ? 87  LYS HHH HA   1 
ATOM   1453 H  HB2  . LYS B 2 87  ? 1.822   40.230 26.827 1.000 44.789 ? 87  LYS HHH HB2  1 
ATOM   1454 H  HB3  . LYS B 2 87  ? 1.365   41.746 26.868 1.000 45.471 ? 87  LYS HHH HB3  1 
ATOM   1455 H  HG2  . LYS B 2 87  ? 0.079   41.425 28.703 1.000 48.463 ? 87  LYS HHH HG2  1 
ATOM   1456 H  HG3  . LYS B 2 87  ? 0.090   39.852 28.528 1.000 47.916 ? 87  LYS HHH HG3  1 
ATOM   1457 H  HD2  . LYS B 2 87  ? 2.509   40.035 29.039 1.000 47.558 ? 87  LYS HHH HD2  1 
ATOM   1458 H  HD3  . LYS B 2 87  ? 2.121   41.457 29.635 1.000 48.794 ? 87  LYS HHH HD3  1 
ATOM   1459 H  HE2  . LYS B 2 87  ? 0.447   40.209 30.964 1.000 51.980 ? 87  LYS HHH HE2  1 
ATOM   1460 H  HE3  . LYS B 2 87  ? 1.296   38.930 30.598 1.000 50.658 ? 87  LYS HHH HE3  1 
ATOM   1461 H  HZ1  . LYS B 2 87  ? 3.112   39.989 31.617 1.000 51.507 ? 87  LYS HHH HZ1  1 
ATOM   1462 H  HZ2  . LYS B 2 87  ? 2.031   39.678 32.575 1.000 53.303 ? 87  LYS HHH HZ2  1 
ATOM   1463 H  HZ3  . LYS B 2 87  ? 2.207   41.060 32.082 1.000 52.891 ? 87  LYS HHH HZ3  1 
ATOM   1464 N  N    . THR B 2 88  ? 0.242   42.204 24.229 1.000 45.409 ? 88  THR HHH N    1 
ATOM   1465 C  CA   . THR B 2 88  ? 0.640   42.778 22.914 1.000 45.078 ? 88  THR HHH CA   1 
ATOM   1466 C  C    . THR B 2 88  ? 2.149   42.580 22.704 1.000 44.763 ? 88  THR HHH C    1 
ATOM   1467 O  O    . THR B 2 88  ? 2.576   42.493 21.541 1.000 43.341 ? 88  THR HHH O    1 
ATOM   1468 C  CB   . THR B 2 88  ? 0.225   44.252 22.816 1.000 45.903 ? 88  THR HHH CB   1 
ATOM   1469 O  OG1  . THR B 2 88  ? 0.785   44.947 23.930 1.000 46.472 ? 88  THR HHH OG1  1 
ATOM   1470 C  CG2  . THR B 2 88  ? -1.276  44.447 22.809 1.000 47.014 ? 88  THR HHH CG2  1 
ATOM   1471 H  H    . THR B 2 88  ? -0.066  42.838 24.806 1.000 46.176 ? 88  THR HHH H    1 
ATOM   1472 H  HA   . THR B 2 88  ? 0.163   42.277 22.212 1.000 44.981 ? 88  THR HHH HA   1 
ATOM   1473 H  HB   . THR B 2 88  ? 0.600   44.626 21.983 1.000 45.175 ? 88  THR HHH HB   1 
ATOM   1474 H  HG1  . THR B 2 88  ? 0.484   45.724 23.833 0.000 30.000 ? 88  THR HHH HG1  1 
ATOM   1475 H  HG21 . THR B 2 88  ? -1.630  44.223 21.931 1.000 46.806 ? 88  THR HHH HG21 1 
ATOM   1476 H  HG22 . THR B 2 88  ? -1.484  45.376 23.013 1.000 47.627 ? 88  THR HHH HG22 1 
ATOM   1477 H  HG23 . THR B 2 88  ? -1.685  43.870 23.479 1.000 47.711 ? 88  THR HHH HG23 1 
ATOM   1478 N  N    . GLU B 2 89  ? 2.917   42.495 23.798 1.000 46.479 ? 89  GLU HHH N    1 
ATOM   1479 C  CA   . GLU B 2 89  ? 4.373   42.170 23.814 1.000 46.003 ? 89  GLU HHH CA   1 
ATOM   1480 C  C    . GLU B 2 89  ? 4.622   40.822 23.123 1.000 43.319 ? 89  GLU HHH C    1 
ATOM   1481 O  O    . GLU B 2 89  ? 5.742   40.624 22.619 1.000 42.938 ? 89  GLU HHH O    1 
ATOM   1482 C  CB   . GLU B 2 89  ? 4.908   42.095 25.251 1.000 48.896 ? 89  GLU HHH CB   1 
ATOM   1483 C  CG   . GLU B 2 89  ? 5.130   43.451 25.906 1.000 51.269 ? 89  GLU HHH CG   1 
ATOM   1484 C  CD   . GLU B 2 89  ? 3.876   44.282 26.142 1.000 52.893 ? 89  GLU HHH CD   1 
ATOM   1485 O  OE1  . GLU B 2 89  ? 2.893   43.728 26.690 1.000 53.041 ? 89  GLU HHH OE1  1 
ATOM   1486 O  OE2  . GLU B 2 89  ? 3.881   45.483 25.769 1.000 53.440 ? 89  GLU HHH OE2  1 
ATOM   1487 H  H    . GLU B 2 89  ? 2.579   42.637 24.629 1.000 47.023 ? 89  GLU HHH H    1 
ATOM   1488 H  HA   . GLU B 2 89  ? 4.859   42.874 23.326 1.000 45.626 ? 89  GLU HHH HA   1 
ATOM   1489 H  HB2  . GLU B 2 89  ? 4.274   41.581 25.793 1.000 49.330 ? 89  GLU HHH HB2  1 
ATOM   1490 H  HB3  . GLU B 2 89  ? 5.758   41.606 25.242 1.000 48.345 ? 89  GLU HHH HB3  1 
ATOM   1491 H  HG2  . GLU B 2 89  ? 5.573   43.314 26.770 1.000 51.666 ? 89  GLU HHH HG2  1 
ATOM   1492 H  HG3  . GLU B 2 89  ? 5.743   43.974 25.345 1.000 50.549 ? 89  GLU HHH HG3  1 
ATOM   1493 N  N    . ASP B 2 90  ? 3.631   39.925 23.123 1.000 41.409 ? 90  ASP HHH N    1 
ATOM   1494 C  CA   . ASP B 2 90  ? 3.794   38.515 22.683 1.000 39.664 ? 90  ASP HHH CA   1 
ATOM   1495 C  C    . ASP B 2 90  ? 3.620   38.392 21.173 1.000 38.101 ? 90  ASP HHH C    1 
ATOM   1496 O  O    . ASP B 2 90  ? 4.011   37.336 20.652 1.000 37.543 ? 90  ASP HHH O    1 
ATOM   1497 C  CB   . ASP B 2 90  ? 2.802   37.575 23.367 1.000 40.005 ? 90  ASP HHH CB   1 
ATOM   1498 C  CG   . ASP B 2 90  ? 3.049   37.425 24.855 1.000 40.870 ? 90  ASP HHH CG   1 
ATOM   1499 O  OD1  . ASP B 2 90  ? 4.233   37.449 25.268 1.000 40.680 ? 90  ASP HHH OD1  1 
ATOM   1500 O  OD2  . ASP B 2 90  ? 2.059   37.291 25.591 1.000 41.537 ? 90  ASP HHH OD2  1 
ATOM   1501 H  H    . ASP B 2 90  ? 2.792   40.118 23.412 1.000 42.282 ? 90  ASP HHH H    1 
ATOM   1502 H  HA   . ASP B 2 90  ? 4.706   38.224 22.915 1.000 39.338 ? 90  ASP HHH HA   1 
ATOM   1503 H  HB2  . ASP B 2 90  ? 1.893   37.909 23.232 1.000 40.630 ? 90  ASP HHH HB2  1 
ATOM   1504 H  HB3  . ASP B 2 90  ? 2.866   36.688 22.957 1.000 39.742 ? 90  ASP HHH HB3  1 
ATOM   1505 N  N    . THR B 2 91  ? 3.065   39.394 20.484 1.000 37.417 ? 91  THR HHH N    1 
ATOM   1506 C  CA   . THR B 2 91  ? 2.718   39.215 19.047 1.000 36.939 ? 91  THR HHH CA   1 
ATOM   1507 C  C    . THR B 2 91  ? 4.024   38.882 18.310 1.000 35.490 ? 91  THR HHH C    1 
ATOM   1508 O  O    . THR B 2 91  ? 5.024   39.590 18.527 1.000 35.429 ? 91  THR HHH O    1 
ATOM   1509 C  CB   . THR B 2 91  ? 1.904   40.367 18.436 1.000 36.839 ? 91  THR HHH CB   1 
ATOM   1510 O  OG1  . THR B 2 91  ? 2.763   41.196 17.660 1.000 37.137 ? 91  THR HHH OG1  1 
ATOM   1511 C  CG2  . THR B 2 91  ? 1.168   41.222 19.441 1.000 37.761 ? 91  THR HHH CG2  1 
ATOM   1512 H  H    . THR B 2 91  ? 2.911   40.229 20.805 1.000 37.922 ? 91  THR HHH H    1 
ATOM   1513 H  HA   . THR B 2 91  ? 2.152   38.415 19.003 1.000 36.996 ? 91  THR HHH HA   1 
ATOM   1514 H  HB   . THR B 2 91  ? 1.239   39.968 17.831 1.000 37.383 ? 91  THR HHH HB   1 
ATOM   1515 H  HG1  . THR B 2 91  ? 2.104   41.657 17.267 0.000 30.000 ? 91  THR HHH HG1  1 
ATOM   1516 H  HG21 . THR B 2 91  ? 0.899   40.679 20.203 1.000 38.150 ? 91  THR HHH HG21 1 
ATOM   1517 H  HG22 . THR B 2 91  ? 0.377   41.604 19.022 1.000 38.280 ? 91  THR HHH HG22 1 
ATOM   1518 H  HG23 . THR B 2 91  ? 1.750   41.940 19.740 1.000 37.629 ? 91  THR HHH HG23 1 
ATOM   1519 N  N    . ALA B 2 92  ? 4.027   37.797 17.532 1.000 34.927 ? 92  ALA HHH N    1 
ATOM   1520 C  CA   . ALA B 2 92  ? 5.224   37.245 16.857 1.000 34.252 ? 92  ALA HHH CA   1 
ATOM   1521 C  C    . ALA B 2 92  ? 4.834   36.053 15.975 1.000 34.031 ? 92  ALA HHH C    1 
ATOM   1522 O  O    . ALA B 2 92  ? 3.755   35.468 16.199 1.000 34.215 ? 92  ALA HHH O    1 
ATOM   1523 C  CB   . ALA B 2 92  ? 6.255   36.837 17.885 1.000 33.745 ? 92  ALA HHH CB   1 
ATOM   1524 H  H    . ALA B 2 92  ? 3.276   37.311 17.358 1.000 35.312 ? 92  ALA HHH H    1 
ATOM   1525 H  HA   . ALA B 2 92  ? 5.609   37.946 16.281 1.000 34.030 ? 92  ALA HHH HA   1 
ATOM   1526 H  HB1  . ALA B 2 92  ? 6.871   36.194 17.494 1.000 33.567 ? 92  ALA HHH HB1  1 
ATOM   1527 H  HB2  . ALA B 2 92  ? 6.751   37.620 18.177 1.000 33.835 ? 92  ALA HHH HB2  1 
ATOM   1528 H  HB3  . ALA B 2 92  ? 5.811   36.434 18.650 1.000 34.101 ? 92  ALA HHH HB3  1 
ATOM   1529 N  N    . MET B 2 93  ? 5.697   35.723 15.011 1.000 33.800 ? 93  MET HHH N    1 
ATOM   1530 C  CA   . MET B 2 93  ? 5.724   34.404 14.332 1.000 34.169 ? 93  MET HHH CA   1 
ATOM   1531 C  C    . MET B 2 93  ? 6.426   33.406 15.267 1.000 33.852 ? 93  MET HHH C    1 
ATOM   1532 O  O    . MET B 2 93  ? 7.639   33.574 15.525 1.000 32.604 ? 93  MET HHH O    1 
ATOM   1533 C  CB   . MET B 2 93  ? 6.455   34.477 12.989 1.000 34.573 ? 93  MET HHH CB   1 
ATOM   1534 C  CG   . MET B 2 93  ? 6.148   33.304 12.073 1.000 35.666 ? 93  MET HHH CG   1 
ATOM   1535 S  SD   . MET B 2 93  ? 4.509   33.419 11.285 1.000 37.651 ? 93  MET HHH SD   1 
ATOM   1536 C  CE   . MET B 2 93  ? 4.843   34.589 9.967  1.000 37.815 ? 93  MET HHH CE   1 
ATOM   1537 H  H    . MET B 2 93  ? 6.333   36.301 14.709 1.000 33.696 ? 93  MET HHH H    1 
ATOM   1538 H  HA   . MET B 2 93  ? 4.796   34.108 14.187 1.000 34.572 ? 93  MET HHH HA   1 
ATOM   1539 H  HB2  . MET B 2 93  ? 6.201   35.307 12.538 1.000 34.822 ? 93  MET HHH HB2  1 
ATOM   1540 H  HB3  . MET B 2 93  ? 7.418   34.510 13.153 1.000 34.360 ? 93  MET HHH HB3  1 
ATOM   1541 H  HG2  . MET B 2 93  ? 6.832   33.257 11.371 1.000 35.790 ? 93  MET HHH HG2  1 
ATOM   1542 H  HG3  . MET B 2 93  ? 6.192   32.471 12.590 1.000 35.633 ? 93  MET HHH HG3  1 
ATOM   1543 H  HE1  . MET B 2 93  ? 4.040   34.731 9.452  1.000 38.501 ? 93  MET HHH HE1  1 
ATOM   1544 H  HE2  . MET B 2 93  ? 5.135   35.426 10.347 1.000 37.550 ? 93  MET HHH HE2  1 
ATOM   1545 H  HE3  . MET B 2 93  ? 5.536   34.237 9.394  1.000 37.902 ? 93  MET HHH HE3  1 
ATOM   1546 N  N    . TYR B 2 94  ? 5.670   32.429 15.783 1.000 33.851 ? 94  TYR HHH N    1 
ATOM   1547 C  CA   . TYR B 2 94  ? 6.147   31.366 16.706 1.000 33.148 ? 94  TYR HHH CA   1 
ATOM   1548 C  C    . TYR B 2 94  ? 6.465   30.109 15.894 1.000 32.850 ? 94  TYR HHH C    1 
ATOM   1549 O  O    . TYR B 2 94  ? 5.593   29.644 15.142 1.000 32.374 ? 94  TYR HHH O    1 
ATOM   1550 C  CB   . TYR B 2 94  ? 5.112   31.126 17.806 1.000 33.294 ? 94  TYR HHH CB   1 
ATOM   1551 C  CG   . TYR B 2 94  ? 5.056   32.234 18.825 1.000 32.826 ? 94  TYR HHH CG   1 
ATOM   1552 C  CD1  . TYR B 2 94  ? 4.235   33.335 18.645 1.000 32.733 ? 94  TYR HHH CD1  1 
ATOM   1553 C  CD2  . TYR B 2 94  ? 5.855   32.197 19.957 1.000 32.282 ? 94  TYR HHH CD2  1 
ATOM   1554 C  CE1  . TYR B 2 94  ? 4.191   34.359 19.579 1.000 32.704 ? 94  TYR HHH CE1  1 
ATOM   1555 C  CE2  . TYR B 2 94  ? 5.824   33.213 20.897 1.000 32.475 ? 94  TYR HHH CE2  1 
ATOM   1556 C  CZ   . TYR B 2 94  ? 4.990   34.300 20.706 1.000 32.482 ? 94  TYR HHH CZ   1 
ATOM   1557 O  OH   . TYR B 2 94  ? 4.973   35.305 21.623 1.000 32.833 ? 94  TYR HHH OH   1 
ATOM   1558 H  H    . TYR B 2 94  ? 4.783   32.343 15.592 1.000 34.136 ? 94  TYR HHH H    1 
ATOM   1559 H  HA   . TYR B 2 94  ? 6.985   31.678 17.133 1.000 32.911 ? 94  TYR HHH HA   1 
ATOM   1560 H  HB2  . TYR B 2 94  ? 4.229   31.028 17.391 1.000 33.591 ? 94  TYR HHH HB2  1 
ATOM   1561 H  HB3  . TYR B 2 94  ? 5.327   30.284 18.260 1.000 33.265 ? 94  TYR HHH HB3  1 
ATOM   1562 H  HD1  . TYR B 2 94  ? 3.686   33.383 17.881 1.000 32.889 ? 94  TYR HHH HD1  1 
ATOM   1563 H  HD2  . TYR B 2 94  ? 6.424   31.462 20.093 1.000 32.266 ? 94  TYR HHH HD2  1 
ATOM   1564 H  HE1  . TYR B 2 94  ? 3.623   35.099 19.441 1.000 33.019 ? 94  TYR HHH HE1  1 
ATOM   1565 H  HE2  . TYR B 2 94  ? 6.373   33.168 21.662 1.000 32.626 ? 94  TYR HHH HE2  1 
ATOM   1566 H  HH   . TYR B 2 94  ? 4.186   35.459 21.858 0.000 30.000 ? 94  TYR HHH HH   1 
ATOM   1567 N  N    . TYR B 2 95  ? 7.692   29.602 16.042 1.000 33.314 ? 95  TYR HHH N    1 
ATOM   1568 C  CA   . TYR B 2 95  ? 8.288   28.536 15.194 1.000 33.962 ? 95  TYR HHH CA   1 
ATOM   1569 C  C    . TYR B 2 95  ? 8.558   27.284 16.025 1.000 34.475 ? 95  TYR HHH C    1 
ATOM   1570 O  O    . TYR B 2 95  ? 9.195   27.357 17.086 1.000 33.687 ? 95  TYR HHH O    1 
ATOM   1571 C  CB   . TYR B 2 95  ? 9.598   28.994 14.544 1.000 33.963 ? 95  TYR HHH CB   1 
ATOM   1572 C  CG   . TYR B 2 95  ? 9.431   29.860 13.322 1.000 34.373 ? 95  TYR HHH CG   1 
ATOM   1573 C  CD1  . TYR B 2 95  ? 9.030   29.315 12.114 1.000 35.082 ? 95  TYR HHH CD1  1 
ATOM   1574 C  CD2  . TYR B 2 95  ? 9.675   31.221 13.367 1.000 34.455 ? 95  TYR HHH CD2  1 
ATOM   1575 C  CE1  . TYR B 2 95  ? 8.875   30.098 10.983 1.000 35.550 ? 95  TYR HHH CE1  1 
ATOM   1576 C  CE2  . TYR B 2 95  ? 9.525   32.021 12.245 1.000 34.959 ? 95  TYR HHH CE2  1 
ATOM   1577 C  CZ   . TYR B 2 95  ? 9.128   31.457 11.046 1.000 35.551 ? 95  TYR HHH CZ   1 
ATOM   1578 O  OH   . TYR B 2 95  ? 8.980   32.233 9.932  1.000 35.558 ? 95  TYR HHH OH   1 
ATOM   1579 H  H    . TYR B 2 95  ? 8.265   29.880 16.693 1.000 33.147 ? 95  TYR HHH H    1 
ATOM   1580 H  HA   . TYR B 2 95  ? 7.645   28.306 14.476 1.000 34.212 ? 95  TYR HHH HA   1 
ATOM   1581 H  HB2  . TYR B 2 95  ? 10.120  29.485 15.208 1.000 33.858 ? 95  TYR HHH HB2  1 
ATOM   1582 H  HB3  . TYR B 2 95  ? 10.112  28.198 14.294 1.000 34.128 ? 95  TYR HHH HB3  1 
ATOM   1583 H  HD1  . TYR B 2 95  ? 8.859   28.390 12.060 1.000 35.231 ? 95  TYR HHH HD1  1 
ATOM   1584 H  HD2  . TYR B 2 95  ? 9.950   31.615 14.178 1.000 34.278 ? 95  TYR HHH HD2  1 
ATOM   1585 H  HE1  . TYR B 2 95  ? 8.603   29.706 10.170 1.000 36.016 ? 95  TYR HHH HE1  1 
ATOM   1586 H  HE2  . TYR B 2 95  ? 9.700   32.946 12.296 1.000 34.823 ? 95  TYR HHH HE2  1 
ATOM   1587 H  HH   . TYR B 2 95  ? 8.171   32.068 9.610  0.000 30.000 ? 95  TYR HHH HH   1 
ATOM   1588 N  N    . CYS B 2 96  ? 8.057   26.165 15.516 1.000 36.389 ? 96  CYS HHH N    1 
ATOM   1589 C  CA   . CYS B 2 96  ? 8.485   24.775 15.808 1.000 37.314 ? 96  CYS HHH CA   1 
ATOM   1590 C  C    . CYS B 2 96  ? 9.777   24.483 15.018 1.000 36.446 ? 96  CYS HHH C    1 
ATOM   1591 O  O    . CYS B 2 96  ? 9.809   24.835 13.823 1.000 37.466 ? 96  CYS HHH O    1 
ATOM   1592 C  CB   . CYS B 2 96  ? 7.357   23.844 15.379 1.000 39.359 ? 96  CYS HHH CB   1 
ATOM   1593 S  SG   . CYS B 2 96  ? 7.575   22.154 15.976 1.000 44.785 ? 96  CYS HHH SG   1 
ATOM   1594 H  H    . CYS B 2 96  ? 7.380   26.180 14.909 1.000 36.396 ? 96  CYS HHH H    1 
ATOM   1595 H  HA   . CYS B 2 96  ? 8.650   24.680 16.775 1.000 37.240 ? 96  CYS HHH HA   1 
ATOM   1596 H  HB2  . CYS B 2 96  ? 6.507   24.189 15.720 1.000 40.238 ? 96  CYS HHH HB2  1 
ATOM   1597 H  HB3  . CYS B 2 96  ? 7.307   23.827 14.402 1.000 40.294 ? 96  CYS HHH HB3  1 
ATOM   1598 N  N    . VAL B 2 97  ? 10.812  23.884 15.622 1.000 35.028 ? 97  VAL HHH N    1 
ATOM   1599 C  CA   . VAL B 2 97  ? 12.046  23.457 14.881 1.000 34.785 ? 97  VAL HHH CA   1 
ATOM   1600 C  C    . VAL B 2 97  ? 12.700  22.246 15.573 1.000 34.132 ? 97  VAL HHH C    1 
ATOM   1601 O  O    . VAL B 2 97  ? 12.882  22.282 16.799 1.000 33.995 ? 97  VAL HHH O    1 
ATOM   1602 C  CB   . VAL B 2 97  ? 13.033  24.630 14.679 1.000 34.604 ? 97  VAL HHH CB   1 
ATOM   1603 C  CG1  . VAL B 2 97  ? 13.116  25.531 15.896 1.000 34.829 ? 97  VAL HHH CG1  1 
ATOM   1604 C  CG2  . VAL B 2 97  ? 14.420  24.168 14.261 1.000 34.713 ? 97  VAL HHH CG2  1 
ATOM   1605 H  H    . VAL B 2 97  ? 10.830  23.702 16.515 1.000 35.216 ? 97  VAL HHH H    1 
ATOM   1606 H  HA   . VAL B 2 97  ? 11.761  23.165 13.999 1.000 34.889 ? 97  VAL HHH HA   1 
ATOM   1607 H  HB   . VAL B 2 97  ? 12.674  25.178 13.937 1.000 34.602 ? 97  VAL HHH HB   1 
ATOM   1608 H  HG11 . VAL B 2 97  ? 12.346  26.126 15.913 1.000 34.421 ? 97  VAL HHH HG11 1 
ATOM   1609 H  HG12 . VAL B 2 97  ? 13.932  26.059 15.856 1.000 34.798 ? 97  VAL HHH HG12 1 
ATOM   1610 H  HG13 . VAL B 2 97  ? 13.122  24.987 16.702 1.000 34.726 ? 97  VAL HHH HG13 1 
ATOM   1611 H  HG21 . VAL B 2 97  ? 14.863  23.745 15.016 1.000 34.948 ? 97  VAL HHH HG21 1 
ATOM   1612 H  HG22 . VAL B 2 97  ? 14.943  24.933 13.967 1.000 34.928 ? 97  VAL HHH HG22 1 
ATOM   1613 H  HG23 . VAL B 2 97  ? 14.344  23.529 13.531 1.000 35.134 ? 97  VAL HHH HG23 1 
ATOM   1614 N  N    . ARG B 2 98  ? 13.062  21.219 14.797 1.000 33.821 ? 98  ARG HHH N    1 
ATOM   1615 C  CA   . ARG B 2 98  ? 13.549  19.915 15.320 1.000 33.980 ? 98  ARG HHH CA   1 
ATOM   1616 C  C    . ARG B 2 98  ? 15.009  20.056 15.758 1.000 34.127 ? 98  ARG HHH C    1 
ATOM   1617 O  O    . ARG B 2 98  ? 15.833  20.530 14.965 1.000 34.361 ? 98  ARG HHH O    1 
ATOM   1618 C  CB   . ARG B 2 98  ? 13.393  18.796 14.287 1.000 34.586 ? 98  ARG HHH CB   1 
ATOM   1619 C  CG   . ARG B 2 98  ? 13.215  17.421 14.918 1.000 35.281 ? 98  ARG HHH CG   1 
ATOM   1620 C  CD   . ARG B 2 98  ? 13.411  16.255 13.962 1.000 36.312 ? 98  ARG HHH CD   1 
ATOM   1621 N  NE   . ARG B 2 98  ? 14.781  16.171 13.479 1.000 37.225 ? 98  ARG HHH NE   1 
ATOM   1622 C  CZ   . ARG B 2 98  ? 15.251  15.226 12.674 1.000 38.118 ? 98  ARG HHH CZ   1 
ATOM   1623 N  NH1  . ARG B 2 98  ? 14.471  14.248 12.250 1.000 38.393 ? 98  ARG HHH NH1  1 
ATOM   1624 N  NH2  . ARG B 2 98  ? 16.518  15.264 12.303 1.000 39.256 ? 98  ARG HHH NH2  1 
ATOM   1625 H  H    . ARG B 2 98  ? 13.039  21.263 13.887 1.000 34.136 ? 98  ARG HHH H    1 
ATOM   1626 H  HA   . ARG B 2 98  ? 13.008  19.685 16.110 1.000 33.865 ? 98  ARG HHH HA   1 
ATOM   1627 H  HB2  . ARG B 2 98  ? 12.613  18.991 13.726 1.000 34.606 ? 98  ARG HHH HB2  1 
ATOM   1628 H  HB3  . ARG B 2 98  ? 14.185  18.785 13.710 1.000 35.025 ? 98  ARG HHH HB3  1 
ATOM   1629 H  HG2  . ARG B 2 98  ? 13.854  17.328 15.657 1.000 35.310 ? 98  ARG HHH HG2  1 
ATOM   1630 H  HG3  . ARG B 2 98  ? 12.314  17.363 15.300 1.000 35.064 ? 98  ARG HHH HG3  1 
ATOM   1631 H  HD2  . ARG B 2 98  ? 13.181  15.421 14.422 1.000 36.475 ? 98  ARG HHH HD2  1 
ATOM   1632 H  HD3  . ARG B 2 98  ? 12.804  16.357 13.198 1.000 36.422 ? 98  ARG HHH HD3  1 
ATOM   1633 H  HE   . ARG B 2 98  ? 15.336  16.795 13.731 1.000 37.036 ? 98  ARG HHH HE   1 
ATOM   1634 H  HH11 . ARG B 2 98  ? 13.628  14.218 12.493 1.000 38.121 ? 98  ARG HHH HH11 1 
ATOM   1635 H  HH12 . ARG B 2 98  ? 14.796  13.628 11.718 1.000 39.064 ? 98  ARG HHH HH12 1 
ATOM   1636 H  HH21 . ARG B 2 98  ? 17.041  15.913 12.586 1.000 38.942 ? 98  ARG HHH HH21 1 
ATOM   1637 H  HH22 . ARG B 2 98  ? 16.839  14.638 11.771 1.000 39.733 ? 98  ARG HHH HH22 1 
ATOM   1638 N  N    . GLY B 2 99  ? 15.301  19.629 16.986 1.000 34.283 ? 99  GLY HHH N    1 
ATOM   1639 C  CA   . GLY B 2 99  ? 16.606  19.796 17.644 1.000 34.685 ? 99  GLY HHH CA   1 
ATOM   1640 C  C    . GLY B 2 99  ? 17.526  18.617 17.395 1.000 35.389 ? 99  GLY HHH C    1 
ATOM   1641 O  O    . GLY B 2 99  ? 17.502  18.067 16.276 1.000 36.522 ? 99  GLY HHH O    1 
ATOM   1642 H  H    . GLY B 2 99  ? 14.689  19.194 17.500 1.000 34.156 ? 99  GLY HHH H    1 
ATOM   1643 H  HA2  . GLY B 2 99  ? 17.034  20.623 17.307 1.000 34.676 ? 99  GLY HHH HA2  1 
ATOM   1644 H  HA3  . GLY B 2 99  ? 16.461  19.899 18.615 1.000 34.613 ? 99  GLY HHH HA3  1 
ATOM   1645 N  N    . GLY B 2 100 ? 18.295  18.246 18.421 1.000 35.551 ? 100 GLY HHH N    1 
ATOM   1646 C  CA   . GLY B 2 100 ? 19.445  17.336 18.346 1.000 36.422 ? 100 GLY HHH CA   1 
ATOM   1647 C  C    . GLY B 2 100 ? 19.087  15.961 18.861 1.000 37.000 ? 100 GLY HHH C    1 
ATOM   1648 O  O    . GLY B 2 100 ? 18.074  15.825 19.567 1.000 36.048 ? 100 GLY HHH O    1 
ATOM   1649 H  H    . GLY B 2 100 ? 18.125  18.529 19.263 1.000 35.456 ? 100 GLY HHH H    1 
ATOM   1650 H  HA2  . GLY B 2 100 ? 19.747  17.269 17.408 1.000 36.766 ? 100 GLY HHH HA2  1 
ATOM   1651 H  HA3  . GLY B 2 100 ? 20.188  17.707 18.886 1.000 37.051 ? 100 GLY HHH HA3  1 
ATOM   1652 N  N    . SER B 2 101 ? 19.916  14.981 18.518 1.000 38.449 ? 101 SER HHH N    1 
ATOM   1653 C  CA   . SER B 2 101 ? 19.752  13.551 18.865 1.000 39.139 ? 101 SER HHH CA   1 
ATOM   1654 C  C    . SER B 2 101 ? 19.570  13.402 20.378 1.000 39.444 ? 101 SER HHH C    1 
ATOM   1655 O  O    . SER B 2 101 ? 20.359  13.983 21.143 1.000 39.624 ? 101 SER HHH O    1 
ATOM   1656 C  CB   . SER B 2 101 ? 20.932  12.768 18.366 1.000 40.772 ? 101 SER HHH CB   1 
ATOM   1657 O  OG   . SER B 2 101 ? 21.434  13.348 17.168 1.000 41.316 ? 101 SER HHH OG   1 
ATOM   1658 H  H    . SER B 2 101 ? 20.669  15.128 18.026 1.000 38.891 ? 101 SER HHH H    1 
ATOM   1659 H  HA   . SER B 2 101 ? 18.933  13.214 18.413 1.000 38.745 ? 101 SER HHH HA   1 
ATOM   1660 H  HB2  . SER B 2 101 ? 21.639  12.765 19.050 1.000 41.423 ? 101 SER HHH HB2  1 
ATOM   1661 H  HB3  . SER B 2 101 ? 20.663  11.838 18.196 1.000 40.939 ? 101 SER HHH HB3  1 
ATOM   1662 H  HG   . SER B 2 101 ? 22.025  12.935 16.901 0.000 30.000 ? 101 SER HHH HG   1 
ATOM   1663 N  N    . LEU B 2 102 ? 18.547  12.649 20.775 1.000 39.966 ? 102 LEU HHH N    1 
ATOM   1664 C  CA   . LEU B 2 102 ? 18.319  12.193 22.169 1.000 40.684 ? 102 LEU HHH CA   1 
ATOM   1665 C  C    . LEU B 2 102 ? 18.902  10.784 22.329 1.000 42.080 ? 102 LEU HHH C    1 
ATOM   1666 O  O    . LEU B 2 102 ? 18.726  10.187 23.394 1.000 42.043 ? 102 LEU HHH O    1 
ATOM   1667 C  CB   . LEU B 2 102 ? 16.815  12.241 22.432 1.000 39.660 ? 102 LEU HHH CB   1 
ATOM   1668 C  CG   . LEU B 2 102 ? 16.187  13.610 22.190 1.000 38.378 ? 102 LEU HHH CG   1 
ATOM   1669 C  CD1  . LEU B 2 102 ? 14.673  13.533 22.246 1.000 38.069 ? 102 LEU HHH CD1  1 
ATOM   1670 C  CD2  . LEU B 2 102 ? 16.711  14.615 23.201 1.000 38.643 ? 102 LEU HHH CD2  1 
ATOM   1671 H  H    . LEU B 2 102 ? 17.906  12.360 20.196 1.000 39.450 ? 102 LEU HHH H    1 
ATOM   1672 H  HA   . LEU B 2 102 ? 18.786  12.804 22.785 1.000 40.934 ? 102 LEU HHH HA   1 
ATOM   1673 H  HB2  . LEU B 2 102 ? 16.376  11.586 21.853 1.000 39.511 ? 102 LEU HHH HB2  1 
ATOM   1674 H  HB3  . LEU B 2 102 ? 16.651  11.978 23.359 1.000 40.026 ? 102 LEU HHH HB3  1 
ATOM   1675 H  HG   . LEU B 2 102 ? 16.446  13.917 21.287 1.000 38.214 ? 102 LEU HHH HG   1 
ATOM   1676 H  HD11 . LEU B 2 102 ? 14.347  13.008 21.495 1.000 37.874 ? 102 LEU HHH HD11 1 
ATOM   1677 H  HD12 . LEU B 2 102 ? 14.299  14.430 22.200 1.000 37.540 ? 102 LEU HHH HD12 1 
ATOM   1678 H  HD13 . LEU B 2 102 ? 14.400  13.111 23.079 1.000 38.398 ? 102 LEU HHH HD13 1 
ATOM   1679 H  HD21 . LEU B 2 102 ? 16.686  14.224 24.091 1.000 39.190 ? 102 LEU HHH HD21 1 
ATOM   1680 H  HD22 . LEU B 2 102 ? 16.156  15.414 23.183 1.000 38.104 ? 102 LEU HHH HD22 1 
ATOM   1681 H  HD23 . LEU B 2 102 ? 17.627  14.853 22.977 1.000 38.944 ? 102 LEU HHH HD23 1 
ATOM   1682 N  N    . GLY B 2 103 ? 19.577  10.294 21.287 1.000 43.864 ? 103 GLY HHH N    1 
ATOM   1683 C  CA   . GLY B 2 103 ? 20.384  9.061  21.302 1.000 46.467 ? 103 GLY HHH CA   1 
ATOM   1684 C  C    . GLY B 2 103 ? 21.691  9.258  20.555 1.000 48.495 ? 103 GLY HHH C    1 
ATOM   1685 O  O    . GLY B 2 103 ? 22.005  10.423 20.222 1.000 48.392 ? 103 GLY HHH O    1 
ATOM   1686 H  H    . GLY B 2 103 ? 19.562  10.696 20.472 1.000 43.470 ? 103 GLY HHH H    1 
ATOM   1687 H  HA2  . GLY B 2 103 ? 20.575  8.806  22.239 1.000 46.923 ? 103 GLY HHH HA2  1 
ATOM   1688 H  HA3  . GLY B 2 103 ? 19.868  8.330  20.878 1.000 46.271 ? 103 GLY HHH HA3  1 
ATOM   1689 N  N    . ILE B 2 104 ? 22.411  8.161  20.289 1.000 50.808 ? 104 ILE HHH N    1 
ATOM   1690 C  CA   . ILE B 2 104 ? 23.771  8.148  19.667 1.000 53.068 ? 104 ILE HHH CA   1 
ATOM   1691 C  C    . ILE B 2 104 ? 23.614  7.932  18.154 1.000 52.688 ? 104 ILE HHH C    1 
ATOM   1692 O  O    . ILE B 2 104 ? 23.626  6.764  17.703 1.000 53.782 ? 104 ILE HHH O    1 
ATOM   1693 C  CB   . ILE B 2 104 ? 24.668  7.080  20.340 1.000 55.548 ? 104 ILE HHH CB   1 
ATOM   1694 C  CG1  . ILE B 2 104 ? 24.711  7.252  21.864 1.000 56.101 ? 104 ILE HHH CG1  1 
ATOM   1695 C  CG2  . ILE B 2 104 ? 26.068  7.069  19.732 1.000 56.860 ? 104 ILE HHH CG2  1 
ATOM   1696 C  CD1  . ILE B 2 104 ? 25.159  8.631  22.334 1.000 55.932 ? 104 ILE HHH CD1  1 
ATOM   1697 H  H    . ILE B 2 104 ? 22.101  7.325  20.478 1.000 50.923 ? 104 ILE HHH H    1 
ATOM   1698 H  HA   . ILE B 2 104 ? 24.180  9.020  19.810 1.000 53.027 ? 104 ILE HHH HA   1 
ATOM   1699 H  HB   . ILE B 2 104 ? 24.260  6.198  20.159 1.000 55.362 ? 104 ILE HHH HB   1 
ATOM   1700 H  HG12 . ILE B 2 104 ? 23.816  7.074  22.225 1.000 55.225 ? 104 ILE HHH HG12 1 
ATOM   1701 H  HG13 . ILE B 2 104 ? 25.322  6.582  22.238 1.000 57.146 ? 104 ILE HHH HG13 1 
ATOM   1702 H  HG21 . ILE B 2 104 ? 26.054  6.587  18.888 1.000 57.106 ? 104 ILE HHH HG21 1 
ATOM   1703 H  HG22 . ILE B 2 104 ? 26.686  6.631  20.343 1.000 58.028 ? 104 ILE HHH HG22 1 
ATOM   1704 H  HG23 . ILE B 2 104 ? 26.364  7.983  19.577 1.000 56.842 ? 104 ILE HHH HG23 1 
ATOM   1705 H  HD11 . ILE B 2 104 ? 25.940  8.911  21.826 1.000 56.644 ? 104 ILE HHH HD11 1 
ATOM   1706 H  HD12 . ILE B 2 104 ? 25.384  8.595  23.279 1.000 56.627 ? 104 ILE HHH HD12 1 
ATOM   1707 H  HD13 . ILE B 2 104 ? 24.439  9.272  22.198 1.000 54.844 ? 104 ILE HHH HD13 1 
ATOM   1708 N  N    . PHE B 2 105 ? 23.463  9.030  17.406 1.000 51.315 ? 105 PHE HHH N    1 
ATOM   1709 C  CA   . PHE B 2 105 ? 23.260  9.055  15.932 1.000 50.476 ? 105 PHE HHH CA   1 
ATOM   1710 C  C    . PHE B 2 105 ? 23.202  10.508 15.448 1.000 48.699 ? 105 PHE HHH C    1 
ATOM   1711 O  O    . PHE B 2 105 ? 22.814  11.377 16.239 1.000 47.561 ? 105 PHE HHH O    1 
ATOM   1712 C  CB   . PHE B 2 105 ? 21.985  8.295  15.548 1.000 49.475 ? 105 PHE HHH CB   1 
ATOM   1713 C  CG   . PHE B 2 105 ? 20.763  8.638  16.363 1.000 47.744 ? 105 PHE HHH CG   1 
ATOM   1714 C  CD1  . PHE B 2 105 ? 20.094  9.840  16.176 1.000 46.113 ? 105 PHE HHH CD1  1 
ATOM   1715 C  CD2  . PHE B 2 105 ? 20.265  7.747  17.304 1.000 47.786 ? 105 PHE HHH CD2  1 
ATOM   1716 C  CE1  . PHE B 2 105 ? 18.964  10.148 16.917 1.000 44.791 ? 105 PHE HHH CE1  1 
ATOM   1717 C  CE2  . PHE B 2 105 ? 19.138  8.060  18.048 1.000 46.595 ? 105 PHE HHH CE2  1 
ATOM   1718 C  CZ   . PHE B 2 105 ? 18.491  9.261  17.854 1.000 45.081 ? 105 PHE HHH CZ   1 
ATOM   1719 H  H    . PHE B 2 105 ? 23.474  9.869  17.763 1.000 50.885 ? 105 PHE HHH H    1 
ATOM   1720 H  HA   . PHE B 2 105 ? 24.034  8.612  15.499 1.000 51.468 ? 105 PHE HHH HA   1 
ATOM   1721 H  HB2  . PHE B 2 105 ? 21.793  8.478  14.604 1.000 49.427 ? 105 PHE HHH HB2  1 
ATOM   1722 H  HB3  . PHE B 2 105 ? 22.161  7.335  15.633 1.000 50.113 ? 105 PHE HHH HB3  1 
ATOM   1723 H  HD1  . PHE B 2 105 ? 20.413  10.454 15.535 1.000 46.249 ? 105 PHE HHH HD1  1 
ATOM   1724 H  HD2  . PHE B 2 105 ? 20.706  6.924  17.444 1.000 48.465 ? 105 PHE HHH HD2  1 
ATOM   1725 H  HE1  . PHE B 2 105 ? 18.524  10.972 16.783 1.000 44.300 ? 105 PHE HHH HE1  1 
ATOM   1726 H  HE2  . PHE B 2 105 ? 18.814  7.448  18.689 1.000 46.629 ? 105 PHE HHH HE2  1 
ATOM   1727 H  HZ   . PHE B 2 105 ? 17.722  9.471  18.360 1.000 44.627 ? 105 PHE HHH HZ   1 
ATOM   1728 N  N    . GLY B 2 106 ? 23.563  10.749 14.185 1.000 48.494 ? 106 GLY HHH N    1 
ATOM   1729 C  CA   . GLY B 2 106 ? 23.570  12.086 13.563 1.000 47.741 ? 106 GLY HHH CA   1 
ATOM   1730 C  C    . GLY B 2 106 ? 22.301  12.362 12.773 1.000 46.110 ? 106 GLY HHH C    1 
ATOM   1731 O  O    . GLY B 2 106 ? 21.222  11.909 13.197 1.000 43.554 ? 106 GLY HHH O    1 
ATOM   1732 H  H    . GLY B 2 106 ? 23.831  10.081 13.626 1.000 49.393 ? 106 GLY HHH H    1 
ATOM   1733 H  HA2  . GLY B 2 106 ? 23.671  12.772 14.271 1.000 47.279 ? 106 GLY HHH HA2  1 
ATOM   1734 H  HA3  . GLY B 2 106 ? 24.353  12.154 12.961 1.000 48.712 ? 106 GLY HHH HA3  1 
ATOM   1735 N  N    . GLY B 2 107 ? 22.437  13.080 11.652 1.000 46.953 ? 107 GLY HHH N    1 
ATOM   1736 C  CA   . GLY B 2 107 ? 21.314  13.582 10.834 1.000 46.165 ? 107 GLY HHH CA   1 
ATOM   1737 C  C    . GLY B 2 107 ? 20.399  14.481 11.650 1.000 44.651 ? 107 GLY HHH C    1 
ATOM   1738 O  O    . GLY B 2 107 ? 19.190  14.496 11.373 1.000 44.268 ? 107 GLY HHH O    1 
ATOM   1739 H  H    . GLY B 2 107 ? 23.256  13.306 11.323 1.000 47.689 ? 107 GLY HHH H    1 
ATOM   1740 H  HA2  . GLY B 2 107 ? 21.674  14.089 10.064 1.000 46.704 ? 107 GLY HHH HA2  1 
ATOM   1741 H  HA3  . GLY B 2 107 ? 20.797  12.813 10.486 1.000 46.307 ? 107 GLY HHH HA3  1 
ATOM   1742 N  N    . SER B 2 108 ? 20.970  15.217 12.609 1.000 44.398 ? 108 SER HHH N    1 
ATOM   1743 C  CA   . SER B 2 108 ? 20.267  16.079 13.596 1.000 42.451 ? 108 SER HHH CA   1 
ATOM   1744 C  C    . SER B 2 108 ? 20.013  17.466 12.989 1.000 41.241 ? 108 SER HHH C    1 
ATOM   1745 O  O    . SER B 2 108 ? 20.286  18.469 13.668 1.000 40.618 ? 108 SER HHH O    1 
ATOM   1746 C  CB   . SER B 2 108 ? 21.070  16.169 14.877 1.000 42.478 ? 108 SER HHH CB   1 
ATOM   1747 O  OG   . SER B 2 108 ? 22.359  16.718 14.629 1.000 43.602 ? 108 SER HHH OG   1 
ATOM   1748 H  H    . SER B 2 108 ? 21.874  15.254 12.719 1.000 44.953 ? 108 SER HHH H    1 
ATOM   1749 H  HA   . SER B 2 108 ? 19.389  15.662 13.800 1.000 41.829 ? 108 SER HHH HA   1 
ATOM   1750 H  HB2  . SER B 2 108 ? 20.592  16.732 15.523 1.000 41.847 ? 108 SER HHH HB2  1 
ATOM   1751 H  HB3  . SER B 2 108 ? 21.166  15.270 15.266 1.000 42.900 ? 108 SER HHH HB3  1 
ATOM   1752 H  HG   . SER B 2 108 ? 22.754  16.812 15.401 0.000 30.000 ? 108 SER HHH HG   1 
ATOM   1753 N  N    . VAL B 2 109 ? 19.484  17.531 11.766 1.000 40.605 ? 109 VAL HHH N    1 
ATOM   1754 C  CA   . VAL B 2 109 ? 19.314  18.826 11.042 1.000 40.028 ? 109 VAL HHH CA   1 
ATOM   1755 C  C    . VAL B 2 109 ? 18.079  19.539 11.619 1.000 38.507 ? 109 VAL HHH C    1 
ATOM   1756 O  O    . VAL B 2 109 ? 17.153  18.853 12.133 1.000 37.370 ? 109 VAL HHH O    1 
ATOM   1757 C  CB   . VAL B 2 109 ? 19.307  18.699 9.496  1.000 40.901 ? 109 VAL HHH CB   1 
ATOM   1758 C  CG1  . VAL B 2 109 ? 19.212  17.269 8.984  1.000 41.426 ? 109 VAL HHH CG1  1 
ATOM   1759 C  CG2  . VAL B 2 109 ? 18.250  19.569 8.828  1.000 40.545 ? 109 VAL HHH CG2  1 
ATOM   1760 H  H    . VAL B 2 109 ? 19.153  16.808 11.332 1.000 40.938 ? 109 VAL HHH H    1 
ATOM   1761 H  HA   . VAL B 2 109 ? 20.085  19.375 11.270 1.000 40.328 ? 109 VAL HHH HA   1 
ATOM   1762 H  HB   . VAL B 2 109 ? 20.182  19.045 9.193  1.000 41.609 ? 109 VAL HHH HB   1 
ATOM   1763 H  HG11 . VAL B 2 109 ? 19.991  16.765 9.278  1.000 42.082 ? 109 VAL HHH HG11 1 
ATOM   1764 H  HG12 . VAL B 2 109 ? 19.181  17.276 8.012  1.000 42.186 ? 109 VAL HHH HG12 1 
ATOM   1765 H  HG13 . VAL B 2 109 ? 18.404  16.851 9.329  1.000 40.936 ? 109 VAL HHH HG13 1 
ATOM   1766 H  HG21 . VAL B 2 109 ? 17.363  19.258 9.078  1.000 39.922 ? 109 VAL HHH HG21 1 
ATOM   1767 H  HG22 . VAL B 2 109 ? 18.350  19.514 7.862  1.000 41.247 ? 109 VAL HHH HG22 1 
ATOM   1768 H  HG23 . VAL B 2 109 ? 18.362  20.493 9.109  1.000 40.064 ? 109 VAL HHH HG23 1 
ATOM   1769 N  N    . GLY B 2 110 ? 18.132  20.876 11.605 1.000 37.871 ? 110 GLY HHH N    1 
ATOM   1770 C  CA   . GLY B 2 110 ? 17.067  21.784 12.062 1.000 36.445 ? 110 GLY HHH CA   1 
ATOM   1771 C  C    . GLY B 2 110 ? 16.020  21.983 10.982 1.000 36.209 ? 110 GLY HHH C    1 
ATOM   1772 O  O    . GLY B 2 110 ? 16.181  22.909 10.164 1.000 36.930 ? 110 GLY HHH O    1 
ATOM   1773 H  H    . GLY B 2 110 ? 18.865  21.318 11.294 1.000 38.328 ? 110 GLY HHH H    1 
ATOM   1774 H  HA2  . GLY B 2 110 ? 16.641  21.405 12.868 1.000 36.095 ? 110 GLY HHH HA2  1 
ATOM   1775 H  HA3  . GLY B 2 110 ? 17.466  22.658 12.301 1.000 36.402 ? 110 GLY HHH HA3  1 
ATOM   1776 N  N    . TYR B 2 111 ? 15.009  21.111 10.959 1.000 35.287 ? 111 TYR HHH N    1 
ATOM   1777 C  CA   . TYR B 2 111 ? 13.790  21.237 10.123 1.000 34.353 ? 111 TYR HHH CA   1 
ATOM   1778 C  C    . TYR B 2 111 ? 12.821  22.156 10.864 1.000 33.059 ? 111 TYR HHH C    1 
ATOM   1779 O  O    . TYR B 2 111 ? 12.601  21.928 12.066 1.000 32.080 ? 111 TYR HHH O    1 
ATOM   1780 C  CB   . TYR B 2 111 ? 13.155  19.870 9.854  1.000 34.930 ? 111 TYR HHH CB   1 
ATOM   1781 C  CG   . TYR B 2 111 ? 14.060  18.857 9.199  1.000 35.831 ? 111 TYR HHH CG   1 
ATOM   1782 C  CD1  . TYR B 2 111 ? 14.415  18.973 7.865  1.000 36.583 ? 111 TYR HHH CD1  1 
ATOM   1783 C  CD2  . TYR B 2 111 ? 14.563  17.776 9.910  1.000 35.838 ? 111 TYR HHH CD2  1 
ATOM   1784 C  CE1  . TYR B 2 111 ? 15.246  18.046 7.257  1.000 37.850 ? 111 TYR HHH CE1  1 
ATOM   1785 C  CE2  . TYR B 2 111 ? 15.394  16.840 9.316  1.000 36.654 ? 111 TYR HHH CE2  1 
ATOM   1786 C  CZ   . TYR B 2 111 ? 15.735  16.973 7.981  1.000 37.730 ? 111 TYR HHH CZ   1 
ATOM   1787 O  OH   . TYR B 2 111 ? 16.555  16.062 7.378  1.000 38.962 ? 111 TYR HHH OH   1 
ATOM   1788 H  H    . TYR B 2 111 ? 14.996  20.360 11.474 1.000 35.231 ? 111 TYR HHH H    1 
ATOM   1789 H  HA   . TYR B 2 111 ? 14.034  21.656 9.259  1.000 34.923 ? 111 TYR HHH HA   1 
ATOM   1790 H  HB2  . TYR B 2 111 ? 12.841  19.506 10.708 1.000 34.484 ? 111 TYR HHH HB2  1 
ATOM   1791 H  HB3  . TYR B 2 111 ? 12.370  20.005 9.283  1.000 35.068 ? 111 TYR HHH HB3  1 
ATOM   1792 H  HD1  . TYR B 2 111 ? 14.086  19.699 7.361  1.000 36.704 ? 111 TYR HHH HD1  1 
ATOM   1793 H  HD2  . TYR B 2 111 ? 14.334  17.676 10.820 1.000 35.272 ? 111 TYR HHH HD2  1 
ATOM   1794 H  HE1  . TYR B 2 111 ? 15.475  18.143 6.347  1.000 38.590 ? 111 TYR HHH HE1  1 
ATOM   1795 H  HE2  . TYR B 2 111 ? 15.724  16.113 9.817  1.000 36.849 ? 111 TYR HHH HE2  1 
ATOM   1796 H  HH   . TYR B 2 111 ? 17.242  16.444 7.155  0.000 30.000 ? 111 TYR HHH HH   1 
ATOM   1797 N  N    . TRP B 2 112 ? 12.283  23.157 10.162 1.000 32.649 ? 112 TRP HHH N    1 
ATOM   1798 C  CA   . TRP B 2 112 ? 11.391  24.213 10.704 1.000 31.385 ? 112 TRP HHH CA   1 
ATOM   1799 C  C    . TRP B 2 112 ? 9.958   23.957 10.238 1.000 31.934 ? 112 TRP HHH C    1 
ATOM   1800 O  O    . TRP B 2 112 ? 9.780   23.533 9.081  1.000 32.940 ? 112 TRP HHH O    1 
ATOM   1801 C  CB   . TRP B 2 112 ? 11.869  25.595 10.247 1.000 31.229 ? 112 TRP HHH CB   1 
ATOM   1802 C  CG   . TRP B 2 112 ? 13.205  25.996 10.793 1.000 30.937 ? 112 TRP HHH CG   1 
ATOM   1803 C  CD1  . TRP B 2 112 ? 14.423  25.495 10.436 1.000 31.462 ? 112 TRP HHH CD1  1 
ATOM   1804 C  CD2  . TRP B 2 112 ? 13.462  27.002 11.789 1.000 30.172 ? 112 TRP HHH CD2  1 
ATOM   1805 N  NE1  . TRP B 2 112 ? 15.417  26.101 11.157 1.000 31.283 ? 112 TRP HHH NE1  1 
ATOM   1806 C  CE2  . TRP B 2 112 ? 14.860  27.036 11.989 1.000 30.387 ? 112 TRP HHH CE2  1 
ATOM   1807 C  CE3  . TRP B 2 112 ? 12.652  27.868 12.531 1.000 29.494 ? 112 TRP HHH CE3  1 
ATOM   1808 C  CZ2  . TRP B 2 112 ? 15.459  27.898 12.904 1.000 29.961 ? 112 TRP HHH CZ2  1 
ATOM   1809 C  CZ3  . TRP B 2 112 ? 13.247  28.724 13.432 1.000 29.392 ? 112 TRP HHH CZ3  1 
ATOM   1810 C  CH2  . TRP B 2 112 ? 14.631  28.734 13.617 1.000 29.480 ? 112 TRP HHH CH2  1 
ATOM   1811 H  H    . TRP B 2 112 ? 12.434  23.258 9.269  1.000 33.110 ? 112 TRP HHH H    1 
ATOM   1812 H  HA   . TRP B 2 112 ? 11.426  24.180 11.688 1.000 31.103 ? 112 TRP HHH HA   1 
ATOM   1813 H  HB2  . TRP B 2 112 ? 11.909  25.598 9.269  1.000 31.772 ? 112 TRP HHH HB2  1 
ATOM   1814 H  HB3  . TRP B 2 112 ? 11.201  26.257 10.520 1.000 30.885 ? 112 TRP HHH HB3  1 
ATOM   1815 H  HD1  . TRP B 2 112 ? 14.564  24.812 9.800  1.000 31.980 ? 112 TRP HHH HD1  1 
ATOM   1816 H  HE1  . TRP B 2 112 ? 16.270  25.927 11.085 1.000 31.709 ? 112 TRP HHH HE1  1 
ATOM   1817 H  HE3  . TRP B 2 112 ? 11.715  27.862 12.419 1.000 29.451 ? 112 TRP HHH HE3  1 
ATOM   1818 H  HZ2  . TRP B 2 112 ? 16.391  27.911 13.023 1.000 30.498 ? 112 TRP HHH HZ2  1 
ATOM   1819 H  HZ3  . TRP B 2 112 ? 12.709  29.310 13.941 1.000 29.014 ? 112 TRP HHH HZ3  1 
ATOM   1820 H  HH2  . TRP B 2 112 ? 15.008  29.332 14.237 1.000 29.532 ? 112 TRP HHH HH2  1 
ATOM   1821 N  N    . GLY B 2 113 ? 8.980   24.211 11.111 1.000 31.552 ? 113 GLY HHH N    1 
ATOM   1822 C  CA   . GLY B 2 113 ? 7.577   24.418 10.718 1.000 32.025 ? 113 GLY HHH CA   1 
ATOM   1823 C  C    . GLY B 2 113 ? 7.449   25.673 9.874  1.000 32.626 ? 113 GLY HHH C    1 
ATOM   1824 O  O    . GLY B 2 113 ? 8.404   26.477 9.850  1.000 31.661 ? 113 GLY HHH O    1 
ATOM   1825 H  H    . GLY B 2 113 ? 9.130   24.270 12.008 1.000 31.149 ? 113 GLY HHH H    1 
ATOM   1826 H  HA2  . GLY B 2 113 ? 7.266   23.637 10.199 1.000 32.695 ? 113 GLY HHH HA2  1 
ATOM   1827 H  HA3  . GLY B 2 113 ? 7.018   24.500 11.528 1.000 31.879 ? 113 GLY HHH HA3  1 
ATOM   1828 N  N    . GLN B 2 114 ? 6.314   25.841 9.193  1.000 34.244 ? 114 GLN HHH N    1 
ATOM   1829 C  CA   . GLN B 2 114 ? 6.054   27.007 8.307  1.000 35.185 ? 114 GLN HHH CA   1 
ATOM   1830 C  C    . GLN B 2 114 ? 5.963   28.276 9.172  1.000 34.506 ? 114 GLN HHH C    1 
ATOM   1831 O  O    . GLN B 2 114 ? 6.039   29.386 8.605  1.000 34.931 ? 114 GLN HHH O    1 
ATOM   1832 C  CB   . GLN B 2 114 ? 4.813   26.761 7.438  1.000 36.581 ? 114 GLN HHH CB   1 
ATOM   1833 C  CG   . GLN B 2 114 ? 3.477   26.908 8.160  1.000 37.036 ? 114 GLN HHH CG   1 
ATOM   1834 C  CD   . GLN B 2 114 ? 3.041   25.678 8.919  1.000 37.386 ? 114 GLN HHH CD   1 
ATOM   1835 O  OE1  . GLN B 2 114 ? 3.814   24.742 9.134  1.000 37.958 ? 114 GLN HHH OE1  1 
ATOM   1836 N  NE2  . GLN B 2 114 ? 1.786   25.675 9.337  1.000 37.393 ? 114 GLN HHH NE2  1 
ATOM   1837 H  H    . GLN B 2 114 ? 5.632   25.241 9.228  1.000 34.552 ? 114 GLN HHH H    1 
ATOM   1838 H  HA   . GLN B 2 114 ? 6.830   27.105 7.709  1.000 35.270 ? 114 GLN HHH HA   1 
ATOM   1839 H  HB2  . GLN B 2 114 ? 4.836   27.391 6.688  1.000 37.024 ? 114 GLN HHH HB2  1 
ATOM   1840 H  HB3  . GLN B 2 114 ? 4.875   25.857 7.064  1.000 37.102 ? 114 GLN HHH HB3  1 
ATOM   1841 H  HG2  . GLN B 2 114 ? 3.532   27.658 8.784  1.000 36.415 ? 114 GLN HHH HG2  1 
ATOM   1842 H  HG3  . GLN B 2 114 ? 2.786   27.127 7.499  1.000 37.872 ? 114 GLN HHH HG3  1 
ATOM   1843 H  HE21 . GLN B 2 114 ? 1.473   25.048 9.885  0.000 30.000 ? 114 GLN HHH HE21 1 
ATOM   1844 H  HE22 . GLN B 2 114 ? 1.263   26.400 9.199  0.000 30.000 ? 114 GLN HHH HE22 1 
ATOM   1845 N  N    . GLY B 2 115 ? 5.848   28.112 10.492 1.000 33.495 ? 115 GLY HHH N    1 
ATOM   1846 C  CA   . GLY B 2 115 ? 5.650   29.209 11.453 1.000 33.194 ? 115 GLY HHH CA   1 
ATOM   1847 C  C    . GLY B 2 115 ? 4.176   29.362 11.748 1.000 33.935 ? 115 GLY HHH C    1 
ATOM   1848 O  O    . GLY B 2 115 ? 3.382   28.847 10.959 1.000 35.292 ? 115 GLY HHH O    1 
ATOM   1849 H  H    . GLY B 2 115 ? 5.858   27.292 10.883 1.000 33.609 ? 115 GLY HHH H    1 
ATOM   1850 H  HA2  . GLY B 2 115 ? 6.139   29.005 12.289 1.000 32.741 ? 115 GLY HHH HA2  1 
ATOM   1851 H  HA3  . GLY B 2 115 ? 6.005   30.051 11.073 1.000 33.102 ? 115 GLY HHH HA3  1 
ATOM   1852 N  N    . ALA B 2 116 ? 3.825   30.017 12.854 1.000 34.466 ? 116 ALA HHH N    1 
ATOM   1853 C  CA   . ALA B 2 116 ? 2.430   30.243 13.301 1.000 35.570 ? 116 ALA HHH CA   1 
ATOM   1854 C  C    . ALA B 2 116 ? 2.298   31.664 13.858 1.000 35.788 ? 116 ALA HHH C    1 
ATOM   1855 O  O    . ALA B 2 116 ? 2.849   31.927 14.944 1.000 35.490 ? 116 ALA HHH O    1 
ATOM   1856 C  CB   . ALA B 2 116 ? 2.046   29.207 14.327 1.000 35.676 ? 116 ALA HHH CB   1 
ATOM   1857 H  H    . ALA B 2 116 ? 4.434   30.376 13.429 1.000 33.877 ? 116 ALA HHH H    1 
ATOM   1858 H  HA   . ALA B 2 116 ? 1.833   30.154 12.523 1.000 36.199 ? 116 ALA HHH HA   1 
ATOM   1859 H  HB1  . ALA B 2 116 ? 1.154   29.396 14.662 1.000 36.257 ? 116 ALA HHH HB1  1 
ATOM   1860 H  HB2  . ALA B 2 116 ? 2.057   28.325 13.919 1.000 35.917 ? 116 ALA HHH HB2  1 
ATOM   1861 H  HB3  . ALA B 2 116 ? 2.679   29.229 15.064 1.000 35.181 ? 116 ALA HHH HB3  1 
ATOM   1862 N  N    . LEU B 2 117 ? 1.607   32.544 13.130 1.000 37.179 ? 117 LEU HHH N    1 
ATOM   1863 C  CA   . LEU B 2 117 ? 1.454   33.980 13.490 1.000 37.835 ? 117 LEU HHH CA   1 
ATOM   1864 C  C    . LEU B 2 117 ? 0.495   34.110 14.679 1.000 38.075 ? 117 LEU HHH C    1 
ATOM   1865 O  O    . LEU B 2 117 ? -0.674  33.699 14.557 1.000 38.660 ? 117 LEU HHH O    1 
ATOM   1866 C  CB   . LEU B 2 117 ? 0.929   34.760 12.281 1.000 39.059 ? 117 LEU HHH CB   1 
ATOM   1867 C  CG   . LEU B 2 117 ? 0.994   36.282 12.409 1.000 39.275 ? 117 LEU HHH CG   1 
ATOM   1868 C  CD1  . LEU B 2 117 ? 2.314   36.818 11.869 1.000 38.518 ? 117 LEU HHH CD1  1 
ATOM   1869 C  CD2  . LEU B 2 117 ? -0.184  36.931 11.695 1.000 40.515 ? 117 LEU HHH CD2  1 
ATOM   1870 H  H    . LEU B 2 117 ? 1.180   32.312 12.359 1.000 37.695 ? 117 LEU HHH H    1 
ATOM   1871 H  HA   . LEU B 2 117 ? 2.336   34.332 13.751 1.000 37.098 ? 117 LEU HHH HA   1 
ATOM   1872 H  HB2  . LEU B 2 117 ? 1.446   34.493 11.494 1.000 38.900 ? 117 LEU HHH HB2  1 
ATOM   1873 H  HB3  . LEU B 2 117 ? -0.000  34.500 12.125 1.000 39.799 ? 117 LEU HHH HB3  1 
ATOM   1874 H  HG   . LEU B 2 117 ? 0.938   36.515 13.368 1.000 39.044 ? 117 LEU HHH HG   1 
ATOM   1875 H  HD11 . LEU B 2 117 ? 3.054   36.379 12.325 1.000 37.950 ? 117 LEU HHH HD11 1 
ATOM   1876 H  HD12 . LEU B 2 117 ? 2.363   37.778 12.023 1.000 38.470 ? 117 LEU HHH HD12 1 
ATOM   1877 H  HD13 . LEU B 2 117 ? 2.371   36.640 10.914 1.000 38.827 ? 117 LEU HHH HD13 1 
ATOM   1878 H  HD21 . LEU B 2 117 ? -0.212  36.627 10.771 1.000 40.856 ? 117 LEU HHH HD21 1 
ATOM   1879 H  HD22 . LEU B 2 117 ? -0.082  37.899 11.714 1.000 40.410 ? 117 LEU HHH HD22 1 
ATOM   1880 H  HD23 . LEU B 2 117 ? -1.012  36.684 12.142 1.000 41.072 ? 117 LEU HHH HD23 1 
ATOM   1881 N  N    . VAL B 2 118 ? 0.975   34.661 15.789 1.000 37.799 ? 118 VAL HHH N    1 
ATOM   1882 C  CA   . VAL B 2 118 ? 0.126   34.994 16.968 1.000 39.153 ? 118 VAL HHH CA   1 
ATOM   1883 C  C    . VAL B 2 118 ? 0.093   36.517 17.123 1.000 39.573 ? 118 VAL HHH C    1 
ATOM   1884 O  O    . VAL B 2 118 ? 1.117   37.102 17.536 1.000 38.295 ? 118 VAL HHH O    1 
ATOM   1885 C  CB   . VAL B 2 118 ? 0.620   34.297 18.248 1.000 38.875 ? 118 VAL HHH CB   1 
ATOM   1886 C  CG1  . VAL B 2 118 ? -0.199  34.712 19.460 1.000 40.123 ? 118 VAL HHH CG1  1 
ATOM   1887 C  CG2  . VAL B 2 118 ? 0.615   32.787 18.091 1.000 38.670 ? 118 VAL HHH CG2  1 
ATOM   1888 H  H    . VAL B 2 118 ? 1.855   34.869 15.900 1.000 37.294 ? 118 VAL HHH H    1 
ATOM   1889 H  HA   . VAL B 2 118 ? -0.778  34.686 16.787 1.000 39.841 ? 118 VAL HHH HA   1 
ATOM   1890 H  HB   . VAL B 2 118 ? 1.554   34.582 18.400 1.000 38.241 ? 118 VAL HHH HB   1 
ATOM   1891 H  HG11 . VAL B 2 118 ? 0.095   35.588 19.767 1.000 39.900 ? 118 VAL HHH HG11 1 
ATOM   1892 H  HG12 . VAL B 2 118 ? -0.078  34.063 20.175 1.000 40.134 ? 118 VAL HHH HG12 1 
ATOM   1893 H  HG13 . VAL B 2 118 ? -1.140  34.754 19.218 1.000 40.783 ? 118 VAL HHH HG13 1 
ATOM   1894 H  HG21 . VAL B 2 118 ? -0.244  32.500 17.736 1.000 39.397 ? 118 VAL HHH HG21 1 
ATOM   1895 H  HG22 . VAL B 2 118 ? 0.763   32.372 18.957 1.000 38.776 ? 118 VAL HHH HG22 1 
ATOM   1896 H  HG23 . VAL B 2 118 ? 1.323   32.522 17.479 1.000 38.144 ? 118 VAL HHH HG23 1 
ATOM   1897 N  N    . SER B 2 119 ? -1.043  37.122 16.781 1.000 40.677 ? 119 SER HHH N    1 
ATOM   1898 C  CA   . SER B 2 119 ? -1.342  38.553 17.029 1.000 41.224 ? 119 SER HHH CA   1 
ATOM   1899 C  C    . SER B 2 119 ? -2.249  38.663 18.259 1.000 42.224 ? 119 SER HHH C    1 
ATOM   1900 O  O    . SER B 2 119 ? -3.248  37.914 18.332 1.000 42.921 ? 119 SER HHH O    1 
ATOM   1901 C  CB   . SER B 2 119 ? -1.964  39.191 15.819 1.000 41.987 ? 119 SER HHH CB   1 
ATOM   1902 O  OG   . SER B 2 119 ? -1.750  40.593 15.838 1.000 42.190 ? 119 SER HHH OG   1 
ATOM   1903 H  H    . SER B 2 119 ? -1.729  36.695 16.361 1.000 41.280 ? 119 SER HHH H    1 
ATOM   1904 H  HA   . SER B 2 119 ? -0.489  39.018 17.226 1.000 40.528 ? 119 SER HHH HA   1 
ATOM   1905 H  HB2  . SER B 2 119 ? -1.567  38.808 15.004 1.000 41.620 ? 119 SER HHH HB2  1 
ATOM   1906 H  HB3  . SER B 2 119 ? -2.929  39.005 15.809 1.000 42.969 ? 119 SER HHH HB3  1 
ATOM   1907 H  HG   . SER B 2 119 ? -2.298  40.929 15.199 0.000 30.000 ? 119 SER HHH HG   1 
ATOM   1908 N  N    . VAL B 2 120 ? -1.878  39.532 19.202 1.000 41.985 ? 120 VAL HHH N    1 
ATOM   1909 C  CA   . VAL B 2 120 ? -2.715  39.985 20.336 1.000 43.168 ? 120 VAL HHH CA   1 
ATOM   1910 C  C    . VAL B 2 120 ? -2.960  41.488 20.172 1.000 43.606 ? 120 VAL HHH C    1 
ATOM   1911 O  O    . VAL B 2 120 ? -1.999  42.262 20.366 1.000 42.812 ? 120 VAL HHH O    1 
ATOM   1912 C  CB   . VAL B 2 120 ? -2.037  39.670 21.645 1.000 42.750 ? 120 VAL HHH CB   1 
ATOM   1913 H  H    . VAL B 2 120 ? -1.056  39.912 19.217 1.000 41.301 ? 120 VAL HHH H    1 
ATOM   1914 H  HA   . VAL B 2 120 ? -3.580  39.516 20.302 1.000 43.979 ? 120 VAL HHH HA   1 
ATOM   1915 H  HB   . VAL B 2 120 ? -2.554  40.045 22.378 1.000 43.776 ? 120 VAL HHH HB   1 
ATOM   1916 N  N    . SER B 2 121 ? -4.179  41.869 19.780 1.000 45.070 ? 121 SER HHH N    1 
ATOM   1917 C  CA   . SER B 2 121 ? -4.579  43.267 19.467 1.000 46.322 ? 121 SER HHH CA   1 
ATOM   1918 C  C    . SER B 2 121 ? -6.020  43.508 19.919 1.000 48.947 ? 121 SER HHH C    1 
ATOM   1919 O  O    . SER B 2 121 ? -6.873  42.656 19.632 1.000 49.642 ? 121 SER HHH O    1 
ATOM   1920 C  CB   . SER B 2 121 ? -4.418  43.556 17.999 1.000 45.655 ? 121 SER HHH CB   1 
ATOM   1921 O  OG   . SER B 2 121 ? -4.778  44.896 17.701 1.000 46.205 ? 121 SER HHH OG   1 
ATOM   1922 H  H    . SER B 2 121 ? -4.869  41.283 19.670 1.000 45.846 ? 121 SER HHH H    1 
ATOM   1923 H  HA   . SER B 2 121 ? -3.985  43.880 19.977 1.000 45.944 ? 121 SER HHH HA   1 
ATOM   1924 H  HB2  . SER B 2 121 ? -3.482  43.403 17.737 1.000 44.555 ? 121 SER HHH HB2  1 
ATOM   1925 H  HB3  . SER B 2 121 ? -4.986  42.942 17.481 1.000 46.130 ? 121 SER HHH HB3  1 
ATOM   1926 H  HG   . SER B 2 121 ? -4.821  45.066 16.885 0.000 30.000 ? 121 SER HHH HG   1 
ATOM   1927 N  N    . SER B 2 122 ? -6.264  44.630 20.598 1.000 51.643 ? 122 SER HHH N    1 
ATOM   1928 C  CA   . SER B 2 122 ? -7.618  45.134 20.952 1.000 55.378 ? 122 SER HHH CA   1 
ATOM   1929 C  C    . SER B 2 122 ? -8.463  45.254 19.678 1.000 56.753 ? 122 SER HHH C    1 
ATOM   1930 O  O    . SER B 2 122 ? -9.700  45.078 19.767 1.000 58.497 ? 122 SER HHH O    1 
ATOM   1931 C  CB   . SER B 2 122 ? -7.543  46.456 21.677 1.000 56.533 ? 122 SER HHH CB   1 
ATOM   1932 O  OG   . SER B 2 122 ? -6.701  46.360 22.816 1.000 56.898 ? 122 SER HHH OG   1 
ATOM   1933 H  H    . SER B 2 122 ? -5.604  45.180 20.900 1.000 51.001 ? 122 SER HHH H    1 
ATOM   1934 H  HA   . SER B 2 122 ? -8.049  44.468 21.552 1.000 56.044 ? 122 SER HHH HA   1 
ATOM   1935 H  HB2  . SER B 2 122 ? -7.193  47.144 21.067 1.000 56.004 ? 122 SER HHH HB2  1 
ATOM   1936 H  HB3  . SER B 2 122 ? -8.447  46.727 21.958 1.000 58.115 ? 122 SER HHH HB3  1 
ATOM   1937 H  HG   . SER B 2 122 ? -6.982  47.225 23.351 0.000 30.000 ? 122 SER HHH HG   1 
ATOM   1938 N  N    . ALA B 2 123 ? -7.812  45.542 18.542 1.000 55.943 ? 123 ALA HHH N    1 
ATOM   1939 C  CA   . ALA B 2 123 ? -8.448  45.716 17.214 1.000 56.882 ? 123 ALA HHH CA   1 
ATOM   1940 C  C    . ALA B 2 123 ? -9.322  46.979 17.230 1.000 57.762 ? 123 ALA HHH C    1 
ATOM   1941 O  O    . ALA B 2 123 ? -10.229 47.079 16.385 1.000 57.815 ? 123 ALA HHH O    1 
ATOM   1942 C  CB   . ALA B 2 123 ? -9.248  44.477 16.863 1.000 57.968 ? 123 ALA HHH CB   1 
ATOM   1943 H  H    . ALA B 2 123 ? -6.913  45.680 18.508 1.000 54.677 ? 123 ALA HHH H    1 
ATOM   1944 H  HA   . ALA B 2 123 ? -7.738  45.835 16.544 1.000 55.629 ? 123 ALA HHH HA   1 
ATOM   1945 H  HB1  . ALA B 2 123 ? -9.314  44.397 15.896 1.000 57.923 ? 123 ALA HHH HB1  1 
ATOM   1946 H  HB2  . ALA B 2 123 ? -8.804  43.690 17.221 1.000 57.157 ? 123 ALA HHH HB2  1 
ATOM   1947 H  HB3  . ALA B 2 123 ? -10.140 44.545 17.242 1.000 59.388 ? 123 ALA HHH HB3  1 
ATOM   1948 N  N    . LYS B 2 124 ? -9.028  47.916 18.141 1.000 57.738 ? 124 LYS HHH N    1 
ATOM   1949 C  CA   . LYS B 2 124 ? -9.878  49.092 18.469 1.000 59.053 ? 124 LYS HHH CA   1 
ATOM   1950 C  C    . LYS B 2 124 ? -9.457  50.272 17.585 1.000 57.613 ? 124 LYS HHH C    1 
ATOM   1951 O  O    . LYS B 2 124 ? -8.333  50.767 17.767 1.000 55.763 ? 124 LYS HHH O    1 
ATOM   1952 C  CB   . LYS B 2 124 ? -9.756  49.412 19.963 1.000 60.255 ? 124 LYS HHH CB   1 
ATOM   1953 C  CG   . LYS B 2 124 ? -11.024 49.938 20.624 1.000 63.463 ? 124 LYS HHH CG   1 
ATOM   1954 C  CD   . LYS B 2 124 ? -11.223 51.436 20.484 1.000 64.878 ? 124 LYS HHH CD   1 
ATOM   1955 C  CE   . LYS B 2 124 ? -12.677 51.841 20.607 1.000 67.965 ? 124 LYS HHH CE   1 
ATOM   1956 N  NZ   . LYS B 2 124 ? -12.822 53.290 20.874 1.000 69.254 ? 124 LYS HHH NZ   1 
ATOM   1957 H  H    . LYS B 2 124 ? -8.248  47.902 18.612 1.000 56.630 ? 124 LYS HHH H    1 
ATOM   1958 H  HA   . LYS B 2 124 ? -10.815 48.863 18.268 1.000 60.490 ? 124 LYS HHH HA   1 
ATOM   1959 H  HB2  . LYS B 2 124 ? -9.481  48.597 20.432 1.000 59.769 ? 124 LYS HHH HB2  1 
ATOM   1960 H  HB3  . LYS B 2 124 ? -9.046  50.076 20.083 1.000 59.419 ? 124 LYS HHH HB3  1 
ATOM   1961 H  HG2  . LYS B 2 124 ? -11.796 49.478 20.231 1.000 64.433 ? 124 LYS HHH HG2  1 
ATOM   1962 H  HG3  . LYS B 2 124 ? -10.996 49.711 21.578 1.000 63.814 ? 124 LYS HHH HG3  1 
ATOM   1963 H  HD2  . LYS B 2 124 ? -10.704 51.895 21.179 1.000 64.480 ? 124 LYS HHH HD2  1 
ATOM   1964 H  HD3  . LYS B 2 124 ? -10.884 51.726 19.611 1.000 63.970 ? 124 LYS HHH HD3  1 
ATOM   1965 H  HE2  . LYS B 2 124 ? -13.148 51.623 19.780 1.000 68.368 ? 124 LYS HHH HE2  1 
ATOM   1966 H  HE3  . LYS B 2 124 ? -13.096 51.341 21.333 1.000 68.909 ? 124 LYS HHH HE3  1 
ATOM   1967 H  HZ1  . LYS B 2 124 ? -12.616 53.465 21.740 1.000 69.333 ? 124 LYS HHH HZ1  1 
ATOM   1968 H  HZ2  . LYS B 2 124 ? -13.677 53.548 20.714 1.000 70.738 ? 124 LYS HHH HZ2  1 
ATOM   1969 H  HZ3  . LYS B 2 124 ? -12.264 53.760 20.335 1.000 68.086 ? 124 LYS HHH HZ3  1 
ATOM   1970 N  N    . THR B 2 125 ? -10.321 50.679 16.650 1.000 58.266 ? 125 THR HHH N    1 
ATOM   1971 C  CA   . THR B 2 125 ? -10.106 51.834 15.737 1.000 57.896 ? 125 THR HHH CA   1 
ATOM   1972 C  C    . THR B 2 125 ? -9.704  53.050 16.577 1.000 57.323 ? 125 THR HHH C    1 
ATOM   1973 O  O    . THR B 2 125 ? -10.543 53.509 17.370 1.000 59.333 ? 125 THR HHH O    1 
ATOM   1974 C  CB   . THR B 2 125 ? -11.354 52.132 14.897 1.000 59.795 ? 125 THR HHH CB   1 
ATOM   1975 O  OG1  . THR B 2 125 ? -11.531 51.056 13.980 1.000 59.714 ? 125 THR HHH OG1  1 
ATOM   1976 C  CG2  . THR B 2 125 ? -11.257 53.430 14.127 1.000 60.229 ? 125 THR HHH CG2  1 
ATOM   1977 H  H    . THR B 2 125 ? -11.120 50.265 16.502 1.000 59.520 ? 125 THR HHH H    1 
ATOM   1978 H  HA   . THR B 2 125 ? -9.364  51.609 15.130 1.000 56.546 ? 125 THR HHH HA   1 
ATOM   1979 H  HB   . THR B 2 125 ? -12.134 52.174 15.500 1.000 61.248 ? 125 THR HHH HB   1 
ATOM   1980 H  HG1  . THR B 2 125 ? -12.162 51.334 13.399 0.000 30.000 ? 125 THR HHH HG1  1 
ATOM   1981 H  HG21 . THR B 2 125 ? -11.516 54.172 14.702 1.000 60.893 ? 125 THR HHH HG21 1 
ATOM   1982 H  HG22 . THR B 2 125 ? -11.852 53.396 13.356 1.000 61.226 ? 125 THR HHH HG22 1 
ATOM   1983 H  HG23 . THR B 2 125 ? -10.341 53.561 13.822 1.000 58.738 ? 125 THR HHH HG23 1 
ATOM   1984 N  N    . THR B 2 126 ? -8.463  53.519 16.422 1.000 54.733 ? 126 THR HHH N    1 
ATOM   1985 C  CA   . THR B 2 126 ? -7.888  54.681 17.150 1.000 53.744 ? 126 THR HHH CA   1 
ATOM   1986 C  C    . THR B 2 126 ? -7.326  55.664 16.128 1.000 52.966 ? 126 THR HHH C    1 
ATOM   1987 O  O    . THR B 2 126 ? -6.515  55.283 15.283 1.000 51.075 ? 126 THR HHH O    1 
ATOM   1988 C  CB   . THR B 2 126 ? -6.825  54.231 18.164 1.000 51.951 ? 126 THR HHH CB   1 
ATOM   1989 O  OG1  . THR B 2 126 ? -7.456  53.363 19.106 1.000 52.414 ? 126 THR HHH OG1  1 
ATOM   1990 C  CG2  . THR B 2 126 ? -6.173  55.382 18.900 1.000 51.517 ? 126 THR HHH CG2  1 
ATOM   1991 H  H    . THR B 2 126 ? -7.865  53.146 15.844 1.000 53.686 ? 126 THR HHH H    1 
ATOM   1992 H  HA   . THR B 2 126 ? -8.617  55.119 17.641 1.000 55.114 ? 126 THR HHH HA   1 
ATOM   1993 H  HB   . THR B 2 126 ? -6.128  53.726 17.680 1.000 50.665 ? 126 THR HHH HB   1 
ATOM   1994 H  HG1  . THR B 2 126 ? -6.921  53.070 19.599 0.000 30.000 ? 126 THR HHH HG1  1 
ATOM   1995 H  HG21 . THR B 2 126 ? -5.483  55.779 18.339 1.000 50.763 ? 126 THR HHH HG21 1 
ATOM   1996 H  HG22 . THR B 2 126 ? -5.771  55.056 19.725 1.000 51.341 ? 126 THR HHH HG22 1 
ATOM   1997 H  HG23 . THR B 2 126 ? -6.845  56.055 19.112 1.000 52.879 ? 126 THR HHH HG23 1 
ATOM   1998 N  N    . PRO B 2 127 ? -7.730  56.956 16.170 1.000 53.748 ? 127 PRO HHH N    1 
ATOM   1999 C  CA   . PRO B 2 127 ? -7.146  57.960 15.286 1.000 52.757 ? 127 PRO HHH CA   1 
ATOM   2000 C  C    . PRO B 2 127 ? -5.738  58.277 15.779 1.000 50.371 ? 127 PRO HHH C    1 
ATOM   2001 O  O    . PRO B 2 127 ? -5.427  58.065 16.947 1.000 49.607 ? 127 PRO HHH O    1 
ATOM   2002 C  CB   . PRO B 2 127 ? -8.116  59.145 15.395 1.000 54.746 ? 127 PRO HHH CB   1 
ATOM   2003 C  CG   . PRO B 2 127 ? -8.686  59.022 16.794 1.000 55.962 ? 127 PRO HHH CG   1 
ATOM   2004 C  CD   . PRO B 2 127 ? -8.733  57.532 17.081 1.000 55.443 ? 127 PRO HHH CD   1 
ATOM   2005 H  HA   . PRO B 2 127 ? -7.127  57.622 14.357 1.000 52.450 ? 127 PRO HHH HA   1 
ATOM   2006 H  HB2  . PRO B 2 127 ? -7.645  59.999 15.283 1.000 54.550 ? 127 PRO HHH HB2  1 
ATOM   2007 H  HB3  . PRO B 2 127 ? -8.826  59.083 14.721 1.000 55.686 ? 127 PRO HHH HB3  1 
ATOM   2008 H  HG2  . PRO B 2 127 ? -8.114  59.480 17.443 1.000 55.542 ? 127 PRO HHH HG2  1 
ATOM   2009 H  HG3  . PRO B 2 127 ? -9.584  59.410 16.838 1.000 57.469 ? 127 PRO HHH HG3  1 
ATOM   2010 H  HD2  . PRO B 2 127 ? -8.504  57.350 18.011 1.000 55.335 ? 127 PRO HHH HD2  1 
ATOM   2011 H  HD3  . PRO B 2 127 ? -9.619  57.169 16.897 1.000 56.578 ? 127 PRO HHH HD3  1 
ATOM   2012 N  N    . PRO B 2 128 ? -4.833  58.752 14.899 1.000 49.241 ? 128 PRO HHH N    1 
ATOM   2013 C  CA   . PRO B 2 128 ? -3.497  59.161 15.322 1.000 47.941 ? 128 PRO HHH CA   1 
ATOM   2014 C  C    . PRO B 2 128 ? -3.462  60.584 15.900 1.000 48.670 ? 128 PRO HHH C    1 
ATOM   2015 O  O    . PRO B 2 128 ? -4.097  61.456 15.340 1.000 48.750 ? 128 PRO HHH O    1 
ATOM   2016 C  CB   . PRO B 2 128 ? -2.703  59.108 14.010 1.000 46.963 ? 128 PRO HHH CB   1 
ATOM   2017 C  CG   . PRO B 2 128 ? -3.723  59.469 12.951 1.000 48.238 ? 128 PRO HHH CG   1 
ATOM   2018 C  CD   . PRO B 2 128 ? -5.035  58.897 13.450 1.000 49.502 ? 128 PRO HHH CD   1 
ATOM   2019 H  HA   . PRO B 2 128 ? -3.127  58.508 15.968 1.000 47.345 ? 128 PRO HHH HA   1 
ATOM   2020 H  HB2  . PRO B 2 128 ? -1.964  59.754 14.019 1.000 46.638 ? 128 PRO HHH HB2  1 
ATOM   2021 H  HB3  . PRO B 2 128 ? -2.338  58.212 13.853 1.000 46.201 ? 128 PRO HHH HB3  1 
ATOM   2022 H  HG2  . PRO B 2 128 ? -3.786  60.440 12.848 1.000 48.824 ? 128 PRO HHH HG2  1 
ATOM   2023 H  HG3  . PRO B 2 128 ? -3.480  59.076 12.088 1.000 47.881 ? 128 PRO HHH HG3  1 
ATOM   2024 H  HD2  . PRO B 2 128 ? -5.776  59.502 13.261 1.000 50.646 ? 128 PRO HHH HD2  1 
ATOM   2025 H  HD3  . PRO B 2 128 ? -5.219  58.033 13.036 1.000 49.287 ? 128 PRO HHH HD3  1 
ATOM   2026 N  N    . SER B 2 129 ? -2.734  60.766 17.006 1.000 48.649 ? 129 SER HHH N    1 
ATOM   2027 C  CA   . SER B 2 129 ? -2.188  62.073 17.458 1.000 48.920 ? 129 SER HHH CA   1 
ATOM   2028 C  C    . SER B 2 129 ? -1.072  62.462 16.487 1.000 47.674 ? 129 SER HHH C    1 
ATOM   2029 O  O    . SER B 2 129 ? -0.154  61.640 16.308 1.000 46.506 ? 129 SER HHH O    1 
ATOM   2030 C  CB   . SER B 2 129 ? -1.672  62.007 18.877 1.000 49.181 ? 129 SER HHH CB   1 
ATOM   2031 O  OG   . SER B 2 129 ? -2.591  61.347 19.734 1.000 50.230 ? 129 SER HHH OG   1 
ATOM   2032 H  H    . SER B 2 129 ? -2.518  60.087 17.574 1.000 48.137 ? 129 SER HHH H    1 
ATOM   2033 H  HA   . SER B 2 129 ? -2.912  62.753 17.406 1.000 50.000 ? 129 SER HHH HA   1 
ATOM   2034 H  HB2  . SER B 2 129 ? -0.813  61.527 18.889 1.000 48.209 ? 129 SER HHH HB2  1 
ATOM   2035 H  HB3  . SER B 2 129 ? -1.515  62.920 19.207 1.000 49.796 ? 129 SER HHH HB3  1 
ATOM   2036 H  HG   . SER B 2 129 ? -2.183  61.435 20.566 0.000 30.000 ? 129 SER HHH HG   1 
ATOM   2037 N  N    . VAL B 2 130 ? -1.154  63.646 15.875 1.000 48.112 ? 130 VAL HHH N    1 
ATOM   2038 C  CA   . VAL B 2 130 ? -0.220  64.094 14.799 1.000 47.330 ? 130 VAL HHH CA   1 
ATOM   2039 C  C    . VAL B 2 130 ? 0.528   65.346 15.272 1.000 47.638 ? 130 VAL HHH C    1 
ATOM   2040 O  O    . VAL B 2 130 ? -0.132  66.385 15.476 1.000 49.268 ? 130 VAL HHH O    1 
ATOM   2041 C  CB   . VAL B 2 130 ? -0.982  64.340 13.484 1.000 47.801 ? 130 VAL HHH CB   1 
ATOM   2042 C  CG1  . VAL B 2 130 ? -0.040  64.694 12.344 1.000 47.510 ? 130 VAL HHH CG1  1 
ATOM   2043 C  CG2  . VAL B 2 130 ? -1.836  63.140 13.117 1.000 47.604 ? 130 VAL HHH CG2  1 
ATOM   2044 H  H    . VAL B 2 130 ? -1.793  64.262 16.081 1.000 49.103 ? 130 VAL HHH H    1 
ATOM   2045 H  HA   . VAL B 2 130 ? 0.430   63.388 14.646 1.000 46.396 ? 130 VAL HHH HA   1 
ATOM   2046 H  HB   . VAL B 2 130 ? -1.586  65.110 13.628 1.000 48.827 ? 130 VAL HHH HB   1 
ATOM   2047 H  HG11 . VAL B 2 130 ? 0.443   65.511 12.559 1.000 47.642 ? 130 VAL HHH HG11 1 
ATOM   2048 H  HG12 . VAL B 2 130 ? -0.553  64.829 11.529 1.000 47.986 ? 130 VAL HHH HG12 1 
ATOM   2049 H  HG13 . VAL B 2 130 ? 0.595   63.969 12.210 1.000 46.576 ? 130 VAL HHH HG13 1 
ATOM   2050 H  HG21 . VAL B 2 130 ? -1.330  62.323 13.269 1.000 46.755 ? 130 VAL HHH HG21 1 
ATOM   2051 H  HG22 . VAL B 2 130 ? -2.090  63.193 12.179 1.000 47.951 ? 130 VAL HHH HG22 1 
ATOM   2052 H  HG23 . VAL B 2 130 ? -2.638  63.130 13.669 1.000 48.393 ? 130 VAL HHH HG23 1 
ATOM   2053 N  N    . TYR B 2 131 ? 1.857   65.253 15.409 1.000 46.472 ? 131 TYR HHH N    1 
ATOM   2054 C  CA   . TYR B 2 131 ? 2.729   66.314 15.983 1.000 46.318 ? 131 TYR HHH CA   1 
ATOM   2055 C  C    . TYR B 2 131 ? 3.768   66.786 14.967 1.000 45.743 ? 131 TYR HHH C    1 
ATOM   2056 O  O    . TYR B 2 131 ? 4.240   65.999 14.151 1.000 44.911 ? 131 TYR HHH O    1 
ATOM   2057 C  CB   . TYR B 2 131 ? 3.414   65.786 17.241 1.000 45.641 ? 131 TYR HHH CB   1 
ATOM   2058 C  CG   . TYR B 2 131 ? 2.474   65.345 18.331 1.000 45.868 ? 131 TYR HHH CG   1 
ATOM   2059 C  CD1  . TYR B 2 131 ? 1.602   66.237 18.934 1.000 47.080 ? 131 TYR HHH CD1  1 
ATOM   2060 C  CD2  . TYR B 2 131 ? 2.474   64.035 18.784 1.000 45.235 ? 131 TYR HHH CD2  1 
ATOM   2061 C  CE1  . TYR B 2 131 ? 0.747   65.837 19.951 1.000 47.732 ? 131 TYR HHH CE1  1 
ATOM   2062 C  CE2  . TYR B 2 131 ? 1.624   63.618 19.797 1.000 45.672 ? 131 TYR HHH CE2  1 
ATOM   2063 C  CZ   . TYR B 2 131 ? 0.757   64.522 20.381 1.000 46.940 ? 131 TYR HHH CZ   1 
ATOM   2064 O  OH   . TYR B 2 131 ? -0.072  64.105 21.378 1.000 47.886 ? 131 TYR HHH OH   1 
ATOM   2065 H  H    . TYR B 2 131 ? 2.332   64.518 15.153 1.000 45.623 ? 131 TYR HHH H    1 
ATOM   2066 H  HA   . TYR B 2 131 ? 2.162   67.085 16.234 1.000 47.216 ? 131 TYR HHH HA   1 
ATOM   2067 H  HB2  . TYR B 2 131 ? 3.983   65.029 16.988 1.000 44.817 ? 131 TYR HHH HB2  1 
ATOM   2068 H  HB3  . TYR B 2 131 ? 3.996   66.490 17.591 1.000 46.079 ? 131 TYR HHH HB3  1 
ATOM   2069 H  HD1  . TYR B 2 131 ? 1.589   67.135 18.648 1.000 47.628 ? 131 TYR HHH HD1  1 
ATOM   2070 H  HD2  . TYR B 2 131 ? 3.062   63.411 18.392 1.000 44.277 ? 131 TYR HHH HD2  1 
ATOM   2071 H  HE1  . TYR B 2 131 ? 0.157   66.458 20.345 1.000 48.828 ? 131 TYR HHH HE1  1 
ATOM   2072 H  HE2  . TYR B 2 131 ? 1.637   62.721 20.087 1.000 45.246 ? 131 TYR HHH HE2  1 
ATOM   2073 H  HH   . TYR B 2 131 ? -0.841  64.282 21.177 0.000 30.000 ? 131 TYR HHH HH   1 
ATOM   2074 N  N    . PRO B 2 132 ? 4.182   68.076 15.012 1.000 46.535 ? 132 PRO HHH N    1 
ATOM   2075 C  CA   . PRO B 2 132 ? 5.137   68.634 14.053 1.000 46.632 ? 132 PRO HHH CA   1 
ATOM   2076 C  C    . PRO B 2 132 ? 6.604   68.355 14.405 1.000 46.501 ? 132 PRO HHH C    1 
ATOM   2077 O  O    . PRO B 2 132 ? 6.948   68.443 15.562 1.000 47.727 ? 132 PRO HHH O    1 
ATOM   2078 C  CB   . PRO B 2 132 ? 4.883   70.138 14.195 1.000 47.821 ? 132 PRO HHH CB   1 
ATOM   2079 C  CG   . PRO B 2 132 ? 4.598   70.296 15.672 1.000 48.218 ? 132 PRO HHH CG   1 
ATOM   2080 C  CD   . PRO B 2 132 ? 3.772   69.072 16.015 1.000 47.657 ? 132 PRO HHH CD   1 
ATOM   2081 H  HA   . PRO B 2 132 ? 4.923   68.333 13.134 1.000 46.403 ? 132 PRO HHH HA   1 
ATOM   2082 H  HB2  . PRO B 2 132 ? 5.670   70.660 13.930 1.000 47.986 ? 132 PRO HHH HB2  1 
ATOM   2083 H  HB3  . PRO B 2 132 ? 4.114   70.421 13.656 1.000 48.196 ? 132 PRO HHH HB3  1 
ATOM   2084 H  HG2  . PRO B 2 132 ? 5.427   70.318 16.191 1.000 48.219 ? 132 PRO HHH HG2  1 
ATOM   2085 H  HG3  . PRO B 2 132 ? 4.093   71.117 15.844 1.000 49.142 ? 132 PRO HHH HG3  1 
ATOM   2086 H  HD2  . PRO B 2 132 ? 3.965   68.759 16.917 1.000 47.656 ? 132 PRO HHH HD2  1 
ATOM   2087 H  HD3  . PRO B 2 132 ? 2.819   69.264 15.945 1.000 48.199 ? 132 PRO HHH HD3  1 
ATOM   2088 N  N    . LEU B 2 133 ? 7.434   68.058 13.406 1.000 46.135 ? 133 LEU HHH N    1 
ATOM   2089 C  CA   . LEU B 2 133 ? 8.891   67.832 13.587 1.000 45.844 ? 133 LEU HHH CA   1 
ATOM   2090 C  C    . LEU B 2 133 ? 9.667   68.950 12.886 1.000 46.486 ? 133 LEU HHH C    1 
ATOM   2091 O  O    . LEU B 2 133 ? 9.903   68.835 11.672 1.000 46.166 ? 133 LEU HHH O    1 
ATOM   2092 C  CB   . LEU B 2 133 ? 9.268   66.459 13.026 1.000 45.111 ? 133 LEU HHH CB   1 
ATOM   2093 C  CG   . LEU B 2 133 ? 8.539   65.268 13.641 1.000 44.409 ? 133 LEU HHH CG   1 
ATOM   2094 C  CD1  . LEU B 2 133 ? 9.082   63.964 13.079 1.000 43.296 ? 133 LEU HHH CD1  1 
ATOM   2095 C  CD2  . LEU B 2 133 ? 8.650   65.290 15.162 1.000 44.998 ? 133 LEU HHH CD2  1 
ATOM   2096 H  H    . LEU B 2 133 ? 7.155   67.981 12.543 1.000 46.019 ? 133 LEU HHH H    1 
ATOM   2097 H  HA   . LEU B 2 133 ? 9.097   67.861 14.549 1.000 46.056 ? 133 LEU HHH HA   1 
ATOM   2098 H  HB2  . LEU B 2 133 ? 9.100   66.461 12.065 1.000 45.056 ? 133 LEU HHH HB2  1 
ATOM   2099 H  HB3  . LEU B 2 133 ? 10.228  66.331 13.154 1.000 45.077 ? 133 LEU HHH HB3  1 
ATOM   2100 H  HG   . LEU B 2 133 ? 7.582   65.333 13.401 1.000 44.482 ? 133 LEU HHH HG   1 
ATOM   2101 H  HD11 . LEU B 2 133 ? 8.977   63.959 12.111 1.000 43.371 ? 133 LEU HHH HD11 1 
ATOM   2102 H  HD12 . LEU B 2 133 ? 8.592   63.215 13.461 1.000 42.893 ? 133 LEU HHH HD12 1 
ATOM   2103 H  HD13 . LEU B 2 133 ? 10.025  63.882 13.302 1.000 43.396 ? 133 LEU HHH HD13 1 
ATOM   2104 H  HD21 . LEU B 2 133 ? 9.553   65.545 15.418 1.000 45.176 ? 133 LEU HHH HD21 1 
ATOM   2105 H  HD22 . LEU B 2 133 ? 8.452   64.405 15.516 1.000 44.357 ? 133 LEU HHH HD22 1 
ATOM   2106 H  HD23 . LEU B 2 133 ? 8.017   65.933 15.525 1.000 45.440 ? 133 LEU HHH HD23 1 
ATOM   2107 N  N    . ALA B 2 134 ? 10.048  69.980 13.644 1.000 47.601 ? 134 ALA HHH N    1 
ATOM   2108 C  CA   . ALA B 2 134 ? 10.918  71.095 13.207 1.000 48.819 ? 134 ALA HHH CA   1 
ATOM   2109 C  C    . ALA B 2 134 ? 12.296  70.919 13.840 1.000 49.585 ? 134 ALA HHH C    1 
ATOM   2110 O  O    . ALA B 2 134 ? 12.425  70.251 14.863 1.000 48.953 ? 134 ALA HHH O    1 
ATOM   2111 C  CB   . ALA B 2 134 ? 10.295  72.414 13.590 1.000 49.529 ? 134 ALA HHH CB   1 
ATOM   2112 H  H    . ALA B 2 134 ? 9.807   70.061 14.519 1.000 47.869 ? 134 ALA HHH H    1 
ATOM   2113 H  HA   . ALA B 2 134 ? 11.008  71.057 12.228 1.000 48.733 ? 134 ALA HHH HA   1 
ATOM   2114 H  HB1  . ALA B 2 134 ? 10.872  73.142 13.303 1.000 50.338 ? 134 ALA HHH HB1  1 
ATOM   2115 H  HB2  . ALA B 2 134 ? 9.428   72.502 13.160 1.000 49.538 ? 134 ALA HHH HB2  1 
ATOM   2116 H  HB3  . ALA B 2 134 ? 10.182  72.453 14.555 1.000 49.827 ? 134 ALA HHH HB3  1 
ATOM   2117 N  N    . PRO B 2 135 ? 13.371  71.494 13.252 1.000 50.892 ? 135 PRO HHH N    1 
ATOM   2118 C  CA   . PRO B 2 135 ? 14.703  71.443 13.859 1.000 51.517 ? 135 PRO HHH CA   1 
ATOM   2119 C  C    . PRO B 2 135 ? 14.860  72.345 15.095 1.000 52.548 ? 135 PRO HHH C    1 
ATOM   2120 O  O    . PRO B 2 135 ? 13.985  73.155 15.343 1.000 52.868 ? 135 PRO HHH O    1 
ATOM   2121 C  CB   . PRO B 2 135 ? 15.636  71.951 12.742 1.000 52.537 ? 135 PRO HHH CB   1 
ATOM   2122 C  CG   . PRO B 2 135 ? 14.794  71.953 11.479 1.000 51.967 ? 135 PRO HHH CG   1 
ATOM   2123 C  CD   . PRO B 2 135 ? 13.377  72.185 11.954 1.000 51.490 ? 135 PRO HHH CD   1 
ATOM   2124 H  HA   . PRO B 2 135 ? 14.932  70.506 14.083 1.000 50.917 ? 135 PRO HHH HA   1 
ATOM   2125 H  HB2  . PRO B 2 135 ? 15.960  72.856 12.942 1.000 53.494 ? 135 PRO HHH HB2  1 
ATOM   2126 H  HB3  . PRO B 2 135 ? 16.410  71.357 12.640 1.000 52.466 ? 135 PRO HHH HB3  1 
ATOM   2127 H  HG2  . PRO B 2 135 ? 15.078  72.668 10.874 1.000 52.772 ? 135 PRO HHH HG2  1 
ATOM   2128 H  HG3  . PRO B 2 135 ? 14.866  71.096 11.012 1.000 51.327 ? 135 PRO HHH HG3  1 
ATOM   2129 H  HD2  . PRO B 2 135 ? 13.188  73.136 12.059 1.000 52.212 ? 135 PRO HHH HD2  1 
ATOM   2130 H  HD3  . PRO B 2 135 ? 12.732  71.795 11.337 1.000 50.885 ? 135 PRO HHH HD3  1 
ATOM   2131 N  N    . GLY B 2 136 ? 15.975  72.190 15.823 1.000 53.089 ? 136 GLY HHH N    1 
ATOM   2132 C  CA   . GLY B 2 136 ? 16.393  73.079 16.925 1.000 54.017 ? 136 GLY HHH CA   1 
ATOM   2133 C  C    . GLY B 2 136 ? 17.136  74.293 16.399 1.000 54.925 ? 136 GLY HHH C    1 
ATOM   2134 O  O    . GLY B 2 136 ? 17.402  75.190 17.220 1.000 56.306 ? 136 GLY HHH O    1 
ATOM   2135 H  H    . GLY B 2 136 ? 16.553  71.502 15.671 1.000 52.733 ? 136 GLY HHH H    1 
ATOM   2136 H  HA2  . GLY B 2 136 ? 15.592  73.374 17.427 1.000 54.007 ? 136 GLY HHH HA2  1 
ATOM   2137 H  HA3  . GLY B 2 136 ? 16.980  72.576 17.543 1.000 54.260 ? 136 GLY HHH HA3  1 
ATOM   2138 N  N    . GLY B 2 142 ? 23.081  74.752 6.301  1.000 69.923 ? 142 GLY HHH N    1 
ATOM   2139 C  CA   . GLY B 2 142 ? 22.841  74.079 5.009  1.000 69.710 ? 142 GLY HHH CA   1 
ATOM   2140 C  C    . GLY B 2 142 ? 21.854  74.846 4.141  1.000 69.858 ? 142 GLY HHH C    1 
ATOM   2141 O  O    . GLY B 2 142 ? 21.019  75.581 4.701  1.000 69.464 ? 142 GLY HHH O    1 
ATOM   2142 H  H    . GLY B 2 142 ? 22.754  74.246 6.984  1.000 68.863 ? 142 GLY HHH H    1 
ATOM   2143 H  HA2  . GLY B 2 142 ? 23.701  73.990 4.527  1.000 70.957 ? 142 GLY HHH HA2  1 
ATOM   2144 H  HA3  . GLY B 2 142 ? 22.489  73.169 5.180  1.000 68.446 ? 142 GLY HHH HA3  1 
ATOM   2145 N  N    . SER B 2 143 ? 21.952  74.687 2.816  1.000 70.415 ? 143 SER HHH N    1 
ATOM   2146 C  CA   . SER B 2 143 ? 21.001  75.230 1.808  1.000 69.850 ? 143 SER HHH CA   1 
ATOM   2147 C  C    . SER B 2 143 ? 19.658  74.501 1.929  1.000 66.820 ? 143 SER HHH C    1 
ATOM   2148 O  O    . SER B 2 143 ? 18.644  75.048 1.450  1.000 66.156 ? 143 SER HHH O    1 
ATOM   2149 C  CB   . SER B 2 143 ? 21.552  75.109 0.402  1.000 71.761 ? 143 SER HHH CB   1 
ATOM   2150 O  OG   . SER B 2 143 ? 21.396  73.783 -0.097 1.000 71.161 ? 143 SER HHH OG   1 
ATOM   2151 H  H    . SER B 2 143 ? 22.628  74.215 2.428  1.000 70.938 ? 143 SER HHH H    1 
ATOM   2152 H  HA   . SER B 2 143 ? 20.853  76.193 2.008  1.000 70.394 ? 143 SER HHH HA   1 
ATOM   2153 H  HB2  . SER B 2 143 ? 21.079  75.738 -0.189 1.000 72.302 ? 143 SER HHH HB2  1 
ATOM   2154 H  HB3  . SER B 2 143 ? 22.506  75.349 0.402  1.000 73.023 ? 143 SER HHH HB3  1 
ATOM   2155 H  HG   . SER B 2 143 ? 21.528  73.519 -0.951 0.000 30.000 ? 143 SER HHH HG   1 
ATOM   2156 N  N    . SER B 2 144 ? 19.667  73.298 2.517  1.000 64.507 ? 144 SER HHH N    1 
ATOM   2157 C  CA   . SER B 2 144 ? 18.475  72.432 2.715  1.000 61.873 ? 144 SER HHH CA   1 
ATOM   2158 C  C    . SER B 2 144 ? 18.097  72.369 4.199  1.000 59.082 ? 144 SER HHH C    1 
ATOM   2159 O  O    . SER B 2 144 ? 18.995  72.483 5.056  1.000 59.112 ? 144 SER HHH O    1 
ATOM   2160 C  CB   . SER B 2 144 ? 18.702  71.057 2.139  1.000 61.792 ? 144 SER HHH CB   1 
ATOM   2161 O  OG   . SER B 2 144 ? 18.293  71.018 0.778  1.000 62.924 ? 144 SER HHH OG   1 
ATOM   2162 H  H    . SER B 2 144 ? 20.425  72.906 2.831  1.000 64.735 ? 144 SER HHH H    1 
ATOM   2163 H  HA   . SER B 2 144 ? 17.716  72.847 2.226  1.000 61.873 ? 144 SER HHH HA   1 
ATOM   2164 H  HB2  . SER B 2 144 ? 19.657  70.827 2.203  1.000 62.408 ? 144 SER HHH HB2  1 
ATOM   2165 H  HB3  . SER B 2 144 ? 18.190  70.394 2.655  1.000 60.492 ? 144 SER HHH HB3  1 
ATOM   2166 H  HG   . SER B 2 144 ? 18.080  70.409 0.486  0.000 30.000 ? 144 SER HHH HG   1 
ATOM   2167 N  N    . VAL B 2 145 ? 16.799  72.202 4.462  1.000 56.560 ? 145 VAL HHH N    1 
ATOM   2168 C  CA   . VAL B 2 145 ? 16.189  72.075 5.818  1.000 54.587 ? 145 VAL HHH CA   1 
ATOM   2169 C  C    . VAL B 2 145 ? 15.127  70.970 5.750  1.000 52.795 ? 145 VAL HHH C    1 
ATOM   2170 O  O    . VAL B 2 145 ? 14.370  70.937 4.762  1.000 52.768 ? 145 VAL HHH O    1 
ATOM   2171 C  CB   . VAL B 2 145 ? 15.601  73.418 6.292  1.000 54.715 ? 145 VAL HHH CB   1 
ATOM   2172 C  CG1  . VAL B 2 145 ? 14.579  73.976 5.315  1.000 55.042 ? 145 VAL HHH CG1  1 
ATOM   2173 C  CG2  . VAL B 2 145 ? 15.002  73.311 7.684  1.000 53.785 ? 145 VAL HHH CG2  1 
ATOM   2174 H  H    . VAL B 2 145 ? 16.181  72.145 3.795  1.000 56.625 ? 145 VAL HHH H    1 
ATOM   2175 H  HA   . VAL B 2 145 ? 16.883  71.801 6.444  1.000 54.568 ? 145 VAL HHH HA   1 
ATOM   2176 H  HB   . VAL B 2 145 ? 16.350  74.063 6.340  1.000 55.791 ? 145 VAL HHH HB   1 
ATOM   2177 H  HG11 . VAL B 2 145 ? 14.937  73.942 4.411  1.000 55.683 ? 145 VAL HHH HG11 1 
ATOM   2178 H  HG12 . VAL B 2 145 ? 14.380  74.900 5.547  1.000 55.613 ? 145 VAL HHH HG12 1 
ATOM   2179 H  HG13 . VAL B 2 145 ? 13.763  73.450 5.360  1.000 54.192 ? 145 VAL HHH HG13 1 
ATOM   2180 H  HG21 . VAL B 2 145 ? 14.118  72.909 7.629  1.000 53.016 ? 145 VAL HHH HG21 1 
ATOM   2181 H  HG22 . VAL B 2 145 ? 14.929  74.199 8.075  1.000 54.396 ? 145 VAL HHH HG22 1 
ATOM   2182 H  HG23 . VAL B 2 145 ? 15.575  72.757 8.243  1.000 53.492 ? 145 VAL HHH HG23 1 
ATOM   2183 N  N    . THR B 2 146 ? 15.097  70.085 6.751  1.000 51.703 ? 146 THR HHH N    1 
ATOM   2184 C  CA   . THR B 2 146 ? 14.208  68.891 6.806  1.000 50.047 ? 146 THR HHH CA   1 
ATOM   2185 C  C    . THR B 2 146 ? 13.185  69.065 7.934  1.000 48.964 ? 146 THR HHH C    1 
ATOM   2186 O  O    . THR B 2 146 ? 13.600  69.277 9.098  1.000 48.256 ? 146 THR HHH O    1 
ATOM   2187 C  CB   . THR B 2 146 ? 15.004  67.590 6.972  1.000 49.331 ? 146 THR HHH CB   1 
ATOM   2188 O  OG1  . THR B 2 146 ? 16.182  67.689 6.173  1.000 50.669 ? 146 THR HHH OG1  1 
ATOM   2189 C  CG2  . THR B 2 146 ? 14.218  66.360 6.571  1.000 48.001 ? 146 THR HHH CG2  1 
ATOM   2190 H  H    . THR B 2 146 ? 15.630  70.152 7.487  1.000 51.702 ? 146 THR HHH H    1 
ATOM   2191 H  HA   . THR B 2 146 ? 13.720  68.842 5.953  1.000 50.140 ? 146 THR HHH HA   1 
ATOM   2192 H  HB   . THR B 2 146 ? 15.267  67.505 7.920  1.000 49.071 ? 146 THR HHH HB   1 
ATOM   2193 H  HG1  . THR B 2 146 ? 16.556  67.084 6.152  0.000 30.000 ? 146 THR HHH HG1  1 
ATOM   2194 H  HG21 . THR B 2 146 ? 13.523  66.189 7.232  1.000 47.388 ? 146 THR HHH HG21 1 
ATOM   2195 H  HG22 . THR B 2 146 ? 14.816  65.593 6.524  1.000 47.884 ? 146 THR HHH HG22 1 
ATOM   2196 H  HG23 . THR B 2 146 ? 13.808  66.505 5.700  1.000 48.426 ? 146 THR HHH HG23 1 
ATOM   2197 N  N    . LEU B 2 147 ? 11.901  68.977 7.574  1.000 48.464 ? 147 LEU HHH N    1 
ATOM   2198 C  CA   . LEU B 2 147 ? 10.733  69.048 8.489  1.000 47.763 ? 147 LEU HHH CA   1 
ATOM   2199 C  C    . LEU B 2 147 ? 10.069  67.675 8.500  1.000 46.712 ? 147 LEU HHH C    1 
ATOM   2200 O  O    . LEU B 2 147 ? 10.464  66.838 7.662  1.000 46.870 ? 147 LEU HHH O    1 
ATOM   2201 C  CB   . LEU B 2 147 ? 9.778   70.132 7.985  1.000 48.268 ? 147 LEU HHH CB   1 
ATOM   2202 C  CG   . LEU B 2 147 ? 10.453  71.450 7.614  1.000 49.317 ? 147 LEU HHH CG   1 
ATOM   2203 C  CD1  . LEU B 2 147 ? 9.458   72.402 6.987  1.000 50.249 ? 147 LEU HHH CD1  1 
ATOM   2204 C  CD2  . LEU B 2 147 ? 11.111  72.082 8.828  1.000 49.484 ? 147 LEU HHH CD2  1 
ATOM   2205 H  H    . LEU B 2 147 ? 11.655  68.861 6.704  1.000 48.653 ? 147 LEU HHH H    1 
ATOM   2206 H  HA   . LEU B 2 147 ? 11.046  69.268 9.396  1.000 47.745 ? 147 LEU HHH HA   1 
ATOM   2207 H  HB2  . LEU B 2 147 ? 9.307   69.790 7.199  1.000 48.289 ? 147 LEU HHH HB2  1 
ATOM   2208 H  HB3  . LEU B 2 147 ? 9.111   70.306 8.679  1.000 48.179 ? 147 LEU HHH HB3  1 
ATOM   2209 H  HG   . LEU B 2 147 ? 11.157  71.261 6.947  1.000 49.584 ? 147 LEU HHH HG   1 
ATOM   2210 H  HD11 . LEU B 2 147 ? 9.048   71.978 6.215  1.000 50.198 ? 147 LEU HHH HD11 1 
ATOM   2211 H  HD12 . LEU B 2 147 ? 9.918   73.210 6.705  1.000 51.040 ? 147 LEU HHH HD12 1 
ATOM   2212 H  HD13 . LEU B 2 147 ? 8.770   72.629 7.636  1.000 50.140 ? 147 LEU HHH HD13 1 
ATOM   2213 H  HD21 . LEU B 2 147 ? 10.462  72.153 9.550  1.000 49.305 ? 147 LEU HHH HD21 1 
ATOM   2214 H  HD22 . LEU B 2 147 ? 11.435  72.970 8.596  1.000 50.387 ? 147 LEU HHH HD22 1 
ATOM   2215 H  HD23 . LEU B 2 147 ? 11.858  71.531 9.118  1.000 49.212 ? 147 LEU HHH HD23 1 
ATOM   2216 N  N    . GLY B 2 148 ? 9.115   67.450 9.405  1.000 46.141 ? 148 GLY HHH N    1 
ATOM   2217 C  CA   . GLY B 2 148 ? 8.449   66.143 9.536  1.000 45.305 ? 148 GLY HHH CA   1 
ATOM   2218 C  C    . GLY B 2 148 ? 7.142   66.205 10.305 1.000 45.629 ? 148 GLY HHH C    1 
ATOM   2219 O  O    . GLY B 2 148 ? 6.882   67.215 10.993 1.000 45.786 ? 148 GLY HHH O    1 
ATOM   2220 H  H    . GLY B 2 148 ? 8.830   68.090 9.988  1.000 46.517 ? 148 GLY HHH H    1 
ATOM   2221 H  HA2  . GLY B 2 148 ? 8.272   65.789 8.630  1.000 45.359 ? 148 GLY HHH HA2  1 
ATOM   2222 H  HA3  . GLY B 2 148 ? 9.065   65.515 9.990  1.000 44.850 ? 148 GLY HHH HA3  1 
ATOM   2223 N  N    . CYS B 2 149 ? 6.339   65.150 10.148 1.000 45.334 ? 149 CYS HHH N    1 
ATOM   2224 C  CA   . CYS B 2 149 ? 5.106   64.863 10.919 1.000 45.195 ? 149 CYS HHH CA   1 
ATOM   2225 C  C    . CYS B 2 149 ? 5.273   63.507 11.602 1.000 42.794 ? 149 CYS HHH C    1 
ATOM   2226 O  O    . CYS B 2 149 ? 5.601   62.522 10.912 1.000 41.704 ? 149 CYS HHH O    1 
ATOM   2227 C  CB   . CYS B 2 149 ? 3.870   64.886 10.024 1.000 46.927 ? 149 CYS HHH CB   1 
ATOM   2228 S  SG   . CYS B 2 149 ? 3.157   66.547 9.891  1.000 51.248 ? 149 CYS HHH SG   1 
ATOM   2229 H  H    . CYS B 2 149 ? 6.503   64.506 9.525  1.000 44.946 ? 149 CYS HHH H    1 
ATOM   2230 H  HA   . CYS B 2 149 ? 5.007   65.557 11.610 1.000 45.553 ? 149 CYS HHH HA   1 
ATOM   2231 H  HB2  . CYS B 2 149 ? 4.111   64.573 9.129  1.000 47.257 ? 149 CYS HHH HB2  1 
ATOM   2232 H  HB3  . CYS B 2 149 ? 3.193   64.279 10.388 1.000 47.148 ? 149 CYS HHH HB3  1 
ATOM   2233 N  N    . LEU B 2 150 ? 5.083   63.478 12.916 1.000 41.484 ? 150 LEU HHH N    1 
ATOM   2234 C  CA   . LEU B 2 150 ? 5.021   62.230 13.711 1.000 40.531 ? 150 LEU HHH CA   1 
ATOM   2235 C  C    . LEU B 2 150 ? 3.556   61.819 13.828 1.000 40.683 ? 150 LEU HHH C    1 
ATOM   2236 O  O    . LEU B 2 150 ? 2.776   62.603 14.391 1.000 41.869 ? 150 LEU HHH O    1 
ATOM   2237 C  CB   . LEU B 2 150 ? 5.636   62.484 15.088 1.000 40.456 ? 150 LEU HHH CB   1 
ATOM   2238 C  CG   . LEU B 2 150 ? 5.531   61.324 16.068 1.000 39.589 ? 150 LEU HHH CG   1 
ATOM   2239 C  CD1  . LEU B 2 150 ? 6.351   60.149 15.573 1.000 38.671 ? 150 LEU HHH CD1  1 
ATOM   2240 C  CD2  . LEU B 2 150 ? 5.972   61.759 17.455 1.000 40.202 ? 150 LEU HHH CD2  1 
ATOM   2241 H  H    . LEU B 2 150 ? 4.974   64.234 13.412 1.000 42.269 ? 150 LEU HHH H    1 
ATOM   2242 H  HA   . LEU B 2 150 ? 5.523   61.524 13.243 1.000 39.931 ? 150 LEU HHH HA   1 
ATOM   2243 H  HB2  . LEU B 2 150 ? 6.581   62.705 14.968 1.000 40.344 ? 150 LEU HHH HB2  1 
ATOM   2244 H  HB3  . LEU B 2 150 ? 5.198   63.264 15.483 1.000 41.111 ? 150 LEU HHH HB3  1 
ATOM   2245 H  HG   . LEU B 2 150 ? 4.585   61.042 16.120 1.000 39.812 ? 150 LEU HHH HG   1 
ATOM   2246 H  HD11 . LEU B 2 150 ? 5.920   59.756 14.795 1.000 38.404 ? 150 LEU HHH HD11 1 
ATOM   2247 H  HD12 . LEU B 2 150 ? 6.419   59.481 16.277 1.000 38.412 ? 150 LEU HHH HD12 1 
ATOM   2248 H  HD13 . LEU B 2 150 ? 7.242   60.455 15.329 1.000 38.651 ? 150 LEU HHH HD13 1 
ATOM   2249 H  HD21 . LEU B 2 150 ? 6.896   62.063 17.422 1.000 40.213 ? 150 LEU HHH HD21 1 
ATOM   2250 H  HD22 . LEU B 2 150 ? 5.900   61.008 18.069 1.000 39.974 ? 150 LEU HHH HD22 1 
ATOM   2251 H  HD23 . LEU B 2 150 ? 5.403   62.485 17.765 1.000 40.913 ? 150 LEU HHH HD23 1 
ATOM   2252 N  N    . VAL B 2 151 ? 3.207   60.650 13.293 1.000 40.328 ? 151 VAL HHH N    1 
ATOM   2253 C  CA   . VAL B 2 151 ? 1.835   60.065 13.345 1.000 40.867 ? 151 VAL HHH CA   1 
ATOM   2254 C  C    . VAL B 2 151 ? 1.857   58.928 14.377 1.000 40.229 ? 151 VAL HHH C    1 
ATOM   2255 O  O    . VAL B 2 151 ? 2.310   57.820 14.041 1.000 39.201 ? 151 VAL HHH O    1 
ATOM   2256 C  CB   . VAL B 2 151 ? 1.387   59.619 11.937 1.000 40.684 ? 151 VAL HHH CB   1 
ATOM   2257 C  CG1  . VAL B 2 151 ? -0.076  59.200 11.895 1.000 41.247 ? 151 VAL HHH CG1  1 
ATOM   2258 C  CG2  . VAL B 2 151 ? 1.652   60.715 10.914 1.000 41.003 ? 151 VAL HHH CG2  1 
ATOM   2259 H  H    . VAL B 2 151 ? 3.802   60.121 12.850 1.000 39.778 ? 151 VAL HHH H    1 
ATOM   2260 H  HA   . VAL B 2 151 ? 1.220   60.752 13.658 1.000 41.529 ? 151 VAL HHH HA   1 
ATOM   2261 H  HB   . VAL B 2 151 ? 1.933   58.835 11.686 1.000 39.962 ? 151 VAL HHH HB   1 
ATOM   2262 H  HG11 . VAL B 2 151 ? -0.232  58.493 12.545 1.000 41.023 ? 151 VAL HHH HG11 1 
ATOM   2263 H  HG12 . VAL B 2 151 ? -0.296  58.874 11.005 1.000 41.470 ? 151 VAL HHH HG12 1 
ATOM   2264 H  HG13 . VAL B 2 151 ? -0.639  59.964 12.107 1.000 42.125 ? 151 VAL HHH HG13 1 
ATOM   2265 H  HG21 . VAL B 2 151 ? 1.404   61.577 11.290 1.000 41.646 ? 151 VAL HHH HG21 1 
ATOM   2266 H  HG22 . VAL B 2 151 ? 1.126   60.547 10.113 1.000 41.499 ? 151 VAL HHH HG22 1 
ATOM   2267 H  HG23 . VAL B 2 151 ? 2.597   60.723 10.684 1.000 40.614 ? 151 VAL HHH HG23 1 
ATOM   2268 N  N    . LYS B 2 152 ? 1.401   59.219 15.596 1.000 41.205 ? 152 LYS HHH N    1 
ATOM   2269 C  CA   . LYS B 2 152 ? 1.649   58.400 16.810 1.000 41.868 ? 152 LYS HHH CA   1 
ATOM   2270 C  C    . LYS B 2 152 ? 0.355   57.710 17.274 1.000 42.579 ? 152 LYS HHH C    1 
ATOM   2271 O  O    . LYS B 2 152 ? -0.697  58.391 17.354 1.000 43.322 ? 152 LYS HHH O    1 
ATOM   2272 C  CB   . LYS B 2 152 ? 2.222   59.306 17.904 1.000 43.301 ? 152 LYS HHH CB   1 
ATOM   2273 C  CG   . LYS B 2 152 ? 2.812   58.594 19.115 1.000 43.936 ? 152 LYS HHH CG   1 
ATOM   2274 C  CD   . LYS B 2 152 ? 3.034   59.511 20.297 1.000 45.875 ? 152 LYS HHH CD   1 
ATOM   2275 C  CE   . LYS B 2 152 ? 3.320   58.772 21.589 1.000 47.302 ? 152 LYS HHH CE   1 
ATOM   2276 N  NZ   . LYS B 2 152 ? 3.519   59.710 22.723 1.000 49.183 ? 152 LYS HHH NZ   1 
ATOM   2277 H  H    . LYS B 2 152 ? 0.894   59.957 15.760 1.000 42.094 ? 152 LYS HHH H    1 
ATOM   2278 H  HA   . LYS B 2 152 ? 2.315   57.709 16.590 1.000 41.075 ? 152 LYS HHH HA   1 
ATOM   2279 H  HB2  . LYS B 2 152 ? 2.921   59.865 17.504 1.000 43.110 ? 152 LYS HHH HB2  1 
ATOM   2280 H  HB3  . LYS B 2 152 ? 1.508   59.902 18.213 1.000 44.146 ? 152 LYS HHH HB3  1 
ATOM   2281 H  HG2  . LYS B 2 152 ? 2.207   57.870 19.382 1.000 43.983 ? 152 LYS HHH HG2  1 
ATOM   2282 H  HG3  . LYS B 2 152 ? 3.668   58.191 18.858 1.000 43.225 ? 152 LYS HHH HG3  1 
ATOM   2283 H  HD2  . LYS B 2 152 ? 3.789   60.106 20.101 1.000 45.864 ? 152 LYS HHH HD2  1 
ATOM   2284 H  HD3  . LYS B 2 152 ? 2.237   60.069 20.423 1.000 46.735 ? 152 LYS HHH HD3  1 
ATOM   2285 H  HE2  . LYS B 2 152 ? 2.575   58.176 21.797 1.000 47.300 ? 152 LYS HHH HE2  1 
ATOM   2286 H  HE3  . LYS B 2 152 ? 4.123   58.227 21.483 1.000 46.444 ? 152 LYS HHH HE3  1 
ATOM   2287 H  HZ1  . LYS B 2 152 ? 4.279   60.188 22.597 1.000 48.916 ? 152 LYS HHH HZ1  1 
ATOM   2288 H  HZ2  . LYS B 2 152 ? 3.587   59.244 23.499 1.000 49.294 ? 152 LYS HHH HZ2  1 
ATOM   2289 H  HZ3  . LYS B 2 152 ? 2.815   60.279 22.779 1.000 49.715 ? 152 LYS HHH HZ3  1 
ATOM   2290 N  N    . GLY B 2 153 ? 0.445   56.398 17.538 1.000 42.057 ? 153 GLY HHH N    1 
ATOM   2291 C  CA   . GLY B 2 153 ? -0.516  55.591 18.319 1.000 42.722 ? 153 GLY HHH CA   1 
ATOM   2292 C  C    . GLY B 2 153 ? -1.882  55.460 17.666 1.000 43.690 ? 153 GLY HHH C    1 
ATOM   2293 O  O    . GLY B 2 153 ? -2.857  55.915 18.285 1.000 44.779 ? 153 GLY HHH O    1 
ATOM   2294 H  H    . GLY B 2 153 ? 1.145   55.904 17.230 1.000 41.257 ? 153 GLY HHH H    1 
ATOM   2295 H  HA2  . GLY B 2 153 ? -0.134  54.689 18.452 1.000 42.081 ? 153 GLY HHH HA2  1 
ATOM   2296 H  HA3  . GLY B 2 153 ? -0.624  56.005 19.213 1.000 43.369 ? 153 GLY HHH HA3  1 
ATOM   2297 N  N    . TYR B 2 154 ? -1.963  54.809 16.499 1.000 43.738 ? 154 TYR HHH N    1 
ATOM   2298 C  CA   . TYR B 2 154 ? -3.221  54.593 15.730 1.000 45.348 ? 154 TYR HHH CA   1 
ATOM   2299 C  C    . TYR B 2 154 ? -3.411  53.109 15.387 1.000 45.858 ? 154 TYR HHH C    1 
ATOM   2300 O  O    . TYR B 2 154 ? -2.438  52.336 15.485 1.000 44.721 ? 154 TYR HHH O    1 
ATOM   2301 C  CB   . TYR B 2 154 ? -3.220  55.430 14.451 1.000 45.261 ? 154 TYR HHH CB   1 
ATOM   2302 C  CG   . TYR B 2 154 ? -2.115  55.089 13.486 1.000 43.742 ? 154 TYR HHH CG   1 
ATOM   2303 C  CD1  . TYR B 2 154 ? -0.872  55.697 13.575 1.000 42.618 ? 154 TYR HHH CD1  1 
ATOM   2304 C  CD2  . TYR B 2 154 ? -2.307  54.148 12.487 1.000 43.695 ? 154 TYR HHH CD2  1 
ATOM   2305 C  CE1  . TYR B 2 154 ? 0.149   55.382 12.693 1.000 41.673 ? 154 TYR HHH CE1  1 
ATOM   2306 C  CE2  . TYR B 2 154 ? -1.295  53.818 11.599 1.000 42.644 ? 154 TYR HHH CE2  1 
ATOM   2307 C  CZ   . TYR B 2 154 ? -0.063  54.439 11.702 1.000 41.420 ? 154 TYR HHH CZ   1 
ATOM   2308 O  OH   . TYR B 2 154 ? 0.931   54.122 10.827 1.000 39.964 ? 154 TYR HHH OH   1 
ATOM   2309 H  H    . TYR B 2 154 ? -1.240  54.435 16.091 1.000 42.891 ? 154 TYR HHH H    1 
ATOM   2310 H  HA   . TYR B 2 154 ? -3.986  54.879 16.291 1.000 46.347 ? 154 TYR HHH HA   1 
ATOM   2311 H  HB2  . TYR B 2 154 ? -4.082  55.309 14.001 1.000 46.110 ? 154 TYR HHH HB2  1 
ATOM   2312 H  HB3  . TYR B 2 154 ? -3.143  56.373 14.701 1.000 45.624 ? 154 TYR HHH HB3  1 
ATOM   2313 H  HD1  . TYR B 2 154 ? -0.719  56.340 14.248 1.000 42.844 ? 154 TYR HHH HD1  1 
ATOM   2314 H  HD2  . TYR B 2 154 ? -3.143  53.720 12.412 1.000 44.297 ? 154 TYR HHH HD2  1 
ATOM   2315 H  HE1  . TYR B 2 154 ? 0.987   55.807 12.767 1.000 41.264 ? 154 TYR HHH HE1  1 
ATOM   2316 H  HE2  . TYR B 2 154 ? -1.447  53.177 10.924 1.000 42.637 ? 154 TYR HHH HE2  1 
ATOM   2317 H  HH   . TYR B 2 154 ? 1.580   53.844 11.291 0.000 30.000 ? 154 TYR HHH HH   1 
ATOM   2318 N  N    . PHE B 2 155 ? -4.642  52.741 14.997 1.000 48.679 ? 155 PHE HHH N    1 
ATOM   2319 C  CA   . PHE B 2 155 ? -5.045  51.404 14.474 1.000 49.335 ? 155 PHE HHH CA   1 
ATOM   2320 C  C    . PHE B 2 155 ? -6.243  51.550 13.533 1.000 51.378 ? 155 PHE HHH C    1 
ATOM   2321 O  O    . PHE B 2 155 ? -7.117  52.374 13.800 1.000 51.711 ? 155 PHE HHH O    1 
ATOM   2322 C  CB   . PHE B 2 155 ? -5.397  50.466 15.634 1.000 49.913 ? 155 PHE HHH CB   1 
ATOM   2323 C  CG   . PHE B 2 155 ? -5.484  49.014 15.242 1.000 49.745 ? 155 PHE HHH CG   1 
ATOM   2324 C  CD1  . PHE B 2 155 ? -4.350  48.214 15.241 1.000 48.442 ? 155 PHE HHH CD1  1 
ATOM   2325 C  CD2  . PHE B 2 155 ? -6.688  48.458 14.839 1.000 51.530 ? 155 PHE HHH CD2  1 
ATOM   2326 C  CE1  . PHE B 2 155 ? -4.422  46.883 14.860 1.000 48.617 ? 155 PHE HHH CE1  1 
ATOM   2327 C  CE2  . PHE B 2 155 ? -6.759  47.127 14.452 1.000 51.685 ? 155 PHE HHH CE2  1 
ATOM   2328 C  CZ   . PHE B 2 155 ? -5.627  46.342 14.465 1.000 50.326 ? 155 PHE HHH CZ   1 
ATOM   2329 H  H    . PHE B 2 155 ? -5.349  53.315 15.034 1.000 49.475 ? 155 PHE HHH H    1 
ATOM   2330 H  HA   . PHE B 2 155 ? -4.285  51.021 13.971 1.000 48.411 ? 155 PHE HHH HA   1 
ATOM   2331 H  HB2  . PHE B 2 155 ? -4.717  50.567 16.332 1.000 49.182 ? 155 PHE HHH HB2  1 
ATOM   2332 H  HB3  . PHE B 2 155 ? -6.258  50.746 16.011 1.000 51.063 ? 155 PHE HHH HB3  1 
ATOM   2333 H  HD1  . PHE B 2 155 ? -3.522  48.580 15.507 1.000 47.724 ? 155 PHE HHH HD1  1 
ATOM   2334 H  HD2  . PHE B 2 155 ? -7.467  48.992 14.824 1.000 52.726 ? 155 PHE HHH HD2  1 
ATOM   2335 H  HE1  . PHE B 2 155 ? -3.645  46.347 14.870 1.000 47.605 ? 155 PHE HHH HE1  1 
ATOM   2336 H  HE2  . PHE B 2 155 ? -7.587  46.758 14.188 1.000 52.694 ? 155 PHE HHH HE2  1 
ATOM   2337 H  HZ   . PHE B 2 155 ? -5.678  45.434 14.210 1.000 50.022 ? 155 PHE HHH HZ   1 
ATOM   2338 N  N    . PRO B 2 156 ? -6.371  50.768 12.426 1.000 53.297 ? 156 PRO HHH N    1 
ATOM   2339 C  CA   . PRO B 2 156 ? -5.312  49.912 11.870 1.000 53.044 ? 156 PRO HHH CA   1 
ATOM   2340 C  C    . PRO B 2 156 ? -4.311  50.627 10.938 1.000 53.525 ? 156 PRO HHH C    1 
ATOM   2341 O  O    . PRO B 2 156 ? -4.208  51.836 11.023 1.000 54.177 ? 156 PRO HHH O    1 
ATOM   2342 C  CB   . PRO B 2 156 ? -6.124  48.842 11.117 1.000 53.560 ? 156 PRO HHH CB   1 
ATOM   2343 C  CG   . PRO B 2 156 ? -7.325  49.592 10.605 1.000 55.330 ? 156 PRO HHH CG   1 
ATOM   2344 C  CD   . PRO B 2 156 ? -7.639  50.592 11.699 1.000 55.557 ? 156 PRO HHH CD   1 
ATOM   2345 H  HA   . PRO B 2 156 ? -4.822  49.477 12.610 1.000 52.105 ? 156 PRO HHH HA   1 
ATOM   2346 H  HB2  . PRO B 2 156 ? -5.614  48.456 10.378 1.000 53.141 ? 156 PRO HHH HB2  1 
ATOM   2347 H  HB3  . PRO B 2 156 ? -6.398  48.120 11.723 1.000 53.651 ? 156 PRO HHH HB3  1 
ATOM   2348 H  HG2  . PRO B 2 156 ? -7.119  50.049 9.764  1.000 55.464 ? 156 PRO HHH HG2  1 
ATOM   2349 H  HG3  . PRO B 2 156 ? -8.080  48.986 10.461 1.000 56.302 ? 156 PRO HHH HG3  1 
ATOM   2350 H  HD2  . PRO B 2 156 ? -7.935  51.439 11.322 1.000 56.212 ? 156 PRO HHH HD2  1 
ATOM   2351 H  HD3  . PRO B 2 156 ? -8.334  50.252 12.293 1.000 56.261 ? 156 PRO HHH HD3  1 
ATOM   2352 N  N    . GLU B 2 157 ? -3.605  49.874 10.080 1.000 53.909 ? 157 GLU HHH N    1 
ATOM   2353 C  CA   . GLU B 2 157 ? -2.275  50.254 9.519  1.000 53.528 ? 157 GLU HHH CA   1 
ATOM   2354 C  C    . GLU B 2 157 ? -2.392  51.394 8.495  1.000 54.297 ? 157 GLU HHH C    1 
ATOM   2355 O  O    . GLU B 2 157 ? -1.433  52.188 8.415  1.000 54.069 ? 157 GLU HHH O    1 
ATOM   2356 C  CB   . GLU B 2 157 ? -1.570  49.053 8.878  1.000 53.431 ? 157 GLU HHH CB   1 
ATOM   2357 C  CG   . GLU B 2 157 ? -0.089  48.940 9.227  1.000 52.911 ? 157 GLU HHH CG   1 
ATOM   2358 C  CD   . GLU B 2 157 ? 0.806   50.140 8.930  1.000 53.438 ? 157 GLU HHH CD   1 
ATOM   2359 O  OE1  . GLU B 2 157 ? 0.470   51.272 9.347  1.000 53.130 ? 157 GLU HHH OE1  1 
ATOM   2360 O  OE2  . GLU B 2 157 ? 1.865   49.940 8.297  1.000 53.640 ? 157 GLU HHH OE2  1 
ATOM   2361 H  H    . GLU B 2 157 ? -3.905  49.074 9.773  1.000 54.035 ? 157 GLU HHH H    1 
ATOM   2362 H  HA   . GLU B 2 157 ? -1.720  50.574 10.267 1.000 52.808 ? 157 GLU HHH HA   1 
ATOM   2363 H  HB2  . GLU B 2 157 ? -2.024  48.233 9.166  1.000 53.601 ? 157 GLU HHH HB2  1 
ATOM   2364 H  HB3  . GLU B 2 157 ? -1.662  49.118 7.904  1.000 54.083 ? 157 GLU HHH HB3  1 
ATOM   2365 H  HG2  . GLU B 2 157 ? -0.016  48.746 10.184 1.000 52.358 ? 157 GLU HHH HG2  1 
ATOM   2366 H  HG3  . GLU B 2 157 ? 0.280   48.167 8.750  1.000 52.612 ? 157 GLU HHH HG3  1 
ATOM   2367 N  N    . SER B 2 158 ? -3.491  51.472 7.732  1.000 55.098 ? 158 SER HHH N    1 
ATOM   2368 C  CA   . SER B 2 158 ? -3.678  52.452 6.625  1.000 55.499 ? 158 SER HHH CA   1 
ATOM   2369 C  C    . SER B 2 158 ? -3.616  53.898 7.151  1.000 54.494 ? 158 SER HHH C    1 
ATOM   2370 O  O    . SER B 2 158 ? -4.551  54.307 7.873  1.000 55.565 ? 158 SER HHH O    1 
ATOM   2371 C  CB   . SER B 2 158 ? -4.972  52.198 5.870  1.000 58.266 ? 158 SER HHH CB   1 
ATOM   2372 O  OG   . SER B 2 158 ? -6.108  52.677 6.582  1.000 59.719 ? 158 SER HHH OG   1 
ATOM   2373 H  H    . SER B 2 158 ? -4.211  50.925 7.837  1.000 55.683 ? 158 SER HHH H    1 
ATOM   2374 H  HA   . SER B 2 158 ? -2.924  52.330 5.988  1.000 55.166 ? 158 SER HHH HA   1 
ATOM   2375 H  HB2  . SER B 2 158 ? -4.927  52.644 4.994  1.000 58.838 ? 158 SER HHH HB2  1 
ATOM   2376 H  HB3  . SER B 2 158 ? -5.070  51.232 5.712  1.000 58.120 ? 158 SER HHH HB3  1 
ATOM   2377 H  HG   . SER B 2 158 ? -6.811  52.552 6.052  0.000 30.000 ? 158 SER HHH HG   1 
ATOM   2378 N  N    . VAL B 2 159 ? -2.546  54.633 6.814  1.000 52.334 ? 159 VAL HHH N    1 
ATOM   2379 C  CA   . VAL B 2 159 ? -2.494  56.131 6.833  1.000 51.803 ? 159 VAL HHH CA   1 
ATOM   2380 C  C    . VAL B 2 159 ? -1.704  56.609 5.609  1.000 50.603 ? 159 VAL HHH C    1 
ATOM   2381 O  O    . VAL B 2 159 ? -0.756  55.915 5.212  1.000 49.474 ? 159 VAL HHH O    1 
ATOM   2382 C  CB   . VAL B 2 159 ? -1.889  56.708 8.130  1.000 51.236 ? 159 VAL HHH CB   1 
ATOM   2383 C  CG1  . VAL B 2 159 ? -2.692  56.313 9.359  1.000 51.551 ? 159 VAL HHH CG1  1 
ATOM   2384 C  CG2  . VAL B 2 159 ? -0.420  56.347 8.304  1.000 49.657 ? 159 VAL HHH CG2  1 
ATOM   2385 H  H    . VAL B 2 159 ? -1.761  54.253 6.552  1.000 51.730 ? 159 VAL HHH H    1 
ATOM   2386 H  HA   . VAL B 2 159 ? -3.405  56.459 6.751  1.000 52.884 ? 159 VAL HHH HA   1 
ATOM   2387 H  HB   . VAL B 2 159 ? -1.940  57.693 8.054  1.000 51.671 ? 159 VAL HHH HB   1 
ATOM   2388 H  HG11 . VAL B 2 159 ? -3.622  56.568 9.235  1.000 52.570 ? 159 VAL HHH HG11 1 
ATOM   2389 H  HG12 . VAL B 2 159 ? -2.333  56.766 10.142 1.000 51.084 ? 159 VAL HHH HG12 1 
ATOM   2390 H  HG13 . VAL B 2 159 ? -2.635  55.350 9.489  1.000 51.014 ? 159 VAL HHH HG13 1 
ATOM   2391 H  HG21 . VAL B 2 159 ? -0.278  55.423 8.035  1.000 49.344 ? 159 VAL HHH HG21 1 
ATOM   2392 H  HG22 . VAL B 2 159 ? -0.166  56.455 9.237  1.000 49.177 ? 159 VAL HHH HG22 1 
ATOM   2393 H  HG23 . VAL B 2 159 ? 0.127   56.932 7.751  1.000 49.771 ? 159 VAL HHH HG23 1 
ATOM   2394 N  N    . THR B 2 160 ? -2.089  57.753 5.038  1.000 51.043 ? 160 THR HHH N    1 
ATOM   2395 C  CA   . THR B 2 160 ? -1.326  58.480 3.983  1.000 50.432 ? 160 THR HHH CA   1 
ATOM   2396 C  C    . THR B 2 160 ? -0.926  59.858 4.531  1.000 49.439 ? 160 THR HHH C    1 
ATOM   2397 O  O    . THR B 2 160 ? -1.703  60.436 5.329  1.000 49.147 ? 160 THR HHH O    1 
ATOM   2398 C  CB   . THR B 2 160 ? -2.108  58.557 2.660  1.000 52.022 ? 160 THR HHH CB   1 
ATOM   2399 O  OG1  . THR B 2 160 ? -3.362  59.204 2.875  1.000 52.831 ? 160 THR HHH OG1  1 
ATOM   2400 C  CG2  . THR B 2 160 ? -2.356  57.197 2.043  1.000 52.296 ? 160 THR HHH CG2  1 
ATOM   2401 H  H    . THR B 2 160 ? -2.863  58.178 5.259  1.000 51.754 ? 160 THR HHH H    1 
ATOM   2402 H  HA   . THR B 2 160 ? -0.499  57.973 3.814  1.000 49.657 ? 160 THR HHH HA   1 
ATOM   2403 H  HB   . THR B 2 160 ? -1.579  59.097 2.025  1.000 52.282 ? 160 THR HHH HB   1 
ATOM   2404 H  HG1  . THR B 2 160 ? -3.801  59.162 2.036  0.000 30.000 ? 160 THR HHH HG1  1 
ATOM   2405 H  HG21 . THR B 2 160 ? -1.504  56.757 1.871  1.000 51.520 ? 160 THR HHH HG21 1 
ATOM   2406 H  HG22 . THR B 2 160 ? -2.841  57.302 1.205  1.000 53.622 ? 160 THR HHH HG22 1 
ATOM   2407 H  HG23 . THR B 2 160 ? -2.882  56.652 2.656  1.000 52.065 ? 160 THR HHH HG23 1 
ATOM   2408 N  N    . VAL B 2 161 ? 0.260   60.339 4.148  1.000 48.445 ? 161 VAL HHH N    1 
ATOM   2409 C  CA   . VAL B 2 161 ? 0.775   61.700 4.482  1.000 48.254 ? 161 VAL HHH CA   1 
ATOM   2410 C  C    . VAL B 2 161 ? 1.141   62.405 3.170  1.000 48.806 ? 161 VAL HHH C    1 
ATOM   2411 O  O    . VAL B 2 161 ? 1.867   61.811 2.358  1.000 48.377 ? 161 VAL HHH O    1 
ATOM   2412 C  CB   . VAL B 2 161 ? 1.971   61.628 5.449  1.000 47.172 ? 161 VAL HHH CB   1 
ATOM   2413 C  CG1  . VAL B 2 161 ? 2.395   63.010 5.932  1.000 47.606 ? 161 VAL HHH CG1  1 
ATOM   2414 C  CG2  . VAL B 2 161 ? 1.675   60.722 6.634  1.000 46.345 ? 161 VAL HHH CG2  1 
ATOM   2415 H  H    . VAL B 2 161 ? 0.843   59.850 3.646  1.000 48.275 ? 161 VAL HHH H    1 
ATOM   2416 H  HA   . VAL B 2 161 ? 0.062   62.200 4.912  1.000 48.731 ? 161 VAL HHH HA   1 
ATOM   2417 H  HB   . VAL B 2 161 ? 2.731   61.236 4.952  1.000 46.883 ? 161 VAL HHH HB   1 
ATOM   2418 H  HG11 . VAL B 2 161 ? 2.787   63.507 5.194  1.000 48.049 ? 161 VAL HHH HG11 1 
ATOM   2419 H  HG12 . VAL B 2 161 ? 3.051   62.919 6.645  1.000 46.782 ? 161 VAL HHH HG12 1 
ATOM   2420 H  HG13 . VAL B 2 161 ? 1.617   63.489 6.267  1.000 48.064 ? 161 VAL HHH HG13 1 
ATOM   2421 H  HG21 . VAL B 2 161 ? 0.804   60.946 7.005  1.000 46.787 ? 161 VAL HHH HG21 1 
ATOM   2422 H  HG22 . VAL B 2 161 ? 2.358   60.843 7.316  1.000 45.643 ? 161 VAL HHH HG22 1 
ATOM   2423 H  HG23 . VAL B 2 161 ? 1.673   59.794 6.342  1.000 46.019 ? 161 VAL HHH HG23 1 
ATOM   2424 N  N    . THR B 2 162 ? 0.623   63.616 2.964  1.000 49.741 ? 162 THR HHH N    1 
ATOM   2425 C  CA   . THR B 2 162 ? 0.901   64.475 1.782  1.000 50.809 ? 162 THR HHH CA   1 
ATOM   2426 C  C    . THR B 2 162 ? 1.392   65.827 2.300  1.000 50.407 ? 162 THR HHH C    1 
ATOM   2427 O  O    . THR B 2 162 ? 0.931   66.234 3.378  1.000 49.768 ? 162 THR HHH O    1 
ATOM   2428 C  CB   . THR B 2 162 ? -0.336  64.595 0.882  1.000 52.207 ? 162 THR HHH CB   1 
ATOM   2429 O  OG1  . THR B 2 162 ? -1.333  65.302 1.617  1.000 52.548 ? 162 THR HHH OG1  1 
ATOM   2430 C  CG2  . THR B 2 162 ? -0.891  63.257 0.443  1.000 52.218 ? 162 THR HHH CG2  1 
ATOM   2431 H  H    . THR B 2 162 ? 0.044   64.010 3.548  1.000 49.916 ? 162 THR HHH H    1 
ATOM   2432 H  HA   . THR B 2 162 ? 1.626   64.057 1.263  1.000 50.492 ? 162 THR HHH HA   1 
ATOM   2433 H  HB   . THR B 2 162 ? -0.092  65.120 0.082  1.000 53.104 ? 162 THR HHH HB   1 
ATOM   2434 H  HG1  . THR B 2 162 ? -1.893  65.403 1.041  0.000 30.000 ? 162 THR HHH HG1  1 
ATOM   2435 H  HG21 . THR B 2 162 ? -0.166  62.697 0.110  1.000 51.775 ? 162 THR HHH HG21 1 
ATOM   2436 H  HG22 . THR B 2 162 ? -1.547  63.392 -0.263 1.000 53.626 ? 162 THR HHH HG22 1 
ATOM   2437 H  HG23 . THR B 2 162 ? -1.317  62.817 1.201  1.000 51.677 ? 162 THR HHH HG23 1 
ATOM   2438 N  N    . TRP B 2 163 ? 2.294   66.476 1.561  1.000 50.858 ? 163 TRP HHH N    1 
ATOM   2439 C  CA   . TRP B 2 163 ? 2.923   67.773 1.931  1.000 50.887 ? 163 TRP HHH CA   1 
ATOM   2440 C  C    . TRP B 2 163 ? 2.566   68.858 0.914  1.000 53.250 ? 163 TRP HHH C    1 
ATOM   2441 O  O    . TRP B 2 163 ? 2.459   68.535 -0.279 1.000 54.567 ? 163 TRP HHH O    1 
ATOM   2442 C  CB   . TRP B 2 163 ? 4.445   67.627 2.005  1.000 49.480 ? 163 TRP HHH CB   1 
ATOM   2443 C  CG   . TRP B 2 163 ? 4.946   66.728 3.088  1.000 47.076 ? 163 TRP HHH CG   1 
ATOM   2444 C  CD1  . TRP B 2 163 ? 5.269   65.409 2.975  1.000 45.941 ? 163 TRP HHH CD1  1 
ATOM   2445 C  CD2  . TRP B 2 163 ? 5.223   67.099 4.448  1.000 45.969 ? 163 TRP HHH CD2  1 
ATOM   2446 N  NE1  . TRP B 2 163 ? 5.718   64.929 4.175  1.000 44.627 ? 163 TRP HHH NE1  1 
ATOM   2447 C  CE2  . TRP B 2 163 ? 5.701   65.941 5.099  1.000 44.556 ? 163 TRP HHH CE2  1 
ATOM   2448 C  CE3  . TRP B 2 163 ? 5.108   68.287 5.178  1.000 46.205 ? 163 TRP HHH CE3  1 
ATOM   2449 C  CZ2  . TRP B 2 163 ? 6.062   65.940 6.445  1.000 43.377 ? 163 TRP HHH CZ2  1 
ATOM   2450 C  CZ3  . TRP B 2 163 ? 5.473   68.286 6.507  1.000 45.494 ? 163 TRP HHH CZ3  1 
ATOM   2451 C  CH2  . TRP B 2 163 ? 5.934   67.125 7.131  1.000 44.001 ? 163 TRP HHH CH2  1 
ATOM   2452 H  H    . TRP B 2 163 ? 2.590   66.157 0.761  1.000 51.236 ? 163 TRP HHH H    1 
ATOM   2453 H  HA   . TRP B 2 163 ? 2.592   68.039 2.820  1.000 50.534 ? 163 TRP HHH HA   1 
ATOM   2454 H  HB2  . TRP B 2 163 ? 4.759   67.288 1.142  1.000 49.864 ? 163 TRP HHH HB2  1 
ATOM   2455 H  HB3  . TRP B 2 163 ? 4.830   68.518 2.131  1.000 49.771 ? 163 TRP HHH HB3  1 
ATOM   2456 H  HD1  . TRP B 2 163 ? 5.193   64.894 2.186  1.000 46.378 ? 163 TRP HHH HD1  1 
ATOM   2457 H  HE1  . TRP B 2 163 ? 5.970   64.106 4.326  1.000 43.972 ? 163 TRP HHH HE1  1 
ATOM   2458 H  HE3  . TRP B 2 163 ? 4.797   69.076 4.765  1.000 47.134 ? 163 TRP HHH HE3  1 
ATOM   2459 H  HZ2  . TRP B 2 163 ? 6.375   65.158 6.865  1.000 42.792 ? 163 TRP HHH HZ2  1 
ATOM   2460 H  HZ3  . TRP B 2 163 ? 5.396   69.081 7.010  1.000 45.770 ? 163 TRP HHH HZ3  1 
ATOM   2461 H  HH2  . TRP B 2 163 ? 6.171   67.156 8.039  1.000 43.715 ? 163 TRP HHH HH2  1 
ATOM   2462 N  N    . ASN B 2 164 ? 2.451   70.105 1.376  1.000 54.931 ? 164 ASN HHH N    1 
ATOM   2463 C  CA   . ASN B 2 164 ? 2.477   71.330 0.530  1.000 57.395 ? 164 ASN HHH CA   1 
ATOM   2464 C  C    . ASN B 2 164 ? 3.573   72.258 1.077  1.000 57.659 ? 164 ASN HHH C    1 
ATOM   2465 O  O    . ASN B 2 164 ? 3.763   72.278 2.314  1.000 55.520 ? 164 ASN HHH O    1 
ATOM   2466 C  CB   . ASN B 2 164 ? 1.092   71.984 0.445  1.000 58.734 ? 164 ASN HHH CB   1 
ATOM   2467 C  CG   . ASN B 2 164 ? 0.036   71.087 -0.175 1.000 59.677 ? 164 ASN HHH CG   1 
ATOM   2468 O  OD1  . ASN B 2 164 ? -1.157  71.306 0.016  1.000 61.053 ? 164 ASN HHH OD1  1 
ATOM   2469 N  ND2  . ASN B 2 164 ? 0.449   70.080 -0.928 1.000 59.086 ? 164 ASN HHH ND2  1 
ATOM   2470 H  H    . ASN B 2 164 ? 2.343   70.284 2.262  1.000 54.283 ? 164 ASN HHH H    1 
ATOM   2471 H  HA   . ASN B 2 164 ? 2.732   71.063 -0.384 1.000 57.911 ? 164 ASN HHH HA   1 
ATOM   2472 H  HB2  . ASN B 2 164 ? 0.806   72.234 1.348  1.000 58.346 ? 164 ASN HHH HB2  1 
ATOM   2473 H  HB3  . ASN B 2 164 ? 1.164   72.804 -0.085 1.000 59.829 ? 164 ASN HHH HB3  1 
ATOM   2474 H  HD21 . ASN B 2 164 ? -0.170  69.344 -1.208 0.000 30.000 ? 164 ASN HHH HD21 1 
ATOM   2475 H  HD22 . ASN B 2 164 ? 1.279   69.736 -0.904 0.000 30.000 ? 164 ASN HHH HD22 1 
ATOM   2476 N  N    . SER B 2 165 ? 4.286   72.959 0.182  1.000 59.891 ? 165 SER HHH N    1 
ATOM   2477 C  CA   . SER B 2 165 ? 5.427   73.870 0.488  1.000 60.341 ? 165 SER HHH CA   1 
ATOM   2478 C  C    . SER B 2 165 ? 5.347   75.137 -0.376 1.000 61.427 ? 165 SER HHH C    1 
ATOM   2479 O  O    . SER B 2 165 ? 5.243   74.982 -1.608 1.000 61.787 ? 165 SER HHH O    1 
ATOM   2480 C  CB   . SER B 2 165 ? 6.760   73.164 0.310  1.000 60.210 ? 165 SER HHH CB   1 
ATOM   2481 O  OG   . SER B 2 165 ? 6.940   72.710 -1.026 1.000 61.655 ? 165 SER HHH OG   1 
ATOM   2482 H  H    . SER B 2 165 ? 4.115   72.921 -0.712 1.000 60.598 ? 165 SER HHH H    1 
ATOM   2483 H  HA   . SER B 2 165 ? 5.348   74.145 1.441  1.000 59.626 ? 165 SER HHH HA   1 
ATOM   2484 H  HB2  . SER B 2 165 ? 7.488   73.782 0.544  1.000 60.387 ? 165 SER HHH HB2  1 
ATOM   2485 H  HB3  . SER B 2 165 ? 6.804   72.395 0.923  1.000 59.090 ? 165 SER HHH HB3  1 
ATOM   2486 H  HG   . SER B 2 165 ? 7.813   72.274 -1.112 0.000 30.000 ? 165 SER HHH HG   1 
ATOM   2487 N  N    . SER B 2 170 ? 11.871  69.388 -4.283 1.000 71.630 ? 170 SER HHH N    1 
ATOM   2488 C  CA   . SER B 2 170 ? 11.792  69.243 -2.805 1.000 69.186 ? 170 SER HHH CA   1 
ATOM   2489 C  C    . SER B 2 170 ? 11.176  67.878 -2.469 1.000 67.722 ? 170 SER HHH C    1 
ATOM   2490 O  O    . SER B 2 170 ? 9.943   67.744 -2.596 1.000 68.542 ? 170 SER HHH O    1 
ATOM   2491 C  CB   . SER B 2 170 ? 11.013  70.388 -2.196 1.000 68.991 ? 170 SER HHH CB   1 
ATOM   2492 O  OG   . SER B 2 170 ? 11.372  71.628 -2.797 1.000 70.102 ? 170 SER HHH OG   1 
ATOM   2493 H  H    . SER B 2 170 ? 11.195  69.924 -4.578 1.000 72.065 ? 170 SER HHH H    1 
ATOM   2494 H  HA   . SER B 2 170 ? 12.719  69.265 -2.444 1.000 69.110 ? 170 SER HHH HA   1 
ATOM   2495 H  HB2  . SER B 2 170 ? 10.050  70.233 -2.320 1.000 68.766 ? 170 SER HHH HB2  1 
ATOM   2496 H  HB3  . SER B 2 170 ? 11.194  70.428 -1.231 1.000 67.776 ? 170 SER HHH HB3  1 
ATOM   2497 H  HG   . SER B 2 170 ? 11.058  72.433 -2.701 0.000 30.000 ? 170 SER HHH HG   1 
ATOM   2498 N  N    . SER B 2 171 ? 12.009  66.911 -2.062 1.000 66.377 ? 171 SER HHH N    1 
ATOM   2499 C  CA   . SER B 2 171 ? 11.701  65.453 -2.039 1.000 64.583 ? 171 SER HHH CA   1 
ATOM   2500 C  C    . SER B 2 171 ? 11.281  64.977 -0.641 1.000 61.389 ? 171 SER HHH C    1 
ATOM   2501 O  O    . SER B 2 171 ? 11.852  65.463 0.354  1.000 60.456 ? 171 SER HHH O    1 
ATOM   2502 C  CB   . SER B 2 171 ? 12.881  64.669 -2.523 1.000 65.361 ? 171 SER HHH CB   1 
ATOM   2503 O  OG   . SER B 2 171 ? 13.998  64.918 -1.687 1.000 65.233 ? 171 SER HHH OG   1 
ATOM   2504 H  H    . SER B 2 171 ? 12.849  67.085 -1.756 1.000 66.300 ? 171 SER HHH H    1 
ATOM   2505 H  HA   . SER B 2 171 ? 10.942  65.291 -2.662 1.000 65.051 ? 171 SER HHH HA   1 
ATOM   2506 H  HB2  . SER B 2 171 ? 12.667  63.709 -2.513 1.000 64.758 ? 171 SER HHH HB2  1 
ATOM   2507 H  HB3  . SER B 2 171 ? 13.094  64.929 -3.447 1.000 66.715 ? 171 SER HHH HB3  1 
ATOM   2508 H  HG   . SER B 2 171 ? 14.478  64.413 -1.771 0.000 30.000 ? 171 SER HHH HG   1 
ATOM   2509 N  N    . VAL B 2 172 ? 10.368  63.999 -0.601 1.000 59.735 ? 172 VAL HHH N    1 
ATOM   2510 C  CA   . VAL B 2 172 ? 9.689   63.461 0.617  1.000 57.389 ? 172 VAL HHH CA   1 
ATOM   2511 C  C    . VAL B 2 172 ? 10.203  62.039 0.903  1.000 56.489 ? 172 VAL HHH C    1 
ATOM   2512 O  O    . VAL B 2 172 ? 10.379  61.276 -0.059 1.000 57.429 ? 172 VAL HHH O    1 
ATOM   2513 C  CB   . VAL B 2 172 ? 8.160   63.477 0.405  1.000 56.942 ? 172 VAL HHH CB   1 
ATOM   2514 C  CG1  . VAL B 2 172 ? 7.403   62.726 1.491  1.000 55.465 ? 172 VAL HHH CG1  1 
ATOM   2515 C  CG2  . VAL B 2 172 ? 7.631   64.894 0.270  1.000 57.705 ? 172 VAL HHH CG2  1 
ATOM   2516 H  H    . VAL B 2 172 ? 10.094  63.577 -1.361 1.000 60.353 ? 172 VAL HHH H    1 
ATOM   2517 H  HA   . VAL B 2 172 ? 9.907   64.032 1.375  1.000 57.024 ? 172 VAL HHH HA   1 
ATOM   2518 H  HB   . VAL B 2 172 ? 7.983   63.014 -0.451 1.000 57.660 ? 172 VAL HHH HB   1 
ATOM   2519 H  HG11 . VAL B 2 172 ? 7.429   61.771 1.305  1.000 55.176 ? 172 VAL HHH HG11 1 
ATOM   2520 H  HG12 . VAL B 2 172 ? 6.478   63.025 1.509  1.000 55.769 ? 172 VAL HHH HG12 1 
ATOM   2521 H  HG13 . VAL B 2 172 ? 7.815   62.899 2.354  1.000 54.764 ? 172 VAL HHH HG13 1 
ATOM   2522 H  HG21 . VAL B 2 172 ? 7.804   65.386 1.092  1.000 57.215 ? 172 VAL HHH HG21 1 
ATOM   2523 H  HG22 . VAL B 2 172 ? 6.673   64.870 0.104  1.000 58.054 ? 172 VAL HHH HG22 1 
ATOM   2524 H  HG23 . VAL B 2 172 ? 8.076   65.339 -0.472 1.000 58.730 ? 172 VAL HHH HG23 1 
ATOM   2525 N  N    . HIS B 2 173 ? 10.422  61.692 2.177  1.000 55.761 ? 173 HIS HHH N    1 
ATOM   2526 C  CA   . HIS B 2 173 ? 10.718  60.311 2.655  1.000 55.030 ? 173 HIS HHH CA   1 
ATOM   2527 C  C    . HIS B 2 173 ? 9.633   59.879 3.648  1.000 53.665 ? 173 HIS HHH C    1 
ATOM   2528 O  O    . HIS B 2 173 ? 9.504   60.552 4.692  1.000 53.703 ? 173 HIS HHH O    1 
ATOM   2529 C  CB   . HIS B 2 173 ? 12.108  60.226 3.309  1.000 55.444 ? 173 HIS HHH CB   1 
ATOM   2530 C  CG   . HIS B 2 173 ? 13.246  60.415 2.364  1.000 57.542 ? 173 HIS HHH CG   1 
ATOM   2531 N  ND1  . HIS B 2 173 ? 13.883  61.633 2.223  1.000 59.754 ? 173 HIS HHH ND1  1 
ATOM   2532 C  CD2  . HIS B 2 173 ? 13.863  59.559 1.519  1.000 58.879 ? 173 HIS HHH CD2  1 
ATOM   2533 C  CE1  . HIS B 2 173 ? 14.842  61.526 1.327  1.000 61.545 ? 173 HIS HHH CE1  1 
ATOM   2534 N  NE2  . HIS B 2 173 ? 14.852  60.257 0.877  1.000 61.323 ? 173 HIS HHH NE2  1 
ATOM   2535 H  H    . HIS B 2 173 ? 10.406  62.295 2.860  1.000 55.455 ? 173 HIS HHH H    1 
ATOM   2536 H  HA   . HIS B 2 173 ? 10.693  59.702 1.881  1.000 55.416 ? 173 HIS HHH HA   1 
ATOM   2537 H  HB2  . HIS B 2 173 ? 12.167  60.909 4.013  1.000 55.292 ? 173 HIS HHH HB2  1 
ATOM   2538 H  HB3  . HIS B 2 173 ? 12.200  59.347 3.740  1.000 54.743 ? 173 HIS HHH HB3  1 
ATOM   2539 H  HD1  . HIS B 2 173 ? 13.834  62.299 2.513  0.000 30.000 ? 173 HIS HHH HD1  1 
ATOM   2540 H  HD2  . HIS B 2 173 ? 13.653  58.653 1.389  1.000 58.569 ? 173 HIS HHH HD2  1 
ATOM   2541 H  HE1  . HIS B 2 173 ? 15.418  62.217 1.053  1.000 62.292 ? 173 HIS HHH HE1  1 
ATOM   2542 H  HE2  . HIS B 2 173 ? 15.356  59.734 0.104  0.000 30.000 ? 173 HIS HHH HE2  1 
ATOM   2543 N  N    . THR B 2 174 ? 8.904   58.795 3.349  1.000 52.567 ? 174 THR HHH N    1 
ATOM   2544 C  CA   . THR B 2 174 ? 7.795   58.256 4.189  1.000 50.983 ? 174 THR HHH CA   1 
ATOM   2545 C  C    . THR B 2 174 ? 8.207   56.914 4.807  1.000 48.231 ? 174 THR HHH C    1 
ATOM   2546 O  O    . THR B 2 174 ? 8.330   55.931 4.061  1.000 47.981 ? 174 THR HHH O    1 
ATOM   2547 C  CB   . THR B 2 174 ? 6.500   58.149 3.377  1.000 52.211 ? 174 THR HHH CB   1 
ATOM   2548 O  OG1  . THR B 2 174 ? 5.985   59.475 3.238  1.000 53.240 ? 174 THR HHH OG1  1 
ATOM   2549 C  CG2  . THR B 2 174 ? 5.460   57.259 4.023  1.000 51.755 ? 174 THR HHH CG2  1 
ATOM   2550 H  H    . THR B 2 174 ? 9.039   58.300 2.596  1.000 52.972 ? 174 THR HHH H    1 
ATOM   2551 H  HA   . THR B 2 174 ? 7.640   58.895 4.923  1.000 50.681 ? 174 THR HHH HA   1 
ATOM   2552 H  HB   . THR B 2 174 ? 6.719   57.792 2.483  1.000 52.747 ? 174 THR HHH HB   1 
ATOM   2553 H  HG1  . THR B 2 174 ? 5.419   59.584 2.851  0.000 30.000 ? 174 THR HHH HG1  1 
ATOM   2554 H  HG21 . THR B 2 174 ? 5.659   56.326 3.823  1.000 51.422 ? 174 THR HHH HG21 1 
ATOM   2555 H  HG22 . THR B 2 174 ? 4.579   57.482 3.673  1.000 52.375 ? 174 THR HHH HG22 1 
ATOM   2556 H  HG23 . THR B 2 174 ? 5.468   57.393 4.987  1.000 51.070 ? 174 THR HHH HG23 1 
ATOM   2557 N  N    . PHE B 2 175 ? 8.365   56.878 6.130  1.000 46.146 ? 175 PHE HHH N    1 
ATOM   2558 C  CA   . PHE B 2 175 ? 8.970   55.746 6.878  1.000 45.922 ? 175 PHE HHH CA   1 
ATOM   2559 C  C    . PHE B 2 175 ? 7.905   54.698 7.173  1.000 46.371 ? 175 PHE HHH C    1 
ATOM   2560 O  O    . PHE B 2 175 ? 6.758   55.044 7.442  1.000 46.645 ? 175 PHE HHH O    1 
ATOM   2561 C  CB   . PHE B 2 175 ? 9.648   56.256 8.153  1.000 44.719 ? 175 PHE HHH CB   1 
ATOM   2562 C  CG   . PHE B 2 175 ? 10.759  57.226 7.854  1.000 44.796 ? 175 PHE HHH CG   1 
ATOM   2563 C  CD1  . PHE B 2 175 ? 12.043  56.773 7.611  1.000 44.586 ? 175 PHE HHH CD1  1 
ATOM   2564 C  CD2  . PHE B 2 175 ? 10.503  58.583 7.737  1.000 45.274 ? 175 PHE HHH CD2  1 
ATOM   2565 C  CE1  . PHE B 2 175 ? 13.055  57.666 7.297  1.000 45.522 ? 175 PHE HHH CE1  1 
ATOM   2566 C  CE2  . PHE B 2 175 ? 11.516  59.471 7.420  1.000 45.552 ? 175 PHE HHH CE2  1 
ATOM   2567 C  CZ   . PHE B 2 175 ? 12.789  59.011 7.199  1.000 45.612 ? 175 PHE HHH CZ   1 
ATOM   2568 H  H    . PHE B 2 175 ? 8.094   57.552 6.680  1.000 46.602 ? 175 PHE HHH H    1 
ATOM   2569 H  HA   . PHE B 2 175 ? 9.662   55.332 6.303  1.000 45.980 ? 175 PHE HHH HA   1 
ATOM   2570 H  HB2  . PHE B 2 175 ? 8.977   56.695 8.716  1.000 44.714 ? 175 PHE HHH HB2  1 
ATOM   2571 H  HB3  . PHE B 2 175 ? 10.010  55.492 8.647  1.000 44.254 ? 175 PHE HHH HB3  1 
ATOM   2572 H  HD1  . PHE B 2 175 ? 12.232  55.850 7.671  1.000 44.286 ? 175 PHE HHH HD1  1 
ATOM   2573 H  HD2  . PHE B 2 175 ? 9.630   58.905 7.882  1.000 45.190 ? 175 PHE HHH HD2  1 
ATOM   2574 H  HE1  . PHE B 2 175 ? 13.930  57.348 7.147  1.000 45.619 ? 175 PHE HHH HE1  1 
ATOM   2575 H  HE2  . PHE B 2 175 ? 11.331  60.395 7.359  1.000 46.142 ? 175 PHE HHH HE2  1 
ATOM   2576 H  HZ   . PHE B 2 175 ? 13.481  59.616 6.988  1.000 46.441 ? 175 PHE HHH HZ   1 
ATOM   2577 N  N    . PRO B 2 176 ? 8.256   53.390 7.155  1.000 46.507 ? 176 PRO HHH N    1 
ATOM   2578 C  CA   . PRO B 2 176 ? 7.284   52.335 7.423  1.000 45.775 ? 176 PRO HHH CA   1 
ATOM   2579 C  C    . PRO B 2 176 ? 6.912   52.409 8.909  1.000 44.899 ? 176 PRO HHH C    1 
ATOM   2580 O  O    . PRO B 2 176 ? 7.727   52.868 9.694  1.000 44.002 ? 176 PRO HHH O    1 
ATOM   2581 C  CB   . PRO B 2 176 ? 8.043   51.055 7.060  1.000 46.041 ? 176 PRO HHH CB   1 
ATOM   2582 C  CG   . PRO B 2 176 ? 9.480   51.404 7.389  1.000 46.474 ? 176 PRO HHH CG   1 
ATOM   2583 C  CD   . PRO B 2 176 ? 9.616   52.855 6.967  1.000 47.208 ? 176 PRO HHH CD   1 
ATOM   2584 H  HA   . PRO B 2 176 ? 6.487   52.444 6.845  1.000 46.414 ? 176 PRO HHH HA   1 
ATOM   2585 H  HB2  . PRO B 2 176 ? 7.733   50.294 7.595  1.000 45.556 ? 176 PRO HHH HB2  1 
ATOM   2586 H  HB3  . PRO B 2 176 ? 7.942   50.840 6.108  1.000 46.558 ? 176 PRO HHH HB3  1 
ATOM   2587 H  HG2  . PRO B 2 176 ? 9.652   51.303 8.347  1.000 45.840 ? 176 PRO HHH HG2  1 
ATOM   2588 H  HG3  . PRO B 2 176 ? 10.101  50.835 6.894  1.000 46.439 ? 176 PRO HHH HG3  1 
ATOM   2589 H  HD2  . PRO B 2 176 ? 10.258  53.325 7.529  1.000 46.919 ? 176 PRO HHH HD2  1 
ATOM   2590 H  HD3  . PRO B 2 176 ? 9.895   52.926 6.036  1.000 47.594 ? 176 PRO HHH HD3  1 
ATOM   2591 N  N    . ALA B 2 177 ? 5.695   51.985 9.244  1.000 44.578 ? 177 ALA HHH N    1 
ATOM   2592 C  CA   . ALA B 2 177 ? 5.099   52.125 10.588 1.000 44.590 ? 177 ALA HHH CA   1 
ATOM   2593 C  C    . ALA B 2 177 ? 5.710   51.089 11.534 1.000 44.196 ? 177 ALA HHH C    1 
ATOM   2594 O  O    . ALA B 2 177 ? 6.173   50.042 11.054 1.000 43.797 ? 177 ALA HHH O    1 
ATOM   2595 C  CB   . ALA B 2 177 ? 3.601   51.988 10.499 1.000 45.550 ? 177 ALA HHH CB   1 
ATOM   2596 H  H    . ALA B 2 177 ? 5.135   51.568 8.658  1.000 44.997 ? 177 ALA HHH H    1 
ATOM   2597 H  HA   . ALA B 2 177 ? 5.315   53.022 10.931 1.000 44.822 ? 177 ALA HHH HA   1 
ATOM   2598 H  HB1  . ALA B 2 177 ? 3.205   52.174 11.367 1.000 45.479 ? 177 ALA HHH HB1  1 
ATOM   2599 H  HB2  . ALA B 2 177 ? 3.255   52.618 9.845  1.000 46.032 ? 177 ALA HHH HB2  1 
ATOM   2600 H  HB3  . ALA B 2 177 ? 3.373   51.083 10.227 1.000 45.345 ? 177 ALA HHH HB3  1 
ATOM   2601 N  N    . LEU B 2 178 ? 5.696   51.399 12.833 1.000 45.082 ? 178 LEU HHH N    1 
ATOM   2602 C  CA   . LEU B 2 178 ? 6.241   50.567 13.937 1.000 44.958 ? 178 LEU HHH CA   1 
ATOM   2603 C  C    . LEU B 2 178 ? 5.082   50.135 14.833 1.000 45.162 ? 178 LEU HHH C    1 
ATOM   2604 O  O    . LEU B 2 178 ? 4.232   50.981 15.135 1.000 46.005 ? 178 LEU HHH O    1 
ATOM   2605 C  CB   . LEU B 2 178 ? 7.252   51.398 14.731 1.000 45.829 ? 178 LEU HHH CB   1 
ATOM   2606 C  CG   . LEU B 2 178 ? 7.960   50.671 15.877 1.000 45.923 ? 178 LEU HHH CG   1 
ATOM   2607 C  CD1  . LEU B 2 178 ? 9.295   50.104 15.412 1.000 45.704 ? 178 LEU HHH CD1  1 
ATOM   2608 C  CD2  . LEU B 2 178 ? 8.160   51.599 17.071 1.000 46.621 ? 178 LEU HHH CD2  1 
ATOM   2609 H  H    . LEU B 2 178 ? 5.331   52.179 13.132 1.000 45.307 ? 178 LEU HHH H    1 
ATOM   2610 H  HA   . LEU B 2 178 ? 6.679   49.771 13.557 1.000 44.670 ? 178 LEU HHH HA   1 
ATOM   2611 H  HB2  . LEU B 2 178 ? 7.929   51.733 14.111 1.000 45.742 ? 178 LEU HHH HB2  1 
ATOM   2612 H  HB3  . LEU B 2 178 ? 6.785   52.175 15.099 1.000 46.144 ? 178 LEU HHH HB3  1 
ATOM   2613 H  HG   . LEU B 2 178 ? 7.390   49.917 16.166 1.000 45.737 ? 178 LEU HHH HG   1 
ATOM   2614 H  HD11 . LEU B 2 178 ? 9.153   49.527 14.642 1.000 45.417 ? 178 LEU HHH HD11 1 
ATOM   2615 H  HD12 . LEU B 2 178 ? 9.698   49.589 16.133 1.000 45.585 ? 178 LEU HHH HD12 1 
ATOM   2616 H  HD13 . LEU B 2 178 ? 9.890   50.833 15.165 1.000 45.925 ? 178 LEU HHH HD13 1 
ATOM   2617 H  HD21 . LEU B 2 178 ? 8.747   52.333 16.818 1.000 46.802 ? 178 LEU HHH HD21 1 
ATOM   2618 H  HD22 . LEU B 2 178 ? 8.560   51.101 17.805 1.000 46.561 ? 178 LEU HHH HD22 1 
ATOM   2619 H  HD23 . LEU B 2 178 ? 7.300   51.955 17.354 1.000 46.903 ? 178 LEU HHH HD23 1 
ATOM   2620 N  N    . LEU B 2 179 ? 5.065   48.868 15.244 1.000 45.785 ? 179 LEU HHH N    1 
ATOM   2621 C  CA   . LEU B 2 179 ? 4.027   48.295 16.139 1.000 45.760 ? 179 LEU HHH CA   1 
ATOM   2622 C  C    . LEU B 2 179 ? 4.592   48.291 17.560 1.000 45.504 ? 179 LEU HHH C    1 
ATOM   2623 O  O    . LEU B 2 179 ? 5.667   47.709 17.765 1.000 45.797 ? 179 LEU HHH O    1 
ATOM   2624 C  CB   . LEU B 2 179 ? 3.660   46.889 15.645 1.000 45.217 ? 179 LEU HHH CB   1 
ATOM   2625 C  CG   . LEU B 2 179 ? 2.458   46.214 16.313 1.000 45.800 ? 179 LEU HHH CG   1 
ATOM   2626 C  CD1  . LEU B 2 179 ? 1.327   47.197 16.579 1.000 46.702 ? 179 LEU HHH CD1  1 
ATOM   2627 C  CD2  . LEU B 2 179 ? 1.958   45.043 15.477 1.000 45.494 ? 179 LEU HHH CD2  1 
ATOM   2628 H  H    . LEU B 2 179 ? 5.704   48.267 14.998 1.000 45.056 ? 179 LEU HHH H    1 
ATOM   2629 H  HA   . LEU B 2 179 ? 3.234   48.876 16.110 1.000 46.272 ? 179 LEU HHH HA   1 
ATOM   2630 H  HB2  . LEU B 2 179 ? 3.484   46.943 14.684 1.000 45.355 ? 179 LEU HHH HB2  1 
ATOM   2631 H  HB3  . LEU B 2 179 ? 4.440   46.312 15.765 1.000 44.808 ? 179 LEU HHH HB3  1 
ATOM   2632 H  HG   . LEU B 2 179 ? 2.759   45.856 17.185 1.000 45.602 ? 179 LEU HHH HG   1 
ATOM   2633 H  HD11 . LEU B 2 179 ? 1.544   47.740 17.357 1.000 46.885 ? 179 LEU HHH HD11 1 
ATOM   2634 H  HD12 . LEU B 2 179 ? 0.503   46.708 16.747 1.000 47.199 ? 179 LEU HHH HD12 1 
ATOM   2635 H  HD13 . LEU B 2 179 ? 1.208   47.774 15.805 1.000 46.880 ? 179 LEU HHH HD13 1 
ATOM   2636 H  HD21 . LEU B 2 179 ? 1.630   45.372 14.621 1.000 45.846 ? 179 LEU HHH HD21 1 
ATOM   2637 H  HD22 . LEU B 2 179 ? 1.236   44.592 15.948 1.000 45.978 ? 179 LEU HHH HD22 1 
ATOM   2638 H  HD23 . LEU B 2 179 ? 2.687   44.417 15.326 1.000 45.007 ? 179 LEU HHH HD23 1 
ATOM   2639 N  N    . GLN B 2 180 ? 3.912   48.971 18.480 1.000 47.020 ? 180 GLN HHH N    1 
ATOM   2640 C  CA   . GLN B 2 180 ? 4.252   49.022 19.924 1.000 49.104 ? 180 GLN HHH CA   1 
ATOM   2641 C  C    . GLN B 2 180 ? 2.940   48.988 20.714 1.000 49.876 ? 180 GLN HHH C    1 
ATOM   2642 O  O    . GLN B 2 180 ? 2.108   49.899 20.505 1.000 50.228 ? 180 GLN HHH O    1 
ATOM   2643 C  CB   . GLN B 2 180 ? 5.075   50.279 20.216 1.000 51.250 ? 180 GLN HHH CB   1 
ATOM   2644 C  CG   . GLN B 2 180 ? 5.805   50.261 21.554 1.000 52.904 ? 180 GLN HHH CG   1 
ATOM   2645 C  CD   . GLN B 2 180 ? 6.785   51.407 21.647 1.000 54.389 ? 180 GLN HHH CD   1 
ATOM   2646 O  OE1  . GLN B 2 180 ? 6.595   52.460 21.037 1.000 54.940 ? 180 GLN HHH OE1  1 
ATOM   2647 N  NE2  . GLN B 2 180 ? 7.854   51.205 22.402 1.000 54.541 ? 180 GLN HHH NE2  1 
ATOM   2648 H  H    . GLN B 2 180 ? 3.177   49.466 18.269 1.000 47.674 ? 180 GLN HHH H    1 
ATOM   2649 H  HA   . GLN B 2 180 ? 4.786   48.226 20.153 1.000 48.702 ? 180 GLN HHH HA   1 
ATOM   2650 H  HB2  . GLN B 2 180 ? 5.732   50.390 19.497 1.000 50.608 ? 180 GLN HHH HB2  1 
ATOM   2651 H  HB3  . GLN B 2 180 ? 4.475   51.053 20.192 1.000 51.592 ? 180 GLN HHH HB3  1 
ATOM   2652 H  HG2  . GLN B 2 180 ? 5.153   50.330 22.284 1.000 53.567 ? 180 GLN HHH HG2  1 
ATOM   2653 H  HG3  . GLN B 2 180 ? 6.287   49.412 21.653 1.000 52.502 ? 180 GLN HHH HG3  1 
ATOM   2654 H  HE21 . GLN B 2 180 ? 8.637   51.993 22.080 0.000 30.000 ? 180 GLN HHH HE21 1 
ATOM   2655 H  HE22 . GLN B 2 180 ? 8.232   50.583 22.515 0.000 30.000 ? 180 GLN HHH HE22 1 
ATOM   2656 N  N    . SER B 2 181 ? 2.749   47.953 21.540 1.000 50.133 ? 181 SER HHH N    1 
ATOM   2657 C  CA   . SER B 2 181 ? 1.562   47.763 22.418 1.000 51.354 ? 181 SER HHH CA   1 
ATOM   2658 C  C    . SER B 2 181 ? 0.277   47.744 21.579 1.000 50.397 ? 181 SER HHH C    1 
ATOM   2659 O  O    . SER B 2 181 ? -0.716  48.366 22.003 1.000 50.933 ? 181 SER HHH O    1 
ATOM   2660 C  CB   . SER B 2 181 ? 1.503   48.840 23.477 1.000 53.104 ? 181 SER HHH CB   1 
ATOM   2661 O  OG   . SER B 2 181 ? 2.737   48.932 24.172 1.000 53.899 ? 181 SER HHH OG   1 
ATOM   2662 H  H    . SER B 2 181 ? 3.347   47.272 21.625 1.000 49.653 ? 181 SER HHH H    1 
ATOM   2663 H  HA   . SER B 2 181 ? 1.654   46.884 22.868 1.000 51.125 ? 181 SER HHH HA   1 
ATOM   2664 H  HB2  . SER B 2 181 ? 1.298   49.704 23.055 1.000 53.334 ? 181 SER HHH HB2  1 
ATOM   2665 H  HB3  . SER B 2 181 ? 0.783   48.631 24.115 1.000 54.040 ? 181 SER HHH HB3  1 
ATOM   2666 H  HG   . SER B 2 181 ? 2.559   49.806 24.482 0.000 30.000 ? 181 SER HHH HG   1 
ATOM   2667 N  N    . GLY B 2 182 ? 0.310   47.090 20.416 1.000 48.290 ? 182 GLY HHH N    1 
ATOM   2668 C  CA   . GLY B 2 182 ? -0.857  46.933 19.528 1.000 48.126 ? 182 GLY HHH CA   1 
ATOM   2669 C  C    . GLY B 2 182 ? -1.258  48.218 18.818 1.000 47.460 ? 182 GLY HHH C    1 
ATOM   2670 O  O    . GLY B 2 182 ? -2.245  48.159 18.063 1.000 48.394 ? 182 GLY HHH O    1 
ATOM   2671 H  H    . GLY B 2 182 ? 1.068   46.693 20.104 1.000 47.655 ? 182 GLY HHH H    1 
ATOM   2672 H  HA2  . GLY B 2 182 ? -0.649  46.241 18.850 1.000 47.413 ? 182 GLY HHH HA2  1 
ATOM   2673 H  HA3  . GLY B 2 182 ? -1.623  46.607 20.064 1.000 48.798 ? 182 GLY HHH HA3  1 
ATOM   2674 N  N    . LEU B 2 183 ? -0.535  49.328 19.032 1.000 46.155 ? 183 LEU HHH N    1 
ATOM   2675 C  CA   . LEU B 2 183 ? -0.761  50.633 18.345 1.000 45.548 ? 183 LEU HHH CA   1 
ATOM   2676 C  C    . LEU B 2 183 ? 0.376   50.899 17.348 1.000 43.512 ? 183 LEU HHH C    1 
ATOM   2677 O  O    . LEU B 2 183 ? 1.495   50.405 17.575 1.000 42.746 ? 183 LEU HHH O    1 
ATOM   2678 C  CB   . LEU B 2 183 ? -0.838  51.752 19.388 1.000 46.322 ? 183 LEU HHH CB   1 
ATOM   2679 C  CG   . LEU B 2 183 ? -2.172  51.902 20.116 1.000 48.055 ? 183 LEU HHH CG   1 
ATOM   2680 C  CD1  . LEU B 2 183 ? -2.089  53.011 21.155 1.000 48.790 ? 183 LEU HHH CD1  1 
ATOM   2681 C  CD2  . LEU B 2 183 ? -3.310  52.172 19.141 1.000 48.878 ? 183 LEU HHH CD2  1 
ATOM   2682 H  H    . LEU B 2 183 ? 0.165   49.349 19.609 1.000 45.883 ? 183 LEU HHH H    1 
ATOM   2683 H  HA   . LEU B 2 183 ? -1.609  50.585 17.849 1.000 46.102 ? 183 LEU HHH HA   1 
ATOM   2684 H  HB2  . LEU B 2 183 ? -0.139  51.598 20.054 1.000 46.074 ? 183 LEU HHH HB2  1 
ATOM   2685 H  HB3  . LEU B 2 183 ? -0.636  52.598 18.942 1.000 46.381 ? 183 LEU HHH HB3  1 
ATOM   2686 H  HG   . LEU B 2 183 ? -2.364  51.053 20.586 1.000 48.065 ? 183 LEU HHH HG   1 
ATOM   2687 H  HD11 . LEU B 2 183 ? -1.349  52.833 21.761 1.000 48.478 ? 183 LEU HHH HD11 1 
ATOM   2688 H  HD12 . LEU B 2 183 ? -2.920  53.046 21.660 1.000 49.943 ? 183 LEU HHH HD12 1 
ATOM   2689 H  HD13 . LEU B 2 183 ? -1.945  53.863 20.709 1.000 48.856 ? 183 LEU HHH HD13 1 
ATOM   2690 H  HD21 . LEU B 2 183 ? -2.994  52.751 18.425 1.000 48.529 ? 183 LEU HHH HD21 1 
ATOM   2691 H  HD22 . LEU B 2 183 ? -4.044  52.606 19.609 1.000 50.006 ? 183 LEU HHH HD22 1 
ATOM   2692 H  HD23 . LEU B 2 183 ? -3.620  51.331 18.763 1.000 48.736 ? 183 LEU HHH HD23 1 
ATOM   2693 N  N    . TYR B 2 184 ? 0.100   51.674 16.294 1.000 42.345 ? 184 TYR HHH N    1 
ATOM   2694 C  CA   . TYR B 2 184 ? 1.062   51.998 15.206 1.000 40.371 ? 184 TYR HHH CA   1 
ATOM   2695 C  C    . TYR B 2 184 ? 1.567   53.432 15.347 1.000 39.211 ? 184 TYR HHH C    1 
ATOM   2696 O  O    . TYR B 2 184 ? 0.790   54.326 15.700 1.000 39.998 ? 184 TYR HHH O    1 
ATOM   2697 C  CB   . TYR B 2 184 ? 0.423   51.795 13.832 1.000 40.840 ? 184 TYR HHH CB   1 
ATOM   2698 C  CG   . TYR B 2 184 ? 0.246   50.343 13.479 1.000 41.219 ? 184 TYR HHH CG   1 
ATOM   2699 C  CD1  . TYR B 2 184 ? 1.292   49.614 12.934 1.000 40.333 ? 184 TYR HHH CD1  1 
ATOM   2700 C  CD2  . TYR B 2 184 ? -0.948  49.685 13.724 1.000 41.983 ? 184 TYR HHH CD2  1 
ATOM   2701 C  CE1  . TYR B 2 184 ? 1.153   48.275 12.619 1.000 39.953 ? 184 TYR HHH CE1  1 
ATOM   2702 C  CE2  . TYR B 2 184 ? -1.104  48.345 13.414 1.000 41.962 ? 184 TYR HHH CE2  1 
ATOM   2703 C  CZ   . TYR B 2 184 ? -0.049  47.640 12.863 1.000 40.921 ? 184 TYR HHH CZ   1 
ATOM   2704 O  OH   . TYR B 2 184 ? -0.191  46.324 12.552 1.000 42.030 ? 184 TYR HHH OH   1 
ATOM   2705 H  H    . TYR B 2 184 ? -0.712  52.066 16.167 1.000 43.126 ? 184 TYR HHH H    1 
ATOM   2706 H  HA   . TYR B 2 184 ? 1.835   51.387 15.282 1.000 39.672 ? 184 TYR HHH HA   1 
ATOM   2707 H  HB2  . TYR B 2 184 ? -0.450  52.239 13.821 1.000 41.803 ? 184 TYR HHH HB2  1 
ATOM   2708 H  HB3  . TYR B 2 184 ? 0.990   52.222 13.157 1.000 40.770 ? 184 TYR HHH HB3  1 
ATOM   2709 H  HD1  . TYR B 2 184 ? 2.116   50.043 12.767 1.000 39.950 ? 184 TYR HHH HD1  1 
ATOM   2710 H  HD2  . TYR B 2 184 ? -1.671  50.160 14.100 1.000 42.789 ? 184 TYR HHH HD2  1 
ATOM   2711 H  HE1  . TYR B 2 184 ? 1.873   47.797 12.241 1.000 39.543 ? 184 TYR HHH HE1  1 
ATOM   2712 H  HE2  . TYR B 2 184 ? -1.926  47.912 13.578 1.000 42.507 ? 184 TYR HHH HE2  1 
ATOM   2713 H  HH   . TYR B 2 184 ? 0.457   45.932 13.030 0.000 30.000 ? 184 TYR HHH HH   1 
ATOM   2714 N  N    . THR B 2 185 ? 2.855   53.620 15.072 1.000 37.698 ? 185 THR HHH N    1 
ATOM   2715 C  CA   . THR B 2 185 ? 3.532   54.934 14.967 1.000 37.693 ? 185 THR HHH CA   1 
ATOM   2716 C  C    . THR B 2 185 ? 4.346   54.952 13.673 1.000 36.997 ? 185 THR HHH C    1 
ATOM   2717 O  O    . THR B 2 185 ? 5.098   53.996 13.446 1.000 36.599 ? 185 THR HHH O    1 
ATOM   2718 C  CB   . THR B 2 185 ? 4.437   55.187 16.176 1.000 37.684 ? 185 THR HHH CB   1 
ATOM   2719 O  OG1  . THR B 2 185 ? 3.614   55.237 17.342 1.000 38.716 ? 185 THR HHH OG1  1 
ATOM   2720 C  CG2  . THR B 2 185 ? 5.238   56.463 16.039 1.000 38.042 ? 185 THR HHH CG2  1 
ATOM   2721 H  H    . THR B 2 185 ? 3.429   52.928 14.927 1.000 37.275 ? 185 THR HHH H    1 
ATOM   2722 H  HA   . THR B 2 185 ? 2.846   55.636 14.927 1.000 38.340 ? 185 THR HHH HA   1 
ATOM   2723 H  HB   . THR B 2 185 ? 5.061   54.427 16.258 1.000 37.206 ? 185 THR HHH HB   1 
ATOM   2724 H  HG1  . THR B 2 185 ? 4.127   55.425 17.971 0.000 30.000 ? 185 THR HHH HG1  1 
ATOM   2725 H  HG21 . THR B 2 185 ? 6.054   56.284 15.538 1.000 37.639 ? 185 THR HHH HG21 1 
ATOM   2726 H  HG22 . THR B 2 185 ? 5.470   56.797 16.924 1.000 38.343 ? 185 THR HHH HG22 1 
ATOM   2727 H  HG23 . THR B 2 185 ? 4.710   57.132 15.569 1.000 38.458 ? 185 THR HHH HG23 1 
ATOM   2728 N  N    . MET B 2 186 ? 4.194   55.990 12.856 1.000 37.098 ? 186 MET HHH N    1 
ATOM   2729 C  CA   . MET B 2 186 ? 5.044   56.201 11.657 1.000 37.065 ? 186 MET HHH CA   1 
ATOM   2730 C  C    . MET B 2 186 ? 5.434   57.681 11.564 1.000 37.280 ? 186 MET HHH C    1 
ATOM   2731 O  O    . MET B 2 186 ? 4.842   58.511 12.286 1.000 37.665 ? 186 MET HHH O    1 
ATOM   2732 C  CB   . MET B 2 186 ? 4.341   55.750 10.371 1.000 37.808 ? 186 MET HHH CB   1 
ATOM   2733 C  CG   . MET B 2 186 ? 3.056   56.501 10.042 1.000 39.188 ? 186 MET HHH CG   1 
ATOM   2734 S  SD   . MET B 2 186 ? 3.337   58.057 9.158  1.000 39.619 ? 186 MET HHH SD   1 
ATOM   2735 C  CE   . MET B 2 186 ? 3.830   57.441 7.549  1.000 39.835 ? 186 MET HHH CE   1 
ATOM   2736 H  H    . MET B 2 186 ? 3.562   56.634 12.985 1.000 37.778 ? 186 MET HHH H    1 
ATOM   2737 H  HA   . MET B 2 186 ? 5.869   55.675 11.772 1.000 36.572 ? 186 MET HHH HA   1 
ATOM   2738 H  HB2  . MET B 2 186 ? 4.965   55.852 9.625  1.000 37.850 ? 186 MET HHH HB2  1 
ATOM   2739 H  HB3  . MET B 2 186 ? 4.133   54.800 10.450 1.000 37.516 ? 186 MET HHH HB3  1 
ATOM   2740 H  HG2  . MET B 2 186 ? 2.483   55.927 9.491  1.000 39.226 ? 186 MET HHH HG2  1 
ATOM   2741 H  HG3  . MET B 2 186 ? 2.575   56.695 10.874 1.000 39.120 ? 186 MET HHH HG3  1 
ATOM   2742 H  HE1  . MET B 2 186 ? 3.852   58.171 6.918  1.000 40.456 ? 186 MET HHH HE1  1 
ATOM   2743 H  HE2  . MET B 2 186 ? 4.707   57.043 7.611  1.000 39.271 ? 186 MET HHH HE2  1 
ATOM   2744 H  HE3  . MET B 2 186 ? 3.196   56.778 7.251  1.000 39.977 ? 186 MET HHH HE3  1 
ATOM   2745 N  N    . SER B 2 187 ? 6.420   57.973 10.718 1.000 36.687 ? 187 SER HHH N    1 
ATOM   2746 C  CA   . SER B 2 187 ? 7.004   59.317 10.497 1.000 36.872 ? 187 SER HHH CA   1 
ATOM   2747 C  C    . SER B 2 187 ? 7.058   59.595 8.999  1.000 36.859 ? 187 SER HHH C    1 
ATOM   2748 O  O    . SER B 2 187 ? 7.174   58.646 8.227  1.000 37.271 ? 187 SER HHH O    1 
ATOM   2749 C  CB   . SER B 2 187 ? 8.371   59.424 11.114 1.000 36.714 ? 187 SER HHH CB   1 
ATOM   2750 O  OG   . SER B 2 187 ? 8.267   59.738 12.492 1.000 36.915 ? 187 SER HHH OG   1 
ATOM   2751 H  H    . SER B 2 187 ? 6.822   57.340 10.200 1.000 36.476 ? 187 SER HHH H    1 
ATOM   2752 H  HA   . SER B 2 187 ? 6.408   59.992 10.920 1.000 37.244 ? 187 SER HHH HA   1 
ATOM   2753 H  HB2  . SER B 2 187 ? 8.848   58.571 11.004 1.000 36.311 ? 187 SER HHH HB2  1 
ATOM   2754 H  HB3  . SER B 2 187 ? 8.886   60.126 10.654 1.000 37.202 ? 187 SER HHH HB3  1 
ATOM   2755 H  HG   . SER B 2 187 ? 9.085   59.752 12.724 0.000 30.000 ? 187 SER HHH HG   1 
ATOM   2756 N  N    . SER B 2 188 ? 6.968   60.861 8.623  1.000 37.410 ? 188 SER HHH N    1 
ATOM   2757 C  CA   . SER B 2 188 ? 7.198   61.347 7.244  1.000 38.130 ? 188 SER HHH CA   1 
ATOM   2758 C  C    . SER B 2 188 ? 8.026   62.627 7.337  1.000 38.538 ? 188 SER HHH C    1 
ATOM   2759 O  O    . SER B 2 188 ? 7.757   63.430 8.245  1.000 38.454 ? 188 SER HHH O    1 
ATOM   2760 C  CB   . SER B 2 188 ? 5.891   61.557 6.527  1.000 38.878 ? 188 SER HHH CB   1 
ATOM   2761 O  OG   . SER B 2 188 ? 6.102   61.926 5.178  1.000 39.717 ? 188 SER HHH OG   1 
ATOM   2762 H  H    . SER B 2 188 ? 6.748   61.535 9.196  1.000 37.679 ? 188 SER HHH H    1 
ATOM   2763 H  HA   . SER B 2 188 ? 7.727   60.663 6.753  1.000 37.932 ? 188 SER HHH HA   1 
ATOM   2764 H  HB2  . SER B 2 188 ? 5.365   60.726 6.560  1.000 38.548 ? 188 SER HHH HB2  1 
ATOM   2765 H  HB3  . SER B 2 188 ? 5.378   62.261 6.984  1.000 39.150 ? 188 SER HHH HB3  1 
ATOM   2766 H  HG   . SER B 2 188 ? 5.361   62.358 4.975  0.000 30.000 ? 188 SER HHH HG   1 
ATOM   2767 N  N    . SER B 2 189 ? 9.033   62.767 6.475  1.000 39.194 ? 189 SER HHH N    1 
ATOM   2768 C  CA   . SER B 2 189 ? 9.914   63.959 6.391  1.000 39.935 ? 189 SER HHH CA   1 
ATOM   2769 C  C    . SER B 2 189 ? 9.858   64.518 4.970  1.000 41.215 ? 189 SER HHH C    1 
ATOM   2770 O  O    . SER B 2 189 ? 9.577   63.736 4.043  1.000 41.268 ? 189 SER HHH O    1 
ATOM   2771 C  CB   . SER B 2 189 ? 11.323  63.631 6.804  1.000 39.597 ? 189 SER HHH CB   1 
ATOM   2772 O  OG   . SER B 2 189 ? 11.982  62.876 5.800  1.000 39.666 ? 189 SER HHH OG   1 
ATOM   2773 H  H    . SER B 2 189 ? 9.258   62.129 5.865  1.000 39.113 ? 189 SER HHH H    1 
ATOM   2774 H  HA   . SER B 2 189 ? 9.558   64.649 7.010  1.000 40.071 ? 189 SER HHH HA   1 
ATOM   2775 H  HB2  . SER B 2 189 ? 11.818  64.465 6.966  1.000 40.155 ? 189 SER HHH HB2  1 
ATOM   2776 H  HB3  . SER B 2 189 ? 11.306  63.117 7.643  1.000 38.923 ? 189 SER HHH HB3  1 
ATOM   2777 H  HG   . SER B 2 189 ? 12.777  62.786 6.076  0.000 30.000 ? 189 SER HHH HG   1 
ATOM   2778 N  N    . VAL B 2 190 ? 10.100  65.824 4.833  1.000 42.300 ? 190 VAL HHH N    1 
ATOM   2779 C  CA   . VAL B 2 190 ? 10.194  66.559 3.537  1.000 43.558 ? 190 VAL HHH CA   1 
ATOM   2780 C  C    . VAL B 2 190 ? 11.418  67.482 3.611  1.000 44.605 ? 190 VAL HHH C    1 
ATOM   2781 O  O    . VAL B 2 190 ? 11.526  68.246 4.598  1.000 44.598 ? 190 VAL HHH O    1 
ATOM   2782 C  CB   . VAL B 2 190 ? 8.899   67.343 3.242  1.000 44.114 ? 190 VAL HHH CB   1 
ATOM   2783 C  CG1  . VAL B 2 190 ? 8.418   68.149 4.442  1.000 43.675 ? 190 VAL HHH CG1  1 
ATOM   2784 C  CG2  . VAL B 2 190 ? 9.046   68.244 2.023  1.000 45.714 ? 190 VAL HHH CG2  1 
ATOM   2785 H  H    . VAL B 2 190 ? 10.233  66.364 5.555  1.000 42.190 ? 190 VAL HHH H    1 
ATOM   2786 H  HA   . VAL B 2 190 ? 10.336  65.912 2.824  1.000 43.754 ? 190 VAL HHH HA   1 
ATOM   2787 H  HB   . VAL B 2 190 ? 8.199   66.677 3.034  1.000 43.876 ? 190 VAL HHH HB   1 
ATOM   2788 H  HG11 . VAL B 2 190 ? 8.132   67.543 5.148  1.000 42.917 ? 190 VAL HHH HG11 1 
ATOM   2789 H  HG12 . VAL B 2 190 ? 7.669   68.710 4.175  1.000 44.324 ? 190 VAL HHH HG12 1 
ATOM   2790 H  HG13 . VAL B 2 190 ? 9.139   68.711 4.771  1.000 43.928 ? 190 VAL HHH HG13 1 
ATOM   2791 H  HG21 . VAL B 2 190 ? 9.457   69.085 2.287  1.000 46.077 ? 190 VAL HHH HG21 1 
ATOM   2792 H  HG22 . VAL B 2 190 ? 8.168   68.419 1.642  1.000 46.140 ? 190 VAL HHH HG22 1 
ATOM   2793 H  HG23 . VAL B 2 190 ? 9.604   67.805 1.358  1.000 46.002 ? 190 VAL HHH HG23 1 
ATOM   2794 N  N    . THR B 2 191 ? 12.312  67.398 2.623  1.000 45.525 ? 191 THR HHH N    1 
ATOM   2795 C  CA   . THR B 2 191 ? 13.504  68.278 2.493  1.000 46.988 ? 191 THR HHH CA   1 
ATOM   2796 C  C    . THR B 2 191 ? 13.200  69.364 1.452  1.000 49.073 ? 191 THR HHH C    1 
ATOM   2797 O  O    . THR B 2 191 ? 12.877  69.007 0.297  1.000 49.796 ? 191 THR HHH O    1 
ATOM   2798 C  CB   . THR B 2 191 ? 14.758  67.452 2.178  1.000 47.005 ? 191 THR HHH CB   1 
ATOM   2799 O  OG1  . THR B 2 191 ? 15.041  66.670 3.337  1.000 45.479 ? 191 THR HHH OG1  1 
ATOM   2800 C  CG2  . THR B 2 191 ? 15.962  68.298 1.827  1.000 48.511 ? 191 THR HHH CG2  1 
ATOM   2801 H  H    . THR B 2 191 ? 12.253  66.789 1.948  1.000 45.734 ? 191 THR HHH H    1 
ATOM   2802 H  HA   . THR B 2 191 ? 13.645  68.718 3.362  1.000 46.723 ? 191 THR HHH HA   1 
ATOM   2803 H  HB   . THR B 2 191 ? 14.556  66.850 1.422  1.000 47.134 ? 191 THR HHH HB   1 
ATOM   2804 H  HG1  . THR B 2 191 ? 15.725  66.249 3.273  0.000 30.000 ? 191 THR HHH HG1  1 
ATOM   2805 H  HG21 . THR B 2 191 ? 15.922  68.548 0.886  1.000 49.470 ? 191 THR HHH HG21 1 
ATOM   2806 H  HG22 . THR B 2 191 ? 16.776  67.790 1.991  1.000 48.553 ? 191 THR HHH HG22 1 
ATOM   2807 H  HG23 . THR B 2 191 ? 15.966  69.103 2.375  1.000 48.651 ? 191 THR HHH HG23 1 
ATOM   2808 N  N    . VAL B 2 192 ? 13.275  70.635 1.865  1.000 50.210 ? 192 VAL HHH N    1 
ATOM   2809 C  CA   . VAL B 2 192 ? 12.993  71.833 1.019  1.000 51.913 ? 192 VAL HHH CA   1 
ATOM   2810 C  C    . VAL B 2 192 ? 14.240  72.707 1.003  1.000 53.520 ? 192 VAL HHH C    1 
ATOM   2811 O  O    . VAL B 2 192 ? 15.125  72.532 1.840  1.000 53.205 ? 192 VAL HHH O    1 
ATOM   2812 C  CB   . VAL B 2 192 ? 11.778  72.627 1.534  1.000 51.846 ? 192 VAL HHH CB   1 
ATOM   2813 C  CG1  . VAL B 2 192 ? 10.534  71.760 1.628  1.000 51.102 ? 192 VAL HHH CG1  1 
ATOM   2814 C  CG2  . VAL B 2 192 ? 12.062  73.302 2.868  1.000 51.464 ? 192 VAL HHH CG2  1 
ATOM   2815 H  H    . VAL B 2 192 ? 13.522  70.852 2.714  1.000 49.745 ? 192 VAL HHH H    1 
ATOM   2816 H  HA   . VAL B 2 192 ? 12.809  71.533 0.112  1.000 52.531 ? 192 VAL HHH HA   1 
ATOM   2817 H  HB   . VAL B 2 192 ? 11.592  73.340 0.876  1.000 52.926 ? 192 VAL HHH HB   1 
ATOM   2818 H  HG11 . VAL B 2 192 ? 10.421  71.262 0.801  1.000 51.381 ? 192 VAL HHH HG11 1 
ATOM   2819 H  HG12 . VAL B 2 192 ? 9.755   72.325 1.775  1.000 51.235 ? 192 VAL HHH HG12 1 
ATOM   2820 H  HG13 . VAL B 2 192 ? 10.627  71.138 2.370  1.000 50.004 ? 192 VAL HHH HG13 1 
ATOM   2821 H  HG21 . VAL B 2 192 ? 12.560  72.695 3.442  1.000 50.762 ? 192 VAL HHH HG21 1 
ATOM   2822 H  HG22 . VAL B 2 192 ? 11.222  73.536 3.299  1.000 51.138 ? 192 VAL HHH HG22 1 
ATOM   2823 H  HG23 . VAL B 2 192 ? 12.584  74.109 2.721  1.000 52.384 ? 192 VAL HHH HG23 1 
ATOM   2824 N  N    . PRO B 2 193 ? 14.344  73.672 0.059  1.000 55.331 ? 193 PRO HHH N    1 
ATOM   2825 C  CA   . PRO B 2 193 ? 15.397  74.684 0.113  1.000 56.578 ? 193 PRO HHH CA   1 
ATOM   2826 C  C    . PRO B 2 193 ? 15.205  75.558 1.361  1.000 55.768 ? 193 PRO HHH C    1 
ATOM   2827 O  O    . PRO B 2 193 ? 14.084  75.938 1.655  1.000 55.012 ? 193 PRO HHH O    1 
ATOM   2828 C  CB   . PRO B 2 193 ? 15.239  75.498 -1.183 1.000 58.755 ? 193 PRO HHH CB   1 
ATOM   2829 C  CG   . PRO B 2 193 ? 14.309  74.669 -2.060 1.000 58.524 ? 193 PRO HHH CG   1 
ATOM   2830 C  CD   . PRO B 2 193 ? 13.466  73.845 -1.109 1.000 56.426 ? 193 PRO HHH CD   1 
ATOM   2831 H  HA   . PRO B 2 193 ? 16.284  74.244 0.128  1.000 56.763 ? 193 PRO HHH HA   1 
ATOM   2832 H  HB2  . PRO B 2 193 ? 14.850  76.379 -0.999 1.000 59.009 ? 193 PRO HHH HB2  1 
ATOM   2833 H  HB3  . PRO B 2 193 ? 16.107  75.624 -1.622 1.000 59.739 ? 193 PRO HHH HB3  1 
ATOM   2834 H  HG2  . PRO B 2 193 ? 13.742  75.250 -2.606 1.000 59.306 ? 193 PRO HHH HG2  1 
ATOM   2835 H  HG3  . PRO B 2 193 ? 14.824  74.086 -2.655 1.000 58.962 ? 193 PRO HHH HG3  1 
ATOM   2836 H  HD2  . PRO B 2 193 ? 12.648  74.317 -0.866 1.000 56.220 ? 193 PRO HHH HD2  1 
ATOM   2837 H  HD3  . PRO B 2 193 ? 13.233  72.985 -1.504 1.000 56.074 ? 193 PRO HHH HD3  1 
ATOM   2838 N  N    . SER B 2 194 ? 16.303  75.852 2.057  1.000 55.963 ? 194 SER HHH N    1 
ATOM   2839 C  CA   . SER B 2 194 ? 16.325  76.579 3.351  1.000 55.790 ? 194 SER HHH CA   1 
ATOM   2840 C  C    . SER B 2 194 ? 15.806  78.011 3.167  1.000 57.277 ? 194 SER HHH C    1 
ATOM   2841 O  O    . SER B 2 194 ? 15.499  78.661 4.183  1.000 57.329 ? 194 SER HHH O    1 
ATOM   2842 C  CB   . SER B 2 194 ? 17.703  76.551 3.950  1.000 56.138 ? 194 SER HHH CB   1 
ATOM   2843 O  OG   . SER B 2 194 ? 17.668  76.981 5.297  1.000 55.804 ? 194 SER HHH OG   1 
ATOM   2844 H  H    . SER B 2 194 ? 17.138  75.632 1.772  1.000 56.643 ? 194 SER HHH H    1 
ATOM   2845 H  HA   . SER B 2 194 ? 15.708  76.109 3.973  1.000 54.651 ? 194 SER HHH HA   1 
ATOM   2846 H  HB2  . SER B 2 194 ? 18.059  75.636 3.910  1.000 55.727 ? 194 SER HHH HB2  1 
ATOM   2847 H  HB3  . SER B 2 194 ? 18.299  77.138 3.431  1.000 57.525 ? 194 SER HHH HB3  1 
ATOM   2848 H  HG   . SER B 2 194 ? 18.353  76.826 5.559  0.000 30.000 ? 194 SER HHH HG   1 
ATOM   2849 N  N    . SER B 2 195 ? 15.712  78.484 1.919  1.000 58.737 ? 195 SER HHH N    1 
ATOM   2850 C  CA   . SER B 2 195 ? 15.111  79.791 1.542  1.000 59.611 ? 195 SER HHH CA   1 
ATOM   2851 C  C    . SER B 2 195 ? 13.582  79.742 1.692  1.000 58.843 ? 195 SER HHH C    1 
ATOM   2852 O  O    . SER B 2 195 ? 13.005  80.768 2.098  1.000 59.538 ? 195 SER HHH O    1 
ATOM   2853 C  CB   . SER B 2 195 ? 15.525  80.176 0.146  1.000 60.975 ? 195 SER HHH CB   1 
ATOM   2854 O  OG   . SER B 2 195 ? 15.602  79.029 -0.684 1.000 60.830 ? 195 SER HHH OG   1 
ATOM   2855 H  H    . SER B 2 195 ? 16.044  78.044 1.196  1.000 58.973 ? 195 SER HHH H    1 
ATOM   2856 H  HA   . SER B 2 195 ? 15.460  80.478 2.171  1.000 60.037 ? 195 SER HHH HA   1 
ATOM   2857 H  HB2  . SER B 2 195 ? 14.872  80.810 -0.227 1.000 61.636 ? 195 SER HHH HB2  1 
ATOM   2858 H  HB3  . SER B 2 195 ? 16.403  80.621 0.176  1.000 62.051 ? 195 SER HHH HB3  1 
ATOM   2859 H  HG   . SER B 2 195 ? 15.932  79.253 -1.445 0.000 30.000 ? 195 SER HHH HG   1 
ATOM   2860 N  N    . THR B 2 196 ? 12.949  78.598 1.403  1.000 57.788 ? 196 THR HHH N    1 
ATOM   2861 C  CA   . THR B 2 196 ? 11.466  78.458 1.315  1.000 57.342 ? 196 THR HHH CA   1 
ATOM   2862 C  C    . THR B 2 196 ? 10.856  78.170 2.699  1.000 56.062 ? 196 THR HHH C    1 
ATOM   2863 O  O    . THR B 2 196 ? 9.614   78.154 2.789  1.000 55.475 ? 196 THR HHH O    1 
ATOM   2864 C  CB   . THR B 2 196 ? 11.048  77.394 0.285  1.000 57.079 ? 196 THR HHH CB   1 
ATOM   2865 O  OG1  . THR B 2 196 ? 11.101  76.096 0.880  1.000 55.417 ? 196 THR HHH OG1  1 
ATOM   2866 C  CG2  . THR B 2 196 ? 11.900  77.404 -0.965 1.000 58.358 ? 196 THR HHH CG2  1 
ATOM   2867 H  H    . THR B 2 196 ? 13.383  77.812 1.252  1.000 57.395 ? 196 THR HHH H    1 
ATOM   2868 H  HA   . THR B 2 196 ? 11.111  79.323 1.007  1.000 58.271 ? 196 THR HHH HA   1 
ATOM   2869 H  HB   . THR B 2 196 ? 10.114  77.578 0.024  1.000 57.280 ? 196 THR HHH HB   1 
ATOM   2870 H  HG1  . THR B 2 196 ? 10.843  75.510 0.258  0.000 30.000 ? 196 THR HHH HG1  1 
ATOM   2871 H  HG21 . THR B 2 196 ? 12.147  78.320 -1.185 1.000 59.475 ? 196 THR HHH HG21 1 
ATOM   2872 H  HG22 . THR B 2 196 ? 11.397  77.018 -1.705 1.000 58.677 ? 196 THR HHH HG22 1 
ATOM   2873 H  HG23 . THR B 2 196 ? 12.705  76.879 -0.814 1.000 58.068 ? 196 THR HHH HG23 1 
ATOM   2874 N  N    . TRP B 2 197 ? 11.667  77.952 3.742  1.000 55.576 ? 197 TRP HHH N    1 
ATOM   2875 C  CA   . TRP B 2 197 ? 11.166  77.719 5.127  1.000 54.722 ? 197 TRP HHH CA   1 
ATOM   2876 C  C    . TRP B 2 197 ? 12.129  78.314 6.152  1.000 55.328 ? 197 TRP HHH C    1 
ATOM   2877 O  O    . TRP B 2 197 ? 13.335  78.101 6.055  1.000 55.859 ? 197 TRP HHH O    1 
ATOM   2878 C  CB   . TRP B 2 197 ? 10.944  76.222 5.375  1.000 53.205 ? 197 TRP HHH CB   1 
ATOM   2879 C  CG   . TRP B 2 197 ? 10.266  75.929 6.680  1.000 52.261 ? 197 TRP HHH CG   1 
ATOM   2880 C  CD1  . TRP B 2 197 ? 8.924   75.820 6.907  1.000 51.785 ? 197 TRP HHH CD1  1 
ATOM   2881 C  CD2  . TRP B 2 197 ? 10.901  75.727 7.955  1.000 51.772 ? 197 TRP HHH CD2  1 
ATOM   2882 N  NE1  . TRP B 2 197 ? 8.682   75.546 8.226  1.000 50.788 ? 197 TRP HHH NE1  1 
ATOM   2883 C  CE2  . TRP B 2 197 ? 9.874   75.492 8.895  1.000 50.910 ? 197 TRP HHH CE2  1 
ATOM   2884 C  CE3  . TRP B 2 197 ? 12.231  75.724 8.392  1.000 51.988 ? 197 TRP HHH CE3  1 
ATOM   2885 C  CZ2  . TRP B 2 197 ? 10.140  75.262 10.243 1.000 50.803 ? 197 TRP HHH CZ2  1 
ATOM   2886 C  CZ3  . TRP B 2 197 ? 12.493  75.493 9.724  1.000 51.574 ? 197 TRP HHH CZ3  1 
ATOM   2887 C  CH2  . TRP B 2 197 ? 11.460  75.266 10.634 1.000 51.117 ? 197 TRP HHH CH2  1 
ATOM   2888 H  H    . TRP B 2 197 ? 12.574  77.921 3.674  1.000 55.900 ? 197 TRP HHH H    1 
ATOM   2889 H  HA   . TRP B 2 197 ? 10.297  78.169 5.207  1.000 54.911 ? 197 TRP HHH HA   1 
ATOM   2890 H  HB2  . TRP B 2 197 ? 10.402  75.863 4.643  1.000 53.166 ? 197 TRP HHH HB2  1 
ATOM   2891 H  HB3  . TRP B 2 197 ? 11.813  75.772 5.356  1.000 53.054 ? 197 TRP HHH HB3  1 
ATOM   2892 H  HD1  . TRP B 2 197 ? 8.253   75.897 6.247  1.000 52.074 ? 197 TRP HHH HD1  1 
ATOM   2893 H  HE1  . TRP B 2 197 ? 7.892   75.438 8.582  1.000 50.775 ? 197 TRP HHH HE1  1 
ATOM   2894 H  HE3  . TRP B 2 197 ? 12.935  75.882 7.784  1.000 52.537 ? 197 TRP HHH HE3  1 
ATOM   2895 H  HZ2  . TRP B 2 197 ? 9.444   75.103 10.858 1.000 50.469 ? 197 TRP HHH HZ2  1 
ATOM   2896 H  HZ3  . TRP B 2 197 ? 13.386  75.488 10.028 1.000 51.931 ? 197 TRP HHH HZ3  1 
ATOM   2897 H  HH2  . TRP B 2 197 ? 11.671  75.105 11.537 1.000 50.943 ? 197 TRP HHH HH2  1 
ATOM   2898 N  N    . PRO B 2 198 ? 11.646  79.038 7.193  1.000 55.789 ? 198 PRO HHH N    1 
ATOM   2899 C  CA   . PRO B 2 198 ? 10.215  79.221 7.456  1.000 55.529 ? 198 PRO HHH CA   1 
ATOM   2900 C  C    . PRO B 2 198 ? 9.523   80.375 6.709  1.000 56.515 ? 198 PRO HHH C    1 
ATOM   2901 O  O    . PRO B 2 198 ? 8.355   80.583 6.967  1.000 56.520 ? 198 PRO HHH O    1 
ATOM   2902 C  CB   . PRO B 2 198 ? 10.215  79.525 8.963  1.000 55.644 ? 198 PRO HHH CB   1 
ATOM   2903 C  CG   . PRO B 2 198 ? 11.480  80.332 9.161  1.000 56.741 ? 198 PRO HHH CG   1 
ATOM   2904 C  CD   . PRO B 2 198 ? 12.480  79.717 8.200  1.000 56.658 ? 198 PRO HHH CD   1 
ATOM   2905 H  HA   . PRO B 2 198 ? 9.732   78.373 7.296  1.000 54.684 ? 198 PRO HHH HA   1 
ATOM   2906 H  HB2  . PRO B 2 198 ? 9.423   80.043 9.222  1.000 55.966 ? 198 PRO HHH HB2  1 
ATOM   2907 H  HB3  . PRO B 2 198 ? 10.241  78.698 9.489  1.000 54.744 ? 198 PRO HHH HB3  1 
ATOM   2908 H  HG2  . PRO B 2 198 ? 11.329  81.276 8.949  1.000 57.687 ? 198 PRO HHH HG2  1 
ATOM   2909 H  HG3  . PRO B 2 198 ? 11.797  80.262 10.085 1.000 56.678 ? 198 PRO HHH HG3  1 
ATOM   2910 H  HD2  . PRO B 2 198 ? 13.033  80.405 7.785  1.000 57.605 ? 198 PRO HHH HD2  1 
ATOM   2911 H  HD3  . PRO B 2 198 ? 13.059  79.081 8.658  1.000 56.121 ? 198 PRO HHH HD3  1 
ATOM   2912 N  N    . SER B 2 199 ? 10.232  81.074 5.813  1.000 57.511 ? 199 SER HHH N    1 
ATOM   2913 C  CA   . SER B 2 199 ? 9.718   82.234 5.032  1.000 58.815 ? 199 SER HHH CA   1 
ATOM   2914 C  C    . SER B 2 199 ? 8.347   81.897 4.425  1.000 58.827 ? 199 SER HHH C    1 
ATOM   2915 O  O    . SER B 2 199 ? 7.456   82.756 4.479  1.000 59.333 ? 199 SER HHH O    1 
ATOM   2916 C  CB   . SER B 2 199 ? 10.709  82.680 3.976  1.000 59.475 ? 199 SER HHH CB   1 
ATOM   2917 O  OG   . SER B 2 199 ? 10.732  81.785 2.874  1.000 58.691 ? 199 SER HHH OG   1 
ATOM   2918 H  H    . SER B 2 199 ? 11.100  80.885 5.613  1.000 57.607 ? 199 SER HHH H    1 
ATOM   2919 H  HA   . SER B 2 199 ? 9.589   82.988 5.669  1.000 59.251 ? 199 SER HHH HA   1 
ATOM   2920 H  HB2  . SER B 2 199 ? 10.463  83.579 3.660  1.000 60.499 ? 199 SER HHH HB2  1 
ATOM   2921 H  HB3  . SER B 2 199 ? 11.607  82.733 4.373  1.000 59.553 ? 199 SER HHH HB3  1 
ATOM   2922 H  HG   . SER B 2 199 ? 11.285  82.129 2.269  0.000 30.000 ? 199 SER HHH HG   1 
ATOM   2923 N  N    . GLN B 2 200 ? 8.186   80.687 3.881  1.000 58.612 ? 200 GLN HHH N    1 
ATOM   2924 C  CA   . GLN B 2 200 ? 6.901   80.176 3.331  1.000 58.834 ? 200 GLN HHH CA   1 
ATOM   2925 C  C    . GLN B 2 200 ? 6.428   78.981 4.168  1.000 57.494 ? 200 GLN HHH C    1 
ATOM   2926 O  O    . GLN B 2 200 ? 7.251   78.380 4.886  1.000 56.065 ? 200 GLN HHH O    1 
ATOM   2927 C  CB   . GLN B 2 200 ? 7.046   79.815 1.849  1.000 59.709 ? 200 GLN HHH CB   1 
ATOM   2928 C  CG   . GLN B 2 200 ? 7.277   81.020 0.947  1.000 61.881 ? 200 GLN HHH CG   1 
ATOM   2929 C  CD   . GLN B 2 200 ? 6.139   82.011 1.021  1.000 63.243 ? 200 GLN HHH CD   1 
ATOM   2930 O  OE1  . GLN B 2 200 ? 4.990   81.641 1.255  1.000 63.589 ? 200 GLN HHH OE1  1 
ATOM   2931 N  NE2  . GLN B 2 200 ? 6.450   83.283 0.827  1.000 64.082 ? 200 GLN HHH NE2  1 
ATOM   2932 H  H    . GLN B 2 200 ? 8.871   80.091 3.810  1.000 58.033 ? 200 GLN HHH H    1 
ATOM   2933 H  HA   . GLN B 2 200 ? 6.229   80.889 3.414  1.000 59.559 ? 200 GLN HHH HA   1 
ATOM   2934 H  HB2  . GLN B 2 200 ? 7.795   79.194 1.750  1.000 59.215 ? 200 GLN HHH HB2  1 
ATOM   2935 H  HB3  . GLN B 2 200 ? 6.233   79.350 1.561  1.000 59.656 ? 200 GLN HHH HB3  1 
ATOM   2936 H  HG2  . GLN B 2 200 ? 8.110   81.466 1.211  1.000 62.062 ? 200 GLN HHH HG2  1 
ATOM   2937 H  HG3  . GLN B 2 200 ? 7.379   80.715 0.020  1.000 62.365 ? 200 GLN HHH HG3  1 
ATOM   2938 H  HE21 . GLN B 2 200 ? 6.089   83.943 0.713  0.000 30.000 ? 200 GLN HHH HE21 1 
ATOM   2939 H  HE22 . GLN B 2 200 ? 7.519   83.449 0.480  0.000 30.000 ? 200 GLN HHH HE22 1 
ATOM   2940 N  N    . THR B 2 201 ? 5.135   78.668 4.065  1.000 58.178 ? 201 THR HHH N    1 
ATOM   2941 C  CA   . THR B 2 201 ? 4.411   77.679 4.904  1.000 57.204 ? 201 THR HHH CA   1 
ATOM   2942 C  C    . THR B 2 201 ? 4.644   76.265 4.368  1.000 56.389 ? 201 THR HHH C    1 
ATOM   2943 O  O    . THR B 2 201 ? 4.483   76.058 3.149  1.000 56.456 ? 201 THR HHH O    1 
ATOM   2944 C  CB   . THR B 2 201 ? 2.907   77.981 4.939  1.000 58.291 ? 201 THR HHH CB   1 
ATOM   2945 O  OG1  . THR B 2 201 ? 2.725   79.368 5.230  1.000 59.244 ? 201 THR HHH OG1  1 
ATOM   2946 C  CG2  . THR B 2 201 ? 2.166   77.131 5.949  1.000 57.512 ? 201 THR HHH CG2  1 
ATOM   2947 H  H    . THR B 2 201 ? 4.589   79.055 3.446  1.000 58.928 ? 201 THR HHH H    1 
ATOM   2948 H  HA   . THR B 2 201 ? 4.767   77.736 5.820  1.000 56.778 ? 201 THR HHH HA   1 
ATOM   2949 H  HB   . THR B 2 201 ? 2.537   77.796 4.043  1.000 58.717 ? 201 THR HHH HB   1 
ATOM   2950 H  HG1  . THR B 2 201 ? 1.896   79.556 5.085  0.000 30.000 ? 201 THR HHH HG1  1 
ATOM   2951 H  HG21 . THR B 2 201 ? 1.784   76.354 5.503  1.000 57.230 ? 201 THR HHH HG21 1 
ATOM   2952 H  HG22 . THR B 2 201 ? 1.452   77.654 6.356  1.000 58.148 ? 201 THR HHH HG22 1 
ATOM   2953 H  HG23 . THR B 2 201 ? 2.784   76.834 6.641  1.000 56.656 ? 201 THR HHH HG23 1 
ATOM   2954 N  N    . VAL B 2 202 ? 5.001   75.337 5.264  1.000 55.985 ? 202 VAL HHH N    1 
ATOM   2955 C  CA   . VAL B 2 202 ? 5.057   73.865 5.011  1.000 54.818 ? 202 VAL HHH CA   1 
ATOM   2956 C  C    . VAL B 2 202 ? 4.033   73.185 5.924  1.000 54.001 ? 202 VAL HHH C    1 
ATOM   2957 O  O    . VAL B 2 202 ? 4.115   73.381 7.145  1.000 53.472 ? 202 VAL HHH O    1 
ATOM   2958 C  CB   . VAL B 2 202 ? 6.472   73.300 5.231  1.000 53.752 ? 202 VAL HHH CB   1 
ATOM   2959 C  CG1  . VAL B 2 202 ? 6.496   71.785 5.109  1.000 52.853 ? 202 VAL HHH CG1  1 
ATOM   2960 C  CG2  . VAL B 2 202 ? 7.474   73.934 4.279  1.000 54.853 ? 202 VAL HHH CG2  1 
ATOM   2961 H  H    . VAL B 2 202 ? 5.241   75.556 6.115  1.000 55.458 ? 202 VAL HHH H    1 
ATOM   2962 H  HA   . VAL B 2 202 ? 4.803   73.703 4.087  1.000 55.248 ? 202 VAL HHH HA   1 
ATOM   2963 H  HB   . VAL B 2 202 ? 6.743   73.533 6.153  1.000 53.569 ? 202 VAL HHH HB   1 
ATOM   2964 H  HG11 . VAL B 2 202 ? 6.329   71.385 5.980  1.000 52.075 ? 202 VAL HHH HG11 1 
ATOM   2965 H  HG12 . VAL B 2 202 ? 7.366   71.497 4.782  1.000 52.645 ? 202 VAL HHH HG12 1 
ATOM   2966 H  HG13 . VAL B 2 202 ? 5.807   71.497 4.484  1.000 53.068 ? 202 VAL HHH HG13 1 
ATOM   2967 H  HG21 . VAL B 2 202 ? 7.300   73.626 3.372  1.000 55.142 ? 202 VAL HHH HG21 1 
ATOM   2968 H  HG22 . VAL B 2 202 ? 8.376   73.678 4.540  1.000 54.411 ? 202 VAL HHH HG22 1 
ATOM   2969 H  HG23 . VAL B 2 202 ? 7.390   74.902 4.313  1.000 55.567 ? 202 VAL HHH HG23 1 
ATOM   2970 N  N    . THR B 2 203 ? 3.097   72.435 5.339  1.000 54.495 ? 203 THR HHH N    1 
ATOM   2971 C  CA   . THR B 2 203 ? 1.976   71.766 6.051  1.000 54.386 ? 203 THR HHH CA   1 
ATOM   2972 C  C    . THR B 2 203 ? 1.884   70.316 5.583  1.000 53.736 ? 203 THR HHH C    1 
ATOM   2973 O  O    . THR B 2 203 ? 1.963   70.088 4.365  1.000 54.697 ? 203 THR HHH O    1 
ATOM   2974 C  CB   . THR B 2 203 ? 0.655   72.507 5.817  1.000 55.556 ? 203 THR HHH CB   1 
ATOM   2975 O  OG1  . THR B 2 203 ? 0.805   73.795 6.409  1.000 56.917 ? 203 THR HHH OG1  1 
ATOM   2976 C  CG2  . THR B 2 203 ? -0.546  71.807 6.412  1.000 55.427 ? 203 THR HHH CG2  1 
ATOM   2977 H  H    . THR B 2 203 ? 3.078   72.279 4.441  1.000 54.850 ? 203 THR HHH H    1 
ATOM   2978 H  HA   . THR B 2 203 ? 2.175   71.775 7.015  1.000 53.797 ? 203 THR HHH HA   1 
ATOM   2979 H  HB   . THR B 2 203 ? 0.520   72.611 4.845  1.000 56.406 ? 203 THR HHH HB   1 
ATOM   2980 H  HG1  . THR B 2 203 ? 0.079   74.144 6.447  0.000 30.000 ? 203 THR HHH HG1  1 
ATOM   2981 H  HG21 . THR B 2 203 ? -0.880  71.141 5.784  1.000 55.554 ? 203 THR HHH HG21 1 
ATOM   2982 H  HG22 . THR B 2 203 ? -1.247  72.459 6.593  1.000 56.427 ? 203 THR HHH HG22 1 
ATOM   2983 H  HG23 . THR B 2 203 ? -0.290  71.369 7.243  1.000 54.621 ? 203 THR HHH HG23 1 
ATOM   2984 N  N    . CYS B 2 204 ? 1.728   69.385 6.522  1.000 52.756 ? 204 CYS HHH N    1 
ATOM   2985 C  CA   . CYS B 2 204 ? 1.427   67.962 6.233  1.000 52.255 ? 204 CYS HHH CA   1 
ATOM   2986 C  C    . CYS B 2 204 ? -0.055  67.697 6.530  1.000 51.976 ? 204 CYS HHH C    1 
ATOM   2987 O  O    . CYS B 2 204 ? -0.564  68.234 7.534  1.000 50.932 ? 204 CYS HHH O    1 
ATOM   2988 C  CB   . CYS B 2 204 ? 2.352   67.039 7.018  1.000 51.478 ? 204 CYS HHH CB   1 
ATOM   2989 S  SG   . CYS B 2 204 ? 1.640   66.403 8.557  1.000 52.288 ? 204 CYS HHH SG   1 
ATOM   2990 H  H    . CYS B 2 204 ? 1.794   69.554 7.415  1.000 52.483 ? 204 CYS HHH H    1 
ATOM   2991 H  HA   . CYS B 2 204 ? 1.584   67.809 5.275  1.000 52.497 ? 204 CYS HHH HA   1 
ATOM   2992 H  HB2  . CYS B 2 204 ? 2.598   66.278 6.454  1.000 51.291 ? 204 CYS HHH HB2  1 
ATOM   2993 H  HB3  . CYS B 2 204 ? 3.169   67.525 7.239  1.000 51.446 ? 204 CYS HHH HB3  1 
ATOM   2994 N  N    . SER B 2 205 ? -0.712  66.932 5.653  1.000 52.465 ? 205 SER HHH N    1 
ATOM   2995 C  CA   . SER B 2 205 ? -2.098  66.413 5.802  1.000 53.726 ? 205 SER HHH CA   1 
ATOM   2996 C  C    . SER B 2 205 ? -2.030  64.902 6.039  1.000 52.495 ? 205 SER HHH C    1 
ATOM   2997 O  O    . SER B 2 205 ? -1.430  64.201 5.195  1.000 51.961 ? 205 SER HHH O    1 
ATOM   2998 C  CB   . SER B 2 205 ? -2.940  66.736 4.587  1.000 55.790 ? 205 SER HHH CB   1 
ATOM   2999 O  OG   . SER B 2 205 ? -2.785  68.097 4.201  1.000 56.888 ? 205 SER HHH OG   1 
ATOM   3000 H  H    . SER B 2 205 ? -0.338  66.663 4.867  1.000 52.598 ? 205 SER HHH H    1 
ATOM   3001 H  HA   . SER B 2 205 ? -2.510  66.842 6.599  1.000 53.889 ? 205 SER HHH HA   1 
ATOM   3002 H  HB2  . SER B 2 205 ? -2.674  66.153 3.841  1.000 55.655 ? 205 SER HHH HB2  1 
ATOM   3003 H  HB3  . SER B 2 205 ? -3.886  66.559 4.790  1.000 56.457 ? 205 SER HHH HB3  1 
ATOM   3004 H  HG   . SER B 2 205 ? -3.226  68.211 3.488  0.000 30.000 ? 205 SER HHH HG   1 
ATOM   3005 N  N    . VAL B 2 206 ? -2.605  64.420 7.144  1.000 52.058 ? 206 VAL HHH N    1 
ATOM   3006 C  CA   . VAL B 2 206 ? -2.554  62.980 7.537  1.000 51.320 ? 206 VAL HHH CA   1 
ATOM   3007 C  C    . VAL B 2 206 ? -3.957  62.382 7.424  1.000 52.282 ? 206 VAL HHH C    1 
ATOM   3008 O  O    . VAL B 2 206 ? -4.843  62.805 8.186  1.000 53.569 ? 206 VAL HHH O    1 
ATOM   3009 C  CB   . VAL B 2 206 ? -1.979  62.792 8.952  1.000 50.374 ? 206 VAL HHH CB   1 
ATOM   3010 C  CG1  . VAL B 2 206 ? -1.980  61.326 9.354  1.000 49.663 ? 206 VAL HHH CG1  1 
ATOM   3011 C  CG2  . VAL B 2 206 ? -0.583  63.387 9.074  1.000 49.593 ? 206 VAL HHH CG2  1 
ATOM   3012 H  H    . VAL B 2 206 ? -3.067  64.943 7.730  1.000 52.647 ? 206 VAL HHH H    1 
ATOM   3013 H  HA   . VAL B 2 206 ? -1.972  62.515 6.911  1.000 50.790 ? 206 VAL HHH HA   1 
ATOM   3014 H  HB   . VAL B 2 206 ? -2.570  63.278 9.579  1.000 51.005 ? 206 VAL HHH HB   1 
ATOM   3015 H  HG11 . VAL B 2 206 ? -2.869  61.073 9.660  1.000 50.209 ? 206 VAL HHH HG11 1 
ATOM   3016 H  HG12 . VAL B 2 206 ? -1.340  61.184 10.073 1.000 48.774 ? 206 VAL HHH HG12 1 
ATOM   3017 H  HG13 . VAL B 2 206 ? -1.734  60.779 8.589  1.000 49.371 ? 206 VAL HHH HG13 1 
ATOM   3018 H  HG21 . VAL B 2 206 ? -0.027  63.063 8.345  1.000 49.225 ? 206 VAL HHH HG21 1 
ATOM   3019 H  HG22 . VAL B 2 206 ? -0.189  63.123 9.924  1.000 48.880 ? 206 VAL HHH HG22 1 
ATOM   3020 H  HG23 . VAL B 2 206 ? -0.639  64.357 9.032  1.000 50.196 ? 206 VAL HHH HG23 1 
ATOM   3021 N  N    . ALA B 2 207 ? -4.134  61.434 6.502  1.000 52.262 ? 207 ALA HHH N    1 
ATOM   3022 C  CA   . ALA B 2 207 ? -5.403  60.717 6.252  1.000 53.347 ? 207 ALA HHH CA   1 
ATOM   3023 C  C    . ALA B 2 207 ? -5.378  59.373 6.990  1.000 52.381 ? 207 ALA HHH C    1 
ATOM   3024 O  O    . ALA B 2 207 ? -4.367  58.648 6.859  1.000 50.789 ? 207 ALA HHH O    1 
ATOM   3025 C  CB   . ALA B 2 207 ? -5.586  60.535 4.769  1.000 54.606 ? 207 ALA HHH CB   1 
ATOM   3026 H  H    . ALA B 2 207 ? -3.467  61.153 5.949  1.000 51.756 ? 207 ALA HHH H    1 
ATOM   3027 H  HA   . ALA B 2 207 ? -6.148  61.258 6.603  1.000 54.398 ? 207 ALA HHH HA   1 
ATOM   3028 H  HB1  . ALA B 2 207 ? -6.528  60.401 4.572  1.000 55.805 ? 207 ALA HHH HB1  1 
ATOM   3029 H  HB2  . ALA B 2 207 ? -5.268  61.327 4.303  1.000 54.872 ? 207 ALA HHH HB2  1 
ATOM   3030 H  HB3  . ALA B 2 207 ? -5.081  59.761 4.472  1.000 53.826 ? 207 ALA HHH HB3  1 
ATOM   3031 N  N    . HIS B 2 208 ? -6.433  59.075 7.757  1.000 53.277 ? 208 HIS HHH N    1 
ATOM   3032 C  CA   . HIS B 2 208 ? -6.650  57.781 8.461  1.000 53.319 ? 208 HIS HHH CA   1 
ATOM   3033 C  C    . HIS B 2 208 ? -8.040  57.260 8.110  1.000 56.473 ? 208 HIS HHH C    1 
ATOM   3034 O  O    . HIS B 2 208 ? -8.995  57.500 8.850  1.000 58.631 ? 208 HIS HHH O    1 
ATOM   3035 C  CB   . HIS B 2 208 ? -6.442  57.932 9.974  1.000 51.931 ? 208 HIS HHH CB   1 
ATOM   3036 C  CG   . HIS B 2 208 ? -6.504  56.637 10.713 1.000 50.652 ? 208 HIS HHH CG   1 
ATOM   3037 N  ND1  . HIS B 2 208 ? -5.824  55.513 10.289 1.000 49.253 ? 208 HIS HHH ND1  1 
ATOM   3038 C  CD2  . HIS B 2 208 ? -7.154  56.282 11.841 1.000 50.748 ? 208 HIS HHH CD2  1 
ATOM   3039 C  CE1  . HIS B 2 208 ? -6.057  54.521 11.124 1.000 48.562 ? 208 HIS HHH CE1  1 
ATOM   3040 N  NE2  . HIS B 2 208 ? -6.868  54.967 12.086 1.000 49.661 ? 208 HIS HHH NE2  1 
ATOM   3041 H  H    . HIS B 2 208 ? -7.112  59.664 7.908  1.000 54.481 ? 208 HIS HHH H    1 
ATOM   3042 H  HA   . HIS B 2 208 ? -5.986  57.136 8.126  1.000 52.375 ? 208 HIS HHH HA   1 
ATOM   3043 H  HB2  . HIS B 2 208 ? -5.565  58.346 10.134 1.000 50.993 ? 208 HIS HHH HB2  1 
ATOM   3044 H  HB3  . HIS B 2 208 ? -7.128  58.537 10.333 1.000 52.999 ? 208 HIS HHH HB3  1 
ATOM   3045 H  HD1  . HIS B 2 208 ? -5.241  55.594 9.561  0.000 30.000 ? 208 HIS HHH HD1  1 
ATOM   3046 H  HD2  . HIS B 2 208 ? -7.696  56.835 12.368 1.000 51.713 ? 208 HIS HHH HD2  1 
ATOM   3047 H  HE1  . HIS B 2 208 ? -5.712  53.649 11.053 1.000 47.993 ? 208 HIS HHH HE1  1 
ATOM   3048 H  HE2  . HIS B 2 208 ? -7.127  54.469 12.684 0.000 30.000 ? 208 HIS HHH HE2  1 
ATOM   3049 N  N    . PRO B 2 209 ? -8.194  56.539 6.972  1.000 57.973 ? 209 PRO HHH N    1 
ATOM   3050 C  CA   . PRO B 2 209 ? -9.518  56.197 6.442  1.000 59.888 ? 209 PRO HHH CA   1 
ATOM   3051 C  C    . PRO B 2 209 ? -10.398 55.394 7.414  1.000 60.096 ? 209 PRO HHH C    1 
ATOM   3052 O  O    . PRO B 2 209 ? -11.592 55.642 7.452  1.000 62.230 ? 209 PRO HHH O    1 
ATOM   3053 C  CB   . PRO B 2 209 ? -9.209  55.362 5.188  1.000 60.331 ? 209 PRO HHH CB   1 
ATOM   3054 C  CG   . PRO B 2 209 ? -7.792  55.760 4.805  1.000 58.848 ? 209 PRO HHH CG   1 
ATOM   3055 C  CD   . PRO B 2 209 ? -7.101  56.031 6.124  1.000 56.819 ? 209 PRO HHH CD   1 
ATOM   3056 H  HA   . PRO B 2 209 ? -9.985  57.028 6.174  1.000 61.132 ? 209 PRO HHH HA   1 
ATOM   3057 H  HB2  . PRO B 2 209 ? -9.260  54.401 5.384  1.000 59.927 ? 209 PRO HHH HB2  1 
ATOM   3058 H  HB3  . PRO B 2 209 ? -9.837  55.571 4.464  1.000 61.865 ? 209 PRO HHH HB3  1 
ATOM   3059 H  HG2  . PRO B 2 209 ? -7.346  55.036 4.321  1.000 58.257 ? 209 PRO HHH HG2  1 
ATOM   3060 H  HG3  . PRO B 2 209 ? -7.796  56.562 4.243  1.000 59.448 ? 209 PRO HHH HG3  1 
ATOM   3061 H  HD2  . PRO B 2 209 ? -6.717  55.216 6.497  1.000 55.865 ? 209 PRO HHH HD2  1 
ATOM   3062 H  HD3  . PRO B 2 209 ? -6.396  56.696 6.018  1.000 56.252 ? 209 PRO HHH HD3  1 
ATOM   3063 N  N    . ALA B 2 210 ? -9.789  54.485 8.185  1.000 58.080 ? 210 ALA HHH N    1 
ATOM   3064 C  CA   . ALA B 2 210 ? -10.460 53.571 9.142  1.000 57.759 ? 210 ALA HHH CA   1 
ATOM   3065 C  C    . ALA B 2 210 ? -11.231 54.360 10.211 1.000 58.289 ? 210 ALA HHH C    1 
ATOM   3066 O  O    . ALA B 2 210 ? -12.274 53.863 10.665 1.000 59.208 ? 210 ALA HHH O    1 
ATOM   3067 C  CB   . ALA B 2 210 ? -9.437  52.657 9.767  1.000 55.540 ? 210 ALA HHH CB   1 
ATOM   3068 H  H    . ALA B 2 210 ? -8.887  54.358 8.169  1.000 56.591 ? 210 ALA HHH H    1 
ATOM   3069 H  HA   . ALA B 2 210 ? -11.106 53.020 8.641  1.000 58.878 ? 210 ALA HHH HA   1 
ATOM   3070 H  HB1  . ALA B 2 210 ? -9.878  52.056 10.390 1.000 55.877 ? 210 ALA HHH HB1  1 
ATOM   3071 H  HB2  . ALA B 2 210 ? -8.997  52.138 9.074  1.000 55.030 ? 210 ALA HHH HB2  1 
ATOM   3072 H  HB3  . ALA B 2 210 ? -8.776  53.189 10.242 1.000 54.585 ? 210 ALA HHH HB3  1 
ATOM   3073 N  N    . SER B 2 211 ? -10.730 55.534 10.607 1.000 57.607 ? 211 SER HHH N    1 
ATOM   3074 C  CA   . SER B 2 211 ? -11.383 56.445 11.585 1.000 58.809 ? 211 SER HHH CA   1 
ATOM   3075 C  C    . SER B 2 211 ? -11.979 57.668 10.873 1.000 60.327 ? 211 SER HHH C    1 
ATOM   3076 O  O    . SER B 2 211 ? -12.626 58.473 11.566 1.000 61.610 ? 211 SER HHH O    1 
ATOM   3077 C  CB   . SER B 2 211 ? -10.421 56.852 12.680 1.000 57.312 ? 211 SER HHH CB   1 
ATOM   3078 O  OG   . SER B 2 211 ? -9.675  58.002 12.313 1.000 56.542 ? 211 SER HHH OG   1 
ATOM   3079 H  H    . SER B 2 211 ? -9.930  55.858 10.318 1.000 56.571 ? 211 SER HHH H    1 
ATOM   3080 H  HA   . SER B 2 211 ? -12.133 55.948 12.008 1.000 59.814 ? 211 SER HHH HA   1 
ATOM   3081 H  HB2  . SER B 2 211 ? -10.927 57.040 13.502 1.000 58.106 ? 211 SER HHH HB2  1 
ATOM   3082 H  HB3  . SER B 2 211 ? -9.807  56.107 12.865 1.000 55.969 ? 211 SER HHH HB3  1 
ATOM   3083 H  HG   . SER B 2 211 ? -9.140  58.230 12.937 0.000 30.000 ? 211 SER HHH HG   1 
ATOM   3084 N  N    . SER B 2 212 ? -11.773 57.800 9.555  1.000 60.172 ? 212 SER HHH N    1 
ATOM   3085 C  CA   . SER B 2 212 ? -12.372 58.848 8.681  1.000 61.926 ? 212 SER HHH CA   1 
ATOM   3086 C  C    . SER B 2 212 ? -11.869 60.242 9.081  1.000 61.399 ? 212 SER HHH C    1 
ATOM   3087 O  O    . SER B 2 212 ? -12.634 61.217 8.900  1.000 63.016 ? 212 SER HHH O    1 
ATOM   3088 C  CB   . SER B 2 212 ? -13.883 58.799 8.721  1.000 64.450 ? 212 SER HHH CB   1 
ATOM   3089 O  OG   . SER B 2 212 ? -14.356 57.471 8.571  1.000 65.052 ? 212 SER HHH OG   1 
ATOM   3090 H  H    . SER B 2 212 ? -11.224 57.250 9.087  1.000 59.253 ? 212 SER HHH H    1 
ATOM   3091 H  HA   . SER B 2 212 ? -12.079 58.671 7.747  1.000 61.713 ? 212 SER HHH HA   1 
ATOM   3092 H  HB2  . SER B 2 212 ? -14.200 59.164 9.578  1.000 64.972 ? 212 SER HHH HB2  1 
ATOM   3093 H  HB3  . SER B 2 212 ? -14.247 59.359 7.998  1.000 65.778 ? 212 SER HHH HB3  1 
ATOM   3094 H  HG   . SER B 2 212 ? -15.288 57.777 8.658  0.000 30.000 ? 212 SER HHH HG   1 
ATOM   3095 N  N    . THR B 2 213 ? -10.636 60.334 9.596  1.000 58.949 ? 213 THR HHH N    1 
ATOM   3096 C  CA   . THR B 2 213 ? -10.032 61.589 10.120 1.000 58.031 ? 213 THR HHH CA   1 
ATOM   3097 C  C    . THR B 2 213 ? -8.871  62.025 9.222  1.000 56.583 ? 213 THR HHH C    1 
ATOM   3098 O  O    . THR B 2 213 ? -7.914  61.250 9.064  1.000 54.971 ? 213 THR HHH O    1 
ATOM   3099 C  CB   . THR B 2 213 ? -9.574  61.431 11.576 1.000 56.758 ? 213 THR HHH CB   1 
ATOM   3100 O  OG1  . THR B 2 213 ? -8.625  60.366 11.644 1.000 54.522 ? 213 THR HHH OG1  1 
ATOM   3101 C  CG2  . THR B 2 213 ? -10.724 61.167 12.524 1.000 58.147 ? 213 THR HHH CG2  1 
ATOM   3102 H  H    . THR B 2 213 ? -10.067 59.625 9.654  1.000 57.670 ? 213 THR HHH H    1 
ATOM   3103 H  HA   . THR B 2 213 ? -10.723 62.289 10.092 1.000 59.501 ? 213 THR HHH HA   1 
ATOM   3104 H  HB   . THR B 2 213 ? -9.128  62.268 11.848 1.000 56.449 ? 213 THR HHH HB   1 
ATOM   3105 H  HG1  . THR B 2 213 ? -8.320  60.353 12.427 0.000 30.000 ? 213 THR HHH HG1  1 
ATOM   3106 H  HG21 . THR B 2 213 ? -11.436 61.811 12.359 1.000 59.716 ? 213 THR HHH HG21 1 
ATOM   3107 H  HG22 . THR B 2 213 ? -10.415 61.255 13.443 1.000 57.718 ? 213 THR HHH HG22 1 
ATOM   3108 H  HG23 . THR B 2 213 ? -11.063 60.267 12.382 1.000 58.322 ? 213 THR HHH HG23 1 
ATOM   3109 N  N    . THR B 2 214 ? -8.984  63.220 8.645  1.000 57.689 ? 214 THR HHH N    1 
ATOM   3110 C  CA   . THR B 2 214 ? -7.861  64.014 8.087  1.000 56.987 ? 214 THR HHH CA   1 
ATOM   3111 C  C    . THR B 2 214 ? -7.473  65.069 9.130  1.000 56.734 ? 214 THR HHH C    1 
ATOM   3112 O  O    . THR B 2 214 ? -8.391  65.685 9.703  1.000 58.303 ? 214 THR HHH O    1 
ATOM   3113 C  CB   . THR B 2 214 ? -8.245  64.662 6.749  1.000 58.423 ? 214 THR HHH CB   1 
ATOM   3114 O  OG1  . THR B 2 214 ? -8.884  63.674 5.939  1.000 58.825 ? 214 THR HHH OG1  1 
ATOM   3115 C  CG2  . THR B 2 214 ? -7.058  65.245 6.009  1.000 57.462 ? 214 THR HHH CG2  1 
ATOM   3116 H  H    . THR B 2 214 ? -9.785  63.644 8.547  1.000 59.185 ? 214 THR HHH H    1 
ATOM   3117 H  HA   . THR B 2 214 ? -7.099  63.412 7.941  1.000 55.656 ? 214 THR HHH HA   1 
ATOM   3118 H  HB   . THR B 2 214 ? -8.889  65.387 6.932  1.000 59.577 ? 214 THR HHH HB   1 
ATOM   3119 H  HG1  . THR B 2 214 ? -9.044  64.045 5.215  0.000 30.000 ? 214 THR HHH HG1  1 
ATOM   3120 H  HG21 . THR B 2 214 ? -6.688  65.988 6.519  1.000 57.169 ? 214 THR HHH HG21 1 
ATOM   3121 H  HG22 . THR B 2 214 ? -7.344  65.564 5.134  1.000 58.563 ? 214 THR HHH HG22 1 
ATOM   3122 H  HG23 . THR B 2 214 ? -6.376  64.559 5.896  1.000 56.303 ? 214 THR HHH HG23 1 
ATOM   3123 N  N    . VAL B 2 215 ? -6.176  65.258 9.380  1.000 55.167 ? 215 VAL HHH N    1 
ATOM   3124 C  CA   . VAL B 2 215 ? -5.642  66.385 10.206 1.000 55.111 ? 215 VAL HHH CA   1 
ATOM   3125 C  C    . VAL B 2 215 ? -4.476  67.021 9.447  1.000 54.459 ? 215 VAL HHH C    1 
ATOM   3126 O  O    . VAL B 2 215 ? -3.639  66.267 8.915  1.000 53.831 ? 215 VAL HHH O    1 
ATOM   3127 C  CB   . VAL B 2 215 ? -5.218  65.946 11.623 1.000 54.115 ? 215 VAL HHH CB   1 
ATOM   3128 C  CG1  . VAL B 2 215 ? -6.410  65.805 12.557 1.000 55.595 ? 215 VAL HHH CG1  1 
ATOM   3129 C  CG2  . VAL B 2 215 ? -4.397  64.670 11.616 1.000 52.251 ? 215 VAL HHH CG2  1 
ATOM   3130 H  H    . VAL B 2 215 ? -5.528  64.707 9.053  1.000 54.180 ? 215 VAL HHH H    1 
ATOM   3131 H  HA   . VAL B 2 215 ? -6.346  67.052 10.294 1.000 56.360 ? 215 VAL HHH HA   1 
ATOM   3132 H  HB   . VAL B 2 215 ? -4.643  66.664 11.987 1.000 53.924 ? 215 VAL HHH HB   1 
ATOM   3133 H  HG11 . VAL B 2 215 ? -6.885  66.653 12.609 1.000 56.672 ? 215 VAL HHH HG11 1 
ATOM   3134 H  HG12 . VAL B 2 215 ? -6.100  65.553 13.444 1.000 55.002 ? 215 VAL HHH HG12 1 
ATOM   3135 H  HG13 . VAL B 2 215 ? -7.010  65.118 12.217 1.000 55.880 ? 215 VAL HHH HG13 1 
ATOM   3136 H  HG21 . VAL B 2 215 ? -4.906  63.955 11.196 1.000 52.496 ? 215 VAL HHH HG21 1 
ATOM   3137 H  HG22 . VAL B 2 215 ? -4.185  64.419 12.532 1.000 51.860 ? 215 VAL HHH HG22 1 
ATOM   3138 H  HG23 . VAL B 2 215 ? -3.572  64.815 11.122 1.000 51.604 ? 215 VAL HHH HG23 1 
ATOM   3139 N  N    . ASP B 2 216 ? -4.460  68.355 9.381  1.000 55.204 ? 216 ASP HHH N    1 
ATOM   3140 C  CA   . ASP B 2 216 ? -3.348  69.176 8.835  1.000 54.693 ? 216 ASP HHH CA   1 
ATOM   3141 C  C    . ASP B 2 216 ? -2.551  69.753 10.007 1.000 53.958 ? 216 ASP HHH C    1 
ATOM   3142 O  O    . ASP B 2 216 ? -3.181  70.234 10.964 1.000 54.172 ? 216 ASP HHH O    1 
ATOM   3143 C  CB   . ASP B 2 216 ? -3.870  70.312 7.952  1.000 56.577 ? 216 ASP HHH CB   1 
ATOM   3144 C  CG   . ASP B 2 216 ? -4.878  69.870 6.908  1.000 57.799 ? 216 ASP HHH CG   1 
ATOM   3145 O  OD1  . ASP B 2 216 ? -4.562  68.923 6.161  1.000 57.233 ? 216 ASP HHH OD1  1 
ATOM   3146 O  OD2  . ASP B 2 216 ? -5.974  70.475 6.857  1.000 59.352 ? 216 ASP HHH OD2  1 
ATOM   3147 H  H    . ASP B 2 216 ? -5.157  68.859 9.679  1.000 56.255 ? 216 ASP HHH H    1 
ATOM   3148 H  HA   . ASP B 2 216 ? -2.762  68.598 8.298  1.000 53.962 ? 216 ASP HHH HA   1 
ATOM   3149 H  HB2  . ASP B 2 216 ? -4.292  70.989 8.520  1.000 57.257 ? 216 ASP HHH HB2  1 
ATOM   3150 H  HB3  . ASP B 2 216 ? -3.114  70.729 7.492  1.000 56.246 ? 216 ASP HHH HB3  1 
ATOM   3151 N  N    . LYS B 2 217 ? -1.220  69.719 9.929  1.000 53.261 ? 217 LYS HHH N    1 
ATOM   3152 C  CA   . LYS B 2 217 ? -0.325  70.305 10.962 1.000 53.017 ? 217 LYS HHH CA   1 
ATOM   3153 C  C    . LYS B 2 217 ? 0.726   71.184 10.274 1.000 52.576 ? 217 LYS HHH C    1 
ATOM   3154 O  O    . LYS B 2 217 ? 1.573   70.643 9.534  1.000 52.111 ? 217 LYS HHH O    1 
ATOM   3155 C  CB   . LYS B 2 217 ? 0.300   69.195 11.814 1.000 52.236 ? 217 LYS HHH CB   1 
ATOM   3156 C  CG   . LYS B 2 217 ? 0.802   69.646 13.179 1.000 52.999 ? 217 LYS HHH CG   1 
ATOM   3157 C  CD   . LYS B 2 217 ? -0.302  69.883 14.197 1.000 54.629 ? 217 LYS HHH CD   1 
ATOM   3158 C  CE   . LYS B 2 217 ? 0.105   70.835 15.305 1.000 55.692 ? 217 LYS HHH CE   1 
ATOM   3159 N  NZ   . LYS B 2 217 ? -0.731  70.659 16.516 1.000 56.892 ? 217 LYS HHH NZ   1 
ATOM   3160 H  H    . LYS B 2 217 ? -0.778  69.331 9.234  1.000 52.729 ? 217 LYS HHH H    1 
ATOM   3161 H  HA   . LYS B 2 217 ? -0.869  70.877 11.549 1.000 53.783 ? 217 LYS HHH HA   1 
ATOM   3162 H  HB2  . LYS B 2 217 ? -0.369  68.491 11.945 1.000 52.239 ? 217 LYS HHH HB2  1 
ATOM   3163 H  HB3  . LYS B 2 217 ? 1.050   68.806 11.318 1.000 51.554 ? 217 LYS HHH HB3  1 
ATOM   3164 H  HG2  . LYS B 2 217 ? 1.415   68.964 13.528 1.000 52.121 ? 217 LYS HHH HG2  1 
ATOM   3165 H  HG3  . LYS B 2 217 ? 1.313   70.476 13.066 1.000 53.287 ? 217 LYS HHH HG3  1 
ATOM   3166 H  HD2  . LYS B 2 217 ? -1.088  70.247 13.738 1.000 55.372 ? 217 LYS HHH HD2  1 
ATOM   3167 H  HD3  . LYS B 2 217 ? -0.557  69.023 14.596 1.000 54.180 ? 217 LYS HHH HD3  1 
ATOM   3168 H  HE2  . LYS B 2 217 ? 1.039   70.683 15.540 1.000 55.033 ? 217 LYS HHH HE2  1 
ATOM   3169 H  HE3  . LYS B 2 217 ? 0.019   71.755 14.991 1.000 56.420 ? 217 LYS HHH HE3  1 
ATOM   3170 H  HZ1  . LYS B 2 217 ? -1.601  70.564 16.278 1.000 57.300 ? 217 LYS HHH HZ1  1 
ATOM   3171 H  HZ2  . LYS B 2 217 ? -0.650  71.385 17.052 1.000 57.510 ? 217 LYS HHH HZ2  1 
ATOM   3172 H  HZ3  . LYS B 2 217 ? -0.466  69.919 16.967 1.000 56.167 ? 217 LYS HHH HZ3  1 
ATOM   3173 N  N    . LYS B 2 218 ? 0.646   72.499 10.491 1.000 53.112 ? 218 LYS HHH N    1 
ATOM   3174 C  CA   . LYS B 2 218 ? 1.635   73.486 9.990  1.000 53.263 ? 218 LYS HHH CA   1 
ATOM   3175 C  C    . LYS B 2 218 ? 2.893   73.364 10.852 1.000 52.040 ? 218 LYS HHH C    1 
ATOM   3176 O  O    . LYS B 2 218 ? 2.753   73.375 12.090 1.000 52.056 ? 218 LYS HHH O    1 
ATOM   3177 C  CB   . LYS B 2 218 ? 1.046   74.901 10.034 1.000 54.896 ? 218 LYS HHH CB   1 
ATOM   3178 C  CG   . LYS B 2 218 ? 1.962   76.002 9.521  1.000 55.721 ? 218 LYS HHH CG   1 
ATOM   3179 C  CD   . LYS B 2 218 ? 1.341   77.377 9.603  1.000 57.680 ? 218 LYS HHH CD   1 
ATOM   3180 C  CE   . LYS B 2 218 ? 2.313   78.494 9.282  1.000 58.263 ? 218 LYS HHH CE   1 
ATOM   3181 N  NZ   . LYS B 2 218 ? 1.681   79.825 9.437  1.000 59.788 ? 218 LYS HHH NZ   1 
ATOM   3182 H  H    . LYS B 2 218 ? -0.033  72.874 10.968 1.000 53.905 ? 218 LYS HHH H    1 
ATOM   3183 H  HA   . LYS B 2 218 ? 1.860   73.261 9.058  1.000 53.111 ? 218 LYS HHH HA   1 
ATOM   3184 H  HB2  . LYS B 2 218 ? 0.223   74.909 9.502  1.000 55.547 ? 218 LYS HHH HB2  1 
ATOM   3185 H  HB3  . LYS B 2 218 ? 0.803   75.105 10.961 1.000 55.169 ? 218 LYS HHH HB3  1 
ATOM   3186 H  HG2  . LYS B 2 218 ? 2.791   75.996 10.045 1.000 55.276 ? 218 LYS HHH HG2  1 
ATOM   3187 H  HG3  . LYS B 2 218 ? 2.194   75.811 8.588  1.000 55.661 ? 218 LYS HHH HG3  1 
ATOM   3188 H  HD2  . LYS B 2 218 ? 0.588   77.424 8.976  1.000 58.183 ? 218 LYS HHH HD2  1 
ATOM   3189 H  HD3  . LYS B 2 218 ? 0.987   77.514 10.507 1.000 57.815 ? 218 LYS HHH HD3  1 
ATOM   3190 H  HE2  . LYS B 2 218 ? 3.084   78.437 9.876  1.000 57.799 ? 218 LYS HHH HE2  1 
ATOM   3191 H  HE3  . LYS B 2 218 ? 2.630   78.399 8.365  1.000 58.212 ? 218 LYS HHH HE3  1 
ATOM   3192 H  HZ1  . LYS B 2 218 ? 0.854   79.819 9.064  1.000 60.310 ? 218 LYS HHH HZ1  1 
ATOM   3193 H  HZ2  . LYS B 2 218 ? 2.187   80.455 9.026  1.000 60.218 ? 218 LYS HHH HZ2  1 
ATOM   3194 H  HZ3  . LYS B 2 218 ? 1.608   80.030 10.317 1.000 59.942 ? 218 LYS HHH HZ3  1 
ATOM   3195 N  N    . ILE B 2 219 ? 4.064   73.244 10.221 1.000 51.357 ? 219 ILE HHH N    1 
ATOM   3196 C  CA   . ILE B 2 219 ? 5.383   73.140 10.914 1.000 50.921 ? 219 ILE HHH CA   1 
ATOM   3197 C  C    . ILE B 2 219 ? 5.888   74.560 11.198 1.000 52.296 ? 219 ILE HHH C    1 
ATOM   3198 O  O    . ILE B 2 219 ? 6.289   75.246 10.246 1.000 52.172 ? 219 ILE HHH O    1 
ATOM   3199 C  CB   . ILE B 2 219 ? 6.390   72.309 10.090 1.000 49.857 ? 219 ILE HHH CB   1 
ATOM   3200 C  CG1  . ILE B 2 219 ? 5.772   71.012 9.561  1.000 49.032 ? 219 ILE HHH CG1  1 
ATOM   3201 C  CG2  . ILE B 2 219 ? 7.646   72.031 10.901 1.000 49.361 ? 219 ILE HHH CG2  1 
ATOM   3202 C  CD1  . ILE B 2 219 ? 5.249   70.095 10.642 1.000 48.342 ? 219 ILE HHH CD1  1 
ATOM   3203 H  H    . ILE B 2 219 ? 4.131   73.243 9.313  1.000 51.558 ? 219 ILE HHH H    1 
ATOM   3204 H  HA   . ILE B 2 219 ? 5.244   72.688 11.765 1.000 50.538 ? 219 ILE HHH HA   1 
ATOM   3205 H  HB   . ILE B 2 219 ? 6.653   72.852 9.307  1.000 50.439 ? 219 ILE HHH HB   1 
ATOM   3206 H  HG12 . ILE B 2 219 ? 5.037   71.235 8.953  1.000 49.541 ? 219 ILE HHH HG12 1 
ATOM   3207 H  HG13 . ILE B 2 219 ? 6.452   70.530 9.044  1.000 48.669 ? 219 ILE HHH HG13 1 
ATOM   3208 H  HG21 . ILE B 2 219 ? 8.209   72.825 10.914 1.000 50.020 ? 219 ILE HHH HG21 1 
ATOM   3209 H  HG22 . ILE B 2 219 ? 8.139   71.294 10.500 1.000 48.811 ? 219 ILE HHH HG22 1 
ATOM   3210 H  HG23 . ILE B 2 219 ? 7.401   71.795 11.813 1.000 49.167 ? 219 ILE HHH HG23 1 
ATOM   3211 H  HD11 . ILE B 2 219 ? 5.956   69.905 11.282 1.000 47.963 ? 219 ILE HHH HD11 1 
ATOM   3212 H  HD12 . ILE B 2 219 ? 4.945   69.261 10.242 1.000 47.848 ? 219 ILE HHH HD12 1 
ATOM   3213 H  HD13 . ILE B 2 219 ? 4.504   70.521 11.100 1.000 48.827 ? 219 ILE HHH HD13 1 
ATOM   3214 N  N    . GLU B 2 220 ? 5.845   74.979 12.467 1.000 53.845 ? 220 GLU HHH N    1 
ATOM   3215 C  CA   . GLU B 2 220 ? 6.260   76.331 12.929 1.000 55.814 ? 220 GLU HHH CA   1 
ATOM   3216 C  C    . GLU B 2 220 ? 7.699   76.269 13.441 1.000 56.405 ? 220 GLU HHH C    1 
ATOM   3217 O  O    . GLU B 2 220 ? 8.088   75.295 14.076 1.000 55.274 ? 220 GLU HHH O    1 
ATOM   3218 C  CB   . GLU B 2 220 ? 5.307   76.832 14.017 1.000 56.778 ? 220 GLU HHH CB   1 
ATOM   3219 C  CG   . GLU B 2 220 ? 3.863   76.984 13.560 1.000 57.763 ? 220 GLU HHH CG   1 
ATOM   3220 C  CD   . GLU B 2 220 ? 3.558   78.170 12.652 1.000 59.629 ? 220 GLU HHH CD   1 
ATOM   3221 O  OE1  . GLU B 2 220 ? 4.506   78.781 12.110 1.000 60.351 ? 220 GLU HHH OE1  1 
ATOM   3222 O  OE2  . GLU B 2 220 ? 2.362   78.488 12.484 1.000 60.728 ? 220 GLU HHH OE2  1 
ATOM   3223 H  H    . GLU B 2 220 ? 5.551   74.444 13.143 1.000 53.396 ? 220 GLU HHH H    1 
ATOM   3224 H  HA   . GLU B 2 220 ? 6.220   76.945 12.163 1.000 56.340 ? 220 GLU HHH HA   1 
ATOM   3225 H  HB2  . GLU B 2 220 ? 5.336   76.205 14.770 1.000 56.453 ? 220 GLU HHH HB2  1 
ATOM   3226 H  HB3  . GLU B 2 220 ? 5.630   77.700 14.338 1.000 57.704 ? 220 GLU HHH HB3  1 
ATOM   3227 H  HG2  . GLU B 2 220 ? 3.597   76.166 13.088 1.000 57.091 ? 220 GLU HHH HG2  1 
ATOM   3228 H  HG3  . GLU B 2 220 ? 3.292   77.057 14.354 1.000 58.255 ? 220 GLU HHH HG3  1 
ATOM   3229 N  N    . PRO B 2 221 ? 8.537   77.303 13.186 1.000 58.854 ? 221 PRO HHH N    1 
ATOM   3230 C  CA   . PRO B 2 221 ? 9.884   77.364 13.757 1.000 59.810 ? 221 PRO HHH CA   1 
ATOM   3231 C  C    . PRO B 2 221 ? 9.854   77.675 15.259 1.000 61.155 ? 221 PRO HHH C    1 
ATOM   3232 O  O    . PRO B 2 221 ? 8.898   78.273 15.706 1.000 61.809 ? 221 PRO HHH O    1 
ATOM   3233 C  CB   . PRO B 2 221 ? 10.554  78.515 12.994 1.000 60.954 ? 221 PRO HHH CB   1 
ATOM   3234 C  CG   . PRO B 2 221 ? 9.397   79.412 12.600 1.000 61.519 ? 221 PRO HHH CG   1 
ATOM   3235 C  CD   . PRO B 2 221 ? 8.239   78.470 12.338 1.000 60.160 ? 221 PRO HHH CD   1 
ATOM   3236 H  HA   . PRO B 2 221 ? 10.365  76.516 13.583 1.000 59.050 ? 221 PRO HHH HA   1 
ATOM   3237 H  HB2  . PRO B 2 221 ? 11.191  78.995 13.566 1.000 61.670 ? 221 PRO HHH HB2  1 
ATOM   3238 H  HB3  . PRO B 2 221 ? 11.026  78.183 12.201 1.000 60.626 ? 221 PRO HHH HB3  1 
ATOM   3239 H  HG2  . PRO B 2 221 ? 9.180   80.035 13.323 1.000 62.185 ? 221 PRO HHH HG2  1 
ATOM   3240 H  HG3  . PRO B 2 221 ? 9.615   79.925 11.795 1.000 61.937 ? 221 PRO HHH HG3  1 
ATOM   3241 H  HD2  . PRO B 2 221 ? 7.392   78.880 12.593 1.000 60.596 ? 221 PRO HHH HD2  1 
ATOM   3242 H  HD3  . PRO B 2 221 ? 8.198   78.217 11.397 1.000 59.872 ? 221 PRO HHH HD3  1 
ATOM   3243 N  N    . ARG B 2 222 ? 10.910  77.288 15.978 1.000 62.259 ? 222 ARG HHH N    1 
ATOM   3244 C  CA   . ARG B 2 222 ? 11.018  77.399 17.459 1.000 63.699 ? 222 ARG HHH CA   1 
ATOM   3245 C  C    . ARG B 2 222 ? 11.659  78.745 17.823 1.000 65.729 ? 222 ARG HHH C    1 
ATOM   3246 O  O    . ARG B 2 222 ? 11.225  79.471 18.730 1.000 66.986 ? 222 ARG HHH O    1 
ATOM   3247 C  CB   . ARG B 2 222 ? 11.816  76.203 17.991 1.000 63.306 ? 222 ARG HHH CB   1 
ATOM   3248 C  CG   . ARG B 2 222 ? 11.254  74.856 17.555 1.000 61.801 ? 222 ARG HHH CG   1 
ATOM   3249 C  CD   . ARG B 2 222 ? 12.128  73.669 17.915 1.000 61.382 ? 222 ARG HHH CD   1 
ATOM   3250 N  NE   . ARG B 2 222 ? 11.472  72.418 17.545 1.000 60.094 ? 222 ARG HHH NE   1 
ATOM   3251 C  CZ   . ARG B 2 222 ? 10.745  71.651 18.360 1.000 59.502 ? 222 ARG HHH CZ   1 
ATOM   3252 N  NH1  . ARG B 2 222 ? 10.577  71.973 19.633 1.000 60.294 ? 222 ARG HHH NH1  1 
ATOM   3253 N  NH2  . ARG B 2 222 ? 10.184  70.551 17.891 1.000 58.431 ? 222 ARG HHH NH2  1 
ATOM   3254 O  OXT  . ARG B 2 222 ? 12.642  79.141 17.201 1.000 66.342 ? 222 ARG HHH OXT  1 
ATOM   3255 H  H    . ARG B 2 222 ? 11.652  76.929 15.589 1.000 61.887 ? 222 ARG HHH H    1 
ATOM   3256 H  HA   . ARG B 2 222 ? 10.111  77.369 17.840 1.000 63.643 ? 222 ARG HHH HA   1 
ATOM   3257 H  HB2  . ARG B 2 222 ? 12.741  76.278 17.679 1.000 63.530 ? 222 ARG HHH HB2  1 
ATOM   3258 H  HB3  . ARG B 2 222 ? 11.823  76.241 18.971 1.000 63.885 ? 222 ARG HHH HB3  1 
ATOM   3259 H  HG2  . ARG B 2 222 ? 10.373  74.731 17.966 1.000 61.704 ? 222 ARG HHH HG2  1 
ATOM   3260 H  HG3  . ARG B 2 222 ? 11.128  74.863 16.582 1.000 61.358 ? 222 ARG HHH HG3  1 
ATOM   3261 H  HD2  . ARG B 2 222 ? 12.984  73.740 17.445 1.000 61.518 ? 222 ARG HHH HD2  1 
ATOM   3262 H  HD3  . ARG B 2 222 ? 12.311  73.678 18.878 1.000 61.973 ? 222 ARG HHH HD3  1 
ATOM   3263 H  HE   . ARG B 2 222 ? 11.540  72.162 16.714 1.000 59.447 ? 222 ARG HHH HE   1 
ATOM   3264 H  HH11 . ARG B 2 222 ? 10.936  72.703 19.959 1.000 61.328 ? 222 ARG HHH HH11 1 
ATOM   3265 H  HH12 . ARG B 2 222 ? 10.096  71.453 20.154 1.000 60.157 ? 222 ARG HHH HH12 1 
ATOM   3266 H  HH21 . ARG B 2 222 ? 10.293  70.327 17.045 1.000 57.813 ? 222 ARG HHH HH21 1 
ATOM   3267 H  HH22 . ARG B 2 222 ? 9.709   70.036 18.426 1.000 58.113 ? 222 ARG HHH HH22 1 
ATOM   3268 N  N    . ASN C 3 1   ? 29.315  31.591 30.940 1.000 42.343 ? 1   ASN LLL N    1 
ATOM   3269 C  CA   . ASN C 3 1   ? 28.204  30.952 30.177 1.000 42.366 ? 1   ASN LLL CA   1 
ATOM   3270 C  C    . ASN C 3 1   ? 28.334  31.396 28.715 1.000 41.247 ? 1   ASN LLL C    1 
ATOM   3271 O  O    . ASN C 3 1   ? 29.073  32.374 28.506 1.000 43.063 ? 1   ASN LLL O    1 
ATOM   3272 C  CB   . ASN C 3 1   ? 26.840  31.265 30.805 1.000 43.208 ? 1   ASN LLL CB   1 
ATOM   3273 C  CG   . ASN C 3 1   ? 26.290  32.635 30.454 1.000 43.489 ? 1   ASN LLL CG   1 
ATOM   3274 O  OD1  . ASN C 3 1   ? 26.660  33.228 29.446 1.000 42.801 ? 1   ASN LLL OD1  1 
ATOM   3275 N  ND2  . ASN C 3 1   ? 25.382  33.146 31.270 1.000 44.884 ? 1   ASN LLL ND2  1 
ATOM   3276 H  H1   . ASN C 3 1   ? 29.199  32.495 30.946 1.000 42.544 ? 1   ASN LLL H1   1 
ATOM   3277 H  H2   . ASN C 3 1   ? 30.155  31.379 30.526 1.000 42.433 ? 1   ASN LLL H2   1 
ATOM   3278 H  H3   . ASN C 3 1   ? 29.313  31.263 31.842 1.000 43.407 ? 1   ASN LLL H3   1 
ATOM   3279 H  HA   . ASN C 3 1   ? 28.330  29.975 30.216 1.000 42.417 ? 1   ASN LLL HA   1 
ATOM   3280 H  HB2  . ASN C 3 1   ? 26.200  30.585 30.514 1.000 43.047 ? 1   ASN LLL HB2  1 
ATOM   3281 H  HB3  . ASN C 3 1   ? 26.924  31.201 31.778 1.000 44.130 ? 1   ASN LLL HB3  1 
ATOM   3282 H  HD21 . ASN C 3 1   ? 25.000  33.991 30.999 0.000 30.000 ? 1   ASN LLL HD21 1 
ATOM   3283 H  HD22 . ASN C 3 1   ? 25.272  32.999 32.133 0.000 30.000 ? 1   ASN LLL HD22 1 
ATOM   3284 N  N    . LEU C 3 2   ? 27.639  30.741 27.764 1.000 39.550 ? 2   LEU LLL N    1 
ATOM   3285 C  CA   . LEU C 3 2   ? 27.884  30.858 26.289 1.000 37.972 ? 2   LEU LLL CA   1 
ATOM   3286 C  C    . LEU C 3 2   ? 26.942  31.865 25.615 1.000 36.827 ? 2   LEU LLL C    1 
ATOM   3287 O  O    . LEU C 3 2   ? 25.727  31.614 25.573 1.000 36.076 ? 2   LEU LLL O    1 
ATOM   3288 C  CB   . LEU C 3 2   ? 27.724  29.497 25.596 1.000 37.687 ? 2   LEU LLL CB   1 
ATOM   3289 C  CG   . LEU C 3 2   ? 27.858  29.512 24.063 1.000 36.683 ? 2   LEU LLL CG   1 
ATOM   3290 C  CD1  . LEU C 3 2   ? 29.256  29.933 23.629 1.000 36.769 ? 2   LEU LLL CD1  1 
ATOM   3291 C  CD2  . LEU C 3 2   ? 27.515  28.163 23.445 1.000 36.055 ? 2   LEU LLL CD2  1 
ATOM   3292 H  H    . LEU C 3 2   ? 26.958  30.172 27.971 1.000 39.749 ? 2   LEU LLL H    1 
ATOM   3293 H  HA   . LEU C 3 2   ? 28.806  31.169 26.165 1.000 38.052 ? 2   LEU LLL HA   1 
ATOM   3294 H  HB2  . LEU C 3 2   ? 28.397  28.887 25.959 1.000 37.953 ? 2   LEU LLL HB2  1 
ATOM   3295 H  HB3  . LEU C 3 2   ? 26.845  29.136 25.826 1.000 37.727 ? 2   LEU LLL HB3  1 
ATOM   3296 H  HG   . LEU C 3 2   ? 27.218  30.176 23.707 1.000 36.405 ? 2   LEU LLL HG   1 
ATOM   3297 H  HD11 . LEU C 3 2   ? 29.476  30.792 24.026 1.000 36.964 ? 2   LEU LLL HD11 1 
ATOM   3298 H  HD12 . LEU C 3 2   ? 29.285  30.008 22.660 1.000 36.319 ? 2   LEU LLL HD12 1 
ATOM   3299 H  HD13 . LEU C 3 2   ? 29.901  29.267 23.920 1.000 37.030 ? 2   LEU LLL HD13 1 
ATOM   3300 H  HD21 . LEU C 3 2   ? 28.109  27.481 23.803 1.000 36.444 ? 2   LEU LLL HD21 1 
ATOM   3301 H  HD22 . LEU C 3 2   ? 27.622  28.212 22.479 1.000 35.755 ? 2   LEU LLL HD22 1 
ATOM   3302 H  HD23 . LEU C 3 2   ? 26.593  27.933 23.657 1.000 36.249 ? 2   LEU LLL HD23 1 
ATOM   3303 N  N    . THR C 3 3   ? 27.511  32.907 25.006 1.000 36.758 ? 3   THR LLL N    1 
ATOM   3304 C  CA   . THR C 3 3   ? 26.876  33.691 23.909 1.000 36.419 ? 3   THR LLL CA   1 
ATOM   3305 C  C    . THR C 3 3   ? 27.629  33.397 22.603 1.000 36.130 ? 3   THR LLL C    1 
ATOM   3306 O  O    . THR C 3 3   ? 28.800  32.974 22.673 1.000 36.493 ? 3   THR LLL O    1 
ATOM   3307 C  CB   . THR C 3 3   ? 26.839  35.194 24.205 1.000 35.743 ? 3   THR LLL CB   1 
ATOM   3308 O  OG1  . THR C 3 3   ? 28.201  35.588 24.338 1.000 36.400 ? 3   THR LLL OG1  1 
ATOM   3309 C  CG2  . THR C 3 3   ? 26.053  35.554 25.446 1.000 36.153 ? 3   THR LLL CG2  1 
ATOM   3310 H  H    . THR C 3 3   ? 28.338  33.221 25.224 1.000 37.008 ? 3   THR LLL H    1 
ATOM   3311 H  HA   . THR C 3 3   ? 25.949  33.374 23.807 1.000 36.138 ? 3   THR LLL HA   1 
ATOM   3312 H  HB   . THR C 3 3   ? 26.444  35.657 23.427 1.000 35.531 ? 3   THR LLL HB   1 
ATOM   3313 H  HG1  . THR C 3 3   ? 28.239  36.372 24.450 0.000 30.000 ? 3   THR LLL HG1  1 
ATOM   3314 H  HG21 . THR C 3 3   ? 25.147  35.204 25.371 1.000 36.128 ? 3   THR LLL HG21 1 
ATOM   3315 H  HG22 . THR C 3 3   ? 26.018  36.523 25.540 1.000 36.235 ? 3   THR LLL HG22 1 
ATOM   3316 H  HG23 . THR C 3 3   ? 26.485  35.168 26.229 1.000 36.702 ? 3   THR LLL HG23 1 
ATOM   3317 N  N    . LEU C 3 4   ? 26.949  33.582 21.469 1.000 35.460 ? 4   LEU LLL N    1 
ATOM   3318 C  CA   . LEU C 3 4   ? 27.497  33.455 20.098 1.000 35.187 ? 4   LEU LLL CA   1 
ATOM   3319 C  C    . LEU C 3 4   ? 27.447  34.833 19.443 1.000 35.117 ? 4   LEU LLL C    1 
ATOM   3320 O  O    . LEU C 3 4   ? 26.338  35.362 19.322 1.000 35.914 ? 4   LEU LLL O    1 
ATOM   3321 C  CB   . LEU C 3 4   ? 26.631  32.470 19.310 1.000 35.031 ? 4   LEU LLL CB   1 
ATOM   3322 C  CG   . LEU C 3 4   ? 26.855  30.989 19.586 1.000 35.266 ? 4   LEU LLL CG   1 
ATOM   3323 C  CD1  . LEU C 3 4   ? 26.124  30.158 18.545 1.000 34.997 ? 4   LEU LLL CD1  1 
ATOM   3324 C  CD2  . LEU C 3 4   ? 28.339  30.639 19.597 1.000 35.859 ? 4   LEU LLL CD2  1 
ATOM   3325 H  H    . LEU C 3 4   ? 26.067  33.812 21.475 1.000 35.439 ? 4   LEU LLL H    1 
ATOM   3326 H  HA   . LEU C 3 4   ? 28.428  33.143 20.142 1.000 35.386 ? 4   LEU LLL HA   1 
ATOM   3327 H  HB2  . LEU C 3 4   ? 25.693  32.676 19.494 1.000 35.015 ? 4   LEU LLL HB2  1 
ATOM   3328 H  HB3  . LEU C 3 4   ? 26.780  32.629 18.357 1.000 34.857 ? 4   LEU LLL HB3  1 
ATOM   3329 H  HG   . LEU C 3 4   ? 26.478  30.776 20.475 1.000 35.552 ? 4   LEU LLL HG   1 
ATOM   3330 H  HD11 . LEU C 3 4   ? 25.240  30.534 18.390 1.000 34.955 ? 4   LEU LLL HD11 1 
ATOM   3331 H  HD12 . LEU C 3 4   ? 26.035  29.243 18.864 1.000 35.127 ? 4   LEU LLL HD12 1 
ATOM   3332 H  HD13 . LEU C 3 4   ? 26.627  30.162 17.713 1.000 34.907 ? 4   LEU LLL HD13 1 
ATOM   3333 H  HD21 . LEU C 3 4   ? 28.800  31.153 18.911 1.000 35.647 ? 4   LEU LLL HD21 1 
ATOM   3334 H  HD22 . LEU C 3 4   ? 28.451  29.689 19.419 1.000 35.732 ? 4   LEU LLL HD22 1 
ATOM   3335 H  HD23 . LEU C 3 4   ? 28.717  30.851 20.469 1.000 36.033 ? 4   LEU LLL HD23 1 
ATOM   3336 N  N    . ILE C 3 5   ? 28.587  35.382 19.025 1.000 35.549 ? 5   ILE LLL N    1 
ATOM   3337 C  CA   . ILE C 3 5   ? 28.685  36.783 18.515 1.000 35.805 ? 5   ILE LLL CA   1 
ATOM   3338 C  C    . ILE C 3 5   ? 28.770  36.754 16.984 1.000 35.244 ? 5   ILE LLL C    1 
ATOM   3339 O  O    . ILE C 3 5   ? 29.667  36.076 16.464 1.000 35.586 ? 5   ILE LLL O    1 
ATOM   3340 C  CB   . ILE C 3 5   ? 29.880  37.521 19.155 1.000 36.869 ? 5   ILE LLL CB   1 
ATOM   3341 C  CG1  . ILE C 3 5   ? 29.817  37.503 20.687 1.000 37.281 ? 5   ILE LLL CG1  1 
ATOM   3342 C  CG2  . ILE C 3 5   ? 29.985  38.942 18.615 1.000 36.992 ? 5   ILE LLL CG2  1 
ATOM   3343 C  CD1  . ILE C 3 5   ? 31.171  37.663 21.356 1.000 37.884 ? 5   ILE LLL CD1  1 
ATOM   3344 H  H    . ILE C 3 5   ? 29.381  34.935 19.024 1.000 35.720 ? 5   ILE LLL H    1 
ATOM   3345 H  HA   . ILE C 3 5   ? 27.872  37.256 18.767 1.000 35.674 ? 5   ILE LLL HA   1 
ATOM   3346 H  HB   . ILE C 3 5   ? 30.701  37.040 18.887 1.000 36.977 ? 5   ILE LLL HB   1 
ATOM   3347 H  HG12 . ILE C 3 5   ? 29.230  38.229 20.987 1.000 37.212 ? 5   ILE LLL HG12 1 
ATOM   3348 H  HG13 . ILE C 3 5   ? 29.421  36.655 20.980 1.000 37.190 ? 5   ILE LLL HG13 1 
ATOM   3349 H  HG21 . ILE C 3 5   ? 30.472  38.936 17.773 1.000 37.014 ? 5   ILE LLL HG21 1 
ATOM   3350 H  HG22 . ILE C 3 5   ? 30.458  39.501 19.256 1.000 37.290 ? 5   ILE LLL HG22 1 
ATOM   3351 H  HG23 . ILE C 3 5   ? 29.094  39.303 18.470 1.000 36.697 ? 5   ILE LLL HG23 1 
ATOM   3352 H  HD11 . ILE C 3 5   ? 31.682  36.842 21.258 1.000 38.020 ? 5   ILE LLL HD11 1 
ATOM   3353 H  HD12 . ILE C 3 5   ? 31.045  37.855 22.302 1.000 38.204 ? 5   ILE LLL HD12 1 
ATOM   3354 H  HD13 . ILE C 3 5   ? 31.656  38.397 20.940 1.000 38.025 ? 5   ILE LLL HD13 1 
ATOM   3355 N  N    . GLN C 3 6   ? 27.856  37.472 16.318 1.000 34.800 ? 6   GLN LLL N    1 
ATOM   3356 C  CA   . GLN C 3 6   ? 27.793  37.704 14.850 1.000 34.758 ? 6   GLN LLL CA   1 
ATOM   3357 C  C    . GLN C 3 6   ? 27.840  39.215 14.577 1.000 34.876 ? 6   GLN LLL C    1 
ATOM   3358 O  O    . GLN C 3 6   ? 27.162  39.965 15.309 1.000 34.179 ? 6   GLN LLL O    1 
ATOM   3359 C  CB   . GLN C 3 6   ? 26.491  37.134 14.272 1.000 34.495 ? 6   GLN LLL CB   1 
ATOM   3360 C  CG   . GLN C 3 6   ? 26.547  35.653 13.927 1.000 35.007 ? 6   GLN LLL CG   1 
ATOM   3361 C  CD   . GLN C 3 6   ? 25.236  35.128 13.387 1.000 35.306 ? 6   GLN LLL CD   1 
ATOM   3362 O  OE1  . GLN C 3 6   ? 24.224  35.083 14.084 1.000 35.443 ? 6   GLN LLL OE1  1 
ATOM   3363 N  NE2  . GLN C 3 6   ? 25.245  34.712 12.132 1.000 35.038 ? 6   GLN LLL NE2  1 
ATOM   3364 H  H    . GLN C 3 6   ? 27.174  37.886 16.757 1.000 34.769 ? 6   GLN LLL H    1 
ATOM   3365 H  HA   . GLN C 3 6   ? 28.565  37.268 14.419 1.000 34.931 ? 6   GLN LLL HA   1 
ATOM   3366 H  HB2  . GLN C 3 6   ? 25.774  37.281 14.923 1.000 34.525 ? 6   GLN LLL HB2  1 
ATOM   3367 H  HB3  . GLN C 3 6   ? 26.264  37.639 13.462 1.000 34.678 ? 6   GLN LLL HB3  1 
ATOM   3368 H  HG2  . GLN C 3 6   ? 27.250  35.505 13.259 1.000 35.130 ? 6   GLN LLL HG2  1 
ATOM   3369 H  HG3  . GLN C 3 6   ? 26.787  35.145 14.731 1.000 34.959 ? 6   GLN LLL HG3  1 
ATOM   3370 H  HE21 . GLN C 3 6   ? 24.421  34.332 11.749 0.000 30.000 ? 6   GLN LLL HE21 1 
ATOM   3371 H  HE22 . GLN C 3 6   ? 25.905  34.687 11.622 0.000 30.000 ? 6   GLN LLL HE22 1 
ATOM   3372 N  N    . SER C 3 7   ? 28.568  39.647 13.542 1.000 35.529 ? 7   SER LLL N    1 
ATOM   3373 C  CA   . SER C 3 7   ? 28.398  40.985 12.916 1.000 36.050 ? 7   SER LLL CA   1 
ATOM   3374 C  C    . SER C 3 7   ? 27.006  41.044 12.280 1.000 36.243 ? 7   SER LLL C    1 
ATOM   3375 O  O    . SER C 3 7   ? 26.480  39.982 11.908 1.000 36.591 ? 7   SER LLL O    1 
ATOM   3376 C  CB   . SER C 3 7   ? 29.468  41.280 11.903 1.000 37.010 ? 7   SER LLL CB   1 
ATOM   3377 O  OG   . SER C 3 7   ? 30.731  41.445 12.529 1.000 38.031 ? 7   SER LLL OG   1 
ATOM   3378 H  H    . SER C 3 7   ? 29.222  39.152 13.144 1.000 35.731 ? 7   SER LLL H    1 
ATOM   3379 H  HA   . SER C 3 7   ? 28.444  41.671 13.635 1.000 36.129 ? 7   SER LLL HA   1 
ATOM   3380 H  HB2  . SER C 3 7   ? 29.516  40.543 11.254 1.000 37.145 ? 7   SER LLL HB2  1 
ATOM   3381 H  HB3  . SER C 3 7   ? 29.235  42.102 11.414 1.000 37.190 ? 7   SER LLL HB3  1 
ATOM   3382 H  HG   . SER C 3 7   ? 31.245  41.610 11.937 0.000 30.000 ? 7   SER LLL HG   1 
ATOM   3383 N  N    . ARG C 3 8   ? 26.431  42.239 12.166 1.000 36.741 ? 8   ARG LLL N    1 
ATOM   3384 C  CA   . ARG C 3 8   ? 25.034  42.433 11.700 1.000 36.960 ? 8   ARG LLL CA   1 
ATOM   3385 C  C    . ARG C 3 8   ? 24.986  42.487 10.167 1.000 36.273 ? 8   ARG LLL C    1 
ATOM   3386 O  O    . ARG C 3 8   ? 23.897  42.221 9.624  1.000 35.978 ? 8   ARG LLL O    1 
ATOM   3387 C  CB   . ARG C 3 8   ? 24.427  43.681 12.351 1.000 38.036 ? 8   ARG LLL CB   1 
ATOM   3388 C  CG   . ARG C 3 8   ? 23.976  43.446 13.785 1.000 39.043 ? 8   ARG LLL CG   1 
ATOM   3389 C  CD   . ARG C 3 8   ? 23.383  44.672 14.458 1.000 40.806 ? 8   ARG LLL CD   1 
ATOM   3390 N  NE   . ARG C 3 8   ? 22.396  45.402 13.658 1.000 42.037 ? 8   ARG LLL NE   1 
ATOM   3391 C  CZ   . ARG C 3 8   ? 21.135  45.017 13.436 1.000 42.570 ? 8   ARG LLL CZ   1 
ATOM   3392 N  NH1  . ARG C 3 8   ? 20.674  43.881 13.933 1.000 43.003 ? 8   ARG LLL NH1  1 
ATOM   3393 N  NH2  . ARG C 3 8   ? 20.338  45.770 12.698 1.000 43.288 ? 8   ARG LLL NH2  1 
ATOM   3394 H  H    . ARG C 3 8   ? 26.868  43.014 12.365 1.000 36.842 ? 8   ARG LLL H    1 
ATOM   3395 H  HA   . ARG C 3 8   ? 24.509  41.653 11.992 1.000 36.746 ? 8   ARG LLL HA   1 
ATOM   3396 H  HB2  . ARG C 3 8   ? 25.092  44.401 12.339 1.000 38.204 ? 8   ARG LLL HB2  1 
ATOM   3397 H  HB3  . ARG C 3 8   ? 23.658  43.971 11.818 1.000 38.150 ? 8   ARG LLL HB3  1 
ATOM   3398 H  HG2  . ARG C 3 8   ? 23.307  42.729 13.794 1.000 39.080 ? 8   ARG LLL HG2  1 
ATOM   3399 H  HG3  . ARG C 3 8   ? 24.743  43.141 14.314 1.000 39.166 ? 8   ARG LLL HG3  1 
ATOM   3400 H  HD2  . ARG C 3 8   ? 22.962  44.395 15.300 1.000 40.580 ? 8   ARG LLL HD2  1 
ATOM   3401 H  HD3  . ARG C 3 8   ? 24.114  45.284 14.687 1.000 40.725 ? 8   ARG LLL HD3  1 
ATOM   3402 H  HE   . ARG C 3 8   ? 22.648  46.160 13.308 1.000 42.053 ? 8   ARG LLL HE   1 
ATOM   3403 H  HH11 . ARG C 3 8   ? 21.190  43.371 14.426 1.000 42.692 ? 8   ARG LLL HH11 1 
ATOM   3404 H  HH12 . ARG C 3 8   ? 19.843  43.641 13.775 1.000 42.894 ? 8   ARG LLL HH12 1 
ATOM   3405 H  HH21 . ARG C 3 8   ? 20.637  46.526 12.359 1.000 43.158 ? 8   ARG LLL HH21 1 
ATOM   3406 H  HH22 . ARG C 3 8   ? 19.508  45.515 12.546 1.000 43.173 ? 8   ARG LLL HH22 1 
ATOM   3407 N  N    . SER C 3 9   ? 26.104  42.796 9.496  1.000 36.011 ? 9   SER LLL N    1 
ATOM   3408 C  CA   . SER C 3 9   ? 26.164  42.994 8.021  1.000 36.237 ? 9   SER LLL CA   1 
ATOM   3409 C  C    . SER C 3 9   ? 27.455  42.431 7.408  1.000 35.864 ? 9   SER LLL C    1 
ATOM   3410 O  O    . SER C 3 9   ? 28.557  42.845 7.810  1.000 36.255 ? 9   SER LLL O    1 
ATOM   3411 C  CB   . SER C 3 9   ? 26.003  44.439 7.659  1.000 36.650 ? 9   SER LLL CB   1 
ATOM   3412 O  OG   . SER C 3 9   ? 26.266  44.633 6.276  1.000 38.139 ? 9   SER LLL OG   1 
ATOM   3413 H  H    . SER C 3 9   ? 26.914  42.915 9.895  1.000 36.144 ? 9   SER LLL H    1 
ATOM   3414 H  HA   . SER C 3 9   ? 25.401  42.496 7.623  1.000 36.143 ? 9   SER LLL HA   1 
ATOM   3415 H  HB2  . SER C 3 9   ? 25.086  44.729 7.865  1.000 36.563 ? 9   SER LLL HB2  1 
ATOM   3416 H  HB3  . SER C 3 9   ? 26.626  44.983 8.192  1.000 36.778 ? 9   SER LLL HB3  1 
ATOM   3417 H  HG   . SER C 3 9   ? 26.313  45.323 6.019  0.000 30.000 ? 9   SER LLL HG   1 
ATOM   3418 N  N    . VAL C 3 10  ? 27.299  41.532 6.438  1.000 35.135 ? 10  VAL LLL N    1 
ATOM   3419 C  CA   . VAL C 3 10  ? 28.356  41.135 5.468  1.000 35.476 ? 10  VAL LLL CA   1 
ATOM   3420 C  C    . VAL C 3 10  ? 27.771  41.343 4.068  1.000 36.079 ? 10  VAL LLL C    1 
ATOM   3421 O  O    . VAL C 3 10  ? 26.543  41.267 3.936  1.000 35.691 ? 10  VAL LLL O    1 
ATOM   3422 C  CB   . VAL C 3 10  ? 28.822  39.687 5.700  1.000 34.912 ? 10  VAL LLL CB   1 
ATOM   3423 C  CG1  . VAL C 3 10  ? 29.661  39.176 4.546  1.000 35.933 ? 10  VAL LLL CG1  1 
ATOM   3424 C  CG2  . VAL C 3 10  ? 29.578  39.540 7.010  1.000 34.546 ? 10  VAL LLL CG2  1 
ATOM   3425 H  H    . VAL C 3 10  ? 26.514  41.087 6.310  1.000 35.136 ? 10  VAL LLL H    1 
ATOM   3426 H  HA   . VAL C 3 10  ? 29.119  41.730 5.577  1.000 35.728 ? 10  VAL LLL HA   1 
ATOM   3427 H  HB   . VAL C 3 10  ? 28.012  39.122 5.756  1.000 34.721 ? 10  VAL LLL HB   1 
ATOM   3428 H  HG11 . VAL C 3 10  ? 29.083  38.956 3.795  1.000 36.139 ? 10  VAL LLL HG11 1 
ATOM   3429 H  HG12 . VAL C 3 10  ? 30.145  38.379 4.824  1.000 35.798 ? 10  VAL LLL HG12 1 
ATOM   3430 H  HG13 . VAL C 3 10  ? 30.296  39.862 4.276  1.000 36.370 ? 10  VAL LLL HG13 1 
ATOM   3431 H  HG21 . VAL C 3 10  ? 30.397  40.064 6.972  1.000 34.911 ? 10  VAL LLL HG21 1 
ATOM   3432 H  HG22 . VAL C 3 10  ? 29.799  38.603 7.155  1.000 34.437 ? 10  VAL LLL HG22 1 
ATOM   3433 H  HG23 . VAL C 3 10  ? 29.023  39.858 7.743  1.000 34.072 ? 10  VAL LLL HG23 1 
ATOM   3434 N  N    . SER C 3 11  ? 28.615  41.630 3.075  1.000 36.893 ? 11  SER LLL N    1 
ATOM   3435 C  CA   . SER C 3 11  ? 28.194  41.891 1.676  1.000 37.399 ? 11  SER LLL CA   1 
ATOM   3436 C  C    . SER C 3 11  ? 29.300  41.485 0.701  1.000 38.082 ? 11  SER LLL C    1 
ATOM   3437 O  O    . SER C 3 11  ? 30.464  41.418 1.108  1.000 38.263 ? 11  SER LLL O    1 
ATOM   3438 C  CB   . SER C 3 11  ? 27.797  43.335 1.483  1.000 37.731 ? 11  SER LLL CB   1 
ATOM   3439 O  OG   . SER C 3 11  ? 28.909  44.206 1.637  1.000 38.111 ? 11  SER LLL OG   1 
ATOM   3440 H  H    . SER C 3 11  ? 29.516  41.702 3.187  1.000 37.068 ? 11  SER LLL H    1 
ATOM   3441 H  HA   . SER C 3 11  ? 27.401  41.324 1.489  1.000 37.269 ? 11  SER LLL HA   1 
ATOM   3442 H  HB2  . SER C 3 11  ? 27.415  43.450 0.584  1.000 38.331 ? 11  SER LLL HB2  1 
ATOM   3443 H  HB3  . SER C 3 11  ? 27.104  43.572 2.141  1.000 37.061 ? 11  SER LLL HB3  1 
ATOM   3444 H  HG   . SER C 3 11  ? 28.616  45.023 1.609  0.000 30.000 ? 11  SER LLL HG   1 
ATOM   3445 N  N    . GLY C 3 12  ? 28.914  41.218 -0.542 1.000 38.855 ? 12  GLY LLL N    1 
ATOM   3446 C  CA   . GLY C 3 12  ? 29.819  40.889 -1.655 1.000 40.221 ? 12  GLY LLL CA   1 
ATOM   3447 C  C    . GLY C 3 12  ? 29.064  40.933 -2.967 1.000 41.241 ? 12  GLY LLL C    1 
ATOM   3448 O  O    . GLY C 3 12  ? 27.820  40.867 -2.919 1.000 40.884 ? 12  GLY LLL O    1 
ATOM   3449 H  H    . GLY C 3 12  ? 28.034  41.224 -0.779 1.000 38.840 ? 12  GLY LLL H    1 
ATOM   3450 H  HA2  . GLY C 3 12  ? 30.564  41.541 -1.677 1.000 40.638 ? 12  GLY LLL HA2  1 
ATOM   3451 H  HA3  . GLY C 3 12  ? 30.195  39.984 -1.516 1.000 40.077 ? 12  GLY LLL HA3  1 
ATOM   3452 N  N    . SER C 3 13  ? 29.779  41.072 -4.088 1.000 42.567 ? 13  SER LLL N    1 
ATOM   3453 C  CA   . SER C 3 13  ? 29.206  41.150 -5.458 1.000 43.328 ? 13  SER LLL CA   1 
ATOM   3454 C  C    . SER C 3 13  ? 28.861  39.744 -5.939 1.000 43.193 ? 13  SER LLL C    1 
ATOM   3455 O  O    . SER C 3 13  ? 29.261  38.761 -5.316 1.000 42.560 ? 13  SER LLL O    1 
ATOM   3456 C  CB   . SER C 3 13  ? 30.154  41.838 -6.398 1.000 44.626 ? 13  SER LLL CB   1 
ATOM   3457 O  OG   . SER C 3 13  ? 30.555  43.082 -5.856 1.000 44.244 ? 13  SER LLL OG   1 
ATOM   3458 H  H    . SER C 3 13  ? 30.688  41.130 -4.090 1.000 42.841 ? 13  SER LLL H    1 
ATOM   3459 H  HA   . SER C 3 13  ? 28.367  41.681 -5.409 1.000 43.065 ? 13  SER LLL HA   1 
ATOM   3460 H  HB2  . SER C 3 13  ? 30.944  41.271 -6.544 1.000 45.056 ? 13  SER LLL HB2  1 
ATOM   3461 H  HB3  . SER C 3 13  ? 29.714  41.984 -7.265 1.000 45.554 ? 13  SER LLL HB3  1 
ATOM   3462 H  HG   . SER C 3 13  ? 31.040  43.404 -6.412 0.000 30.000 ? 13  SER LLL HG   1 
ATOM   3463 N  N    . PRO C 3 14  ? 28.089  39.597 -7.039 1.000 43.543 ? 14  PRO LLL N    1 
ATOM   3464 C  CA   . PRO C 3 14  ? 27.805  38.274 -7.591 1.000 43.414 ? 14  PRO LLL CA   1 
ATOM   3465 C  C    . PRO C 3 14  ? 29.082  37.653 -8.179 1.000 44.149 ? 14  PRO LLL C    1 
ATOM   3466 O  O    . PRO C 3 14  ? 29.781  38.324 -8.911 1.000 45.149 ? 14  PRO LLL O    1 
ATOM   3467 C  CB   . PRO C 3 14  ? 26.731  38.541 -8.657 1.000 44.603 ? 14  PRO LLL CB   1 
ATOM   3468 C  CG   . PRO C 3 14  ? 26.218  39.936 -8.347 1.000 44.406 ? 14  PRO LLL CG   1 
ATOM   3469 C  CD   . PRO C 3 14  ? 27.407  40.673 -7.774 1.000 44.173 ? 14  PRO LLL CD   1 
ATOM   3470 H  HA   . PRO C 3 14  ? 27.433  37.693 -6.882 1.000 42.462 ? 14  PRO LLL HA   1 
ATOM   3471 H  HB2  . PRO C 3 14  ? 27.115  38.505 -9.559 1.000 45.886 ? 14  PRO LLL HB2  1 
ATOM   3472 H  HB3  . PRO C 3 14  ? 26.007  37.882 -8.596 1.000 44.322 ? 14  PRO LLL HB3  1 
ATOM   3473 H  HG2  . PRO C 3 14  ? 25.896  40.376 -9.160 1.000 45.469 ? 14  PRO LLL HG2  1 
ATOM   3474 H  HG3  . PRO C 3 14  ? 25.486  39.900 -7.697 1.000 43.457 ? 14  PRO LLL HG3  1 
ATOM   3475 H  HD2  . PRO C 3 14  ? 27.974  41.037 -8.479 1.000 45.333 ? 14  PRO LLL HD2  1 
ATOM   3476 H  HD3  . PRO C 3 14  ? 27.126  41.392 -7.180 1.000 43.524 ? 14  PRO LLL HD3  1 
ATOM   3477 N  N    . GLY C 3 15  ? 29.361  36.398 -7.823 1.000 43.484 ? 15  GLY LLL N    1 
ATOM   3478 C  CA   . GLY C 3 15  ? 30.590  35.681 -8.206 1.000 44.392 ? 15  GLY LLL CA   1 
ATOM   3479 C  C    . GLY C 3 15  ? 31.594  35.658 -7.069 1.000 43.423 ? 15  GLY LLL C    1 
ATOM   3480 O  O    . GLY C 3 15  ? 32.393  34.708 -7.007 1.000 43.714 ? 15  GLY LLL O    1 
ATOM   3481 H  H    . GLY C 3 15  ? 28.791  35.903 -7.313 1.000 42.681 ? 15  GLY LLL H    1 
ATOM   3482 H  HA2  . GLY C 3 15  ? 30.358  34.753 -8.459 1.000 44.500 ? 15  GLY LLL HA2  1 
ATOM   3483 H  HA3  . GLY C 3 15  ? 30.995  36.123 -8.994 1.000 45.622 ? 15  GLY LLL HA3  1 
ATOM   3484 N  N    . GLN C 3 16  ? 31.558  36.661 -6.189 1.000 42.550 ? 16  GLN LLL N    1 
ATOM   3485 C  CA   . GLN C 3 16  ? 32.551  36.817 -5.095 1.000 42.161 ? 16  GLN LLL CA   1 
ATOM   3486 C  C    . GLN C 3 16  ? 32.263  35.796 -3.988 1.000 41.570 ? 16  GLN LLL C    1 
ATOM   3487 O  O    . GLN C 3 16  ? 31.158  35.212 -3.972 1.000 41.075 ? 16  GLN LLL O    1 
ATOM   3488 C  CB   . GLN C 3 16  ? 32.543  38.240 -4.537 1.000 41.446 ? 16  GLN LLL CB   1 
ATOM   3489 C  CG   . GLN C 3 16  ? 33.040  39.285 -5.526 1.000 42.729 ? 16  GLN LLL CG   1 
ATOM   3490 C  CD   . GLN C 3 16  ? 33.364  40.597 -4.856 1.000 41.696 ? 16  GLN LLL CD   1 
ATOM   3491 O  OE1  . GLN C 3 16  ? 32.780  40.961 -3.840 1.000 39.802 ? 16  GLN LLL OE1  1 
ATOM   3492 N  NE2  . GLN C 3 16  ? 34.309  41.320 -5.429 1.000 42.565 ? 16  GLN LLL NE2  1 
ATOM   3493 H  H    . GLN C 3 16  ? 30.924  37.313 -6.205 1.000 42.498 ? 16  GLN LLL H    1 
ATOM   3494 H  HA   . GLN C 3 16  ? 33.445  36.631 -5.464 1.000 43.017 ? 16  GLN LLL HA   1 
ATOM   3495 H  HB2  . GLN C 3 16  ? 31.629  38.463 -4.265 1.000 40.794 ? 16  GLN LLL HB2  1 
ATOM   3496 H  HB3  . GLN C 3 16  ? 33.108  38.263 -3.736 1.000 40.918 ? 16  GLN LLL HB3  1 
ATOM   3497 H  HG2  . GLN C 3 16  ? 33.843  38.947 -5.977 1.000 43.511 ? 16  GLN LLL HG2  1 
ATOM   3498 H  HG3  . GLN C 3 16  ? 32.352  39.434 -6.210 1.000 43.093 ? 16  GLN LLL HG3  1 
ATOM   3499 H  HE21 . GLN C 3 16  ? 34.655  41.993 -5.041 0.000 30.000 ? 16  GLN LLL HE21 1 
ATOM   3500 H  HE22 . GLN C 3 16  ? 34.780  40.894 -6.100 0.000 30.000 ? 16  GLN LLL HE22 1 
ATOM   3501 N  N    . THR C 3 17  ? 33.249  35.594 -3.111 1.000 41.938 ? 17  THR LLL N    1 
ATOM   3502 C  CA   . THR C 3 17  ? 33.197  34.705 -1.924 1.000 40.775 ? 17  THR LLL CA   1 
ATOM   3503 C  C    . THR C 3 17  ? 33.184  35.572 -0.665 1.000 40.246 ? 17  THR LLL C    1 
ATOM   3504 O  O    . THR C 3 17  ? 34.096  36.396 -0.477 1.000 40.764 ? 17  THR LLL O    1 
ATOM   3505 C  CB   . THR C 3 17  ? 34.371  33.719 -1.902 1.000 41.361 ? 17  THR LLL CB   1 
ATOM   3506 O  OG1  . THR C 3 17  ? 34.212  32.843 -3.018 1.000 42.072 ? 17  THR LLL OG1  1 
ATOM   3507 C  CG2  . THR C 3 17  ? 34.445  32.923 -0.617 1.000 40.248 ? 17  THR LLL CG2  1 
ATOM   3508 H  H    . THR C 3 17  ? 34.057  36.009 -3.188 1.000 42.340 ? 17  THR LLL H    1 
ATOM   3509 H  HA   . THR C 3 17  ? 32.359  34.192 -1.963 1.000 40.462 ? 17  THR LLL HA   1 
ATOM   3510 H  HB   . THR C 3 17  ? 35.208  34.230 -2.011 1.000 41.975 ? 17  THR LLL HB   1 
ATOM   3511 H  HG1  . THR C 3 17  ? 34.786  32.331 -2.969 0.000 30.000 ? 17  THR LLL HG1  1 
ATOM   3512 H  HG21 . THR C 3 17  ? 34.936  33.430 0.054  1.000 39.999 ? 17  THR LLL HG21 1 
ATOM   3513 H  HG22 . THR C 3 17  ? 34.903  32.080 -0.782 1.000 40.486 ? 17  THR LLL HG22 1 
ATOM   3514 H  HG23 . THR C 3 17  ? 33.545  32.742 -0.291 1.000 39.475 ? 17  THR LLL HG23 1 
ATOM   3515 N  N    . VAL C 3 18  ? 32.169  35.383 0.165  1.000 39.773 ? 18  VAL LLL N    1 
ATOM   3516 C  CA   . VAL C 3 18  ? 32.047  36.049 1.486  1.000 39.041 ? 18  VAL LLL CA   1 
ATOM   3517 C  C    . VAL C 3 18  ? 31.939  34.933 2.523  1.000 37.743 ? 18  VAL LLL C    1 
ATOM   3518 O  O    . VAL C 3 18  ? 31.503  33.842 2.154  1.000 38.063 ? 18  VAL LLL O    1 
ATOM   3519 C  CB   . VAL C 3 18  ? 30.836  37.000 1.491  1.000 39.273 ? 18  VAL LLL CB   1 
ATOM   3520 C  CG1  . VAL C 3 18  ? 29.699  36.479 2.354  1.000 38.481 ? 18  VAL LLL CG1  1 
ATOM   3521 C  CG2  . VAL C 3 18  ? 31.232  38.405 1.917  1.000 39.704 ? 18  VAL LLL CG2  1 
ATOM   3522 H  H    . VAL C 3 18  ? 31.472  34.828 -0.027 1.000 39.460 ? 18  VAL LLL H    1 
ATOM   3523 H  HA   . VAL C 3 18  ? 32.856  36.562 1.659  1.000 39.348 ? 18  VAL LLL HA   1 
ATOM   3524 H  HB   . VAL C 3 18  ? 30.503  37.055 0.561  1.000 39.890 ? 18  VAL LLL HB   1 
ATOM   3525 H  HG11 . VAL C 3 18  ? 29.408  35.610 2.024  1.000 38.446 ? 18  VAL LLL HG11 1 
ATOM   3526 H  HG12 . VAL C 3 18  ? 28.955  37.102 2.315  1.000 38.262 ? 18  VAL LLL HG12 1 
ATOM   3527 H  HG13 . VAL C 3 18  ? 29.998  36.394 3.276  1.000 37.858 ? 18  VAL LLL HG13 1 
ATOM   3528 H  HG21 . VAL C 3 18  ? 31.619  38.378 2.809  1.000 39.113 ? 18  VAL LLL HG21 1 
ATOM   3529 H  HG22 . VAL C 3 18  ? 30.445  38.976 1.921  1.000 39.342 ? 18  VAL LLL HG22 1 
ATOM   3530 H  HG23 . VAL C 3 18  ? 31.887  38.762 1.291  1.000 40.392 ? 18  VAL LLL HG23 1 
ATOM   3531 N  N    . SER C 3 19  ? 32.358  35.190 3.757  1.000 37.249 ? 19  SER LLL N    1 
ATOM   3532 C  CA   . SER C 3 19  ? 32.184  34.268 4.903  1.000 36.637 ? 19  SER LLL CA   1 
ATOM   3533 C  C    . SER C 3 19  ? 31.608  35.038 6.091  1.000 36.206 ? 19  SER LLL C    1 
ATOM   3534 O  O    . SER C 3 19  ? 32.132  36.111 6.420  1.000 36.869 ? 19  SER LLL O    1 
ATOM   3535 C  CB   . SER C 3 19  ? 33.460  33.570 5.248  1.000 36.564 ? 19  SER LLL CB   1 
ATOM   3536 O  OG   . SER C 3 19  ? 34.560  34.305 4.757  1.000 38.380 ? 19  SER LLL OG   1 
ATOM   3537 H  H    . SER C 3 19  ? 32.790  35.958 3.989  1.000 37.435 ? 19  SER LLL H    1 
ATOM   3538 H  HA   . SER C 3 19  ? 31.521  33.580 4.635  1.000 36.408 ? 19  SER LLL HA   1 
ATOM   3539 H  HB2  . SER C 3 19  ? 33.534  33.477 6.226  1.000 36.390 ? 19  SER LLL HB2  1 
ATOM   3540 H  HB3  . SER C 3 19  ? 33.460  32.672 4.852  1.000 36.982 ? 19  SER LLL HB3  1 
ATOM   3541 H  HG   . SER C 3 19  ? 35.033  33.490 4.928  0.000 30.000 ? 19  SER LLL HG   1 
ATOM   3542 N  N    . ILE C 3 20  ? 30.532  34.501 6.661  1.000 35.915 ? 20  ILE LLL N    1 
ATOM   3543 C  CA   . ILE C 3 20  ? 29.880  34.970 7.911  1.000 35.876 ? 20  ILE LLL CA   1 
ATOM   3544 C  C    . ILE C 3 20  ? 30.542  34.227 9.068  1.000 36.462 ? 20  ILE LLL C    1 
ATOM   3545 O  O    . ILE C 3 20  ? 30.716  33.009 8.956  1.000 37.117 ? 20  ILE LLL O    1 
ATOM   3546 C  CB   . ILE C 3 20  ? 28.367  34.708 7.842  1.000 35.484 ? 20  ILE LLL CB   1 
ATOM   3547 C  CG1  . ILE C 3 20  ? 27.767  35.366 6.595  1.000 35.840 ? 20  ILE LLL CG1  1 
ATOM   3548 C  CG2  . ILE C 3 20  ? 27.678  35.147 9.128  1.000 34.833 ? 20  ILE LLL CG2  1 
ATOM   3549 C  CD1  . ILE C 3 20  ? 26.294  35.142 6.427  1.000 35.744 ? 20  ILE LLL CD1  1 
ATOM   3550 H  H    . ILE C 3 20  ? 30.118  33.771 6.306  1.000 35.951 ? 20  ILE LLL H    1 
ATOM   3551 H  HA   . ILE C 3 20  ? 30.034  35.926 8.012  1.000 36.004 ? 20  ILE LLL HA   1 
ATOM   3552 H  HB   . ILE C 3 20  ? 28.238  33.731 7.752  1.000 35.412 ? 20  ILE LLL HB   1 
ATOM   3553 H  HG12 . ILE C 3 20  ? 27.935  36.331 6.639  1.000 35.964 ? 20  ILE LLL HG12 1 
ATOM   3554 H  HG13 . ILE C 3 20  ? 28.227  35.017 5.803  1.000 36.338 ? 20  ILE LLL HG13 1 
ATOM   3555 H  HG21 . ILE C 3 20  ? 28.035  34.644 9.880  1.000 34.679 ? 20  ILE LLL HG21 1 
ATOM   3556 H  HG22 . ILE C 3 20  ? 26.722  34.984 9.059  1.000 34.724 ? 20  ILE LLL HG22 1 
ATOM   3557 H  HG23 . ILE C 3 20  ? 27.834  36.097 9.273  1.000 34.899 ? 20  ILE LLL HG23 1 
ATOM   3558 H  HD11 . ILE C 3 20  ? 26.074  34.225 6.666  1.000 35.545 ? 20  ILE LLL HD11 1 
ATOM   3559 H  HD12 . ILE C 3 20  ? 26.043  35.303 5.501  1.000 36.159 ? 20  ILE LLL HD12 1 
ATOM   3560 H  HD13 . ILE C 3 20  ? 25.803  35.753 7.004  1.000 35.430 ? 20  ILE LLL HD13 1 
ATOM   3561 N  N    . SER C 3 21  ? 30.918  34.945 10.122 1.000 37.684 ? 21  SER LLL N    1 
ATOM   3562 C  CA   . SER C 3 21  ? 31.605  34.382 11.307 1.000 38.000 ? 21  SER LLL CA   1 
ATOM   3563 C  C    . SER C 3 21  ? 30.782  34.642 12.562 1.000 37.850 ? 21  SER LLL C    1 
ATOM   3564 O  O    . SER C 3 21  ? 29.936  35.560 12.562 1.000 36.898 ? 21  SER LLL O    1 
ATOM   3565 C  CB   . SER C 3 21  ? 32.994  34.916 11.439 1.000 38.949 ? 21  SER LLL CB   1 
ATOM   3566 O  OG   . SER C 3 21  ? 33.897  34.072 10.744 1.000 39.890 ? 21  SER LLL OG   1 
ATOM   3567 H  H    . SER C 3 21  ? 30.778  35.843 10.195 1.000 37.457 ? 21  SER LLL H    1 
ATOM   3568 H  HA   . SER C 3 21  ? 31.664  33.396 11.185 1.000 38.030 ? 21  SER LLL HA   1 
ATOM   3569 H  HB2  . SER C 3 21  ? 33.035  35.826 11.066 1.000 39.169 ? 21  SER LLL HB2  1 
ATOM   3570 H  HB3  . SER C 3 21  ? 33.246  34.959 12.390 1.000 38.918 ? 21  SER LLL HB3  1 
ATOM   3571 H  HG   . SER C 3 21  ? 34.473  34.283 10.808 0.000 30.000 ? 21  SER LLL HG   1 
ATOM   3572 N  N    . CYS C 3 22  ? 31.098  33.866 13.593 1.000 38.984 ? 22  CYS LLL N    1 
ATOM   3573 C  CA   . CYS C 3 22  ? 30.272  33.610 14.794 1.000 39.566 ? 22  CYS LLL CA   1 
ATOM   3574 C  C    . CYS C 3 22  ? 31.208  33.178 15.925 1.000 39.525 ? 22  CYS LLL C    1 
ATOM   3575 O  O    . CYS C 3 22  ? 31.457  31.967 16.046 1.000 40.433 ? 22  CYS LLL O    1 
ATOM   3576 C  CB   . CYS C 3 22  ? 29.245  32.538 14.453 1.000 40.719 ? 22  CYS LLL CB   1 
ATOM   3577 S  SG   . CYS C 3 22  ? 28.311  31.886 15.860 1.000 42.450 ? 22  CYS LLL SG   1 
ATOM   3578 H  H    . CYS C 3 22  ? 31.888  33.411 13.627 1.000 39.159 ? 22  CYS LLL H    1 
ATOM   3579 H  HA   . CYS C 3 22  ? 29.808  34.438 15.043 1.000 39.492 ? 22  CYS LLL HA   1 
ATOM   3580 H  HB2  . CYS C 3 22  ? 28.608  32.908 13.809 1.000 40.695 ? 22  CYS LLL HB2  1 
ATOM   3581 H  HB3  . CYS C 3 22  ? 29.704  31.790 14.018 1.000 40.917 ? 22  CYS LLL HB3  1 
ATOM   3582 N  N    . THR C 3 23  ? 31.763  34.134 16.673 1.000 39.051 ? 23  THR LLL N    1 
ATOM   3583 C  CA   . THR C 3 23  ? 32.736  33.856 17.761 1.000 39.322 ? 23  THR LLL CA   1 
ATOM   3584 C  C    . THR C 3 23  ? 31.978  33.356 18.995 1.000 38.729 ? 23  THR LLL C    1 
ATOM   3585 O  O    . THR C 3 23  ? 31.020  34.028 19.418 1.000 37.434 ? 23  THR LLL O    1 
ATOM   3586 C  CB   . THR C 3 23  ? 33.614  35.072 18.076 1.000 39.867 ? 23  THR LLL CB   1 
ATOM   3587 O  OG1  . THR C 3 23  ? 34.303  35.423 16.879 1.000 40.296 ? 23  THR LLL OG1  1 
ATOM   3588 C  CG2  . THR C 3 23  ? 34.629  34.802 19.165 1.000 40.412 ? 23  THR LLL CG2  1 
ATOM   3589 H  H    . THR C 3 23  ? 31.586  35.022 16.573 1.000 39.166 ? 23  THR LLL H    1 
ATOM   3590 H  HA   . THR C 3 23  ? 33.325  33.131 17.451 1.000 39.446 ? 23  THR LLL HA   1 
ATOM   3591 H  HB   . THR C 3 23  ? 33.033  35.821 18.351 1.000 39.716 ? 23  THR LLL HB   1 
ATOM   3592 H  HG1  . THR C 3 23  ? 34.936  35.985 17.111 0.000 30.000 ? 23  THR LLL HG1  1 
ATOM   3593 H  HG21 . THR C 3 23  ? 34.199  34.873 20.036 1.000 40.440 ? 23  THR LLL HG21 1 
ATOM   3594 H  HG22 . THR C 3 23  ? 35.351  35.453 19.106 1.000 40.893 ? 23  THR LLL HG22 1 
ATOM   3595 H  HG23 . THR C 3 23  ? 34.993  33.905 19.056 1.000 40.547 ? 23  THR LLL HG23 1 
ATOM   3596 N  N    . ALA C 3 24  ? 32.397  32.204 19.523 1.000 39.055 ? 24  ALA LLL N    1 
ATOM   3597 C  CA   . ALA C 3 24  ? 31.892  31.609 20.779 1.000 39.118 ? 24  ALA LLL CA   1 
ATOM   3598 C  C    . ALA C 3 24  ? 32.569  32.312 21.956 1.000 39.218 ? 24  ALA LLL C    1 
ATOM   3599 O  O    . ALA C 3 24  ? 33.787  32.523 21.897 1.000 38.904 ? 24  ALA LLL O    1 
ATOM   3600 C  CB   . ALA C 3 24  ? 32.154  30.124 20.793 1.000 39.830 ? 24  ALA LLL CB   1 
ATOM   3601 H  H    . ALA C 3 24  ? 33.044  31.692 19.137 1.000 39.164 ? 24  ALA LLL H    1 
ATOM   3602 H  HA   . ALA C 3 24  ? 30.920  31.765 20.833 1.000 38.863 ? 24  ALA LLL HA   1 
ATOM   3603 H  HB1  . ALA C 3 24  ? 31.915  29.760 21.662 1.000 39.844 ? 24  ALA LLL HB1  1 
ATOM   3604 H  HB2  . ALA C 3 24  ? 31.618  29.693 20.106 1.000 39.249 ? 24  ALA LLL HB2  1 
ATOM   3605 H  HB3  . ALA C 3 24  ? 33.096  29.956 20.622 1.000 39.915 ? 24  ALA LLL HB3  1 
ATOM   3606 N  N    . ASN C 3 25  ? 31.791  32.639 22.984 1.000 39.890 ? 25  ASN LLL N    1 
ATOM   3607 C  CA   . ASN C 3 25  ? 32.222  33.447 24.151 1.000 41.025 ? 25  ASN LLL CA   1 
ATOM   3608 C  C    . ASN C 3 25  ? 31.735  32.768 25.438 1.000 41.148 ? 25  ASN LLL C    1 
ATOM   3609 O  O    . ASN C 3 25  ? 30.521  32.681 25.629 1.000 41.538 ? 25  ASN LLL O    1 
ATOM   3610 C  CB   . ASN C 3 25  ? 31.693  34.871 24.007 1.000 41.951 ? 25  ASN LLL CB   1 
ATOM   3611 C  CG   . ASN C 3 25  ? 32.540  35.887 24.736 1.000 43.893 ? 25  ASN LLL CG   1 
ATOM   3612 O  OD1  . ASN C 3 25  ? 32.913  35.681 25.890 1.000 46.221 ? 25  ASN LLL OD1  1 
ATOM   3613 N  ND2  . ASN C 3 25  ? 32.842  36.985 24.065 1.000 44.157 ? 25  ASN LLL ND2  1 
ATOM   3614 H  H    . ASN C 3 25  ? 30.919  32.379 23.032 1.000 39.600 ? 25  ASN LLL H    1 
ATOM   3615 H  HA   . ASN C 3 25  ? 33.207  33.486 24.163 1.000 41.484 ? 25  ASN LLL HA   1 
ATOM   3616 H  HB2  . ASN C 3 25  ? 31.664  35.103 23.056 1.000 41.543 ? 25  ASN LLL HB2  1 
ATOM   3617 H  HB3  . ASN C 3 25  ? 30.779  34.909 24.355 1.000 41.811 ? 25  ASN LLL HB3  1 
ATOM   3618 H  HD21 . ASN C 3 25  ? 33.288  37.576 24.096 0.000 30.000 ? 25  ASN LLL HD21 1 
ATOM   3619 H  HD22 . ASN C 3 25  ? 32.451  36.931 22.989 0.000 30.000 ? 25  ASN LLL HD22 1 
ATOM   3620 N  N    . GLY C 3 26  ? 32.653  32.280 26.272 1.000 41.815 ? 26  GLY LLL N    1 
ATOM   3621 C  CA   . GLY C 3 26  ? 32.342  31.625 27.559 1.000 42.225 ? 26  GLY LLL CA   1 
ATOM   3622 C  C    . GLY C 3 26  ? 32.167  30.119 27.438 1.000 41.702 ? 26  GLY LLL C    1 
ATOM   3623 O  O    . GLY C 3 26  ? 31.557  29.537 28.359 1.000 42.859 ? 26  GLY LLL O    1 
ATOM   3624 H  H    . GLY C 3 26  ? 33.544  32.323 26.087 1.000 42.032 ? 26  GLY LLL H    1 
ATOM   3625 H  HA2  . GLY C 3 26  ? 33.076  31.815 28.196 1.000 42.913 ? 26  GLY LLL HA2  1 
ATOM   3626 H  HA3  . GLY C 3 26  ? 31.515  32.020 27.927 1.000 42.186 ? 26  GLY LLL HA3  1 
ATOM   3627 N  N    . ALA C 3 27  ? 32.681  29.511 26.358 1.000 40.518 ? 27  ALA LLL N    1 
ATOM   3628 C  CA   . ALA C 3 27  ? 32.724  28.047 26.108 1.000 39.394 ? 27  ALA LLL CA   1 
ATOM   3629 C  C    . ALA C 3 27  ? 33.580  27.767 24.865 1.000 38.388 ? 27  ALA LLL C    1 
ATOM   3630 O  O    . ALA C 3 27  ? 33.667  28.666 24.000 1.000 37.472 ? 27  ALA LLL O    1 
ATOM   3631 C  CB   . ALA C 3 27  ? 31.329  27.492 25.941 1.000 38.530 ? 27  ALA LLL CB   1 
ATOM   3632 H  H    . ALA C 3 27  ? 33.057  29.979 25.673 1.000 40.167 ? 27  ALA LLL H    1 
ATOM   3633 H  HA   . ALA C 3 27  ? 33.149  27.610 26.883 1.000 39.997 ? 27  ALA LLL HA   1 
ATOM   3634 H  HB1  . ALA C 3 27  ? 31.370  26.523 25.886 1.000 38.670 ? 27  ALA LLL HB1  1 
ATOM   3635 H  HB2  . ALA C 3 27  ? 30.781  27.749 26.700 1.000 38.986 ? 27  ALA LLL HB2  1 
ATOM   3636 H  HB3  . ALA C 3 27  ? 30.936  27.843 25.126 1.000 38.072 ? 27  ALA LLL HB3  1 
ATOM   3637 N  N    . HIS C 3 28  ? 34.191  26.580 24.789 1.000 38.160 ? 28  HIS LLL N    1 
ATOM   3638 C  CA   . HIS C 3 28  ? 35.005  26.120 23.630 1.000 38.461 ? 28  HIS LLL CA   1 
ATOM   3639 C  C    . HIS C 3 28  ? 34.052  25.775 22.478 1.000 38.168 ? 28  HIS LLL C    1 
ATOM   3640 O  O    . HIS C 3 28  ? 33.049  25.069 22.729 1.000 38.017 ? 28  HIS LLL O    1 
ATOM   3641 C  CB   . HIS C 3 28  ? 35.905  24.939 24.031 1.000 39.037 ? 28  HIS LLL CB   1 
ATOM   3642 C  CG   . HIS C 3 28  ? 36.984  24.595 23.056 1.000 39.105 ? 28  HIS LLL CG   1 
ATOM   3643 N  ND1  . HIS C 3 28  ? 36.772  24.539 21.693 1.000 38.274 ? 28  HIS LLL ND1  1 
ATOM   3644 C  CD2  . HIS C 3 28  ? 38.275  24.239 23.247 1.000 40.066 ? 28  HIS LLL CD2  1 
ATOM   3645 C  CE1  . HIS C 3 28  ? 37.887  24.183 21.086 1.000 38.468 ? 28  HIS LLL CE1  1 
ATOM   3646 N  NE2  . HIS C 3 28  ? 38.824  23.984 22.017 1.000 39.404 ? 28  HIS LLL NE2  1 
ATOM   3647 H  H    . HIS C 3 28  ? 34.148  25.958 25.454 1.000 38.756 ? 28  HIS LLL H    1 
ATOM   3648 H  HA   . HIS C 3 28  ? 35.578  26.869 23.345 1.000 38.603 ? 28  HIS LLL HA   1 
ATOM   3649 H  HB2  . HIS C 3 28  ? 36.321  25.144 24.898 1.000 39.694 ? 28  HIS LLL HB2  1 
ATOM   3650 H  HB3  . HIS C 3 28  ? 35.337  24.147 24.158 1.000 38.867 ? 28  HIS LLL HB3  1 
ATOM   3651 H  HD1  . HIS C 3 28  ? 36.020  24.780 21.236 0.000 30.000 ? 28  HIS LLL HD1  1 
ATOM   3652 H  HD2  . HIS C 3 28  ? 38.719  24.172 24.072 1.000 40.561 ? 28  HIS LLL HD2  1 
ATOM   3653 H  HE1  . HIS C 3 28  ? 38.001  24.085 20.157 1.000 38.316 ? 28  HIS LLL HE1  1 
ATOM   3654 H  HE2  . HIS C 3 28  ? 39.617  23.610 21.753 0.000 30.000 ? 28  HIS LLL HE2  1 
ATOM   3655 N  N    . ILE C 3 29  ? 34.355  26.268 21.272 1.000 38.189 ? 29  ILE LLL N    1 
ATOM   3656 C  CA   . ILE C 3 29  ? 33.493  26.166 20.051 1.000 37.354 ? 29  ILE LLL CA   1 
ATOM   3657 C  C    . ILE C 3 29  ? 33.364  24.696 19.628 1.000 36.436 ? 29  ILE LLL C    1 
ATOM   3658 O  O    . ILE C 3 29  ? 32.333  24.354 19.027 1.000 36.358 ? 29  ILE LLL O    1 
ATOM   3659 C  CB   . ILE C 3 29  ? 34.043  27.056 18.914 1.000 37.641 ? 29  ILE LLL CB   1 
ATOM   3660 C  CG1  . ILE C 3 29  ? 33.111  27.099 17.697 1.000 36.973 ? 29  ILE LLL CG1  1 
ATOM   3661 C  CG2  . ILE C 3 29  ? 35.451  26.634 18.518 1.000 38.434 ? 29  ILE LLL CG2  1 
ATOM   3662 C  CD1  . ILE C 3 29  ? 31.865  27.925 17.902 1.000 36.600 ? 29  ILE LLL CD1  1 
ATOM   3663 H  H    . ILE C 3 29  ? 35.125  26.727 21.126 1.000 38.361 ? 29  ILE LLL H    1 
ATOM   3664 H  HA   . ILE C 3 29  ? 32.606  26.491 20.285 1.000 37.065 ? 29  ILE LLL HA   1 
ATOM   3665 H  HB   . ILE C 3 29  ? 34.101  27.977 19.268 1.000 37.731 ? 29  ILE LLL HB   1 
ATOM   3666 H  HG12 . ILE C 3 29  ? 33.609  27.468 16.937 1.000 37.086 ? 29  ILE LLL HG12 1 
ATOM   3667 H  HG13 . ILE C 3 29  ? 32.848  26.185 17.464 1.000 36.865 ? 29  ILE LLL HG13 1 
ATOM   3668 H  HG21 . ILE C 3 29  ? 36.040  26.679 19.290 1.000 38.802 ? 29  ILE LLL HG21 1 
ATOM   3669 H  HG22 . ILE C 3 29  ? 35.786  27.231 17.826 1.000 38.413 ? 29  ILE LLL HG22 1 
ATOM   3670 H  HG23 . ILE C 3 29  ? 35.437  25.724 18.176 1.000 38.259 ? 29  ILE LLL HG23 1 
ATOM   3671 H  HD11 . ILE C 3 29  ? 31.416  27.645 18.718 1.000 36.629 ? 29  ILE LLL HD11 1 
ATOM   3672 H  HD12 . ILE C 3 29  ? 31.265  27.801 17.146 1.000 36.318 ? 29  ILE LLL HD12 1 
ATOM   3673 H  HD13 . ILE C 3 29  ? 32.105  28.865 17.971 1.000 36.703 ? 29  ILE LLL HD13 1 
ATOM   3674 N  N    . GLY C 3 30  ? 34.366  23.867 19.930 1.000 36.301 ? 30  GLY LLL N    1 
ATOM   3675 C  CA   . GLY C 3 30  ? 34.437  22.453 19.509 1.000 36.048 ? 30  GLY LLL CA   1 
ATOM   3676 C  C    . GLY C 3 30  ? 33.817  21.501 20.520 1.000 35.601 ? 30  GLY LLL C    1 
ATOM   3677 O  O    . GLY C 3 30  ? 33.755  20.297 20.227 1.000 35.411 ? 30  GLY LLL O    1 
ATOM   3678 H  H    . GLY C 3 30  ? 35.085  24.138 20.406 1.000 36.830 ? 30  GLY LLL H    1 
ATOM   3679 H  HA2  . GLY C 3 30  ? 33.972  22.353 18.641 1.000 35.593 ? 30  GLY LLL HA2  1 
ATOM   3680 H  HA3  . GLY C 3 30  ? 35.386  22.209 19.373 1.000 36.306 ? 30  GLY LLL HA3  1 
ATOM   3681 N  N    . ASP C 3 31  ? 33.379  22.010 21.672 1.000 35.793 ? 31  ASP LLL N    1 
ATOM   3682 C  CA   . ASP C 3 31  ? 32.756  21.202 22.756 1.000 36.077 ? 31  ASP LLL CA   1 
ATOM   3683 C  C    . ASP C 3 31  ? 31.370  20.739 22.299 1.000 36.040 ? 31  ASP LLL C    1 
ATOM   3684 O  O    . ASP C 3 31  ? 30.865  19.734 22.843 1.000 36.733 ? 31  ASP LLL O    1 
ATOM   3685 C  CB   . ASP C 3 31  ? 32.651  22.003 24.057 1.000 36.031 ? 31  ASP LLL CB   1 
ATOM   3686 C  CG   . ASP C 3 31  ? 32.352  21.168 25.292 1.000 35.903 ? 31  ASP LLL CG   1 
ATOM   3687 O  OD1  . ASP C 3 31  ? 32.722  19.970 25.306 1.000 35.278 ? 31  ASP LLL OD1  1 
ATOM   3688 O  OD2  . ASP C 3 31  ? 31.753  21.729 26.236 1.000 35.693 ? 31  ASP LLL OD2  1 
ATOM   3689 H  H    . ASP C 3 31  ? 33.436  22.897 21.870 1.000 35.860 ? 31  ASP LLL H    1 
ATOM   3690 H  HA   . ASP C 3 31  ? 33.319  20.410 22.915 1.000 36.330 ? 31  ASP LLL HA   1 
ATOM   3691 H  HB2  . ASP C 3 31  ? 33.493  22.478 24.202 1.000 36.278 ? 31  ASP LLL HB2  1 
ATOM   3692 H  HB3  . ASP C 3 31  ? 31.940  22.669 23.961 1.000 35.714 ? 31  ASP LLL HB3  1 
ATOM   3693 N  N    . SER C 3 32  ? 30.791  21.449 21.330 1.000 35.796 ? 32  SER LLL N    1 
ATOM   3694 C  CA   . SER C 3 32  ? 29.391  21.286 20.875 1.000 35.888 ? 32  SER LLL CA   1 
ATOM   3695 C  C    . SER C 3 32  ? 29.303  21.583 19.381 1.000 35.694 ? 32  SER LLL C    1 
ATOM   3696 O  O    . SER C 3 32  ? 30.125  22.367 18.893 1.000 37.401 ? 32  SER LLL O    1 
ATOM   3697 C  CB   . SER C 3 32  ? 28.496  22.183 21.681 1.000 36.344 ? 32  SER LLL CB   1 
ATOM   3698 O  OG   . SER C 3 32  ? 27.237  22.339 21.054 1.000 36.635 ? 32  SER LLL OG   1 
ATOM   3699 H  H    . SER C 3 32  ? 31.217  22.115 20.880 1.000 35.693 ? 32  SER LLL H    1 
ATOM   3700 H  HA   . SER C 3 32  ? 29.121  20.342 21.026 1.000 36.039 ? 32  SER LLL HA   1 
ATOM   3701 H  HB2  . SER C 3 32  ? 28.370  21.798 22.578 1.000 36.820 ? 32  SER LLL HB2  1 
ATOM   3702 H  HB3  . SER C 3 32  ? 28.923  23.064 21.783 1.000 36.402 ? 32  SER LLL HB3  1 
ATOM   3703 H  HG   . SER C 3 32  ? 26.918  22.892 21.577 0.000 30.000 ? 32  SER LLL HG   1 
ATOM   3704 N  N    . TYR C 3 33  ? 28.326  20.992 18.695 1.000 35.986 ? 33  TYR LLL N    1 
ATOM   3705 C  CA   . TYR C 3 33  ? 28.085  21.151 17.233 1.000 35.646 ? 33  TYR LLL CA   1 
ATOM   3706 C  C    . TYR C 3 33  ? 27.588  22.567 16.906 1.000 34.245 ? 33  TYR LLL C    1 
ATOM   3707 O  O    . TYR C 3 33  ? 26.988  23.235 17.771 1.000 34.007 ? 33  TYR LLL O    1 
ATOM   3708 C  CB   . TYR C 3 33  ? 27.077  20.104 16.756 1.000 36.590 ? 33  TYR LLL CB   1 
ATOM   3709 C  CG   . TYR C 3 33  ? 27.556  18.688 16.929 1.000 37.804 ? 33  TYR LLL CG   1 
ATOM   3710 C  CD1  . TYR C 3 33  ? 28.786  18.291 16.428 1.000 38.741 ? 33  TYR LLL CD1  1 
ATOM   3711 C  CD2  . TYR C 3 33  ? 26.794  17.747 17.595 1.000 39.118 ? 33  TYR LLL CD2  1 
ATOM   3712 C  CE1  . TYR C 3 33  ? 29.244  16.994 16.577 1.000 39.385 ? 33  TYR LLL CE1  1 
ATOM   3713 C  CE2  . TYR C 3 33  ? 27.239  16.444 17.752 1.000 39.802 ? 33  TYR LLL CE2  1 
ATOM   3714 C  CZ   . TYR C 3 33  ? 28.469  16.066 17.245 1.000 39.569 ? 33  TYR LLL CZ   1 
ATOM   3715 O  OH   . TYR C 3 33  ? 28.917  14.786 17.398 1.000 40.270 ? 33  TYR LLL OH   1 
ATOM   3716 H  H    . TYR C 3 33  ? 27.716  20.442 19.088 1.000 36.017 ? 33  TYR LLL H    1 
ATOM   3717 H  HA   . TYR C 3 33  ? 28.941  21.007 16.757 1.000 35.590 ? 33  TYR LLL HA   1 
ATOM   3718 H  HB2  . TYR C 3 33  ? 26.242  20.223 17.255 1.000 36.721 ? 33  TYR LLL HB2  1 
ATOM   3719 H  HB3  . TYR C 3 33  ? 26.886  20.263 15.808 1.000 36.488 ? 33  TYR LLL HB3  1 
ATOM   3720 H  HD1  . TYR C 3 33  ? 29.323  18.917 15.973 1.000 38.546 ? 33  TYR LLL HD1  1 
ATOM   3721 H  HD2  . TYR C 3 33  ? 25.952  17.993 17.943 1.000 39.097 ? 33  TYR LLL HD2  1 
ATOM   3722 H  HE1  . TYR C 3 33  ? 30.085  16.744 16.230 1.000 39.281 ? 33  TYR LLL HE1  1 
ATOM   3723 H  HE2  . TYR C 3 33  ? 26.705  15.814 18.200 1.000 39.862 ? 33  TYR LLL HE2  1 
ATOM   3724 H  HH   . TYR C 3 33  ? 29.655  14.799 17.948 0.000 30.000 ? 33  TYR LLL HH   1 
ATOM   3725 N  N    . VAL C 3 34  ? 27.812  23.003 15.666 1.000 32.711 ? 34  VAL LLL N    1 
ATOM   3726 C  CA   . VAL C 3 34  ? 27.339  24.321 15.156 1.000 32.039 ? 34  VAL LLL CA   1 
ATOM   3727 C  C    . VAL C 3 34  ? 26.452  24.079 13.931 1.000 31.000 ? 34  VAL LLL C    1 
ATOM   3728 O  O    . VAL C 3 34  ? 26.849  23.301 13.054 1.000 30.653 ? 34  VAL LLL O    1 
ATOM   3729 C  CB   . VAL C 3 34  ? 28.517  25.273 14.858 1.000 32.675 ? 34  VAL LLL CB   1 
ATOM   3730 C  CG1  . VAL C 3 34  ? 28.052  26.632 14.336 1.000 32.380 ? 34  VAL LLL CG1  1 
ATOM   3731 C  CG2  . VAL C 3 34  ? 29.402  25.453 16.087 1.000 33.091 ? 34  VAL LLL CG2  1 
ATOM   3732 H  H    . VAL C 3 34  ? 28.271  22.516 15.048 1.000 32.943 ? 34  VAL LLL H    1 
ATOM   3733 H  HA   . VAL C 3 34  ? 26.793  24.730 15.848 1.000 32.055 ? 34  VAL LLL HA   1 
ATOM   3734 H  HB   . VAL C 3 34  ? 29.066  24.851 14.152 1.000 32.658 ? 34  VAL LLL HB   1 
ATOM   3735 H  HG11 . VAL C 3 34  ? 27.782  26.548 13.405 1.000 32.456 ? 34  VAL LLL HG11 1 
ATOM   3736 H  HG12 . VAL C 3 34  ? 28.780  27.274 14.404 1.000 32.514 ? 34  VAL LLL HG12 1 
ATOM   3737 H  HG13 . VAL C 3 34  ? 27.297  26.942 14.865 1.000 32.367 ? 34  VAL LLL HG13 1 
ATOM   3738 H  HG21 . VAL C 3 34  ? 28.858  25.740 16.841 1.000 33.009 ? 34  VAL LLL HG21 1 
ATOM   3739 H  HG22 . VAL C 3 34  ? 30.081  26.126 15.904 1.000 33.110 ? 34  VAL LLL HG22 1 
ATOM   3740 H  HG23 . VAL C 3 34  ? 29.835  24.609 16.304 1.000 33.145 ? 34  VAL LLL HG23 1 
ATOM   3741 N  N    . GLN C 3 35  ? 25.276  24.710 13.914 1.000 30.557 ? 35  GLN LLL N    1 
ATOM   3742 C  CA   . GLN C 3 35  ? 24.312  24.703 12.786 1.000 30.619 ? 35  GLN LLL CA   1 
ATOM   3743 C  C    . GLN C 3 35  ? 24.255  26.115 12.202 1.000 30.865 ? 35  GLN LLL C    1 
ATOM   3744 O  O    . GLN C 3 35  ? 24.504  27.064 12.967 1.000 31.196 ? 35  GLN LLL O    1 
ATOM   3745 C  CB   . GLN C 3 35  ? 22.932  24.262 13.275 1.000 30.497 ? 35  GLN LLL CB   1 
ATOM   3746 C  CG   . GLN C 3 35  ? 21.942  24.009 12.146 1.000 30.777 ? 35  GLN LLL CG   1 
ATOM   3747 C  CD   . GLN C 3 35  ? 20.824  23.086 12.555 1.000 31.161 ? 35  GLN LLL CD   1 
ATOM   3748 O  OE1  . GLN C 3 35  ? 20.313  22.310 11.758 1.000 32.126 ? 35  GLN LLL OE1  1 
ATOM   3749 N  NE2  . GLN C 3 35  ? 20.435  23.158 13.813 1.000 31.335 ? 35  GLN LLL NE2  1 
ATOM   3750 H  H    . GLN C 3 35  ? 24.984  25.202 14.623 1.000 30.623 ? 35  GLN LLL H    1 
ATOM   3751 H  HA   . GLN C 3 35  ? 24.630  24.079 12.096 1.000 30.733 ? 35  GLN LLL HA   1 
ATOM   3752 H  HB2  . GLN C 3 35  ? 23.037  23.442 13.803 1.000 30.626 ? 35  GLN LLL HB2  1 
ATOM   3753 H  HB3  . GLN C 3 35  ? 22.574  24.956 13.865 1.000 30.553 ? 35  GLN LLL HB3  1 
ATOM   3754 H  HG2  . GLN C 3 35  ? 21.562  24.864 11.853 1.000 30.821 ? 35  GLN LLL HG2  1 
ATOM   3755 H  HG3  . GLN C 3 35  ? 22.415  23.615 11.387 1.000 30.846 ? 35  GLN LLL HG3  1 
ATOM   3756 H  HE21 . GLN C 3 35  ? 19.834  22.667 14.104 0.000 30.000 ? 35  GLN LLL HE21 1 
ATOM   3757 H  HE22 . GLN C 3 35  ? 20.939  23.700 14.340 0.000 30.000 ? 35  GLN LLL HE22 1 
ATOM   3758 N  N    . TRP C 3 36  ? 23.946  26.244 10.910 1.000 31.214 ? 36  TRP LLL N    1 
ATOM   3759 C  CA   . TRP C 3 36  ? 23.676  27.549 10.249 1.000 31.489 ? 36  TRP LLL CA   1 
ATOM   3760 C  C    . TRP C 3 36  ? 22.265  27.532 9.657  1.000 31.645 ? 36  TRP LLL C    1 
ATOM   3761 O  O    . TRP C 3 36  ? 21.917  26.573 8.943  1.000 30.842 ? 36  TRP LLL O    1 
ATOM   3762 C  CB   . TRP C 3 36  ? 24.747  27.894 9.200  1.000 31.926 ? 36  TRP LLL CB   1 
ATOM   3763 C  CG   . TRP C 3 36  ? 26.092  28.176 9.799  1.000 31.623 ? 36  TRP LLL CG   1 
ATOM   3764 C  CD1  . TRP C 3 36  ? 27.063  27.263 10.087 1.000 31.462 ? 36  TRP LLL CD1  1 
ATOM   3765 C  CD2  . TRP C 3 36  ? 26.602  29.449 10.232 1.000 31.473 ? 36  TRP LLL CD2  1 
ATOM   3766 N  NE1  . TRP C 3 36  ? 28.145  27.877 10.651 1.000 31.320 ? 36  TRP LLL NE1  1 
ATOM   3767 C  CE2  . TRP C 3 36  ? 27.893  29.219 10.756 1.000 31.399 ? 36  TRP LLL CE2  1 
ATOM   3768 C  CE3  . TRP C 3 36  ? 26.104  30.757 10.231 1.000 31.643 ? 36  TRP LLL CE3  1 
ATOM   3769 C  CZ2  . TRP C 3 36  ? 28.687  30.248 11.263 1.000 31.379 ? 36  TRP LLL CZ2  1 
ATOM   3770 C  CZ3  . TRP C 3 36  ? 26.891  31.773 10.731 1.000 31.491 ? 36  TRP LLL CZ3  1 
ATOM   3771 C  CH2  . TRP C 3 36  ? 28.164  31.521 11.241 1.000 31.337 ? 36  TRP LLL CH2  1 
ATOM   3772 H  H    . TRP C 3 36  ? 23.881  25.533 10.344 1.000 31.415 ? 36  TRP LLL H    1 
ATOM   3773 H  HA   . TRP C 3 36  ? 23.712  28.243 10.944 1.000 31.283 ? 36  TRP LLL HA   1 
ATOM   3774 H  HB2  . TRP C 3 36  ? 24.822  27.145 8.575  1.000 32.064 ? 36  TRP LLL HB2  1 
ATOM   3775 H  HB3  . TRP C 3 36  ? 24.447  28.678 8.698  1.000 31.978 ? 36  TRP LLL HB3  1 
ATOM   3776 H  HD1  . TRP C 3 36  ? 27.006  26.336 9.914  1.000 31.568 ? 36  TRP LLL HD1  1 
ATOM   3777 H  HE1  . TRP C 3 36  ? 28.883  27.475 10.903 1.000 31.461 ? 36  TRP LLL HE1  1 
ATOM   3778 H  HE3  . TRP C 3 36  ? 25.243  30.939 9.889  1.000 31.604 ? 36  TRP LLL HE3  1 
ATOM   3779 H  HZ2  . TRP C 3 36  ? 29.549  30.076 11.604 1.000 31.519 ? 36  TRP LLL HZ2  1 
ATOM   3780 H  HZ3  . TRP C 3 36  ? 26.561  32.658 10.730 1.000 31.425 ? 36  TRP LLL HZ3  1 
ATOM   3781 H  HH2  . TRP C 3 36  ? 28.678  32.235 11.573 1.000 31.458 ? 36  TRP LLL HH2  1 
ATOM   3782 N  N    . PHE C 3 37  ? 21.490  28.570 9.964  1.000 32.303 ? 37  PHE LLL N    1 
ATOM   3783 C  CA   . PHE C 3 37  ? 20.115  28.782 9.452  1.000 33.451 ? 37  PHE LLL CA   1 
ATOM   3784 C  C    . PHE C 3 37  ? 20.108  29.979 8.502  1.000 34.171 ? 37  PHE LLL C    1 
ATOM   3785 O  O    . PHE C 3 37  ? 20.582  31.066 8.898  1.000 34.224 ? 37  PHE LLL O    1 
ATOM   3786 C  CB   . PHE C 3 37  ? 19.144  29.043 10.601 1.000 33.738 ? 37  PHE LLL CB   1 
ATOM   3787 C  CG   . PHE C 3 37  ? 19.045  27.941 11.623 1.000 33.751 ? 37  PHE LLL CG   1 
ATOM   3788 C  CD1  . PHE C 3 37  ? 18.845  26.628 11.231 1.000 34.217 ? 37  PHE LLL CD1  1 
ATOM   3789 C  CD2  . PHE C 3 37  ? 19.114  28.227 12.977 1.000 33.716 ? 37  PHE LLL CD2  1 
ATOM   3790 C  CE1  . PHE C 3 37  ? 18.729  25.618 12.172 1.000 34.522 ? 37  PHE LLL CE1  1 
ATOM   3791 C  CE2  . PHE C 3 37  ? 18.989  27.217 13.918 1.000 34.269 ? 37  PHE LLL CE2  1 
ATOM   3792 C  CZ   . PHE C 3 37  ? 18.793  25.915 13.514 1.000 34.503 ? 37  PHE LLL CZ   1 
ATOM   3793 H  H    . PHE C 3 37  ? 21.755  29.238 10.523 1.000 32.081 ? 37  PHE LLL H    1 
ATOM   3794 H  HA   . PHE C 3 37  ? 19.825  27.976 8.958  1.000 33.772 ? 37  PHE LLL HA   1 
ATOM   3795 H  HB2  . PHE C 3 37  ? 19.420  29.868 11.054 1.000 33.431 ? 37  PHE LLL HB2  1 
ATOM   3796 H  HB3  . PHE C 3 37  ? 18.254  29.198 10.221 1.000 34.049 ? 37  PHE LLL HB3  1 
ATOM   3797 H  HD1  . PHE C 3 37  ? 18.786  26.420 10.314 1.000 34.477 ? 37  PHE LLL HD1  1 
ATOM   3798 H  HD2  . PHE C 3 37  ? 19.238  29.118 13.261 1.000 33.626 ? 37  PHE LLL HD2  1 
ATOM   3799 H  HE1  . PHE C 3 37  ? 18.595  24.727 11.892 1.000 34.698 ? 37  PHE LLL HE1  1 
ATOM   3800 H  HE2  . PHE C 3 37  ? 19.045  27.422 14.838 1.000 34.099 ? 37  PHE LLL HE2  1 
ATOM   3801 H  HZ   . PHE C 3 37  ? 18.725  25.226 14.154 1.000 34.552 ? 37  PHE LLL HZ   1 
ATOM   3802 N  N    . GLN C 3 38  ? 19.587  29.771 7.292  1.000 34.678 ? 38  GLN LLL N    1 
ATOM   3803 C  CA   . GLN C 3 38  ? 19.292  30.835 6.302  1.000 35.093 ? 38  GLN LLL CA   1 
ATOM   3804 C  C    . GLN C 3 38  ? 17.806  31.176 6.414  1.000 35.142 ? 38  GLN LLL C    1 
ATOM   3805 O  O    . GLN C 3 38  ? 16.997  30.238 6.438  1.000 35.714 ? 38  GLN LLL O    1 
ATOM   3806 C  CB   . GLN C 3 38  ? 19.649  30.337 4.901  1.000 36.174 ? 38  GLN LLL CB   1 
ATOM   3807 C  CG   . GLN C 3 38  ? 19.308  31.307 3.778  1.000 36.940 ? 38  GLN LLL CG   1 
ATOM   3808 C  CD   . GLN C 3 38  ? 19.464  30.639 2.435  1.000 38.051 ? 38  GLN LLL CD   1 
ATOM   3809 O  OE1  . GLN C 3 38  ? 18.736  29.708 2.100  1.000 38.443 ? 38  GLN LLL OE1  1 
ATOM   3810 N  NE2  . GLN C 3 38  ? 20.435  31.099 1.659  1.000 38.916 ? 38  GLN LLL NE2  1 
ATOM   3811 H  H    . GLN C 3 38  ? 19.373  28.937 6.995  1.000 34.948 ? 38  GLN LLL H    1 
ATOM   3812 H  HA   . GLN C 3 38  ? 19.829  31.632 6.514  1.000 34.838 ? 38  GLN LLL HA   1 
ATOM   3813 H  HB2  . GLN C 3 38  ? 20.611  30.148 4.877  1.000 35.882 ? 38  GLN LLL HB2  1 
ATOM   3814 H  HB3  . GLN C 3 38  ? 19.177  29.492 4.745  1.000 36.367 ? 38  GLN LLL HB3  1 
ATOM   3815 H  HG2  . GLN C 3 38  ? 18.385  31.619 3.879  1.000 37.176 ? 38  GLN LLL HG2  1 
ATOM   3816 H  HG3  . GLN C 3 38  ? 19.902  32.087 3.826  1.000 36.769 ? 38  GLN LLL HG3  1 
ATOM   3817 H  HE21 . GLN C 3 38  ? 20.619  30.808 0.960  0.000 30.000 ? 38  GLN LLL HE21 1 
ATOM   3818 H  HE22 . GLN C 3 38  ? 20.950  31.827 2.053  0.000 30.000 ? 38  GLN LLL HE22 1 
ATOM   3819 N  N    . GLN C 3 39  ? 17.466  32.461 6.491  1.000 35.025 ? 39  GLN LLL N    1 
ATOM   3820 C  CA   . GLN C 3 39  ? 16.072  32.952 6.342  1.000 36.260 ? 39  GLN LLL CA   1 
ATOM   3821 C  C    . GLN C 3 39  ? 16.052  34.054 5.275  1.000 38.393 ? 39  GLN LLL C    1 
ATOM   3822 O  O    . GLN C 3 39  ? 16.691  35.107 5.502  1.000 37.731 ? 39  GLN LLL O    1 
ATOM   3823 C  CB   . GLN C 3 39  ? 15.532  33.453 7.681  1.000 35.027 ? 39  GLN LLL CB   1 
ATOM   3824 C  CG   . GLN C 3 39  ? 14.147  34.073 7.577  1.000 34.952 ? 39  GLN LLL CG   1 
ATOM   3825 C  CD   . GLN C 3 39  ? 13.512  34.304 8.924  1.000 33.990 ? 39  GLN LLL CD   1 
ATOM   3826 O  OE1  . GLN C 3 39  ? 14.108  34.888 9.819  1.000 33.496 ? 39  GLN LLL OE1  1 
ATOM   3827 N  NE2  . GLN C 3 39  ? 12.284  33.850 9.074  1.000 34.011 ? 39  GLN LLL NE2  1 
ATOM   3828 H  H    . GLN C 3 39  ? 18.075  33.122 6.645  1.000 34.898 ? 39  GLN LLL H    1 
ATOM   3829 H  HA   . GLN C 3 39  ? 15.510  32.205 6.034  1.000 36.746 ? 39  GLN LLL HA   1 
ATOM   3830 H  HB2  . GLN C 3 39  ? 15.502  32.699 8.307  1.000 34.925 ? 39  GLN LLL HB2  1 
ATOM   3831 H  HB3  . GLN C 3 39  ? 16.156  34.118 8.041  1.000 34.610 ? 39  GLN LLL HB3  1 
ATOM   3832 H  HG2  . GLN C 3 39  ? 14.211  34.930 7.106  1.000 35.006 ? 39  GLN LLL HG2  1 
ATOM   3833 H  HG3  . GLN C 3 39  ? 13.569  33.482 7.048  1.000 35.502 ? 39  GLN LLL HG3  1 
ATOM   3834 H  HE21 . GLN C 3 39  ? 11.993  34.053 9.902  0.000 30.000 ? 39  GLN LLL HE21 1 
ATOM   3835 H  HE22 . GLN C 3 39  ? 11.948  33.499 8.476  0.000 30.000 ? 39  GLN LLL HE22 1 
ATOM   3836 N  N    . ARG C 3 40  ? 15.364  33.815 4.152  1.000 41.031 ? 40  ARG LLL N    1 
ATOM   3837 C  CA   . ARG C 3 40  ? 15.126  34.835 3.093  1.000 42.847 ? 40  ARG LLL CA   1 
ATOM   3838 C  C    . ARG C 3 40  ? 13.958  35.716 3.525  1.000 43.517 ? 40  ARG LLL C    1 
ATOM   3839 O  O    . ARG C 3 40  ? 13.054  35.256 4.222  1.000 42.937 ? 40  ARG LLL O    1 
ATOM   3840 C  CB   . ARG C 3 40  ? 14.831  34.181 1.739  1.000 44.944 ? 40  ARG LLL CB   1 
ATOM   3841 C  CG   . ARG C 3 40  ? 15.814  33.087 1.352  1.000 45.773 ? 40  ARG LLL CG   1 
ATOM   3842 C  CD   . ARG C 3 40  ? 16.055  33.000 -0.142 1.000 47.843 ? 40  ARG LLL CD   1 
ATOM   3843 N  NE   . ARG C 3 40  ? 16.766  31.762 -0.427 1.000 48.690 ? 40  ARG LLL NE   1 
ATOM   3844 C  CZ   . ARG C 3 40  ? 16.216  30.643 -0.898 1.000 50.425 ? 40  ARG LLL CZ   1 
ATOM   3845 N  NH1  . ARG C 3 40  ? 14.926  30.589 -1.195 1.000 52.016 ? 40  ARG LLL NH1  1 
ATOM   3846 N  NH2  . ARG C 3 40  ? 16.971  29.574 -1.087 1.000 50.282 ? 40  ARG LLL NH2  1 
ATOM   3847 H  H    . ARG C 3 40  ? 14.988  33.005 3.972  1.000 41.227 ? 40  ARG LLL H    1 
ATOM   3848 H  HA   . ARG C 3 40  ? 15.934  35.392 3.010  1.000 42.578 ? 40  ARG LLL HA   1 
ATOM   3849 H  HB2  . ARG C 3 40  ? 13.930  33.798 1.767  1.000 45.377 ? 40  ARG LLL HB2  1 
ATOM   3850 H  HB3  . ARG C 3 40  ? 14.842  34.874 1.047  1.000 45.368 ? 40  ARG LLL HB3  1 
ATOM   3851 H  HG2  . ARG C 3 40  ? 16.670  33.251 1.801  1.000 45.124 ? 40  ARG LLL HG2  1 
ATOM   3852 H  HG3  . ARG C 3 40  ? 15.472  32.223 1.667  1.000 45.793 ? 40  ARG LLL HG3  1 
ATOM   3853 H  HD2  . ARG C 3 40  ? 15.202  33.023 -0.622 1.000 48.558 ? 40  ARG LLL HD2  1 
ATOM   3854 H  HD3  . ARG C 3 40  ? 16.594  33.764 -0.433 1.000 47.763 ? 40  ARG LLL HD3  1 
ATOM   3855 H  HE   . ARG C 3 40  ? 17.617  31.738 -0.239 1.000 48.357 ? 40  ARG LLL HE   1 
ATOM   3856 H  HH11 . ARG C 3 40  ? 14.410  31.286 -1.069 1.000 51.774 ? 40  ARG LLL HH11 1 
ATOM   3857 H  HH12 . ARG C 3 40  ? 14.582  29.843 -1.510 1.000 52.202 ? 40  ARG LLL HH12 1 
ATOM   3858 H  HH21 . ARG C 3 40  ? 17.832  29.604 -0.898 1.000 49.801 ? 40  ARG LLL HH21 1 
ATOM   3859 H  HH22 . ARG C 3 40  ? 16.616  28.836 -1.411 1.000 50.761 ? 40  ARG LLL HH22 1 
ATOM   3860 N  N    . PRO C 3 41  ? 13.916  37.002 3.109  1.000 44.702 ? 41  PRO LLL N    1 
ATOM   3861 C  CA   . PRO C 3 41  ? 12.832  37.888 3.527  1.000 45.235 ? 41  PRO LLL CA   1 
ATOM   3862 C  C    . PRO C 3 41  ? 11.503  37.265 3.075  1.000 46.805 ? 41  PRO LLL C    1 
ATOM   3863 O  O    . PRO C 3 41  ? 11.440  36.805 1.943  1.000 48.283 ? 41  PRO LLL O    1 
ATOM   3864 C  CB   . PRO C 3 41  ? 13.147  39.230 2.848  1.000 45.671 ? 41  PRO LLL CB   1 
ATOM   3865 C  CG   . PRO C 3 41  ? 14.101  38.877 1.715  1.000 46.035 ? 41  PRO LLL CG   1 
ATOM   3866 C  CD   . PRO C 3 41  ? 14.857  37.650 2.180  1.000 45.124 ? 41  PRO LLL CD   1 
ATOM   3867 H  HA   . PRO C 3 41  ? 12.849  37.997 4.511  1.000 44.733 ? 41  PRO LLL HA   1 
ATOM   3868 H  HB2  . PRO C 3 41  ? 12.330  39.646 2.497  1.000 46.251 ? 41  PRO LLL HB2  1 
ATOM   3869 H  HB3  . PRO C 3 41  ? 13.570  39.850 3.478  1.000 44.991 ? 41  PRO LLL HB3  1 
ATOM   3870 H  HG2  . PRO C 3 41  ? 13.605  38.685 0.893  1.000 46.800 ? 41  PRO LLL HG2  1 
ATOM   3871 H  HG3  . PRO C 3 41  ? 14.719  39.616 1.542  1.000 45.800 ? 41  PRO LLL HG3  1 
ATOM   3872 H  HD2  . PRO C 3 41  ? 15.070  37.065 1.430  1.000 45.597 ? 41  PRO LLL HD2  1 
ATOM   3873 H  HD3  . PRO C 3 41  ? 15.683  37.897 2.635  1.000 44.491 ? 41  PRO LLL HD3  1 
ATOM   3874 N  N    . GLY C 3 42  ? 10.517  37.198 3.977  1.000 46.697 ? 42  GLY LLL N    1 
ATOM   3875 C  CA   . GLY C 3 42  ? 9.186   36.620 3.712  1.000 47.308 ? 42  GLY LLL CA   1 
ATOM   3876 C  C    . GLY C 3 42  ? 9.072   35.187 4.201  1.000 47.276 ? 42  GLY LLL C    1 
ATOM   3877 O  O    . GLY C 3 42  ? 8.110   34.892 4.919  1.000 48.064 ? 42  GLY LLL O    1 
ATOM   3878 H  H    . GLY C 3 42  ? 10.618  37.514 4.826  1.000 46.052 ? 42  GLY LLL H    1 
ATOM   3879 H  HA2  . GLY C 3 42  ? 8.501   37.174 4.163  1.000 47.611 ? 42  GLY LLL HA2  1 
ATOM   3880 H  HA3  . GLY C 3 42  ? 9.008   36.649 2.738  1.000 48.158 ? 42  GLY LLL HA3  1 
ATOM   3881 N  N    . SER C 3 43  ? 10.015  34.315 3.837  1.000 46.938 ? 43  SER LLL N    1 
ATOM   3882 C  CA   . SER C 3 43  ? 9.928   32.847 4.079  1.000 46.814 ? 43  SER LLL CA   1 
ATOM   3883 C  C    . SER C 3 43  ? 10.423  32.486 5.490  1.000 44.212 ? 43  SER LLL C    1 
ATOM   3884 O  O    . SER C 3 43  ? 10.956  33.359 6.185  1.000 42.677 ? 43  SER LLL O    1 
ATOM   3885 C  CB   . SER C 3 43  ? 10.679  32.076 3.010  1.000 47.561 ? 43  SER LLL CB   1 
ATOM   3886 O  OG   . SER C 3 43  ? 12.074  32.346 3.074  1.000 47.050 ? 43  SER LLL OG   1 
ATOM   3887 H  H    . SER C 3 43  ? 10.784  34.554 3.413  1.000 46.572 ? 43  SER LLL H    1 
ATOM   3888 H  HA   . SER C 3 43  ? 8.968   32.590 4.021  1.000 47.461 ? 43  SER LLL HA   1 
ATOM   3889 H  HB2  . SER C 3 43  ? 10.526  31.112 3.134  1.000 47.715 ? 43  SER LLL HB2  1 
ATOM   3890 H  HB3  . SER C 3 43  ? 10.337  32.330 2.123  1.000 48.316 ? 43  SER LLL HB3  1 
ATOM   3891 H  HG   . SER C 3 43  ? 12.520  31.666 2.665  0.000 30.000 ? 43  SER LLL HG   1 
ATOM   3892 N  N    . ALA C 3 44  ? 10.241  31.225 5.886  1.000 43.063 ? 44  ALA LLL N    1 
ATOM   3893 C  CA   . ALA C 3 44  ? 10.687  30.654 7.175  1.000 41.064 ? 44  ALA LLL CA   1 
ATOM   3894 C  C    . ALA C 3 44  ? 12.135  30.201 7.038  1.000 39.290 ? 44  ALA LLL C    1 
ATOM   3895 O  O    . ALA C 3 44  ? 12.607  30.004 5.923  1.000 39.266 ? 44  ALA LLL O    1 
ATOM   3896 C  CB   . ALA C 3 44  ? 9.790   29.507 7.561  1.000 41.657 ? 44  ALA LLL CB   1 
ATOM   3897 H  H    . ALA C 3 44  ? 9.816   30.608 5.368  1.000 43.738 ? 44  ALA LLL H    1 
ATOM   3898 H  HA   . ALA C 3 44  ? 10.633  31.354 7.865  1.000 40.766 ? 44  ALA LLL HA   1 
ATOM   3899 H  HB1  . ALA C 3 44  ? 10.079  29.141 8.414  1.000 41.269 ? 44  ALA LLL HB1  1 
ATOM   3900 H  HB2  . ALA C 3 44  ? 8.874   29.823 7.638  1.000 42.351 ? 44  ALA LLL HB2  1 
ATOM   3901 H  HB3  . ALA C 3 44  ? 9.837   28.814 6.881  1.000 42.059 ? 44  ALA LLL HB3  1 
ATOM   3902 N  N    . PRO C 3 45  ? 12.884  30.028 8.152  1.000 37.865 ? 45  PRO LLL N    1 
ATOM   3903 C  CA   . PRO C 3 45  ? 14.281  29.615 8.084  1.000 37.162 ? 45  PRO LLL CA   1 
ATOM   3904 C  C    . PRO C 3 45  ? 14.406  28.117 7.785  1.000 37.672 ? 45  PRO LLL C    1 
ATOM   3905 O  O    . PRO C 3 45  ? 13.515  27.375 8.133  1.000 37.748 ? 45  PRO LLL O    1 
ATOM   3906 C  CB   . PRO C 3 45  ? 14.849  29.924 9.479  1.000 36.232 ? 45  PRO LLL CB   1 
ATOM   3907 C  CG   . PRO C 3 45  ? 13.755  30.694 10.188 1.000 36.593 ? 45  PRO LLL CG   1 
ATOM   3908 C  CD   . PRO C 3 45  ? 12.462  30.247 9.540  1.000 37.627 ? 45  PRO LLL CD   1 
ATOM   3909 H  HA   . PRO C 3 45  ? 14.755  30.150 7.400  1.000 37.098 ? 45  PRO LLL HA   1 
ATOM   3910 H  HB2  . PRO C 3 45  ? 15.059  29.097 9.963  1.000 36.167 ? 45  PRO LLL HB2  1 
ATOM   3911 H  HB3  . PRO C 3 45  ? 15.665  30.465 9.411  1.000 35.828 ? 45  PRO LLL HB3  1 
ATOM   3912 H  HG2  . PRO C 3 45  ? 13.751  30.488 11.145 1.000 36.434 ? 45  PRO LLL HG2  1 
ATOM   3913 H  HG3  . PRO C 3 45  ? 13.882  31.658 10.075 1.000 36.410 ? 45  PRO LLL HG3  1 
ATOM   3914 H  HD2  . PRO C 3 45  ? 12.128  29.424 9.943  1.000 37.897 ? 45  PRO LLL HD2  1 
ATOM   3915 H  HD3  . PRO C 3 45  ? 11.778  30.938 9.603  1.000 37.964 ? 45  PRO LLL HD3  1 
ATOM   3916 N  N    . ARG C 3 46  ? 15.510  27.726 7.150  1.000 37.919 ? 46  ARG LLL N    1 
ATOM   3917 C  CA   . ARG C 3 46  ? 15.890  26.308 6.928  1.000 38.728 ? 46  ARG LLL CA   1 
ATOM   3918 C  C    . ARG C 3 46  ? 17.338  26.108 7.378  1.000 37.819 ? 46  ARG LLL C    1 
ATOM   3919 O  O    . ARG C 3 46  ? 18.109  27.086 7.358  1.000 37.534 ? 46  ARG LLL O    1 
ATOM   3920 C  CB   . ARG C 3 46  ? 15.718  25.924 5.456  1.000 40.044 ? 46  ARG LLL CB   1 
ATOM   3921 C  CG   . ARG C 3 46  ? 16.638  26.677 4.510  1.000 40.794 ? 46  ARG LLL CG   1 
ATOM   3922 C  CD   . ARG C 3 46  ? 16.619  26.106 3.110  1.000 42.548 ? 46  ARG LLL CD   1 
ATOM   3923 N  NE   . ARG C 3 46  ? 17.471  26.916 2.249  1.000 43.766 ? 46  ARG LLL NE   1 
ATOM   3924 C  CZ   . ARG C 3 46  ? 18.149  26.477 1.190  1.000 44.776 ? 46  ARG LLL CZ   1 
ATOM   3925 N  NH1  . ARG C 3 46  ? 18.095  25.202 0.837  1.000 46.092 ? 46  ARG LLL NH1  1 
ATOM   3926 N  NH2  . ARG C 3 46  ? 18.890  27.324 0.492  1.000 44.524 ? 46  ARG LLL NH2  1 
ATOM   3927 H  H    . ARG C 3 46  ? 16.109  28.320 6.806  1.000 37.722 ? 46  ARG LLL H    1 
ATOM   3928 H  HA   . ARG C 3 46  ? 15.306  25.735 7.477  1.000 38.862 ? 46  ARG LLL HA   1 
ATOM   3929 H  HB2  . ARG C 3 46  ? 15.886  24.963 5.362  1.000 40.214 ? 46  ARG LLL HB2  1 
ATOM   3930 H  HB3  . ARG C 3 46  ? 14.789  26.094 5.195  1.000 40.709 ? 46  ARG LLL HB3  1 
ATOM   3931 H  HG2  . ARG C 3 46  ? 16.363  27.618 4.474  1.000 40.839 ? 46  ARG LLL HG2  1 
ATOM   3932 H  HG3  . ARG C 3 46  ? 17.556  26.644 4.851  1.000 40.233 ? 46  ARG LLL HG3  1 
ATOM   3933 H  HD2  . ARG C 3 46  ? 16.944  25.181 3.130  1.000 42.578 ? 46  ARG LLL HD2  1 
ATOM   3934 H  HD3  . ARG C 3 46  ? 15.701  26.106 2.764  1.000 43.262 ? 46  ARG LLL HD3  1 
ATOM   3935 H  HE   . ARG C 3 46  ? 17.540  27.764 2.440  1.000 43.419 ? 46  ARG LLL HE   1 
ATOM   3936 H  HH11 . ARG C 3 46  ? 17.607  24.634 1.293  1.000 45.650 ? 46  ARG LLL HH11 1 
ATOM   3937 H  HH12 . ARG C 3 46  ? 18.548  24.925 0.137  1.000 46.082 ? 46  ARG LLL HH12 1 
ATOM   3938 H  HH21 . ARG C 3 46  ? 18.928  28.172 0.726  1.000 44.417 ? 46  ARG LLL HH21 1 
ATOM   3939 H  HH22 . ARG C 3 46  ? 19.342  27.038 -0.209 1.000 45.081 ? 46  ARG LLL HH22 1 
ATOM   3940 N  N    . SER C 3 47  ? 17.687  24.889 7.785  1.000 37.456 ? 47  SER LLL N    1 
ATOM   3941 C  CA   . SER C 3 47  ? 19.088  24.493 8.058  1.000 36.879 ? 47  SER LLL CA   1 
ATOM   3942 C  C    . SER C 3 47  ? 19.841  24.533 6.732  1.000 36.956 ? 47  SER LLL C    1 
ATOM   3943 O  O    . SER C 3 47  ? 19.220  24.284 5.699  1.000 37.597 ? 47  SER LLL O    1 
ATOM   3944 C  CB   . SER C 3 47  ? 19.171  23.145 8.713  1.000 37.117 ? 47  SER LLL CB   1 
ATOM   3945 O  OG   . SER C 3 47  ? 20.521  22.769 8.930  1.000 36.855 ? 47  SER LLL OG   1 
ATOM   3946 H  H    . SER C 3 47  ? 17.094  24.211 7.924  1.000 37.842 ? 47  SER LLL H    1 
ATOM   3947 H  HA   . SER C 3 47  ? 19.489  25.167 8.667  1.000 36.487 ? 47  SER LLL HA   1 
ATOM   3948 H  HB2  . SER C 3 47  ? 18.695  23.170 9.573  1.000 37.055 ? 47  SER LLL HB2  1 
ATOM   3949 H  HB3  . SER C 3 47  ? 18.733  22.478 8.139  1.000 37.544 ? 47  SER LLL HB3  1 
ATOM   3950 H  HG   . SER C 3 47  ? 20.516  22.068 9.276  0.000 30.000 ? 47  SER LLL HG   1 
ATOM   3951 N  N    . VAL C 3 48  ? 21.122  24.875 6.773  1.000 37.293 ? 48  VAL LLL N    1 
ATOM   3952 C  CA   . VAL C 3 48  ? 21.981  25.051 5.565  1.000 37.909 ? 48  VAL LLL CA   1 
ATOM   3953 C  C    . VAL C 3 48  ? 23.319  24.343 5.818  1.000 37.093 ? 48  VAL LLL C    1 
ATOM   3954 O  O    . VAL C 3 48  ? 23.796  23.644 4.904  1.000 37.967 ? 48  VAL LLL O    1 
ATOM   3955 C  CB   . VAL C 3 48  ? 22.103  26.548 5.211  1.000 38.469 ? 48  VAL LLL CB   1 
ATOM   3956 C  CG1  . VAL C 3 48  ? 23.536  27.005 5.007  1.000 38.792 ? 48  VAL LLL CG1  1 
ATOM   3957 C  CG2  . VAL C 3 48  ? 21.245  26.903 4.005  1.000 39.160 ? 48  VAL LLL CG2  1 
ATOM   3958 H  H    . VAL C 3 48  ? 21.552  25.046 7.556  1.000 36.762 ? 48  VAL LLL H    1 
ATOM   3959 H  HA   . VAL C 3 48  ? 21.544  24.601 4.820  1.000 38.350 ? 48  VAL LLL HA   1 
ATOM   3960 H  HB   . VAL C 3 48  ? 21.745  27.054 5.982  1.000 38.106 ? 48  VAL LLL HB   1 
ATOM   3961 H  HG11 . VAL C 3 48  ? 24.026  26.927 5.844  1.000 38.207 ? 48  VAL LLL HG11 1 
ATOM   3962 H  HG12 . VAL C 3 48  ? 23.539  27.934 4.719  1.000 38.779 ? 48  VAL LLL HG12 1 
ATOM   3963 H  HG13 . VAL C 3 48  ? 23.962  26.454 4.328  1.000 39.012 ? 48  VAL LLL HG13 1 
ATOM   3964 H  HG21 . VAL C 3 48  ? 21.577  26.434 3.221  1.000 39.610 ? 48  VAL LLL HG21 1 
ATOM   3965 H  HG22 . VAL C 3 48  ? 21.286  27.863 3.849  1.000 39.209 ? 48  VAL LLL HG22 1 
ATOM   3966 H  HG23 . VAL C 3 48  ? 20.324  26.642 4.174  1.000 39.348 ? 48  VAL LLL HG23 1 
ATOM   3967 N  N    . ILE C 3 49  ? 23.881  24.488 7.021  1.000 36.064 ? 49  ILE LLL N    1 
ATOM   3968 C  CA   . ILE C 3 49  ? 24.942  23.582 7.555  1.000 35.673 ? 49  ILE LLL CA   1 
ATOM   3969 C  C    . ILE C 3 49  ? 24.475  23.043 8.911  1.000 35.222 ? 49  ILE LLL C    1 
ATOM   3970 O  O    . ILE C 3 49  ? 23.838  23.808 9.659  1.000 34.792 ? 49  ILE LLL O    1 
ATOM   3971 C  CB   . ILE C 3 49  ? 26.306  24.299 7.633  1.000 35.330 ? 49  ILE LLL CB   1 
ATOM   3972 C  CG1  . ILE C 3 49  ? 26.859  24.620 6.239  1.000 35.584 ? 49  ILE LLL CG1  1 
ATOM   3973 C  CG2  . ILE C 3 49  ? 27.304  23.497 8.461  1.000 34.984 ? 49  ILE LLL CG2  1 
ATOM   3974 C  CD1  . ILE C 3 49  ? 27.415  23.428 5.488  1.000 35.613 ? 49  ILE LLL CD1  1 
ATOM   3975 H  H    . ILE C 3 49  ? 23.669  25.170 7.586  1.000 35.897 ? 49  ILE LLL H    1 
ATOM   3976 H  HA   . ILE C 3 49  ? 25.031  22.831 6.946  1.000 35.935 ? 49  ILE LLL HA   1 
ATOM   3977 H  HB   . ILE C 3 49  ? 26.159  25.160 8.096  1.000 35.081 ? 49  ILE LLL HB   1 
ATOM   3978 H  HG12 . ILE C 3 49  ? 26.143  25.022 5.702  1.000 35.786 ? 49  ILE LLL HG12 1 
ATOM   3979 H  HG13 . ILE C 3 49  ? 27.571  25.289 6.333  1.000 35.546 ? 49  ILE LLL HG13 1 
ATOM   3980 H  HG21 . ILE C 3 49  ? 27.154  23.665 9.408  1.000 34.740 ? 49  ILE LLL HG21 1 
ATOM   3981 H  HG22 . ILE C 3 49  ? 28.209  23.764 8.227  1.000 35.155 ? 49  ILE LLL HG22 1 
ATOM   3982 H  HG23 . ILE C 3 49  ? 27.192  22.548 8.280  1.000 35.139 ? 49  ILE LLL HG23 1 
ATOM   3983 H  HD11 . ILE C 3 49  ? 28.259  23.155 5.887  1.000 35.625 ? 49  ILE LLL HD11 1 
ATOM   3984 H  HD12 . ILE C 3 49  ? 27.562  23.669 4.557  1.000 36.208 ? 49  ILE LLL HD12 1 
ATOM   3985 H  HD13 . ILE C 3 49  ? 26.783  22.690 5.533  1.000 35.745 ? 49  ILE LLL HD13 1 
ATOM   3986 N  N    . PHE C 3 50  ? 24.748  21.762 9.182  1.000 35.548 ? 50  PHE LLL N    1 
ATOM   3987 C  CA   . PHE C 3 50  ? 24.528  21.086 10.489 1.000 35.326 ? 50  PHE LLL CA   1 
ATOM   3988 C  C    . PHE C 3 50  ? 25.766  20.243 10.818 1.000 35.145 ? 50  PHE LLL C    1 
ATOM   3989 O  O    . PHE C 3 50  ? 26.543  19.926 9.905  1.000 34.498 ? 50  PHE LLL O    1 
ATOM   3990 C  CB   . PHE C 3 50  ? 23.234  20.267 10.470 1.000 35.496 ? 50  PHE LLL CB   1 
ATOM   3991 C  CG   . PHE C 3 50  ? 23.309  18.955 9.731  1.000 36.016 ? 50  PHE LLL CG   1 
ATOM   3992 C  CD1  . PHE C 3 50  ? 23.705  17.795 10.376 1.000 36.321 ? 50  PHE LLL CD1  1 
ATOM   3993 C  CD2  . PHE C 3 50  ? 22.959  18.870 8.394  1.000 36.887 ? 50  PHE LLL CD2  1 
ATOM   3994 C  CE1  . PHE C 3 50  ? 23.770  16.587 9.695  1.000 36.631 ? 50  PHE LLL CE1  1 
ATOM   3995 C  CE2  . PHE C 3 50  ? 23.009  17.657 7.720  1.000 37.408 ? 50  PHE LLL CE2  1 
ATOM   3996 C  CZ   . PHE C 3 50  ? 23.419  16.518 8.370  1.000 36.965 ? 50  PHE LLL CZ   1 
ATOM   3997 H  H    . PHE C 3 50  ? 25.096  21.194 8.560  1.000 35.668 ? 50  PHE LLL H    1 
ATOM   3998 H  HA   . PHE C 3 50  ? 24.442  21.784 11.188 1.000 35.100 ? 50  PHE LLL HA   1 
ATOM   3999 H  HB2  . PHE C 3 50  ? 22.971  20.089 11.398 1.000 35.513 ? 50  PHE LLL HB2  1 
ATOM   4000 H  HB3  . PHE C 3 50  ? 22.531  20.815 10.064 1.000 35.749 ? 50  PHE LLL HB3  1 
ATOM   4001 H  HD1  . PHE C 3 50  ? 23.949  17.831 11.287 1.000 36.046 ? 50  PHE LLL HD1  1 
ATOM   4002 H  HD2  . PHE C 3 50  ? 22.677  19.646 7.939  1.000 36.935 ? 50  PHE LLL HD2  1 
ATOM   4003 H  HE1  . PHE C 3 50  ? 24.046  15.807 10.149 1.000 36.578 ? 50  PHE LLL HE1  1 
ATOM   4004 H  HE2  . PHE C 3 50  ? 22.775  17.618 6.806  1.000 37.667 ? 50  PHE LLL HE2  1 
ATOM   4005 H  HZ   . PHE C 3 50  ? 23.460  15.695 7.909  1.000 37.313 ? 50  PHE LLL HZ   1 
ATOM   4006 N  N    . GLU C 3 51  ? 25.938  19.911 12.100 1.000 35.713 ? 51  GLU LLL N    1 
ATOM   4007 C  CA   . GLU C 3 51  ? 27.120  19.198 12.655 1.000 35.847 ? 51  GLU LLL CA   1 
ATOM   4008 C  C    . GLU C 3 51  ? 28.404  19.829 12.083 1.000 35.994 ? 51  GLU LLL C    1 
ATOM   4009 O  O    . GLU C 3 51  ? 29.259  19.095 11.566 1.000 36.190 ? 51  GLU LLL O    1 
ATOM   4010 C  CB   . GLU C 3 51  ? 26.967  17.694 12.399 1.000 36.313 ? 51  GLU LLL CB   1 
ATOM   4011 C  CG   . GLU C 3 51  ? 25.911  17.028 13.278 1.000 36.575 ? 51  GLU LLL CG   1 
ATOM   4012 C  CD   . GLU C 3 51  ? 25.399  15.668 12.814 1.000 37.047 ? 51  GLU LLL CD   1 
ATOM   4013 O  OE1  . GLU C 3 51  ? 26.102  14.991 12.018 1.000 36.885 ? 51  GLU LLL OE1  1 
ATOM   4014 O  OE2  . GLU C 3 51  ? 24.286  15.288 13.242 1.000 36.667 ? 51  GLU LLL OE2  1 
ATOM   4015 H  H    . GLU C 3 51  ? 25.315  20.111 12.734 1.000 35.560 ? 51  GLU LLL H    1 
ATOM   4016 H  HA   . GLU C 3 51  ? 27.123  19.341 13.630 1.000 35.835 ? 51  GLU LLL HA   1 
ATOM   4017 H  HB2  . GLU C 3 51  ? 26.729  17.560 11.458 1.000 36.417 ? 51  GLU LLL HB2  1 
ATOM   4018 H  HB3  . GLU C 3 51  ? 27.830  17.259 12.557 1.000 36.300 ? 51  GLU LLL HB3  1 
ATOM   4019 H  HG2  . GLU C 3 51  ? 26.281  16.920 14.181 1.000 36.559 ? 51  GLU LLL HG2  1 
ATOM   4020 H  HG3  . GLU C 3 51  ? 25.141  17.632 13.352 1.000 36.596 ? 51  GLU LLL HG3  1 
ATOM   4021 N  N    . ASP C 3 52  ? 28.503  21.160 12.147 1.000 36.233 ? 52  ASP LLL N    1 
ATOM   4022 C  CA   . ASP C 3 52  ? 29.727  21.968 11.886 1.000 37.240 ? 52  ASP LLL CA   1 
ATOM   4023 C  C    . ASP C 3 52  ? 29.883  22.280 10.392 1.000 38.678 ? 52  ASP LLL C    1 
ATOM   4024 O  O    . ASP C 3 52  ? 30.099  23.473 10.055 1.000 38.382 ? 52  ASP LLL O    1 
ATOM   4025 C  CB   . ASP C 3 52  ? 30.994  21.291 12.410 1.000 37.077 ? 52  ASP LLL CB   1 
ATOM   4026 C  CG   . ASP C 3 52  ? 31.035  21.157 13.920 1.000 37.470 ? 52  ASP LLL CG   1 
ATOM   4027 O  OD1  . ASP C 3 52  ? 30.583  22.103 14.608 1.000 36.866 ? 52  ASP LLL OD1  1 
ATOM   4028 O  OD2  . ASP C 3 52  ? 31.523  20.107 14.400 1.000 38.921 ? 52  ASP LLL OD2  1 
ATOM   4029 H  H    . ASP C 3 52  ? 27.789  21.679 12.372 1.000 36.258 ? 52  ASP LLL H    1 
ATOM   4030 H  HA   . ASP C 3 52  ? 29.626  22.825 12.364 1.000 37.112 ? 52  ASP LLL HA   1 
ATOM   4031 H  HB2  . ASP C 3 52  ? 31.085  20.402 12.013 1.000 37.377 ? 52  ASP LLL HB2  1 
ATOM   4032 H  HB3  . ASP C 3 52  ? 31.769  21.824 12.135 1.000 37.456 ? 52  ASP LLL HB3  1 
ATOM   4033 N  N    . ASP C 3 53  ? 29.817  21.258 9.535  1.000 39.774 ? 53  ASP LLL N    1 
ATOM   4034 C  CA   . ASP C 3 53  ? 30.291  21.366 8.131  1.000 40.898 ? 53  ASP LLL CA   1 
ATOM   4035 C  C    . ASP C 3 53  ? 29.491  20.470 7.177  1.000 40.835 ? 53  ASP LLL C    1 
ATOM   4036 O  O    . ASP C 3 53  ? 29.971  20.265 6.060  1.000 42.083 ? 53  ASP LLL O    1 
ATOM   4037 C  CB   . ASP C 3 53  ? 31.782  21.024 8.079  1.000 42.033 ? 53  ASP LLL CB   1 
ATOM   4038 C  CG   . ASP C 3 53  ? 32.109  19.603 8.505  1.000 42.283 ? 53  ASP LLL CG   1 
ATOM   4039 O  OD1  . ASP C 3 53  ? 31.166  18.803 8.670  1.000 42.076 ? 53  ASP LLL OD1  1 
ATOM   4040 O  OD2  . ASP C 3 53  ? 33.305  19.313 8.679  1.000 43.546 ? 53  ASP LLL OD2  1 
ATOM   4041 H  H    . ASP C 3 53  ? 29.518  20.432 9.768  1.000 39.661 ? 53  ASP LLL H    1 
ATOM   4042 H  HA   . ASP C 3 53  ? 30.181  22.302 7.840  1.000 40.912 ? 53  ASP LLL HA   1 
ATOM   4043 H  HB2  . ASP C 3 53  ? 32.114  21.159 7.168  1.000 42.318 ? 53  ASP LLL HB2  1 
ATOM   4044 H  HB3  . ASP C 3 53  ? 32.266  21.634 8.672  1.000 41.820 ? 53  ASP LLL HB3  1 
ATOM   4045 N  N    . LYS C 3 54  ? 28.325  19.959 7.572  1.000 40.978 ? 54  LYS LLL N    1 
ATOM   4046 C  CA   . LYS C 3 54  ? 27.548  18.994 6.747  1.000 41.644 ? 54  LYS LLL CA   1 
ATOM   4047 C  C    . LYS C 3 54  ? 26.368  19.723 6.110  1.000 41.383 ? 54  LYS LLL C    1 
ATOM   4048 O  O    . LYS C 3 54  ? 25.749  20.551 6.793  1.000 41.417 ? 54  LYS LLL O    1 
ATOM   4049 C  CB   . LYS C 3 54  ? 27.093  17.789 7.576  1.000 42.040 ? 54  LYS LLL CB   1 
ATOM   4050 C  CG   . LYS C 3 54  ? 28.034  16.596 7.504  1.000 43.184 ? 54  LYS LLL CG   1 
ATOM   4051 C  CD   . LYS C 3 54  ? 27.975  15.684 8.717  1.000 44.365 ? 54  LYS LLL CD   1 
ATOM   4052 C  CE   . LYS C 3 54  ? 29.327  15.107 9.090  1.000 44.869 ? 54  LYS LLL CE   1 
ATOM   4053 N  NZ   . LYS C 3 54  ? 30.327  16.170 9.361  1.000 44.649 ? 54  LYS LLL NZ   1 
ATOM   4054 H  H    . LYS C 3 54  ? 27.921  20.187 8.355  1.000 40.675 ? 54  LYS LLL H    1 
ATOM   4055 H  HA   . LYS C 3 54  ? 28.134  18.668 6.025  1.000 41.944 ? 54  LYS LLL HA   1 
ATOM   4056 H  HB2  . LYS C 3 54  ? 27.008  18.066 8.511  1.000 41.807 ? 54  LYS LLL HB2  1 
ATOM   4057 H  HB3  . LYS C 3 54  ? 26.207  17.509 7.264  1.000 42.324 ? 54  LYS LLL HB3  1 
ATOM   4058 H  HG2  . LYS C 3 54  ? 27.812  16.072 6.705  1.000 43.629 ? 54  LYS LLL HG2  1 
ATOM   4059 H  HG3  . LYS C 3 54  ? 28.950  16.927 7.396  1.000 43.320 ? 54  LYS LLL HG3  1 
ATOM   4060 H  HD2  . LYS C 3 54  ? 27.624  16.187 9.483  1.000 43.885 ? 54  LYS LLL HD2  1 
ATOM   4061 H  HD3  . LYS C 3 54  ? 27.356  14.946 8.533  1.000 44.297 ? 54  LYS LLL HD3  1 
ATOM   4062 H  HE2  . LYS C 3 54  ? 29.235  14.549 9.886  1.000 44.592 ? 54  LYS LLL HE2  1 
ATOM   4063 H  HE3  . LYS C 3 54  ? 29.652  14.544 8.363  1.000 44.996 ? 54  LYS LLL HE3  1 
ATOM   4064 H  HZ1  . LYS C 3 54  ? 30.822  16.324 8.616  1.000 44.939 ? 54  LYS LLL HZ1  1 
ATOM   4065 H  HZ2  . LYS C 3 54  ? 30.878  15.909 10.032 1.000 44.630 ? 54  LYS LLL HZ2  1 
ATOM   4066 H  HZ3  . LYS C 3 54  ? 29.907  16.936 9.605  1.000 44.524 ? 54  LYS LLL HZ3  1 
ATOM   4067 N  N    . ARG C 3 55  ? 26.078  19.406 4.850  1.000 41.822 ? 55  ARG LLL N    1 
ATOM   4068 C  CA   . ARG C 3 55  ? 24.999  20.037 4.053  1.000 42.483 ? 55  ARG LLL CA   1 
ATOM   4069 C  C    . ARG C 3 55  ? 23.803  19.095 4.003  1.000 41.939 ? 55  ARG LLL C    1 
ATOM   4070 O  O    . ARG C 3 55  ? 23.942  17.929 3.654  1.000 41.587 ? 55  ARG LLL O    1 
ATOM   4071 C  CB   . ARG C 3 55  ? 25.530  20.363 2.654  1.000 44.393 ? 55  ARG LLL CB   1 
ATOM   4072 C  CG   . ARG C 3 55  ? 26.692  21.346 2.665  1.000 45.067 ? 55  ARG LLL CG   1 
ATOM   4073 C  CD   . ARG C 3 55  ? 27.262  21.635 1.295  1.000 46.555 ? 55  ARG LLL CD   1 
ATOM   4074 N  NE   . ARG C 3 55  ? 27.893  20.476 0.672  1.000 47.482 ? 55  ARG LLL NE   1 
ATOM   4075 C  CZ   . ARG C 3 55  ? 27.363  19.735 -0.303 1.000 48.772 ? 55  ARG LLL CZ   1 
ATOM   4076 N  NH1  . ARG C 3 55  ? 26.161  20.006 -0.788 1.000 49.294 ? 55  ARG LLL NH1  1 
ATOM   4077 N  NH2  . ARG C 3 55  ? 28.042  18.711 -0.793 1.000 49.366 ? 55  ARG LLL NH2  1 
ATOM   4078 H  H    . ARG C 3 55  ? 26.536  18.764 4.393  1.000 42.188 ? 55  ARG LLL H    1 
ATOM   4079 H  HA   . ARG C 3 55  ? 24.732  20.874 4.493  1.000 42.226 ? 55  ARG LLL HA   1 
ATOM   4080 H  HB2  . ARG C 3 55  ? 25.822  19.531 2.227  1.000 44.633 ? 55  ARG LLL HB2  1 
ATOM   4081 H  HB3  . ARG C 3 55  ? 24.800  20.739 2.120  1.000 44.676 ? 55  ARG LLL HB3  1 
ATOM   4082 H  HG2  . ARG C 3 55  ? 26.390  22.191 3.063  1.000 44.737 ? 55  ARG LLL HG2  1 
ATOM   4083 H  HG3  . ARG C 3 55  ? 27.407  20.990 3.233  1.000 44.704 ? 55  ARG LLL HG3  1 
ATOM   4084 H  HD2  . ARG C 3 55  ? 26.547  21.970 0.715  1.000 46.908 ? 55  ARG LLL HD2  1 
ATOM   4085 H  HD3  . ARG C 3 55  ? 27.930  22.346 1.377  1.000 46.460 ? 55  ARG LLL HD3  1 
ATOM   4086 H  HE   . ARG C 3 55  ? 28.689  20.256 0.951  1.000 47.417 ? 55  ARG LLL HE   1 
ATOM   4087 H  HH11 . ARG C 3 55  ? 25.697  20.681 -0.476 1.000 48.957 ? 55  ARG LLL HH11 1 
ATOM   4088 H  HH12 . ARG C 3 55  ? 25.827  19.505 -1.428 1.000 49.794 ? 55  ARG LLL HH12 1 
ATOM   4089 H  HH21 . ARG C 3 55  ? 28.842  18.522 -0.476 1.000 49.107 ? 55  ARG LLL HH21 1 
ATOM   4090 H  HH22 . ARG C 3 55  ? 27.693  18.217 -1.434 1.000 49.835 ? 55  ARG LLL HH22 1 
ATOM   4091 N  N    . PRO C 3 56  ? 22.586  19.551 4.372  1.000 42.386 ? 56  PRO LLL N    1 
ATOM   4092 C  CA   . PRO C 3 56  ? 21.370  18.820 4.019  1.000 42.610 ? 56  PRO LLL CA   1 
ATOM   4093 C  C    . PRO C 3 56  ? 21.244  18.695 2.492  1.000 43.322 ? 56  PRO LLL C    1 
ATOM   4094 O  O    . PRO C 3 56  ? 21.864  19.477 1.788  1.000 43.518 ? 56  PRO LLL O    1 
ATOM   4095 C  CB   . PRO C 3 56  ? 20.241  19.674 4.617  1.000 42.410 ? 56  PRO LLL CB   1 
ATOM   4096 C  CG   . PRO C 3 56  ? 20.918  20.471 5.714  1.000 41.513 ? 56  PRO LLL CG   1 
ATOM   4097 C  CD   . PRO C 3 56  ? 22.309  20.751 5.180  1.000 41.461 ? 56  PRO LLL CD   1 
ATOM   4098 H  HA   . PRO C 3 56  ? 21.378  17.926 4.443  1.000 42.527 ? 56  PRO LLL HA   1 
ATOM   4099 H  HB2  . PRO C 3 56  ? 19.854  20.271 3.941  1.000 42.837 ? 56  PRO LLL HB2  1 
ATOM   4100 H  HB3  . PRO C 3 56  ? 19.529  19.108 4.985  1.000 42.613 ? 56  PRO LLL HB3  1 
ATOM   4101 H  HG2  . PRO C 3 56  ? 20.437  21.306 5.886  1.000 41.520 ? 56  PRO LLL HG2  1 
ATOM   4102 H  HG3  . PRO C 3 56  ? 20.960  19.953 6.543  1.000 41.261 ? 56  PRO LLL HG3  1 
ATOM   4103 H  HD2  . PRO C 3 56  ? 22.322  21.556 4.630  1.000 41.710 ? 56  PRO LLL HD2  1 
ATOM   4104 H  HD3  . PRO C 3 56  ? 22.954  20.846 5.905  1.000 41.053 ? 56  PRO LLL HD3  1 
ATOM   4105 N  N    . SER C 3 57  ? 20.452  17.723 2.029  1.000 44.110 ? 57  SER LLL N    1 
ATOM   4106 C  CA   . SER C 3 57  ? 20.168  17.434 0.597  1.000 45.391 ? 57  SER LLL CA   1 
ATOM   4107 C  C    . SER C 3 57  ? 19.693  18.698 -0.126 1.000 45.295 ? 57  SER LLL C    1 
ATOM   4108 O  O    . SER C 3 57  ? 18.799  19.371 0.398  1.000 44.896 ? 57  SER LLL O    1 
ATOM   4109 C  CB   . SER C 3 57  ? 19.142  16.343 0.479  1.000 46.842 ? 57  SER LLL CB   1 
ATOM   4110 O  OG   . SER C 3 57  ? 19.307  15.401 1.526  1.000 47.340 ? 57  SER LLL OG   1 
ATOM   4111 H  H    . SER C 3 57  ? 20.015  17.148 2.583  1.000 44.051 ? 57  SER LLL H    1 
ATOM   4112 H  HA   . SER C 3 57  ? 21.012  17.124 0.170  1.000 45.440 ? 57  SER LLL HA   1 
ATOM   4113 H  HB2  . SER C 3 57  ? 18.240  16.733 0.525  1.000 47.225 ? 57  SER LLL HB2  1 
ATOM   4114 H  HB3  . SER C 3 57  ? 19.240  15.892 -0.390 1.000 47.584 ? 57  SER LLL HB3  1 
ATOM   4115 H  HG   . SER C 3 57  ? 18.621  15.071 1.561  0.000 30.000 ? 57  SER LLL HG   1 
ATOM   4116 N  N    . GLY C 3 58  ? 20.278  19.006 -1.284 1.000 45.908 ? 58  GLY LLL N    1 
ATOM   4117 C  CA   . GLY C 3 58  ? 19.846  20.126 -2.141 1.000 46.786 ? 58  GLY LLL CA   1 
ATOM   4118 C  C    . GLY C 3 58  ? 20.382  21.470 -1.677 1.000 46.228 ? 58  GLY LLL C    1 
ATOM   4119 O  O    . GLY C 3 58  ? 19.909  22.496 -2.204 1.000 48.033 ? 58  GLY LLL O    1 
ATOM   4120 H  H    . GLY C 3 58  ? 20.985  18.535 -1.612 1.000 46.054 ? 58  GLY LLL H    1 
ATOM   4121 H  HA2  . GLY C 3 58  ? 20.154  19.955 -3.066 1.000 47.527 ? 58  GLY LLL HA2  1 
ATOM   4122 H  HA3  . GLY C 3 58  ? 18.856  20.156 -2.153 1.000 47.176 ? 58  GLY LLL HA3  1 
ATOM   4123 N  N    . VAL C 3 59  ? 21.313  21.499 -0.720 1.000 44.663 ? 59  VAL LLL N    1 
ATOM   4124 C  CA   . VAL C 3 59  ? 22.137  22.714 -0.450 1.000 44.423 ? 59  VAL LLL CA   1 
ATOM   4125 C  C    . VAL C 3 59  ? 23.399  22.575 -1.293 1.000 44.647 ? 59  VAL LLL C    1 
ATOM   4126 O  O    . VAL C 3 59  ? 24.092  21.568 -1.183 1.000 44.851 ? 59  VAL LLL O    1 
ATOM   4127 C  CB   . VAL C 3 59  ? 22.467  22.901 1.045  1.000 43.291 ? 59  VAL LLL CB   1 
ATOM   4128 C  CG1  . VAL C 3 59  ? 23.457  24.036 1.257  1.000 42.616 ? 59  VAL LLL CG1  1 
ATOM   4129 C  CG2  . VAL C 3 59  ? 21.215  23.127 1.880  1.000 42.818 ? 59  VAL LLL CG2  1 
ATOM   4130 H  H    . VAL C 3 59  ? 21.502  20.794 -0.177 1.000 44.455 ? 59  VAL LLL H    1 
ATOM   4131 H  HA   . VAL C 3 59  ? 21.642  23.492 -0.750 1.000 44.628 ? 59  VAL LLL HA   1 
ATOM   4132 H  HB   . VAL C 3 59  ? 22.893  22.066 1.360  1.000 42.967 ? 59  VAL LLL HB   1 
ATOM   4133 H  HG11 . VAL C 3 59  ? 24.362  23.709 1.116  1.000 42.724 ? 59  VAL LLL HG11 1 
ATOM   4134 H  HG12 . VAL C 3 59  ? 23.375  24.374 2.166  1.000 42.087 ? 59  VAL LLL HG12 1 
ATOM   4135 H  HG13 . VAL C 3 59  ? 23.270  24.754 0.628  1.000 43.144 ? 59  VAL LLL HG13 1 
ATOM   4136 H  HG21 . VAL C 3 59  ? 20.791  23.961 1.612  1.000 43.089 ? 59  VAL LLL HG21 1 
ATOM   4137 H  HG22 . VAL C 3 59  ? 21.457  23.176 2.822  1.000 42.215 ? 59  VAL LLL HG22 1 
ATOM   4138 H  HG23 . VAL C 3 59  ? 20.595  22.390 1.743  1.000 43.216 ? 59  VAL LLL HG23 1 
ATOM   4139 N  N    . PRO C 3 60  ? 23.710  23.541 -2.186 1.000 45.099 ? 60  PRO LLL N    1 
ATOM   4140 C  CA   . PRO C 3 60  ? 24.893  23.447 -3.046 1.000 46.030 ? 60  PRO LLL CA   1 
ATOM   4141 C  C    . PRO C 3 60  ? 26.222  23.452 -2.271 1.000 45.449 ? 60  PRO LLL C    1 
ATOM   4142 O  O    . PRO C 3 60  ? 26.313  24.134 -1.268 1.000 44.613 ? 60  PRO LLL O    1 
ATOM   4143 C  CB   . PRO C 3 60  ? 24.820  24.693 -3.941 1.000 46.931 ? 60  PRO LLL CB   1 
ATOM   4144 C  CG   . PRO C 3 60  ? 23.388  25.180 -3.824 1.000 46.909 ? 60  PRO LLL CG   1 
ATOM   4145 C  CD   . PRO C 3 60  ? 22.921  24.752 -2.449 1.000 45.604 ? 60  PRO LLL CD   1 
ATOM   4146 H  HA   . PRO C 3 60  ? 24.828  22.633 -3.606 1.000 46.595 ? 60  PRO LLL HA   1 
ATOM   4147 H  HB2  . PRO C 3 60  ? 25.445  25.382 -3.634 1.000 46.589 ? 60  PRO LLL HB2  1 
ATOM   4148 H  HB3  . PRO C 3 60  ? 25.033  24.466 -4.872 1.000 47.848 ? 60  PRO LLL HB3  1 
ATOM   4149 H  HG2  . PRO C 3 60  ? 23.346  26.154 -3.913 1.000 46.969 ? 60  PRO LLL HG2  1 
ATOM   4150 H  HG3  . PRO C 3 60  ? 22.828  24.777 -4.518 1.000 47.676 ? 60  PRO LLL HG3  1 
ATOM   4151 H  HD2  . PRO C 3 60  ? 23.103  25.441 -1.784 1.000 44.940 ? 60  PRO LLL HD2  1 
ATOM   4152 H  HD3  . PRO C 3 60  ? 21.966  24.557 -2.453 1.000 45.761 ? 60  PRO LLL HD3  1 
ATOM   4153 N  N    . ASP C 3 61  ? 27.230  22.732 -2.777 1.000 46.055 ? 61  ASP LLL N    1 
ATOM   4154 C  CA   . ASP C 3 61  ? 28.542  22.539 -2.099 1.000 45.365 ? 61  ASP LLL CA   1 
ATOM   4155 C  C    . ASP C 3 61  ? 29.308  23.872 -2.010 1.000 45.544 ? 61  ASP LLL C    1 
ATOM   4156 O  O    . ASP C 3 61  ? 30.380  23.878 -1.387 1.000 46.034 ? 61  ASP LLL O    1 
ATOM   4157 C  CB   . ASP C 3 61  ? 29.355  21.414 -2.757 1.000 45.905 ? 61  ASP LLL CB   1 
ATOM   4158 C  CG   . ASP C 3 61  ? 29.903  21.708 -4.145 1.000 47.461 ? 61  ASP LLL CG   1 
ATOM   4159 O  OD1  . ASP C 3 61  ? 29.354  22.589 -4.822 1.000 48.218 ? 61  ASP LLL OD1  1 
ATOM   4160 O  OD2  . ASP C 3 61  ? 30.880  21.046 -4.541 1.000 48.557 ? 61  ASP LLL OD2  1 
ATOM   4161 H  H    . ASP C 3 61  ? 27.169  22.309 -3.581 1.000 46.748 ? 61  ASP LLL H    1 
ATOM   4162 H  HA   . ASP C 3 61  ? 28.352  22.251 -1.179 1.000 44.619 ? 61  ASP LLL HA   1 
ATOM   4163 H  HB2  . ASP C 3 61  ? 30.113  21.197 -2.175 1.000 45.582 ? 61  ASP LLL HB2  1 
ATOM   4164 H  HB3  . ASP C 3 61  ? 28.789  20.618 -2.820 1.000 45.981 ? 61  ASP LLL HB3  1 
ATOM   4165 N  N    . ARG C 3 62  ? 28.791  24.965 -2.581 1.000 45.769 ? 62  ARG LLL N    1 
ATOM   4166 C  CA   . ARG C 3 62  ? 29.435  26.307 -2.512 1.000 46.038 ? 62  ARG LLL CA   1 
ATOM   4167 C  C    . ARG C 3 62  ? 29.076  27.004 -1.189 1.000 44.487 ? 62  ARG LLL C    1 
ATOM   4168 O  O    . ARG C 3 62  ? 29.745  28.001 -0.850 1.000 43.611 ? 62  ARG LLL O    1 
ATOM   4169 C  CB   . ARG C 3 62  ? 29.052  27.142 -3.737 1.000 47.568 ? 62  ARG LLL CB   1 
ATOM   4170 C  CG   . ARG C 3 62  ? 27.614  27.632 -3.732 1.000 47.572 ? 62  ARG LLL CG   1 
ATOM   4171 C  CD   . ARG C 3 62  ? 27.162  28.050 -5.115 1.000 48.965 ? 62  ARG LLL CD   1 
ATOM   4172 N  NE   . ARG C 3 62  ? 25.753  28.392 -5.111 1.000 48.724 ? 62  ARG LLL NE   1 
ATOM   4173 C  CZ   . ARG C 3 62  ? 25.243  29.502 -4.586 1.000 48.535 ? 62  ARG LLL CZ   1 
ATOM   4174 N  NH1  . ARG C 3 62  ? 26.029  30.401 -4.012 1.000 47.742 ? 62  ARG LLL NH1  1 
ATOM   4175 N  NH2  . ARG C 3 62  ? 23.938  29.711 -4.642 1.000 48.736 ? 62  ARG LLL NH2  1 
ATOM   4176 H  H    . ARG C 3 62  ? 28.029  24.950 -3.072 1.000 46.230 ? 62  ARG LLL H    1 
ATOM   4177 H  HA   . ARG C 3 62  ? 30.411  26.173 -2.529 1.000 46.250 ? 62  ARG LLL HA   1 
ATOM   4178 H  HB2  . ARG C 3 62  ? 29.649  27.918 -3.784 1.000 47.742 ? 62  ARG LLL HB2  1 
ATOM   4179 H  HB3  . ARG C 3 62  ? 29.199  26.601 -4.541 1.000 48.345 ? 62  ARG LLL HB3  1 
ATOM   4180 H  HG2  . ARG C 3 62  ? 27.027  26.920 -3.404 1.000 47.126 ? 62  ARG LLL HG2  1 
ATOM   4181 H  HG3  . ARG C 3 62  ? 27.533  28.396 -3.122 1.000 46.953 ? 62  ARG LLL HG3  1 
ATOM   4182 H  HD2  . ARG C 3 62  ? 27.688  28.821 -5.415 1.000 49.356 ? 62  ARG LLL HD2  1 
ATOM   4183 H  HD3  . ARG C 3 62  ? 27.316  27.313 -5.745 1.000 49.602 ? 62  ARG LLL HD3  1 
ATOM   4184 H  HE   . ARG C 3 62  ? 25.198  27.828 -5.478 1.000 49.224 ? 62  ARG LLL HE   1 
ATOM   4185 H  HH11 . ARG C 3 62  ? 26.895  30.277 -3.973 1.000 47.879 ? 62  ARG LLL HH11 1 
ATOM   4186 H  HH12 . ARG C 3 62  ? 25.678  31.131 -3.672 1.000 47.505 ? 62  ARG LLL HH12 1 
ATOM   4187 H  HH21 . ARG C 3 62  ? 23.413  29.114 -5.022 1.000 49.096 ? 62  ARG LLL HH21 1 
ATOM   4188 H  HH22 . ARG C 3 62  ? 23.595  30.445 -4.296 1.000 48.344 ? 62  ARG LLL HH22 1 
ATOM   4189 N  N    . LEU C 3 63  ? 28.052  26.514 -0.478 1.000 44.047 ? 63  LEU LLL N    1 
ATOM   4190 C  CA   . LEU C 3 63  ? 27.845  26.780 0.975  1.000 42.590 ? 63  LEU LLL CA   1 
ATOM   4191 C  C    . LEU C 3 63  ? 28.702  25.777 1.745  1.000 40.760 ? 63  LEU LLL C    1 
ATOM   4192 O  O    . LEU C 3 63  ? 28.736  24.617 1.332  1.000 42.295 ? 63  LEU LLL O    1 
ATOM   4193 C  CB   . LEU C 3 63  ? 26.365  26.656 1.353  1.000 42.751 ? 63  LEU LLL CB   1 
ATOM   4194 C  CG   . LEU C 3 63  ? 25.505  27.869 1.001  1.000 44.018 ? 63  LEU LLL CG   1 
ATOM   4195 C  CD1  . LEU C 3 63  ? 24.781  27.667 -0.323 1.000 45.340 ? 63  LEU LLL CD1  1 
ATOM   4196 C  CD2  . LEU C 3 63  ? 24.506  28.163 2.107  1.000 43.715 ? 63  LEU LLL CD2  1 
ATOM   4197 H  H    . LEU C 3 63  ? 27.406  25.991 -0.849 1.000 44.130 ? 63  LEU LLL H    1 
ATOM   4198 H  HA   . LEU C 3 63  ? 28.161  27.690 1.176  1.000 42.386 ? 63  LEU LLL HA   1 
ATOM   4199 H  HB2  . LEU C 3 63  ? 25.995  25.869 0.905  1.000 43.194 ? 63  LEU LLL HB2  1 
ATOM   4200 H  HB3  . LEU C 3 63  ? 26.306  26.500 2.317  1.000 42.212 ? 63  LEU LLL HB3  1 
ATOM   4201 H  HG   . LEU C 3 63  ? 26.100  28.653 0.909  1.000 44.045 ? 63  LEU LLL HG   1 
ATOM   4202 H  HD11 . LEU C 3 63  ? 25.431  27.488 -1.025 1.000 45.822 ? 63  LEU LLL HD11 1 
ATOM   4203 H  HD12 . LEU C 3 63  ? 24.278  28.470 -0.545 1.000 45.441 ? 63  LEU LLL HD12 1 
ATOM   4204 H  HD13 . LEU C 3 63  ? 24.171  26.913 -0.248 1.000 45.228 ? 63  LEU LLL HD13 1 
ATOM   4205 H  HD21 . LEU C 3 63  ? 23.907  27.404 2.213  1.000 43.545 ? 63  LEU LLL HD21 1 
ATOM   4206 H  HD22 . LEU C 3 63  ? 23.989  28.954 1.876  1.000 43.741 ? 63  LEU LLL HD22 1 
ATOM   4207 H  HD23 . LEU C 3 63  ? 24.982  28.320 2.941  1.000 43.004 ? 63  LEU LLL HD23 1 
ATOM   4208 N  N    . SER C 3 64  ? 29.376  26.224 2.802  1.000 38.654 ? 64  SER LLL N    1 
ATOM   4209 C  CA   . SER C 3 64  ? 30.520  25.520 3.433  1.000 37.542 ? 64  SER LLL CA   1 
ATOM   4210 C  C    . SER C 3 64  ? 30.694  26.008 4.873  1.000 36.575 ? 64  SER LLL C    1 
ATOM   4211 O  O    . SER C 3 64  ? 30.746  27.232 5.083  1.000 37.477 ? 64  SER LLL O    1 
ATOM   4212 C  CB   . SER C 3 64  ? 31.765  25.725 2.602  1.000 38.105 ? 64  SER LLL CB   1 
ATOM   4213 O  OG   . SER C 3 64  ? 32.917  25.864 3.417  1.000 38.006 ? 64  SER LLL OG   1 
ATOM   4214 H  H    . SER C 3 64  ? 29.181  27.010 3.220  1.000 38.502 ? 64  SER LLL H    1 
ATOM   4215 H  HA   . SER C 3 64  ? 30.311  24.548 3.454  1.000 37.562 ? 64  SER LLL HA   1 
ATOM   4216 H  HB2  . SER C 3 64  ? 31.883  24.956 1.999  1.000 38.592 ? 64  SER LLL HB2  1 
ATOM   4217 H  HB3  . SER C 3 64  ? 31.658  26.532 2.049  1.000 38.558 ? 64  SER LLL HB3  1 
ATOM   4218 H  HG   . SER C 3 64  ? 33.453  26.094 2.731  0.000 30.000 ? 64  SER LLL HG   1 
ATOM   4219 N  N    . GLY C 3 65  ? 30.766  25.079 5.827  1.000 35.914 ? 65  GLY LLL N    1 
ATOM   4220 C  CA   . GLY C 3 65  ? 30.932  25.376 7.260  1.000 35.219 ? 65  GLY LLL CA   1 
ATOM   4221 C  C    . GLY C 3 65  ? 32.287  24.923 7.756  1.000 35.351 ? 65  GLY LLL C    1 
ATOM   4222 O  O    . GLY C 3 65  ? 32.682  23.812 7.415  1.000 36.662 ? 65  GLY LLL O    1 
ATOM   4223 H  H    . GLY C 3 65  ? 30.717  24.189 5.639  1.000 36.009 ? 65  GLY LLL H    1 
ATOM   4224 H  HA2  . GLY C 3 65  ? 30.832  26.347 7.407  1.000 35.171 ? 65  GLY LLL HA2  1 
ATOM   4225 H  HA3  . GLY C 3 65  ? 30.222  24.911 7.770  1.000 34.894 ? 65  GLY LLL HA3  1 
ATOM   4226 N  N    . SER C 3 66  ? 32.975  25.763 8.524  1.000 35.551 ? 66  SER LLL N    1 
ATOM   4227 C  CA   . SER C 3 66  ? 34.291  25.472 9.144  1.000 36.458 ? 66  SER LLL CA   1 
ATOM   4228 C  C    . SER C 3 66  ? 34.243  25.888 10.615 1.000 36.299 ? 66  SER LLL C    1 
ATOM   4229 O  O    . SER C 3 66  ? 33.368  26.708 10.963 1.000 36.426 ? 66  SER LLL O    1 
ATOM   4230 C  CB   . SER C 3 66  ? 35.398  26.189 8.404  1.000 37.791 ? 66  SER LLL CB   1 
ATOM   4231 O  OG   . SER C 3 66  ? 35.281  27.604 8.552  1.000 37.778 ? 66  SER LLL OG   1 
ATOM   4232 H  H    . SER C 3 66  ? 32.680  26.601 8.727  1.000 35.503 ? 66  SER LLL H    1 
ATOM   4233 H  HA   . SER C 3 66  ? 34.455  24.491 9.097  1.000 36.539 ? 66  SER LLL HA   1 
ATOM   4234 H  HB2  . SER C 3 66  ? 36.269  25.894 8.755  1.000 37.961 ? 66  SER LLL HB2  1 
ATOM   4235 H  HB3  . SER C 3 66  ? 35.357  25.954 7.449  1.000 37.982 ? 66  SER LLL HB3  1 
ATOM   4236 H  HG   . SER C 3 66  ? 35.783  27.976 8.032  0.000 30.000 ? 66  SER LLL HG   1 
ATOM   4237 N  N    . THR C 3 67  ? 35.140  25.347 11.442 1.000 36.448 ? 67  THR LLL N    1 
ATOM   4238 C  CA   . THR C 3 67  ? 35.408  25.850 12.816 1.000 36.555 ? 67  THR LLL CA   1 
ATOM   4239 C  C    . THR C 3 67  ? 36.913  26.079 12.967 1.000 37.478 ? 67  THR LLL C    1 
ATOM   4240 O  O    . THR C 3 67  ? 37.677  25.360 12.309 1.000 37.734 ? 67  THR LLL O    1 
ATOM   4241 C  CB   . THR C 3 67  ? 34.807  24.934 13.890 1.000 36.080 ? 67  THR LLL CB   1 
ATOM   4242 O  OG1  . THR C 3 67  ? 35.392  23.636 13.801 1.000 36.534 ? 67  THR LLL OG1  1 
ATOM   4243 C  CG2  . THR C 3 67  ? 33.303  24.821 13.771 1.000 35.187 ? 67  THR LLL CG2  1 
ATOM   4244 H  H    . THR C 3 67  ? 35.653  24.627 11.224 1.000 36.750 ? 67  THR LLL H    1 
ATOM   4245 H  HA   . THR C 3 67  ? 34.968  26.725 12.895 1.000 36.367 ? 67  THR LLL HA   1 
ATOM   4246 H  HB   . THR C 3 67  ? 35.024  25.317 14.774 1.000 36.168 ? 67  THR LLL HB   1 
ATOM   4247 H  HG1  . THR C 3 67  ? 35.038  23.165 14.582 0.000 30.000 ? 67  THR LLL HG1  1 
ATOM   4248 H  HG21 . THR C 3 67  ? 32.920  25.707 13.650 1.000 35.164 ? 67  THR LLL HG21 1 
ATOM   4249 H  HG22 . THR C 3 67  ? 32.941  24.420 14.582 1.000 35.145 ? 67  THR LLL HG22 1 
ATOM   4250 H  HG23 . THR C 3 67  ? 33.078  24.263 13.006 1.000 35.261 ? 67  THR LLL HG23 1 
ATOM   4251 N  N    . ASP C 3 68  ? 37.287  27.086 13.766 1.000 38.301 ? 68  ASP LLL N    1 
ATOM   4252 C  CA   . ASP C 3 68  ? 38.685  27.497 14.060 1.000 39.401 ? 68  ASP LLL CA   1 
ATOM   4253 C  C    . ASP C 3 68  ? 38.857  27.566 15.581 1.000 39.241 ? 68  ASP LLL C    1 
ATOM   4254 O  O    . ASP C 3 68  ? 38.318  28.501 16.195 1.000 39.169 ? 68  ASP LLL O    1 
ATOM   4255 C  CB   . ASP C 3 68  ? 39.021  28.837 13.395 1.000 40.449 ? 68  ASP LLL CB   1 
ATOM   4256 C  CG   . ASP C 3 68  ? 40.459  29.294 13.603 1.000 42.031 ? 68  ASP LLL CG   1 
ATOM   4257 O  OD1  . ASP C 3 68  ? 41.377  28.480 13.382 1.000 43.815 ? 68  ASP LLL OD1  1 
ATOM   4258 O  OD2  . ASP C 3 68  ? 40.653  30.456 13.994 1.000 42.499 ? 68  ASP LLL OD2  1 
ATOM   4259 H  H    . ASP C 3 68  ? 36.674  27.604 14.197 1.000 37.877 ? 68  ASP LLL H    1 
ATOM   4260 H  HA   . ASP C 3 68  ? 39.295  26.809 13.703 1.000 39.798 ? 68  ASP LLL HA   1 
ATOM   4261 H  HB2  . ASP C 3 68  ? 38.861  28.760 12.432 1.000 40.418 ? 68  ASP LLL HB2  1 
ATOM   4262 H  HB3  . ASP C 3 68  ? 38.423  29.527 13.749 1.000 40.061 ? 68  ASP LLL HB3  1 
ATOM   4263 N  N    . PHE C 3 69  ? 39.586  26.611 16.159 1.000 39.861 ? 69  PHE LLL N    1 
ATOM   4264 C  CA   . PHE C 3 69  ? 39.861  26.515 17.616 1.000 40.568 ? 69  PHE LLL CA   1 
ATOM   4265 C  C    . PHE C 3 69  ? 40.663  27.740 18.085 1.000 42.296 ? 69  PHE LLL C    1 
ATOM   4266 O  O    . PHE C 3 69  ? 40.380  28.226 19.196 1.000 43.077 ? 69  PHE LLL O    1 
ATOM   4267 C  CB   . PHE C 3 69  ? 40.548  25.185 17.933 1.000 40.674 ? 69  PHE LLL CB   1 
ATOM   4268 C  CG   . PHE C 3 69  ? 39.666  23.961 17.824 1.000 40.074 ? 69  PHE LLL CG   1 
ATOM   4269 C  CD1  . PHE C 3 69  ? 38.358  24.042 17.362 1.000 38.869 ? 69  PHE LLL CD1  1 
ATOM   4270 C  CD2  . PHE C 3 69  ? 40.160  22.708 18.160 1.000 40.504 ? 69  PHE LLL CD2  1 
ATOM   4271 C  CE1  . PHE C 3 69  ? 37.566  22.908 17.261 1.000 38.210 ? 69  PHE LLL CE1  1 
ATOM   4272 C  CE2  . PHE C 3 69  ? 39.367  21.574 18.053 1.000 39.703 ? 69  PHE LLL CE2  1 
ATOM   4273 C  CZ   . PHE C 3 69  ? 38.072  21.677 17.603 1.000 38.638 ? 69  PHE LLL CZ   1 
ATOM   4274 H  H    . PHE C 3 69  ? 39.975  25.935 15.688 1.000 40.100 ? 69  PHE LLL H    1 
ATOM   4275 H  HA   . PHE C 3 69  ? 38.992  26.532 18.092 1.000 40.115 ? 69  PHE LLL HA   1 
ATOM   4276 H  HB2  . PHE C 3 69  ? 41.309  25.078 17.325 1.000 41.239 ? 69  PHE LLL HB2  1 
ATOM   4277 H  HB3  . PHE C 3 69  ? 40.904  25.233 18.845 1.000 41.208 ? 69  PHE LLL HB3  1 
ATOM   4278 H  HD1  . PHE C 3 69  ? 37.997  24.879 17.124 1.000 38.719 ? 69  PHE LLL HD1  1 
ATOM   4279 H  HD2  . PHE C 3 69  ? 41.049  22.628 18.469 1.000 41.065 ? 69  PHE LLL HD2  1 
ATOM   4280 H  HE1  . PHE C 3 69  ? 36.678  22.982 16.951 1.000 37.811 ? 69  PHE LLL HE1  1 
ATOM   4281 H  HE2  . PHE C 3 69  ? 39.718  20.731 18.292 1.000 39.934 ? 69  PHE LLL HE2  1 
ATOM   4282 H  HZ   . PHE C 3 69  ? 37.532  20.906 17.533 1.000 38.377 ? 69  PHE LLL HZ   1 
ATOM   4283 N  N    . SER C 3 70  ? 41.579  28.267 17.261 1.000 43.609 ? 70  SER LLL N    1 
ATOM   4284 C  CA   . SER C 3 70  ? 42.477  29.402 17.621 1.000 44.937 ? 70  SER LLL CA   1 
ATOM   4285 C  C    . SER C 3 70  ? 41.672  30.666 17.973 1.000 44.056 ? 70  SER LLL C    1 
ATOM   4286 O  O    . SER C 3 70  ? 42.000  31.304 18.990 1.000 44.233 ? 70  SER LLL O    1 
ATOM   4287 C  CB   . SER C 3 70  ? 43.487  29.684 16.532 1.000 46.229 ? 70  SER LLL CB   1 
ATOM   4288 O  OG   . SER C 3 70  ? 44.631  30.340 17.068 1.000 47.385 ? 70  SER LLL OG   1 
ATOM   4289 H  H    . SER C 3 70  ? 41.720  27.966 16.413 1.000 43.554 ? 70  SER LLL H    1 
ATOM   4290 H  HA   . SER C 3 70  ? 42.979  29.132 18.437 1.000 45.390 ? 70  SER LLL HA   1 
ATOM   4291 H  HB2  . SER C 3 70  ? 43.762  28.837 16.113 1.000 46.210 ? 70  SER LLL HB2  1 
ATOM   4292 H  HB3  . SER C 3 70  ? 43.076  30.250 15.841 1.000 45.791 ? 70  SER LLL HB3  1 
ATOM   4293 H  HG   . SER C 3 70  ? 45.354  30.450 16.667 0.000 30.000 ? 70  SER LLL HG   1 
ATOM   4294 N  N    . SER C 3 71  ? 40.672  31.031 17.164 1.000 43.010 ? 71  SER LLL N    1 
ATOM   4295 C  CA   . SER C 3 71  ? 39.831  32.247 17.350 1.000 42.038 ? 71  SER LLL CA   1 
ATOM   4296 C  C    . SER C 3 71  ? 38.495  31.889 18.029 1.000 40.780 ? 71  SER LLL C    1 
ATOM   4297 O  O    . SER C 3 71  ? 37.671  32.811 18.225 1.000 39.846 ? 71  SER LLL O    1 
ATOM   4298 C  CB   . SER C 3 71  ? 39.622  32.972 16.034 1.000 41.508 ? 71  SER LLL CB   1 
ATOM   4299 O  OG   . SER C 3 71  ? 38.855  32.196 15.121 1.000 40.246 ? 71  SER LLL OG   1 
ATOM   4300 H  H    . SER C 3 71  ? 40.428  30.553 16.427 1.000 42.633 ? 71  SER LLL H    1 
ATOM   4301 H  HA   . SER C 3 71  ? 40.322  32.861 17.960 1.000 42.533 ? 71  SER LLL HA   1 
ATOM   4302 H  HB2  . SER C 3 71  ? 39.161  33.825 16.204 1.000 41.242 ? 71  SER LLL HB2  1 
ATOM   4303 H  HB3  . SER C 3 71  ? 40.498  33.175 15.634 1.000 42.165 ? 71  SER LLL HB3  1 
ATOM   4304 H  HG   . SER C 3 71  ? 38.831  32.772 14.433 0.000 30.000 ? 71  SER LLL HG   1 
ATOM   4305 N  N    . ASN C 3 72  ? 38.298  30.609 18.379 1.000 40.136 ? 72  ASN LLL N    1 
ATOM   4306 C  CA   . ASN C 3 72  ? 37.085  30.066 19.056 1.000 38.836 ? 72  ASN LLL CA   1 
ATOM   4307 C  C    . ASN C 3 72  ? 35.843  30.481 18.260 1.000 38.068 ? 72  ASN LLL C    1 
ATOM   4308 O  O    . ASN C 3 72  ? 34.905  31.047 18.860 1.000 38.718 ? 72  ASN LLL O    1 
ATOM   4309 C  CB   . ASN C 3 72  ? 36.998  30.516 20.520 1.000 38.613 ? 72  ASN LLL CB   1 
ATOM   4310 C  CG   . ASN C 3 72  ? 36.230  29.546 21.392 1.000 37.840 ? 72  ASN LLL CG   1 
ATOM   4311 O  OD1  . ASN C 3 72  ? 36.441  28.341 21.317 1.000 38.261 ? 72  ASN LLL OD1  1 
ATOM   4312 N  ND2  . ASN C 3 72  ? 35.337  30.057 22.222 1.000 37.124 ? 72  ASN LLL ND2  1 
ATOM   4313 H  H    . ASN C 3 72  ? 38.917  29.966 18.214 1.000 40.427 ? 72  ASN LLL H    1 
ATOM   4314 H  HA   . ASN C 3 72  ? 37.146  29.083 19.047 1.000 38.820 ? 72  ASN LLL HA   1 
ATOM   4315 H  HB2  . ASN C 3 72  ? 37.906  30.610 20.874 1.000 39.283 ? 72  ASN LLL HB2  1 
ATOM   4316 H  HB3  . ASN C 3 72  ? 36.568  31.395 20.560 1.000 38.447 ? 72  ASN LLL HB3  1 
ATOM   4317 H  HD21 . ASN C 3 72  ? 34.853  29.581 22.770 0.000 30.000 ? 72  ASN LLL HD21 1 
ATOM   4318 H  HD22 . ASN C 3 72  ? 35.125  30.971 22.189 0.000 30.000 ? 72  ASN LLL HD22 1 
ATOM   4319 N  N    . SER C 3 73  ? 35.846  30.215 16.953 1.000 37.319 ? 73  SER LLL N    1 
ATOM   4320 C  CA   . SER C 3 73  ? 34.799  30.664 16.002 1.000 36.499 ? 73  SER LLL CA   1 
ATOM   4321 C  C    . SER C 3 73  ? 34.442  29.534 15.044 1.000 35.475 ? 73  SER LLL C    1 
ATOM   4322 O  O    . SER C 3 73  ? 35.314  28.698 14.756 1.000 35.436 ? 73  SER LLL O    1 
ATOM   4323 C  CB   . SER C 3 73  ? 35.258  31.869 15.231 1.000 37.527 ? 73  SER LLL CB   1 
ATOM   4324 O  OG   . SER C 3 73  ? 36.408  31.553 14.455 1.000 38.823 ? 73  SER LLL OG   1 
ATOM   4325 H  H    . SER C 3 73  ? 36.502  29.733 16.544 1.000 37.682 ? 73  SER LLL H    1 
ATOM   4326 H  HA   . SER C 3 73  ? 33.986  30.907 16.520 1.000 36.210 ? 73  SER LLL HA   1 
ATOM   4327 H  HB2  . SER C 3 73  ? 34.534  32.175 14.639 1.000 37.185 ? 73  SER LLL HB2  1 
ATOM   4328 H  HB3  . SER C 3 73  ? 35.472  32.597 15.857 1.000 37.703 ? 73  SER LLL HB3  1 
ATOM   4329 H  HG   . SER C 3 73  ? 36.689  32.222 14.052 0.000 30.000 ? 73  SER LLL HG   1 
ATOM   4330 N  N    . ALA C 3 74  ? 33.199  29.543 14.572 1.000 34.572 ? 74  ALA LLL N    1 
ATOM   4331 C  CA   . ALA C 3 74  ? 32.737  28.809 13.375 1.000 33.976 ? 74  ALA LLL CA   1 
ATOM   4332 C  C    . ALA C 3 74  ? 32.447  29.846 12.292 1.000 33.534 ? 74  ALA LLL C    1 
ATOM   4333 O  O    . ALA C 3 74  ? 32.267  31.019 12.647 1.000 33.598 ? 74  ALA LLL O    1 
ATOM   4334 C  CB   . ALA C 3 74  ? 31.523  27.981 13.704 1.000 33.617 ? 74  ALA LLL CB   1 
ATOM   4335 H  H    . ALA C 3 74  ? 32.525  30.014 14.965 1.000 34.322 ? 74  ALA LLL H    1 
ATOM   4336 H  HA   . ALA C 3 74  ? 33.458  28.218 13.064 1.000 34.275 ? 74  ALA LLL HA   1 
ATOM   4337 H  HB1  . ALA C 3 74  ? 31.357  27.346 12.987 1.000 33.602 ? 74  ALA LLL HB1  1 
ATOM   4338 H  HB2  . ALA C 3 74  ? 31.673  27.499 14.535 1.000 33.609 ? 74  ALA LLL HB2  1 
ATOM   4339 H  HB3  . ALA C 3 74  ? 30.750  28.562 13.805 1.000 33.386 ? 74  ALA LLL HB3  1 
ATOM   4340 N  N    . SER C 3 75  ? 32.429  29.423 11.029 1.000 33.517 ? 75  SER LLL N    1 
ATOM   4341 C  CA   . SER C 3 75  ? 32.202  30.286 9.841  1.000 33.143 ? 75  SER LLL CA   1 
ATOM   4342 C  C    . SER C 3 75  ? 31.320  29.560 8.831  1.000 33.002 ? 75  SER LLL C    1 
ATOM   4343 O  O    . SER C 3 75  ? 31.555  28.369 8.572  1.000 32.796 ? 75  SER LLL O    1 
ATOM   4344 C  CB   . SER C 3 75  ? 33.498  30.693 9.187  1.000 33.390 ? 75  SER LLL CB   1 
ATOM   4345 O  OG   . SER C 3 75  ? 34.188  31.631 9.986  1.000 33.331 ? 75  SER LLL OG   1 
ATOM   4346 H  H    . SER C 3 75  ? 32.561  28.551 10.799 1.000 33.482 ? 75  SER LLL H    1 
ATOM   4347 H  HA   . SER C 3 75  ? 31.728  31.106 10.141 1.000 32.960 ? 75  SER LLL HA   1 
ATOM   4348 H  HB2  . SER C 3 75  ? 34.061  29.898 9.054  1.000 33.696 ? 75  SER LLL HB2  1 
ATOM   4349 H  HB3  . SER C 3 75  ? 33.310  31.088 8.305  1.000 33.712 ? 75  SER LLL HB3  1 
ATOM   4350 H  HG   . SER C 3 75  ? 34.821  31.825 9.519  0.000 30.000 ? 75  SER LLL HG   1 
ATOM   4351 N  N    . LEU C 3 76  ? 30.361  30.288 8.274  1.000 33.373 ? 76  LEU LLL N    1 
ATOM   4352 C  CA   . LEU C 3 76  ? 29.654  29.942 7.019  1.000 33.806 ? 76  LEU LLL CA   1 
ATOM   4353 C  C    . LEU C 3 76  ? 30.372  30.674 5.882  1.000 34.147 ? 76  LEU LLL C    1 
ATOM   4354 O  O    . LEU C 3 76  ? 30.557  31.886 6.012  1.000 33.111 ? 76  LEU LLL O    1 
ATOM   4355 C  CB   . LEU C 3 76  ? 28.192  30.382 7.163  1.000 33.858 ? 76  LEU LLL CB   1 
ATOM   4356 C  CG   . LEU C 3 76  ? 27.284  30.106 5.967  1.000 34.648 ? 76  LEU LLL CG   1 
ATOM   4357 C  CD1  . LEU C 3 76  ? 27.404  28.660 5.500  1.000 34.778 ? 76  LEU LLL CD1  1 
ATOM   4358 C  CD2  . LEU C 3 76  ? 25.843  30.448 6.309  1.000 34.463 ? 76  LEU LLL CD2  1 
ATOM   4359 H  H    . LEU C 3 76  ? 30.073  31.070 8.643  1.000 33.138 ? 76  LEU LLL H    1 
ATOM   4360 H  HA   . LEU C 3 76  ? 29.707  28.969 6.875  1.000 33.829 ? 76  LEU LLL HA   1 
ATOM   4361 H  HB2  . LEU C 3 76  ? 27.815  29.932 7.944  1.000 33.488 ? 76  LEU LLL HB2  1 
ATOM   4362 H  HB3  . LEU C 3 76  ? 28.178  31.343 7.344  1.000 33.809 ? 76  LEU LLL HB3  1 
ATOM   4363 H  HG   . LEU C 3 76  ? 27.569  30.693 5.224  1.000 34.992 ? 76  LEU LLL HG   1 
ATOM   4364 H  HD11 . LEU C 3 76  ? 28.224  28.551 4.987  1.000 35.179 ? 76  LEU LLL HD11 1 
ATOM   4365 H  HD12 . LEU C 3 76  ? 26.641  28.435 4.940  1.000 35.033 ? 76  LEU LLL HD12 1 
ATOM   4366 H  HD13 . LEU C 3 76  ? 27.425  28.069 6.272  1.000 34.449 ? 76  LEU LLL HD13 1 
ATOM   4367 H  HD21 . LEU C 3 76  ? 25.540  29.882 7.040  1.000 34.112 ? 76  LEU LLL HD21 1 
ATOM   4368 H  HD22 . LEU C 3 76  ? 25.280  30.299 5.530  1.000 34.794 ? 76  LEU LLL HD22 1 
ATOM   4369 H  HD23 . LEU C 3 76  ? 25.785  31.382 6.577  1.000 34.322 ? 76  LEU LLL HD23 1 
ATOM   4370 N  N    . THR C 3 77  ? 30.810  29.950 4.850  1.000 35.312 ? 77  THR LLL N    1 
ATOM   4371 C  CA   . THR C 3 77  ? 31.411  30.513 3.612  1.000 36.714 ? 77  THR LLL CA   1 
ATOM   4372 C  C    . THR C 3 77  ? 30.493  30.197 2.428  1.000 37.988 ? 77  THR LLL C    1 
ATOM   4373 O  O    . THR C 3 77  ? 30.032  29.039 2.333  1.000 37.699 ? 77  THR LLL O    1 
ATOM   4374 C  CB   . THR C 3 77  ? 32.822  29.969 3.366  1.000 37.345 ? 77  THR LLL CB   1 
ATOM   4375 O  OG1  . THR C 3 77  ? 33.608  30.186 4.536  1.000 37.071 ? 77  THR LLL OG1  1 
ATOM   4376 C  CG2  . THR C 3 77  ? 33.506  30.629 2.189  1.000 38.432 ? 77  THR LLL CG2  1 
ATOM   4377 H  H    . THR C 3 77  ? 30.771  29.040 4.832  1.000 35.244 ? 77  THR LLL H    1 
ATOM   4378 H  HA   . THR C 3 77  ? 31.465  31.490 3.714  1.000 36.815 ? 77  THR LLL HA   1 
ATOM   4379 H  HB   . THR C 3 77  ? 32.758  28.999 3.197  1.000 37.359 ? 77  THR LLL HB   1 
ATOM   4380 H  HG1  . THR C 3 77  ? 34.457  29.981 4.291  0.000 30.000 ? 77  THR LLL HG1  1 
ATOM   4381 H  HG21 . THR C 3 77  ? 33.183  30.233 1.360  1.000 38.863 ? 77  THR LLL HG21 1 
ATOM   4382 H  HG22 . THR C 3 77  ? 34.468  30.498 2.256  1.000 38.841 ? 77  THR LLL HG22 1 
ATOM   4383 H  HG23 . THR C 3 77  ? 33.308  31.583 2.191  1.000 38.463 ? 77  THR LLL HG23 1 
ATOM   4384 N  N    . ILE C 3 78  ? 30.240  31.191 1.570  1.000 39.064 ? 78  ILE LLL N    1 
ATOM   4385 C  CA   . ILE C 3 78  ? 29.408  31.052 0.340  1.000 40.383 ? 78  ILE LLL CA   1 
ATOM   4386 C  C    . ILE C 3 78  ? 30.217  31.570 -0.854 1.000 42.723 ? 78  ILE LLL C    1 
ATOM   4387 O  O    . ILE C 3 78  ? 30.435  32.795 -0.926 1.000 43.241 ? 78  ILE LLL O    1 
ATOM   4388 C  CB   . ILE C 3 78  ? 28.069  31.797 0.492  1.000 39.980 ? 78  ILE LLL CB   1 
ATOM   4389 C  CG1  . ILE C 3 78  ? 27.411  31.522 1.847  1.000 39.118 ? 78  ILE LLL CG1  1 
ATOM   4390 C  CG2  . ILE C 3 78  ? 27.145  31.460 -0.667 1.000 40.784 ? 78  ILE LLL CG2  1 
ATOM   4391 C  CD1  . ILE C 3 78  ? 26.064  32.198 2.042  1.000 38.740 ? 78  ILE LLL CD1  1 
ATOM   4392 H  H    . ILE C 3 78  ? 30.567  32.033 1.688  1.000 39.175 ? 78  ILE LLL H    1 
ATOM   4393 H  HA   . ILE C 3 78  ? 29.217  30.111 0.200  1.000 40.480 ? 78  ILE LLL HA   1 
ATOM   4394 H  HB   . ILE C 3 78  ? 28.261  32.766 0.449  1.000 40.187 ? 78  ILE LLL HB   1 
ATOM   4395 H  HG12 . ILE C 3 78  ? 27.293  30.554 1.947  1.000 38.910 ? 78  ILE LLL HG12 1 
ATOM   4396 H  HG13 . ILE C 3 78  ? 28.016  31.825 2.558  1.000 38.660 ? 78  ILE LLL HG13 1 
ATOM   4397 H  HG21 . ILE C 3 78  ? 27.630  31.530 -1.506 1.000 41.580 ? 78  ILE LLL HG21 1 
ATOM   4398 H  HG22 . ILE C 3 78  ? 26.394  32.079 -0.679 1.000 40.730 ? 78  ILE LLL HG22 1 
ATOM   4399 H  HG23 . ILE C 3 78  ? 26.811  30.552 -0.563 1.000 40.613 ? 78  ILE LLL HG23 1 
ATOM   4400 H  HD11 . ILE C 3 78  ? 25.990  32.957 1.439  1.000 39.224 ? 78  ILE LLL HD11 1 
ATOM   4401 H  HD12 . ILE C 3 78  ? 25.985  32.507 2.961  1.000 38.170 ? 78  ILE LLL HD12 1 
ATOM   4402 H  HD13 . ILE C 3 78  ? 25.351  31.564 1.852  1.000 38.849 ? 78  ILE LLL HD13 1 
ATOM   4403 N  N    . SER C 3 79  ? 30.641  30.668 -1.747 1.000 44.618 ? 79  SER LLL N    1 
ATOM   4404 C  CA   . SER C 3 79  ? 31.370  30.980 -3.004 1.000 46.802 ? 79  SER LLL CA   1 
ATOM   4405 C  C    . SER C 3 79  ? 30.370  31.284 -4.121 1.000 48.620 ? 79  SER LLL C    1 
ATOM   4406 O  O    . SER C 3 79  ? 29.269  30.697 -4.095 1.000 49.591 ? 79  SER LLL O    1 
ATOM   4407 C  CB   . SER C 3 79  ? 32.272  29.854 -3.400 1.000 47.522 ? 79  SER LLL CB   1 
ATOM   4408 O  OG   . SER C 3 79  ? 33.285  29.677 -2.429 1.000 47.949 ? 79  SER LLL OG   1 
ATOM   4409 H  H    . SER C 3 79  ? 30.505  29.773 -1.643 1.000 44.335 ? 79  SER LLL H    1 
ATOM   4410 H  HA   . SER C 3 79  ? 31.922  31.791 -2.849 1.000 46.996 ? 79  SER LLL HA   1 
ATOM   4411 H  HB2  . SER C 3 79  ? 31.747  29.026 -3.486 1.000 47.536 ? 79  SER LLL HB2  1 
ATOM   4412 H  HB3  . SER C 3 79  ? 32.682  30.052 -4.272 1.000 48.790 ? 79  SER LLL HB3  1 
ATOM   4413 H  HG   . SER C 3 79  ? 33.760  29.151 -2.635 0.000 30.000 ? 79  SER LLL HG   1 
ATOM   4414 N  N    . GLY C 3 80  ? 30.752  32.151 -5.065 1.000 49.828 ? 80  GLY LLL N    1 
ATOM   4415 C  CA   . GLY C 3 80  ? 29.934  32.506 -6.240 1.000 50.571 ? 80  GLY LLL CA   1 
ATOM   4416 C  C    . GLY C 3 80  ? 28.527  32.897 -5.831 1.000 49.769 ? 80  GLY LLL C    1 
ATOM   4417 O  O    . GLY C 3 80  ? 27.584  32.163 -6.189 1.000 50.459 ? 80  GLY LLL O    1 
ATOM   4418 H  H    . GLY C 3 80  ? 31.557  32.577 -5.032 1.000 50.049 ? 80  GLY LLL H    1 
ATOM   4419 H  HA2  . GLY C 3 80  ? 30.359  33.257 -6.715 1.000 51.342 ? 80  GLY LLL HA2  1 
ATOM   4420 H  HA3  . GLY C 3 80  ? 29.896  31.731 -6.854 1.000 51.258 ? 80  GLY LLL HA3  1 
ATOM   4421 N  N    . LEU C 3 81  ? 28.399  34.002 -5.091 1.000 48.704 ? 81  LEU LLL N    1 
ATOM   4422 C  CA   . LEU C 3 81  ? 27.110  34.552 -4.599 1.000 48.045 ? 81  LEU LLL CA   1 
ATOM   4423 C  C    . LEU C 3 81  ? 26.140  34.705 -5.772 1.000 49.937 ? 81  LEU LLL C    1 
ATOM   4424 O  O    . LEU C 3 81  ? 26.567  35.196 -6.831 1.000 51.451 ? 81  LEU LLL O    1 
ATOM   4425 C  CB   . LEU C 3 81  ? 27.355  35.908 -3.930 1.000 47.351 ? 81  LEU LLL CB   1 
ATOM   4426 C  CG   . LEU C 3 81  ? 28.084  35.870 -2.588 1.000 46.281 ? 81  LEU LLL CG   1 
ATOM   4427 C  CD1  . LEU C 3 81  ? 28.526  37.266 -2.179 1.000 46.416 ? 81  LEU LLL CD1  1 
ATOM   4428 C  CD2  . LEU C 3 81  ? 27.217  35.251 -1.502 1.000 44.762 ? 81  LEU LLL CD2  1 
ATOM   4429 H  H    . LEU C 3 81  ? 29.121  34.498 -4.843 1.000 48.774 ? 81  LEU LLL H    1 
ATOM   4430 H  HA   . LEU C 3 81  ? 26.729  33.921 -3.947 1.000 47.354 ? 81  LEU LLL HA   1 
ATOM   4431 H  HB2  . LEU C 3 81  ? 27.872  36.465 -4.546 1.000 48.242 ? 81  LEU LLL HB2  1 
ATOM   4432 H  HB3  . LEU C 3 81  ? 26.490  36.344 -3.797 1.000 47.173 ? 81  LEU LLL HB3  1 
ATOM   4433 H  HG   . LEU C 3 81  ? 28.892  35.310 -2.692 1.000 46.490 ? 81  LEU LLL HG   1 
ATOM   4434 H  HD11 . LEU C 3 81  ? 29.135  37.624 -2.849 1.000 47.196 ? 81  LEU LLL HD11 1 
ATOM   4435 H  HD12 . LEU C 3 81  ? 28.980  37.225 -1.320 1.000 45.675 ? 81  LEU LLL HD12 1 
ATOM   4436 H  HD13 . LEU C 3 81  ? 27.748  37.846 -2.107 1.000 46.143 ? 81  LEU LLL HD13 1 
ATOM   4437 H  HD21 . LEU C 3 81  ? 26.376  35.736 -1.441 1.000 44.697 ? 81  LEU LLL HD21 1 
ATOM   4438 H  HD22 . LEU C 3 81  ? 27.683  35.301 -0.649 1.000 44.191 ? 81  LEU LLL HD22 1 
ATOM   4439 H  HD23 . LEU C 3 81  ? 27.039  34.320 -1.718 1.000 44.938 ? 81  LEU LLL HD23 1 
ATOM   4440 N  N    . GLU C 3 82  ? 24.888  34.288 -5.573 1.000 50.874 ? 82  GLU LLL N    1 
ATOM   4441 C  CA   . GLU C 3 82  ? 23.726  34.595 -6.450 1.000 52.799 ? 82  GLU LLL CA   1 
ATOM   4442 C  C    . GLU C 3 82  ? 22.727  35.421 -5.635 1.000 51.892 ? 82  GLU LLL C    1 
ATOM   4443 O  O    . GLU C 3 82  ? 22.844  35.407 -4.401 1.000 51.314 ? 82  GLU LLL O    1 
ATOM   4444 C  CB   . GLU C 3 82  ? 23.117  33.288 -6.955 1.000 54.341 ? 82  GLU LLL CB   1 
ATOM   4445 C  CG   . GLU C 3 82  ? 23.976  32.600 -7.999 1.000 56.314 ? 82  GLU LLL CG   1 
ATOM   4446 C  CD   . GLU C 3 82  ? 23.930  31.086 -7.962 1.000 57.239 ? 82  GLU LLL CD   1 
ATOM   4447 O  OE1  . GLU C 3 82  ? 22.825  30.531 -7.775 1.000 57.760 ? 82  GLU LLL OE1  1 
ATOM   4448 O  OE2  . GLU C 3 82  ? 25.005  30.465 -8.113 1.000 58.746 ? 82  GLU LLL OE2  1 
ATOM   4449 H  H    . GLU C 3 82  ? 24.663  33.768 -4.860 1.000 49.961 ? 82  GLU LLL H    1 
ATOM   4450 H  HA   . GLU C 3 82  ? 24.036  35.128 -7.217 1.000 53.734 ? 82  GLU LLL HA   1 
ATOM   4451 H  HB2  . GLU C 3 82  ? 22.991  32.684 -6.193 1.000 53.390 ? 82  GLU LLL HB2  1 
ATOM   4452 H  HB3  . GLU C 3 82  ? 22.236  33.479 -7.340 1.000 54.794 ? 82  GLU LLL HB3  1 
ATOM   4453 H  HG2  . GLU C 3 82  ? 23.689  32.895 -8.890 1.000 57.509 ? 82  GLU LLL HG2  1 
ATOM   4454 H  HG3  . GLU C 3 82  ? 24.908  32.884 -7.882 1.000 56.272 ? 82  GLU LLL HG3  1 
ATOM   4455 N  N    . SER C 3 83  ? 21.786  36.106 -6.289 1.000 52.528 ? 83  SER LLL N    1 
ATOM   4456 C  CA   . SER C 3 83  ? 20.732  36.930 -5.633 1.000 51.945 ? 83  SER LLL CA   1 
ATOM   4457 C  C    . SER C 3 83  ? 20.051  36.134 -4.511 1.000 51.173 ? 83  SER LLL C    1 
ATOM   4458 O  O    . SER C 3 83  ? 19.804  36.728 -3.441 1.000 50.303 ? 83  SER LLL O    1 
ATOM   4459 C  CB   . SER C 3 83  ? 19.709  37.413 -6.627 1.000 52.961 ? 83  SER LLL CB   1 
ATOM   4460 O  OG   . SER C 3 83  ? 20.306  38.242 -7.608 1.000 53.973 ? 83  SER LLL OG   1 
ATOM   4461 H  H    . SER C 3 83  ? 21.721  36.120 -7.198 1.000 53.648 ? 83  SER LLL H    1 
ATOM   4462 H  HA   . SER C 3 83  ? 21.173  37.723 -5.226 1.000 51.509 ? 83  SER LLL HA   1 
ATOM   4463 H  HB2  . SER C 3 83  ? 19.288  36.638 -7.064 1.000 53.564 ? 83  SER LLL HB2  1 
ATOM   4464 H  HB3  . SER C 3 83  ? 19.008  37.916 -6.155 1.000 52.606 ? 83  SER LLL HB3  1 
ATOM   4465 H  HG   . SER C 3 83  ? 19.659  38.503 -7.965 0.000 30.000 ? 83  SER LLL HG   1 
ATOM   4466 N  N    . GLU C 3 84  ? 19.767  34.847 -4.760 1.000 51.904 ? 84  GLU LLL N    1 
ATOM   4467 C  CA   . GLU C 3 84  ? 18.977  33.944 -3.876 1.000 51.397 ? 84  GLU LLL CA   1 
ATOM   4468 C  C    . GLU C 3 84  ? 19.643  33.854 -2.496 1.000 48.717 ? 84  GLU LLL C    1 
ATOM   4469 O  O    . GLU C 3 84  ? 18.930  33.567 -1.515 1.000 48.078 ? 84  GLU LLL O    1 
ATOM   4470 C  CB   . GLU C 3 84  ? 18.828  32.557 -4.516 1.000 53.906 ? 84  GLU LLL CB   1 
ATOM   4471 C  CG   . GLU C 3 84  ? 19.976  31.595 -4.208 1.000 55.151 ? 84  GLU LLL CG   1 
ATOM   4472 C  CD   . GLU C 3 84  ? 19.973  30.266 -4.957 1.000 57.219 ? 84  GLU LLL CD   1 
ATOM   4473 O  OE1  . GLU C 3 84  ? 18.939  29.923 -5.567 1.000 58.800 ? 84  GLU LLL OE1  1 
ATOM   4474 O  OE2  . GLU C 3 84  ? 21.010  29.565 -4.926 1.000 57.963 ? 84  GLU LLL OE2  1 
ATOM   4475 H  H    . GLU C 3 84  ? 20.049  34.436 -5.521 1.000 52.624 ? 84  GLU LLL H    1 
ATOM   4476 H  HA   . GLU C 3 84  ? 18.079  34.335 -3.763 1.000 51.580 ? 84  GLU LLL HA   1 
ATOM   4477 H  HB2  . GLU C 3 84  ? 17.990  32.158 -4.201 1.000 53.823 ? 84  GLU LLL HB2  1 
ATOM   4478 H  HB3  . GLU C 3 84  ? 18.759  32.666 -5.488 1.000 54.933 ? 84  GLU LLL HB3  1 
ATOM   4479 H  HG2  . GLU C 3 84  ? 20.824  32.050 -4.401 1.000 55.031 ? 84  GLU LLL HG2  1 
ATOM   4480 H  HG3  . GLU C 3 84  ? 19.967  31.396 -3.248 1.000 54.058 ? 84  GLU LLL HG3  1 
ATOM   4481 N  N    . ASP C 3 85  ? 20.958  34.075 -2.430 1.000 47.103 ? 85  ASP LLL N    1 
ATOM   4482 C  CA   . ASP C 3 85  ? 21.772  33.969 -1.190 1.000 45.077 ? 85  ASP LLL CA   1 
ATOM   4483 C  C    . ASP C 3 85  ? 21.557  35.189 -0.291 1.000 44.061 ? 85  ASP LLL C    1 
ATOM   4484 O  O    . ASP C 3 85  ? 21.970  35.116 0.877  1.000 43.889 ? 85  ASP LLL O    1 
ATOM   4485 C  CB   . ASP C 3 85  ? 23.258  33.810 -1.505 1.000 44.712 ? 85  ASP LLL CB   1 
ATOM   4486 C  CG   . ASP C 3 85  ? 23.572  32.548 -2.285 1.000 45.240 ? 85  ASP LLL CG   1 
ATOM   4487 O  OD1  . ASP C 3 85  ? 22.762  31.597 -2.205 1.000 45.398 ? 85  ASP LLL OD1  1 
ATOM   4488 O  OD2  . ASP C 3 85  ? 24.616  32.531 -2.970 1.000 45.329 ? 85  ASP LLL OD2  1 
ATOM   4489 H  H    . ASP C 3 85  ? 21.453  34.293 -3.162 1.000 47.855 ? 85  ASP LLL H    1 
ATOM   4490 H  HA   . ASP C 3 85  ? 21.475  33.168 -0.698 1.000 44.687 ? 85  ASP LLL HA   1 
ATOM   4491 H  HB2  . ASP C 3 85  ? 23.562  34.581 -2.024 1.000 45.306 ? 85  ASP LLL HB2  1 
ATOM   4492 H  HB3  . ASP C 3 85  ? 23.763  33.788 -0.666 1.000 44.081 ? 85  ASP LLL HB3  1 
ATOM   4493 N  N    . GLU C 3 86  ? 20.956  36.269 -0.797 1.000 44.357 ? 86  GLU LLL N    1 
ATOM   4494 C  CA   . GLU C 3 86  ? 20.563  37.420 0.055  1.000 43.519 ? 86  GLU LLL CA   1 
ATOM   4495 C  C    . GLU C 3 86  ? 19.538  36.926 1.078  1.000 42.314 ? 86  GLU LLL C    1 
ATOM   4496 O  O    . GLU C 3 86  ? 18.465  36.440 0.662  1.000 42.707 ? 86  GLU LLL O    1 
ATOM   4497 C  CB   . GLU C 3 86  ? 19.999  38.577 -0.760 1.000 44.974 ? 86  GLU LLL CB   1 
ATOM   4498 C  CG   . GLU C 3 86  ? 19.692  39.794 0.092  1.000 44.754 ? 86  GLU LLL CG   1 
ATOM   4499 C  CD   . GLU C 3 86  ? 19.799  41.121 -0.640 1.000 46.217 ? 86  GLU LLL CD   1 
ATOM   4500 O  OE1  . GLU C 3 86  ? 20.756  41.285 -1.443 1.000 46.578 ? 86  GLU LLL OE1  1 
ATOM   4501 O  OE2  . GLU C 3 86  ? 18.926  41.987 -0.406 1.000 46.932 ? 86  GLU LLL OE2  1 
ATOM   4502 H  H    . GLU C 3 86  ? 20.766  36.371 -1.681 1.000 45.176 ? 86  GLU LLL H    1 
ATOM   4503 H  HA   . GLU C 3 86  ? 21.362  37.732 0.534  1.000 43.108 ? 86  GLU LLL HA   1 
ATOM   4504 H  HB2  . GLU C 3 86  ? 20.647  38.820 -1.453 1.000 45.452 ? 86  GLU LLL HB2  1 
ATOM   4505 H  HB3  . GLU C 3 86  ? 19.177  38.279 -1.204 1.000 45.428 ? 86  GLU LLL HB3  1 
ATOM   4506 H  HG2  . GLU C 3 86  ? 18.782  39.710 0.449  1.000 44.722 ? 86  GLU LLL HG2  1 
ATOM   4507 H  HG3  . GLU C 3 86  ? 20.307  39.812 0.855  1.000 44.150 ? 86  GLU LLL HG3  1 
ATOM   4508 N  N    . ALA C 3 87  ? 19.877  37.046 2.362  1.000 40.391 ? 87  ALA LLL N    1 
ATOM   4509 C  CA   . ALA C 3 87  ? 19.196  36.365 3.481  1.000 39.369 ? 87  ALA LLL CA   1 
ATOM   4510 C  C    . ALA C 3 87  ? 19.845  36.755 4.810  1.000 38.276 ? 87  ALA LLL C    1 
ATOM   4511 O  O    . ALA C 3 87  ? 20.958  37.318 4.793  1.000 38.428 ? 87  ALA LLL O    1 
ATOM   4512 C  CB   . ALA C 3 87  ? 19.282  34.879 3.265  1.000 39.762 ? 87  ALA LLL CB   1 
ATOM   4513 H  H    . ALA C 3 87  ? 20.565  37.572 2.646  1.000 40.226 ? 87  ALA LLL H    1 
ATOM   4514 H  HA   . ALA C 3 87  ? 18.249  36.639 3.493  1.000 39.685 ? 87  ALA LLL HA   1 
ATOM   4515 H  HB1  . ALA C 3 87  ? 19.133  34.418 4.107  1.000 39.229 ? 87  ALA LLL HB1  1 
ATOM   4516 H  HB2  . ALA C 3 87  ? 18.605  34.604 2.623  1.000 40.277 ? 87  ALA LLL HB2  1 
ATOM   4517 H  HB3  . ALA C 3 87  ? 20.162  34.650 2.922  1.000 39.719 ? 87  ALA LLL HB3  1 
ATOM   4518 N  N    . ASP C 3 88  ? 19.159  36.457 5.916  1.000 37.264 ? 88  ASP LLL N    1 
ATOM   4519 C  CA   . ASP C 3 88  ? 19.714  36.512 7.292  1.000 35.774 ? 88  ASP LLL CA   1 
ATOM   4520 C  C    . ASP C 3 88  ? 20.273  35.127 7.614  1.000 34.682 ? 88  ASP LLL C    1 
ATOM   4521 O  O    . ASP C 3 88  ? 19.575  34.136 7.332  1.000 35.166 ? 88  ASP LLL O    1 
ATOM   4522 C  CB   . ASP C 3 88  ? 18.661  36.949 8.312  1.000 35.827 ? 88  ASP LLL CB   1 
ATOM   4523 C  CG   . ASP C 3 88  ? 18.146  38.360 8.089  1.000 36.073 ? 88  ASP LLL CG   1 
ATOM   4524 O  OD1  . ASP C 3 88  ? 18.943  39.213 7.664  1.000 35.778 ? 88  ASP LLL OD1  1 
ATOM   4525 O  OD2  . ASP C 3 88  ? 16.947  38.589 8.337  1.000 36.820 ? 88  ASP LLL OD2  1 
ATOM   4526 H  H    . ASP C 3 88  ? 18.286  36.195 5.888  1.000 37.462 ? 88  ASP LLL H    1 
ATOM   4527 H  HA   . ASP C 3 88  ? 20.450  37.163 7.304  1.000 35.639 ? 88  ASP LLL HA   1 
ATOM   4528 H  HB2  . ASP C 3 88  ? 17.901  36.333 8.270  1.000 36.041 ? 88  ASP LLL HB2  1 
ATOM   4529 H  HB3  . ASP C 3 88  ? 19.046  36.899 9.210  1.000 35.404 ? 88  ASP LLL HB3  1 
ATOM   4530 N  N    . TYR C 3 89  ? 21.495  35.067 8.145  1.000 33.219 ? 89  TYR LLL N    1 
ATOM   4531 C  CA   . TYR C 3 89  ? 22.182  33.807 8.512  1.000 32.581 ? 89  TYR LLL CA   1 
ATOM   4532 C  C    . TYR C 3 89  ? 22.445  33.825 10.011 1.000 32.137 ? 89  TYR LLL C    1 
ATOM   4533 O  O    . TYR C 3 89  ? 22.973  34.828 10.501 1.000 32.680 ? 89  TYR LLL O    1 
ATOM   4534 C  CB   . TYR C 3 89  ? 23.461  33.632 7.695  1.000 32.427 ? 89  TYR LLL CB   1 
ATOM   4535 C  CG   . TYR C 3 89  ? 23.191  33.429 6.229  1.000 32.696 ? 89  TYR LLL CG   1 
ATOM   4536 C  CD1  . TYR C 3 89  ? 23.048  34.511 5.374  1.000 32.848 ? 89  TYR LLL CD1  1 
ATOM   4537 C  CD2  . TYR C 3 89  ? 23.032  32.156 5.705  1.000 32.635 ? 89  TYR LLL CD2  1 
ATOM   4538 C  CE1  . TYR C 3 89  ? 22.784  34.331 4.025  1.000 33.691 ? 89  TYR LLL CE1  1 
ATOM   4539 C  CE2  . TYR C 3 89  ? 22.764  31.960 4.360  1.000 33.252 ? 89  TYR LLL CE2  1 
ATOM   4540 C  CZ   . TYR C 3 89  ? 22.637  33.051 3.518  1.000 33.862 ? 89  TYR LLL CZ   1 
ATOM   4541 O  OH   . TYR C 3 89  ? 22.372  32.870 2.193  1.000 34.552 ? 89  TYR LLL OH   1 
ATOM   4542 H  H    . TYR C 3 89  ? 22.000  35.804 8.322  1.000 33.242 ? 89  TYR LLL H    1 
ATOM   4543 H  HA   . TYR C 3 89  ? 21.580  33.052 8.309  1.000 32.783 ? 89  TYR LLL HA   1 
ATOM   4544 H  HB2  . TYR C 3 89  ? 24.019  34.428 7.813  1.000 32.388 ? 89  TYR LLL HB2  1 
ATOM   4545 H  HB3  . TYR C 3 89  ? 23.955  32.860 8.042  1.000 32.287 ? 89  TYR LLL HB3  1 
ATOM   4546 H  HD1  . TYR C 3 89  ? 23.146  35.385 5.713  1.000 32.766 ? 89  TYR LLL HD1  1 
ATOM   4547 H  HD2  . TYR C 3 89  ? 23.116  31.408 6.272  1.000 32.437 ? 89  TYR LLL HD2  1 
ATOM   4548 H  HE1  . TYR C 3 89  ? 22.695  35.075 3.456  1.000 34.027 ? 89  TYR LLL HE1  1 
ATOM   4549 H  HE2  . TYR C 3 89  ? 22.667  31.086 4.018  1.000 33.546 ? 89  TYR LLL HE2  1 
ATOM   4550 H  HH   . TYR C 3 89  ? 23.014  33.193 1.750  0.000 30.000 ? 89  TYR LLL HH   1 
ATOM   4551 N  N    . TYR C 3 90  ? 22.033  32.760 10.696 1.000 32.228 ? 90  TYR LLL N    1 
ATOM   4552 C  CA   . TYR C 3 90  ? 22.210  32.543 12.152 1.000 32.277 ? 90  TYR LLL CA   1 
ATOM   4553 C  C    . TYR C 3 90  ? 23.049  31.285 12.355 1.000 32.994 ? 90  TYR LLL C    1 
ATOM   4554 O  O    . TYR C 3 90  ? 22.744  30.268 11.698 1.000 33.152 ? 90  TYR LLL O    1 
ATOM   4555 C  CB   . TYR C 3 90  ? 20.857  32.362 12.847 1.000 31.934 ? 90  TYR LLL CB   1 
ATOM   4556 C  CG   . TYR C 3 90  ? 19.937  33.546 12.730 1.000 31.568 ? 90  TYR LLL CG   1 
ATOM   4557 C  CD1  . TYR C 3 90  ? 19.162  33.742 11.600 1.000 31.716 ? 90  TYR LLL CD1  1 
ATOM   4558 C  CD2  . TYR C 3 90  ? 19.854  34.484 13.741 1.000 31.637 ? 90  TYR LLL CD2  1 
ATOM   4559 C  CE1  . TYR C 3 90  ? 18.319  34.834 11.481 1.000 31.743 ? 90  TYR LLL CE1  1 
ATOM   4560 C  CE2  . TYR C 3 90  ? 19.014  35.582 13.639 1.000 31.720 ? 90  TYR LLL CE2  1 
ATOM   4561 C  CZ   . TYR C 3 90  ? 18.245  35.758 12.505 1.000 31.660 ? 90  TYR LLL CZ   1 
ATOM   4562 O  OH   . TYR C 3 90  ? 17.432  36.847 12.396 1.000 32.192 ? 90  TYR LLL OH   1 
ATOM   4563 H  H    . TYR C 3 90  ? 21.598  32.064 10.301 1.000 32.451 ? 90  TYR LLL H    1 
ATOM   4564 H  HA   . TYR C 3 90  ? 22.683  33.319 12.547 1.000 32.145 ? 90  TYR LLL HA   1 
ATOM   4565 H  HB2  . TYR C 3 90  ? 20.413  31.577 12.462 1.000 32.123 ? 90  TYR LLL HB2  1 
ATOM   4566 H  HB3  . TYR C 3 90  ? 21.018  32.178 13.796 1.000 31.841 ? 90  TYR LLL HB3  1 
ATOM   4567 H  HD1  . TYR C 3 90  ? 19.206  33.116 10.897 1.000 31.911 ? 90  TYR LLL HD1  1 
ATOM   4568 H  HD2  . TYR C 3 90  ? 20.374  34.372 14.518 1.000 31.430 ? 90  TYR LLL HD2  1 
ATOM   4569 H  HE1  . TYR C 3 90  ? 17.800  34.949 10.702 1.000 32.152 ? 90  TYR LLL HE1  1 
ATOM   4570 H  HE2  . TYR C 3 90  ? 18.972  36.212 14.339 1.000 31.583 ? 90  TYR LLL HE2  1 
ATOM   4571 H  HH   . TYR C 3 90  ? 16.644  36.592 12.317 0.000 30.000 ? 90  TYR LLL HH   1 
ATOM   4572 N  N    . CYS C 3 91  ? 24.056  31.359 13.229 1.000 33.938 ? 91  CYS LLL N    1 
ATOM   4573 C  CA   . CYS C 3 91  ? 24.700  30.176 13.856 1.000 34.826 ? 91  CYS LLL CA   1 
ATOM   4574 C  C    . CYS C 3 91  ? 23.874  29.748 15.073 1.000 33.614 ? 91  CYS LLL C    1 
ATOM   4575 O  O    . CYS C 3 91  ? 23.252  30.604 15.712 1.000 32.569 ? 91  CYS LLL O    1 
ATOM   4576 C  CB   . CYS C 3 91  ? 26.139  30.448 14.271 1.000 36.902 ? 91  CYS LLL CB   1 
ATOM   4577 S  SG   . CYS C 3 91  ? 26.343  31.991 15.198 1.000 40.822 ? 91  CYS LLL SG   1 
ATOM   4578 H  H    . CYS C 3 91  ? 24.424  32.145 13.507 1.000 33.827 ? 91  CYS LLL H    1 
ATOM   4579 H  HA   . CYS C 3 91  ? 24.699  29.446 13.199 1.000 34.849 ? 91  CYS LLL HA   1 
ATOM   4580 H  HB2  . CYS C 3 91  ? 26.459  29.707 14.825 1.000 37.297 ? 91  CYS LLL HB2  1 
ATOM   4581 H  HB3  . CYS C 3 91  ? 26.701  30.489 13.471 1.000 37.339 ? 91  CYS LLL HB3  1 
ATOM   4582 N  N    . GLN C 3 92  ? 23.848  28.448 15.341 1.000 33.473 ? 92  GLN LLL N    1 
ATOM   4583 C  CA   . GLN C 3 92  ? 23.204  27.838 16.529 1.000 33.427 ? 92  GLN LLL CA   1 
ATOM   4584 C  C    . GLN C 3 92  ? 24.181  26.813 17.096 1.000 33.074 ? 92  GLN LLL C    1 
ATOM   4585 O  O    . GLN C 3 92  ? 24.773  26.078 16.291 1.000 32.870 ? 92  GLN LLL O    1 
ATOM   4586 C  CB   . GLN C 3 92  ? 21.880  27.184 16.132 1.000 33.846 ? 92  GLN LLL CB   1 
ATOM   4587 C  CG   . GLN C 3 92  ? 21.230  26.391 17.253 1.000 34.375 ? 92  GLN LLL CG   1 
ATOM   4588 C  CD   . GLN C 3 92  ? 21.739  24.973 17.305 1.000 34.864 ? 92  GLN LLL CD   1 
ATOM   4589 O  OE1  . GLN C 3 92  ? 21.838  24.302 16.280 1.000 35.527 ? 92  GLN LLL OE1  1 
ATOM   4590 N  NE2  . GLN C 3 92  ? 22.078  24.511 18.501 1.000 34.519 ? 92  GLN LLL NE2  1 
ATOM   4591 H  H    . GLN C 3 92  ? 24.235  27.834 14.789 1.000 33.475 ? 92  GLN LLL H    1 
ATOM   4592 H  HA   . GLN C 3 92  ? 23.037  28.537 17.198 1.000 33.473 ? 92  GLN LLL HA   1 
ATOM   4593 H  HB2  . GLN C 3 92  ? 21.264  27.883 15.835 1.000 33.874 ? 92  GLN LLL HB2  1 
ATOM   4594 H  HB3  . GLN C 3 92  ? 22.044  26.591 15.371 1.000 33.817 ? 92  GLN LLL HB3  1 
ATOM   4595 H  HG2  . GLN C 3 92  ? 21.413  26.832 18.111 1.000 34.491 ? 92  GLN LLL HG2  1 
ATOM   4596 H  HG3  . GLN C 3 92  ? 20.260  26.380 17.120 1.000 34.677 ? 92  GLN LLL HG3  1 
ATOM   4597 H  HE21 . GLN C 3 92  ? 22.270  23.595 18.521 0.000 30.000 ? 92  GLN LLL HE21 1 
ATOM   4598 H  HE22 . GLN C 3 92  ? 22.000  24.927 19.225 0.000 30.000 ? 92  GLN LLL HE22 1 
ATOM   4599 N  N    . SER C 3 93  ? 24.372  26.805 18.415 1.000 33.129 ? 93  SER LLL N    1 
ATOM   4600 C  CA   . SER C 3 93  ? 25.090  25.732 19.150 1.000 33.139 ? 93  SER LLL CA   1 
ATOM   4601 C  C    . SER C 3 93  ? 24.433  25.508 20.517 1.000 32.977 ? 93  SER LLL C    1 
ATOM   4602 O  O    . SER C 3 93  ? 23.421  26.173 20.813 1.000 32.692 ? 93  SER LLL O    1 
ATOM   4603 C  CB   . SER C 3 93  ? 26.554  26.041 19.277 1.000 33.372 ? 93  SER LLL CB   1 
ATOM   4604 O  OG   . SER C 3 93  ? 27.253  24.915 19.790 1.000 33.804 ? 93  SER LLL OG   1 
ATOM   4605 H  H    . SER C 3 93  ? 24.076  27.467 18.967 1.000 33.212 ? 93  SER LLL H    1 
ATOM   4606 H  HA   . SER C 3 93  ? 24.997  24.891 18.626 1.000 33.076 ? 93  SER LLL HA   1 
ATOM   4607 H  HB2  . SER C 3 93  ? 26.917  26.281 18.394 1.000 33.144 ? 93  SER LLL HB2  1 
ATOM   4608 H  HB3  . SER C 3 93  ? 26.677  26.809 19.880 1.000 33.465 ? 93  SER LLL HB3  1 
ATOM   4609 H  HG   . SER C 3 93  ? 28.065  25.014 19.733 0.000 30.000 ? 93  SER LLL HG   1 
ATOM   4610 N  N    . TYR C 3 94  ? 24.994  24.600 21.316 1.000 33.098 ? 94  TYR LLL N    1 
ATOM   4611 C  CA   . TYR C 3 94  ? 24.382  24.106 22.576 1.000 33.526 ? 94  TYR LLL CA   1 
ATOM   4612 C  C    . TYR C 3 94  ? 25.224  24.520 23.784 1.000 33.941 ? 94  TYR LLL C    1 
ATOM   4613 O  O    . TYR C 3 94  ? 26.464  24.571 23.684 1.000 33.759 ? 94  TYR LLL O    1 
ATOM   4614 C  CB   . TYR C 3 94  ? 24.229  22.585 22.543 1.000 33.365 ? 94  TYR LLL CB   1 
ATOM   4615 C  CG   . TYR C 3 94  ? 23.319  22.050 21.467 1.000 32.874 ? 94  TYR LLL CG   1 
ATOM   4616 C  CD1  . TYR C 3 94  ? 23.778  21.862 20.172 1.000 32.343 ? 94  TYR LLL CD1  1 
ATOM   4617 C  CD2  . TYR C 3 94  ? 22.012  21.685 21.751 1.000 33.155 ? 94  TYR LLL CD2  1 
ATOM   4618 C  CE1  . TYR C 3 94  ? 22.958  21.350 19.180 1.000 32.276 ? 94  TYR LLL CE1  1 
ATOM   4619 C  CE2  . TYR C 3 94  ? 21.182  21.161 20.773 1.000 33.264 ? 94  TYR LLL CE2  1 
ATOM   4620 C  CZ   . TYR C 3 94  ? 21.655  20.995 19.482 1.000 32.941 ? 94  TYR LLL CZ   1 
ATOM   4621 O  OH   . TYR C 3 94  ? 20.839  20.501 18.505 1.000 33.693 ? 94  TYR LLL OH   1 
ATOM   4622 H  H    . TYR C 3 94  ? 25.798  24.210 21.144 1.000 33.027 ? 94  TYR LLL H    1 
ATOM   4623 H  HA   . TYR C 3 94  ? 23.486  24.508 22.667 1.000 33.613 ? 94  TYR LLL HA   1 
ATOM   4624 H  HB2  . TYR C 3 94  ? 25.117  22.189 22.428 1.000 33.288 ? 94  TYR LLL HB2  1 
ATOM   4625 H  HB3  . TYR C 3 94  ? 23.887  22.293 23.414 1.000 33.903 ? 94  TYR LLL HB3  1 
ATOM   4626 H  HD1  . TYR C 3 94  ? 24.665  22.098 19.959 1.000 32.118 ? 94  TYR LLL HD1  1 
ATOM   4627 H  HD2  . TYR C 3 94  ? 21.682  21.789 22.628 1.000 33.721 ? 94  TYR LLL HD2  1 
ATOM   4628 H  HE1  . TYR C 3 94  ? 23.286  21.241 18.303 1.000 32.058 ? 94  TYR LLL HE1  1 
ATOM   4629 H  HE2  . TYR C 3 94  ? 20.296  20.933 20.980 1.000 33.661 ? 94  TYR LLL HE2  1 
ATOM   4630 H  HH   . TYR C 3 94  ? 21.165  19.779 18.181 0.000 30.000 ? 94  TYR LLL HH   1 
ATOM   4631 N  N    . TYR C 3 95  ? 24.543  24.805 24.895 1.000 35.032 ? 95  TYR LLL N    1 
ATOM   4632 C  CA   . TYR C 3 95  ? 25.130  24.944 26.251 1.000 36.215 ? 95  TYR LLL CA   1 
ATOM   4633 C  C    . TYR C 3 95  ? 24.160  24.315 27.256 1.000 37.534 ? 95  TYR LLL C    1 
ATOM   4634 O  O    . TYR C 3 95  ? 23.008  24.759 27.314 1.000 37.036 ? 95  TYR LLL O    1 
ATOM   4635 C  CB   . TYR C 3 95  ? 25.442  26.412 26.551 1.000 35.854 ? 95  TYR LLL CB   1 
ATOM   4636 C  CG   . TYR C 3 95  ? 26.251  26.632 27.803 1.000 36.446 ? 95  TYR LLL CG   1 
ATOM   4637 C  CD1  . TYR C 3 95  ? 27.600  26.311 27.851 1.000 36.661 ? 95  TYR LLL CD1  1 
ATOM   4638 C  CD2  . TYR C 3 95  ? 25.671  27.159 28.944 1.000 37.317 ? 95  TYR LLL CD2  1 
ATOM   4639 C  CE1  . TYR C 3 95  ? 28.351  26.504 29.000 1.000 37.433 ? 95  TYR LLL CE1  1 
ATOM   4640 C  CE2  . TYR C 3 95  ? 26.407  27.364 30.099 1.000 38.439 ? 95  TYR LLL CE2  1 
ATOM   4641 C  CZ   . TYR C 3 95  ? 27.750  27.033 30.128 1.000 38.513 ? 95  TYR LLL CZ   1 
ATOM   4642 O  OH   . TYR C 3 95  ? 28.465  27.233 31.269 1.000 39.969 ? 95  TYR LLL OH   1 
ATOM   4643 H  H    . TYR C 3 95  ? 23.642  24.945 24.896 1.000 35.135 ? 95  TYR LLL H    1 
ATOM   4644 H  HA   . TYR C 3 95  ? 25.979  24.433 26.277 1.000 36.180 ? 95  TYR LLL HA   1 
ATOM   4645 H  HB2  . TYR C 3 95  ? 25.930  26.786 25.788 1.000 35.357 ? 95  TYR LLL HB2  1 
ATOM   4646 H  HB3  . TYR C 3 95  ? 24.594  26.898 26.631 1.000 35.951 ? 95  TYR LLL HB3  1 
ATOM   4647 H  HD1  . TYR C 3 95  ? 28.015  25.947 27.087 1.000 36.154 ? 95  TYR LLL HD1  1 
ATOM   4648 H  HD2  . TYR C 3 95  ? 24.756  27.386 28.935 1.000 37.392 ? 95  TYR LLL HD2  1 
ATOM   4649 H  HE1  . TYR C 3 95  ? 29.267  26.278 29.014 1.000 37.668 ? 95  TYR LLL HE1  1 
ATOM   4650 H  HE2  . TYR C 3 95  ? 25.994  27.723 30.867 1.000 38.995 ? 95  TYR LLL HE2  1 
ATOM   4651 H  HH   . TYR C 3 95  ? 29.071  27.738 31.200 0.000 30.000 ? 95  TYR LLL HH   1 
ATOM   4652 N  N    . ARG C 3 96  ? 24.610  23.289 27.988 1.000 39.687 ? 96  ARG LLL N    1 
ATOM   4653 C  CA   . ARG C 3 96  ? 23.809  22.538 28.997 1.000 41.631 ? 96  ARG LLL CA   1 
ATOM   4654 C  C    . ARG C 3 96  ? 22.548  21.959 28.339 1.000 40.580 ? 96  ARG LLL C    1 
ATOM   4655 O  O    . ARG C 3 96  ? 21.494  21.963 28.998 1.000 41.788 ? 96  ARG LLL O    1 
ATOM   4656 C  CB   . ARG C 3 96  ? 23.444  23.456 30.171 1.000 44.515 ? 96  ARG LLL CB   1 
ATOM   4657 C  CG   . ARG C 3 96  ? 24.580  23.714 31.153 1.000 47.232 ? 96  ARG LLL CG   1 
ATOM   4658 C  CD   . ARG C 3 96  ? 24.365  23.047 32.509 1.000 50.382 ? 96  ARG LLL CD   1 
ATOM   4659 N  NE   . ARG C 3 96  ? 24.668  23.934 33.631 1.000 52.613 ? 96  ARG LLL NE   1 
ATOM   4660 C  CZ   . ARG C 3 96  ? 23.989  25.044 33.941 1.000 53.820 ? 96  ARG LLL CZ   1 
ATOM   4661 N  NH1  . ARG C 3 96  ? 22.956  25.434 33.209 1.000 53.274 ? 96  ARG LLL NH1  1 
ATOM   4662 N  NH2  . ARG C 3 96  ? 24.356  25.772 34.983 1.000 55.221 ? 96  ARG LLL NH2  1 
ATOM   4663 H  H    . ARG C 3 96  ? 25.463  22.978 27.909 1.000 39.414 ? 96  ARG LLL H    1 
ATOM   4664 H  HA   . ARG C 3 96  ? 24.357  21.795 29.336 1.000 41.946 ? 96  ARG LLL HA   1 
ATOM   4665 H  HB2  . ARG C 3 96  ? 23.140  24.315 29.813 1.000 44.100 ? 96  ARG LLL HB2  1 
ATOM   4666 H  HB3  . ARG C 3 96  ? 22.694  23.056 30.657 1.000 45.169 ? 96  ARG LLL HB3  1 
ATOM   4667 H  HG2  . ARG C 3 96  ? 25.418  23.380 30.768 1.000 46.732 ? 96  ARG LLL HG2  1 
ATOM   4668 H  HG3  . ARG C 3 96  ? 24.678  24.681 31.284 1.000 47.143 ? 96  ARG LLL HG3  1 
ATOM   4669 H  HD2  . ARG C 3 96  ? 23.433  22.749 32.581 1.000 50.553 ? 96  ARG LLL HD2  1 
ATOM   4670 H  HD3  . ARG C 3 96  ? 24.937  22.252 32.567 1.000 50.383 ? 96  ARG LLL HD3  1 
ATOM   4671 H  HE   . ARG C 3 96  ? 25.342  23.720 34.142 1.000 53.098 ? 96  ARG LLL HE   1 
ATOM   4672 H  HH11 . ARG C 3 96  ? 22.698  24.962 32.517 1.000 52.614 ? 96  ARG LLL HH11 1 
ATOM   4673 H  HH12 . ARG C 3 96  ? 22.521  26.167 33.426 1.000 53.380 ? 96  ARG LLL HH12 1 
ATOM   4674 H  HH21 . ARG C 3 96  ? 25.044  25.522 35.474 1.000 55.514 ? 96  ARG LLL HH21 1 
ATOM   4675 H  HH22 . ARG C 3 96  ? 23.911  26.505 35.186 1.000 55.175 ? 96  ARG LLL HH22 1 
ATOM   4676 N  N    . GLY C 3 97  ? 22.646  21.498 27.085 1.000 38.504 ? 97  GLY LLL N    1 
ATOM   4677 C  CA   . GLY C 3 97  ? 21.532  20.910 26.313 1.000 37.293 ? 97  GLY LLL CA   1 
ATOM   4678 C  C    . GLY C 3 97  ? 20.652  21.953 25.638 1.000 36.268 ? 97  GLY LLL C    1 
ATOM   4679 O  O    . GLY C 3 97  ? 19.798  21.563 24.824 1.000 36.162 ? 97  GLY LLL O    1 
ATOM   4680 H  H    . GLY C 3 97  ? 23.433  21.517 26.627 1.000 38.024 ? 97  GLY LLL H    1 
ATOM   4681 H  HA2  . GLY C 3 97  ? 21.903  20.308 25.627 1.000 36.947 ? 97  GLY LLL HA2  1 
ATOM   4682 H  HA3  . GLY C 3 97  ? 20.975  20.364 26.924 1.000 38.115 ? 97  GLY LLL HA3  1 
ATOM   4683 N  N    . ASP C 3 98  ? 20.834  23.234 25.961 1.000 35.645 ? 98  ASP LLL N    1 
ATOM   4684 C  CA   . ASP C 3 98  ? 19.985  24.350 25.469 1.000 35.256 ? 98  ASP LLL CA   1 
ATOM   4685 C  C    . ASP C 3 98  ? 20.613  24.962 24.217 1.000 33.679 ? 98  ASP LLL C    1 
ATOM   4686 O  O    . ASP C 3 98  ? 21.839  24.937 24.098 1.000 33.306 ? 98  ASP LLL O    1 
ATOM   4687 C  CB   . ASP C 3 98  ? 19.835  25.434 26.535 1.000 35.924 ? 98  ASP LLL CB   1 
ATOM   4688 C  CG   . ASP C 3 98  ? 19.349  24.913 27.871 1.000 37.449 ? 98  ASP LLL CG   1 
ATOM   4689 O  OD1  . ASP C 3 98  ? 19.015  23.716 27.949 1.000 38.152 ? 98  ASP LLL OD1  1 
ATOM   4690 O  OD2  . ASP C 3 98  ? 19.321  25.709 28.821 1.000 38.694 ? 98  ASP LLL OD2  1 
ATOM   4691 H  H    . ASP C 3 98  ? 21.509  23.511 26.501 1.000 35.841 ? 98  ASP LLL H    1 
ATOM   4692 H  HA   . ASP C 3 98  ? 19.092  23.997 25.243 1.000 35.483 ? 98  ASP LLL HA   1 
ATOM   4693 H  HB2  . ASP C 3 98  ? 20.702  25.865 26.673 1.000 35.701 ? 98  ASP LLL HB2  1 
ATOM   4694 H  HB3  . ASP C 3 98  ? 19.208  26.112 26.218 1.000 35.862 ? 98  ASP LLL HB3  1 
ATOM   4695 N  N    . TRP C 3 99  ? 19.791  25.527 23.341 1.000 33.261 ? 99  TRP LLL N    1 
ATOM   4696 C  CA   . TRP C 3 99  ? 20.240  26.268 22.133 1.000 32.446 ? 99  TRP LLL CA   1 
ATOM   4697 C  C    . TRP C 3 99  ? 20.788  27.639 22.540 1.000 32.108 ? 99  TRP LLL C    1 
ATOM   4698 O  O    . TRP C 3 99  ? 20.223  28.259 23.453 1.000 32.316 ? 99  TRP LLL O    1 
ATOM   4699 C  CB   . TRP C 3 99  ? 19.089  26.412 21.128 1.000 32.201 ? 99  TRP LLL CB   1 
ATOM   4700 C  CG   . TRP C 3 99  ? 18.941  25.279 20.163 1.000 31.607 ? 99  TRP LLL CG   1 
ATOM   4701 C  CD1  . TRP C 3 99  ? 19.361  23.992 20.323 1.000 31.818 ? 99  TRP LLL CD1  1 
ATOM   4702 C  CD2  . TRP C 3 99  ? 18.281  25.329 18.889 1.000 31.389 ? 99  TRP LLL CD2  1 
ATOM   4703 N  NE1  . TRP C 3 99  ? 19.033  23.247 19.222 1.000 31.809 ? 99  TRP LLL NE1  1 
ATOM   4704 C  CE2  . TRP C 3 99  ? 18.370  24.041 18.326 1.000 31.566 ? 99  TRP LLL CE2  1 
ATOM   4705 C  CE3  . TRP C 3 99  ? 17.643  26.339 18.161 1.000 31.512 ? 99  TRP LLL CE3  1 
ATOM   4706 C  CZ2  . TRP C 3 99  ? 17.836  23.735 17.077 1.000 31.788 ? 99  TRP LLL CZ2  1 
ATOM   4707 C  CZ3  . TRP C 3 99  ? 17.115  26.038 16.925 1.000 31.650 ? 99  TRP LLL CZ3  1 
ATOM   4708 C  CH2  . TRP C 3 99  ? 17.209  24.751 16.394 1.000 31.841 ? 99  TRP LLL CH2  1 
ATOM   4709 H  H    . TRP C 3 99  ? 18.887  25.493 23.427 1.000 33.682 ? 99  TRP LLL H    1 
ATOM   4710 H  HA   . TRP C 3 99  ? 20.961  25.749 21.706 1.000 32.074 ? 99  TRP LLL HA   1 
ATOM   4711 H  HB2  . TRP C 3 99  ? 18.262  26.509 21.628 1.000 32.640 ? 99  TRP LLL HB2  1 
ATOM   4712 H  HB3  . TRP C 3 99  ? 19.228  27.239 20.623 1.000 31.780 ? 99  TRP LLL HB3  1 
ATOM   4713 H  HD1  . TRP C 3 99  ? 19.831  23.661 21.072 1.000 31.975 ? 99  TRP LLL HD1  1 
ATOM   4714 H  HE1  . TRP C 3 99  ? 19.214  22.398 19.113 1.000 31.804 ? 99  TRP LLL HE1  1 
ATOM   4715 H  HE3  . TRP C 3 99  ? 17.574  27.212 18.514 1.000 31.460 ? 99  TRP LLL HE3  1 
ATOM   4716 H  HZ2  . TRP C 3 99  ? 17.899  22.867 16.718 1.000 31.838 ? 99  TRP LLL HZ2  1 
ATOM   4717 H  HZ3  . TRP C 3 99  ? 16.682  26.713 16.428 1.000 31.674 ? 99  TRP LLL HZ3  1 
ATOM   4718 H  HH2  . TRP C 3 99  ? 16.844  24.577 15.546 1.000 31.945 ? 99  TRP LLL HH2  1 
ATOM   4719 N  N    . VAL C 3 100 ? 21.856  28.077 21.879 1.000 31.838 ? 100 VAL LLL N    1 
ATOM   4720 C  CA   . VAL C 3 100 ? 22.313  29.497 21.847 1.000 31.925 ? 100 VAL LLL CA   1 
ATOM   4721 C  C    . VAL C 3 100 ? 22.318  29.930 20.378 1.000 31.832 ? 100 VAL LLL C    1 
ATOM   4722 O  O    . VAL C 3 100 ? 22.784  29.132 19.530 1.000 32.083 ? 100 VAL LLL O    1 
ATOM   4723 C  CB   . VAL C 3 100 ? 23.697  29.683 22.496 1.000 31.561 ? 100 VAL LLL CB   1 
ATOM   4724 C  CG1  . VAL C 3 100 ? 24.117  31.143 22.495 1.000 31.511 ? 100 VAL LLL CG1  1 
ATOM   4725 C  CG2  . VAL C 3 100 ? 23.740  29.120 23.906 1.000 32.246 ? 100 VAL LLL CG2  1 
ATOM   4726 H  H    . VAL C 3 100 ? 22.390  27.520 21.394 1.000 31.625 ? 100 VAL LLL H    1 
ATOM   4727 H  HA   . VAL C 3 100 ? 21.666  30.042 22.329 1.000 32.123 ? 100 VAL LLL HA   1 
ATOM   4728 H  HB   . VAL C 3 100 ? 24.351  29.180 21.950 1.000 31.430 ? 100 VAL LLL HB   1 
ATOM   4729 H  HG11 . VAL C 3 100 ? 24.361  31.411 21.593 1.000 31.107 ? 100 VAL LLL HG11 1 
ATOM   4730 H  HG12 . VAL C 3 100 ? 24.882  31.262 23.084 1.000 31.703 ? 100 VAL LLL HG12 1 
ATOM   4731 H  HG13 . VAL C 3 100 ? 23.379  31.694 22.809 1.000 31.636 ? 100 VAL LLL HG13 1 
ATOM   4732 H  HG21 . VAL C 3 100 ? 23.027  29.516 24.437 1.000 32.574 ? 100 VAL LLL HG21 1 
ATOM   4733 H  HG22 . VAL C 3 100 ? 24.599  29.326 24.314 1.000 32.371 ? 100 VAL LLL HG22 1 
ATOM   4734 H  HG23 . VAL C 3 100 ? 23.622  28.154 23.875 1.000 32.356 ? 100 VAL LLL HG23 1 
ATOM   4735 N  N    . LEU C 3 101 ? 21.793  31.122 20.091 1.000 31.771 ? 101 LEU LLL N    1 
ATOM   4736 C  CA   . LEU C 3 101 ? 21.697  31.686 18.719 1.000 31.544 ? 101 LEU LLL CA   1 
ATOM   4737 C  C    . LEU C 3 101 ? 22.480  33.000 18.660 1.000 31.503 ? 101 LEU LLL C    1 
ATOM   4738 O  O    . LEU C 3 101 ? 22.432  33.776 19.643 1.000 31.790 ? 101 LEU LLL O    1 
ATOM   4739 C  CB   . LEU C 3 101 ? 20.226  31.928 18.366 1.000 32.088 ? 101 LEU LLL CB   1 
ATOM   4740 C  CG   . LEU C 3 101 ? 19.353  30.690 18.164 1.000 32.714 ? 101 LEU LLL CG   1 
ATOM   4741 C  CD1  . LEU C 3 101 ? 17.974  31.091 17.665 1.000 33.192 ? 101 LEU LLL CD1  1 
ATOM   4742 C  CD2  . LEU C 3 101 ? 19.993  29.708 17.194 1.000 32.608 ? 101 LEU LLL CD2  1 
ATOM   4743 H  H    . LEU C 3 101 ? 21.456  31.674 20.733 1.000 32.003 ? 101 LEU LLL H    1 
ATOM   4744 H  HA   . LEU C 3 101 ? 22.094  31.048 18.084 1.000 31.482 ? 101 LEU LLL HA   1 
ATOM   4745 H  HB2  . LEU C 3 101 ? 19.829  32.468 19.079 1.000 32.286 ? 101 LEU LLL HB2  1 
ATOM   4746 H  HB3  . LEU C 3 101 ? 20.195  32.460 17.546 1.000 31.903 ? 101 LEU LLL HB3  1 
ATOM   4747 H  HG   . LEU C 3 101 ? 19.247  30.238 19.038 1.000 32.989 ? 101 LEU LLL HG   1 
ATOM   4748 H  HD11 . LEU C 3 101 ? 17.565  31.705 18.299 1.000 33.343 ? 101 LEU LLL HD11 1 
ATOM   4749 H  HD12 . LEU C 3 101 ? 17.417  30.298 17.576 1.000 33.452 ? 101 LEU LLL HD12 1 
ATOM   4750 H  HD13 . LEU C 3 101 ? 18.057  31.528 16.799 1.000 32.947 ? 101 LEU LLL HD13 1 
ATOM   4751 H  HD21 . LEU C 3 101 ? 20.380  30.196 16.446 1.000 32.332 ? 101 LEU LLL HD21 1 
ATOM   4752 H  HD22 . LEU C 3 101 ? 19.319  29.090 16.863 1.000 32.805 ? 101 LEU LLL HD22 1 
ATOM   4753 H  HD23 . LEU C 3 101 ? 20.691  29.210 17.653 1.000 32.523 ? 101 LEU LLL HD23 1 
ATOM   4754 N  N    . GLY C 3 102 ? 23.180  33.231 17.549 1.000 30.917 ? 102 GLY LLL N    1 
ATOM   4755 C  CA   . GLY C 3 102 ? 23.749  34.544 17.214 1.000 30.620 ? 102 GLY LLL CA   1 
ATOM   4756 C  C    . GLY C 3 102 ? 22.630  35.517 16.903 1.000 30.490 ? 102 GLY LLL C    1 
ATOM   4757 O  O    . GLY C 3 102 ? 21.500  35.050 16.631 1.000 31.424 ? 102 GLY LLL O    1 
ATOM   4758 H  H    . GLY C 3 102 ? 23.346  32.580 16.933 1.000 30.895 ? 102 GLY LLL H    1 
ATOM   4759 H  HA2  . GLY C 3 102 ? 24.277  34.878 17.979 1.000 30.733 ? 102 GLY LLL HA2  1 
ATOM   4760 H  HA3  . GLY C 3 102 ? 24.345  34.454 16.431 1.000 30.562 ? 102 GLY LLL HA3  1 
ATOM   4761 N  N    . GLY C 3 103 ? 22.920  36.817 16.944 1.000 29.653 ? 103 GLY LLL N    1 
ATOM   4762 C  CA   . GLY C 3 103 ? 21.944  37.883 16.661 1.000 29.253 ? 103 GLY LLL CA   1 
ATOM   4763 C  C    . GLY C 3 103 ? 21.569  37.927 15.196 1.000 28.959 ? 103 GLY LLL C    1 
ATOM   4764 O  O    . GLY C 3 103 ? 20.651  38.688 14.857 1.000 29.119 ? 103 GLY LLL O    1 
ATOM   4765 H  H    . GLY C 3 103 ? 23.753  37.121 17.153 1.000 29.736 ? 103 GLY LLL H    1 
ATOM   4766 H  HA2  . GLY C 3 103 ? 21.130  37.727 17.204 1.000 29.437 ? 103 GLY LLL HA2  1 
ATOM   4767 H  HA3  . GLY C 3 103 ? 22.331  38.754 16.928 1.000 29.277 ? 103 GLY LLL HA3  1 
ATOM   4768 N  N    . GLY C 3 104 ? 22.262  37.154 14.355 1.000 29.167 ? 104 GLY LLL N    1 
ATOM   4769 C  CA   . GLY C 3 104 ? 22.024  37.096 12.902 1.000 29.781 ? 104 GLY LLL CA   1 
ATOM   4770 C  C    . GLY C 3 104 ? 22.877  38.102 12.147 1.000 30.509 ? 104 GLY LLL C    1 
ATOM   4771 O  O    . GLY C 3 104 ? 23.185  39.178 12.706 1.000 30.917 ? 104 GLY LLL O    1 
ATOM   4772 H  H    . GLY C 3 104 ? 22.948  36.627 14.630 1.000 29.182 ? 104 GLY LLL H    1 
ATOM   4773 H  HA2  . GLY C 3 104 ? 22.228  36.184 12.581 1.000 29.871 ? 104 GLY LLL HA2  1 
ATOM   4774 H  HA3  . GLY C 3 104 ? 21.068  37.278 12.723 1.000 29.952 ? 104 GLY LLL HA3  1 
ATOM   4775 N  N    . THR C 3 105 ? 23.254  37.740 10.919 1.000 31.330 ? 105 THR LLL N    1 
ATOM   4776 C  CA   . THR C 3 105 ? 23.993  38.568 9.933  1.000 31.713 ? 105 THR LLL CA   1 
ATOM   4777 C  C    . THR C 3 105 ? 23.129  38.678 8.679  1.000 32.304 ? 105 THR LLL C    1 
ATOM   4778 O  O    . THR C 3 105 ? 22.513  37.662 8.318  1.000 32.546 ? 105 THR LLL O    1 
ATOM   4779 C  CB   . THR C 3 105 ? 25.331  37.914 9.568  1.000 31.979 ? 105 THR LLL CB   1 
ATOM   4780 O  OG1  . THR C 3 105 ? 26.110  37.809 10.761 1.000 32.451 ? 105 THR LLL OG1  1 
ATOM   4781 C  CG2  . THR C 3 105 ? 26.093  38.669 8.500  1.000 32.298 ? 105 THR LLL CG2  1 
ATOM   4782 H  H    . THR C 3 105 ? 23.073  36.911 10.588 1.000 31.282 ? 105 THR LLL H    1 
ATOM   4783 H  HA   . THR C 3 105 ? 24.150  39.464 10.310 1.000 31.692 ? 105 THR LLL HA   1 
ATOM   4784 H  HB   . THR C 3 105 ? 25.143  37.005 9.234  1.000 32.116 ? 105 THR LLL HB   1 
ATOM   4785 H  HG1  . THR C 3 105 ? 26.797  37.424 10.587 0.000 30.000 ? 105 THR LLL HG1  1 
ATOM   4786 H  HG21 . THR C 3 105 ? 25.788  38.385 7.620  1.000 32.646 ? 105 THR LLL HG21 1 
ATOM   4787 H  HG22 . THR C 3 105 ? 27.045  38.483 8.587  1.000 32.477 ? 105 THR LLL HG22 1 
ATOM   4788 H  HG23 . THR C 3 105 ? 25.939  39.625 8.604  1.000 32.365 ? 105 THR LLL HG23 1 
ATOM   4789 N  N    . LYS C 3 106 ? 23.070  39.847 8.044  1.000 32.836 ? 106 LYS LLL N    1 
ATOM   4790 C  CA   . LYS C 3 106 ? 22.441  39.964 6.707  1.000 34.063 ? 106 LYS LLL CA   1 
ATOM   4791 C  C    . LYS C 3 106 ? 23.550  39.942 5.653  1.000 35.196 ? 106 LYS LLL C    1 
ATOM   4792 O  O    . LYS C 3 106 ? 24.367  40.896 5.612  1.000 35.499 ? 106 LYS LLL O    1 
ATOM   4793 C  CB   . LYS C 3 106 ? 21.558  41.206 6.553  1.000 34.460 ? 106 LYS LLL CB   1 
ATOM   4794 C  CG   . LYS C 3 106 ? 20.543  41.073 5.424  1.000 35.444 ? 106 LYS LLL CG   1 
ATOM   4795 C  CD   . LYS C 3 106 ? 19.914  42.353 4.939  1.000 36.155 ? 106 LYS LLL CD   1 
ATOM   4796 C  CE   . LYS C 3 106 ? 18.790  42.076 3.961  1.000 37.478 ? 106 LYS LLL CE   1 
ATOM   4797 N  NZ   . LYS C 3 106 ? 18.135  43.321 3.494  1.000 38.501 ? 106 LYS LLL NZ   1 
ATOM   4798 H  H    . LYS C 3 106 ? 23.404  40.624 8.382  1.000 32.844 ? 106 LYS LLL H    1 
ATOM   4799 H  HA   . LYS C 3 106 ? 21.873  39.172 6.569  1.000 34.159 ? 106 LYS LLL HA   1 
ATOM   4800 H  HB2  . LYS C 3 106 ? 21.081  41.363 7.394  1.000 34.145 ? 106 LYS LLL HB2  1 
ATOM   4801 H  HB3  . LYS C 3 106 ? 22.129  41.982 6.376  1.000 34.591 ? 106 LYS LLL HB3  1 
ATOM   4802 H  HG2  . LYS C 3 106 ? 20.985  40.639 4.664  1.000 35.807 ? 106 LYS LLL HG2  1 
ATOM   4803 H  HG3  . LYS C 3 106 ? 19.828  40.473 5.724  1.000 35.361 ? 106 LYS LLL HG3  1 
ATOM   4804 H  HD2  . LYS C 3 106 ? 19.560  42.853 5.705  1.000 35.872 ? 106 LYS LLL HD2  1 
ATOM   4805 H  HD3  . LYS C 3 106 ? 20.596  42.904 4.499  1.000 36.435 ? 106 LYS LLL HD3  1 
ATOM   4806 H  HE2  . LYS C 3 106 ? 19.142  41.596 3.188  1.000 37.888 ? 106 LYS LLL HE2  1 
ATOM   4807 H  HE3  . LYS C 3 106 ? 18.120  41.508 4.387  1.000 37.337 ? 106 LYS LLL HE3  1 
ATOM   4808 H  HZ1  . LYS C 3 106 ? 17.793  43.773 4.203  1.000 37.977 ? 106 LYS LLL HZ1  1 
ATOM   4809 H  HZ2  . LYS C 3 106 ? 17.463  43.118 2.919  1.000 38.846 ? 106 LYS LLL HZ2  1 
ATOM   4810 H  HZ3  . LYS C 3 106 ? 18.740  43.846 3.070  1.000 38.525 ? 106 LYS LLL HZ3  1 
ATOM   4811 N  N    . LEU C 3 107 ? 23.574  38.870 4.855  1.000 35.506 ? 107 LEU LLL N    1 
ATOM   4812 C  CA   . LEU C 3 107 ? 24.366  38.774 3.608  1.000 36.263 ? 107 LEU LLL CA   1 
ATOM   4813 C  C    . LEU C 3 107 ? 23.628  39.569 2.528  1.000 37.281 ? 107 LEU LLL C    1 
ATOM   4814 O  O    . LEU C 3 107 ? 22.543  39.127 2.115  1.000 37.970 ? 107 LEU LLL O    1 
ATOM   4815 C  CB   . LEU C 3 107 ? 24.513  37.300 3.217  1.000 36.528 ? 107 LEU LLL CB   1 
ATOM   4816 C  CG   . LEU C 3 107 ? 25.247  37.026 1.906  1.000 37.358 ? 107 LEU LLL CG   1 
ATOM   4817 C  CD1  . LEU C 3 107 ? 26.447  37.936 1.755  1.000 37.910 ? 107 LEU LLL CD1  1 
ATOM   4818 C  CD2  . LEU C 3 107 ? 25.678  35.573 1.825  1.000 37.627 ? 107 LEU LLL CD2  1 
ATOM   4819 H  H    . LEU C 3 107 ? 23.094  38.118 5.040  1.000 35.375 ? 107 LEU LLL H    1 
ATOM   4820 H  HA   . LEU C 3 107 ? 25.251  39.172 3.762  1.000 36.359 ? 107 LEU LLL HA   1 
ATOM   4821 H  HB2  . LEU C 3 107 ? 24.984  36.837 3.938  1.000 36.041 ? 107 LEU LLL HB2  1 
ATOM   4822 H  HB3  . LEU C 3 107 ? 23.619  36.912 3.154  1.000 36.466 ? 107 LEU LLL HB3  1 
ATOM   4823 H  HG   . LEU C 3 107 ? 24.625  37.206 1.158  1.000 37.982 ? 107 LEU LLL HG   1 
ATOM   4824 H  HD11 . LEU C 3 107 ? 26.155  38.815 1.459  1.000 38.102 ? 107 LEU LLL HD11 1 
ATOM   4825 H  HD12 . LEU C 3 107 ? 27.057  37.561 1.096  1.000 38.422 ? 107 LEU LLL HD12 1 
ATOM   4826 H  HD13 . LEU C 3 107 ? 26.904  38.016 2.610  1.000 37.337 ? 107 LEU LLL HD13 1 
ATOM   4827 H  HD21 . LEU C 3 107 ? 26.364  35.400 2.493  1.000 37.164 ? 107 LEU LLL HD21 1 
ATOM   4828 H  HD22 . LEU C 3 107 ? 26.034  35.388 0.940  1.000 38.255 ? 107 LEU LLL HD22 1 
ATOM   4829 H  HD23 . LEU C 3 107 ? 24.911  34.997 1.992  1.000 37.351 ? 107 LEU LLL HD23 1 
ATOM   4830 N  N    . THR C 3 108 ? 24.185  40.712 2.118  1.000 37.694 ? 108 THR LLL N    1 
ATOM   4831 C  CA   . THR C 3 108 ? 23.674  41.550 1.004  1.000 38.311 ? 108 THR LLL CA   1 
ATOM   4832 C  C    . THR C 3 108 ? 24.479  41.214 -0.256 1.000 38.930 ? 108 THR LLL C    1 
ATOM   4833 O  O    . THR C 3 108 ? 25.717  41.310 -0.206 1.000 38.534 ? 108 THR LLL O    1 
ATOM   4834 C  CB   . THR C 3 108 ? 23.720  43.038 1.374  1.000 38.546 ? 108 THR LLL CB   1 
ATOM   4835 O  OG1  . THR C 3 108 ? 23.078  43.186 2.644  1.000 38.606 ? 108 THR LLL OG1  1 
ATOM   4836 C  CG2  . THR C 3 108 ? 23.059  43.925 0.342  1.000 39.154 ? 108 THR LLL CG2  1 
ATOM   4837 H  H    . THR C 3 108 ? 24.932  41.064 2.502  1.000 37.478 ? 108 THR LLL H    1 
ATOM   4838 H  HA   . THR C 3 108 ? 22.734  41.302 0.847  1.000 38.406 ? 108 THR LLL HA   1 
ATOM   4839 H  HB   . THR C 3 108 ? 24.666  43.304 1.462  1.000 38.690 ? 108 THR LLL HB   1 
ATOM   4840 H  HG1  . THR C 3 108 ? 23.172  44.034 2.954  0.000 30.000 ? 108 THR LLL HG1  1 
ATOM   4841 H  HG21 . THR C 3 108 ? 23.583  43.917 -0.479 1.000 39.968 ? 108 THR LLL HG21 1 
ATOM   4842 H  HG22 . THR C 3 108 ? 23.005  44.836 0.681  1.000 39.050 ? 108 THR LLL HG22 1 
ATOM   4843 H  HG23 . THR C 3 108 ? 22.161  43.596 0.157  1.000 39.318 ? 108 THR LLL HG23 1 
ATOM   4844 N  N    . VAL C 3 109 ? 23.790  40.795 -1.322 1.000 39.355 ? 109 VAL LLL N    1 
ATOM   4845 C  CA   . VAL C 3 109 ? 24.355  40.664 -2.696 1.000 40.378 ? 109 VAL LLL CA   1 
ATOM   4846 C  C    . VAL C 3 109 ? 24.169  42.012 -3.402 1.000 40.987 ? 109 VAL LLL C    1 
ATOM   4847 O  O    . VAL C 3 109 ? 23.015  42.376 -3.708 1.000 41.377 ? 109 VAL LLL O    1 
ATOM   4848 C  CB   . VAL C 3 109 ? 23.705  39.508 -3.476 1.000 41.144 ? 109 VAL LLL CB   1 
ATOM   4849 C  CG1  . VAL C 3 109 ? 24.236  39.422 -4.900 1.000 42.394 ? 109 VAL LLL CG1  1 
ATOM   4850 C  CG2  . VAL C 3 109 ? 23.881  38.178 -2.750 1.000 40.452 ? 109 VAL LLL CG2  1 
ATOM   4851 H  H    . VAL C 3 109 ? 22.912  40.556 -1.273 1.000 39.279 ? 109 VAL LLL H    1 
ATOM   4852 H  HA   . VAL C 3 109 ? 25.307  40.484 -2.619 1.000 40.446 ? 109 VAL LLL HA   1 
ATOM   4853 H  HB   . VAL C 3 109 ? 22.735  39.695 -3.528 1.000 41.127 ? 109 VAL LLL HB   1 
ATOM   4854 H  HG11 . VAL C 3 109 ? 23.773  40.069 -5.460 1.000 43.134 ? 109 VAL LLL HG11 1 
ATOM   4855 H  HG12 . VAL C 3 109 ? 24.087  38.526 -5.251 1.000 42.770 ? 109 VAL LLL HG12 1 
ATOM   4856 H  HG13 . VAL C 3 109 ? 25.190  39.615 -4.904 1.000 42.615 ? 109 VAL LLL HG13 1 
ATOM   4857 H  HG21 . VAL C 3 109 ? 24.829  37.969 -2.679 1.000 40.405 ? 109 VAL LLL HG21 1 
ATOM   4858 H  HG22 . VAL C 3 109 ? 23.432  37.475 -3.249 1.000 40.856 ? 109 VAL LLL HG22 1 
ATOM   4859 H  HG23 . VAL C 3 109 ? 23.495  38.239 -1.860 1.000 39.572 ? 109 VAL LLL HG23 1 
ATOM   4860 N  N    . LEU C 3 110 ? 25.279  42.709 -3.650 1.000 40.945 ? 110 LEU LLL N    1 
ATOM   4861 C  CA   . LEU C 3 110 ? 25.309  44.134 -4.063 1.000 41.559 ? 110 LEU LLL CA   1 
ATOM   4862 C  C    . LEU C 3 110 ? 24.836  44.266 -5.518 1.000 42.929 ? 110 LEU LLL C    1 
ATOM   4863 O  O    . LEU C 3 110 ? 25.500  43.707 -6.411 1.000 44.604 ? 110 LEU LLL O    1 
ATOM   4864 C  CB   . LEU C 3 110 ? 26.737  44.661 -3.881 1.000 41.873 ? 110 LEU LLL CB   1 
ATOM   4865 C  CG   . LEU C 3 110 ? 27.319  44.541 -2.470 1.000 40.571 ? 110 LEU LLL CG   1 
ATOM   4866 C  CD1  . LEU C 3 110 ? 28.839  44.594 -2.502 1.000 41.058 ? 110 LEU LLL CD1  1 
ATOM   4867 C  CD2  . LEU C 3 110 ? 26.771  45.625 -1.553 1.000 39.698 ? 110 LEU LLL CD2  1 
ATOM   4868 H  H    . LEU C 3 110 ? 26.105  42.329 -3.605 1.000 41.129 ? 110 LEU LLL H    1 
ATOM   4869 H  HA   . LEU C 3 110 ? 24.696  44.640 -3.481 1.000 40.909 ? 110 LEU LLL HA   1 
ATOM   4870 H  HB2  . LEU C 3 110 ? 27.322  44.178 -4.499 1.000 42.598 ? 110 LEU LLL HB2  1 
ATOM   4871 H  HB3  . LEU C 3 110 ? 26.751  45.604 -4.142 1.000 42.301 ? 110 LEU LLL HB3  1 
ATOM   4872 H  HG   . LEU C 3 110 ? 27.053  43.665 -2.099 1.000 39.982 ? 110 LEU LLL HG   1 
ATOM   4873 H  HD11 . LEU C 3 110 ? 29.178  43.865 -3.050 1.000 41.622 ? 110 LEU LLL HD11 1 
ATOM   4874 H  HD12 . LEU C 3 110 ? 29.185  44.507 -1.597 1.000 40.326 ? 110 LEU LLL HD12 1 
ATOM   4875 H  HD13 . LEU C 3 110 ? 29.127  45.443 -2.878 1.000 41.735 ? 110 LEU LLL HD13 1 
ATOM   4876 H  HD21 . LEU C 3 110 ? 26.982  46.500 -1.922 1.000 40.277 ? 110 LEU LLL HD21 1 
ATOM   4877 H  HD22 . LEU C 3 110 ? 27.175  45.539 -0.672 1.000 39.008 ? 110 LEU LLL HD22 1 
ATOM   4878 H  HD23 . LEU C 3 110 ? 25.806  45.529 -1.477 1.000 39.384 ? 110 LEU LLL HD23 1 
ATOM   4879 N  N    . GLY C 3 111 ? 23.726  44.974 -5.739 1.000 42.656 ? 111 GLY LLL N    1 
ATOM   4880 C  CA   . GLY C 3 111 ? 23.221  45.335 -7.078 1.000 43.919 ? 111 GLY LLL CA   1 
ATOM   4881 C  C    . GLY C 3 111 ? 23.399  46.816 -7.369 1.000 44.416 ? 111 GLY LLL C    1 
ATOM   4882 O  O    . GLY C 3 111 ? 22.913  47.264 -8.421 1.000 45.933 ? 111 GLY LLL O    1 
ATOM   4883 H  H    . GLY C 3 111 ? 23.202  45.274 -5.057 1.000 41.906 ? 111 GLY LLL H    1 
ATOM   4884 H  HA2  . GLY C 3 111 ? 23.702  44.806 -7.762 1.000 44.801 ? 111 GLY LLL HA2  1 
ATOM   4885 H  HA3  . GLY C 3 111 ? 22.259  45.105 -7.132 1.000 43.932 ? 111 GLY LLL HA3  1 
ATOM   4886 N  N    . GLN C 3 112 ? 24.055  47.550 -6.464 1.000 43.388 ? 112 GLN LLL N    1 
ATOM   4887 C  CA   . GLN C 3 112 ? 24.335  49.007 -6.578 1.000 43.430 ? 112 GLN LLL CA   1 
ATOM   4888 C  C    . GLN C 3 112 ? 25.468  49.366 -5.619 1.000 42.289 ? 112 GLN LLL C    1 
ATOM   4889 O  O    . GLN C 3 112 ? 25.767  48.606 -4.705 1.000 40.615 ? 112 GLN LLL O    1 
ATOM   4890 C  CB   . GLN C 3 112 ? 23.067  49.826 -6.317 1.000 43.096 ? 112 GLN LLL CB   1 
ATOM   4891 C  CG   . GLN C 3 112 ? 22.496  49.700 -4.909 1.000 41.583 ? 112 GLN LLL CG   1 
ATOM   4892 C  CD   . GLN C 3 112 ? 21.315  50.621 -4.698 1.000 41.571 ? 112 GLN LLL CD   1 
ATOM   4893 O  OE1  . GLN C 3 112 ? 21.434  51.841 -4.764 1.000 42.113 ? 112 GLN LLL OE1  1 
ATOM   4894 N  NE2  . GLN C 3 112 ? 20.151  50.047 -4.447 1.000 41.421 ? 112 GLN LLL NE2  1 
ATOM   4895 H  H    . GLN C 3 112 ? 24.382  47.188 -5.695 1.000 42.417 ? 112 GLN LLL H    1 
ATOM   4896 H  HA   . GLN C 3 112 ? 24.636  49.184 -7.498 1.000 44.695 ? 112 GLN LLL HA   1 
ATOM   4897 H  HB2  . GLN C 3 112 ? 23.267  50.768 -6.492 1.000 43.563 ? 112 GLN LLL HB2  1 
ATOM   4898 H  HB3  . GLN C 3 112 ? 22.383  49.545 -6.960 1.000 43.789 ? 112 GLN LLL HB3  1 
ATOM   4899 H  HG2  . GLN C 3 112 ? 22.215  48.773 -4.755 1.000 41.225 ? 112 GLN LLL HG2  1 
ATOM   4900 H  HG3  . GLN C 3 112 ? 23.193  49.917 -4.254 1.000 40.979 ? 112 GLN LLL HG3  1 
ATOM   4901 H  HE21 . GLN C 3 112 ? 19.428  50.332 -4.228 0.000 30.000 ? 112 GLN LLL HE21 1 
ATOM   4902 H  HE22 . GLN C 3 112 ? 20.255  49.043 -4.233 0.000 30.000 ? 112 GLN LLL HE22 1 
ATOM   4903 N  N    . PRO C 3 113 ? 26.152  50.518 -5.806 1.000 43.106 ? 113 PRO LLL N    1 
ATOM   4904 C  CA   . PRO C 3 113 ? 27.228  50.929 -4.904 1.000 42.585 ? 113 PRO LLL CA   1 
ATOM   4905 C  C    . PRO C 3 113 ? 26.738  51.203 -3.475 1.000 40.998 ? 113 PRO LLL C    1 
ATOM   4906 O  O    . PRO C 3 113 ? 25.585  51.571 -3.298 1.000 40.168 ? 113 PRO LLL O    1 
ATOM   4907 C  CB   . PRO C 3 113 ? 27.758  52.239 -5.507 1.000 43.730 ? 113 PRO LLL CB   1 
ATOM   4908 C  CG   . PRO C 3 113 ? 27.252  52.239 -6.938 1.000 45.273 ? 113 PRO LLL CG   1 
ATOM   4909 C  CD   . PRO C 3 113 ? 25.940  51.486 -6.893 1.000 44.568 ? 113 PRO LLL CD   1 
ATOM   4910 H  HA   . PRO C 3 113 ? 27.944  50.245 -4.902 1.000 42.687 ? 113 PRO LLL HA   1 
ATOM   4911 H  HB2  . PRO C 3 113 ? 27.414  53.017 -5.018 1.000 43.246 ? 113 PRO LLL HB2  1 
ATOM   4912 H  HB3  . PRO C 3 113 ? 28.739  52.262 -5.486 1.000 44.159 ? 113 PRO LLL HB3  1 
ATOM   4913 H  HG2  . PRO C 3 113 ? 27.114  53.154 -7.257 1.000 45.858 ? 113 PRO LLL HG2  1 
ATOM   4914 H  HG3  . PRO C 3 113 ? 27.888  51.791 -7.531 1.000 46.163 ? 113 PRO LLL HG3  1 
ATOM   4915 H  HD2  . PRO C 3 113 ? 25.197  52.083 -6.691 1.000 44.250 ? 113 PRO LLL HD2  1 
ATOM   4916 H  HD3  . PRO C 3 113 ? 25.766  51.035 -7.739 1.000 45.495 ? 113 PRO LLL HD3  1 
ATOM   4917 N  N    . LYS C 3 114 ? 27.632  51.036 -2.498 1.000 40.547 ? 114 LYS LLL N    1 
ATOM   4918 C  CA   . LYS C 3 114 ? 27.360  51.352 -1.073 1.000 39.428 ? 114 LYS LLL CA   1 
ATOM   4919 C  C    . LYS C 3 114 ? 26.880  52.801 -0.980 1.000 38.935 ? 114 LYS LLL C    1 
ATOM   4920 O  O    . LYS C 3 114 ? 27.295  53.633 -1.813 1.000 40.110 ? 114 LYS LLL O    1 
ATOM   4921 C  CB   . LYS C 3 114 ? 28.596  51.152 -0.190 1.000 39.904 ? 114 LYS LLL CB   1 
ATOM   4922 C  CG   . LYS C 3 114 ? 28.922  49.712 0.170  1.000 40.108 ? 114 LYS LLL CG   1 
ATOM   4923 C  CD   . LYS C 3 114 ? 29.915  49.056 -0.777 1.000 42.227 ? 114 LYS LLL CD   1 
ATOM   4924 C  CE   . LYS C 3 114 ? 30.235  47.619 -0.418 1.000 42.063 ? 114 LYS LLL CE   1 
ATOM   4925 N  NZ   . LYS C 3 114 ? 30.504  47.462 1.033  1.000 41.360 ? 114 LYS LLL NZ   1 
ATOM   4926 H  H    . LYS C 3 114 ? 28.472  50.725 -2.654 1.000 40.993 ? 114 LYS LLL H    1 
ATOM   4927 H  HA   . LYS C 3 114 ? 26.642  50.759 -0.757 1.000 38.757 ? 114 LYS LLL HA   1 
ATOM   4928 H  HB2  . LYS C 3 114 ? 29.369  51.538 -0.651 1.000 40.729 ? 114 LYS LLL HB2  1 
ATOM   4929 H  HB3  . LYS C 3 114 ? 28.465  51.655 0.641  1.000 39.215 ? 114 LYS LLL HB3  1 
ATOM   4930 H  HG2  . LYS C 3 114 ? 29.287  49.694 1.080  1.000 39.572 ? 114 LYS LLL HG2  1 
ATOM   4931 H  HG3  . LYS C 3 114 ? 28.091  49.190 0.171  1.000 39.718 ? 114 LYS LLL HG3  1 
ATOM   4932 H  HD2  . LYS C 3 114 ? 29.551  49.079 -1.686 1.000 42.758 ? 114 LYS LLL HD2  1 
ATOM   4933 H  HD3  . LYS C 3 114 ? 30.748  49.575 -0.774 1.000 42.608 ? 114 LYS LLL HD3  1 
ATOM   4934 H  HE2  . LYS C 3 114 ? 29.485  47.046 -0.665 1.000 41.853 ? 114 LYS LLL HE2  1 
ATOM   4935 H  HE3  . LYS C 3 114 ? 31.019  47.325 -0.919 1.000 42.861 ? 114 LYS LLL HE3  1 
ATOM   4936 H  HZ1  . LYS C 3 114 ? 30.996  48.161 1.335  1.000 41.380 ? 114 LYS LLL HZ1  1 
ATOM   4937 H  HZ2  . LYS C 3 114 ? 30.966  46.694 1.176  1.000 41.172 ? 114 LYS LLL HZ2  1 
ATOM   4938 H  HZ3  . LYS C 3 114 ? 29.722  47.423 1.490  1.000 40.491 ? 114 LYS LLL HZ3  1 
ATOM   4939 N  N    . SER C 3 115 ? 26.027  53.074 0.002  1.000 37.243 ? 115 SER LLL N    1 
ATOM   4940 C  CA   . SER C 3 115 ? 25.402  54.396 0.246  1.000 36.688 ? 115 SER LLL CA   1 
ATOM   4941 C  C    . SER C 3 115 ? 25.313  54.611 1.757  1.000 34.888 ? 115 SER LLL C    1 
ATOM   4942 O  O    . SER C 3 115 ? 24.674  53.792 2.425  1.000 34.406 ? 115 SER LLL O    1 
ATOM   4943 C  CB   . SER C 3 115 ? 24.058  54.463 -0.428 1.000 36.817 ? 115 SER LLL CB   1 
ATOM   4944 O  OG   . SER C 3 115 ? 23.527  55.774 -0.383 1.000 36.824 ? 115 SER LLL OG   1 
ATOM   4945 H  H    . SER C 3 115 ? 25.757  52.450 0.609  1.000 36.539 ? 115 SER LLL H    1 
ATOM   4946 H  HA   . SER C 3 115 ? 25.990  55.098 -0.142 1.000 37.335 ? 115 SER LLL HA   1 
ATOM   4947 H  HB2  . SER C 3 115 ? 24.149  54.179 -1.365 1.000 37.676 ? 115 SER LLL HB2  1 
ATOM   4948 H  HB3  . SER C 3 115 ? 23.438  53.843 0.020  1.000 36.170 ? 115 SER LLL HB3  1 
ATOM   4949 H  HG   . SER C 3 115 ? 22.780  55.601 -0.797 0.000 30.000 ? 115 SER LLL HG   1 
ATOM   4950 N  N    . SER C 3 116 ? 25.995  55.632 2.275  1.000 34.628 ? 116 SER LLL N    1 
ATOM   4951 C  CA   . SER C 3 116 ? 26.000  56.001 3.714  1.000 33.474 ? 116 SER LLL CA   1 
ATOM   4952 C  C    . SER C 3 116 ? 24.677  56.670 4.065  1.000 32.596 ? 116 SER LLL C    1 
ATOM   4953 O  O    . SER C 3 116 ? 24.132  57.444 3.287  1.000 32.754 ? 116 SER LLL O    1 
ATOM   4954 C  CB   . SER C 3 116 ? 27.172  56.885 4.051  1.000 33.930 ? 116 SER LLL CB   1 
ATOM   4955 O  OG   . SER C 3 116 ? 28.391  56.187 3.856  1.000 34.395 ? 116 SER LLL OG   1 
ATOM   4956 H  H    . SER C 3 116 ? 26.514  56.188 1.774  1.000 35.370 ? 116 SER LLL H    1 
ATOM   4957 H  HA   . SER C 3 116 ? 26.078  55.162 4.241  1.000 32.928 ? 116 SER LLL HA   1 
ATOM   4958 H  HB2  . SER C 3 116 ? 27.155  57.686 3.480  1.000 34.518 ? 116 SER LLL HB2  1 
ATOM   4959 H  HB3  . SER C 3 116 ? 27.105  57.175 4.989  1.000 33.354 ? 116 SER LLL HB3  1 
ATOM   4960 H  HG   . SER C 3 116 ? 28.961  56.630 4.107  0.000 30.000 ? 116 SER LLL HG   1 
ATOM   4961 N  N    . PRO C 3 117 ? 24.114  56.397 5.255  1.000 31.763 ? 117 PRO LLL N    1 
ATOM   4962 C  CA   . PRO C 3 117 ? 22.821  56.969 5.622  1.000 31.596 ? 117 PRO LLL CA   1 
ATOM   4963 C  C    . PRO C 3 117 ? 22.885  58.493 5.804  1.000 31.814 ? 117 PRO LLL C    1 
ATOM   4964 O  O    . PRO C 3 117 ? 23.856  58.970 6.354  1.000 31.352 ? 117 PRO LLL O    1 
ATOM   4965 C  CB   . PRO C 3 117 ? 22.501  56.273 6.957  1.000 30.749 ? 117 PRO LLL CB   1 
ATOM   4966 C  CG   . PRO C 3 117 ? 23.864  55.916 7.525  1.000 30.607 ? 117 PRO LLL CG   1 
ATOM   4967 C  CD   . PRO C 3 117 ? 24.700  55.560 6.313  1.000 31.139 ? 117 PRO LLL CD   1 
ATOM   4968 H  HA   . PRO C 3 117 ? 22.143  56.726 4.944  1.000 31.835 ? 117 PRO LLL HA   1 
ATOM   4969 H  HB2  . PRO C 3 117 ? 22.018  56.877 7.561  1.000 30.473 ? 117 PRO LLL HB2  1 
ATOM   4970 H  HB3  . PRO C 3 117 ? 21.960  55.468 6.814  1.000 30.586 ? 117 PRO LLL HB3  1 
ATOM   4971 H  HG2  . PRO C 3 117 ? 24.252  56.676 8.004  1.000 30.590 ? 117 PRO LLL HG2  1 
ATOM   4972 H  HG3  . PRO C 3 117 ? 23.798  55.155 8.137  1.000 30.130 ? 117 PRO LLL HG3  1 
ATOM   4973 H  HD2  . PRO C 3 117 ? 25.639  55.779 6.457  1.000 31.439 ? 117 PRO LLL HD2  1 
ATOM   4974 H  HD3  . PRO C 3 117 ? 24.622  54.614 6.095  1.000 31.118 ? 117 PRO LLL HD3  1 
ATOM   4975 N  N    . SER C 3 118 ? 21.863  59.202 5.314  1.000 32.490 ? 118 SER LLL N    1 
ATOM   4976 C  CA   . SER C 3 118 ? 21.487  60.573 5.752  1.000 32.760 ? 118 SER LLL CA   1 
ATOM   4977 C  C    . SER C 3 118 ? 20.669  60.465 7.040  1.000 31.734 ? 118 SER LLL C    1 
ATOM   4978 O  O    . SER C 3 118 ? 19.691  59.683 7.056  1.000 31.043 ? 118 SER LLL O    1 
ATOM   4979 C  CB   . SER C 3 118 ? 20.724  61.320 4.692  1.000 33.898 ? 118 SER LLL CB   1 
ATOM   4980 O  OG   . SER C 3 118 ? 21.591  62.192 3.987  1.000 35.707 ? 118 SER LLL OG   1 
ATOM   4981 H  H    . SER C 3 118 ? 21.309  58.883 4.666  1.000 32.726 ? 118 SER LLL H    1 
ATOM   4982 H  HA   . SER C 3 118 ? 22.323  61.074 5.952  1.000 32.900 ? 118 SER LLL HA   1 
ATOM   4983 H  HB2  . SER C 3 118 ? 20.316  60.682 4.065  1.000 34.266 ? 118 SER LLL HB2  1 
ATOM   4984 H  HB3  . SER C 3 118 ? 20.002  61.842 5.111  1.000 33.792 ? 118 SER LLL HB3  1 
ATOM   4985 H  HG   . SER C 3 118 ? 21.064  62.627 3.501  0.000 30.000 ? 118 SER LLL HG   1 
ATOM   4986 N  N    . VAL C 3 119 ? 21.061  61.217 8.072  1.000 31.501 ? 119 VAL LLL N    1 
ATOM   4987 C  CA   . VAL C 3 119 ? 20.478  61.122 9.443  1.000 30.933 ? 119 VAL LLL CA   1 
ATOM   4988 C  C    . VAL C 3 119 ? 20.017  62.503 9.899  1.000 30.983 ? 119 VAL LLL C    1 
ATOM   4989 O  O    . VAL C 3 119 ? 20.845  63.428 9.875  1.000 31.271 ? 119 VAL LLL O    1 
ATOM   4990 C  CB   . VAL C 3 119 ? 21.485  60.550 10.452 1.000 30.298 ? 119 VAL LLL CB   1 
ATOM   4991 C  CG1  . VAL C 3 119 ? 20.821  60.300 11.796 1.000 29.733 ? 119 VAL LLL CG1  1 
ATOM   4992 C  CG2  . VAL C 3 119 ? 22.150  59.297 9.915  1.000 30.274 ? 119 VAL LLL CG2  1 
ATOM   4993 H  H    . VAL C 3 119 ? 21.716  61.846 8.001  1.000 31.788 ? 119 VAL LLL H    1 
ATOM   4994 H  HA   . VAL C 3 119 ? 19.707  60.533 9.409  1.000 30.709 ? 119 VAL LLL HA   1 
ATOM   4995 H  HB   . VAL C 3 119 ? 22.190  61.231 10.586 1.000 30.553 ? 119 VAL LLL HB   1 
ATOM   4996 H  HG11 . VAL C 3 119 ? 20.706  61.145 12.264 1.000 29.773 ? 119 VAL LLL HG11 1 
ATOM   4997 H  HG12 . VAL C 3 119 ? 21.378  59.709 12.331 1.000 29.577 ? 119 VAL LLL HG12 1 
ATOM   4998 H  HG13 . VAL C 3 119 ? 19.951  59.886 11.657 1.000 29.638 ? 119 VAL LLL HG13 1 
ATOM   4999 H  HG21 . VAL C 3 119 ? 21.473  58.695 9.562  1.000 30.220 ? 119 VAL LLL HG21 1 
ATOM   5000 H  HG22 . VAL C 3 119 ? 22.636  58.853 10.632 1.000 30.060 ? 119 VAL LLL HG22 1 
ATOM   5001 H  HG23 . VAL C 3 119 ? 22.772  59.537 9.206  1.000 30.743 ? 119 VAL LLL HG23 1 
ATOM   5002 N  N    . THR C 3 120 ? 18.760  62.602 10.333 1.000 31.037 ? 120 THR LLL N    1 
ATOM   5003 C  CA   . THR C 3 120 ? 18.175  63.795 10.998 1.000 31.233 ? 120 THR LLL CA   1 
ATOM   5004 C  C    . THR C 3 120 ? 17.584  63.385 12.348 1.000 30.888 ? 120 THR LLL C    1 
ATOM   5005 O  O    . THR C 3 120 ? 16.811  62.403 12.382 1.000 30.393 ? 120 THR LLL O    1 
ATOM   5006 C  CB   . THR C 3 120 ? 17.093  64.445 10.133 1.000 31.726 ? 120 THR LLL CB   1 
ATOM   5007 O  OG1  . THR C 3 120 ? 17.568  64.426 8.788  1.000 32.688 ? 120 THR LLL OG1  1 
ATOM   5008 C  CG2  . THR C 3 120 ? 16.774  65.856 10.575 1.000 31.941 ? 120 THR LLL CG2  1 
ATOM   5009 H  H    . THR C 3 120 ? 18.155  61.926 10.247 1.000 30.925 ? 120 THR LLL H    1 
ATOM   5010 H  HA   . THR C 3 120 ? 18.895  64.449 11.151 1.000 31.337 ? 120 THR LLL HA   1 
ATOM   5011 H  HB   . THR C 3 120 ? 16.275  63.900 10.194 1.000 31.752 ? 120 THR LLL HB   1 
ATOM   5012 H  HG1  . THR C 3 120 ? 16.990  64.705 8.321  0.000 30.000 ? 120 THR LLL HG1  1 
ATOM   5013 H  HG21 . THR C 3 120 ? 16.353  65.836 11.453 1.000 31.651 ? 120 THR LLL HG21 1 
ATOM   5014 H  HG22 . THR C 3 120 ? 16.166  66.267 9.935  1.000 32.252 ? 120 THR LLL HG22 1 
ATOM   5015 H  HG23 . THR C 3 120 ? 17.595  66.377 10.621 1.000 31.999 ? 120 THR LLL HG23 1 
ATOM   5016 N  N    . LEU C 3 121 ? 17.937  64.114 13.408 1.000 30.916 ? 121 LEU LLL N    1 
ATOM   5017 C  CA   . LEU C 3 121 ? 17.339  63.961 14.756 1.000 31.018 ? 121 LEU LLL CA   1 
ATOM   5018 C  C    . LEU C 3 121 ? 16.332  65.088 14.967 1.000 31.905 ? 121 LEU LLL C    1 
ATOM   5019 O  O    . LEU C 3 121 ? 16.709  66.247 14.793 1.000 32.481 ? 121 LEU LLL O    1 
ATOM   5020 C  CB   . LEU C 3 121 ? 18.444  64.019 15.811 1.000 30.692 ? 121 LEU LLL CB   1 
ATOM   5021 C  CG   . LEU C 3 121 ? 17.974  63.878 17.255 1.000 30.527 ? 121 LEU LLL CG   1 
ATOM   5022 C  CD1  . LEU C 3 121 ? 17.156  62.609 17.440 1.000 30.188 ? 121 LEU LLL CD1  1 
ATOM   5023 C  CD2  . LEU C 3 121 ? 19.158  63.903 18.207 1.000 30.658 ? 121 LEU LLL CD2  1 
ATOM   5024 H  H    . LEU C 3 121 ? 18.576  64.761 13.364 1.000 31.106 ? 121 LEU LLL H    1 
ATOM   5025 H  HA   . LEU C 3 121 ? 16.873  63.095 14.803 1.000 30.929 ? 121 LEU LLL HA   1 
ATOM   5026 H  HB2  . LEU C 3 121 ? 19.087  63.306 15.623 1.000 30.641 ? 121 LEU LLL HB2  1 
ATOM   5027 H  HB3  . LEU C 3 121 ? 18.914  64.872 15.719 1.000 30.906 ? 121 LEU LLL HB3  1 
ATOM   5028 H  HG   . LEU C 3 121 ? 17.394  64.650 17.468 1.000 30.680 ? 121 LEU LLL HG   1 
ATOM   5029 H  HD11 . LEU C 3 121 ? 16.269  62.735 17.060 1.000 30.337 ? 121 LEU LLL HD11 1 
ATOM   5030 H  HD12 . LEU C 3 121 ? 17.075  62.411 18.388 1.000 30.316 ? 121 LEU LLL HD12 1 
ATOM   5031 H  HD13 . LEU C 3 121 ? 17.599  61.869 16.990 1.000 30.119 ? 121 LEU LLL HD13 1 
ATOM   5032 H  HD21 . LEU C 3 121 ? 19.763  63.172 17.993 1.000 30.550 ? 121 LEU LLL HD21 1 
ATOM   5033 H  HD22 . LEU C 3 121 ? 18.842  63.804 19.122 1.000 30.704 ? 121 LEU LLL HD22 1 
ATOM   5034 H  HD23 . LEU C 3 121 ? 19.629  64.750 18.117 1.000 30.826 ? 121 LEU LLL HD23 1 
ATOM   5035 N  N    . PHE C 3 122 ? 15.099  64.759 15.337 1.000 32.828 ? 122 PHE LLL N    1 
ATOM   5036 C  CA   . PHE C 3 122 ? 14.055  65.759 15.667 1.000 33.757 ? 122 PHE LLL CA   1 
ATOM   5037 C  C    . PHE C 3 122 ? 13.806  65.764 17.170 1.000 33.908 ? 122 PHE LLL C    1 
ATOM   5038 O  O    . PHE C 3 122 ? 13.660  64.708 17.781 1.000 33.419 ? 122 PHE LLL O    1 
ATOM   5039 C  CB   . PHE C 3 122 ? 12.770  65.457 14.897 1.000 34.305 ? 122 PHE LLL CB   1 
ATOM   5040 C  CG   . PHE C 3 122 ? 12.859  65.718 13.417 1.000 34.379 ? 122 PHE LLL CG   1 
ATOM   5041 C  CD1  . PHE C 3 122 ? 13.028  67.006 12.941 1.000 34.722 ? 122 PHE LLL CD1  1 
ATOM   5042 C  CD2  . PHE C 3 122 ? 12.749  64.683 12.505 1.000 34.582 ? 122 PHE LLL CD2  1 
ATOM   5043 C  CE1  . PHE C 3 122 ? 13.091  67.255 11.580 1.000 35.361 ? 122 PHE LLL CE1  1 
ATOM   5044 C  CE2  . PHE C 3 122 ? 12.810  64.932 11.143 1.000 35.199 ? 122 PHE LLL CE2  1 
ATOM   5045 C  CZ   . PHE C 3 122 ? 12.981  66.217 10.684 1.000 35.618 ? 122 PHE LLL CZ   1 
ATOM   5046 H  H    . PHE C 3 122 ? 14.805  63.900 15.416 1.000 32.689 ? 122 PHE LLL H    1 
ATOM   5047 H  HA   . PHE C 3 122 ? 14.380  66.651 15.396 1.000 33.807 ? 122 PHE LLL HA   1 
ATOM   5048 H  HB2  . PHE C 3 122 ? 12.536  64.517 15.041 1.000 34.150 ? 122 PHE LLL HB2  1 
ATOM   5049 H  HB3  . PHE C 3 122 ? 12.048  66.005 15.272 1.000 34.436 ? 122 PHE LLL HB3  1 
ATOM   5050 H  HD1  . PHE C 3 122 ? 13.098  67.723 13.551 1.000 34.751 ? 122 PHE LLL HD1  1 
ATOM   5051 H  HD2  . PHE C 3 122 ? 12.626  63.800 12.814 1.000 34.481 ? 122 PHE LLL HD2  1 
ATOM   5052 H  HE1  . PHE C 3 122 ? 13.211  68.137 11.269 1.000 35.536 ? 122 PHE LLL HE1  1 
ATOM   5053 H  HE2  . PHE C 3 122 ? 12.739  64.217 10.531 1.000 35.284 ? 122 PHE LLL HE2  1 
ATOM   5054 H  HZ   . PHE C 3 122 ? 13.031  66.385 9.756  1.000 35.890 ? 122 PHE LLL HZ   1 
ATOM   5055 N  N    . PRO C 3 123 ? 13.743  66.952 17.813 1.000 34.489 ? 123 PRO LLL N    1 
ATOM   5056 C  CA   . PRO C 3 123 ? 13.266  67.047 19.190 1.000 34.921 ? 123 PRO LLL CA   1 
ATOM   5057 C  C    . PRO C 3 123 ? 11.773  66.754 19.266 1.000 35.388 ? 123 PRO LLL C    1 
ATOM   5058 O  O    . PRO C 3 123 ? 11.113  66.608 18.245 1.000 35.482 ? 123 PRO LLL O    1 
ATOM   5059 C  CB   . PRO C 3 123 ? 13.565  68.499 19.579 1.000 35.060 ? 123 PRO LLL CB   1 
ATOM   5060 C  CG   . PRO C 3 123 ? 13.549  69.239 18.263 1.000 35.084 ? 123 PRO LLL CG   1 
ATOM   5061 C  CD   . PRO C 3 123 ? 14.132  68.259 17.263 1.000 34.635 ? 123 PRO LLL CD   1 
ATOM   5062 H  HA   . PRO C 3 123 ? 13.778  66.427 19.768 1.000 34.798 ? 123 PRO LLL HA   1 
ATOM   5063 H  HB2  . PRO C 3 123 ? 12.879  68.851 20.186 1.000 35.366 ? 123 PRO LLL HB2  1 
ATOM   5064 H  HB3  . PRO C 3 123 ? 14.442  68.574 20.012 1.000 35.024 ? 123 PRO LLL HB3  1 
ATOM   5065 H  HG2  . PRO C 3 123 ? 12.636  69.486 18.013 1.000 35.269 ? 123 PRO LLL HG2  1 
ATOM   5066 H  HG3  . PRO C 3 123 ? 14.095  70.050 18.312 1.000 35.097 ? 123 PRO LLL HG3  1 
ATOM   5067 H  HD2  . PRO C 3 123 ? 13.750  68.397 16.377 1.000 34.761 ? 123 PRO LLL HD2  1 
ATOM   5068 H  HD3  . PRO C 3 123 ? 15.101  68.343 17.210 1.000 34.564 ? 123 PRO LLL HD3  1 
ATOM   5069 N  N    . PRO C 3 124 ? 11.186  66.657 20.477 1.000 36.402 ? 124 PRO LLL N    1 
ATOM   5070 C  CA   . PRO C 3 124 ? 9.746   66.482 20.605 1.000 37.239 ? 124 PRO LLL CA   1 
ATOM   5071 C  C    . PRO C 3 124 ? 9.070   67.810 20.266 1.000 37.935 ? 124 PRO LLL C    1 
ATOM   5072 O  O    . PRO C 3 124 ? 9.710   68.823 20.355 1.000 38.190 ? 124 PRO LLL O    1 
ATOM   5073 C  CB   . PRO C 3 124 ? 9.526   66.119 22.079 1.000 37.732 ? 124 PRO LLL CB   1 
ATOM   5074 C  CG   . PRO C 3 124 ? 10.922  65.910 22.647 1.000 37.275 ? 124 PRO LLL CG   1 
ATOM   5075 C  CD   . PRO C 3 124 ? 11.850  66.735 21.784 1.000 36.582 ? 124 PRO LLL CD   1 
ATOM   5076 H  HA   . PRO C 3 124 ? 9.429   65.753 20.015 1.000 37.228 ? 124 PRO LLL HA   1 
ATOM   5077 H  HB2  . PRO C 3 124 ? 9.064   66.843 22.553 1.000 38.089 ? 124 PRO LLL HB2  1 
ATOM   5078 H  HB3  . PRO C 3 124 ? 8.993   65.300 22.160 1.000 37.906 ? 124 PRO LLL HB3  1 
ATOM   5079 H  HG2  . PRO C 3 124 ? 10.963  66.210 23.578 1.000 37.574 ? 124 PRO LLL HG2  1 
ATOM   5080 H  HG3  . PRO C 3 124 ? 11.170  64.964 22.612 1.000 37.077 ? 124 PRO LLL HG3  1 
ATOM   5081 H  HD2  . PRO C 3 124 ? 11.906  67.656 22.099 1.000 36.786 ? 124 PRO LLL HD2  1 
ATOM   5082 H  HD3  . PRO C 3 124 ? 12.744  66.348 21.755 1.000 36.329 ? 124 PRO LLL HD3  1 
ATOM   5083 N  N    . SER C 3 125 ? 7.801   67.767 19.881 1.000 39.502 ? 125 SER LLL N    1 
ATOM   5084 C  CA   . SER C 3 125 ? 6.943   68.969 19.738 1.000 40.195 ? 125 SER LLL CA   1 
ATOM   5085 C  C    . SER C 3 125 ? 6.585   69.472 21.136 1.000 41.231 ? 125 SER LLL C    1 
ATOM   5086 O  O    . SER C 3 125 ? 6.529   68.641 22.062 1.000 41.430 ? 125 SER LLL O    1 
ATOM   5087 C  CB   . SER C 3 125 ? 5.717   68.653 18.936 1.000 40.550 ? 125 SER LLL CB   1 
ATOM   5088 O  OG   . SER C 3 125 ? 5.082   67.490 19.441 1.000 40.673 ? 125 SER LLL OG   1 
ATOM   5089 H  H    . SER C 3 125 ? 7.361   66.995 19.679 1.000 39.432 ? 125 SER LLL H    1 
ATOM   5090 H  HA   . SER C 3 125 ? 7.464   69.675 19.268 1.000 39.965 ? 125 SER LLL HA   1 
ATOM   5091 H  HB2  . SER C 3 125 ? 5.093   69.413 18.974 1.000 40.951 ? 125 SER LLL HB2  1 
ATOM   5092 H  HB3  . SER C 3 125 ? 5.969   68.508 17.997 1.000 40.296 ? 125 SER LLL HB3  1 
ATOM   5093 H  HG   . SER C 3 125 ? 4.491   67.328 18.916 0.000 30.000 ? 125 SER LLL HG   1 
ATOM   5094 N  N    . SER C 3 126 ? 6.367   70.778 21.287 1.000 42.561 ? 126 SER LLL N    1 
ATOM   5095 C  CA   . SER C 3 126 ? 5.820   71.378 22.531 1.000 44.095 ? 126 SER LLL CA   1 
ATOM   5096 C  C    . SER C 3 126 ? 4.384   70.875 22.720 1.000 45.970 ? 126 SER LLL C    1 
ATOM   5097 O  O    . SER C 3 126 ? 4.012   70.615 23.876 1.000 48.262 ? 126 SER LLL O    1 
ATOM   5098 C  CB   . SER C 3 126 ? 5.900   72.881 22.515 1.000 43.724 ? 126 SER LLL CB   1 
ATOM   5099 O  OG   . SER C 3 126 ? 4.871   73.424 21.715 1.000 43.842 ? 126 SER LLL OG   1 
ATOM   5100 H  H    . SER C 3 126 ? 6.533   71.397 20.640 1.000 42.331 ? 126 SER LLL H    1 
ATOM   5101 H  HA   . SER C 3 126 ? 6.364   71.045 23.293 1.000 43.964 ? 126 SER LLL HA   1 
ATOM   5102 H  HB2  . SER C 3 126 ? 5.818   73.224 23.434 1.000 44.129 ? 126 SER LLL HB2  1 
ATOM   5103 H  HB3  . SER C 3 126 ? 6.775   73.160 22.160 1.000 43.255 ? 126 SER LLL HB3  1 
ATOM   5104 H  HG   . SER C 3 126 ? 5.008   74.283 21.882 0.000 30.000 ? 126 SER LLL HG   1 
ATOM   5105 N  N    . GLU C 3 127 ? 3.633   70.716 21.620 1.000 46.748 ? 127 GLU LLL N    1 
ATOM   5106 C  CA   . GLU C 3 127 ? 2.286   70.072 21.579 1.000 47.798 ? 127 GLU LLL CA   1 
ATOM   5107 C  C    . GLU C 3 127 ? 2.331   68.744 22.337 1.000 46.881 ? 127 GLU LLL C    1 
ATOM   5108 O  O    . GLU C 3 127 ? 1.536   68.574 23.264 1.000 48.225 ? 127 GLU LLL O    1 
ATOM   5109 C  CB   . GLU C 3 127 ? 1.825   69.800 20.143 1.000 49.222 ? 127 GLU LLL CB   1 
ATOM   5110 C  CG   . GLU C 3 127 ? 1.260   71.015 19.418 1.000 50.831 ? 127 GLU LLL CG   1 
ATOM   5111 C  CD   . GLU C 3 127 ? 2.221   71.828 18.555 1.000 51.320 ? 127 GLU LLL CD   1 
ATOM   5112 O  OE1  . GLU C 3 127 ? 3.467   71.715 18.736 1.000 49.813 ? 127 GLU LLL OE1  1 
ATOM   5113 O  OE2  . GLU C 3 127 ? 1.714   72.592 17.698 1.000 53.330 ? 127 GLU LLL OE2  1 
ATOM   5114 H  H    . GLU C 3 127 ? 3.908   71.014 20.804 1.000 46.295 ? 127 GLU LLL H    1 
ATOM   5115 H  HA   . GLU C 3 127 ? 1.639   70.670 22.019 1.000 48.452 ? 127 GLU LLL HA   1 
ATOM   5116 H  HB2  . GLU C 3 127 ? 2.587   69.453 19.633 1.000 48.525 ? 127 GLU LLL HB2  1 
ATOM   5117 H  HB3  . GLU C 3 127 ? 1.138   69.101 20.165 1.000 49.707 ? 127 GLU LLL HB3  1 
ATOM   5118 H  HG2  . GLU C 3 127 ? 0.525   70.715 18.846 1.000 51.309 ? 127 GLU LLL HG2  1 
ATOM   5119 H  HG3  . GLU C 3 127 ? 0.872   71.620 20.085 1.000 51.238 ? 127 GLU LLL HG3  1 
ATOM   5120 N  N    . GLU C 3 128 ? 3.243   67.850 21.954 1.000 45.439 ? 128 GLU LLL N    1 
ATOM   5121 C  CA   . GLU C 3 128 ? 3.385   66.491 22.539 1.000 45.235 ? 128 GLU LLL CA   1 
ATOM   5122 C  C    . GLU C 3 128 ? 3.703   66.596 24.034 1.000 45.217 ? 128 GLU LLL C    1 
ATOM   5123 O  O    . GLU C 3 128 ? 3.140   65.789 24.805 1.000 46.274 ? 128 GLU LLL O    1 
ATOM   5124 C  CB   . GLU C 3 128 ? 4.482   65.706 21.819 1.000 44.523 ? 128 GLU LLL CB   1 
ATOM   5125 C  CG   . GLU C 3 128 ? 4.618   64.274 22.299 1.000 44.834 ? 128 GLU LLL CG   1 
ATOM   5126 C  CD   . GLU C 3 128 ? 5.670   63.437 21.589 1.000 44.602 ? 128 GLU LLL CD   1 
ATOM   5127 O  OE1  . GLU C 3 128 ? 6.507   64.006 20.820 1.000 43.957 ? 128 GLU LLL OE1  1 
ATOM   5128 O  OE2  . GLU C 3 128 ? 5.651   62.208 21.804 1.000 44.956 ? 128 GLU LLL OE2  1 
ATOM   5129 H  H    . GLU C 3 128 ? 3.845   68.026 21.293 1.000 44.946 ? 128 GLU LLL H    1 
ATOM   5130 H  HA   . GLU C 3 128 ? 2.529   66.015 22.431 1.000 45.885 ? 128 GLU LLL HA   1 
ATOM   5131 H  HB2  . GLU C 3 128 ? 4.281   65.700 20.861 1.000 44.407 ? 128 GLU LLL HB2  1 
ATOM   5132 H  HB3  . GLU C 3 128 ? 5.336   66.170 21.946 1.000 44.015 ? 128 GLU LLL HB3  1 
ATOM   5133 H  HG2  . GLU C 3 128 ? 4.831   64.281 23.254 1.000 45.103 ? 128 GLU LLL HG2  1 
ATOM   5134 H  HG3  . GLU C 3 128 ? 3.752   63.826 22.197 1.000 45.517 ? 128 GLU LLL HG3  1 
ATOM   5135 N  N    . LEU C 3 129 ? 4.576   67.537 24.418 1.000 44.046 ? 129 LEU LLL N    1 
ATOM   5136 C  CA   . LEU C 3 129 ? 5.120   67.672 25.799 1.000 43.634 ? 129 LEU LLL CA   1 
ATOM   5137 C  C    . LEU C 3 129 ? 3.983   68.012 26.766 1.000 44.188 ? 129 LEU LLL C    1 
ATOM   5138 O  O    . LEU C 3 129 ? 4.086   67.645 27.948 1.000 44.212 ? 129 LEU LLL O    1 
ATOM   5139 C  CB   . LEU C 3 129 ? 6.208   68.752 25.827 1.000 43.557 ? 129 LEU LLL CB   1 
ATOM   5140 C  CG   . LEU C 3 129 ? 7.541   68.384 25.168 1.000 42.754 ? 129 LEU LLL CG   1 
ATOM   5141 C  CD1  . LEU C 3 129 ? 8.472   69.589 25.098 1.000 42.220 ? 129 LEU LLL CD1  1 
ATOM   5142 C  CD2  . LEU C 3 129 ? 8.215   67.238 25.905 1.000 42.779 ? 129 LEU LLL CD2  1 
ATOM   5143 H  H    . LEU C 3 129 ? 4.900   68.161 23.839 1.000 43.636 ? 129 LEU LLL H    1 
ATOM   5144 H  HA   . LEU C 3 129 ? 5.508   66.811 26.065 1.000 43.609 ? 129 LEU LLL HA   1 
ATOM   5145 H  HB2  . LEU C 3 129 ? 5.858   69.552 25.387 1.000 43.524 ? 129 LEU LLL HB2  1 
ATOM   5146 H  HB3  . LEU C 3 129 ? 6.382   68.985 26.760 1.000 43.879 ? 129 LEU LLL HB3  1 
ATOM   5147 H  HG   . LEU C 3 129 ? 7.355   68.086 24.246 1.000 42.385 ? 129 LEU LLL HG   1 
ATOM   5148 H  HD11 . LEU C 3 129 ? 8.011   70.332 24.672 1.000 42.356 ? 129 LEU LLL HD11 1 
ATOM   5149 H  HD12 . LEU C 3 129 ? 9.263   69.359 24.581 1.000 41.707 ? 129 LEU LLL HD12 1 
ATOM   5150 H  HD13 . LEU C 3 129 ? 8.738   69.847 25.998 1.000 42.594 ? 129 LEU LLL HD13 1 
ATOM   5151 H  HD21 . LEU C 3 129 ? 8.154   67.387 26.865 1.000 43.293 ? 129 LEU LLL HD21 1 
ATOM   5152 H  HD22 . LEU C 3 129 ? 9.152   67.189 25.645 1.000 42.211 ? 129 LEU LLL HD22 1 
ATOM   5153 H  HD23 . LEU C 3 129 ? 7.773   66.402 25.679 1.000 42.824 ? 129 LEU LLL HD23 1 
ATOM   5154 N  N    . GLU C 3 130 ? 2.929   68.661 26.267 1.000 44.305 ? 130 GLU LLL N    1 
ATOM   5155 C  CA   . GLU C 3 130 ? 1.754   69.091 27.068 1.000 45.521 ? 130 GLU LLL CA   1 
ATOM   5156 C  C    . GLU C 3 130 ? 0.892   67.876 27.443 1.000 46.104 ? 130 GLU LLL C    1 
ATOM   5157 O  O    . GLU C 3 130 ? -0.055  68.069 28.225 1.000 47.140 ? 130 GLU LLL O    1 
ATOM   5158 C  CB   . GLU C 3 130 ? 0.954   70.149 26.303 1.000 45.809 ? 130 GLU LLL CB   1 
ATOM   5159 C  CG   . GLU C 3 130 ? 1.746   71.418 26.022 1.000 45.196 ? 130 GLU LLL CG   1 
ATOM   5160 C  CD   . GLU C 3 130 ? 1.961   72.332 27.218 1.000 45.546 ? 130 GLU LLL CD   1 
ATOM   5161 O  OE1  . GLU C 3 130 ? 0.981   72.929 27.689 1.000 46.389 ? 130 GLU LLL OE1  1 
ATOM   5162 O  OE2  . GLU C 3 130 ? 3.113   72.445 27.673 1.000 45.192 ? 130 GLU LLL OE2  1 
ATOM   5163 H  H    . GLU C 3 130 ? 2.869   68.890 25.388 1.000 43.996 ? 130 GLU LLL H    1 
ATOM   5164 H  HA   . GLU C 3 130 ? 2.089   69.498 27.900 1.000 45.708 ? 130 GLU LLL HA   1 
ATOM   5165 H  HB2  . GLU C 3 130 ? 0.656   69.763 25.454 1.000 45.670 ? 130 GLU LLL HB2  1 
ATOM   5166 H  HB3  . GLU C 3 130 ? 0.158   70.379 26.827 1.000 46.768 ? 130 GLU LLL HB3  1 
ATOM   5167 H  HG2  . GLU C 3 130 ? 2.623   71.171 25.668 1.000 44.329 ? 130 GLU LLL HG2  1 
ATOM   5168 H  HG3  . GLU C 3 130 ? 1.283   71.930 25.325 1.000 45.171 ? 130 GLU LLL HG3  1 
ATOM   5169 N  N    . THR C 3 131 ? 1.217   66.679 26.936 1.000 45.356 ? 131 THR LLL N    1 
ATOM   5170 C  CA   . THR C 3 131 ? 0.549   65.397 27.292 1.000 46.474 ? 131 THR LLL CA   1 
ATOM   5171 C  C    . THR C 3 131 ? 1.492   64.496 28.105 1.000 46.485 ? 131 THR LLL C    1 
ATOM   5172 O  O    . THR C 3 131 ? 1.225   63.279 28.147 1.000 46.427 ? 131 THR LLL O    1 
ATOM   5173 C  CB   . THR C 3 131 ? 0.047   64.667 26.039 1.000 46.212 ? 131 THR LLL CB   1 
ATOM   5174 O  OG1  . THR C 3 131 ? 1.168   64.103 25.357 1.000 44.471 ? 131 THR LLL OG1  1 
ATOM   5175 C  CG2  . THR C 3 131 ? -0.734  65.576 25.115 1.000 46.485 ? 131 THR LLL CG2  1 
ATOM   5176 H  H    . THR C 3 131 ? 1.862   66.565 26.307 1.000 44.620 ? 131 THR LLL H    1 
ATOM   5177 H  HA   . THR C 3 131 ? -0.230  65.609 27.854 1.000 47.496 ? 131 THR LLL HA   1 
ATOM   5178 H  HB   . THR C 3 131 ? -0.546  63.934 26.330 1.000 46.919 ? 131 THR LLL HB   1 
ATOM   5179 H  HG1  . THR C 3 131 ? 0.836   63.630 24.728 0.000 30.000 ? 131 THR LLL HG1  1 
ATOM   5180 H  HG21 . THR C 3 131 ? -1.351  66.119 25.637 1.000 47.283 ? 131 THR LLL HG21 1 
ATOM   5181 H  HG22 . THR C 3 131 ? -1.236  65.039 24.477 1.000 46.700 ? 131 THR LLL HG22 1 
ATOM   5182 H  HG23 . THR C 3 131 ? -0.118  66.158 24.634 1.000 45.652 ? 131 THR LLL HG23 1 
ATOM   5183 N  N    . ASN C 3 132 ? 2.525   65.073 28.734 1.000 46.468 ? 132 ASN LLL N    1 
ATOM   5184 C  CA   . ASN C 3 132 ? 3.504   64.391 29.629 1.000 47.060 ? 132 ASN LLL CA   1 
ATOM   5185 C  C    . ASN C 3 132 ? 4.313   63.343 28.843 1.000 45.720 ? 132 ASN LLL C    1 
ATOM   5186 O  O    . ASN C 3 132 ? 4.864   62.441 29.492 1.000 45.434 ? 132 ASN LLL O    1 
ATOM   5187 C  CB   . ASN C 3 132 ? 2.837   63.762 30.861 1.000 49.292 ? 132 ASN LLL CB   1 
ATOM   5188 C  CG   . ASN C 3 132 ? 1.810   64.658 31.531 1.000 51.985 ? 132 ASN LLL CG   1 
ATOM   5189 O  OD1  . ASN C 3 132 ? 0.983   65.273 30.859 1.000 52.999 ? 132 ASN LLL OD1  1 
ATOM   5190 N  ND2  . ASN C 3 132 ? 1.824   64.717 32.856 1.000 53.477 ? 132 ASN LLL ND2  1 
ATOM   5191 H  H    . ASN C 3 132 ? 2.697   65.963 28.652 1.000 46.303 ? 132 ASN LLL H    1 
ATOM   5192 H  HA   . ASN C 3 132 ? 4.132   65.075 29.959 1.000 46.763 ? 132 ASN LLL HA   1 
ATOM   5193 H  HB2  . ASN C 3 132 ? 2.400   62.929 30.589 1.000 49.627 ? 132 ASN LLL HB2  1 
ATOM   5194 H  HB3  . ASN C 3 132 ? 3.532   63.537 31.513 1.000 49.422 ? 132 ASN LLL HB3  1 
ATOM   5195 H  HD21 . ASN C 3 132 ? 1.031   65.206 33.230 0.000 30.000 ? 132 ASN LLL HD21 1 
ATOM   5196 H  HD22 . ASN C 3 132 ? 2.295   64.357 33.387 0.000 30.000 ? 132 ASN LLL HD22 1 
ATOM   5197 N  N    . LYS C 3 133 ? 4.410   63.479 27.512 1.000 45.067 ? 133 LYS LLL N    1 
ATOM   5198 C  CA   . LYS C 3 133 ? 5.148   62.567 26.589 1.000 43.876 ? 133 LYS LLL CA   1 
ATOM   5199 C  C    . LYS C 3 133 ? 6.161   63.378 25.771 1.000 42.075 ? 133 LYS LLL C    1 
ATOM   5200 O  O    . LYS C 3 133 ? 5.872   64.547 25.456 1.000 41.629 ? 133 LYS LLL O    1 
ATOM   5201 C  CB   . LYS C 3 133 ? 4.192   61.861 25.622 1.000 44.823 ? 133 LYS LLL CB   1 
ATOM   5202 C  CG   . LYS C 3 133 ? 3.109   61.008 26.268 1.000 47.006 ? 133 LYS LLL CG   1 
ATOM   5203 C  CD   . LYS C 3 133 ? 3.606   59.656 26.736 1.000 48.046 ? 133 LYS LLL CD   1 
ATOM   5204 C  CE   . LYS C 3 133 ? 2.492   58.737 27.193 1.000 49.953 ? 133 LYS LLL CE   1 
ATOM   5205 N  NZ   . LYS C 3 133 ? 3.014   57.414 27.618 1.000 50.447 ? 133 LYS LLL NZ   1 
ATOM   5206 H  H    . LYS C 3 133 ? 4.028   64.179 27.074 1.000 44.960 ? 133 LYS LLL H    1 
ATOM   5207 H  HA   . LYS C 3 133 ? 5.629   61.892 27.121 1.000 43.912 ? 133 LYS LLL HA   1 
ATOM   5208 H  HB2  . LYS C 3 133 ? 3.758   62.543 25.067 1.000 44.898 ? 133 LYS LLL HB2  1 
ATOM   5209 H  HB3  . LYS C 3 133 ? 4.722   61.290 25.027 1.000 44.221 ? 133 LYS LLL HB3  1 
ATOM   5210 H  HG2  . LYS C 3 133 ? 2.739   61.493 27.035 1.000 47.723 ? 133 LYS LLL HG2  1 
ATOM   5211 H  HG3  . LYS C 3 133 ? 2.384   60.874 25.620 1.000 47.293 ? 133 LYS LLL HG3  1 
ATOM   5212 H  HD2  . LYS C 3 133 ? 4.092   59.222 26.002 1.000 47.180 ? 133 LYS LLL HD2  1 
ATOM   5213 H  HD3  . LYS C 3 133 ? 4.234   59.786 27.478 1.000 47.881 ? 133 LYS LLL HD3  1 
ATOM   5214 H  HE2  . LYS C 3 133 ? 2.018   59.146 27.942 1.000 50.776 ? 133 LYS LLL HE2  1 
ATOM   5215 H  HE3  . LYS C 3 133 ? 1.855   58.608 26.466 1.000 50.083 ? 133 LYS LLL HE3  1 
ATOM   5216 H  HZ1  . LYS C 3 133 ? 3.450   57.020 26.927 1.000 49.534 ? 133 LYS LLL HZ1  1 
ATOM   5217 H  HZ2  . LYS C 3 133 ? 2.327   56.882 27.879 1.000 51.103 ? 133 LYS LLL HZ2  1 
ATOM   5218 H  HZ3  . LYS C 3 133 ? 3.589   57.518 28.311 1.000 50.240 ? 133 LYS LLL HZ3  1 
ATOM   5219 N  N    . ALA C 3 134 ? 7.300   62.770 25.433 1.000 40.737 ? 134 ALA LLL N    1 
ATOM   5220 C  CA   . ALA C 3 134 ? 8.377   63.369 24.607 1.000 39.518 ? 134 ALA LLL CA   1 
ATOM   5221 C  C    . ALA C 3 134 ? 8.995   62.288 23.718 1.000 38.474 ? 134 ALA LLL C    1 
ATOM   5222 O  O    . ALA C 3 134 ? 9.703   61.411 24.256 1.000 38.704 ? 134 ALA LLL O    1 
ATOM   5223 C  CB   . ALA C 3 134 ? 9.418   64.006 25.492 1.000 39.578 ? 134 ALA LLL CB   1 
ATOM   5224 H  H    . ALA C 3 134 ? 7.502   61.922 25.697 1.000 40.812 ? 134 ALA LLL H    1 
ATOM   5225 H  HA   . ALA C 3 134 ? 7.982   64.063 24.030 1.000 39.508 ? 134 ALA LLL HA   1 
ATOM   5226 H  HB1  . ALA C 3 134 ? 9.976   64.599 24.962 1.000 39.082 ? 134 ALA LLL HB1  1 
ATOM   5227 H  HB2  . ALA C 3 134 ? 8.980   64.516 26.193 1.000 40.118 ? 134 ALA LLL HB2  1 
ATOM   5228 H  HB3  . ALA C 3 134 ? 9.972   63.317 25.895 1.000 39.472 ? 134 ALA LLL HB3  1 
ATOM   5229 N  N    . THR C 3 135 ? 8.727   62.345 22.411 1.000 37.374 ? 135 THR LLL N    1 
ATOM   5230 C  CA   . THR C 3 135 ? 9.236   61.378 21.409 1.000 36.009 ? 135 THR LLL CA   1 
ATOM   5231 C  C    . THR C 3 135 ? 10.273  62.089 20.546 1.000 34.712 ? 135 THR LLL C    1 
ATOM   5232 O  O    . THR C 3 135 ? 9.879   62.984 19.780 1.000 34.870 ? 135 THR LLL O    1 
ATOM   5233 C  CB   . THR C 3 135 ? 8.103   60.777 20.567 1.000 36.370 ? 135 THR LLL CB   1 
ATOM   5234 O  OG1  . THR C 3 135 ? 7.112   60.243 21.445 1.000 37.051 ? 135 THR LLL OG1  1 
ATOM   5235 C  CG2  . THR C 3 135 ? 8.589   59.683 19.641 1.000 35.949 ? 135 THR LLL CG2  1 
ATOM   5236 H  H    . THR C 3 135 ? 8.224   63.002 22.035 1.000 37.538 ? 135 THR LLL H    1 
ATOM   5237 H  HA   . THR C 3 135 ? 9.679   60.647 21.892 1.000 35.945 ? 135 THR LLL HA   1 
ATOM   5238 H  HB   . THR C 3 135 ? 7.699   61.498 20.027 1.000 36.477 ? 135 THR LLL HB   1 
ATOM   5239 H  HG1  . THR C 3 135 ? 6.490   59.883 20.931 0.000 30.000 ? 135 THR LLL HG1  1 
ATOM   5240 H  HG21 . THR C 3 135 ? 9.064   60.079 18.888 1.000 35.584 ? 135 THR LLL HG21 1 
ATOM   5241 H  HG22 . THR C 3 135 ? 7.827   59.174 19.311 1.000 36.300 ? 135 THR LLL HG22 1 
ATOM   5242 H  HG23 . THR C 3 135 ? 9.190   59.088 20.126 1.000 35.719 ? 135 THR LLL HG23 1 
ATOM   5243 N  N    . LEU C 3 136 ? 11.546  61.727 20.704 1.000 34.173 ? 136 LEU LLL N    1 
ATOM   5244 C  CA   . LEU C 3 136 ? 12.630  62.116 19.764 1.000 33.835 ? 136 LEU LLL CA   1 
ATOM   5245 C  C    . LEU C 3 136 ? 12.548  61.185 18.553 1.000 33.792 ? 136 LEU LLL C    1 
ATOM   5246 O  O    . LEU C 3 136 ? 12.234  60.007 18.748 1.000 34.027 ? 136 LEU LLL O    1 
ATOM   5247 C  CB   . LEU C 3 136 ? 13.991  62.036 20.462 1.000 33.522 ? 136 LEU LLL CB   1 
ATOM   5248 C  CG   . LEU C 3 136 ? 14.285  63.171 21.446 1.000 34.249 ? 136 LEU LLL CG   1 
ATOM   5249 C  CD1  . LEU C 3 136 ? 13.760  62.850 22.840 1.000 34.928 ? 136 LEU LLL CD1  1 
ATOM   5250 C  CD2  . LEU C 3 136 ? 15.773  63.474 21.502 1.000 33.983 ? 136 LEU LLL CD2  1 
ATOM   5251 H  H    . LEU C 3 136 ? 11.827  61.212 21.401 1.000 34.281 ? 136 LEU LLL H    1 
ATOM   5252 H  HA   . LEU C 3 136 ? 12.468  63.040 19.466 1.000 33.899 ? 136 LEU LLL HA   1 
ATOM   5253 H  HB2  . LEU C 3 136 ? 14.044  61.185 20.940 1.000 33.675 ? 136 LEU LLL HB2  1 
ATOM   5254 H  HB3  . LEU C 3 136 ? 14.688  62.031 19.775 1.000 33.377 ? 136 LEU LLL HB3  1 
ATOM   5255 H  HG   . LEU C 3 136 ? 13.821  63.983 21.124 1.000 34.287 ? 136 LEU LLL HG   1 
ATOM   5256 H  HD11 . LEU C 3 136 ? 12.787  62.836 22.826 1.000 35.125 ? 136 LEU LLL HD11 1 
ATOM   5257 H  HD12 . LEU C 3 136 ? 14.065  63.529 23.466 1.000 35.085 ? 136 LEU LLL HD12 1 
ATOM   5258 H  HD13 . LEU C 3 136 ? 14.092  61.979 23.120 1.000 34.823 ? 136 LEU LLL HD13 1 
ATOM   5259 H  HD21 . LEU C 3 136 ? 16.259  62.670 21.758 1.000 33.927 ? 136 LEU LLL HD21 1 
ATOM   5260 H  HD22 . LEU C 3 136 ? 15.938  64.174 22.157 1.000 34.252 ? 136 LEU LLL HD22 1 
ATOM   5261 H  HD23 . LEU C 3 136 ? 16.078  63.771 20.627 1.000 33.810 ? 136 LEU LLL HD23 1 
ATOM   5262 N  N    . VAL C 3 137 ? 12.765  61.713 17.348 1.000 34.264 ? 137 VAL LLL N    1 
ATOM   5263 C  CA   . VAL C 3 137 ? 12.656  60.946 16.073 1.000 34.722 ? 137 VAL LLL CA   1 
ATOM   5264 C  C    . VAL C 3 137 ? 13.967  61.071 15.297 1.000 34.629 ? 137 VAL LLL C    1 
ATOM   5265 O  O    . VAL C 3 137 ? 14.345  62.206 14.953 1.000 34.992 ? 137 VAL LLL O    1 
ATOM   5266 C  CB   . VAL C 3 137 ? 11.471  61.427 15.221 1.000 35.356 ? 137 VAL LLL CB   1 
ATOM   5267 C  CG1  . VAL C 3 137 ? 11.432  60.709 13.877 1.000 35.381 ? 137 VAL LLL CG1  1 
ATOM   5268 C  CG2  . VAL C 3 137 ? 10.154  61.273 15.970 1.000 36.045 ? 137 VAL LLL CG2  1 
ATOM   5269 H  H    . VAL C 3 137 ? 12.997  62.586 17.228 1.000 34.253 ? 137 VAL LLL H    1 
ATOM   5270 H  HA   . VAL C 3 137 ? 12.516  60.007 16.290 1.000 34.669 ? 137 VAL LLL HA   1 
ATOM   5271 H  HB   . VAL C 3 137 ? 11.606  62.390 15.044 1.000 35.397 ? 137 VAL LLL HB   1 
ATOM   5272 H  HG11 . VAL C 3 137 ? 12.043  61.145 13.257 1.000 35.330 ? 137 VAL LLL HG11 1 
ATOM   5273 H  HG12 . VAL C 3 137 ? 10.530  60.742 13.515 1.000 35.810 ? 137 VAL LLL HG12 1 
ATOM   5274 H  HG13 . VAL C 3 137 ? 11.699  59.781 13.995 1.000 35.232 ? 137 VAL LLL HG13 1 
ATOM   5275 H  HG21 . VAL C 3 137 ? 10.069  60.360 16.291 1.000 35.963 ? 137 VAL LLL HG21 1 
ATOM   5276 H  HG22 . VAL C 3 137 ? 9.413   61.476 15.372 1.000 36.342 ? 137 VAL LLL HG22 1 
ATOM   5277 H  HG23 . VAL C 3 137 ? 10.136  61.885 16.726 1.000 36.020 ? 137 VAL LLL HG23 1 
ATOM   5278 N  N    . CYS C 3 138 ? 14.599  59.932 15.019 1.000 34.640 ? 138 CYS LLL N    1 
ATOM   5279 C  CA   . CYS C 3 138 ? 15.843  59.804 14.222 1.000 34.479 ? 138 CYS LLL CA   1 
ATOM   5280 C  C    . CYS C 3 138 ? 15.510  59.171 12.871 1.000 34.292 ? 138 CYS LLL C    1 
ATOM   5281 O  O    . CYS C 3 138 ? 15.346  57.948 12.825 1.000 33.633 ? 138 CYS LLL O    1 
ATOM   5282 C  CB   . CYS C 3 138 ? 16.864  58.954 14.961 1.000 34.626 ? 138 CYS LLL CB   1 
ATOM   5283 S  SG   . CYS C 3 138 ? 18.565  59.318 14.472 1.000 36.252 ? 138 CYS LLL SG   1 
ATOM   5284 H  H    . CYS C 3 138 ? 14.299  59.122 15.310 1.000 34.558 ? 138 CYS LLL H    1 
ATOM   5285 H  HA   . CYS C 3 138 ? 16.218  60.701 14.078 1.000 34.562 ? 138 CYS LLL HA   1 
ATOM   5286 H  HB2  . CYS C 3 138 ? 16.776  59.112 15.922 1.000 34.876 ? 138 CYS LLL HB2  1 
ATOM   5287 H  HB3  . CYS C 3 138 ? 16.685  58.006 14.794 1.000 34.826 ? 138 CYS LLL HB3  1 
ATOM   5288 N  N    . THR C 3 139 ? 15.383  59.986 11.822 1.000 34.860 ? 139 THR LLL N    1 
ATOM   5289 C  CA   . THR C 3 139 ? 15.155  59.527 10.426 1.000 35.147 ? 139 THR LLL CA   1 
ATOM   5290 C  C    . THR C 3 139 ? 16.488  59.124 9.812  1.000 34.866 ? 139 THR LLL C    1 
ATOM   5291 O  O    . THR C 3 139 ? 17.475  59.834 10.046 1.000 35.261 ? 139 THR LLL O    1 
ATOM   5292 C  CB   . THR C 3 139 ? 14.538  60.606 9.535  1.000 35.942 ? 139 THR LLL CB   1 
ATOM   5293 O  OG1  . THR C 3 139 ? 15.449  61.707 9.509  1.000 36.680 ? 139 THR LLL OG1  1 
ATOM   5294 C  CG2  . THR C 3 139 ? 13.163  61.027 10.004 1.000 36.219 ? 139 THR LLL CG2  1 
ATOM   5295 H  H    . THR C 3 139 ? 15.428  60.894 11.889 1.000 34.877 ? 139 THR LLL H    1 
ATOM   5296 H  HA   . THR C 3 139 ? 14.557  58.745 10.447 1.000 35.192 ? 139 THR LLL HA   1 
ATOM   5297 H  HB   . THR C 3 139 ? 14.464  60.243 8.627  1.000 36.408 ? 139 THR LLL HB   1 
ATOM   5298 H  HG1  . THR C 3 139 ? 15.227  62.195 8.919  0.000 30.000 ? 139 THR LLL HG1  1 
ATOM   5299 H  HG21 . THR C 3 139 ? 12.587  60.245 10.070 1.000 36.261 ? 139 THR LLL HG21 1 
ATOM   5300 H  HG22 . THR C 3 139 ? 12.781  61.657 9.367  1.000 36.609 ? 139 THR LLL HG22 1 
ATOM   5301 H  HG23 . THR C 3 139 ? 13.233  61.453 10.877 1.000 35.946 ? 139 THR LLL HG23 1 
ATOM   5302 N  N    . ILE C 3 140 ? 16.482  58.033 9.050  1.000 34.967 ? 140 ILE LLL N    1 
ATOM   5303 C  CA   . ILE C 3 140 ? 17.678  57.428 8.400  1.000 34.917 ? 140 ILE LLL CA   1 
ATOM   5304 C  C    . ILE C 3 140 ? 17.277  57.073 6.967  1.000 35.632 ? 140 ILE LLL C    1 
ATOM   5305 O  O    . ILE C 3 140 ? 16.323  56.299 6.807  1.000 36.240 ? 140 ILE LLL O    1 
ATOM   5306 C  CB   . ILE C 3 140 ? 18.163  56.202 9.197  1.000 34.395 ? 140 ILE LLL CB   1 
ATOM   5307 C  CG1  . ILE C 3 140 ? 18.093  56.434 10.713 1.000 33.896 ? 140 ILE LLL CG1  1 
ATOM   5308 C  CG2  . ILE C 3 140 ? 19.556  55.805 8.741  1.000 34.738 ? 140 ILE LLL CG2  1 
ATOM   5309 C  CD1  . ILE C 3 140 ? 18.393  55.211 11.556 1.000 33.326 ? 140 ILE LLL CD1  1 
ATOM   5310 H  H    . ILE C 3 140 ? 15.716  57.571 8.877  1.000 35.085 ? 140 ILE LLL H    1 
ATOM   5311 H  HA   . ILE C 3 140 ? 18.391  58.088 8.377  1.000 35.012 ? 140 ILE LLL HA   1 
ATOM   5312 H  HB   . ILE C 3 140 ? 17.554  55.452 8.986  1.000 34.489 ? 140 ILE LLL HB   1 
ATOM   5313 H  HG12 . ILE C 3 140 ? 18.729  57.142 10.950 1.000 33.854 ? 140 ILE LLL HG12 1 
ATOM   5314 H  HG13 . ILE C 3 140 ? 17.195  56.751 10.942 1.000 33.913 ? 140 ILE LLL HG13 1 
ATOM   5315 H  HG21 . ILE C 3 140 ? 19.578  55.745 7.771  1.000 35.076 ? 140 ILE LLL HG21 1 
ATOM   5316 H  HG22 . ILE C 3 140 ? 19.790  54.941 9.123  1.000 34.393 ? 140 ILE LLL HG22 1 
ATOM   5317 H  HG23 . ILE C 3 140 ? 20.198  56.473 9.038  1.000 34.645 ? 140 ILE LLL HG23 1 
ATOM   5318 H  HD11 . ILE C 3 140 ? 17.856  54.462 11.245 1.000 33.432 ? 140 ILE LLL HD11 1 
ATOM   5319 H  HD12 . ILE C 3 140 ? 18.181  55.398 12.487 1.000 33.209 ? 140 ILE LLL HD12 1 
ATOM   5320 H  HD13 . ILE C 3 140 ? 19.337  54.986 11.479 1.000 33.339 ? 140 ILE LLL HD13 1 
ATOM   5321 N  N    . THR C 3 141 ? 17.945  57.646 5.967  1.000 35.911 ? 141 THR LLL N    1 
ATOM   5322 C  CA   . THR C 3 141 ? 17.519  57.568 4.547  1.000 36.659 ? 141 THR LLL CA   1 
ATOM   5323 C  C    . THR C 3 141 ? 18.712  57.203 3.665  1.000 37.036 ? 141 THR LLL C    1 
ATOM   5324 O  O    . THR C 3 141 ? 19.851  57.524 4.044  1.000 37.505 ? 141 THR LLL O    1 
ATOM   5325 C  CB   . THR C 3 141 ? 16.858  58.883 4.111  1.000 37.297 ? 141 THR LLL CB   1 
ATOM   5326 O  OG1  . THR C 3 141 ? 17.731  59.985 4.363  1.000 36.933 ? 141 THR LLL OG1  1 
ATOM   5327 C  CG2  . THR C 3 141 ? 15.553  59.138 4.830  1.000 37.300 ? 141 THR LLL CG2  1 
ATOM   5328 H  H    . THR C 3 141 ? 18.711  58.128 6.081  1.000 35.942 ? 141 THR LLL H    1 
ATOM   5329 H  HA   . THR C 3 141 ? 16.851  56.849 4.471  1.000 36.697 ? 141 THR LLL HA   1 
ATOM   5330 H  HB   . THR C 3 141 ? 16.680  58.832 3.142  1.000 37.950 ? 141 THR LLL HB   1 
ATOM   5331 H  HG1  . THR C 3 141 ? 17.311  60.787 4.166  0.000 30.000 ? 141 THR LLL HG1  1 
ATOM   5332 H  HG21 . THR C 3 141 ? 14.946  58.392 4.677  1.000 37.331 ? 141 THR LLL HG21 1 
ATOM   5333 H  HG22 . THR C 3 141 ? 15.150  59.957 4.492  1.000 37.637 ? 141 THR LLL HG22 1 
ATOM   5334 H  HG23 . THR C 3 141 ? 15.720  59.229 5.785  1.000 36.645 ? 141 THR LLL HG23 1 
ATOM   5335 N  N    . ASP C 3 142 ? 18.445  56.539 2.542  1.000 37.600 ? 142 ASP LLL N    1 
ATOM   5336 C  CA   . ASP C 3 142 ? 19.395  56.393 1.407  1.000 38.761 ? 142 ASP LLL CA   1 
ATOM   5337 C  C    . ASP C 3 142 ? 20.658  55.632 1.847  1.000 38.147 ? 142 ASP LLL C    1 
ATOM   5338 O  O    . ASP C 3 142 ? 21.765  56.079 1.470  1.000 38.700 ? 142 ASP LLL O    1 
ATOM   5339 C  CB   . ASP C 3 142 ? 19.746  57.769 0.834  1.000 39.514 ? 142 ASP LLL CB   1 
ATOM   5340 C  CG   . ASP C 3 142 ? 18.549  58.689 0.657  1.000 40.265 ? 142 ASP LLL CG   1 
ATOM   5341 O  OD1  . ASP C 3 142 ? 17.738  58.425 -0.258 1.000 40.882 ? 142 ASP LLL OD1  1 
ATOM   5342 O  OD2  . ASP C 3 142 ? 18.432  59.660 1.444  1.000 40.135 ? 142 ASP LLL OD2  1 
ATOM   5343 H  H    . ASP C 3 142 ? 17.646  56.125 2.401  1.000 37.798 ? 142 ASP LLL H    1 
ATOM   5344 H  HA   . ASP C 3 142 ? 18.948  55.872 0.700  1.000 39.181 ? 142 ASP LLL HA   1 
ATOM   5345 H  HB2  . ASP C 3 142 ? 20.384  58.212 1.430  1.000 39.258 ? 142 ASP LLL HB2  1 
ATOM   5346 H  HB3  . ASP C 3 142 ? 20.175  57.651 -0.039 1.000 40.378 ? 142 ASP LLL HB3  1 
ATOM   5347 N  N    . PHE C 3 143 ? 20.517  54.514 2.575  1.000 36.537 ? 143 PHE LLL N    1 
ATOM   5348 C  CA   . PHE C 3 143 ? 21.651  53.612 2.915  1.000 35.695 ? 143 PHE LLL CA   1 
ATOM   5349 C  C    . PHE C 3 143 ? 21.513  52.266 2.179  1.000 36.106 ? 143 PHE LLL C    1 
ATOM   5350 O  O    . PHE C 3 143 ? 20.380  51.773 1.962  1.000 35.840 ? 143 PHE LLL O    1 
ATOM   5351 C  CB   . PHE C 3 143 ? 21.825  53.488 4.431  1.000 34.219 ? 143 PHE LLL CB   1 
ATOM   5352 C  CG   . PHE C 3 143 ? 20.655  52.925 5.195  1.000 33.489 ? 143 PHE LLL CG   1 
ATOM   5353 C  CD1  . PHE C 3 143 ? 19.623  53.747 5.622  1.000 33.290 ? 143 PHE LLL CD1  1 
ATOM   5354 C  CD2  . PHE C 3 143 ? 20.605  51.582 5.529  1.000 32.874 ? 143 PHE LLL CD2  1 
ATOM   5355 C  CE1  . PHE C 3 143 ? 18.555  53.234 6.341  1.000 32.681 ? 143 PHE LLL CE1  1 
ATOM   5356 C  CE2  . PHE C 3 143 ? 19.537  51.070 6.248  1.000 32.535 ? 143 PHE LLL CE2  1 
ATOM   5357 C  CZ   . PHE C 3 143 ? 18.515  51.896 6.650  1.000 32.568 ? 143 PHE LLL CZ   1 
ATOM   5358 H  H    . PHE C 3 143 ? 19.719  54.217 2.895  1.000 36.310 ? 143 PHE LLL H    1 
ATOM   5359 H  HA   . PHE C 3 143 ? 22.470  54.041 2.570  1.000 36.156 ? 143 PHE LLL HA   1 
ATOM   5360 H  HB2  . PHE C 3 143 ? 22.607  52.922 4.601  1.000 34.194 ? 143 PHE LLL HB2  1 
ATOM   5361 H  HB3  . PHE C 3 143 ? 22.026  54.378 4.786  1.000 34.235 ? 143 PHE LLL HB3  1 
ATOM   5362 H  HD1  . PHE C 3 143 ? 19.645  54.667 5.410  1.000 33.510 ? 143 PHE LLL HD1  1 
ATOM   5363 H  HD2  . PHE C 3 143 ? 21.303  51.010 5.255  1.000 33.067 ? 143 PHE LLL HD2  1 
ATOM   5364 H  HE1  . PHE C 3 143 ? 17.854  53.804 6.614  1.000 32.779 ? 143 PHE LLL HE1  1 
ATOM   5365 H  HE2  . PHE C 3 143 ? 19.511  50.151 6.459  1.000 32.337 ? 143 PHE LLL HE2  1 
ATOM   5366 H  HZ   . PHE C 3 143 ? 17.788  51.545 7.139  1.000 32.335 ? 143 PHE LLL HZ   1 
ATOM   5367 N  N    . TYR C 3 144 ? 22.661  51.727 1.745  1.000 36.370 ? 144 TYR LLL N    1 
ATOM   5368 C  CA   . TYR C 3 144 ? 22.838  50.371 1.156  1.000 36.623 ? 144 TYR LLL CA   1 
ATOM   5369 C  C    . TYR C 3 144 ? 24.242  49.864 1.495  1.000 36.438 ? 144 TYR LLL C    1 
ATOM   5370 O  O    . TYR C 3 144 ? 25.213  50.604 1.325  1.000 37.088 ? 144 TYR LLL O    1 
ATOM   5371 C  CB   . TYR C 3 144 ? 22.613  50.400 -0.358 1.000 37.820 ? 144 TYR LLL CB   1 
ATOM   5372 C  CG   . TYR C 3 144 ? 22.513  49.037 -0.998 1.000 37.976 ? 144 TYR LLL CG   1 
ATOM   5373 C  CD1  . TYR C 3 144 ? 21.375  48.262 -0.849 1.000 37.632 ? 144 TYR LLL CD1  1 
ATOM   5374 C  CD2  . TYR C 3 144 ? 23.551  48.517 -1.753 1.000 38.673 ? 144 TYR LLL CD2  1 
ATOM   5375 C  CE1  . TYR C 3 144 ? 21.267  47.010 -1.430 1.000 38.150 ? 144 TYR LLL CE1  1 
ATOM   5376 C  CE2  . TYR C 3 144 ? 23.459  47.265 -2.344 1.000 39.195 ? 144 TYR LLL CE2  1 
ATOM   5377 C  CZ   . TYR C 3 144 ? 22.311  46.506 -2.187 1.000 38.922 ? 144 TYR LLL CZ   1 
ATOM   5378 O  OH   . TYR C 3 144 ? 22.207  45.265 -2.758 1.000 39.234 ? 144 TYR LLL OH   1 
ATOM   5379 H  H    . TYR C 3 144 ? 23.450  52.182 1.780  1.000 36.565 ? 144 TYR LLL H    1 
ATOM   5380 H  HA   . TYR C 3 144 ? 22.172  49.767 1.558  1.000 36.127 ? 144 TYR LLL HA   1 
ATOM   5381 H  HB2  . TYR C 3 144 ? 21.786  50.895 -0.538 1.000 37.951 ? 144 TYR LLL HB2  1 
ATOM   5382 H  HB3  . TYR C 3 144 ? 23.352  50.892 -0.772 1.000 38.347 ? 144 TYR LLL HB3  1 
ATOM   5383 H  HD1  . TYR C 3 144 ? 20.655  48.595 -0.339 1.000 37.267 ? 144 TYR LLL HD1  1 
ATOM   5384 H  HD2  . TYR C 3 144 ? 24.337  49.025 -1.871 1.000 39.066 ? 144 TYR LLL HD2  1 
ATOM   5385 H  HE1  . TYR C 3 144 ? 20.481  46.501 -1.315 1.000 37.979 ? 144 TYR LLL HE1  1 
ATOM   5386 H  HE2  . TYR C 3 144 ? 24.178  46.930 -2.855 1.000 39.741 ? 144 TYR LLL HE2  1 
ATOM   5387 H  HH   . TYR C 3 144 ? 21.462  45.215 -3.291 0.000 30.000 ? 144 TYR LLL HH   1 
ATOM   5388 N  N    . PRO C 3 145 ? 24.421  48.616 1.997  1.000 35.571 ? 145 PRO LLL N    1 
ATOM   5389 C  CA   . PRO C 3 145 ? 23.318  47.714 2.344  1.000 34.776 ? 145 PRO LLL CA   1 
ATOM   5390 C  C    . PRO C 3 145 ? 22.312  48.263 3.367  1.000 33.725 ? 145 PRO LLL C    1 
ATOM   5391 O  O    . PRO C 3 145 ? 22.610  49.232 4.026  1.000 33.187 ? 145 PRO LLL O    1 
ATOM   5392 C  CB   . PRO C 3 145 ? 24.027  46.492 2.956  1.000 34.211 ? 145 PRO LLL CB   1 
ATOM   5393 C  CG   . PRO C 3 145 ? 25.405  46.510 2.340  1.000 34.847 ? 145 PRO LLL CG   1 
ATOM   5394 C  CD   . PRO C 3 145 ? 25.734  47.981 2.202  1.000 35.377 ? 145 PRO LLL CD   1 
ATOM   5395 H  HA   . PRO C 3 145 ? 22.847  47.441 1.517  1.000 35.289 ? 145 PRO LLL HA   1 
ATOM   5396 H  HB2  . PRO C 3 145 ? 24.081  46.569 3.933  1.000 33.589 ? 145 PRO LLL HB2  1 
ATOM   5397 H  HB3  . PRO C 3 145 ? 23.555  45.664 2.731  1.000 34.232 ? 145 PRO LLL HB3  1 
ATOM   5398 H  HG2  . PRO C 3 145 ? 26.053  46.061 2.920  1.000 34.555 ? 145 PRO LLL HG2  1 
ATOM   5399 H  HG3  . PRO C 3 145 ? 25.402  46.070 1.466  1.000 35.482 ? 145 PRO LLL HG3  1 
ATOM   5400 H  HD2  . PRO C 3 145 ? 26.165  48.321 3.007  1.000 34.991 ? 145 PRO LLL HD2  1 
ATOM   5401 H  HD3  . PRO C 3 145 ? 26.320  48.138 1.438  1.000 36.167 ? 145 PRO LLL HD3  1 
ATOM   5402 N  N    . GLY C 3 146 ? 21.153  47.606 3.459  1.000 33.715 ? 146 GLY LLL N    1 
ATOM   5403 C  CA   . GLY C 3 146 ? 20.031  47.955 4.352  1.000 33.107 ? 146 GLY LLL CA   1 
ATOM   5404 C  C    . GLY C 3 146 ? 20.161  47.283 5.708  1.000 32.329 ? 146 GLY LLL C    1 
ATOM   5405 O  O    . GLY C 3 146 ? 19.268  46.492 6.079  1.000 31.874 ? 146 GLY LLL O    1 
ATOM   5406 H  H    . GLY C 3 146 ? 20.985  46.870 2.949  1.000 33.926 ? 146 GLY LLL H    1 
ATOM   5407 H  HA2  . GLY C 3 146 ? 20.004  48.936 4.471  1.000 33.183 ? 146 GLY LLL HA2  1 
ATOM   5408 H  HA3  . GLY C 3 146 ? 19.185  47.671 3.929  1.000 33.483 ? 146 GLY LLL HA3  1 
ATOM   5409 N  N    . VAL C 3 147 ? 21.252  47.568 6.416  1.000 32.365 ? 147 VAL LLL N    1 
ATOM   5410 C  CA   . VAL C 3 147 ? 21.465  47.161 7.835  1.000 32.196 ? 147 VAL LLL CA   1 
ATOM   5411 C  C    . VAL C 3 147 ? 22.052  48.354 8.580  1.000 32.429 ? 147 VAL LLL C    1 
ATOM   5412 O  O    . VAL C 3 147 ? 22.976  48.997 8.068  1.000 32.950 ? 147 VAL LLL O    1 
ATOM   5413 C  CB   . VAL C 3 147 ? 22.366  45.920 7.968  1.000 31.785 ? 147 VAL LLL CB   1 
ATOM   5414 C  CG1  . VAL C 3 147 ? 22.693  45.621 9.425  1.000 31.052 ? 147 VAL LLL CG1  1 
ATOM   5415 C  CG2  . VAL C 3 147 ? 21.745  44.711 7.292  1.000 31.917 ? 147 VAL LLL CG2  1 
ATOM   5416 H  H    . VAL C 3 147 ? 21.949  48.039 6.070  1.000 32.640 ? 147 VAL LLL H    1 
ATOM   5417 H  HA   . VAL C 3 147 ? 20.597  46.953 8.225  1.000 31.963 ? 147 VAL LLL HA   1 
ATOM   5418 H  HB   . VAL C 3 147 ? 23.216  46.122 7.504  1.000 32.079 ? 147 VAL LLL HB   1 
ATOM   5419 H  HG11 . VAL C 3 147 ? 23.435  46.179 9.714  1.000 31.122 ? 147 VAL LLL HG11 1 
ATOM   5420 H  HG12 . VAL C 3 147 ? 22.939  44.684 9.519  1.000 31.026 ? 147 VAL LLL HG12 1 
ATOM   5421 H  HG13 . VAL C 3 147 ? 21.914  45.807 9.978  1.000 30.929 ? 147 VAL LLL HG13 1 
ATOM   5422 H  HG21 . VAL C 3 147 ? 20.851  44.564 7.646  1.000 31.802 ? 147 VAL LLL HG21 1 
ATOM   5423 H  HG22 . VAL C 3 147 ? 22.293  43.926 7.464  1.000 31.814 ? 147 VAL LLL HG22 1 
ATOM   5424 H  HG23 . VAL C 3 147 ? 21.693  44.865 6.333  1.000 32.408 ? 147 VAL LLL HG23 1 
ATOM   5425 N  N    . VAL C 3 148 ? 21.529  48.613 9.768  1.000 33.466 ? 148 VAL LLL N    1 
ATOM   5426 C  CA   . VAL C 3 148 ? 21.865  49.820 10.569 1.000 33.480 ? 148 VAL LLL CA   1 
ATOM   5427 C  C    . VAL C 3 148 ? 21.709  49.447 12.051 1.000 33.268 ? 148 VAL LLL C    1 
ATOM   5428 O  O    . VAL C 3 148 ? 20.734  48.744 12.398 1.000 33.069 ? 148 VAL LLL O    1 
ATOM   5429 C  CB   . VAL C 3 148 ? 20.981  50.992 10.097 1.000 33.875 ? 148 VAL LLL CB   1 
ATOM   5430 C  CG1  . VAL C 3 148 ? 19.847  51.314 11.052 1.000 33.810 ? 148 VAL LLL CG1  1 
ATOM   5431 C  CG2  . VAL C 3 148 ? 21.807  52.225 9.791  1.000 34.661 ? 148 VAL LLL CG2  1 
ATOM   5432 H  H    . VAL C 3 148 ? 20.924  48.063 10.171 1.000 32.963 ? 148 VAL LLL H    1 
ATOM   5433 H  HA   . VAL C 3 148 ? 22.797  50.047 10.404 1.000 33.674 ? 148 VAL LLL HA   1 
ATOM   5434 H  HB   . VAL C 3 148 ? 20.565  50.708 9.245  1.000 34.231 ? 148 VAL LLL HB   1 
ATOM   5435 H  HG11 . VAL C 3 148 ? 19.303  50.520 11.195 1.000 33.685 ? 148 VAL LLL HG11 1 
ATOM   5436 H  HG12 . VAL C 3 148 ? 19.294  52.018 10.672 1.000 33.965 ? 148 VAL LLL HG12 1 
ATOM   5437 H  HG13 . VAL C 3 148 ? 20.212  51.617 11.902 1.000 33.580 ? 148 VAL LLL HG13 1 
ATOM   5438 H  HG21 . VAL C 3 148 ? 22.452  52.369 10.504 1.000 34.362 ? 148 VAL LLL HG21 1 
ATOM   5439 H  HG22 . VAL C 3 148 ? 21.222  53.000 9.722  1.000 34.601 ? 148 VAL LLL HG22 1 
ATOM   5440 H  HG23 . VAL C 3 148 ? 22.278  52.100 8.949  1.000 34.848 ? 148 VAL LLL HG23 1 
ATOM   5441 N  N    . THR C 3 149 ? 22.710  49.791 12.858 1.000 33.484 ? 149 THR LLL N    1 
ATOM   5442 C  CA   . THR C 3 149 ? 22.682  49.715 14.337 1.000 33.442 ? 149 THR LLL CA   1 
ATOM   5443 C  C    . THR C 3 149 ? 22.457  51.130 14.850 1.000 33.566 ? 149 THR LLL C    1 
ATOM   5444 O  O    . THR C 3 149 ? 23.279  51.994 14.504 1.000 34.241 ? 149 THR LLL O    1 
ATOM   5445 C  CB   . THR C 3 149 ? 23.984  49.135 14.896 1.000 33.360 ? 149 THR LLL CB   1 
ATOM   5446 O  OG1  . THR C 3 149 ? 24.039  47.768 14.489 1.000 33.454 ? 149 THR LLL OG1  1 
ATOM   5447 C  CG2  . THR C 3 149 ? 24.075  49.245 16.401 1.000 33.264 ? 149 THR LLL CG2  1 
ATOM   5448 H  H    . THR C 3 149 ? 23.505  50.108 12.546 1.000 33.642 ? 149 THR LLL H    1 
ATOM   5449 H  HA   . THR C 3 149 ? 21.929  49.145 14.612 1.000 33.275 ? 149 THR LLL HA   1 
ATOM   5450 H  HB   . THR C 3 149 ? 24.740  49.621 14.492 1.000 33.624 ? 149 THR LLL HB   1 
ATOM   5451 H  HG1  . THR C 3 149 ? 24.718  47.428 14.822 0.000 30.000 ? 149 THR LLL HG1  1 
ATOM   5452 H  HG21 . THR C 3 149 ? 24.422  50.122 16.644 1.000 33.458 ? 149 THR LLL HG21 1 
ATOM   5453 H  HG22 . THR C 3 149 ? 24.673  48.556 16.742 1.000 33.332 ? 149 THR LLL HG22 1 
ATOM   5454 H  HG23 . THR C 3 149 ? 23.191  49.127 16.792 1.000 33.192 ? 149 THR LLL HG23 1 
ATOM   5455 N  N    . VAL C 3 150 ? 21.384  51.353 15.608 1.000 33.992 ? 150 VAL LLL N    1 
ATOM   5456 C  CA   . VAL C 3 150 ? 21.051  52.685 16.192 1.000 35.172 ? 150 VAL LLL CA   1 
ATOM   5457 C  C    . VAL C 3 150 ? 21.297  52.640 17.701 1.000 36.083 ? 150 VAL LLL C    1 
ATOM   5458 O  O    . VAL C 3 150 ? 20.887  51.660 18.333 1.000 36.198 ? 150 VAL LLL O    1 
ATOM   5459 C  CB   . VAL C 3 150 ? 19.608  53.095 15.870 1.000 35.290 ? 150 VAL LLL CB   1 
ATOM   5460 C  CG1  . VAL C 3 150 ? 19.231  54.387 16.582 1.000 35.444 ? 150 VAL LLL CG1  1 
ATOM   5461 C  CG2  . VAL C 3 150 ? 19.401  53.205 14.369 1.000 35.416 ? 150 VAL LLL CG2  1 
ATOM   5462 H  H    . VAL C 3 150 ? 20.783  50.701 15.819 1.000 34.049 ? 150 VAL LLL H    1 
ATOM   5463 H  HA   . VAL C 3 150 ? 21.649  53.346 15.803 1.000 35.253 ? 150 VAL LLL HA   1 
ATOM   5464 H  HB   . VAL C 3 150 ? 19.014  52.379 16.206 1.000 35.260 ? 150 VAL LLL HB   1 
ATOM   5465 H  HG11 . VAL C 3 150 ? 18.942  54.187 17.489 1.000 35.481 ? 150 VAL LLL HG11 1 
ATOM   5466 H  HG12 . VAL C 3 150 ? 18.506  54.825 16.103 1.000 35.518 ? 150 VAL LLL HG12 1 
ATOM   5467 H  HG13 . VAL C 3 150 ? 20.002  54.980 16.612 1.000 35.491 ? 150 VAL LLL HG13 1 
ATOM   5468 H  HG21 . VAL C 3 150 ? 20.079  53.790 13.989 1.000 35.501 ? 150 VAL LLL HG21 1 
ATOM   5469 H  HG22 . VAL C 3 150 ? 18.519  53.572 14.187 1.000 35.523 ? 150 VAL LLL HG22 1 
ATOM   5470 H  HG23 . VAL C 3 150 ? 19.472  52.322 13.966 1.000 35.367 ? 150 VAL LLL HG23 1 
ATOM   5471 N  N    . ASP C 3 151 ? 21.953  53.669 18.239 1.000 37.509 ? 151 ASP LLL N    1 
ATOM   5472 C  CA   . ASP C 3 151 ? 22.316  53.775 19.675 1.000 39.211 ? 151 ASP LLL CA   1 
ATOM   5473 C  C    . ASP C 3 151 ? 21.966  55.180 20.160 1.000 39.394 ? 151 ASP LLL C    1 
ATOM   5474 O  O    . ASP C 3 151 ? 22.526  56.149 19.613 1.000 40.565 ? 151 ASP LLL O    1 
ATOM   5475 C  CB   . ASP C 3 151 ? 23.799  53.473 19.904 1.000 40.819 ? 151 ASP LLL CB   1 
ATOM   5476 C  CG   . ASP C 3 151 ? 24.146  51.994 19.842 1.000 42.068 ? 151 ASP LLL CG   1 
ATOM   5477 O  OD1  . ASP C 3 151 ? 23.365  51.181 20.386 1.000 43.930 ? 151 ASP LLL OD1  1 
ATOM   5478 O  OD2  . ASP C 3 151 ? 25.194  51.666 19.251 1.000 43.200 ? 151 ASP LLL OD2  1 
ATOM   5479 H  H    . ASP C 3 151 ? 22.226  54.384 17.744 1.000 37.611 ? 151 ASP LLL H    1 
ATOM   5480 H  HA   . ASP C 3 151 ? 21.780  53.123 20.183 1.000 39.172 ? 151 ASP LLL HA   1 
ATOM   5481 H  HB2  . ASP C 3 151 ? 24.327  53.942 19.226 1.000 40.857 ? 151 ASP LLL HB2  1 
ATOM   5482 H  HB3  . ASP C 3 151 ? 24.061  53.812 20.784 1.000 41.084 ? 151 ASP LLL HB3  1 
ATOM   5483 N  N    . TRP C 3 152 ? 21.069  55.275 21.141 1.000 38.593 ? 152 TRP LLL N    1 
ATOM   5484 C  CA   . TRP C 3 152 ? 20.685  56.550 21.793 1.000 38.500 ? 152 TRP LLL CA   1 
ATOM   5485 C  C    . TRP C 3 152 ? 21.591  56.794 22.999 1.000 38.601 ? 152 TRP LLL C    1 
ATOM   5486 O  O    . TRP C 3 152 ? 21.785  55.857 23.798 1.000 38.597 ? 152 TRP LLL O    1 
ATOM   5487 C  CB   . TRP C 3 152 ? 19.205  56.528 22.184 1.000 38.429 ? 152 TRP LLL CB   1 
ATOM   5488 C  CG   . TRP C 3 152 ? 18.304  56.568 20.993 1.000 37.606 ? 152 TRP LLL CG   1 
ATOM   5489 C  CD1  . TRP C 3 152 ? 17.911  55.512 20.230 1.000 37.300 ? 152 TRP LLL CD1  1 
ATOM   5490 C  CD2  . TRP C 3 152 ? 17.720  57.738 20.394 1.000 37.635 ? 152 TRP LLL CD2  1 
ATOM   5491 N  NE1  . TRP C 3 152 ? 17.110  55.938 19.207 1.000 37.214 ? 152 TRP LLL NE1  1 
ATOM   5492 C  CE2  . TRP C 3 152 ? 16.976  57.299 19.278 1.000 37.726 ? 152 TRP LLL CE2  1 
ATOM   5493 C  CE3  . TRP C 3 152 ? 17.744  59.105 20.692 1.000 37.519 ? 152 TRP LLL CE3  1 
ATOM   5494 C  CZ2  . TRP C 3 152 ? 16.254  58.181 18.472 1.000 37.887 ? 152 TRP LLL CZ2  1 
ATOM   5495 C  CZ3  . TRP C 3 152 ? 17.035  59.975 19.893 1.000 37.370 ? 152 TRP LLL CZ3  1 
ATOM   5496 C  CH2  . TRP C 3 152 ? 16.297  59.517 18.801 1.000 37.641 ? 152 TRP LLL CH2  1 
ATOM   5497 H  H    . TRP C 3 152 ? 20.631  54.552 21.480 1.000 38.733 ? 152 TRP LLL H    1 
ATOM   5498 H  HA   . TRP C 3 152 ? 20.816  57.277 21.142 1.000 38.389 ? 152 TRP LLL HA   1 
ATOM   5499 H  HB2  . TRP C 3 152 ? 19.027  55.715 22.700 1.000 38.454 ? 152 TRP LLL HB2  1 
ATOM   5500 H  HB3  . TRP C 3 152 ? 19.020  57.299 22.758 1.000 38.612 ? 152 TRP LLL HB3  1 
ATOM   5501 H  HD1  . TRP C 3 152 ? 18.152  54.611 20.380 1.000 37.266 ? 152 TRP LLL HD1  1 
ATOM   5502 H  HE1  . TRP C 3 152 ? 16.743  55.423 18.607 1.000 37.210 ? 152 TRP LLL HE1  1 
ATOM   5503 H  HE3  . TRP C 3 152 ? 18.236  59.425 21.431 1.000 37.784 ? 152 TRP LLL HE3  1 
ATOM   5504 H  HZ2  . TRP C 3 152 ? 15.757  57.872 17.733 1.000 37.728 ? 152 TRP LLL HZ2  1 
ATOM   5505 H  HZ3  . TRP C 3 152 ? 17.046  60.898 20.089 1.000 37.659 ? 152 TRP LLL HZ3  1 
ATOM   5506 H  HH2  . TRP C 3 152 ? 15.828  60.136 18.270 1.000 37.724 ? 152 TRP LLL HH2  1 
ATOM   5507 N  N    . LYS C 3 153 ? 22.144  58.001 23.098 1.000 39.004 ? 153 LYS LLL N    1 
ATOM   5508 C  CA   . LYS C 3 153 ? 22.804  58.516 24.325 1.000 40.102 ? 153 LYS LLL CA   1 
ATOM   5509 C  C    . LYS C 3 153 ? 21.961  59.675 24.875 1.000 38.558 ? 153 LYS LLL C    1 
ATOM   5510 O  O    . LYS C 3 153 ? 21.347  60.409 24.075 1.000 37.252 ? 153 LYS LLL O    1 
ATOM   5511 C  CB   . LYS C 3 153 ? 24.243  58.958 24.036 1.000 41.855 ? 153 LYS LLL CB   1 
ATOM   5512 C  CG   . LYS C 3 153 ? 25.288  57.851 23.976 1.000 43.546 ? 153 LYS LLL CG   1 
ATOM   5513 C  CD   . LYS C 3 153 ? 26.639  58.299 24.522 1.000 46.489 ? 153 LYS LLL CD   1 
ATOM   5514 C  CE   . LYS C 3 153 ? 27.818  57.471 24.048 1.000 48.334 ? 153 LYS LLL CE   1 
ATOM   5515 N  NZ   . LYS C 3 153 ? 27.763  56.078 24.561 1.000 49.293 ? 153 LYS LLL NZ   1 
ATOM   5516 H  H    . LYS C 3 153 ? 22.152  58.593 22.405 1.000 38.941 ? 153 LYS LLL H    1 
ATOM   5517 H  HA   . LYS C 3 153 ? 22.822  57.796 24.996 1.000 40.134 ? 153 LYS LLL HA   1 
ATOM   5518 H  HB2  . LYS C 3 153 ? 24.251  59.432 23.180 1.000 41.613 ? 153 LYS LLL HB2  1 
ATOM   5519 H  HB3  . LYS C 3 153 ? 24.512  59.597 24.729 1.000 42.331 ? 153 LYS LLL HB3  1 
ATOM   5520 H  HG2  . LYS C 3 153 ? 24.970  57.082 24.495 1.000 43.660 ? 153 LYS LLL HG2  1 
ATOM   5521 H  HG3  . LYS C 3 153 ? 25.397  57.564 23.044 1.000 43.310 ? 153 LYS LLL HG3  1 
ATOM   5522 H  HD2  . LYS C 3 153 ? 26.790  59.233 24.265 1.000 46.462 ? 153 LYS LLL HD2  1 
ATOM   5523 H  HD3  . LYS C 3 153 ? 26.608  58.261 25.501 1.000 46.747 ? 153 LYS LLL HD3  1 
ATOM   5524 H  HE2  . LYS C 3 153 ? 27.828  57.449 23.072 1.000 47.804 ? 153 LYS LLL HE2  1 
ATOM   5525 H  HE3  . LYS C 3 153 ? 28.649  57.886 24.348 1.000 48.721 ? 153 LYS LLL HE3  1 
ATOM   5526 H  HZ1  . LYS C 3 153 ? 27.597  56.085 25.452 1.000 49.304 ? 153 LYS LLL HZ1  1 
ATOM   5527 H  HZ2  . LYS C 3 153 ? 28.556  55.664 24.410 1.000 49.166 ? 153 LYS LLL HZ2  1 
ATOM   5528 H  HZ3  . LYS C 3 153 ? 27.104  55.621 24.138 1.000 48.472 ? 153 LYS LLL HZ3  1 
ATOM   5529 N  N    . VAL C 3 154 ? 21.921  59.812 26.198 1.000 37.796 ? 154 VAL LLL N    1 
ATOM   5530 C  CA   . VAL C 3 154 ? 21.319  60.980 26.903 1.000 37.827 ? 154 VAL LLL CA   1 
ATOM   5531 C  C    . VAL C 3 154 ? 22.299  61.399 28.003 1.000 37.673 ? 154 VAL LLL C    1 
ATOM   5532 O  O    . VAL C 3 154 ? 22.419  60.653 28.984 1.000 38.063 ? 154 VAL LLL O    1 
ATOM   5533 C  CB   . VAL C 3 154 ? 19.916  60.638 27.446 1.000 38.024 ? 154 VAL LLL CB   1 
ATOM   5534 C  CG1  . VAL C 3 154 ? 19.333  61.763 28.291 1.000 38.378 ? 154 VAL LLL CG1  1 
ATOM   5535 C  CG2  . VAL C 3 154 ? 18.966  60.267 26.314 1.000 37.257 ? 154 VAL LLL CG2  1 
ATOM   5536 H  H    . VAL C 3 154 ? 22.263  59.185 26.765 1.000 38.294 ? 154 VAL LLL H    1 
ATOM   5537 H  HA   . VAL C 3 154 ? 21.235  61.712 26.268 1.000 37.483 ? 154 VAL LLL HA   1 
ATOM   5538 H  HB   . VAL C 3 154 ? 20.012  59.845 28.028 1.000 38.210 ? 154 VAL LLL HB   1 
ATOM   5539 H  HG11 . VAL C 3 154 ? 19.779  61.787 29.155 1.000 39.034 ? 154 VAL LLL HG11 1 
ATOM   5540 H  HG12 . VAL C 3 154 ? 18.381  61.612 28.424 1.000 38.534 ? 154 VAL LLL HG12 1 
ATOM   5541 H  HG13 . VAL C 3 154 ? 19.464  62.613 27.836 1.000 38.297 ? 154 VAL LLL HG13 1 
ATOM   5542 H  HG21 . VAL C 3 154 ? 19.128  60.848 25.551 1.000 36.975 ? 154 VAL LLL HG21 1 
ATOM   5543 H  HG22 . VAL C 3 154 ? 18.046  60.371 26.611 1.000 37.487 ? 154 VAL LLL HG22 1 
ATOM   5544 H  HG23 . VAL C 3 154 ? 19.119  59.342 26.053 1.000 37.060 ? 154 VAL LLL HG23 1 
ATOM   5545 N  N    . ASP C 3 155 ? 23.002  62.521 27.818 1.000 36.840 ? 155 ASP LLL N    1 
ATOM   5546 C  CA   . ASP C 3 155 ? 24.075  62.985 28.736 1.000 37.425 ? 155 ASP LLL CA   1 
ATOM   5547 C  C    . ASP C 3 155 ? 25.082  61.850 28.959 1.000 38.119 ? 155 ASP LLL C    1 
ATOM   5548 O  O    . ASP C 3 155 ? 25.501  61.643 30.111 1.000 38.288 ? 155 ASP LLL O    1 
ATOM   5549 C  CB   . ASP C 3 155 ? 23.480  63.474 30.056 1.000 37.575 ? 155 ASP LLL CB   1 
ATOM   5550 C  CG   . ASP C 3 155 ? 22.591  64.686 29.876 1.000 36.783 ? 155 ASP LLL CG   1 
ATOM   5551 O  OD1  . ASP C 3 155 ? 22.852  65.450 28.931 1.000 36.558 ? 155 ASP LLL OD1  1 
ATOM   5552 O  OD2  . ASP C 3 155 ? 21.655  64.853 30.679 1.000 36.147 ? 155 ASP LLL OD2  1 
ATOM   5553 H  H    . ASP C 3 155 ? 22.862  63.076 27.109 1.000 36.678 ? 155 ASP LLL H    1 
ATOM   5554 H  HA   . ASP C 3 155 ? 24.544  63.738 28.307 1.000 37.457 ? 155 ASP LLL HA   1 
ATOM   5555 H  HB2  . ASP C 3 155 ? 22.954  62.757 30.465 1.000 37.633 ? 155 ASP LLL HB2  1 
ATOM   5556 H  HB3  . ASP C 3 155 ? 24.203  63.714 30.670 1.000 38.248 ? 155 ASP LLL HB3  1 
ATOM   5557 N  N    . GLY C 3 156 ? 25.439  61.135 27.889 1.000 38.604 ? 156 GLY LLL N    1 
ATOM   5558 C  CA   . GLY C 3 156 ? 26.490  60.100 27.896 1.000 39.612 ? 156 GLY LLL CA   1 
ATOM   5559 C  C    . GLY C 3 156 ? 26.097  58.851 28.671 1.000 40.696 ? 156 GLY LLL C    1 
ATOM   5560 O  O    . GLY C 3 156 ? 27.008  58.081 29.041 1.000 41.794 ? 156 GLY LLL O    1 
ATOM   5561 H  H    . GLY C 3 156 ? 25.050  61.255 27.075 1.000 37.953 ? 156 GLY LLL H    1 
ATOM   5562 H  HA2  . GLY C 3 156 ? 26.698  59.852 26.963 1.000 39.179 ? 156 GLY LLL HA2  1 
ATOM   5563 H  HA3  . GLY C 3 156 ? 27.311  60.483 28.295 1.000 40.279 ? 156 GLY LLL HA3  1 
ATOM   5564 N  N    . THR C 3 157 ? 24.801  58.634 28.917 1.000 41.083 ? 157 THR LLL N    1 
ATOM   5565 C  CA   . THR C 3 157 ? 24.272  57.355 29.460 1.000 41.451 ? 157 THR LLL CA   1 
ATOM   5566 C  C    . THR C 3 157 ? 23.548  56.647 28.315 1.000 40.884 ? 157 THR LLL C    1 
ATOM   5567 O  O    . THR C 3 157 ? 22.637  57.213 27.723 1.000 40.764 ? 157 THR LLL O    1 
ATOM   5568 C  CB   . THR C 3 157 ? 23.475  57.566 30.760 1.000 41.976 ? 157 THR LLL CB   1 
ATOM   5569 O  OG1  . THR C 3 157 ? 22.486  56.538 30.830 1.000 41.803 ? 157 THR LLL OG1  1 
ATOM   5570 C  CG2  . THR C 3 157 ? 22.810  58.917 30.899 1.000 41.861 ? 157 THR LLL CG2  1 
ATOM   5571 H  H    . THR C 3 157 ? 24.146  59.235 28.729 1.000 40.788 ? 157 THR LLL H    1 
ATOM   5572 H  HA   . THR C 3 157 ? 25.050  56.807 29.697 1.000 41.708 ? 157 THR LLL HA   1 
ATOM   5573 H  HB   . THR C 3 157 ? 24.095  57.452 31.513 1.000 42.682 ? 157 THR LLL HB   1 
ATOM   5574 H  HG1  . THR C 3 157 ? 22.021  56.640 31.558 0.000 30.000 ? 157 THR LLL HG1  1 
ATOM   5575 H  HG21 . THR C 3 157 ? 23.484  59.619 30.872 1.000 42.133 ? 157 THR LLL HG21 1 
ATOM   5576 H  HG22 . THR C 3 157 ? 22.335  58.958 31.749 1.000 42.547 ? 157 THR LLL HG22 1 
ATOM   5577 H  HG23 . THR C 3 157 ? 22.176  59.040 30.172 1.000 41.320 ? 157 THR LLL HG23 1 
ATOM   5578 N  N    . PRO C 3 158 ? 23.985  55.435 27.899 1.000 41.566 ? 158 PRO LLL N    1 
ATOM   5579 C  CA   . PRO C 3 158 ? 23.316  54.698 26.823 1.000 41.731 ? 158 PRO LLL CA   1 
ATOM   5580 C  C    . PRO C 3 158 ? 21.919  54.197 27.218 1.000 42.730 ? 158 PRO LLL C    1 
ATOM   5581 O  O    . PRO C 3 158 ? 21.784  53.631 28.285 1.000 44.281 ? 158 PRO LLL O    1 
ATOM   5582 C  CB   . PRO C 3 158 ? 24.223  53.487 26.551 1.000 41.091 ? 158 PRO LLL CB   1 
ATOM   5583 C  CG   . PRO C 3 158 ? 25.540  53.833 27.225 1.000 41.694 ? 158 PRO LLL CG   1 
ATOM   5584 C  CD   . PRO C 3 158 ? 25.178  54.731 28.390 1.000 42.086 ? 158 PRO LLL CD   1 
ATOM   5585 H  HA   . PRO C 3 158 ? 23.265  55.264 26.013 1.000 41.250 ? 158 PRO LLL HA   1 
ATOM   5586 H  HB2  . PRO C 3 158 ? 23.843  52.668 26.934 1.000 41.269 ? 158 PRO LLL HB2  1 
ATOM   5587 H  HB3  . PRO C 3 158 ? 24.351  53.356 25.587 1.000 40.701 ? 158 PRO LLL HB3  1 
ATOM   5588 H  HG2  . PRO C 3 158 ? 25.989  53.023 27.541 1.000 41.849 ? 158 PRO LLL HG2  1 
ATOM   5589 H  HG3  . PRO C 3 158 ? 26.134  54.299 26.602 1.000 41.513 ? 158 PRO LLL HG3  1 
ATOM   5590 H  HD2  . PRO C 3 158 ? 24.976  54.210 29.189 1.000 42.582 ? 158 PRO LLL HD2  1 
ATOM   5591 H  HD3  . PRO C 3 158 ? 25.902  55.353 28.587 1.000 42.547 ? 158 PRO LLL HD3  1 
ATOM   5592 N  N    . VAL C 3 159 ? 20.930  54.403 26.346 1.000 43.172 ? 159 VAL LLL N    1 
ATOM   5593 C  CA   . VAL C 3 159 ? 19.512  54.013 26.590 1.000 44.586 ? 159 VAL LLL CA   1 
ATOM   5594 C  C    . VAL C 3 159 ? 19.299  52.578 26.091 1.000 46.264 ? 159 VAL LLL C    1 
ATOM   5595 O  O    . VAL C 3 159 ? 19.559  52.312 24.891 1.000 45.518 ? 159 VAL LLL O    1 
ATOM   5596 C  CB   . VAL C 3 159 ? 18.525  54.990 25.927 1.000 44.090 ? 159 VAL LLL CB   1 
ATOM   5597 C  CG1  . VAL C 3 159 ? 17.093  54.689 26.349 1.000 44.225 ? 159 VAL LLL CG1  1 
ATOM   5598 C  CG2  . VAL C 3 159 ? 18.887  56.436 26.226 1.000 44.186 ? 159 VAL LLL CG2  1 
ATOM   5599 H  H    . VAL C 3 159 ? 21.065  54.791 25.533 1.000 42.856 ? 159 VAL LLL H    1 
ATOM   5600 H  HA   . VAL C 3 159 ? 19.354  54.030 27.551 1.000 45.238 ? 159 VAL LLL HA   1 
ATOM   5601 H  HB   . VAL C 3 159 ? 18.587  54.857 24.949 1.000 43.581 ? 159 VAL LLL HB   1 
ATOM   5602 H  HG11 . VAL C 3 159 ? 16.818  53.832 25.982 1.000 44.160 ? 159 VAL LLL HG11 1 
ATOM   5603 H  HG12 . VAL C 3 159 ? 16.503  55.385 26.020 1.000 44.215 ? 159 VAL LLL HG12 1 
ATOM   5604 H  HG13 . VAL C 3 159 ? 17.042  54.656 27.320 1.000 44.868 ? 159 VAL LLL HG13 1 
ATOM   5605 H  HG21 . VAL C 3 159 ? 19.094  56.531 27.172 1.000 44.751 ? 159 VAL LLL HG21 1 
ATOM   5606 H  HG22 . VAL C 3 159 ? 18.138  57.014 25.999 1.000 44.208 ? 159 VAL LLL HG22 1 
ATOM   5607 H  HG23 . VAL C 3 159 ? 19.663  56.693 25.698 1.000 43.952 ? 159 VAL LLL HG23 1 
ATOM   5608 N  N    . THR C 3 160 ? 18.835  51.704 26.992 1.000 48.353 ? 160 THR LLL N    1 
ATOM   5609 C  CA   . THR C 3 160 ? 18.558  50.263 26.756 1.000 49.189 ? 160 THR LLL CA   1 
ATOM   5610 C  C    . THR C 3 160 ? 17.050  49.992 26.818 1.000 50.619 ? 160 THR LLL C    1 
ATOM   5611 O  O    . THR C 3 160 ? 16.653  48.908 26.377 1.000 51.693 ? 160 THR LLL O    1 
ATOM   5612 C  CB   . THR C 3 160 ? 19.301  49.400 27.784 1.000 49.643 ? 160 THR LLL CB   1 
ATOM   5613 O  OG1  . THR C 3 160 ? 18.716  49.684 29.056 1.000 50.309 ? 160 THR LLL OG1  1 
ATOM   5614 C  CG2  . THR C 3 160 ? 20.793  49.663 27.815 1.000 48.747 ? 160 THR LLL CG2  1 
ATOM   5615 H  H    . THR C 3 160 ? 18.680  51.940 27.858 1.000 48.758 ? 160 THR LLL H    1 
ATOM   5616 H  HA   . THR C 3 160 ? 18.884  50.029 25.856 1.000 48.646 ? 160 THR LLL HA   1 
ATOM   5617 H  HB   . THR C 3 160 ? 19.147  48.451 27.564 1.000 49.327 ? 160 THR LLL HB   1 
ATOM   5618 H  HG1  . THR C 3 160 ? 18.991  49.236 29.610 0.000 30.000 ? 160 THR LLL HG1  1 
ATOM   5619 H  HG21 . THR C 3 160 ? 21.146  49.642 26.907 1.000 48.435 ? 160 THR LLL HG21 1 
ATOM   5620 H  HG22 . THR C 3 160 ? 21.234  48.978 28.349 1.000 49.314 ? 160 THR LLL HG22 1 
ATOM   5621 H  HG23 . THR C 3 160 ? 20.962  50.538 28.207 1.000 49.277 ? 160 THR LLL HG23 1 
ATOM   5622 N  N    . GLN C 3 161 ? 16.257  50.926 27.361 1.000 52.775 ? 161 GLN LLL N    1 
ATOM   5623 C  CA   . GLN C 3 161 ? 14.772  50.836 27.470 1.000 54.293 ? 161 GLN LLL CA   1 
ATOM   5624 C  C    . GLN C 3 161 ? 14.140  52.174 27.051 1.000 53.416 ? 161 GLN LLL C    1 
ATOM   5625 O  O    . GLN C 3 161 ? 14.581  53.222 27.567 1.000 53.090 ? 161 GLN LLL O    1 
ATOM   5626 C  CB   . GLN C 3 161 ? 14.352  50.486 28.903 1.000 57.089 ? 161 GLN LLL CB   1 
ATOM   5627 C  CG   . GLN C 3 161 ? 14.892  49.149 29.408 1.000 58.668 ? 161 GLN LLL CG   1 
ATOM   5628 C  CD   . GLN C 3 161 ? 14.105  47.954 28.920 1.000 59.217 ? 161 GLN LLL CD   1 
ATOM   5629 O  OE1  . GLN C 3 161 ? 12.877  47.936 28.966 1.000 61.155 ? 161 GLN LLL OE1  1 
ATOM   5630 N  NE2  . GLN C 3 161 ? 14.811  46.932 28.463 1.000 57.483 ? 161 GLN LLL NE2  1 
ATOM   5631 H  H    . GLN C 3 161 ? 16.587  51.695 27.714 1.000 52.736 ? 161 GLN LLL H    1 
ATOM   5632 H  HA   . GLN C 3 161 ? 14.454  50.130 26.862 1.000 54.005 ? 161 GLN LLL HA   1 
ATOM   5633 H  HB2  . GLN C 3 161 ? 14.664  51.199 29.498 1.000 57.298 ? 161 GLN LLL HB2  1 
ATOM   5634 H  HB3  . GLN C 3 161 ? 13.374  50.471 28.944 1.000 57.413 ? 161 GLN LLL HB3  1 
ATOM   5635 H  HG2  . GLN C 3 161 ? 15.825  49.051 29.123 1.000 57.959 ? 161 GLN LLL HG2  1 
ATOM   5636 H  HG3  . GLN C 3 161 ? 14.882  49.153 30.389 1.000 59.224 ? 161 GLN LLL HG3  1 
ATOM   5637 H  HE21 . GLN C 3 161 ? 14.223  46.139 28.256 0.000 30.000 ? 161 GLN LLL HE21 1 
ATOM   5638 H  HE22 . GLN C 3 161 ? 15.561  46.873 28.382 0.000 30.000 ? 161 GLN LLL HE22 1 
ATOM   5639 N  N    . GLY C 3 162 ? 13.139  52.132 26.162 1.000 52.249 ? 162 GLY LLL N    1 
ATOM   5640 C  CA   . GLY C 3 162 ? 12.388  53.309 25.683 1.000 51.677 ? 162 GLY LLL CA   1 
ATOM   5641 C  C    . GLY C 3 162 ? 12.633  53.601 24.211 1.000 50.894 ? 162 GLY LLL C    1 
ATOM   5642 O  O    . GLY C 3 162 ? 11.885  54.433 23.657 1.000 49.665 ? 162 GLY LLL O    1 
ATOM   5643 H  H    . GLY C 3 162 ? 12.858  51.347 25.795 1.000 52.301 ? 162 GLY LLL H    1 
ATOM   5644 H  HA2  . GLY C 3 162 ? 11.421  53.151 25.826 1.000 52.337 ? 162 GLY LLL HA2  1 
ATOM   5645 H  HA3  . GLY C 3 162 ? 12.648  54.099 26.219 1.000 51.998 ? 162 GLY LLL HA3  1 
ATOM   5646 N  N    . MET C 3 163 ? 13.640  52.953 23.606 1.000 51.369 ? 163 MET LLL N    1 
ATOM   5647 C  CA   . MET C 3 163 ? 14.019  53.093 22.169 1.000 51.030 ? 163 MET LLL CA   1 
ATOM   5648 C  C    . MET C 3 163 ? 13.508  51.880 21.387 1.000 48.181 ? 163 MET LLL C    1 
ATOM   5649 O  O    . MET C 3 163 ? 13.635  50.755 21.896 1.000 47.132 ? 163 MET LLL O    1 
ATOM   5650 C  CB   . MET C 3 163 ? 15.535  53.210 21.947 1.000 53.818 ? 163 MET LLL CB   1 
ATOM   5651 C  CG   . MET C 3 163 ? 16.414  52.836 23.141 1.000 58.021 ? 163 MET LLL CG   1 
ATOM   5652 S  SD   . MET C 3 163 ? 16.468  51.062 23.579 1.000 62.881 ? 163 MET LLL SD   1 
ATOM   5653 C  CE   . MET C 3 163 ? 17.583  50.444 22.317 1.000 62.580 ? 163 MET LLL CE   1 
ATOM   5654 H  H    . MET C 3 163 ? 14.147  52.341 24.047 1.000 51.237 ? 163 MET LLL H    1 
ATOM   5655 H  HA   . MET C 3 163 ? 13.580  53.898 21.816 1.000 50.998 ? 163 MET LLL HA   1 
ATOM   5656 H  HB2  . MET C 3 163 ? 15.781  52.641 21.190 1.000 53.606 ? 163 MET LLL HB2  1 
ATOM   5657 H  HB3  . MET C 3 163 ? 15.735  54.133 21.692 1.000 53.819 ? 163 MET LLL HB3  1 
ATOM   5658 H  HG2  . MET C 3 163 ? 17.331  53.129 22.952 1.000 57.859 ? 163 MET LLL HG2  1 
ATOM   5659 H  HG3  . MET C 3 163 ? 16.106  53.338 23.925 1.000 58.417 ? 163 MET LLL HG3  1 
ATOM   5660 H  HE1  . MET C 3 163 ? 17.771  49.512 22.483 1.000 62.467 ? 163 MET LLL HE1  1 
ATOM   5661 H  HE2  . MET C 3 163 ? 17.172  50.541 21.450 1.000 62.262 ? 163 MET LLL HE2  1 
ATOM   5662 H  HE3  . MET C 3 163 ? 18.406  50.948 22.342 1.000 62.354 ? 163 MET LLL HE3  1 
ATOM   5663 N  N    . GLU C 3 164 ? 12.952  52.117 20.196 1.000 46.110 ? 164 GLU LLL N    1 
ATOM   5664 C  CA   . GLU C 3 164 ? 12.639  51.071 19.184 1.000 45.359 ? 164 GLU LLL CA   1 
ATOM   5665 C  C    . GLU C 3 164 ? 13.007  51.613 17.798 1.000 42.176 ? 164 GLU LLL C    1 
ATOM   5666 O  O    . GLU C 3 164 ? 12.727  52.794 17.536 1.000 40.773 ? 164 GLU LLL O    1 
ATOM   5667 C  CB   . GLU C 3 164 ? 11.156  50.680 19.214 1.000 47.455 ? 164 GLU LLL CB   1 
ATOM   5668 C  CG   . GLU C 3 164 ? 10.578  50.458 20.608 1.000 49.400 ? 164 GLU LLL CG   1 
ATOM   5669 C  CD   . GLU C 3 164 ? 11.053  49.207 21.336 1.000 49.943 ? 164 GLU LLL CD   1 
ATOM   5670 O  OE1  . GLU C 3 164 ? 11.799  48.409 20.720 1.000 49.785 ? 164 GLU LLL OE1  1 
ATOM   5671 O  OE2  . GLU C 3 164 ? 10.673  49.032 22.523 1.000 49.501 ? 164 GLU LLL OE2  1 
ATOM   5672 H  H    . GLU C 3 164 ? 12.721  52.956 19.929 1.000 46.445 ? 164 GLU LLL H    1 
ATOM   5673 H  HA   . GLU C 3 164 ? 13.186  50.274 19.372 1.000 45.022 ? 164 GLU LLL HA   1 
ATOM   5674 H  HB2  . GLU C 3 164 ? 10.643  51.388 18.772 1.000 47.578 ? 164 GLU LLL HB2  1 
ATOM   5675 H  HB3  . GLU C 3 164 ? 11.042  49.860 18.691 1.000 47.430 ? 164 GLU LLL HB3  1 
ATOM   5676 H  HG2  . GLU C 3 164 ? 10.789  51.236 21.165 1.000 49.217 ? 164 GLU LLL HG2  1 
ATOM   5677 H  HG3  . GLU C 3 164 ? 9.602   50.412 20.533 1.000 49.742 ? 164 GLU LLL HG3  1 
ATOM   5678 N  N    . THR C 3 165 ? 13.605  50.779 16.946 1.000 39.828 ? 165 THR LLL N    1 
ATOM   5679 C  CA   . THR C 3 165 ? 13.889  51.102 15.522 1.000 38.704 ? 165 THR LLL CA   1 
ATOM   5680 C  C    . THR C 3 165 ? 13.058  50.192 14.615 1.000 38.083 ? 165 THR LLL C    1 
ATOM   5681 O  O    . THR C 3 165 ? 12.858  49.020 14.961 1.000 37.687 ? 165 THR LLL O    1 
ATOM   5682 C  CB   . THR C 3 165 ? 15.376  50.970 15.180 1.000 37.961 ? 165 THR LLL CB   1 
ATOM   5683 O  OG1  . THR C 3 165 ? 16.150  51.352 16.316 1.000 38.323 ? 165 THR LLL OG1  1 
ATOM   5684 C  CG2  . THR C 3 165 ? 15.770  51.813 13.988 1.000 37.625 ? 165 THR LLL CG2  1 
ATOM   5685 H  H    . THR C 3 165 ? 13.886  49.944 17.177 1.000 39.991 ? 165 THR LLL H    1 
ATOM   5686 H  HA   . THR C 3 165 ? 13.615  52.033 15.362 1.000 38.733 ? 165 THR LLL HA   1 
ATOM   5687 H  HB   . THR C 3 165 ? 15.563  50.023 14.973 1.000 37.989 ? 165 THR LLL HB   1 
ATOM   5688 H  HG1  . THR C 3 165 ? 16.854  51.358 16.149 0.000 30.000 ? 165 THR LLL HG1  1 
ATOM   5689 H  HG21 . THR C 3 165 ? 15.301  51.496 13.195 1.000 37.940 ? 165 THR LLL HG21 1 
ATOM   5690 H  HG22 . THR C 3 165 ? 16.731  51.745 13.844 1.000 37.538 ? 165 THR LLL HG22 1 
ATOM   5691 H  HG23 . THR C 3 165 ? 15.533  52.743 14.154 1.000 37.805 ? 165 THR LLL HG23 1 
ATOM   5692 N  N    . THR C 3 166 ? 12.603  50.732 13.489 1.000 38.137 ? 166 THR LLL N    1 
ATOM   5693 C  CA   . THR C 3 166 ? 11.878  49.990 12.434 1.000 39.256 ? 166 THR LLL CA   1 
ATOM   5694 C  C    . THR C 3 166 ? 12.892  49.112 11.705 1.000 39.213 ? 166 THR LLL C    1 
ATOM   5695 O  O    . THR C 3 166 ? 14.061  49.510 11.635 1.000 38.954 ? 166 THR LLL O    1 
ATOM   5696 C  CB   . THR C 3 166 ? 11.142  50.949 11.490 1.000 40.233 ? 166 THR LLL CB   1 
ATOM   5697 O  OG1  . THR C 3 166 ? 12.080  51.760 10.781 1.000 40.769 ? 166 THR LLL OG1  1 
ATOM   5698 C  CG2  . THR C 3 166 ? 10.179  51.854 12.223 1.000 40.899 ? 166 THR LLL CG2  1 
ATOM   5699 H  H    . THR C 3 166 ? 12.725  51.609 13.277 1.000 38.344 ? 166 THR LLL H    1 
ATOM   5700 H  HA   . THR C 3 166 ? 11.214  49.408 12.871 1.000 39.524 ? 166 THR LLL HA   1 
ATOM   5701 H  HB   . THR C 3 166 ? 10.635  50.409 10.838 1.000 40.778 ? 166 THR LLL HB   1 
ATOM   5702 H  HG1  . THR C 3 166 ? 11.588  52.291 10.185 0.000 30.000 ? 166 THR LLL HG1  1 
ATOM   5703 H  HG21 . THR C 3 166 ? 9.655   51.328 12.852 1.000 41.015 ? 166 THR LLL HG21 1 
ATOM   5704 H  HG22 . THR C 3 166 ? 9.581   52.282 11.583 1.000 41.254 ? 166 THR LLL HG22 1 
ATOM   5705 H  HG23 . THR C 3 166 ? 10.675  52.537 12.708 1.000 40.447 ? 166 THR LLL HG23 1 
ATOM   5706 N  N    . GLN C 3 167 ? 12.468  47.948 11.217 1.000 40.316 ? 167 GLN LLL N    1 
ATOM   5707 C  CA   . GLN C 3 167 ? 13.267  47.153 10.252 1.000 41.023 ? 167 GLN LLL CA   1 
ATOM   5708 C  C    . GLN C 3 167 ? 13.489  48.047 9.033  1.000 41.842 ? 167 GLN LLL C    1 
ATOM   5709 O  O    . GLN C 3 167 ? 12.579  48.783 8.644  1.000 42.156 ? 167 GLN LLL O    1 
ATOM   5710 C  CB   . GLN C 3 167 ? 12.542  45.854 9.899  1.000 41.851 ? 167 GLN LLL CB   1 
ATOM   5711 C  CG   . GLN C 3 167 ? 13.428  44.806 9.244  1.000 41.883 ? 167 GLN LLL CG   1 
ATOM   5712 C  CD   . GLN C 3 167 ? 12.602  43.691 8.651  1.000 42.958 ? 167 GLN LLL CD   1 
ATOM   5713 O  OE1  . GLN C 3 167 ? 11.445  43.884 8.289  1.000 43.938 ? 167 GLN LLL OE1  1 
ATOM   5714 N  NE2  . GLN C 3 167 ? 13.189  42.510 8.543  1.000 43.160 ? 167 GLN LLL NE2  1 
ATOM   5715 H  H    . GLN C 3 167 ? 11.667  47.577 11.443 1.000 40.648 ? 167 GLN LLL H    1 
ATOM   5716 H  HA   . GLN C 3 167 ? 14.133  46.938 10.664 1.000 40.594 ? 167 GLN LLL HA   1 
ATOM   5717 H  HB2  . GLN C 3 167 ? 12.160  45.480 10.720 1.000 41.784 ? 167 GLN LLL HB2  1 
ATOM   5718 H  HB3  . GLN C 3 167 ? 11.800  46.071 9.297  1.000 42.353 ? 167 GLN LLL HB3  1 
ATOM   5719 H  HG2  . GLN C 3 167 ? 13.962  45.225 8.537  1.000 41.967 ? 167 GLN LLL HG2  1 
ATOM   5720 H  HG3  . GLN C 3 167 ? 14.043  44.434 9.912  1.000 41.495 ? 167 GLN LLL HG3  1 
ATOM   5721 H  HE21 . GLN C 3 167 ? 12.709  41.830 7.981  0.000 30.000 ? 167 GLN LLL HE21 1 
ATOM   5722 H  HE22 . GLN C 3 167 ? 14.038  42.303 8.576  0.000 30.000 ? 167 GLN LLL HE22 1 
ATOM   5723 N  N    . PRO C 3 168 ? 14.705  48.082 8.436  1.000 41.205 ? 168 PRO LLL N    1 
ATOM   5724 C  CA   . PRO C 3 168 ? 14.929  48.885 7.233  1.000 41.292 ? 168 PRO LLL CA   1 
ATOM   5725 C  C    . PRO C 3 168 ? 13.995  48.452 6.090  1.000 42.015 ? 168 PRO LLL C    1 
ATOM   5726 O  O    . PRO C 3 168 ? 13.713  47.282 5.979  1.000 42.751 ? 168 PRO LLL O    1 
ATOM   5727 C  CB   . PRO C 3 168 ? 16.411  48.640 6.916  1.000 41.100 ? 168 PRO LLL CB   1 
ATOM   5728 C  CG   . PRO C 3 168 ? 17.010  48.251 8.255  1.000 40.365 ? 168 PRO LLL CG   1 
ATOM   5729 C  CD   . PRO C 3 168 ? 15.930  47.418 8.911  1.000 40.153 ? 168 PRO LLL CD   1 
ATOM   5730 H  HA   . PRO C 3 168 ? 14.790  49.842 7.445  1.000 41.330 ? 168 PRO LLL HA   1 
ATOM   5731 H  HB2  . PRO C 3 168 ? 16.518  47.917 6.262  1.000 41.345 ? 168 PRO LLL HB2  1 
ATOM   5732 H  HB3  . PRO C 3 168 ? 16.836  49.452 6.565  1.000 41.192 ? 168 PRO LLL HB3  1 
ATOM   5733 H  HG2  . PRO C 3 168 ? 17.829  47.729 8.134  1.000 40.192 ? 168 PRO LLL HG2  1 
ATOM   5734 H  HG3  . PRO C 3 168 ? 17.213  49.044 8.791  1.000 40.118 ? 168 PRO LLL HG3  1 
ATOM   5735 H  HD2  . PRO C 3 168 ? 15.968  46.490 8.616  1.000 40.395 ? 168 PRO LLL HD2  1 
ATOM   5736 H  HD3  . PRO C 3 168 ? 16.001  47.452 9.882  1.000 39.974 ? 168 PRO LLL HD3  1 
ATOM   5737 N  N    . SER C 3 169 ? 13.521  49.408 5.291  1.000 42.373 ? 169 SER LLL N    1 
ATOM   5738 C  CA   . SER C 3 169 ? 12.521  49.200 4.213  1.000 43.536 ? 169 SER LLL CA   1 
ATOM   5739 C  C    . SER C 3 169 ? 12.988  49.906 2.935  1.000 44.530 ? 169 SER LLL C    1 
ATOM   5740 O  O    . SER C 3 169 ? 13.547  51.001 3.057  1.000 44.527 ? 169 SER LLL O    1 
ATOM   5741 C  CB   . SER C 3 169 ? 11.179  49.699 4.661  1.000 44.145 ? 169 SER LLL CB   1 
ATOM   5742 O  OG   . SER C 3 169 ? 10.359  50.027 3.551  1.000 45.971 ? 169 SER LLL OG   1 
ATOM   5743 H  H    . SER C 3 169 ? 13.783  50.279 5.353  1.000 42.381 ? 169 SER LLL H    1 
ATOM   5744 H  HA   . SER C 3 169 ? 12.454  48.225 4.028  1.000 43.753 ? 169 SER LLL HA   1 
ATOM   5745 H  HB2  . SER C 3 169 ? 10.738  49.007 5.204  1.000 44.162 ? 169 SER LLL HB2  1 
ATOM   5746 H  HB3  . SER C 3 169 ? 11.303  50.496 5.222  1.000 43.894 ? 169 SER LLL HB3  1 
ATOM   5747 H  HG   . SER C 3 169 ? 9.741   50.337 4.009  0.000 30.000 ? 169 SER LLL HG   1 
ATOM   5748 N  N    . LYS C 3 170 ? 12.758  49.308 1.761  1.000 46.003 ? 170 LYS LLL N    1 
ATOM   5749 C  CA   . LYS C 3 170 ? 13.235  49.837 0.453  1.000 47.748 ? 170 LYS LLL CA   1 
ATOM   5750 C  C    . LYS C 3 170 ? 12.579  51.189 0.143  1.000 48.108 ? 170 LYS LLL C    1 
ATOM   5751 O  O    . LYS C 3 170 ? 11.431  51.407 0.557  1.000 48.006 ? 170 LYS LLL O    1 
ATOM   5752 C  CB   . LYS C 3 170 ? 12.917  48.883 -0.701 1.000 49.546 ? 170 LYS LLL CB   1 
ATOM   5753 C  CG   . LYS C 3 170 ? 13.832  47.678 -0.846 1.000 49.900 ? 170 LYS LLL CG   1 
ATOM   5754 C  CD   . LYS C 3 170 ? 13.761  47.066 -2.237 1.000 51.997 ? 170 LYS LLL CD   1 
ATOM   5755 C  CE   . LYS C 3 170 ? 13.906  45.556 -2.256 1.000 52.342 ? 170 LYS LLL CE   1 
ATOM   5756 N  NZ   . LYS C 3 170 ? 15.072  45.097 -1.462 1.000 50.931 ? 170 LYS LLL NZ   1 
ATOM   5757 H  H    . LYS C 3 170 ? 12.289  48.529 1.695  1.000 46.304 ? 170 LYS LLL H    1 
ATOM   5758 H  HA   . LYS C 3 170 ? 14.209  49.960 0.505  1.000 47.315 ? 170 LYS LLL HA   1 
ATOM   5759 H  HB2  . LYS C 3 170 ? 11.999  48.560 -0.588 1.000 49.788 ? 170 LYS LLL HB2  1 
ATOM   5760 H  HB3  . LYS C 3 170 ? 12.948  49.393 -1.538 1.000 50.288 ? 170 LYS LLL HB3  1 
ATOM   5761 H  HG2  . LYS C 3 170 ? 14.755  47.953 -0.661 1.000 49.490 ? 170 LYS LLL HG2  1 
ATOM   5762 H  HG3  . LYS C 3 170 ? 13.578  47.002 -0.182 1.000 49.450 ? 170 LYS LLL HG3  1 
ATOM   5763 H  HD2  . LYS C 3 170 ? 12.902  47.304 -2.646 1.000 52.638 ? 170 LYS LLL HD2  1 
ATOM   5764 H  HD3  . LYS C 3 170 ? 14.472  47.457 -2.787 1.000 52.214 ? 170 LYS LLL HD3  1 
ATOM   5765 H  HE2  . LYS C 3 170 ? 13.097  45.147 -1.895 1.000 52.159 ? 170 LYS LLL HE2  1 
ATOM   5766 H  HE3  . LYS C 3 170 ? 14.012  45.252 -3.178 1.000 53.034 ? 170 LYS LLL HE3  1 
ATOM   5767 H  HZ1  . LYS C 3 170 ? 15.755  45.687 -1.547 1.000 50.909 ? 170 LYS LLL HZ1  1 
ATOM   5768 H  HZ2  . LYS C 3 170 ? 15.345  44.285 -1.760 1.000 51.170 ? 170 LYS LLL HZ2  1 
ATOM   5769 H  HZ3  . LYS C 3 170 ? 14.842  45.029 -0.588 1.000 50.311 ? 170 LYS LLL HZ3  1 
ATOM   5770 N  N    . GLN C 3 171 ? 13.304  52.046 -0.578 1.000 48.745 ? 171 GLN LLL N    1 
ATOM   5771 C  CA   . GLN C 3 171 ? 12.803  53.297 -1.204 1.000 49.708 ? 171 GLN LLL CA   1 
ATOM   5772 C  C    . GLN C 3 171 ? 12.496  52.972 -2.669 1.000 51.443 ? 171 GLN LLL C    1 
ATOM   5773 O  O    . GLN C 3 171 ? 12.585  51.781 -3.015 1.000 52.014 ? 171 GLN LLL O    1 
ATOM   5774 C  CB   . GLN C 3 171 ? 13.849  54.403 -1.038 1.000 49.133 ? 171 GLN LLL CB   1 
ATOM   5775 C  CG   . GLN C 3 171 ? 14.318  54.587 0.402  1.000 47.395 ? 171 GLN LLL CG   1 
ATOM   5776 C  CD   . GLN C 3 171 ? 15.381  55.648 0.554  1.000 46.930 ? 171 GLN LLL CD   1 
ATOM   5777 O  OE1  . GLN C 3 171 ? 15.422  56.375 1.542  1.000 45.660 ? 171 GLN LLL OE1  1 
ATOM   5778 N  NE2  . GLN C 3 171 ? 16.259  55.745 -0.430 1.000 47.840 ? 171 GLN LLL NE2  1 
ATOM   5779 H  H    . GLN C 3 171 ? 14.190  51.905 -0.737 1.000 48.577 ? 171 GLN LLL H    1 
ATOM   5780 H  HA   . GLN C 3 171 ? 11.971  53.568 -0.752 1.000 49.612 ? 171 GLN LLL HA   1 
ATOM   5781 H  HB2  . GLN C 3 171 ? 14.619  54.186 -1.602 1.000 49.401 ? 171 GLN LLL HB2  1 
ATOM   5782 H  HB3  . GLN C 3 171 ? 13.467  55.245 -1.362 1.000 49.599 ? 171 GLN LLL HB3  1 
ATOM   5783 H  HG2  . GLN C 3 171 ? 13.548  54.827 0.960  1.000 47.211 ? 171 GLN LLL HG2  1 
ATOM   5784 H  HG3  . GLN C 3 171 ? 14.672  53.736 0.736  1.000 46.981 ? 171 GLN LLL HG3  1 
ATOM   5785 H  HE21 . GLN C 3 171 ? 16.873  56.394 -0.397 0.000 30.000 ? 171 GLN LLL HE21 1 
ATOM   5786 H  HE22 . GLN C 3 171 ? 16.179  55.264 -1.162 0.000 30.000 ? 171 GLN LLL HE22 1 
ATOM   5787 N  N    . SER C 3 172 ? 12.151  53.972 -3.488 1.000 52.824 ? 172 SER LLL N    1 
ATOM   5788 C  CA   . SER C 3 172 ? 11.955  53.834 -4.958 1.000 54.776 ? 172 SER LLL CA   1 
ATOM   5789 C  C    . SER C 3 172 ? 13.207  53.218 -5.594 1.000 55.524 ? 172 SER LLL C    1 
ATOM   5790 O  O    . SER C 3 172 ? 13.055  52.305 -6.434 1.000 56.424 ? 172 SER LLL O    1 
ATOM   5791 C  CB   . SER C 3 172 ? 11.650  55.158 -5.606 1.000 56.279 ? 172 SER LLL CB   1 
ATOM   5792 O  OG   . SER C 3 172 ? 10.865  55.977 -4.754 1.000 56.481 ? 172 SER LLL OG   1 
ATOM   5793 H  H    . SER C 3 172 ? 12.006  54.824 -3.199 1.000 52.648 ? 172 SER LLL H    1 
ATOM   5794 H  HA   . SER C 3 172 ? 11.189  53.219 -5.114 1.000 55.350 ? 172 SER LLL HA   1 
ATOM   5795 H  HB2  . SER C 3 172 ? 12.493  55.620 -5.818 1.000 56.344 ? 172 SER LLL HB2  1 
ATOM   5796 H  HB3  . SER C 3 172 ? 11.165  55.004 -6.449 1.000 57.513 ? 172 SER LLL HB3  1 
ATOM   5797 H  HG   . SER C 3 172 ? 10.912  56.651 -5.342 0.000 30.000 ? 172 SER LLL HG   1 
ATOM   5798 N  N    . ASN C 3 173 ? 14.391  53.694 -5.183 1.000 54.750 ? 173 ASN LLL N    1 
ATOM   5799 C  CA   . ASN C 3 173 ? 15.702  53.444 -5.848 1.000 54.993 ? 173 ASN LLL CA   1 
ATOM   5800 C  C    . ASN C 3 173 ? 16.419  52.236 -5.221 1.000 54.086 ? 173 ASN LLL C    1 
ATOM   5801 O  O    . ASN C 3 173 ? 17.635  52.079 -5.469 1.000 54.531 ? 173 ASN LLL O    1 
ATOM   5802 C  CB   . ASN C 3 173 ? 16.575  54.704 -5.824 1.000 54.875 ? 173 ASN LLL CB   1 
ATOM   5803 C  CG   . ASN C 3 173 ? 16.849  55.238 -4.432 1.000 53.275 ? 173 ASN LLL CG   1 
ATOM   5804 O  OD1  . ASN C 3 173 ? 16.191  54.861 -3.465 1.000 52.567 ? 173 ASN LLL OD1  1 
ATOM   5805 N  ND2  . ASN C 3 173 ? 17.820  56.128 -4.321 1.000 53.193 ? 173 ASN LLL ND2  1 
ATOM   5806 H  H    . ASN C 3 173 ? 14.464  54.216 -4.442 1.000 53.918 ? 173 ASN LLL H    1 
ATOM   5807 H  HA   . ASN C 3 173 ? 15.523  53.233 -6.794 1.000 56.175 ? 173 ASN LLL HA   1 
ATOM   5808 H  HB2  . ASN C 3 173 ? 17.429  54.503 -6.259 1.000 55.291 ? 173 ASN LLL HB2  1 
ATOM   5809 H  HB3  . ASN C 3 173 ? 16.130  55.402 -6.347 1.000 55.693 ? 173 ASN LLL HB3  1 
ATOM   5810 H  HD21 . ASN C 3 173 ? 17.925  56.561 -3.464 0.000 30.000 ? 173 ASN LLL HD21 1 
ATOM   5811 H  HD22 . ASN C 3 173 ? 18.193  56.445 -4.967 0.000 30.000 ? 173 ASN LLL HD22 1 
ATOM   5812 N  N    . ASN C 3 174 ? 15.703  51.409 -4.449 1.000 53.175 ? 174 ASN LLL N    1 
ATOM   5813 C  CA   . ASN C 3 174 ? 16.208  50.142 -3.849 1.000 51.972 ? 174 ASN LLL CA   1 
ATOM   5814 C  C    . ASN C 3 174 ? 17.337  50.433 -2.845 1.000 50.456 ? 174 ASN LLL C    1 
ATOM   5815 O  O    . ASN C 3 174 ? 18.097  49.490 -2.518 1.000 50.290 ? 174 ASN LLL O    1 
ATOM   5816 C  CB   . ASN C 3 174 ? 16.617  49.127 -4.924 1.000 52.867 ? 174 ASN LLL CB   1 
ATOM   5817 C  CG   . ASN C 3 174 ? 15.428  48.406 -5.526 1.000 54.086 ? 174 ASN LLL CG   1 
ATOM   5818 O  OD1  . ASN C 3 174 ? 14.728  48.954 -6.375 1.000 55.279 ? 174 ASN LLL OD1  1 
ATOM   5819 N  ND2  . ASN C 3 174 ? 15.192  47.176 -5.096 1.000 53.732 ? 174 ASN LLL ND2  1 
ATOM   5820 H  H    . ASN C 3 174 ? 14.837  51.577 -4.232 1.000 53.113 ? 174 ASN LLL H    1 
ATOM   5821 H  HA   . ASN C 3 174 ? 15.462  49.738 -3.346 1.000 51.568 ? 174 ASN LLL HA   1 
ATOM   5822 H  HB2  . ASN C 3 174 ? 17.102  49.592 -5.635 1.000 53.743 ? 174 ASN LLL HB2  1 
ATOM   5823 H  HB3  . ASN C 3 174 ? 17.220  48.467 -4.527 1.000 52.359 ? 174 ASN LLL HB3  1 
ATOM   5824 H  HD21 . ASN C 3 174 ? 14.479  46.698 -5.307 0.000 30.000 ? 174 ASN LLL HD21 1 
ATOM   5825 H  HD22 . ASN C 3 174 ? 15.717  46.820 -4.415 0.000 30.000 ? 174 ASN LLL HD22 1 
ATOM   5826 N  N    . LYS C 3 175 ? 17.435  51.678 -2.361 1.000 49.530 ? 175 LYS LLL N    1 
ATOM   5827 C  CA   . LYS C 3 175 ? 18.162  52.035 -1.113 1.000 47.863 ? 175 LYS LLL CA   1 
ATOM   5828 C  C    . LYS C 3 175 ? 17.175  51.859 0.038  1.000 46.382 ? 175 LYS LLL C    1 
ATOM   5829 O  O    . LYS C 3 175 ? 15.986  51.649 -0.248 1.000 46.907 ? 175 LYS LLL O    1 
ATOM   5830 C  CB   . LYS C 3 175 ? 18.699  53.468 -1.152 1.000 47.949 ? 175 LYS LLL CB   1 
ATOM   5831 C  CG   . LYS C 3 175 ? 19.791  53.717 -2.181 1.000 48.771 ? 175 LYS LLL CG   1 
ATOM   5832 C  CD   . LYS C 3 175 ? 20.438  55.080 -2.067 1.000 48.357 ? 175 LYS LLL CD   1 
ATOM   5833 C  CE   . LYS C 3 175 ? 21.640  55.206 -2.974 1.000 48.884 ? 175 LYS LLL CE   1 
ATOM   5834 N  NZ   . LYS C 3 175 ? 22.308  56.510 -2.796 1.000 49.456 ? 175 LYS LLL NZ   1 
ATOM   5835 H  H    . LYS C 3 175 ? 17.052  52.395 -2.767 1.000 50.112 ? 175 LYS LLL H    1 
ATOM   5836 H  HA   . LYS C 3 175 ? 18.914  51.410 -0.991 1.000 47.579 ? 175 LYS LLL HA   1 
ATOM   5837 H  HB2  . LYS C 3 175 ? 17.952  54.073 -1.341 1.000 48.246 ? 175 LYS LLL HB2  1 
ATOM   5838 H  HB3  . LYS C 3 175 ? 19.049  53.694 -0.265 1.000 47.131 ? 175 LYS LLL HB3  1 
ATOM   5839 H  HG2  . LYS C 3 175 ? 20.482  53.028 -2.079 1.000 48.489 ? 175 LYS LLL HG2  1 
ATOM   5840 H  HG3  . LYS C 3 175 ? 19.405  53.623 -3.078 1.000 49.576 ? 175 LYS LLL HG3  1 
ATOM   5841 H  HD2  . LYS C 3 175 ? 19.783  55.771 -2.305 1.000 48.701 ? 175 LYS LLL HD2  1 
ATOM   5842 H  HD3  . LYS C 3 175 ? 20.718  55.230 -1.139 1.000 47.522 ? 175 LYS LLL HD3  1 
ATOM   5843 H  HE2  . LYS C 3 175 ? 22.276  54.492 -2.776 1.000 48.812 ? 175 LYS LLL HE2  1 
ATOM   5844 H  HE3  . LYS C 3 175 ? 21.360  55.114 -3.904 1.000 50.035 ? 175 LYS LLL HE3  1 
ATOM   5845 H  HZ1  . LYS C 3 175 ? 21.732  57.181 -3.002 1.000 49.614 ? 175 LYS LLL HZ1  1 
ATOM   5846 H  HZ2  . LYS C 3 175 ? 23.031  56.562 -3.341 1.000 50.067 ? 175 LYS LLL HZ2  1 
ATOM   5847 H  HZ3  . LYS C 3 175 ? 22.577  56.604 -1.935 1.000 48.542 ? 175 LYS LLL HZ3  1 
ATOM   5848 N  N    . TYR C 3 176 ? 17.640  51.942 1.283  1.000 44.889 ? 176 TYR LLL N    1 
ATOM   5849 C  CA   . TYR C 3 176 ? 16.812  51.627 2.474  1.000 44.002 ? 176 TYR LLL CA   1 
ATOM   5850 C  C    . TYR C 3 176 ? 16.622  52.883 3.323  1.000 43.073 ? 176 TYR LLL C    1 
ATOM   5851 O  O    . TYR C 3 176 ? 17.445  53.814 3.244  1.000 43.401 ? 176 TYR LLL O    1 
ATOM   5852 C  CB   . TYR C 3 176 ? 17.427  50.481 3.279  1.000 43.821 ? 176 TYR LLL CB   1 
ATOM   5853 C  CG   . TYR C 3 176 ? 17.274  49.124 2.640  1.000 44.636 ? 176 TYR LLL CG   1 
ATOM   5854 C  CD1  . TYR C 3 176 ? 18.098  48.728 1.597  1.000 45.479 ? 176 TYR LLL CD1  1 
ATOM   5855 C  CD2  . TYR C 3 176 ? 16.305  48.233 3.075  1.000 44.762 ? 176 TYR LLL CD2  1 
ATOM   5856 C  CE1  . TYR C 3 176 ? 17.963  47.488 0.998  1.000 46.001 ? 176 TYR LLL CE1  1 
ATOM   5857 C  CE2  . TYR C 3 176 ? 16.156  46.989 2.487  1.000 45.473 ? 176 TYR LLL CE2  1 
ATOM   5858 C  CZ   . TYR C 3 176 ? 16.993  46.613 1.450  1.000 46.263 ? 176 TYR LLL CZ   1 
ATOM   5859 O  OH   . TYR C 3 176 ? 16.864  45.383 0.877  1.000 47.419 ? 176 TYR LLL OH   1 
ATOM   5860 H  H    . TYR C 3 176 ? 18.489  52.194 1.494  1.000 44.755 ? 176 TYR LLL H    1 
ATOM   5861 H  HA   . TYR C 3 176 ? 15.920  51.336 2.161  1.000 44.414 ? 176 TYR LLL HA   1 
ATOM   5862 H  HB2  . TYR C 3 176 ? 18.382  50.666 3.404  1.000 43.589 ? 176 TYR LLL HB2  1 
ATOM   5863 H  HB3  . TYR C 3 176 ? 17.008  50.463 4.165  1.000 43.281 ? 176 TYR LLL HB3  1 
ATOM   5864 H  HD1  . TYR C 3 176 ? 18.763  49.320 1.285  1.000 45.709 ? 176 TYR LLL HD1  1 
ATOM   5865 H  HD2  . TYR C 3 176 ? 15.732  48.481 3.782  1.000 44.477 ? 176 TYR LLL HD2  1 
ATOM   5866 H  HE1  . TYR C 3 176 ? 18.538  47.235 0.294  1.000 46.550 ? 176 TYR LLL HE1  1 
ATOM   5867 H  HE2  . TYR C 3 176 ? 15.496  46.393 2.800  1.000 45.373 ? 176 TYR LLL HE2  1 
ATOM   5868 H  HH   . TYR C 3 176 ? 17.674  44.967 0.985  0.000 30.000 ? 176 TYR LLL HH   1 
ATOM   5869 N  N    . MET C 3 177 ? 15.531  52.887 4.090  1.000 42.221 ? 177 MET LLL N    1 
ATOM   5870 C  CA   . MET C 3 177 ? 15.177  53.931 5.083  1.000 41.162 ? 177 MET LLL CA   1 
ATOM   5871 C  C    . MET C 3 177 ? 14.715  53.234 6.365  1.000 39.022 ? 177 MET LLL C    1 
ATOM   5872 O  O    . MET C 3 177 ? 14.175  52.107 6.270  1.000 38.032 ? 177 MET LLL O    1 
ATOM   5873 C  CB   . MET C 3 177 ? 14.064  54.850 4.572  1.000 42.457 ? 177 MET LLL CB   1 
ATOM   5874 C  CG   . MET C 3 177 ? 12.717  54.164 4.439  1.000 43.636 ? 177 MET LLL CG   1 
ATOM   5875 S  SD   . MET C 3 177 ? 11.574  55.146 3.453  1.000 46.493 ? 177 MET LLL SD   1 
ATOM   5876 C  CE   . MET C 3 177 ? 10.612  53.846 2.678  1.000 47.277 ? 177 MET LLL CE   1 
ATOM   5877 H  H    . MET C 3 177 ? 14.913  52.218 4.046  1.000 42.334 ? 177 MET LLL H    1 
ATOM   5878 H  HA   . MET C 3 177 ? 15.981  54.460 5.280  1.000 40.850 ? 177 MET LLL HA   1 
ATOM   5879 H  HB2  . MET C 3 177 ? 13.976  55.606 5.186  1.000 42.206 ? 177 MET LLL HB2  1 
ATOM   5880 H  HB3  . MET C 3 177 ? 14.327  55.205 3.700  1.000 43.013 ? 177 MET LLL HB3  1 
ATOM   5881 H  HG2  . MET C 3 177 ? 12.835  53.288 4.016  1.000 44.029 ? 177 MET LLL HG2  1 
ATOM   5882 H  HG3  . MET C 3 177 ? 12.330  54.024 5.330  1.000 43.460 ? 177 MET LLL HG3  1 
ATOM   5883 H  HE1  . MET C 3 177 ? 9.921   54.240 2.131  1.000 48.054 ? 177 MET LLL HE1  1 
ATOM   5884 H  HE2  . MET C 3 177 ? 11.190  53.307 2.127  1.000 47.425 ? 177 MET LLL HE2  1 
ATOM   5885 H  HE3  . MET C 3 177 ? 10.209  53.295 3.359  1.000 47.009 ? 177 MET LLL HE3  1 
ATOM   5886 N  N    . ALA C 3 178 ? 14.951  53.887 7.504  1.000 36.927 ? 178 ALA LLL N    1 
ATOM   5887 C  CA   . ALA C 3 178 ? 14.514  53.455 8.848  1.000 35.670 ? 178 ALA LLL CA   1 
ATOM   5888 C  C    . ALA C 3 178 ? 14.267  54.689 9.716  1.000 34.414 ? 178 ALA LLL C    1 
ATOM   5889 O  O    . ALA C 3 178 ? 14.663  55.797 9.320  1.000 33.659 ? 178 ALA LLL O    1 
ATOM   5890 C  CB   . ALA C 3 178 ? 15.543  52.542 9.464  1.000 35.308 ? 178 ALA LLL CB   1 
ATOM   5891 H  H    . ALA C 3 178 ? 15.418  54.669 7.533  1.000 37.050 ? 178 ALA LLL H    1 
ATOM   5892 H  HA   . ALA C 3 178 ? 13.665  52.962 8.758  1.000 35.912 ? 178 ALA LLL HA   1 
ATOM   5893 H  HB1  . ALA C 3 178 ? 15.260  52.289 10.358 1.000 35.020 ? 178 ALA LLL HB1  1 
ATOM   5894 H  HB2  . ALA C 3 178 ? 15.638  51.744 8.917  1.000 35.382 ? 178 ALA LLL HB2  1 
ATOM   5895 H  HB3  . ALA C 3 178 ? 16.398  53.002 9.514  1.000 35.091 ? 178 ALA LLL HB3  1 
ATOM   5896 N  N    . SER C 3 179 ? 13.584  54.488 10.837 1.000 33.419 ? 179 SER LLL N    1 
ATOM   5897 C  CA   . SER C 3 179 ? 13.332  55.525 11.864 1.000 32.786 ? 179 SER LLL CA   1 
ATOM   5898 C  C    . SER C 3 179 ? 13.459  54.870 13.237 1.000 31.780 ? 179 SER LLL C    1 
ATOM   5899 O  O    . SER C 3 179 ? 12.997  53.736 13.396 1.000 31.021 ? 179 SER LLL O    1 
ATOM   5900 C  CB   . SER C 3 179 ? 12.000  56.196 11.670 1.000 32.893 ? 179 SER LLL CB   1 
ATOM   5901 O  OG   . SER C 3 179 ? 10.979  55.234 11.466 1.000 33.594 ? 179 SER LLL OG   1 
ATOM   5902 H  H    . SER C 3 179 ? 13.211  53.686 11.056 1.000 33.521 ? 179 SER LLL H    1 
ATOM   5903 H  HA   . SER C 3 179 ? 14.042  56.213 11.782 1.000 32.529 ? 179 SER LLL HA   1 
ATOM   5904 H  HB2  . SER C 3 179 ? 11.787  56.737 12.464 1.000 32.999 ? 179 SER LLL HB2  1 
ATOM   5905 H  HB3  . SER C 3 179 ? 12.046  56.796 10.892 1.000 33.283 ? 179 SER LLL HB3  1 
ATOM   5906 H  HG   . SER C 3 179 ? 10.266  55.601 11.290 0.000 30.000 ? 179 SER LLL HG   1 
ATOM   5907 N  N    . SER C 3 180 ? 14.138  55.551 14.155 1.000 31.374 ? 180 SER LLL N    1 
ATOM   5908 C  CA   . SER C 3 180 ? 14.226  55.186 15.585 1.000 31.305 ? 180 SER LLL CA   1 
ATOM   5909 C  C    . SER C 3 180 ? 13.487  56.249 16.394 1.000 32.012 ? 180 SER LLL C    1 
ATOM   5910 O  O    . SER C 3 180 ? 13.543  57.433 16.012 1.000 32.682 ? 180 SER LLL O    1 
ATOM   5911 C  CB   . SER C 3 180 ? 15.643  55.039 16.020 1.000 30.599 ? 180 SER LLL CB   1 
ATOM   5912 O  OG   . SER C 3 180 ? 15.722  54.113 17.087 1.000 30.544 ? 180 SER LLL OG   1 
ATOM   5913 H  H    . SER C 3 180 ? 14.608  56.308 13.966 1.000 31.372 ? 180 SER LLL H    1 
ATOM   5914 H  HA   . SER C 3 180 ? 13.763  54.317 15.713 1.000 31.442 ? 180 SER LLL HA   1 
ATOM   5915 H  HB2  . SER C 3 180 ? 16.189  54.723 15.265 1.000 30.586 ? 180 SER LLL HB2  1 
ATOM   5916 H  HB3  . SER C 3 180 ? 15.993  55.911 16.311 1.000 30.673 ? 180 SER LLL HB3  1 
ATOM   5917 H  HG   . SER C 3 180 ? 16.478  54.035 17.280 0.000 30.000 ? 180 SER LLL HG   1 
ATOM   5918 N  N    . TYR C 3 181 ? 12.781  55.824 17.438 1.000 32.309 ? 181 TYR LLL N    1 
ATOM   5919 C  CA   . TYR C 3 181 ? 11.958  56.700 18.300 1.000 32.986 ? 181 TYR LLL CA   1 
ATOM   5920 C  C    . TYR C 3 181 ? 12.379  56.484 19.755 1.000 33.215 ? 181 TYR LLL C    1 
ATOM   5921 O  O    . TYR C 3 181 ? 12.177  55.372 20.270 1.000 34.123 ? 181 TYR LLL O    1 
ATOM   5922 C  CB   . TYR C 3 181 ? 10.471  56.400 18.097 1.000 33.798 ? 181 TYR LLL CB   1 
ATOM   5923 C  CG   . TYR C 3 181 ? 9.983   56.452 16.671 1.000 34.437 ? 181 TYR LLL CG   1 
ATOM   5924 C  CD1  . TYR C 3 181 ? 10.115  55.361 15.826 1.000 34.968 ? 181 TYR LLL CD1  1 
ATOM   5925 C  CD2  . TYR C 3 181 ? 9.345   57.574 16.169 1.000 34.985 ? 181 TYR LLL CD2  1 
ATOM   5926 C  CE1  . TYR C 3 181 ? 9.653   55.396 14.518 1.000 35.475 ? 181 TYR LLL CE1  1 
ATOM   5927 C  CE2  . TYR C 3 181 ? 8.876   57.625 14.865 1.000 35.265 ? 181 TYR LLL CE2  1 
ATOM   5928 C  CZ   . TYR C 3 181 ? 9.025   56.531 14.032 1.000 35.383 ? 181 TYR LLL CZ   1 
ATOM   5929 O  OH   . TYR C 3 181 ? 8.563   56.561 12.743 1.000 35.643 ? 181 TYR LLL OH   1 
ATOM   5930 H  H    . TYR C 3 181 ? 12.754  54.951 17.700 1.000 32.370 ? 181 TYR LLL H    1 
ATOM   5931 H  HA   . TYR C 3 181 ? 12.129  57.642 18.057 1.000 32.954 ? 181 TYR LLL HA   1 
ATOM   5932 H  HB2  . TYR C 3 181 ? 10.288  55.506 18.456 1.000 33.999 ? 181 TYR LLL HB2  1 
ATOM   5933 H  HB3  . TYR C 3 181 ? 9.955   57.042 18.627 1.000 34.190 ? 181 TYR LLL HB3  1 
ATOM   5934 H  HD1  . TYR C 3 181 ? 10.540  54.581 16.143 1.000 34.641 ? 181 TYR LLL HD1  1 
ATOM   5935 H  HD2  . TYR C 3 181 ? 9.232   58.325 16.727 1.000 35.031 ? 181 TYR LLL HD2  1 
ATOM   5936 H  HE1  . TYR C 3 181 ? 9.761   54.644 13.960 1.000 35.265 ? 181 TYR LLL HE1  1 
ATOM   5937 H  HE2  . TYR C 3 181 ? 8.449   58.402 14.548 1.000 35.569 ? 181 TYR LLL HE2  1 
ATOM   5938 H  HH   . TYR C 3 181 ? 7.950   55.876 12.565 0.000 30.000 ? 181 TYR LLL HH   1 
ATOM   5939 N  N    . LEU C 3 182 ? 12.952  57.506 20.394 1.000 32.939 ? 182 LEU LLL N    1 
ATOM   5940 C  CA   . LEU C 3 182 ? 13.156  57.531 21.867 1.000 33.153 ? 182 LEU LLL CA   1 
ATOM   5941 C  C    . LEU C 3 182 ? 11.939  58.201 22.514 1.000 33.710 ? 182 LEU LLL C    1 
ATOM   5942 O  O    . LEU C 3 182 ? 11.670  59.382 22.199 1.000 33.426 ? 182 LEU LLL O    1 
ATOM   5943 C  CB   . LEU C 3 182 ? 14.456  58.271 22.192 1.000 32.980 ? 182 LEU LLL CB   1 
ATOM   5944 C  CG   . LEU C 3 182 ? 14.875  58.249 23.661 1.000 33.740 ? 182 LEU LLL CG   1 
ATOM   5945 C  CD1  . LEU C 3 182 ? 15.220  56.838 24.109 1.000 34.014 ? 182 LEU LLL CD1  1 
ATOM   5946 C  CD2  . LEU C 3 182 ? 16.051  59.184 23.909 1.000 33.766 ? 182 LEU LLL CD2  1 
ATOM   5947 H  H    . LEU C 3 182 ? 13.253  58.251 19.964 1.000 32.821 ? 182 LEU LLL H    1 
ATOM   5948 H  HA   . LEU C 3 182 ? 13.217  56.603 22.189 1.000 33.227 ? 182 LEU LLL HA   1 
ATOM   5949 H  HB2  . LEU C 3 182 ? 15.175  57.877 21.659 1.000 32.707 ? 182 LEU LLL HB2  1 
ATOM   5950 H  HB3  . LEU C 3 182 ? 14.358  59.202 21.913 1.000 33.047 ? 182 LEU LLL HB3  1 
ATOM   5951 H  HG   . LEU C 3 182 ? 14.113  58.565 24.205 1.000 34.171 ? 182 LEU LLL HG   1 
ATOM   5952 H  HD11 . LEU C 3 182 ? 14.415  56.292 24.117 1.000 34.140 ? 182 LEU LLL HD11 1 
ATOM   5953 H  HD12 . LEU C 3 182 ? 15.598  56.869 25.004 1.000 34.288 ? 182 LEU LLL HD12 1 
ATOM   5954 H  HD13 . LEU C 3 182 ? 15.869  56.451 23.497 1.000 33.546 ? 182 LEU LLL HD13 1 
ATOM   5955 H  HD21 . LEU C 3 182 ? 16.826  58.870 23.411 1.000 33.421 ? 182 LEU LLL HD21 1 
ATOM   5956 H  HD22 . LEU C 3 182 ? 16.261  59.197 24.859 1.000 34.114 ? 182 LEU LLL HD22 1 
ATOM   5957 H  HD23 . LEU C 3 182 ? 15.819  60.082 23.616 1.000 33.737 ? 182 LEU LLL HD23 1 
ATOM   5958 N  N    . THR C 3 183 ? 11.224  57.462 23.365 1.000 34.359 ? 183 THR LLL N    1 
ATOM   5959 C  CA   . THR C 3 183 ? 10.009  57.932 24.083 1.000 35.192 ? 183 THR LLL CA   1 
ATOM   5960 C  C    . THR C 3 183 ? 10.340  58.109 25.572 1.000 35.629 ? 183 THR LLL C    1 
ATOM   5961 O  O    . THR C 3 183 ? 10.774  57.135 26.211 1.000 35.815 ? 183 THR LLL O    1 
ATOM   5962 C  CB   . THR C 3 183 ? 8.826   56.987 23.836 1.000 35.655 ? 183 THR LLL CB   1 
ATOM   5963 O  OG1  . THR C 3 183 ? 8.664   56.876 22.423 1.000 34.821 ? 183 THR LLL OG1  1 
ATOM   5964 C  CG2  . THR C 3 183 ? 7.538   57.478 24.458 1.000 36.868 ? 183 THR LLL CG2  1 
ATOM   5965 H  H    . THR C 3 183 ? 11.434  56.600 23.571 1.000 34.332 ? 183 THR LLL H    1 
ATOM   5966 H  HA   . THR C 3 183 ? 9.770   58.813 23.717 1.000 35.137 ? 183 THR LLL HA   1 
ATOM   5967 H  HB   . THR C 3 183 ? 9.048   56.100 24.208 1.000 35.695 ? 183 THR LLL HB   1 
ATOM   5968 H  HG1  . THR C 3 183 ? 8.054   56.439 22.164 0.000 30.000 ? 183 THR LLL HG1  1 
ATOM   5969 H  HG21 . THR C 3 183 ? 7.558   57.320 25.419 1.000 37.263 ? 183 THR LLL HG21 1 
ATOM   5970 H  HG22 . THR C 3 183 ? 6.784   57.000 24.067 1.000 37.139 ? 183 THR LLL HG22 1 
ATOM   5971 H  HG23 . THR C 3 183 ? 7.438   58.432 24.289 1.000 36.767 ? 183 THR LLL HG23 1 
ATOM   5972 N  N    . LEU C 3 184 ? 10.158  59.329 26.078 1.000 35.909 ? 184 LEU LLL N    1 
ATOM   5973 C  CA   . LEU C 3 184 ? 10.380  59.726 27.491 1.000 36.562 ? 184 LEU LLL CA   1 
ATOM   5974 C  C    . LEU C 3 184 ? 9.088   60.354 28.007 1.000 37.072 ? 184 LEU LLL C    1 
ATOM   5975 O  O    . LEU C 3 184 ? 8.218   60.671 27.187 1.000 36.721 ? 184 LEU LLL O    1 
ATOM   5976 C  CB   . LEU C 3 184 ? 11.509  60.763 27.572 1.000 36.453 ? 184 LEU LLL CB   1 
ATOM   5977 C  CG   . LEU C 3 184 ? 12.646  60.607 26.567 1.000 35.692 ? 184 LEU LLL CG   1 
ATOM   5978 C  CD1  . LEU C 3 184 ? 13.415  61.906 26.413 1.000 35.329 ? 184 LEU LLL CD1  1 
ATOM   5979 C  CD2  . LEU C 3 184 ? 13.573  59.474 26.980 1.000 35.924 ? 184 LEU LLL CD2  1 
ATOM   5980 H  H    . LEU C 3 184 ? 9.875   60.024 25.560 1.000 35.790 ? 184 LEU LLL H    1 
ATOM   5981 H  HA   . LEU C 3 184 ? 10.602  58.931 28.028 1.000 36.780 ? 184 LEU LLL HA   1 
ATOM   5982 H  HB2  . LEU C 3 184 ? 11.116  61.651 27.454 1.000 36.542 ? 184 LEU LLL HB2  1 
ATOM   5983 H  HB3  . LEU C 3 184 ? 11.888  60.730 28.473 1.000 36.858 ? 184 LEU LLL HB3  1 
ATOM   5984 H  HG   . LEU C 3 184 ? 12.255  60.379 25.689 1.000 35.361 ? 184 LEU LLL HG   1 
ATOM   5985 H  HD11 . LEU C 3 184 ? 12.817  62.601 26.086 1.000 35.412 ? 184 LEU LLL HD11 1 
ATOM   5986 H  HD12 . LEU C 3 184 ? 14.142  61.781 25.780 1.000 34.855 ? 184 LEU LLL HD12 1 
ATOM   5987 H  HD13 . LEU C 3 184 ? 13.779  62.173 27.275 1.000 35.766 ? 184 LEU LLL HD13 1 
ATOM   5988 H  HD21 . LEU C 3 184 ? 13.872  59.617 27.895 1.000 36.288 ? 184 LEU LLL HD21 1 
ATOM   5989 H  HD22 . LEU C 3 184 ? 14.344  59.453 26.387 1.000 35.291 ? 184 LEU LLL HD22 1 
ATOM   5990 H  HD23 . LEU C 3 184 ? 13.097  58.628 26.923 1.000 35.916 ? 184 LEU LLL HD23 1 
ATOM   5991 N  N    . THR C 3 185 ? 9.001   60.579 29.312 1.000 37.783 ? 185 THR LLL N    1 
ATOM   5992 C  CA   . THR C 3 185 ? 8.009   61.501 29.904 1.000 38.936 ? 185 THR LLL CA   1 
ATOM   5993 C  C    . THR C 3 185 ? 8.476   62.936 29.618 1.000 38.939 ? 185 THR LLL C    1 
ATOM   5994 O  O    . THR C 3 185 ? 9.633   63.117 29.189 1.000 37.039 ? 185 THR LLL O    1 
ATOM   5995 C  CB   . THR C 3 185 ? 7.821   61.193 31.391 1.000 40.215 ? 185 THR LLL CB   1 
ATOM   5996 O  OG1  . THR C 3 185 ? 9.073   61.448 32.029 1.000 40.376 ? 185 THR LLL OG1  1 
ATOM   5997 C  CG2  . THR C 3 185 ? 7.373   59.769 31.641 1.000 40.631 ? 185 THR LLL CG2  1 
ATOM   5998 H  H    . THR C 3 185 ? 9.549   60.195 29.930 1.000 38.053 ? 185 THR LLL H    1 
ATOM   5999 H  HA   . THR C 3 185 ? 7.151   61.356 29.447 1.000 39.173 ? 185 THR LLL HA   1 
ATOM   6000 H  HB   . THR C 3 185 ? 7.143   61.811 31.755 1.000 40.931 ? 185 THR LLL HB   1 
ATOM   6001 H  HG1  . THR C 3 185 ? 8.918   61.324 32.792 0.000 30.000 ? 185 THR LLL HG1  1 
ATOM   6002 H  HG21 . THR C 3 185 ? 6.656   59.540 31.023 1.000 40.631 ? 185 THR LLL HG21 1 
ATOM   6003 H  HG22 . THR C 3 185 ? 7.049   59.685 32.556 1.000 41.655 ? 185 THR LLL HG22 1 
ATOM   6004 H  HG23 . THR C 3 185 ? 8.122   59.163 31.506 1.000 40.139 ? 185 THR LLL HG23 1 
ATOM   6005 N  N    . ALA C 3 186 ? 7.598   63.920 29.812 1.000 40.268 ? 186 ALA LLL N    1 
ATOM   6006 C  CA   . ALA C 3 186 ? 7.960   65.350 29.761 1.000 40.802 ? 186 ALA LLL CA   1 
ATOM   6007 C  C    . ALA C 3 186 ? 8.982   65.621 30.872 1.000 41.759 ? 186 ALA LLL C    1 
ATOM   6008 O  O    . ALA C 3 186 ? 9.979   66.316 30.612 1.000 41.371 ? 186 ALA LLL O    1 
ATOM   6009 C  CB   . ALA C 3 186 ? 6.725   66.207 29.897 1.000 41.465 ? 186 ALA LLL CB   1 
ATOM   6010 H  H    . ALA C 3 186 ? 6.720   63.783 30.004 1.000 40.929 ? 186 ALA LLL H    1 
ATOM   6011 H  HA   . ALA C 3 186 ? 8.384   65.536 28.891 1.000 39.957 ? 186 ALA LLL HA   1 
ATOM   6012 H  HB1  . ALA C 3 186 ? 6.980   67.145 29.914 1.000 41.392 ? 186 ALA LLL HB1  1 
ATOM   6013 H  HB2  . ALA C 3 186 ? 6.134   66.047 29.142 1.000 41.337 ? 186 ALA LLL HB2  1 
ATOM   6014 H  HB3  . ALA C 3 186 ? 6.262   65.983 30.722 1.000 42.381 ? 186 ALA LLL HB3  1 
ATOM   6015 N  N    . ARG C 3 187 ? 8.759   65.055 32.061 1.000 43.808 ? 187 ARG LLL N    1 
ATOM   6016 C  CA   . ARG C 3 187 ? 9.570   65.348 33.273 1.000 45.477 ? 187 ARG LLL CA   1 
ATOM   6017 C  C    . ARG C 3 187 ? 10.972  64.755 33.080 1.000 44.049 ? 187 ARG LLL C    1 
ATOM   6018 O  O    . ARG C 3 187 ? 11.939  65.384 33.553 1.000 44.201 ? 187 ARG LLL O    1 
ATOM   6019 C  CB   . ARG C 3 187 ? 8.841   64.898 34.549 1.000 48.216 ? 187 ARG LLL CB   1 
ATOM   6020 C  CG   . ARG C 3 187 ? 8.072   66.023 35.239 1.000 50.530 ? 187 ARG LLL CG   1 
ATOM   6021 C  CD   . ARG C 3 187 ? 6.910   65.575 36.119 1.000 53.516 ? 187 ARG LLL CD   1 
ATOM   6022 N  NE   . ARG C 3 187 ? 5.591   65.891 35.553 1.000 55.026 ? 187 ARG LLL NE   1 
ATOM   6023 C  CZ   . ARG C 3 187 ? 4.420   65.387 35.969 1.000 56.234 ? 187 ARG LLL CZ   1 
ATOM   6024 N  NH1  . ARG C 3 187 ? 4.370   64.517 36.966 1.000 57.642 ? 187 ARG LLL NH1  1 
ATOM   6025 N  NH2  . ARG C 3 187 ? 3.298   65.750 35.370 1.000 55.978 ? 187 ARG LLL NH2  1 
ATOM   6026 H  H    . ARG C 3 187 ? 8.090   64.453 32.199 1.000 44.255 ? 187 ARG LLL H    1 
ATOM   6027 H  HA   . ARG C 3 187 ? 9.672   66.326 33.321 1.000 45.417 ? 187 ARG LLL HA   1 
ATOM   6028 H  HB2  . ARG C 3 187 ? 8.216   64.179 34.320 1.000 48.308 ? 187 ARG LLL HB2  1 
ATOM   6029 H  HB3  . ARG C 3 187 ? 9.501   64.535 35.176 1.000 48.511 ? 187 ARG LLL HB3  1 
ATOM   6030 H  HG2  . ARG C 3 187 ? 8.699   66.536 35.793 1.000 50.821 ? 187 ARG LLL HG2  1 
ATOM   6031 H  HG3  . ARG C 3 187 ? 7.725   66.632 34.553 1.000 50.082 ? 187 ARG LLL HG3  1 
ATOM   6032 H  HD2  . ARG C 3 187 ? 6.974   64.606 36.258 1.000 53.596 ? 187 ARG LLL HD2  1 
ATOM   6033 H  HD3  . ARG C 3 187 ? 6.991   66.006 36.997 1.000 54.355 ? 187 ARG LLL HD3  1 
ATOM   6034 H  HE   . ARG C 3 187 ? 5.566   66.457 34.891 1.000 54.055 ? 187 ARG LLL HE   1 
ATOM   6035 H  HH11 . ARG C 3 187 ? 5.107   64.266 37.372 1.000 57.463 ? 187 ARG LLL HH11 1 
ATOM   6036 H  HH12 . ARG C 3 187 ? 3.595   64.195 37.226 1.000 58.404 ? 187 ARG LLL HH12 1 
ATOM   6037 H  HH21 . ARG C 3 187 ? 3.321   66.327 34.704 1.000 55.423 ? 187 ARG LLL HH21 1 
ATOM   6038 H  HH22 . ARG C 3 187 ? 2.528   65.419 35.641 1.000 57.027 ? 187 ARG LLL HH22 1 
ATOM   6039 N  N    . ALA C 3 188 ? 11.090  63.641 32.352 1.000 42.635 ? 188 ALA LLL N    1 
ATOM   6040 C  CA   . ALA C 3 188 ? 12.384  63.035 31.957 1.000 41.385 ? 188 ALA LLL CA   1 
ATOM   6041 C  C    . ALA C 3 188 ? 13.079  63.915 30.906 1.000 40.126 ? 188 ALA LLL C    1 
ATOM   6042 O  O    . ALA C 3 188 ? 14.294  64.125 31.038 1.000 40.155 ? 188 ALA LLL O    1 
ATOM   6043 C  CB   . ALA C 3 188 ? 12.173  61.630 31.457 1.000 40.866 ? 188 ALA LLL CB   1 
ATOM   6044 H  H    . ALA C 3 188 ? 10.376  63.163 32.049 1.000 42.720 ? 188 ALA LLL H    1 
ATOM   6045 H  HA   . ALA C 3 188 ? 12.961  62.998 32.756 1.000 41.893 ? 188 ALA LLL HA   1 
ATOM   6046 H  HB1  . ALA C 3 188 ? 13.029  61.237 31.218 1.000 40.434 ? 188 ALA LLL HB1  1 
ATOM   6047 H  HB2  . ALA C 3 188 ? 11.757  61.095 32.154 1.000 41.626 ? 188 ALA LLL HB2  1 
ATOM   6048 H  HB3  . ALA C 3 188 ? 11.596  61.646 30.675 1.000 40.515 ? 188 ALA LLL HB3  1 
ATOM   6049 N  N    . TRP C 3 189 ? 12.342  64.418 29.910 1.000 39.075 ? 189 TRP LLL N    1 
ATOM   6050 C  CA   . TRP C 3 189 ? 12.866  65.338 28.862 1.000 38.101 ? 189 TRP LLL CA   1 
ATOM   6051 C  C    . TRP C 3 189 ? 13.488  66.569 29.525 1.000 38.647 ? 189 TRP LLL C    1 
ATOM   6052 O  O    . TRP C 3 189 ? 14.639  66.905 29.200 1.000 38.413 ? 189 TRP LLL O    1 
ATOM   6053 C  CB   . TRP C 3 189 ? 11.755  65.731 27.881 1.000 37.899 ? 189 TRP LLL CB   1 
ATOM   6054 C  CG   . TRP C 3 189 ? 12.054  66.922 27.022 1.000 37.288 ? 189 TRP LLL CG   1 
ATOM   6055 C  CD1  . TRP C 3 189 ? 11.470  68.153 27.100 1.000 37.729 ? 189 TRP LLL CD1  1 
ATOM   6056 C  CD2  . TRP C 3 189 ? 12.994  66.994 25.935 1.000 36.364 ? 189 TRP LLL CD2  1 
ATOM   6057 N  NE1  . TRP C 3 189 ? 11.978  68.984 26.138 1.000 37.089 ? 189 TRP LLL NE1  1 
ATOM   6058 C  CE2  . TRP C 3 189 ? 12.916  68.303 25.409 1.000 36.374 ? 189 TRP LLL CE2  1 
ATOM   6059 C  CE3  . TRP C 3 189 ? 13.896  66.090 25.363 1.000 35.926 ? 189 TRP LLL CE3  1 
ATOM   6060 C  CZ2  . TRP C 3 189 ? 13.706  68.723 24.340 1.000 35.884 ? 189 TRP LLL CZ2  1 
ATOM   6061 C  CZ3  . TRP C 3 189 ? 14.674  66.504 24.304 1.000 35.469 ? 189 TRP LLL CZ3  1 
ATOM   6062 C  CH2  . TRP C 3 189 ? 14.580  67.804 23.803 1.000 35.669 ? 189 TRP LLL CH2  1 
ATOM   6063 H  H    . TRP C 3 189 ? 11.460  64.218 29.804 1.000 39.375 ? 189 TRP LLL H    1 
ATOM   6064 H  HA   . TRP C 3 189 ? 13.563  64.859 28.358 1.000 37.651 ? 189 TRP LLL HA   1 
ATOM   6065 H  HB2  . TRP C 3 189 ? 11.576  64.961 27.303 1.000 37.535 ? 189 TRP LLL HB2  1 
ATOM   6066 H  HB3  . TRP C 3 189 ? 10.943  65.909 28.394 1.000 38.462 ? 189 TRP LLL HB3  1 
ATOM   6067 H  HD1  . TRP C 3 189 ? 10.799  68.399 27.718 1.000 38.268 ? 189 TRP LLL HD1  1 
ATOM   6068 H  HE1  . TRP C 3 189 ? 11.742  69.820 26.013 1.000 37.192 ? 189 TRP LLL HE1  1 
ATOM   6069 H  HE3  . TRP C 3 189 ? 13.962  65.208 25.692 1.000 35.985 ? 189 TRP LLL HE3  1 
ATOM   6070 H  HZ2  . TRP C 3 189 ? 13.646  69.601 24.005 1.000 35.926 ? 189 TRP LLL HZ2  1 
ATOM   6071 H  HZ3  . TRP C 3 189 ? 15.281  65.898 23.909 1.000 35.184 ? 189 TRP LLL HZ3  1 
ATOM   6072 H  HH2  . TRP C 3 189 ? 15.125  68.059 23.080 1.000 35.266 ? 189 TRP LLL HH2  1 
ATOM   6073 N  N    . GLU C 3 190 ? 12.749  67.200 30.437 1.000 39.490 ? 190 GLU LLL N    1 
ATOM   6074 C  CA   . GLU C 3 190 ? 13.182  68.421 31.166 1.000 40.098 ? 190 GLU LLL CA   1 
ATOM   6075 C  C    . GLU C 3 190 ? 14.376  68.121 32.082 1.000 40.489 ? 190 GLU LLL C    1 
ATOM   6076 O  O    . GLU C 3 190 ? 15.092  69.080 32.428 1.000 41.399 ? 190 GLU LLL O    1 
ATOM   6077 C  CB   . GLU C 3 190 ? 12.022  68.990 31.981 1.000 41.130 ? 190 GLU LLL CB   1 
ATOM   6078 C  CG   . GLU C 3 190 ? 11.004  69.719 31.126 1.000 41.076 ? 190 GLU LLL CG   1 
ATOM   6079 C  CD   . GLU C 3 190 ? 9.558   69.437 31.492 1.000 41.893 ? 190 GLU LLL CD   1 
ATOM   6080 O  OE1  . GLU C 3 190 ? 9.293   69.174 32.684 1.000 43.336 ? 190 GLU LLL OE1  1 
ATOM   6081 O  OE2  . GLU C 3 190 ? 8.708   69.466 30.582 1.000 41.117 ? 190 GLU LLL OE2  1 
ATOM   6082 H  H    . GLU C 3 190 ? 11.914  66.915 30.666 1.000 39.894 ? 190 GLU LLL H    1 
ATOM   6083 H  HA   . GLU C 3 190 ? 13.458  69.092 30.504 1.000 39.607 ? 190 GLU LLL HA   1 
ATOM   6084 H  HB2  . GLU C 3 190 ? 11.581  68.256 32.456 1.000 41.642 ? 190 GLU LLL HB2  1 
ATOM   6085 H  HB3  . GLU C 3 190 ? 12.380  69.611 32.649 1.000 41.688 ? 190 GLU LLL HB3  1 
ATOM   6086 H  HG2  . GLU C 3 190 ? 11.160  70.684 31.200 1.000 41.124 ? 190 GLU LLL HG2  1 
ATOM   6087 H  HG3  . GLU C 3 190 ? 11.139  69.469 30.187 1.000 40.281 ? 190 GLU LLL HG3  1 
ATOM   6088 N  N    . ARG C 3 191 ? 14.574  66.865 32.489 1.000 40.216 ? 191 ARG LLL N    1 
ATOM   6089 C  CA   . ARG C 3 191 ? 15.646  66.480 33.446 1.000 40.621 ? 191 ARG LLL CA   1 
ATOM   6090 C  C    . ARG C 3 191 ? 17.025  66.602 32.781 1.000 39.315 ? 191 ARG LLL C    1 
ATOM   6091 O  O    . ARG C 3 191 ? 17.921  67.230 33.379 1.000 39.115 ? 191 ARG LLL O    1 
ATOM   6092 C  CB   . ARG C 3 191 ? 15.435  65.051 33.951 1.000 41.256 ? 191 ARG LLL CB   1 
ATOM   6093 C  CG   . ARG C 3 191 ? 16.398  64.641 35.052 1.000 42.588 ? 191 ARG LLL CG   1 
ATOM   6094 C  CD   . ARG C 3 191 ? 16.373  65.628 36.202 1.000 44.586 ? 191 ARG LLL CD   1 
ATOM   6095 N  NE   . ARG C 3 191 ? 15.056  65.740 36.824 1.000 45.956 ? 191 ARG LLL NE   1 
ATOM   6096 C  CZ   . ARG C 3 191 ? 14.590  64.923 37.769 1.000 47.434 ? 191 ARG LLL CZ   1 
ATOM   6097 N  NH1  . ARG C 3 191 ? 15.329  63.913 38.206 1.000 47.965 ? 191 ARG LLL NH1  1 
ATOM   6098 N  NH2  . ARG C 3 191 ? 13.384  65.118 38.277 1.000 48.051 ? 191 ARG LLL NH2  1 
ATOM   6099 H  H    . ARG C 3 191 ? 14.055  66.170 32.220 1.000 40.092 ? 191 ARG LLL H    1 
ATOM   6100 H  HA   . ARG C 3 191 ? 15.608  67.099 34.208 1.000 41.359 ? 191 ARG LLL HA   1 
ATOM   6101 H  HB2  . ARG C 3 191 ? 14.517  64.968 34.283 1.000 41.768 ? 191 ARG LLL HB2  1 
ATOM   6102 H  HB3  . ARG C 3 191 ? 15.540  64.435 33.197 1.000 40.563 ? 191 ARG LLL HB3  1 
ATOM   6103 H  HG2  . ARG C 3 191 ? 16.151  63.752 35.387 1.000 42.953 ? 191 ARG LLL HG2  1 
ATOM   6104 H  HG3  . ARG C 3 191 ? 17.308  64.589 34.691 1.000 42.231 ? 191 ARG LLL HG3  1 
ATOM   6105 H  HD2  . ARG C 3 191 ? 17.026  65.347 36.877 1.000 45.171 ? 191 ARG LLL HD2  1 
ATOM   6106 H  HD3  . ARG C 3 191 ? 16.650  66.510 35.877 1.000 44.254 ? 191 ARG LLL HD3  1 
ATOM   6107 H  HE   . ARG C 3 191 ? 14.541  66.391 36.566 1.000 45.818 ? 191 ARG LLL HE   1 
ATOM   6108 H  HH11 . ARG C 3 191 ? 16.131  63.774 37.879 1.000 47.348 ? 191 ARG LLL HH11 1 
ATOM   6109 H  HH12 . ARG C 3 191 ? 15.013  63.379 38.829 1.000 48.617 ? 191 ARG LLL HH12 1 
ATOM   6110 H  HH21 . ARG C 3 191 ? 12.889  65.787 37.989 1.000 47.961 ? 191 ARG LLL HH21 1 
ATOM   6111 H  HH22 . ARG C 3 191 ? 13.076  64.576 38.899 1.000 48.921 ? 191 ARG LLL HH22 1 
ATOM   6112 N  N    . HIS C 3 192 ? 17.173  66.014 31.592 1.000 37.589 ? 192 HIS LLL N    1 
ATOM   6113 C  CA   . HIS C 3 192 ? 18.466  65.818 30.887 1.000 36.622 ? 192 HIS LLL CA   1 
ATOM   6114 C  C    . HIS C 3 192 ? 18.676  66.955 29.871 1.000 36.408 ? 192 HIS LLL C    1 
ATOM   6115 O  O    . HIS C 3 192 ? 17.678  67.610 29.476 1.000 35.584 ? 192 HIS LLL O    1 
ATOM   6116 C  CB   . HIS C 3 192 ? 18.527  64.397 30.292 1.000 35.302 ? 192 HIS LLL CB   1 
ATOM   6117 C  CG   . HIS C 3 192 ? 18.273  63.308 31.287 1.000 35.208 ? 192 HIS LLL CG   1 
ATOM   6118 N  ND1  . HIS C 3 192 ? 17.016  62.783 31.505 1.000 35.241 ? 192 HIS LLL ND1  1 
ATOM   6119 C  CD2  . HIS C 3 192 ? 19.094  62.642 32.123 1.000 35.397 ? 192 HIS LLL CD2  1 
ATOM   6120 C  CE1  . HIS C 3 192 ? 17.076  61.846 32.427 1.000 35.649 ? 192 HIS LLL CE1  1 
ATOM   6121 N  NE2  . HIS C 3 192 ? 18.338  61.743 32.821 1.000 35.857 ? 192 HIS LLL NE2  1 
ATOM   6122 H  H    . HIS C 3 192 ? 16.471  65.681 31.117 1.000 37.306 ? 192 HIS LLL H    1 
ATOM   6123 H  HA   . HIS C 3 192 ? 19.182  65.889 31.559 1.000 37.177 ? 192 HIS LLL HA   1 
ATOM   6124 H  HB2  . HIS C 3 192 ? 17.860  64.327 29.574 1.000 34.804 ? 192 HIS LLL HB2  1 
ATOM   6125 H  HB3  . HIS C 3 192 ? 19.412  64.258 29.890 1.000 35.026 ? 192 HIS LLL HB3  1 
ATOM   6126 H  HD1  . HIS C 3 192 ? 16.378  62.880 31.078 0.000 30.000 ? 192 HIS LLL HD1  1 
ATOM   6127 H  HD2  . HIS C 3 192 ? 20.019  62.759 32.206 1.000 35.609 ? 192 HIS LLL HD2  1 
ATOM   6128 H  HE1  . HIS C 3 192 ? 16.350  61.343 32.752 1.000 36.051 ? 192 HIS LLL HE1  1 
ATOM   6129 H  HE2  . HIS C 3 192 ? 18.768  61.317 33.548 0.000 30.000 ? 192 HIS LLL HE2  1 
ATOM   6130 N  N    . SER C 3 193 ? 19.941  67.175 29.485 1.000 36.720 ? 193 SER LLL N    1 
ATOM   6131 C  CA   . SER C 3 193 ? 20.440  68.370 28.756 1.000 36.705 ? 193 SER LLL CA   1 
ATOM   6132 C  C    . SER C 3 193 ? 20.694  68.033 27.285 1.000 36.335 ? 193 SER LLL C    1 
ATOM   6133 O  O    . SER C 3 193 ? 20.276  68.840 26.434 1.000 36.677 ? 193 SER LLL O    1 
ATOM   6134 C  CB   . SER C 3 193 ? 21.689  68.923 29.404 1.000 37.355 ? 193 SER LLL CB   1 
ATOM   6135 O  OG   . SER C 3 193 ? 21.498  69.170 30.791 1.000 38.186 ? 193 SER LLL OG   1 
ATOM   6136 H  H    . SER C 3 193 ? 20.610  66.586 29.662 1.000 36.767 ? 193 SER LLL H    1 
ATOM   6137 H  HA   . SER C 3 193 ? 19.734  69.070 28.795 1.000 36.806 ? 193 SER LLL HA   1 
ATOM   6138 H  HB2  . SER C 3 193 ? 22.426  68.281 29.286 1.000 37.321 ? 193 SER LLL HB2  1 
ATOM   6139 H  HB3  . SER C 3 193 ? 21.942  69.761 28.956 1.000 37.300 ? 193 SER LLL HB3  1 
ATOM   6140 H  HG   . SER C 3 193 ? 22.247  69.388 31.153 0.000 30.000 ? 193 SER LLL HG   1 
ATOM   6141 N  N    . SER C 3 194 ? 21.345  66.899 27.001 1.000 36.450 ? 194 SER LLL N    1 
ATOM   6142 C  CA   . SER C 3 194 ? 21.893  66.552 25.662 1.000 36.733 ? 194 SER LLL CA   1 
ATOM   6143 C  C    . SER C 3 194 ? 21.485  65.142 25.217 1.000 35.994 ? 194 SER LLL C    1 
ATOM   6144 O  O    . SER C 3 194 ? 21.675  64.181 25.987 1.000 35.752 ? 194 SER LLL O    1 
ATOM   6145 C  CB   . SER C 3 194 ? 23.387  66.705 25.646 1.000 37.874 ? 194 SER LLL CB   1 
ATOM   6146 O  OG   . SER C 3 194 ? 23.728  68.059 25.400 1.000 39.753 ? 194 SER LLL OG   1 
ATOM   6147 H  H    . SER C 3 194 ? 21.506  66.248 27.617 1.000 36.814 ? 194 SER LLL H    1 
ATOM   6148 H  HA   . SER C 3 194 ? 21.514  67.196 25.008 1.000 36.432 ? 194 SER LLL HA   1 
ATOM   6149 H  HB2  . SER C 3 194 ? 23.757  66.421 26.512 1.000 38.523 ? 194 SER LLL HB2  1 
ATOM   6150 H  HB3  . SER C 3 194 ? 23.771  66.134 24.942 1.000 37.749 ? 194 SER LLL HB3  1 
ATOM   6151 H  HG   . SER C 3 194 ? 24.470  68.031 25.205 0.000 30.000 ? 194 SER LLL HG   1 
ATOM   6152 N  N    . TYR C 3 195 ? 21.005  65.033 23.980 1.000 35.385 ? 195 TYR LLL N    1 
ATOM   6153 C  CA   . TYR C 3 195 ? 20.467  63.789 23.382 1.000 35.290 ? 195 TYR LLL CA   1 
ATOM   6154 C  C    . TYR C 3 195 ? 21.220  63.499 22.084 1.000 35.117 ? 195 TYR LLL C    1 
ATOM   6155 O  O    . TYR C 3 195 ? 21.288  64.373 21.210 1.000 34.015 ? 195 TYR LLL O    1 
ATOM   6156 C  CB   . TYR C 3 195 ? 18.961  63.927 23.156 1.000 35.136 ? 195 TYR LLL CB   1 
ATOM   6157 C  CG   . TYR C 3 195 ? 18.190  64.244 24.409 1.000 35.771 ? 195 TYR LLL CG   1 
ATOM   6158 C  CD1  . TYR C 3 195 ? 18.115  65.539 24.896 1.000 36.574 ? 195 TYR LLL CD1  1 
ATOM   6159 C  CD2  . TYR C 3 195 ? 17.557  63.246 25.128 1.000 36.338 ? 195 TYR LLL CD2  1 
ATOM   6160 C  CE1  . TYR C 3 195 ? 17.415  65.836 26.055 1.000 37.303 ? 195 TYR LLL CE1  1 
ATOM   6161 C  CE2  . TYR C 3 195 ? 16.854  63.524 26.289 1.000 37.078 ? 195 TYR LLL CE2  1 
ATOM   6162 C  CZ   . TYR C 3 195 ? 16.781  64.824 26.756 1.000 37.603 ? 195 TYR LLL CZ   1 
ATOM   6163 O  OH   . TYR C 3 195 ? 16.090  65.102 27.901 1.000 38.198 ? 195 TYR LLL OH   1 
ATOM   6164 H  H    . TYR C 3 195 ? 20.974  65.734 23.398 1.000 35.405 ? 195 TYR LLL H    1 
ATOM   6165 H  HA   . TYR C 3 195 ? 20.624  63.040 24.011 1.000 35.382 ? 195 TYR LLL HA   1 
ATOM   6166 H  HB2  . TYR C 3 195 ? 18.808  64.638 22.499 1.000 35.067 ? 195 TYR LLL HB2  1 
ATOM   6167 H  HB3  . TYR C 3 195 ? 18.624  63.089 22.777 1.000 34.920 ? 195 TYR LLL HB3  1 
ATOM   6168 H  HD1  . TYR C 3 195 ? 18.543  66.235 24.425 1.000 36.443 ? 195 TYR LLL HD1  1 
ATOM   6169 H  HD2  . TYR C 3 195 ? 17.598  62.357 24.817 1.000 36.044 ? 195 TYR LLL HD2  1 
ATOM   6170 H  HE1  . TYR C 3 195 ? 17.371  66.725 26.367 1.000 37.542 ? 195 TYR LLL HE1  1 
ATOM   6171 H  HE2  . TYR C 3 195 ? 16.424  62.829 26.760 1.000 37.287 ? 195 TYR LLL HE2  1 
ATOM   6172 H  HH   . TYR C 3 195 ? 15.494  65.596 27.711 0.000 30.000 ? 195 TYR LLL HH   1 
ATOM   6173 N  N    . SER C 3 196 ? 21.777  62.294 21.983 1.000 36.013 ? 196 SER LLL N    1 
ATOM   6174 C  CA   . SER C 3 196 ? 22.504  61.803 20.790 1.000 36.154 ? 196 SER LLL CA   1 
ATOM   6175 C  C    . SER C 3 196 ? 21.747  60.632 20.157 1.000 35.821 ? 196 SER LLL C    1 
ATOM   6176 O  O    . SER C 3 196 ? 21.216  59.785 20.892 1.000 35.439 ? 196 SER LLL O    1 
ATOM   6177 C  CB   . SER C 3 196 ? 23.908  61.425 21.142 1.000 36.649 ? 196 SER LLL CB   1 
ATOM   6178 O  OG   . SER C 3 196 ? 24.804  61.917 20.159 1.000 37.566 ? 196 SER LLL OG   1 
ATOM   6179 H  H    . SER C 3 196 ? 21.752  61.674 22.650 1.000 35.938 ? 196 SER LLL H    1 
ATOM   6180 H  HA   . SER C 3 196 ? 22.538  62.543 20.125 1.000 36.154 ? 196 SER LLL HA   1 
ATOM   6181 H  HB2  . SER C 3 196 ? 24.141  61.802 22.021 1.000 37.148 ? 196 SER LLL HB2  1 
ATOM   6182 H  HB3  . SER C 3 196 ? 23.983  60.446 21.196 1.000 36.652 ? 196 SER LLL HB3  1 
ATOM   6183 H  HG   . SER C 3 196 ? 25.632  61.738 20.334 0.000 30.000 ? 196 SER LLL HG   1 
ATOM   6184 N  N    . CYS C 3 197 ? 21.691  60.621 18.829 1.000 36.398 ? 197 CYS LLL N    1 
ATOM   6185 C  CA   . CYS C 3 197 ? 21.328  59.454 17.989 1.000 37.013 ? 197 CYS LLL CA   1 
ATOM   6186 C  C    . CYS C 3 197 ? 22.566  59.060 17.180 1.000 36.810 ? 197 CYS LLL C    1 
ATOM   6187 O  O    . CYS C 3 197 ? 22.957  59.852 16.313 1.000 37.038 ? 197 CYS LLL O    1 
ATOM   6188 C  CB   . CYS C 3 197 ? 20.170  59.802 17.063 1.000 37.611 ? 197 CYS LLL CB   1 
ATOM   6189 S  SG   . CYS C 3 197 ? 19.675  58.433 15.985 1.000 39.448 ? 197 CYS LLL SG   1 
ATOM   6190 H  H    . CYS C 3 197 ? 21.877  61.356 18.324 1.000 36.534 ? 197 CYS LLL H    1 
ATOM   6191 H  HA   . CYS C 3 197 ? 21.064  58.707 18.574 1.000 36.818 ? 197 CYS LLL HA   1 
ATOM   6192 H  HB2  . CYS C 3 197 ? 19.397  60.068 17.603 1.000 37.944 ? 197 CYS LLL HB2  1 
ATOM   6193 H  HB3  . CYS C 3 197 ? 20.422  60.564 16.504 1.000 38.054 ? 197 CYS LLL HB3  1 
ATOM   6194 N  N    . GLN C 3 198 ? 23.167  57.908 17.489 1.000 36.813 ? 198 GLN LLL N    1 
ATOM   6195 C  CA   . GLN C 3 198 ? 24.334  57.326 16.770 1.000 37.194 ? 198 GLN LLL CA   1 
ATOM   6196 C  C    . GLN C 3 198 ? 23.855  56.219 15.828 1.000 35.941 ? 198 GLN LLL C    1 
ATOM   6197 O  O    . GLN C 3 198 ? 23.293  55.231 16.319 1.000 35.700 ? 198 GLN LLL O    1 
ATOM   6198 C  CB   . GLN C 3 198 ? 25.338  56.750 17.769 1.000 38.732 ? 198 GLN LLL CB   1 
ATOM   6199 C  CG   . GLN C 3 198 ? 26.075  57.819 18.562 1.000 40.826 ? 198 GLN LLL CG   1 
ATOM   6200 C  CD   . GLN C 3 198 ? 26.664  57.289 19.846 1.000 42.201 ? 198 GLN LLL CD   1 
ATOM   6201 O  OE1  . GLN C 3 198 ? 25.999  56.587 20.607 1.000 43.584 ? 198 GLN LLL OE1  1 
ATOM   6202 N  NE2  . GLN C 3 198 ? 27.917  57.635 20.100 1.000 42.652 ? 198 GLN LLL NE2  1 
ATOM   6203 H  H    . GLN C 3 198 ? 22.884  57.390 18.184 1.000 36.776 ? 198 GLN LLL H    1 
ATOM   6204 H  HA   . GLN C 3 198 ? 24.771  58.035 16.244 1.000 37.453 ? 198 GLN LLL HA   1 
ATOM   6205 H  HB2  . GLN C 3 198 ? 24.860  56.159 18.386 1.000 38.612 ? 198 GLN LLL HB2  1 
ATOM   6206 H  HB3  . GLN C 3 198 ? 25.990  56.208 17.278 1.000 38.858 ? 198 GLN LLL HB3  1 
ATOM   6207 H  HG2  . GLN C 3 198 ? 26.796  58.189 18.009 1.000 41.002 ? 198 GLN LLL HG2  1 
ATOM   6208 H  HG3  . GLN C 3 198 ? 25.455  58.549 18.773 1.000 40.661 ? 198 GLN LLL HG3  1 
ATOM   6209 H  HE21 . GLN C 3 198 ? 28.121  57.423 20.944 0.000 30.000 ? 198 GLN LLL HE21 1 
ATOM   6210 H  HE22 . GLN C 3 198 ? 28.246  58.186 19.623 0.000 30.000 ? 198 GLN LLL HE22 1 
ATOM   6211 N  N    . VAL C 3 199 ? 24.074  56.380 14.525 1.000 35.226 ? 199 VAL LLL N    1 
ATOM   6212 C  CA   . VAL C 3 199 ? 23.659  55.393 13.488 1.000 34.828 ? 199 VAL LLL CA   1 
ATOM   6213 C  C    . VAL C 3 199 ? 24.925  54.796 12.876 1.000 35.165 ? 199 VAL LLL C    1 
ATOM   6214 O  O    . VAL C 3 199 ? 25.648  55.542 12.180 1.000 35.816 ? 199 VAL LLL O    1 
ATOM   6215 C  CB   . VAL C 3 199 ? 22.769  56.047 12.413 1.000 34.855 ? 199 VAL LLL CB   1 
ATOM   6216 C  CG1  . VAL C 3 199 ? 22.302  55.037 11.375 1.000 34.744 ? 199 VAL LLL CG1  1 
ATOM   6217 C  CG2  . VAL C 3 199 ? 21.577  56.765 13.027 1.000 34.742 ? 199 VAL LLL CG2  1 
ATOM   6218 H  H    . VAL C 3 199 ? 24.496  57.111 14.183 1.000 35.649 ? 199 VAL LLL H    1 
ATOM   6219 H  HA   . VAL C 3 199 ? 23.154  54.681 13.918 1.000 34.608 ? 199 VAL LLL HA   1 
ATOM   6220 H  HB   . VAL C 3 199 ? 23.318  56.724 11.947 1.000 35.192 ? 199 VAL LLL HB   1 
ATOM   6221 H  HG11 . VAL C 3 199 ? 23.051  54.780 10.810 1.000 35.023 ? 199 VAL LLL HG11 1 
ATOM   6222 H  HG12 . VAL C 3 199 ? 21.605  55.435 10.824 1.000 34.930 ? 199 VAL LLL HG12 1 
ATOM   6223 H  HG13 . VAL C 3 199 ? 21.949  54.250 11.824 1.000 34.519 ? 199 VAL LLL HG13 1 
ATOM   6224 H  HG21 . VAL C 3 199 ? 21.100  56.157 13.617 1.000 34.497 ? 199 VAL LLL HG21 1 
ATOM   6225 H  HG22 . VAL C 3 199 ? 20.979  57.067 12.321 1.000 34.865 ? 199 VAL LLL HG22 1 
ATOM   6226 H  HG23 . VAL C 3 199 ? 21.888  57.534 13.537 1.000 34.802 ? 199 VAL LLL HG23 1 
ATOM   6227 N  N    . THR C 3 200 ? 25.173  53.505 13.117 1.000 35.037 ? 200 THR LLL N    1 
ATOM   6228 C  CA   . THR C 3 200 ? 26.365  52.766 12.614 1.000 35.693 ? 200 THR LLL CA   1 
ATOM   6229 C  C    . THR C 3 200 ? 25.994  52.005 11.336 1.000 35.592 ? 200 THR LLL C    1 
ATOM   6230 O  O    . THR C 3 200 ? 24.988  51.284 11.346 1.000 34.140 ? 200 THR LLL O    1 
ATOM   6231 C  CB   . THR C 3 200 ? 26.947  51.864 13.706 1.000 35.496 ? 200 THR LLL CB   1 
ATOM   6232 O  OG1  . THR C 3 200 ? 27.112  52.715 14.840 1.000 36.610 ? 200 THR LLL OG1  1 
ATOM   6233 C  CG2  . THR C 3 200 ? 28.263  51.224 13.320 1.000 35.548 ? 200 THR LLL CG2  1 
ATOM   6234 H  H    . THR C 3 200 ? 24.621  52.978 13.614 1.000 34.811 ? 200 THR LLL H    1 
ATOM   6235 H  HA   . THR C 3 200 ? 27.048  53.434 12.381 1.000 36.014 ? 200 THR LLL HA   1 
ATOM   6236 H  HB   . THR C 3 200 ? 26.292  51.159 13.918 1.000 35.288 ? 200 THR LLL HB   1 
ATOM   6237 H  HG1  . THR C 3 200 ? 27.336  52.477 15.484 0.000 30.000 ? 200 THR LLL HG1  1 
ATOM   6238 H  HG21 . THR C 3 200 ? 28.108  50.541 12.644 1.000 35.607 ? 200 THR LLL HG21 1 
ATOM   6239 H  HG22 . THR C 3 200 ? 28.669  50.816 14.105 1.000 35.642 ? 200 THR LLL HG22 1 
ATOM   6240 H  HG23 . THR C 3 200 ? 28.863  51.903 12.962 1.000 36.097 ? 200 THR LLL HG23 1 
ATOM   6241 N  N    . HIS C 3 201 ? 26.792  52.182 10.282 1.000 37.051 ? 201 HIS LLL N    1 
ATOM   6242 C  CA   . HIS C 3 201 ? 26.558  51.620 8.930  1.000 38.479 ? 201 HIS LLL CA   1 
ATOM   6243 C  C    . HIS C 3 201 ? 27.889  51.215 8.294  1.000 41.268 ? 201 HIS LLL C    1 
ATOM   6244 O  O    . HIS C 3 201 ? 28.706  52.122 7.984  1.000 42.150 ? 201 HIS LLL O    1 
ATOM   6245 C  CB   . HIS C 3 201 ? 25.814  52.618 8.042  1.000 38.440 ? 201 HIS LLL CB   1 
ATOM   6246 C  CG   . HIS C 3 201 ? 25.524  52.059 6.694  1.000 38.521 ? 201 HIS LLL CG   1 
ATOM   6247 N  ND1  . HIS C 3 201 ? 26.400  52.202 5.639  1.000 39.264 ? 201 HIS LLL ND1  1 
ATOM   6248 C  CD2  . HIS C 3 201 ? 24.491  51.318 6.242  1.000 38.278 ? 201 HIS LLL CD2  1 
ATOM   6249 C  CE1  . HIS C 3 201 ? 25.908  51.591 4.581  1.000 39.763 ? 201 HIS LLL CE1  1 
ATOM   6250 N  NE2  . HIS C 3 201 ? 24.735  51.040 4.925  1.000 39.145 ? 201 HIS LLL NE2  1 
ATOM   6251 H  H    . HIS C 3 201 ? 27.557  52.676 10.320 1.000 37.456 ? 201 HIS LLL H    1 
ATOM   6252 H  HA   . HIS C 3 201 ? 26.002  50.811 9.026  1.000 38.257 ? 201 HIS LLL HA   1 
ATOM   6253 H  HB2  . HIS C 3 201 ? 24.969  52.868 8.476  1.000 38.074 ? 201 HIS LLL HB2  1 
ATOM   6254 H  HB3  . HIS C 3 201 ? 26.358  53.431 7.945  1.000 38.811 ? 201 HIS LLL HB3  1 
ATOM   6255 H  HD1  . HIS C 3 201 ? 27.146  52.646 5.723  0.000 30.000 ? 201 HIS LLL HD1  1 
ATOM   6256 H  HD2  . HIS C 3 201 ? 23.737  51.052 6.732  1.000 37.889 ? 201 HIS LLL HD2  1 
ATOM   6257 H  HE1  . HIS C 3 201 ? 26.310  51.552 3.730  1.000 40.403 ? 201 HIS LLL HE1  1 
ATOM   6258 H  HE2  . HIS C 3 201 ? 24.157  50.593 4.509  0.000 30.000 ? 201 HIS LLL HE2  1 
ATOM   6259 N  N    . GLU C 3 202 ? 28.065  49.905 8.079  1.000 43.582 ? 202 GLU LLL N    1 
ATOM   6260 C  CA   . GLU C 3 202 ? 29.297  49.281 7.525  1.000 45.514 ? 202 GLU LLL CA   1 
ATOM   6261 C  C    . GLU C 3 202 ? 30.484  49.785 8.356  1.000 47.019 ? 202 GLU LLL C    1 
ATOM   6262 O  O    . GLU C 3 202 ? 31.446  50.339 7.772  1.000 47.525 ? 202 GLU LLL O    1 
ATOM   6263 C  CB   . GLU C 3 202 ? 29.400  49.566 6.022  1.000 46.605 ? 202 GLU LLL CB   1 
ATOM   6264 C  CG   . GLU C 3 202 ? 28.209  49.047 5.219  1.000 46.914 ? 202 GLU LLL CG   1 
ATOM   6265 C  CD   . GLU C 3 202 ? 27.935  47.545 5.280  1.000 47.121 ? 202 GLU LLL CD   1 
ATOM   6266 O  OE1  . GLU C 3 202 ? 28.831  46.762 4.905  1.000 49.073 ? 202 GLU LLL OE1  1 
ATOM   6267 O  OE2  . GLU C 3 202 ? 26.817  47.152 5.690  1.000 45.653 ? 202 GLU LLL OE2  1 
ATOM   6268 H  H    . GLU C 3 202 ? 27.414  49.295 8.266  1.000 42.860 ? 202 GLU LLL H    1 
ATOM   6269 H  HA   . GLU C 3 202 ? 29.226  48.307 7.652  1.000 45.264 ? 202 GLU LLL HA   1 
ATOM   6270 H  HB2  . GLU C 3 202 ? 29.475  50.534 5.892  1.000 46.968 ? 202 GLU LLL HB2  1 
ATOM   6271 H  HB3  . GLU C 3 202 ? 30.219  49.151 5.680  1.000 47.138 ? 202 GLU LLL HB3  1 
ATOM   6272 H  HG2  . GLU C 3 202 ? 27.403  49.512 5.527  1.000 46.562 ? 202 GLU LLL HG2  1 
ATOM   6273 H  HG3  . GLU C 3 202 ? 28.340  49.291 4.278  1.000 47.630 ? 202 GLU LLL HG3  1 
ATOM   6274 N  N    . GLY C 3 203 ? 30.359  49.651 9.685  1.000 47.456 ? 203 GLY LLL N    1 
ATOM   6275 C  CA   . GLY C 3 203 ? 31.403  49.945 10.686 1.000 48.127 ? 203 GLY LLL CA   1 
ATOM   6276 C  C    . GLY C 3 203 ? 31.756  51.420 10.807 1.000 49.092 ? 203 GLY LLL C    1 
ATOM   6277 O  O    . GLY C 3 203 ? 32.758  51.701 11.487 1.000 51.246 ? 203 GLY LLL O    1 
ATOM   6278 H  H    . GLY C 3 203 ? 29.586  49.351 10.060 1.000 46.750 ? 203 GLY LLL H    1 
ATOM   6279 H  HA2  . GLY C 3 203 ? 31.096  49.615 11.567 1.000 47.670 ? 203 GLY LLL HA2  1 
ATOM   6280 H  HA3  . GLY C 3 203 ? 32.220  49.438 10.447 1.000 48.563 ? 203 GLY LLL HA3  1 
ATOM   6281 N  N    . HIS C 3 204 ? 30.996  52.336 10.192 1.000 49.400 ? 204 HIS LLL N    1 
ATOM   6282 C  CA   . HIS C 3 204 ? 31.181  53.808 10.338 1.000 49.673 ? 204 HIS LLL CA   1 
ATOM   6283 C  C    . HIS C 3 204 ? 29.957  54.413 11.039 1.000 46.252 ? 204 HIS LLL C    1 
ATOM   6284 O  O    . HIS C 3 204 ? 28.830  54.197 10.554 1.000 43.995 ? 204 HIS LLL O    1 
ATOM   6285 C  CB   . HIS C 3 204 ? 31.508  54.464 8.987  1.000 52.929 ? 204 HIS LLL CB   1 
ATOM   6286 C  CG   . HIS C 3 204 ? 32.883  54.151 8.481  1.000 57.131 ? 204 HIS LLL CG   1 
ATOM   6287 N  ND1  . HIS C 3 204 ? 33.923  53.775 9.322  1.000 58.966 ? 204 HIS LLL ND1  1 
ATOM   6288 C  CD2  . HIS C 3 204 ? 33.403  54.168 7.231  1.000 59.605 ? 204 HIS LLL CD2  1 
ATOM   6289 C  CE1  . HIS C 3 204 ? 35.013  53.561 8.609  1.000 60.227 ? 204 HIS LLL CE1  1 
ATOM   6290 N  NE2  . HIS C 3 204 ? 34.721  53.799 7.322  1.000 60.710 ? 204 HIS LLL NE2  1 
ATOM   6291 H  H    . HIS C 3 204 ? 30.300  52.128 9.646  1.000 49.056 ? 204 HIS LLL H    1 
ATOM   6292 H  HA   . HIS C 3 204 ? 31.956  53.950 10.930 1.000 49.919 ? 204 HIS LLL HA   1 
ATOM   6293 H  HB2  . HIS C 3 204 ? 30.850  54.165 8.321  1.000 52.910 ? 204 HIS LLL HB2  1 
ATOM   6294 H  HB3  . HIS C 3 204 ? 31.419  55.439 9.077  1.000 53.246 ? 204 HIS LLL HB3  1 
ATOM   6295 H  HD1  . HIS C 3 204 ? 33.855  53.586 10.180 0.000 30.000 ? 204 HIS LLL HD1  1 
ATOM   6296 H  HD2  . HIS C 3 204 ? 32.946  54.386 6.441  1.000 59.453 ? 204 HIS LLL HD2  1 
ATOM   6297 H  HE1  . HIS C 3 204 ? 35.851  53.296 8.948  1.000 60.533 ? 204 HIS LLL HE1  1 
ATOM   6298 H  HE2  . HIS C 3 204 ? 35.423  53.801 6.705  0.000 30.000 ? 204 HIS LLL HE2  1 
ATOM   6299 N  N    . THR C 3 205 ? 30.183  55.120 12.154 1.000 44.660 ? 205 THR LLL N    1 
ATOM   6300 C  CA   . THR C 3 205 ? 29.139  55.795 12.973 1.000 43.562 ? 205 THR LLL CA   1 
ATOM   6301 C  C    . THR C 3 205 ? 29.018  57.269 12.584 1.000 42.501 ? 205 THR LLL C    1 
ATOM   6302 O  O    . THR C 3 205 ? 30.021  57.982 12.663 1.000 43.662 ? 205 THR LLL O    1 
ATOM   6303 C  CB   . THR C 3 205 ? 29.431  55.728 14.475 1.000 43.591 ? 205 THR LLL CB   1 
ATOM   6304 O  OG1  . THR C 3 205 ? 29.505  54.356 14.869 1.000 43.508 ? 205 THR LLL OG1  1 
ATOM   6305 C  CG2  . THR C 3 205 ? 28.377  56.444 15.293 1.000 43.006 ? 205 THR LLL CG2  1 
ATOM   6306 H  H    . THR C 3 205 ? 31.019  55.241 12.498 1.000 45.323 ? 205 THR LLL H    1 
ATOM   6307 H  HA   . THR C 3 205 ? 28.278  55.350 12.801 1.000 42.930 ? 205 THR LLL HA   1 
ATOM   6308 H  HB   . THR C 3 205 ? 30.306  56.155 14.640 1.000 44.108 ? 205 THR LLL HB   1 
ATOM   6309 H  HG1  . THR C 3 205 ? 29.595  54.449 15.753 0.000 30.000 ? 205 THR LLL HG1  1 
ATOM   6310 H  HG21 . THR C 3 205 ? 28.611  57.386 15.375 1.000 43.372 ? 205 THR LLL HG21 1 
ATOM   6311 H  HG22 . THR C 3 205 ? 28.326  56.045 16.180 1.000 42.910 ? 205 THR LLL HG22 1 
ATOM   6312 H  HG23 . THR C 3 205 ? 27.511  56.363 14.853 1.000 42.716 ? 205 THR LLL HG23 1 
ATOM   6313 N  N    . VAL C 3 206 ? 27.815  57.687 12.197 1.000 41.652 ? 206 VAL LLL N    1 
ATOM   6314 C  CA   . VAL C 3 206 ? 27.409  59.114 12.034 1.000 42.266 ? 206 VAL LLL CA   1 
ATOM   6315 C  C    . VAL C 3 206 ? 26.389  59.409 13.139 1.000 41.808 ? 206 VAL LLL C    1 
ATOM   6316 O  O    . VAL C 3 206 ? 25.403  58.650 13.249 1.000 42.080 ? 206 VAL LLL O    1 
ATOM   6317 C  CB   . VAL C 3 206 ? 26.851  59.408 10.625 1.000 42.485 ? 206 VAL LLL CB   1 
ATOM   6318 C  CG1  . VAL C 3 206 ? 26.174  58.198 10.003 1.000 42.564 ? 206 VAL LLL CG1  1 
ATOM   6319 C  CG2  . VAL C 3 206 ? 25.907  60.604 10.612 1.000 42.453 ? 206 VAL LLL CG2  1 
ATOM   6320 H  H    . VAL C 3 206 ? 27.136  57.104 12.035 1.000 41.502 ? 206 VAL LLL H    1 
ATOM   6321 H  HA   . VAL C 3 206 ? 28.192  59.675 12.179 1.000 42.671 ? 206 VAL LLL HA   1 
ATOM   6322 H  HB   . VAL C 3 206 ? 27.624  59.638 10.053 1.000 43.173 ? 206 VAL LLL HB   1 
ATOM   6323 H  HG11 . VAL C 3 206 ? 26.845  57.534 9.768  1.000 42.627 ? 206 VAL LLL HG11 1 
ATOM   6324 H  HG12 . VAL C 3 206 ? 25.696  58.471 9.201  1.000 42.644 ? 206 VAL LLL HG12 1 
ATOM   6325 H  HG13 . VAL C 3 206 ? 25.545  57.814 10.638 1.000 41.921 ? 206 VAL LLL HG13 1 
ATOM   6326 H  HG21 . VAL C 3 206 ? 25.035  60.335 10.949 1.000 41.967 ? 206 VAL LLL HG21 1 
ATOM   6327 H  HG22 . VAL C 3 206 ? 25.813  60.931 9.701  1.000 42.824 ? 206 VAL LLL HG22 1 
ATOM   6328 H  HG23 . VAL C 3 206 ? 26.269  61.312 11.173 1.000 42.581 ? 206 VAL LLL HG23 1 
ATOM   6329 N  N    . GLU C 3 207 ? 26.624  60.448 13.944 1.000 41.772 ? 207 GLU LLL N    1 
ATOM   6330 C  CA   . GLU C 3 207 ? 25.730  60.792 15.079 1.000 41.651 ? 207 GLU LLL CA   1 
ATOM   6331 C  C    . GLU C 3 207 ? 25.197  62.218 14.912 1.000 40.201 ? 207 GLU LLL C    1 
ATOM   6332 O  O    . GLU C 3 207 ? 25.978  63.108 14.584 1.000 40.893 ? 207 GLU LLL O    1 
ATOM   6333 C  CB   . GLU C 3 207 ? 26.453  60.575 16.410 1.000 43.040 ? 207 GLU LLL CB   1 
ATOM   6334 C  CG   . GLU C 3 207 ? 26.884  61.848 17.118 1.000 44.554 ? 207 GLU LLL CG   1 
ATOM   6335 C  CD   . GLU C 3 207 ? 27.416  61.607 18.521 1.000 46.002 ? 207 GLU LLL CD   1 
ATOM   6336 O  OE1  . GLU C 3 207 ? 27.906  60.485 18.796 1.000 46.127 ? 207 GLU LLL OE1  1 
ATOM   6337 O  OE2  . GLU C 3 207 ? 27.321  62.539 19.343 1.000 48.126 ? 207 GLU LLL OE2  1 
ATOM   6338 H  H    . GLU C 3 207 ? 27.340  61.003 13.847 1.000 42.352 ? 207 GLU LLL H    1 
ATOM   6339 H  HA   . GLU C 3 207 ? 24.964  60.179 15.049 1.000 41.114 ? 207 GLU LLL HA   1 
ATOM   6340 H  HB2  . GLU C 3 207 ? 25.858  60.075 17.003 1.000 42.638 ? 207 GLU LLL HB2  1 
ATOM   6341 H  HB3  . GLU C 3 207 ? 27.245  60.022 16.246 1.000 43.188 ? 207 GLU LLL HB3  1 
ATOM   6342 H  HG2  . GLU C 3 207 ? 27.582  62.291 16.590 1.000 45.002 ? 207 GLU LLL HG2  1 
ATOM   6343 H  HG3  . GLU C 3 207 ? 26.121  62.460 17.179 1.000 44.406 ? 207 GLU LLL HG3  1 
ATOM   6344 N  N    . LYS C 3 208 ? 23.899  62.403 15.146 1.000 38.942 ? 208 LYS LLL N    1 
ATOM   6345 C  CA   . LYS C 3 208 ? 23.255  63.734 15.271 1.000 38.936 ? 208 LYS LLL CA   1 
ATOM   6346 C  C    . LYS C 3 208 ? 22.897  63.951 16.744 1.000 37.482 ? 208 LYS LLL C    1 
ATOM   6347 O  O    . LYS C 3 208 ? 22.552  62.966 17.410 1.000 37.219 ? 208 LYS LLL O    1 
ATOM   6348 C  CB   . LYS C 3 208 ? 22.063  63.812 14.313 1.000 39.278 ? 208 LYS LLL CB   1 
ATOM   6349 C  CG   . LYS C 3 208 ? 22.433  63.765 12.835 1.000 40.080 ? 208 LYS LLL CG   1 
ATOM   6350 C  CD   . LYS C 3 208 ? 23.626  64.644 12.473 1.000 41.084 ? 208 LYS LLL CD   1 
ATOM   6351 C  CE   . LYS C 3 208 ? 23.854  64.772 10.982 1.000 41.923 ? 208 LYS LLL CE   1 
ATOM   6352 N  NZ   . LYS C 3 208 ? 22.696  65.404 10.310 1.000 42.454 ? 208 LYS LLL NZ   1 
ATOM   6353 H  H    . LYS C 3 208 ? 23.317  61.709 15.244 1.000 38.820 ? 208 LYS LLL H    1 
ATOM   6354 H  HA   . LYS C 3 208 ? 23.910  64.421 15.014 1.000 39.177 ? 208 LYS LLL HA   1 
ATOM   6355 H  HB2  . LYS C 3 208 ? 21.458  63.066 14.508 1.000 38.977 ? 208 LYS LLL HB2  1 
ATOM   6356 H  HB3  . LYS C 3 208 ? 21.577  64.645 14.487 1.000 39.332 ? 208 LYS LLL HB3  1 
ATOM   6357 H  HG2  . LYS C 3 208 ? 22.636  62.836 12.591 1.000 39.962 ? 208 LYS LLL HG2  1 
ATOM   6358 H  HG3  . LYS C 3 208 ? 21.656  64.049 12.309 1.000 40.077 ? 208 LYS LLL HG3  1 
ATOM   6359 H  HD2  . LYS C 3 208 ? 23.490  65.538 12.851 1.000 41.159 ? 208 LYS LLL HD2  1 
ATOM   6360 H  HD3  . LYS C 3 208 ? 24.435  64.267 12.878 1.000 41.128 ? 208 LYS LLL HD3  1 
ATOM   6361 H  HE2  . LYS C 3 208 ? 24.650  65.312 10.818 1.000 42.435 ? 208 LYS LLL HE2  1 
ATOM   6362 H  HE3  . LYS C 3 208 ? 24.002  63.888 10.596 1.000 41.920 ? 208 LYS LLL HE3  1 
ATOM   6363 H  HZ1  . LYS C 3 208 ? 22.080  64.773 10.099 1.000 42.082 ? 208 LYS LLL HZ1  1 
ATOM   6364 H  HZ2  . LYS C 3 208 ? 22.969  65.816 9.549  1.000 42.789 ? 208 LYS LLL HZ2  1 
ATOM   6365 H  HZ3  . LYS C 3 208 ? 22.316  66.019 10.859 1.000 42.174 ? 208 LYS LLL HZ3  1 
ATOM   6366 N  N    . SER C 3 209 ? 23.028  65.187 17.229 1.000 36.890 ? 209 SER LLL N    1 
ATOM   6367 C  CA   . SER C 3 209 ? 22.948  65.563 18.665 1.000 36.660 ? 209 SER LLL CA   1 
ATOM   6368 C  C    . SER C 3 209 ? 22.133  66.844 18.808 1.000 35.705 ? 209 SER LLL C    1 
ATOM   6369 O  O    . SER C 3 209 ? 22.013  67.557 17.818 1.000 36.121 ? 209 SER LLL O    1 
ATOM   6370 C  CB   . SER C 3 209 ? 24.319  65.748 19.241 1.000 37.751 ? 209 SER LLL CB   1 
ATOM   6371 O  OG   . SER C 3 209 ? 25.198  64.734 18.777 1.000 39.038 ? 209 SER LLL OG   1 
ATOM   6372 H  H    . SER C 3 209 ? 23.183  65.910 16.696 1.000 37.237 ? 209 SER LLL H    1 
ATOM   6373 H  HA   . SER C 3 209 ? 22.486  64.835 19.157 1.000 36.410 ? 209 SER LLL HA   1 
ATOM   6374 H  HB2  . SER C 3 209 ? 24.668  66.631 18.981 1.000 38.219 ? 209 SER LLL HB2  1 
ATOM   6375 H  HB3  . SER C 3 209 ? 24.268  65.716 20.223 1.000 38.017 ? 209 SER LLL HB3  1 
ATOM   6376 H  HG   . SER C 3 209 ? 25.946  64.979 18.978 0.000 30.000 ? 209 SER LLL HG   1 
ATOM   6377 N  N    . LEU C 3 210 ? 21.612  67.130 19.998 1.000 35.242 ? 210 LEU LLL N    1 
ATOM   6378 C  CA   . LEU C 3 210 ? 20.877  68.394 20.264 1.000 35.533 ? 210 LEU LLL CA   1 
ATOM   6379 C  C    . LEU C 3 210 ? 20.766  68.632 21.771 1.000 35.444 ? 210 LEU LLL C    1 
ATOM   6380 O  O    . LEU C 3 210 ? 20.961  67.668 22.533 1.000 35.413 ? 210 LEU LLL O    1 
ATOM   6381 C  CB   . LEU C 3 210 ? 19.500  68.339 19.588 1.000 35.554 ? 210 LEU LLL CB   1 
ATOM   6382 C  CG   . LEU C 3 210 ? 18.486  67.355 20.173 1.000 35.530 ? 210 LEU LLL CG   1 
ATOM   6383 C  CD1  . LEU C 3 210 ? 17.842  67.914 21.437 1.000 36.123 ? 210 LEU LLL CD1  1 
ATOM   6384 C  CD2  . LEU C 3 210 ? 17.415  67.007 19.148 1.000 34.945 ? 210 LEU LLL CD2  1 
ATOM   6385 H  H    . LEU C 3 210 ? 21.672  66.570 20.714 1.000 35.415 ? 210 LEU LLL H    1 
ATOM   6386 H  HA   . LEU C 3 210 ? 21.395  69.135 19.873 1.000 35.717 ? 210 LEU LLL HA   1 
ATOM   6387 H  HB2  . LEU C 3 210 ? 19.111  69.236 19.621 1.000 35.668 ? 210 LEU LLL HB2  1 
ATOM   6388 H  HB3  . LEU C 3 210 ? 19.633  68.118 18.645 1.000 35.395 ? 210 LEU LLL HB3  1 
ATOM   6389 H  HG   . LEU C 3 210 ? 18.965  66.524 20.412 1.000 35.402 ? 210 LEU LLL HG   1 
ATOM   6390 H  HD11 . LEU C 3 210 ? 18.271  67.525 22.219 1.000 36.183 ? 210 LEU LLL HD11 1 
ATOM   6391 H  HD12 . LEU C 3 210 ? 16.895  67.691 21.445 1.000 36.005 ? 210 LEU LLL HD12 1 
ATOM   6392 H  HD13 . LEU C 3 210 ? 17.945  68.881 21.458 1.000 36.226 ? 210 LEU LLL HD13 1 
ATOM   6393 H  HD21 . LEU C 3 210 ? 16.851  67.784 18.991 1.000 35.182 ? 210 LEU LLL HD21 1 
ATOM   6394 H  HD22 . LEU C 3 210 ? 16.870  66.275 19.485 1.000 34.985 ? 210 LEU LLL HD22 1 
ATOM   6395 H  HD23 . LEU C 3 210 ? 17.837  66.739 18.314 1.000 34.931 ? 210 LEU LLL HD23 1 
ATOM   6396 N  N    . SER C 3 211 ? 20.475  69.879 22.155 1.000 35.802 ? 211 SER LLL N    1 
ATOM   6397 C  CA   . SER C 3 211 ? 20.306  70.344 23.556 1.000 36.637 ? 211 SER LLL CA   1 
ATOM   6398 C  C    . SER C 3 211 ? 18.914  70.955 23.753 1.000 36.448 ? 211 SER LLL C    1 
ATOM   6399 O  O    . SER C 3 211 ? 18.381  71.541 22.789 1.000 36.704 ? 211 SER LLL O    1 
ATOM   6400 C  CB   . SER C 3 211 ? 21.393  71.304 23.923 1.000 37.708 ? 211 SER LLL CB   1 
ATOM   6401 O  OG   . SER C 3 211 ? 22.571  70.588 24.269 1.000 39.018 ? 211 SER LLL OG   1 
ATOM   6402 H  H    . SER C 3 211 ? 20.356  70.557 21.558 1.000 35.867 ? 211 SER LLL H    1 
ATOM   6403 H  HA   . SER C 3 211 ? 20.378  69.552 24.149 1.000 36.680 ? 211 SER LLL HA   1 
ATOM   6404 H  HB2  . SER C 3 211 ? 21.578  71.899 23.161 1.000 37.779 ? 211 SER LLL HB2  1 
ATOM   6405 H  HB3  . SER C 3 211 ? 21.105  71.856 24.685 1.000 38.174 ? 211 SER LLL HB3  1 
ATOM   6406 H  HG   . SER C 3 211 ? 23.150  71.080 24.443 0.000 30.000 ? 211 SER LLL HG   1 
ATOM   6407 N  N    . ARG C 3 212 ? 18.353  70.824 24.960 1.000 36.335 ? 212 ARG LLL N    1 
ATOM   6408 C  CA   . ARG C 3 212 ? 16.929  71.144 25.260 1.000 36.091 ? 212 ARG LLL CA   1 
ATOM   6409 C  C    . ARG C 3 212 ? 16.687  72.659 25.153 1.000 35.450 ? 212 ARG LLL C    1 
ATOM   6410 O  O    . ARG C 3 212 ? 17.472  73.475 25.623 1.000 34.990 ? 212 ARG LLL O    1 
ATOM   6411 C  CB   . ARG C 3 212 ? 16.554  70.593 26.640 1.000 36.715 ? 212 ARG LLL CB   1 
ATOM   6412 C  CG   . ARG C 3 212 ? 15.109  70.853 27.041 1.000 37.027 ? 212 ARG LLL CG   1 
ATOM   6413 C  CD   . ARG C 3 212 ? 14.657  70.049 28.247 1.000 37.497 ? 212 ARG LLL CD   1 
ATOM   6414 N  NE   . ARG C 3 212 ? 15.685  69.894 29.272 1.000 38.177 ? 212 ARG LLL NE   1 
ATOM   6415 C  CZ   . ARG C 3 212 ? 16.143  70.867 30.061 1.000 38.380 ? 212 ARG LLL CZ   1 
ATOM   6416 N  NH1  . ARG C 3 212 ? 15.681  72.099 29.944 1.000 38.408 ? 212 ARG LLL NH1  1 
ATOM   6417 N  NH2  . ARG C 3 212 ? 17.073  70.606 30.966 1.000 38.827 ? 212 ARG LLL NH2  1 
ATOM   6418 H  H    . ARG C 3 212 ? 18.821  70.526 25.683 1.000 36.657 ? 212 ARG LLL H    1 
ATOM   6419 H  HA   . ARG C 3 212 ? 16.369  70.695 24.585 1.000 35.658 ? 212 ARG LLL HA   1 
ATOM   6420 H  HB2  . ARG C 3 212 ? 16.715  69.627 26.645 1.000 36.539 ? 212 ARG LLL HB2  1 
ATOM   6421 H  HB3  . ARG C 3 212 ? 17.145  71.000 27.308 1.000 37.113 ? 212 ARG LLL HB3  1 
ATOM   6422 H  HG2  . ARG C 3 212 ? 14.997  71.806 27.238 1.000 37.262 ? 212 ARG LLL HG2  1 
ATOM   6423 H  HG3  . ARG C 3 212 ? 14.524  70.636 26.284 1.000 36.649 ? 212 ARG LLL HG3  1 
ATOM   6424 H  HD2  . ARG C 3 212 ? 13.875  70.486 28.645 1.000 37.982 ? 212 ARG LLL HD2  1 
ATOM   6425 H  HD3  . ARG C 3 212 ? 14.375  69.160 27.945 1.000 37.319 ? 212 ARG LLL HD3  1 
ATOM   6426 H  HE   . ARG C 3 212 ? 16.018  69.096 29.388 1.000 37.955 ? 212 ARG LLL HE   1 
ATOM   6427 H  HH11 . ARG C 3 212 ? 15.061  72.287 29.355 1.000 38.146 ? 212 ARG LLL HH11 1 
ATOM   6428 H  HH12 . ARG C 3 212 ? 15.991  72.732 30.469 1.000 38.912 ? 212 ARG LLL HH12 1 
ATOM   6429 H  HH21 . ARG C 3 212 ? 17.389  69.787 31.048 1.000 38.826 ? 212 ARG LLL HH21 1 
ATOM   6430 H  HH22 . ARG C 3 212 ? 17.378  71.251 31.483 1.000 39.383 ? 212 ARG LLL HH22 1 
HETATM 6431 C  C1   . NAG D 4 .   ? 10.755  5.252  18.934 1.000 48.329 ? 1   NAG A   C1   1 
HETATM 6432 C  C2   . NAG D 4 .   ? 10.408  3.773  18.949 1.000 50.673 ? 1   NAG A   C2   1 
HETATM 6433 C  C3   . NAG D 4 .   ? 10.095  3.317  20.371 1.000 51.318 ? 1   NAG A   C3   1 
HETATM 6434 C  C4   . NAG D 4 .   ? 11.134  3.817  21.373 1.000 51.914 ? 1   NAG A   C4   1 
HETATM 6435 C  C5   . NAG D 4 .   ? 11.507  5.289  21.145 1.000 50.470 ? 1   NAG A   C5   1 
HETATM 6436 C  C6   . NAG D 4 .   ? 12.646  5.805  22.027 1.000 49.992 ? 1   NAG A   C6   1 
HETATM 6437 C  C7   . NAG D 4 .   ? 9.333   2.809  16.966 1.000 53.114 ? 1   NAG A   C7   1 
HETATM 6438 C  C8   . NAG D 4 .   ? 8.069   2.790  16.155 1.000 53.361 ? 1   NAG A   C8   1 
HETATM 6439 N  N2   . NAG D 4 .   ? 9.279   3.562  18.064 1.000 52.064 ? 1   NAG A   N2   1 
HETATM 6440 O  O3   . NAG D 4 .   ? 10.128  1.897  20.418 1.000 51.903 ? 1   NAG A   O3   1 
HETATM 6441 O  O4   . NAG D 4 .   ? 10.623  3.627  22.695 1.000 54.392 ? 1   NAG A   O4   1 
HETATM 6442 O  O5   . NAG D 4 .   ? 11.880  5.462  19.780 1.000 48.839 ? 1   NAG A   O5   1 
HETATM 6443 O  O6   . NAG D 4 .   ? 13.757  4.905  22.050 1.000 50.161 ? 1   NAG A   O6   1 
HETATM 6444 O  O7   . NAG D 4 .   ? 10.332  2.191  16.635 1.000 53.377 ? 1   NAG A   O7   1 
HETATM 6445 H  H1   . NAG D 4 .   ? 9.882   5.793  19.325 1.000 48.526 ? 1   NAG A   H1   1 
HETATM 6446 H  H2   . NAG D 4 .   ? 11.281  3.210  18.590 1.000 51.003 ? 1   NAG A   H2   1 
HETATM 6447 H  H3   . NAG D 4 .   ? 9.100   3.686  20.656 1.000 51.301 ? 1   NAG A   H3   1 
HETATM 6448 H  H4   . NAG D 4 .   ? 12.040  3.211  21.231 1.000 52.441 ? 1   NAG A   H4   1 
HETATM 6449 H  H5   . NAG D 4 .   ? 10.621  5.900  21.369 1.000 49.908 ? 1   NAG A   H5   1 
HETATM 6450 H  H61  . NAG D 4 .   ? 12.277  5.953  23.042 1.000 50.204 ? 1   NAG A   H61  1 
HETATM 6451 H  H62  . NAG D 4 .   ? 12.978  6.776  21.651 1.000 49.392 ? 1   NAG A   H62  1 
HETATM 6452 H  H81  . NAG D 4 .   ? 7.786   3.783  15.919 1.000 52.891 ? 1   NAG A   H81  1 
HETATM 6453 H  H82  . NAG D 4 .   ? 8.232   2.248  15.260 1.000 54.033 ? 1   NAG A   H82  1 
HETATM 6454 H  H83  . NAG D 4 .   ? 7.297   2.326  16.713 1.000 53.880 ? 1   NAG A   H83  1 
HETATM 6455 H  HN2  . NAG D 4 .   ? 8.420   4.043  18.288 1.000 51.760 ? 1   NAG A   HN2  1 
HETATM 6456 H  HO3  . NAG D 4 .   ? 10.185  1.596  21.350 0.000 30.000 ? 1   NAG A   HO3  1 
HETATM 6457 H  HO4  . NAG D 4 .   ? 9.799   4.124  22.794 1.000 53.597 ? 1   NAG A   HO4  1 
HETATM 6458 H  HO6  . NAG D 4 .   ? 13.961  4.623  21.148 1.000 50.332 ? 1   NAG A   HO6  1 
HETATM 6459 C  C1   . NAG D 4 .   ? 11.304  2.811  23.546 1.000 62.294 ? 2   NAG A   C1   1 
HETATM 6460 C  C2   . NAG D 4 .   ? 11.026  3.251  24.984 1.000 64.137 ? 2   NAG A   C2   1 
HETATM 6461 C  C3   . NAG D 4 .   ? 11.821  2.425  25.986 1.000 66.227 ? 2   NAG A   C3   1 
HETATM 6462 C  C4   . NAG D 4 .   ? 11.699  0.971  25.570 1.000 68.190 ? 2   NAG A   C4   1 
HETATM 6463 C  C5   . NAG D 4 .   ? 12.380  0.749  24.226 1.000 66.382 ? 2   NAG A   C5   1 
HETATM 6464 C  C6   . NAG D 4 .   ? 11.640  -0.308 23.426 1.000 66.634 ? 2   NAG A   C6   1 
HETATM 6465 C  C7   . NAG D 4 .   ? 10.298  5.561  25.117 1.000 61.876 ? 2   NAG A   C7   1 
HETATM 6466 C  C8   . NAG D 4 .   ? 10.680  6.985  25.381 1.000 61.025 ? 2   NAG A   C8   1 
HETATM 6467 N  N2   . NAG D 4 .   ? 11.286  4.667  25.160 1.000 62.696 ? 2   NAG A   N2   1 
HETATM 6468 O  O3   . NAG D 4 .   ? 11.292  2.576  27.305 1.000 66.752 ? 2   NAG A   O3   1 
HETATM 6469 O  O4   . NAG D 4 .   ? 12.269  0.106  26.560 1.000 72.667 ? 2   NAG A   O4   1 
HETATM 6470 O  O5   . NAG D 4 .   ? 12.452  1.959  23.462 1.000 64.529 ? 2   NAG A   O5   1 
HETATM 6471 O  O6   . NAG D 4 .   ? 12.626  -1.111 22.785 1.000 67.854 ? 2   NAG A   O6   1 
HETATM 6472 O  O7   . NAG D 4 .   ? 9.144   5.243  24.885 1.000 61.848 ? 2   NAG A   O7   1 
HETATM 6473 H  H1   . NAG D 4 .   ? 10.419  2.267  23.186 1.000 63.242 ? 2   NAG A   H1   1 
HETATM 6474 H  H2   . NAG D 4 .   ? 9.964   3.054  25.187 1.000 64.190 ? 2   NAG A   H2   1 
HETATM 6475 H  H3   . NAG D 4 .   ? 12.877  2.728  25.958 1.000 66.132 ? 2   NAG A   H3   1 
HETATM 6476 H  H4   . NAG D 4 .   ? 10.628  0.746  25.466 1.000 68.389 ? 2   NAG A   H4   1 
HETATM 6477 H  H5   . NAG D 4 .   ? 13.400  0.387  24.419 1.000 66.926 ? 2   NAG A   H5   1 
HETATM 6478 H  H61  . NAG D 4 .   ? 10.993  0.151  22.677 1.000 66.315 ? 2   NAG A   H61  1 
HETATM 6479 H  H62  . NAG D 4 .   ? 11.027  -0.933 24.079 1.000 67.525 ? 2   NAG A   H62  1 
HETATM 6480 H  H81  . NAG D 4 .   ? 11.221  7.368  24.556 1.000 60.448 ? 2   NAG A   H81  1 
HETATM 6481 H  H82  . NAG D 4 .   ? 9.805   7.563  25.527 1.000 60.923 ? 2   NAG A   H82  1 
HETATM 6482 H  H83  . NAG D 4 .   ? 11.283  7.033  26.251 1.000 61.555 ? 2   NAG A   H83  1 
HETATM 6483 H  HN2  . NAG D 4 .   ? 12.234  4.963  25.347 1.000 62.749 ? 2   NAG A   HN2  1 
HETATM 6484 H  HO3  . NAG D 4 .   ? 11.670  1.969  27.927 0.000 30.000 ? 2   NAG A   HO3  1 
HETATM 6485 H  HO4  . NAG D 4 .   ? 12.057  -0.811 26.330 1.000 72.167 ? 2   NAG A   HO4  1 
HETATM 6486 H  HO6  . NAG D 4 .   ? 12.422  -1.766 22.697 0.000 30.000 ? 2   NAG A   HO6  1 
HETATM 6487 C  C1   . BMA D 4 .   ? 12.993  -0.697 27.423 1.000 79.370 ? 3   BMA A   C1   1 
HETATM 6488 C  C2   . BMA D 4 .   ? 14.238  -1.601 27.465 1.000 80.617 ? 3   BMA A   C2   1 
HETATM 6489 C  C3   . BMA D 4 .   ? 14.077  -2.890 28.294 1.000 81.964 ? 3   BMA A   C3   1 
HETATM 6490 C  C4   . BMA D 4 .   ? 13.145  -2.742 29.499 1.000 82.660 ? 3   BMA A   C4   1 
HETATM 6491 C  C5   . BMA D 4 .   ? 11.886  -1.946 29.145 1.000 81.662 ? 3   BMA A   C5   1 
HETATM 6492 C  C6   . BMA D 4 .   ? 10.957  -1.763 30.347 1.000 82.055 ? 3   BMA A   C6   1 
HETATM 6493 O  O2   . BMA D 4 .   ? 15.355  -0.826 27.930 1.000 79.827 ? 3   BMA A   O2   1 
HETATM 6494 O  O3   . BMA D 4 .   ? 15.366  -3.346 28.746 1.000 82.531 ? 3   BMA A   O3   1 
HETATM 6495 O  O4   . BMA D 4 .   ? 12.790  -4.046 29.985 1.000 83.526 ? 3   BMA A   O4   1 
HETATM 6496 O  O5   . BMA D 4 .   ? 12.264  -0.658 28.656 1.000 80.781 ? 3   BMA A   O5   1 
HETATM 6497 O  O6   . BMA D 4 .   ? 10.468  -0.415 30.411 1.000 80.279 ? 3   BMA A   O6   1 
HETATM 6498 H  H1   . BMA D 4 .   ? 13.346  0.320  27.200 1.000 78.786 ? 3   BMA A   H1   1 
HETATM 6499 H  H2   . BMA D 4 .   ? 14.443  -1.911 26.430 1.000 80.017 ? 3   BMA A   H2   1 
HETATM 6500 H  H3   . BMA D 4 .   ? 13.645  -3.656 27.634 1.000 81.941 ? 3   BMA A   H3   1 
HETATM 6501 H  H4   . BMA D 4 .   ? 13.685  -2.196 30.285 1.000 82.922 ? 3   BMA A   H4   1 
HETATM 6502 H  H5   . BMA D 4 .   ? 11.339  -2.491 28.363 1.000 81.452 ? 3   BMA A   H5   1 
HETATM 6503 H  H61  . BMA D 4 .   ? 11.496  -1.998 31.268 1.000 82.911 ? 3   BMA A   H61  1 
HETATM 6504 H  H62  . BMA D 4 .   ? 10.115  -2.453 30.264 1.000 82.391 ? 3   BMA A   H62  1 
HETATM 6505 H  HO2  . BMA D 4 .   ? 15.255  -0.071 27.176 0.000 30.000 ? 3   BMA A   HO2  1 
HETATM 6506 H  HO3  . BMA D 4 .   ? 16.066  -3.357 28.040 0.000 30.000 ? 3   BMA A   HO3  1 
HETATM 6507 H  HO4  . BMA D 4 .   ? 13.756  -4.647 30.301 0.000 30.000 ? 3   BMA A   HO4  1 
HETATM 6508 H  HO6  . BMA D 4 .   ? 11.061  0.110  29.848 0.000 30.000 ? 3   BMA A   HO6  1 
HETATM 6509 C  C1   . FUC D 4 .   ? 14.884  5.327  22.717 1.000 48.173 ? 4   FUC A   C1   1 
HETATM 6510 C  C2   . FUC D 4 .   ? 15.965  4.256  22.662 1.000 48.314 ? 4   FUC A   C2   1 
HETATM 6511 C  C3   . FUC D 4 .   ? 16.810  4.388  21.404 1.000 48.040 ? 4   FUC A   C3   1 
HETATM 6512 C  C4   . FUC D 4 .   ? 17.265  5.824  21.150 1.000 47.813 ? 4   FUC A   C4   1 
HETATM 6513 C  C5   . FUC D 4 .   ? 16.117  6.808  21.327 1.000 46.722 ? 4   FUC A   C5   1 
HETATM 6514 C  C6   . FUC D 4 .   ? 16.598  8.250  21.225 1.000 45.734 ? 4   FUC A   C6   1 
HETATM 6515 O  O2   . FUC D 4 .   ? 15.350  2.963  22.692 1.000 48.738 ? 4   FUC A   O2   1 
HETATM 6516 O  O3   . FUC D 4 .   ? 17.946  3.541  21.561 1.000 48.787 ? 4   FUC A   O3   1 
HETATM 6517 O  O4   . FUC D 4 .   ? 18.328  6.189  22.046 1.000 48.756 ? 4   FUC A   O4   1 
HETATM 6518 O  O5   . FUC D 4 .   ? 15.513  6.606  22.604 1.000 47.223 ? 4   FUC A   O5   1 
HETATM 6519 H  H1   . FUC D 4 .   ? 14.398  5.254  23.701 1.000 48.144 ? 4   FUC A   H1   1 
HETATM 6520 H  H2   . FUC D 4 .   ? 16.619  4.374  23.536 1.000 48.908 ? 4   FUC A   H2   1 
HETATM 6521 H  H3   . FUC D 4 .   ? 16.213  4.052  20.544 1.000 47.897 ? 4   FUC A   H3   1 
HETATM 6522 H  H4   . FUC D 4 .   ? 17.622  5.894  20.113 1.000 47.769 ? 4   FUC A   H4   1 
HETATM 6523 H  H5   . FUC D 4 .   ? 15.377  6.627  20.536 1.000 46.369 ? 4   FUC A   H5   1 
HETATM 6524 H  H61  . FUC D 4 .   ? 15.765  8.888  21.082 1.000 45.144 ? 4   FUC A   H61  1 
HETATM 6525 H  H62  . FUC D 4 .   ? 17.094  8.519  22.120 1.000 46.188 ? 4   FUC A   H62  1 
HETATM 6526 H  H63  . FUC D 4 .   ? 17.263  8.346  20.407 1.000 45.976 ? 4   FUC A   H63  1 
HETATM 6527 H  HO2  . FUC D 4 .   ? 14.917  2.862  23.511 0.000 30.000 ? 4   FUC A   HO2  1 
HETATM 6528 H  HO3  . FUC D 4 .   ? 17.639  2.718  21.741 0.000 30.000 ? 4   FUC A   HO3  1 
HETATM 6529 H  HO4  . FUC D 4 .   ? 17.931  7.060  22.580 0.000 30.000 ? 4   FUC A   HO4  1 
HETATM 6530 C  C1   . CIR E 5 .   ? 22.943  18.333 23.373 1.000 39.407 ? 701 CIR BBB C1   1 
HETATM 6531 O  O1   . CIR E 5 .   ? 23.215  19.286 24.144 1.000 38.640 ? 701 CIR BBB O1   1 
HETATM 6532 C  C2   . CIR E 5 .   ? 21.897  17.354 23.826 1.000 38.683 ? 701 CIR BBB C2   1 
HETATM 6533 N  N2   . CIR E 5 .   ? 22.178  16.898 25.169 1.000 39.635 ? 701 CIR BBB N2   1 
HETATM 6534 C  C3   . CIR E 5 .   ? 20.555  18.054 23.808 1.000 37.890 ? 701 CIR BBB C3   1 
HETATM 6535 C  C4   . CIR E 5 .   ? 19.659  17.490 22.727 1.000 37.261 ? 701 CIR BBB C4   1 
HETATM 6536 C  C5   . CIR E 5 .   ? 18.919  18.560 21.948 1.000 36.796 ? 701 CIR BBB C5   1 
HETATM 6537 N  N6   . CIR E 5 .   ? 18.419  19.700 22.701 1.000 36.048 ? 701 CIR BBB N6   1 
HETATM 6538 C  C7   . CIR E 5 .   ? 17.914  20.772 22.103 1.000 35.670 ? 701 CIR BBB C7   1 
HETATM 6539 O  O7   . CIR E 5 .   ? 17.608  21.744 22.747 1.000 35.819 ? 701 CIR BBB O7   1 
HETATM 6540 N  N8   . CIR E 5 .   ? 17.778  20.836 20.792 1.000 35.540 ? 701 CIR BBB N8   1 
HETATM 6541 H  H2   . CIR E 5 .   ? 21.885  16.486 23.152 1.000 39.004 ? 701 CIR BBB H2   1 
HETATM 6542 H  HN21 . CIR E 5 .   ? 22.377  17.570 25.895 1.000 39.294 ? 701 CIR BBB HN21 1 
HETATM 6543 H  HN22 . CIR E 5 .   ? 22.140  15.909 25.368 1.000 39.447 ? 701 CIR BBB HN22 1 
HETATM 6544 H  H31  . CIR E 5 .   ? 20.066  17.932 24.777 1.000 37.787 ? 701 CIR BBB H31  1 
HETATM 6545 H  H32  . CIR E 5 .   ? 20.702  19.123 23.645 1.000 37.875 ? 701 CIR BBB H32  1 
HETATM 6546 H  H41  . CIR E 5 .   ? 20.244  16.899 22.020 1.000 37.501 ? 701 CIR BBB H41  1 
HETATM 6547 H  H42  . CIR E 5 .   ? 18.930  16.820 23.187 1.000 37.312 ? 701 CIR BBB H42  1 
HETATM 6548 H  H51  . CIR E 5 .   ? 19.585  18.907 21.159 1.000 36.873 ? 701 CIR BBB H51  1 
HETATM 6549 H  H52  . CIR E 5 .   ? 18.072  18.079 21.460 1.000 36.745 ? 701 CIR BBB H52  1 
HETATM 6550 H  HN6  . CIR E 5 .   ? 18.494  19.686 23.708 1.000 36.071 ? 701 CIR BBB HN6  1 
HETATM 6551 H  HN81 . CIR E 5 .   ? 18.033  20.069 20.203 1.000 35.732 ? 701 CIR BBB HN81 1 
HETATM 6552 H  HN82 . CIR E 5 .   ? 17.415  21.676 20.377 1.000 35.723 ? 701 CIR BBB HN82 1 
HETATM 6553 ZN ZN   . ZN  F 6 .   ? 31.995  19.173 26.963 1.000 30.575 ? 702 ZN  BBB ZN   1 
HETATM 6554 ZN ZN   . ZN  G 6 .   ? -3.349  28.564 30.108 1.000 39.053 ? 305 ZN  HHH ZN   1 
HETATM 6555 ZN ZN   . ZN  H 6 .   ? 16.166  60.327 -0.540 1.000 70.355 ? 306 ZN  HHH ZN   1 
HETATM 6556 ZN ZN   . ZN  I 6 .   ? 4.382   22.016 6.284  1.000 49.449 ? 307 ZN  HHH ZN   1 
HETATM 6557 O  O    . HOH J 7 .   ? 21.952  12.544 23.770 1.000 26.996 ? 801 HOH BBB O    1 
HETATM 6558 O  O    . HOH J 7 .   ? 22.998  16.729 17.995 1.000 34.994 ? 802 HOH BBB O    1 
HETATM 6559 O  O    . HOH K 7 .   ? 6.141   22.970 7.349  1.000 41.229 ? 401 HOH HHH O    1 
HETATM 6560 O  O    . HOH K 7 .   ? 12.009  71.778 -5.417 1.000 39.755 ? 402 HOH HHH O    1 
HETATM 6561 O  O    . HOH K 7 .   ? 7.105   31.848 8.081  1.000 35.132 ? 403 HOH HHH O    1 
HETATM 6562 O  O    . HOH K 7 .   ? -0.040  31.306 11.224 1.000 33.782 ? 404 HOH HHH O    1 
HETATM 6563 O  O    . HOH K 7 .   ? 17.547  33.483 21.479 1.000 15.808 ? 405 HOH HHH O    1 
HETATM 6564 O  O    . HOH K 7 .   ? 14.224  19.673 27.947 1.000 21.969 ? 406 HOH HHH O    1 
HETATM 6565 O  O    . HOH K 7 .   ? 18.639  20.833 14.876 1.000 16.202 ? 407 HOH HHH O    1 
HETATM 6566 O  O    . HOH K 7 .   ? -5.232  28.283 29.650 1.000 33.478 ? 408 HOH HHH O    1 
HETATM 6567 O  O    . HOH K 7 .   ? 6.727   27.566 32.377 1.000 37.217 ? 409 HOH HHH O    1 
HETATM 6568 O  O    . HOH K 7 .   ? 11.960  37.802 18.328 1.000 23.516 ? 410 HOH HHH O    1 
HETATM 6569 O  O    . HOH K 7 .   ? 9.446   20.853 7.721  1.000 22.515 ? 411 HOH HHH O    1 
HETATM 6570 O  O    . HOH K 7 .   ? -9.985  36.851 21.296 1.000 28.989 ? 412 HOH HHH O    1 
HETATM 6571 O  O    . HOH K 7 .   ? 16.237  19.209 35.191 1.000 41.077 ? 413 HOH HHH O    1 
HETATM 6572 O  O    . HOH K 7 .   ? 9.812   67.537 -6.129 1.000 31.619 ? 414 HOH HHH O    1 
HETATM 6573 O  O    . HOH K 7 .   ? 14.401  60.012 -2.557 1.000 44.266 ? 415 HOH HHH O    1 
HETATM 6574 O  O    . HOH K 7 .   ? 9.660   72.918 -5.754 1.000 41.596 ? 416 HOH HHH O    1 
HETATM 6575 O  O    . HOH L 7 .   ? 10.139  54.464 21.825 1.000 29.493 ? 301 HOH LLL O    1 
HETATM 6576 O  O    . HOH L 7 .   ? 18.945  75.532 25.508 1.000 30.867 ? 302 HOH LLL O    1 
HETATM 6577 O  O    . HOH L 7 .   ? 17.598  61.755 0.142  1.000 41.536 ? 303 HOH LLL O    1 
HETATM 6578 O  O    . HOH L 7 .   ? 12.009  34.877 0.274  1.000 38.508 ? 304 HOH LLL O    1 
HETATM 6579 O  O    . HOH L 7 .   ? 14.266  31.082 4.063  1.000 27.019 ? 305 HOH LLL O    1 
HETATM 6580 O  O    . HOH L 7 .   ? 19.155  69.505 32.493 1.000 18.874 ? 306 HOH LLL O    1 
HETATM 6581 O  O    . HOH L 7 .   ? 19.879  49.089 16.244 1.000 27.087 ? 307 HOH LLL O    1 
HETATM 6582 O  O    . HOH L 7 .   ? 28.572  53.992 5.626  1.000 24.691 ? 308 HOH LLL O    1 
HETATM 6583 O  O    . HOH L 7 .   ? 24.623  67.031 15.819 1.000 29.112 ? 309 HOH LLL O    1 
HETATM 6584 O  O    . HOH L 7 .   ? 24.967  13.176 10.179 1.000 30.579 ? 310 HOH LLL O    1 
HETATM 6585 O  O    . HOH L 7 .   ? 16.872  35.772 -1.661 1.000 29.457 ? 311 HOH LLL O    1 
HETATM 6586 O  O    . HOH L 7 .   ? 30.292  38.081 11.147 1.000 32.796 ? 312 HOH LLL O    1 
HETATM 6587 O  O    . HOH L 7 .   ? 2.190   73.791 23.069 1.000 37.708 ? 313 HOH LLL O    1 
HETATM 6588 O  O    . HOH L 7 .   ? 21.610  29.219 -0.674 1.000 31.125 ? 314 HOH LLL O    1 
HETATM 6589 O  O    . HOH L 7 .   ? 36.285  29.671 11.220 1.000 27.377 ? 315 HOH LLL O    1 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N N    . LEU A 1   ? 0.685 0.688 0.717 0.054  0.048  -0.083 597 LEU BBB N    
2    C CA   . LEU A 1   ? 0.674 0.692 0.711 0.052  0.054  -0.081 597 LEU BBB CA   
3    C C    . LEU A 1   ? 0.658 0.681 0.701 0.041  0.062  -0.074 597 LEU BBB C    
4    O O    . LEU A 1   ? 0.655 0.668 0.700 0.035  0.063  -0.069 597 LEU BBB O    
5    C CB   . LEU A 1   ? 0.678 0.717 0.714 0.061  0.055  -0.088 597 LEU BBB CB   
6    C CG   . LEU A 1   ? 0.674 0.731 0.714 0.059  0.061  -0.086 597 LEU BBB CG   
7    C CD1  . LEU A 1   ? 0.679 0.727 0.717 0.063  0.057  -0.087 597 LEU BBB CD1  
8    C CD2  . LEU A 1   ? 0.668 0.753 0.708 0.065  0.063  -0.090 597 LEU BBB CD2  
9    H H1   . LEU A 1   ? 0.689 0.698 0.718 0.060  0.046  -0.088 597 LEU BBB H1   
10   H H2   . LEU A 1   ? 0.680 0.681 0.714 0.047  0.051  -0.079 597 LEU BBB H2   
11   H H3   . LEU A 1   ? 0.694 0.683 0.722 0.055  0.042  -0.083 597 LEU BBB H3   
12   H HA   . LEU A 1   ? 0.679 0.688 0.714 0.053  0.051  -0.081 597 LEU BBB HA   
13   H HB2  . LEU A 1   ? 0.688 0.723 0.719 0.069  0.049  -0.093 597 LEU BBB HB2  
14   H HB3  . LEU A 1   ? 0.676 0.723 0.712 0.061  0.057  -0.088 597 LEU BBB HB3  
15   H HG   . LEU A 1   ? 0.664 0.722 0.708 0.051  0.066  -0.081 597 LEU BBB HG   
16   H HD11 . LEU A 1   ? 0.679 0.713 0.718 0.058  0.057  -0.084 597 LEU BBB HD11 
17   H HD12 . LEU A 1   ? 0.674 0.734 0.714 0.062  0.061  -0.086 597 LEU BBB HD12 
18   H HD13 . LEU A 1   ? 0.689 0.734 0.722 0.071  0.052  -0.093 597 LEU BBB HD13 
19   H HD21 . LEU A 1   ? 0.678 0.763 0.714 0.075  0.058  -0.097 597 LEU BBB HD21 
20   H HD22 . LEU A 1   ? 0.664 0.761 0.707 0.063  0.066  -0.089 597 LEU BBB HD22 
21   H HD23 . LEU A 1   ? 0.665 0.756 0.707 0.062  0.066  -0.089 597 LEU BBB HD23 
22   N N    . PRO A 2   ? 0.638 0.675 0.684 0.038  0.068  -0.072 598 PRO BBB N    
23   C CA   . PRO A 2   ? 0.614 0.653 0.664 0.029  0.074  -0.066 598 PRO BBB CA   
24   C C    . PRO A 2   ? 0.598 0.622 0.647 0.023  0.073  -0.061 598 PRO BBB C    
25   O O    . PRO A 2   ? 0.603 0.622 0.651 0.024  0.071  -0.062 598 PRO BBB O    
26   C CB   . PRO A 2   ? 0.611 0.666 0.662 0.027  0.077  -0.066 598 PRO BBB CB   
27   C CG   . PRO A 2   ? 0.624 0.681 0.671 0.035  0.073  -0.072 598 PRO BBB CG   
28   C CD   . PRO A 2   ? 0.637 0.687 0.681 0.043  0.067  -0.077 598 PRO BBB CD   
29   H HA   . PRO A 2   ? 0.612 0.653 0.662 0.027  0.075  -0.064 598 PRO BBB HA   
30   H HB2  . PRO A 2   ? 0.609 0.661 0.660 0.022  0.079  -0.062 598 PRO BBB HB2  
31   H HB3  . PRO A 2   ? 0.610 0.676 0.661 0.027  0.079  -0.066 598 PRO BBB HB3  
32   H HG2  . PRO A 2   ? 0.625 0.673 0.672 0.033  0.072  -0.071 598 PRO BBB HG2  
33   H HG3  . PRO A 2   ? 0.622 0.693 0.670 0.036  0.075  -0.074 598 PRO BBB HG3  
34   H HD2  . PRO A 2   ? 0.644 0.686 0.685 0.047  0.063  -0.080 598 PRO BBB HD2  
35   H HD3  . PRO A 2   ? 0.637 0.700 0.681 0.048  0.068  -0.080 598 PRO BBB HD3  
36   N N    . GLY A 3   ? 0.576 0.595 0.627 0.018  0.076  -0.056 599 GLY BBB N    
37   C CA   . GLY A 3   ? 0.564 0.574 0.615 0.014  0.075  -0.051 599 GLY BBB CA   
38   C C    . GLY A 3   ? 0.548 0.561 0.600 0.009  0.080  -0.047 599 GLY BBB C    
39   O O    . GLY A 3   ? 0.541 0.550 0.593 0.007  0.081  -0.043 599 GLY BBB O    
40   H H    . GLY A 3   ? 0.575 0.598 0.627 0.018  0.077  -0.055 599 GLY BBB H    
41   H HA2  . GLY A 3   ? 0.568 0.574 0.618 0.014  0.073  -0.052 599 GLY BBB HA2  
42   H HA3  . GLY A 3   ? 0.566 0.571 0.618 0.014  0.074  -0.050 599 GLY BBB HA3  
43   N N    . GLN A 4   ? 0.535 0.557 0.587 0.008  0.083  -0.048 600 GLN BBB N    
44   C CA   . GLN A 4   ? 0.522 0.545 0.573 0.004  0.086  -0.045 600 GLN BBB CA   
45   C C    . GLN A 4   ? 0.510 0.538 0.561 0.003  0.087  -0.045 600 GLN BBB C    
46   O O    . GLN A 4   ? 0.514 0.551 0.564 0.002  0.087  -0.047 600 GLN BBB O    
47   C CB   . GLN A 4   ? 0.520 0.546 0.570 0.003  0.087  -0.043 600 GLN BBB CB   
48   C CG   . GLN A 4   ? 0.520 0.543 0.566 -0.001 0.087  -0.040 600 GLN BBB CG   
49   C CD   . GLN A 4   ? 0.520 0.541 0.564 -0.002 0.086  -0.039 600 GLN BBB CD   
50   O OE1  . GLN A 4   ? 0.520 0.545 0.561 -0.006 0.085  -0.037 600 GLN BBB OE1  
51   N NE2  . GLN A 4   ? 0.518 0.533 0.561 0.001  0.086  -0.038 600 GLN BBB NE2  
52   H H    . GLN A 4   ? 0.536 0.564 0.588 0.010  0.083  -0.051 600 GLN BBB H    
53   H HA   . GLN A 4   ? 0.522 0.540 0.572 0.004  0.086  -0.042 600 GLN BBB HA   
54   H HB2  . GLN A 4   ? 0.521 0.544 0.571 0.004  0.086  -0.043 600 GLN BBB HB2  
55   H HB3  . GLN A 4   ? 0.520 0.553 0.571 0.003  0.086  -0.045 600 GLN BBB HB3  
56   H HG2  . GLN A 4   ? 0.520 0.547 0.565 -0.003 0.087  -0.040 600 GLN BBB HG2  
57   H HG3  . GLN A 4   ? 0.520 0.538 0.565 0.000  0.087  -0.039 600 GLN BBB HG3  
60   N N    . GLY A 8   ? 0.498 0.547 0.547 -0.004 0.088  -0.046 602 GLY BBB N    
61   C CA   . GLY A 8   ? 0.506 0.566 0.553 -0.009 0.088  -0.044 602 GLY BBB CA   
62   C C    . GLY A 8   ? 0.510 0.582 0.558 -0.008 0.088  -0.044 602 GLY BBB C    
63   O O    . GLY A 8   ? 0.504 0.590 0.551 -0.012 0.088  -0.042 602 GLY BBB O    
64   H H    . GLY A 8   ? 0.501 0.545 0.549 -0.004 0.089  -0.045 602 GLY BBB H    
65   H HA2  . GLY A 8   ? 0.505 0.571 0.552 -0.009 0.089  -0.045 602 GLY BBB HA2  
66   H HA3  . GLY A 8   ? 0.507 0.561 0.551 -0.012 0.088  -0.041 602 GLY BBB HA3  
67   N N    . GLU A 9   ? 0.522 0.588 0.571 -0.004 0.088  -0.046 603 GLU BBB N    
68   C CA   . GLU A 9   ? 0.537 0.613 0.587 -0.003 0.087  -0.046 603 GLU BBB CA   
69   C C    . GLU A 9   ? 0.558 0.647 0.610 0.004  0.087  -0.052 603 GLU BBB C    
70   O O    . GLU A 9   ? 0.571 0.652 0.624 0.011  0.086  -0.056 603 GLU BBB O    
71   C CB   . GLU A 9   ? 0.533 0.596 0.583 -0.001 0.087  -0.046 603 GLU BBB CB   
72   C CG   . GLU A 9   ? 0.529 0.602 0.581 0.002  0.087  -0.048 603 GLU BBB CG   
73   C CD   . GLU A 9   ? 0.527 0.614 0.577 -0.004 0.086  -0.045 603 GLU BBB CD   
74   O OE1  . GLU A 9   ? 0.531 0.613 0.578 -0.011 0.086  -0.040 603 GLU BBB OE1  
75   O OE2  . GLU A 9   ? 0.530 0.636 0.582 -0.001 0.086  -0.047 603 GLU BBB OE2  
76   H H    . GLU A 9   ? 0.522 0.578 0.572 -0.002 0.088  -0.046 603 GLU BBB H    
77   H HA   . GLU A 9   ? 0.538 0.620 0.586 -0.008 0.087  -0.043 603 GLU BBB HA   
78   H HB2  . GLU A 9   ? 0.534 0.590 0.582 -0.004 0.087  -0.043 603 GLU BBB HB2  
79   H HB3  . GLU A 9   ? 0.533 0.589 0.584 0.003  0.087  -0.048 603 GLU BBB HB3  
80   H HG2  . GLU A 9   ? 0.530 0.594 0.581 0.003  0.086  -0.048 603 GLU BBB HG2  
81   H HG3  . GLU A 9   ? 0.530 0.608 0.583 0.007  0.086  -0.052 603 GLU BBB HG3  
82   N N    . ARG A 10  ? 0.582 0.692 0.634 0.003  0.087  -0.052 604 ARG BBB N    
83   C CA   . ARG A 10  ? 0.611 0.739 0.664 0.011  0.087  -0.058 604 ARG BBB CA   
84   C C    . ARG A 10  ? 0.611 0.766 0.665 0.007  0.087  -0.055 604 ARG BBB C    
85   O O    . ARG A 10  ? 0.631 0.790 0.685 0.001  0.087  -0.050 604 ARG BBB O    
86   C CB   . ARG A 10  ? 0.643 0.765 0.695 0.015  0.086  -0.061 604 ARG BBB CB   
87   C CG   . ARG A 10  ? 0.663 0.761 0.715 0.019  0.084  -0.063 604 ARG BBB CG   
88   C CD   . ARG A 10  ? 0.669 0.751 0.721 0.012  0.086  -0.059 604 ARG BBB CD   
89   N NE   . ARG A 10  ? 0.679 0.742 0.731 0.014  0.084  -0.059 604 ARG BBB NE   
90   C CZ   . ARG A 10  ? 0.683 0.734 0.734 0.011  0.084  -0.057 604 ARG BBB CZ   
91   N NH1  . ARG A 10  ? 0.682 0.737 0.734 0.007  0.086  -0.055 604 ARG BBB NH1  
92   N NH2  . ARG A 10  ? 0.689 0.726 0.740 0.012  0.082  -0.056 604 ARG BBB NH2  
93   H H    . ARG A 10  ? 0.582 0.698 0.633 -0.004 0.088  -0.048 604 ARG BBB H    
94   H HA   . ARG A 10  ? 0.613 0.737 0.667 0.017  0.086  -0.061 604 ARG BBB HA   
95   H HB2  . ARG A 10  ? 0.637 0.761 0.690 0.009  0.087  -0.058 604 ARG BBB HB2  
96   H HB3  . ARG A 10  ? 0.641 0.776 0.694 0.021  0.085  -0.065 604 ARG BBB HB3  
97   H HG2  . ARG A 10  ? 0.664 0.763 0.715 0.025  0.082  -0.068 604 ARG BBB HG2  
98   H HG3  . ARG A 10  ? 0.661 0.752 0.713 0.020  0.084  -0.064 604 ARG BBB HG3  
99   H HD2  . ARG A 10  ? 0.666 0.748 0.718 0.006  0.087  -0.055 604 ARG BBB HD2  
100  H HD3  . ARG A 10  ? 0.668 0.755 0.720 0.011  0.086  -0.059 604 ARG BBB HD3  
101  H HE   . ARG A 10  ? 0.681 0.740 0.732 0.017  0.082  -0.061 604 ARG BBB HE   
102  H HH11 . ARG A 10  ? 0.680 0.745 0.731 0.006  0.087  -0.055 604 ARG BBB HH11 
103  H HH12 . ARG A 10  ? 0.681 0.729 0.732 0.006  0.086  -0.054 604 ARG BBB HH12 
104  H HH21 . ARG A 10  ? 0.690 0.724 0.741 0.014  0.080  -0.057 604 ARG BBB HH21 
105  H HH22 . ARG A 10  ? 0.687 0.719 0.738 0.010  0.082  -0.055 604 ARG BBB HH22 
106  N N    . GLY A 11  ? 0.603 0.779 0.657 0.009  0.088  -0.057 605 GLY BBB N    
107  C CA   . GLY A 11  ? 0.588 0.795 0.643 0.004  0.088  -0.053 605 GLY BBB CA   
108  C C    . GLY A 11  ? 0.574 0.781 0.628 -0.008 0.088  -0.045 605 GLY BBB C    
109  O O    . GLY A 11  ? 0.550 0.777 0.604 -0.009 0.089  -0.045 605 GLY BBB O    
110  H H    . GLY A 11  ? 0.603 0.776 0.657 0.015  0.087  -0.061 605 GLY BBB H    
111  H HA2  . GLY A 11  ? 0.588 0.800 0.643 0.001  0.088  -0.050 605 GLY BBB HA2  
112  H HA3  . GLY A 11  ? 0.589 0.812 0.644 0.011  0.088  -0.057 605 GLY BBB HA3  
113  N N    . GLN B 1   ? 0.940 0.647 0.687 -0.040 0.076  -0.012 1   GLN HHH N    
114  C CA   . GLN B 1   ? 0.901 0.644 0.679 -0.035 0.080  -0.005 1   GLN HHH CA   
115  C C    . GLN B 1   ? 0.834 0.625 0.657 -0.041 0.062  -0.003 1   GLN HHH C    
116  O O    . GLN B 1   ? 0.834 0.631 0.667 -0.048 0.051  -0.005 1   GLN HHH O    
117  C CB   . GLN B 1   ? 0.940 0.658 0.680 -0.032 0.079  -0.007 1   GLN HHH CB   
118  C CG   . GLN B 1   ? 0.979 0.683 0.693 -0.040 0.051  -0.015 1   GLN HHH CG   
119  C CD   . GLN B 1   ? 1.032 0.706 0.703 -0.036 0.050  -0.016 1   GLN HHH CD   
120  O OE1  . GLN B 1   ? 1.063 0.717 0.716 -0.028 0.074  -0.012 1   GLN HHH OE1  
121  N NE2  . GLN B 1   ? 1.047 0.716 0.703 -0.042 0.022  -0.021 1   GLN HHH NE2  
122  H H1   . GLN B 1   ? 0.977 0.650 0.689 -0.037 0.084  -0.014 1   GLN HHH H1   
123  H H2   . GLN B 1   ? 0.940 0.650 0.686 -0.047 0.056  -0.016 1   GLN HHH H2   
124  H H3   . GLN B 1   ? 0.929 0.644 0.695 -0.039 0.083  -0.009 1   GLN HHH H3   
125  H HA   . GLN B 1   ? 0.891 0.639 0.684 -0.030 0.098  0.001  1   GLN HHH HA   
126  H HB2  . GLN B 1   ? 0.915 0.657 0.678 -0.030 0.082  -0.002 1   GLN HHH HB2  
127  H HB3  . GLN B 1   ? 0.975 0.661 0.688 -0.028 0.095  -0.007 1   GLN HHH HB3  
128  H HG2  . GLN B 1   ? 1.005 0.685 0.699 -0.044 0.045  -0.020 1   GLN HHH HG2  
129  H HG3  . GLN B 1   ? 0.946 0.682 0.690 -0.044 0.037  -0.014 1   GLN HHH HG3  
132  N N    . VAL B 2   ? 0.774 0.596 0.621 -0.039 0.061  0.002  2   VAL HHH N    
133  C CA   . VAL B 2   ? 0.703 0.570 0.593 -0.043 0.050  0.006  2   VAL HHH CA   
134  C C    . VAL B 2   ? 0.670 0.548 0.558 -0.045 0.034  0.004  2   VAL HHH C    
135  O O    . VAL B 2   ? 0.670 0.537 0.541 -0.040 0.039  0.004  2   VAL HHH O    
136  C CB   . VAL B 2   ? 0.672 0.565 0.595 -0.037 0.063  0.014  2   VAL HHH CB   
137  C CG1  . VAL B 2   ? 0.633 0.563 0.587 -0.039 0.052  0.017  2   VAL HHH CG1  
138  C CG2  . VAL B 2   ? 0.675 0.563 0.608 -0.035 0.076  0.018  2   VAL HHH CG2  
139  H H    . VAL B 2   ? 0.780 0.597 0.619 -0.035 0.068  0.004  2   VAL HHH H    
140  H HA   . VAL B 2   ? 0.700 0.570 0.597 -0.047 0.044  0.004  2   VAL HHH HA   
141  H HB   . VAL B 2   ? 0.678 0.564 0.595 -0.032 0.072  0.016  2   VAL HHH HB   
142  H HG11 . VAL B 2   ? 0.629 0.564 0.580 -0.038 0.049  0.017  2   VAL HHH HG11 
143  H HG12 . VAL B 2   ? 0.619 0.561 0.591 -0.037 0.058  0.022  2   VAL HHH HG12 
144  H HG13 . VAL B 2   ? 0.631 0.565 0.587 -0.044 0.043  0.015  2   VAL HHH HG13 
145  H HG21 . VAL B 2   ? 0.668 0.563 0.609 -0.039 0.069  0.017  2   VAL HHH HG21 
146  H HG22 . VAL B 2   ? 0.660 0.561 0.612 -0.031 0.083  0.024  2   VAL HHH HG22 
147  H HG23 . VAL B 2   ? 0.702 0.564 0.614 -0.033 0.084  0.016  2   VAL HHH HG23 
148  N N    . HIS B 3   ? 0.632 0.532 0.541 -0.051 0.018  0.002  3   HIS HHH N    
149  C CA   . HIS B 3   ? 0.612 0.526 0.527 -0.054 0.002  0.000  3   HIS HHH CA   
150  C C    . HIS B 3   ? 0.561 0.514 0.517 -0.055 -0.000 0.004  3   HIS HHH C    
151  O O    . HIS B 3   ? 0.546 0.506 0.519 -0.060 -0.001 0.005  3   HIS HHH O    
152  C CB   . HIS B 3   ? 0.637 0.530 0.534 -0.060 -0.018 -0.007 3   HIS HHH CB   
153  C CG   . HIS B 3   ? 0.640 0.535 0.532 -0.060 -0.033 -0.008 3   HIS HHH CG   
154  N ND1  . HIS B 3   ? 0.671 0.545 0.530 -0.055 -0.031 -0.009 3   HIS HHH ND1  
155  C CD2  . HIS B 3   ? 0.623 0.540 0.542 -0.065 -0.050 -0.009 3   HIS HHH CD2  
156  C CE1  . HIS B 3   ? 0.669 0.549 0.532 -0.057 -0.048 -0.010 3   HIS HHH CE1  
157  N NE2  . HIS B 3   ? 0.643 0.551 0.545 -0.062 -0.060 -0.010 3   HIS HHH NE2  
158  H H    . HIS B 3   ? 0.627 0.534 0.550 -0.054 0.017  0.002  3   HIS HHH H    
159  H HA   . HIS B 3   ? 0.613 0.524 0.519 -0.050 0.006  0.002  3   HIS HHH HA   
160  H HB2  . HIS B 3   ? 0.668 0.532 0.536 -0.059 -0.014 -0.009 3   HIS HHH HB2  
161  H HB3  . HIS B 3   ? 0.630 0.532 0.545 -0.065 -0.023 -0.007 3   HIS HHH HB3  
163  H HD2  . HIS B 3   ? 0.610 0.544 0.555 -0.069 -0.054 -0.008 3   HIS HHH HD2  
164  H HE1  . HIS B 3   ? 0.684 0.551 0.526 -0.054 -0.050 -0.010 3   HIS HHH HE1  
166  N N    . LEU B 4   ? 0.535 0.506 0.501 -0.052 -0.000 0.007  4   LEU HHH N    
167  C CA   . LEU B 4   ? 0.507 0.508 0.503 -0.053 -0.004 0.010  4   LEU HHH CA   
168  C C    . LEU B 4   ? 0.505 0.510 0.504 -0.055 -0.019 0.007  4   LEU HHH C    
169  O O    . LEU B 4   ? 0.519 0.515 0.500 -0.052 -0.022 0.006  4   LEU HHH O    
170  C CB   . LEU B 4   ? 0.488 0.504 0.493 -0.047 0.006  0.016  4   LEU HHH CB   
171  C CG   . LEU B 4   ? 0.474 0.494 0.489 -0.046 0.016  0.020  4   LEU HHH CG   
172  C CD1  . LEU B 4   ? 0.493 0.491 0.493 -0.044 0.025  0.020  4   LEU HHH CD1  
173  C CD2  . LEU B 4   ? 0.453 0.487 0.479 -0.041 0.019  0.026  4   LEU HHH CD2  
174  H H    . LEU B 4   ? 0.542 0.506 0.496 -0.048 0.003  0.008  4   LEU HHH H    
175  H HA   . LEU B 4   ? 0.502 0.508 0.510 -0.056 -0.003 0.010  4   LEU HHH HA   
176  H HB2  . LEU B 4   ? 0.494 0.501 0.486 -0.044 0.008  0.016  4   LEU HHH HB2  
177  H HB3  . LEU B 4   ? 0.474 0.503 0.490 -0.048 0.002  0.016  4   LEU HHH HB3  
178  H HG   . LEU B 4   ? 0.471 0.496 0.494 -0.049 0.015  0.020  4   LEU HHH HG   
179  H HD11 . LEU B 4   ? 0.505 0.494 0.499 -0.047 0.023  0.017  4   LEU HHH HD11 
180  H HD12 . LEU B 4   ? 0.487 0.489 0.496 -0.041 0.032  0.024  4   LEU HHH HD12 
181  H HD13 . LEU B 4   ? 0.502 0.491 0.490 -0.041 0.027  0.020  4   LEU HHH HD13 
182  H HD21 . LEU B 4   ? 0.458 0.486 0.480 -0.038 0.024  0.027  4   LEU HHH HD21 
183  H HD22 . LEU B 4   ? 0.449 0.488 0.483 -0.041 0.022  0.028  4   LEU HHH HD22 
184  H HD23 . LEU B 4   ? 0.447 0.490 0.476 -0.042 0.014  0.025  4   LEU HHH HD23 
185  N N    . GLU B 5   ? 0.502 0.520 0.525 -0.061 -0.028 0.006  5   GLU HHH N    
186  C CA   . GLU B 5   ? 0.513 0.536 0.546 -0.063 -0.044 0.004  5   GLU HHH CA   
187  C C    . GLU B 5   ? 0.479 0.530 0.546 -0.062 -0.040 0.007  5   GLU HHH C    
188  O O    . GLU B 5   ? 0.470 0.530 0.554 -0.064 -0.030 0.010  5   GLU HHH O    
189  C CB   . GLU B 5   ? 0.539 0.547 0.574 -0.070 -0.059 -0.001 5   GLU HHH CB   
190  C CG   . GLU B 5   ? 0.559 0.569 0.607 -0.073 -0.080 -0.003 5   GLU HHH CG   
191  C CD   . GLU B 5   ? 0.601 0.585 0.611 -0.071 -0.093 -0.006 5   GLU HHH CD   
192  O OE1  . GLU B 5   ? 0.593 0.577 0.586 -0.064 -0.085 -0.004 5   GLU HHH OE1  
193  O OE2  . GLU B 5   ? 0.648 0.607 0.642 -0.076 -0.112 -0.011 5   GLU HHH OE2  
194  H H    . GLU B 5   ? 0.497 0.521 0.532 -0.063 -0.023 0.007  5   GLU HHH H    
195  H HA   . GLU B 5   ? 0.518 0.533 0.535 -0.060 -0.047 0.003  5   GLU HHH HA   
196  H HB2  . GLU B 5   ? 0.561 0.548 0.570 -0.070 -0.059 -0.003 5   GLU HHH HB2  
197  H HB3  . GLU B 5   ? 0.533 0.550 0.588 -0.073 -0.055 0.001  5   GLU HHH HB3  
198  H HG2  . GLU B 5   ? 0.566 0.575 0.629 -0.078 -0.088 -0.004 5   GLU HHH HG2  
199  H HG3  . GLU B 5   ? 0.540 0.570 0.609 -0.071 -0.077 0.000  5   GLU HHH HG3  
200  N N    . GLN B 6   ? 0.459 0.518 0.532 -0.060 -0.046 0.008  6   GLN HHH N    
201  C CA   . GLN B 6   ? 0.430 0.511 0.528 -0.057 -0.040 0.011  6   GLN HHH CA   
202  C C    . GLN B 6   ? 0.417 0.508 0.544 -0.059 -0.052 0.011  6   GLN HHH C    
203  O O    . GLN B 6   ? 0.418 0.498 0.539 -0.061 -0.069 0.008  6   GLN HHH O    
204  C CB   . GLN B 6   ? 0.423 0.506 0.505 -0.050 -0.034 0.013  6   GLN HHH CB   
205  C CG   . GLN B 6   ? 0.411 0.496 0.485 -0.048 -0.020 0.016  6   GLN HHH CG   
206  C CD   . GLN B 6   ? 0.400 0.485 0.461 -0.043 -0.017 0.017  6   GLN HHH CD   
207  O OE1  . GLN B 6   ? 0.407 0.480 0.450 -0.041 -0.017 0.017  6   GLN HHH OE1  
208  N NE2  . GLN B 6   ? 0.389 0.484 0.458 -0.040 -0.014 0.019  6   GLN HHH NE2  
209  H H    . GLN B 6   ? 0.472 0.521 0.531 -0.059 -0.055 0.006  6   GLN HHH H    
210  H HA   . GLN B 6   ? 0.422 0.509 0.529 -0.058 -0.030 0.013  6   GLN HHH HA   
211  H HB2  . GLN B 6   ? 0.433 0.504 0.496 -0.050 -0.039 0.011  6   GLN HHH HB2  
212  H HB3  . GLN B 6   ? 0.416 0.508 0.510 -0.049 -0.036 0.014  6   GLN HHH HB3  
213  H HG2  . GLN B 6   ? 0.403 0.497 0.491 -0.048 -0.014 0.018  6   GLN HHH HG2  
214  H HG3  . GLN B 6   ? 0.416 0.493 0.482 -0.049 -0.017 0.016  6   GLN HHH HG3  
217  N N    . SER B 7   ? 0.396 0.505 0.554 -0.059 -0.042 0.014  7   SER HHH N    
218  C CA   . SER B 7   ? 0.389 0.513 0.584 -0.059 -0.048 0.015  7   SER HHH CA   
219  C C    . SER B 7   ? 0.393 0.514 0.577 -0.055 -0.061 0.014  7   SER HHH C    
220  O O    . SER B 7   ? 0.390 0.502 0.541 -0.051 -0.059 0.013  7   SER HHH O    
221  C CB   . SER B 7   ? 0.378 0.515 0.592 -0.055 -0.028 0.020  7   SER HHH CB   
222  O OG   . SER B 7   ? 0.379 0.513 0.592 -0.058 -0.014 0.021  7   SER HHH OG   
223  H H    . SER B 7   ? 0.391 0.503 0.548 -0.058 -0.030 0.016  7   SER HHH H    
224  H HA   . SER B 7   ? 0.397 0.520 0.609 -0.063 -0.056 0.015  7   SER HHH HA   
225  H HB2  . SER B 7   ? 0.374 0.510 0.572 -0.051 -0.023 0.020  7   SER HHH HB2  
226  H HB3  . SER B 7   ? 0.377 0.523 0.621 -0.056 -0.030 0.021  7   SER HHH HB3  
228  N N    . GLY B 8   ? 0.394 0.524 0.611 -0.056 -0.074 0.015  8   GLY HHH N    
229  C CA   . GLY B 8   ? 0.402 0.531 0.615 -0.051 -0.087 0.015  8   GLY HHH CA   
230  C C    . GLY B 8   ? 0.395 0.533 0.606 -0.044 -0.071 0.017  8   GLY HHH C    
231  O O    . GLY B 8   ? 0.381 0.524 0.591 -0.042 -0.051 0.019  8   GLY HHH O    
232  H H    . GLY B 8   ? 0.395 0.532 0.640 -0.059 -0.075 0.016  8   GLY HHH H    
233  H HA2  . GLY B 8   ? 0.415 0.528 0.598 -0.051 -0.096 0.012  8   GLY HHH HA2  
234  H HA3  . GLY B 8   ? 0.407 0.541 0.648 -0.053 -0.098 0.015  8   GLY HHH HA3  
235  N N    . SER B 9   ? 0.416 0.553 0.623 -0.040 -0.081 0.017  9   SER HHH N    
236  C CA   . SER B 9   ? 0.419 0.563 0.628 -0.033 -0.070 0.019  9   SER HHH CA   
237  C C    . SER B 9   ? 0.414 0.575 0.665 -0.031 -0.055 0.023  9   SER HHH C    
238  O O    . SER B 9   ? 0.412 0.583 0.703 -0.035 -0.060 0.024  9   SER HHH O    
239  C CB   . SER B 9   ? 0.431 0.571 0.637 -0.029 -0.086 0.019  9   SER HHH CB   
240  O OG   . SER B 9   ? 0.450 0.570 0.613 -0.030 -0.096 0.017  9   SER HHH OG   
241  H H    . SER B 9   ? 0.426 0.555 0.628 -0.041 -0.097 0.016  9   SER HHH H    
242  H HA   . SER B 9   ? 0.415 0.554 0.600 -0.031 -0.060 0.019  9   SER HHH HA   
243  H HB2  . SER B 9   ? 0.436 0.580 0.667 -0.031 -0.098 0.020  9   SER HHH HB2  
244  H HB3  . SER B 9   ? 0.426 0.570 0.634 -0.025 -0.078 0.021  9   SER HHH HB3  
246  N N    . GLU B 10  ? 0.418 0.580 0.659 -0.026 -0.035 0.024  10  GLU HHH N    
247  C CA   . GLU B 10  ? 0.425 0.596 0.697 -0.022 -0.017 0.027  10  GLU HHH CA   
248  C C    . GLU B 10  ? 0.421 0.593 0.691 -0.015 -0.016 0.028  10  GLU HHH C    
249  O O    . GLU B 10  ? 0.427 0.588 0.661 -0.011 -0.010 0.026  10  GLU HHH O    
250  C CB   . GLU B 10  ? 0.438 0.603 0.693 -0.022 0.005  0.028  10  GLU HHH CB   
251  C CG   . GLU B 10  ? 0.448 0.610 0.695 -0.028 0.005  0.028  10  GLU HHH CG   
252  C CD   . GLU B 10  ? 0.457 0.629 0.748 -0.033 0.005  0.030  10  GLU HHH CD   
253  O OE1  . GLU B 10  ? 0.446 0.628 0.778 -0.031 0.013  0.033  10  GLU HHH OE1  
254  O OE2  . GLU B 10  ? 0.480 0.649 0.765 -0.039 -0.000 0.028  10  GLU HHH OE2  
255  H H    . GLU B 10  ? 0.417 0.572 0.631 -0.024 -0.032 0.023  10  GLU HHH H    
256  H HA   . GLU B 10  ? 0.424 0.605 0.730 -0.024 -0.021 0.029  10  GLU HHH HA   
257  H HB2  . GLU B 10  ? 0.439 0.596 0.665 -0.019 0.008  0.027  10  GLU HHH HB2  
258  H HB3  . GLU B 10  ? 0.440 0.609 0.716 -0.019 0.019  0.031  10  GLU HHH HB3  
259  H HG2  . GLU B 10  ? 0.446 0.605 0.677 -0.031 -0.008 0.025  10  GLU HHH HG2  
260  H HG3  . GLU B 10  ? 0.450 0.605 0.678 -0.027 0.016  0.028  10  GLU HHH HG3  
261  N N    . LEU B 11  ? 0.419 0.600 0.727 -0.012 -0.024 0.030  11  LEU HHH N    
262  C CA   . LEU B 11  ? 0.422 0.605 0.738 -0.004 -0.020 0.032  11  LEU HHH CA   
263  C C    . LEU B 11  ? 0.417 0.605 0.766 0.000  0.005  0.036  11  LEU HHH C    
264  O O    . LEU B 11  ? 0.418 0.621 0.819 -0.001 0.004  0.039  11  LEU HHH O    
265  C CB   . LEU B 11  ? 0.431 0.619 0.768 -0.004 -0.046 0.033  11  LEU HHH CB   
266  C CG   . LEU B 11  ? 0.447 0.621 0.743 -0.008 -0.068 0.029  11  LEU HHH CG   
267  C CD1  . LEU B 11  ? 0.458 0.633 0.778 -0.012 -0.095 0.030  11  LEU HHH CD1  
268  C CD2  . LEU B 11  ? 0.451 0.615 0.715 -0.003 -0.070 0.028  11  LEU HHH CD2  
269  H H    . LEU B 11  ? 0.420 0.608 0.755 -0.015 -0.032 0.031  11  LEU HHH H    
270  H HA   . LEU B 11  ? 0.423 0.596 0.705 -0.003 -0.017 0.030  11  LEU HHH HA   
271  H HB2  . LEU B 11  ? 0.432 0.628 0.804 -0.006 -0.051 0.035  11  LEU HHH HB2  
272  H HB3  . LEU B 11  ? 0.434 0.622 0.776 0.001  -0.043 0.034  11  LEU HHH HB3  
273  H HG   . LEU B 11  ? 0.443 0.613 0.719 -0.012 -0.063 0.027  11  LEU HHH HG   
274  H HD11 . LEU B 11  ? 0.455 0.637 0.794 -0.017 -0.095 0.030  11  LEU HHH HD11 
275  H HD12 . LEU B 11  ? 0.466 0.629 0.755 -0.014 -0.108 0.028  11  LEU HHH HD12 
276  H HD13 . LEU B 11  ? 0.459 0.641 0.806 -0.009 -0.101 0.033  11  LEU HHH HD13 
277  H HD21 . LEU B 11  ? 0.454 0.621 0.736 0.001  -0.077 0.030  11  LEU HHH HD21 
278  H HD22 . LEU B 11  ? 0.457 0.610 0.693 -0.005 -0.080 0.026  11  LEU HHH HD22 
279  H HD23 . LEU B 11  ? 0.447 0.609 0.698 -0.001 -0.055 0.028  11  LEU HHH HD23 
280  N N    . LYS B 12  ? 0.418 0.594 0.738 0.005  0.026  0.035  12  LYS HHH N    
281  C CA   . LYS B 12  ? 0.426 0.598 0.761 0.009  0.056  0.038  12  LYS HHH CA   
282  C C    . LYS B 12  ? 0.432 0.593 0.757 0.018  0.070  0.038  12  LYS HHH C    
283  O O    . LYS B 12  ? 0.437 0.593 0.736 0.020  0.057  0.035  12  LYS HHH O    
284  C CB   . LYS B 12  ? 0.436 0.594 0.733 0.006  0.069  0.036  12  LYS HHH CB   
285  C CG   . LYS B 12  ? 0.429 0.595 0.737 -0.002 0.061  0.037  12  LYS HHH CG   
286  C CD   . LYS B 12  ? 0.427 0.610 0.797 -0.004 0.064  0.041  12  LYS HHH CD   
287  C CE   . LYS B 12  ? 0.424 0.610 0.804 -0.012 0.064  0.042  12  LYS HHH CE   
288  N NZ   . LYS B 12  ? 0.426 0.629 0.872 -0.014 0.068  0.047  12  LYS HHH NZ   
289  H H    . LYS B 12  ? 0.420 0.587 0.707 0.006  0.024  0.032  12  LYS HHH H    
290  H HA   . LYS B 12  ? 0.424 0.607 0.800 0.008  0.058  0.041  12  LYS HHH HA   
291  H HB2  . LYS B 12  ? 0.437 0.585 0.697 0.006  0.064  0.034  12  LYS HHH HB2  
292  H HB3  . LYS B 12  ? 0.449 0.598 0.746 0.010  0.090  0.038  12  LYS HHH HB3  
293  H HG2  . LYS B 12  ? 0.421 0.589 0.718 -0.006 0.043  0.034  12  LYS HHH HG2  
294  H HG3  . LYS B 12  ? 0.436 0.591 0.721 -0.003 0.072  0.037  12  LYS HHH HG3  
295  H HD2  . LYS B 12  ? 0.435 0.617 0.822 0.001  0.083  0.044  12  LYS HHH HD2  
296  H HD3  . LYS B 12  ? 0.420 0.613 0.811 -0.005 0.047  0.041  12  LYS HHH HD3  
297  H HE2  . LYS B 12  ? 0.418 0.605 0.784 -0.017 0.046  0.039  12  LYS HHH HE2  
298  H HE3  . LYS B 12  ? 0.434 0.608 0.789 -0.011 0.080  0.042  12  LYS HHH HE3  
299  H HZ1  . LYS B 12  ? 0.433 0.634 0.893 -0.010 0.088  0.050  12  LYS HHH HZ1  
300  H HZ2  . LYS B 12  ? 0.424 0.628 0.876 -0.019 0.067  0.047  12  LYS HHH HZ2  
301  H HZ3  . LYS B 12  ? 0.419 0.632 0.888 -0.015 0.052  0.047  12  LYS HHH HZ3  
302  N N    . LYS B 13  ? 0.437 0.592 0.780 0.024  0.098  0.042  13  LYS HHH N    
303  C CA   . LYS B 13  ? 0.451 0.587 0.774 0.034  0.119  0.041  13  LYS HHH CA   
304  C C    . LYS B 13  ? 0.464 0.571 0.725 0.034  0.134  0.038  13  LYS HHH C    
305  O O    . LYS B 13  ? 0.464 0.568 0.714 0.029  0.138  0.039  13  LYS HHH O    
306  C CB   . LYS B 13  ? 0.465 0.606 0.841 0.041  0.144  0.048  13  LYS HHH CB   
307  C CG   . LYS B 13  ? 0.456 0.622 0.892 0.043  0.128  0.051  13  LYS HHH CG   
308  C CD   . LYS B 13  ? 0.478 0.641 0.951 0.054  0.153  0.056  13  LYS HHH CD   
309  C CE   . LYS B 13  ? 0.468 0.660 1.021 0.055  0.141  0.062  13  LYS HHH CE   
310  N NZ   . LYS B 13  ? 0.452 0.657 1.004 0.051  0.100  0.059  13  LYS HHH NZ   
311  H H    . LYS B 13  ? 0.438 0.599 0.807 0.023  0.108  0.045  13  LYS HHH H    
312  H HA   . LYS B 13  ? 0.447 0.584 0.761 0.035  0.106  0.040  13  LYS HHH HA   
313  H HB2  . LYS B 13  ? 0.467 0.612 0.861 0.038  0.154  0.050  13  LYS HHH HB2  
314  H HB3  . LYS B 13  ? 0.485 0.608 0.840 0.047  0.162  0.047  13  LYS HHH HB3  
315  H HG2  . LYS B 13  ? 0.448 0.615 0.866 0.042  0.108  0.048  13  LYS HHH HG2  
316  H HG3  . LYS B 13  ? 0.444 0.627 0.916 0.038  0.119  0.053  13  LYS HHH HG3  
317  H HD2  . LYS B 13  ? 0.493 0.645 0.965 0.056  0.179  0.058  13  LYS HHH HD2  
318  H HD3  . LYS B 13  ? 0.486 0.636 0.930 0.058  0.154  0.053  13  LYS HHH HD3  
319  H HE2  . LYS B 13  ? 0.463 0.666 1.050 0.051  0.144  0.065  13  LYS HHH HE2  
320  H HE3  . LYS B 13  ? 0.478 0.667 1.052 0.063  0.157  0.065  13  LYS HHH HE3  
321  H HZ1  . LYS B 13  ? 0.454 0.647 0.965 0.052  0.096  0.056  13  LYS HHH HZ1  
322  H HZ2  . LYS B 13  ? 0.449 0.665 1.041 0.054  0.094  0.063  13  LYS HHH HZ2  
323  H HZ3  . LYS B 13  ? 0.442 0.653 0.992 0.044  0.086  0.058  13  LYS HHH HZ3  
324  N N    . PRO B 14  ? 0.476 0.560 0.695 0.039  0.139  0.035  14  PRO HHH N    
325  C CA   . PRO B 14  ? 0.501 0.553 0.658 0.039  0.148  0.032  14  PRO HHH CA   
326  C C    . PRO B 14  ? 0.529 0.559 0.679 0.043  0.181  0.035  14  PRO HHH C    
327  O O    . PRO B 14  ? 0.545 0.568 0.715 0.051  0.204  0.038  14  PRO HHH O    
328  C CB   . PRO B 14  ? 0.520 0.552 0.642 0.044  0.145  0.028  14  PRO HHH CB   
329  C CG   . PRO B 14  ? 0.494 0.552 0.656 0.045  0.128  0.029  14  PRO HHH CG   
330  C CD   . PRO B 14  ? 0.479 0.563 0.704 0.045  0.133  0.034  14  PRO HHH CD   
331  H HA   . PRO B 14  ? 0.490 0.546 0.632 0.033  0.133  0.030  14  PRO HHH HA   
332  H HB2  . PRO B 14  ? 0.545 0.558 0.657 0.050  0.165  0.029  14  PRO HHH HB2  
333  H HB3  . PRO B 14  ? 0.523 0.543 0.609 0.041  0.134  0.025  14  PRO HHH HB3  
334  H HG2  . PRO B 14  ? 0.506 0.554 0.662 0.050  0.133  0.028  14  PRO HHH HG2  
335  H HG3  . PRO B 14  ? 0.478 0.544 0.631 0.040  0.108  0.027  14  PRO HHH HG3  
336  H HD2  . PRO B 14  ? 0.491 0.571 0.735 0.051  0.151  0.037  14  PRO HHH HD2  
337  H HD3  . PRO B 14  ? 0.458 0.561 0.707 0.042  0.115  0.035  14  PRO HHH HD3  
338  N N    . GLY B 15  ? 0.533 0.551 0.652 0.039  0.183  0.035  15  GLY HHH N    
339  C CA   . GLY B 15  ? 0.559 0.553 0.666 0.042  0.213  0.039  15  GLY HHH CA   
340  C C    . GLY B 15  ? 0.534 0.552 0.683 0.036  0.215  0.043  15  GLY HHH C    
341  O O    . GLY B 15  ? 0.559 0.556 0.691 0.036  0.238  0.047  15  GLY HHH O    
342  H H    . GLY B 15  ? 0.520 0.543 0.625 0.033  0.165  0.033  15  GLY HHH H    
343  H HA2  . GLY B 15  ? 0.581 0.550 0.639 0.042  0.213  0.037  15  GLY HHH HA2  
344  H HA3  . GLY B 15  ? 0.577 0.562 0.694 0.048  0.234  0.041  15  GLY HHH HA3  
345  N N    . ALA B 16  ? 0.490 0.545 0.689 0.030  0.193  0.044  16  ALA HHH N    
346  C CA   . ALA B 16  ? 0.471 0.549 0.709 0.022  0.187  0.047  16  ALA HHH CA   
347  C C    . ALA B 16  ? 0.473 0.541 0.668 0.015  0.175  0.044  16  ALA HHH C    
348  O O    . ALA B 16  ? 0.491 0.538 0.631 0.017  0.168  0.040  16  ALA HHH O    
349  C CB   . ALA B 16  ? 0.436 0.549 0.727 0.018  0.162  0.046  16  ALA HHH CB   
350  H H    . ALA B 16  ? 0.477 0.544 0.687 0.030  0.179  0.042  16  ALA HHH H    
351  H HA   . ALA B 16  ? 0.484 0.558 0.743 0.024  0.209  0.051  16  ALA HHH HA   
352  H HB1  . ALA B 16  ? 0.426 0.551 0.743 0.013  0.159  0.048  16  ALA HHH HB1  
353  H HB2  . ALA B 16  ? 0.437 0.556 0.758 0.022  0.169  0.049  16  ALA HHH HB2  
354  H HB3  . ALA B 16  ? 0.425 0.540 0.695 0.016  0.143  0.043  16  ALA HHH HB3  
355  N N    . SER B 17  ? 0.462 0.545 0.683 0.009  0.172  0.046  17  SER HHH N    
356  C CA   . SER B 17  ? 0.463 0.539 0.650 0.002  0.161  0.045  17  SER HHH CA   
357  C C    . SER B 17  ? 0.429 0.533 0.653 -0.006 0.138  0.044  17  SER HHH C    
358  O O    . SER B 17  ? 0.426 0.550 0.705 -0.008 0.140  0.047  17  SER HHH O    
359  C CB   . SER B 17  ? 0.497 0.548 0.664 0.004  0.187  0.049  17  SER HHH CB   
360  O OG   . SER B 17  ? 0.538 0.554 0.653 0.011  0.203  0.049  17  SER HHH OG   
361  H H    . SER B 17  ? 0.455 0.552 0.717 0.007  0.177  0.049  17  SER HHH H    
362  H HA   . SER B 17  ? 0.465 0.531 0.616 0.003  0.150  0.042  17  SER HHH HA   
363  H HB2  . SER B 17  ? 0.498 0.557 0.702 0.004  0.201  0.053  17  SER HHH HB2  
364  H HB3  . SER B 17  ? 0.492 0.543 0.646 -0.001 0.178  0.049  17  SER HHH HB3  
366  N N    . VAL B 18  ? 0.409 0.514 0.605 -0.011 0.117  0.040  18  VAL HHH N    
367  C CA   . VAL B 18  ? 0.383 0.507 0.601 -0.018 0.095  0.039  18  VAL HHH CA   
368  C C    . VAL B 18  ? 0.380 0.494 0.571 -0.023 0.093  0.038  18  VAL HHH C    
369  O O    . VAL B 18  ? 0.385 0.480 0.533 -0.020 0.098  0.038  18  VAL HHH O    
370  C CB   . VAL B 18  ? 0.371 0.504 0.584 -0.019 0.071  0.034  18  VAL HHH CB   
371  C CG1  . VAL B 18  ? 0.368 0.516 0.620 -0.016 0.068  0.035  18  VAL HHH CG1  
372  C CG2  . VAL B 18  ? 0.378 0.495 0.543 -0.015 0.068  0.032  18  VAL HHH CG2  
373  H H    . VAL B 18  ? 0.419 0.509 0.579 -0.009 0.116  0.039  18  VAL HHH H    
374  H HA   . VAL B 18  ? 0.379 0.514 0.634 -0.020 0.098  0.041  18  VAL HHH HA   
375  H HB   . VAL B 18  ? 0.362 0.501 0.578 -0.023 0.058  0.033  18  VAL HHH HB   
376  H HG11 . VAL B 18  ? 0.361 0.520 0.644 -0.019 0.062  0.036  18  VAL HHH HG11 
377  H HG12 . VAL B 18  ? 0.363 0.511 0.603 -0.014 0.056  0.033  18  VAL HHH HG12 
378  H HG13 . VAL B 18  ? 0.378 0.520 0.635 -0.011 0.084  0.037  18  VAL HHH HG13 
379  H HG21 . VAL B 18  ? 0.390 0.498 0.548 -0.010 0.079  0.033  18  VAL HHH HG21 
380  H HG22 . VAL B 18  ? 0.368 0.491 0.531 -0.016 0.054  0.030  18  VAL HHH HG22 
381  H HG23 . VAL B 18  ? 0.382 0.491 0.526 -0.017 0.069  0.032  18  VAL HHH HG23 
382  N N    . THR B 19  ? 0.368 0.494 0.585 -0.030 0.085  0.039  19  THR HHH N    
383  C CA   . THR B 19  ? 0.372 0.492 0.568 -0.035 0.079  0.038  19  THR HHH CA   
384  C C    . THR B 19  ? 0.353 0.482 0.555 -0.040 0.055  0.034  19  THR HHH C    
385  O O    . THR B 19  ? 0.355 0.496 0.591 -0.045 0.048  0.034  19  THR HHH O    
386  C CB   . THR B 19  ? 0.390 0.506 0.604 -0.038 0.096  0.042  19  THR HHH CB   
387  O OG1  . THR B 19  ? 0.414 0.514 0.617 -0.032 0.121  0.046  19  THR HHH OG1  
388  C CG2  . THR B 19  ? 0.394 0.501 0.585 -0.042 0.092  0.042  19  THR HHH CG2  
389  H H    . THR B 19  ? 0.363 0.501 0.612 -0.032 0.081  0.039  19  THR HHH H    
390  H HA   . THR B 19  ? 0.379 0.486 0.542 -0.032 0.081  0.038  19  THR HHH HA   
391  H HB   . THR B 19  ? 0.383 0.511 0.632 -0.041 0.093  0.043  19  THR HHH HB   
393  H HG21 . THR B 19  ? 0.383 0.498 0.588 -0.046 0.079  0.040  19  THR HHH HG21 
394  H HG22 . THR B 19  ? 0.405 0.504 0.598 -0.042 0.106  0.045  19  THR HHH HG22 
395  H HG23 . THR B 19  ? 0.396 0.494 0.555 -0.039 0.088  0.041  19  THR HHH HG23 
396  N N    . ILE B 20  ? 0.346 0.470 0.516 -0.038 0.044  0.031  20  ILE HHH N    
397  C CA   . ILE B 20  ? 0.342 0.468 0.505 -0.042 0.025  0.028  20  ILE HHH CA   
398  C C    . ILE B 20  ? 0.345 0.464 0.500 -0.046 0.026  0.028  20  ILE HHH C    
399  O O    . ILE B 20  ? 0.348 0.457 0.482 -0.044 0.036  0.030  20  ILE HHH O    
400  C CB   . ILE B 20  ? 0.337 0.459 0.472 -0.038 0.017  0.026  20  ILE HHH CB   
401  C CG1  . ILE B 20  ? 0.334 0.462 0.478 -0.034 0.015  0.025  20  ILE HHH CG1  
402  C CG2  . ILE B 20  ? 0.330 0.448 0.453 -0.041 0.004  0.023  20  ILE HHH CG2  
403  C CD1  . ILE B 20  ? 0.340 0.460 0.456 -0.029 0.015  0.025  20  ILE HHH CD1  
404  H H    . ILE B 20  ? 0.352 0.469 0.501 -0.035 0.047  0.031  20  ILE HHH H    
405  H HA   . ILE B 20  ? 0.338 0.472 0.522 -0.044 0.017  0.026  20  ILE HHH HA   
406  H HB   . ILE B 20  ? 0.341 0.455 0.459 -0.036 0.024  0.027  20  ILE HHH HB   
407  H HG12 . ILE B 20  ? 0.332 0.464 0.484 -0.035 0.004  0.023  20  ILE HHH HG12 
408  H HG13 . ILE B 20  ? 0.338 0.469 0.498 -0.033 0.023  0.027  20  ILE HHH HG13 
409  H HG21 . ILE B 20  ? 0.334 0.446 0.444 -0.042 0.007  0.024  20  ILE HHH HG21 
410  H HG22 . ILE B 20  ? 0.330 0.447 0.442 -0.039 -0.001 0.022  20  ILE HHH HG22 
411  H HG23 . ILE B 20  ? 0.333 0.453 0.469 -0.044 -0.002 0.022  20  ILE HHH HG23 
412  H HD11 . ILE B 20  ? 0.342 0.455 0.442 -0.030 0.018  0.026  20  ILE HHH HD11 
413  H HD12 . ILE B 20  ? 0.343 0.462 0.462 -0.026 0.022  0.026  20  ILE HHH HD12 
414  H HD13 . ILE B 20  ? 0.335 0.456 0.447 -0.029 0.006  0.023  20  ILE HHH HD13 
415  N N    . SER B 21  ? 0.350 0.471 0.518 -0.052 0.015  0.026  21  SER HHH N    
416  C CA   . SER B 21  ? 0.368 0.481 0.529 -0.056 0.016  0.026  21  SER HHH CA   
417  C C    . SER B 21  ? 0.382 0.486 0.518 -0.057 0.005  0.022  21  SER HHH C    
418  O O    . SER B 21  ? 0.377 0.481 0.507 -0.055 -0.006 0.020  21  SER HHH O    
419  C CB   . SER B 21  ? 0.369 0.487 0.563 -0.063 0.014  0.025  21  SER HHH CB   
420  O OG   . SER B 21  ? 0.377 0.497 0.581 -0.066 -0.006 0.022  21  SER HHH OG   
421  H H    . SER B 21  ? 0.350 0.476 0.531 -0.053 0.006  0.024  21  SER HHH H    
422  H HA   . SER B 21  ? 0.370 0.478 0.521 -0.055 0.027  0.028  21  SER HHH HA   
423  H HB2  . SER B 21  ? 0.376 0.487 0.565 -0.066 0.017  0.026  21  SER HHH HB2  
424  H HB3  . SER B 21  ? 0.371 0.495 0.584 -0.062 0.023  0.028  21  SER HHH HB3  
426  N N    . CYS B 22  ? 0.402 0.496 0.523 -0.058 0.009  0.023  22  CYS HHH N    
427  C CA   . CYS B 22  ? 0.419 0.501 0.518 -0.058 0.003  0.020  22  CYS HHH CA   
428  C C    . CYS B 22  ? 0.414 0.486 0.514 -0.063 0.004  0.020  22  CYS HHH C    
429  O O    . CYS B 22  ? 0.406 0.474 0.501 -0.062 0.014  0.023  22  CYS HHH O    
430  C CB   . CYS B 22  ? 0.446 0.525 0.526 -0.052 0.009  0.023  22  CYS HHH CB   
431  S SG   . CYS B 22  ? 0.487 0.552 0.546 -0.051 0.006  0.022  22  CYS HHH SG   
432  H H    . CYS B 22  ? 0.403 0.496 0.527 -0.058 0.017  0.025  22  CYS HHH H    
433  H HA   . CYS B 22  ? 0.422 0.502 0.518 -0.058 -0.006 0.018  22  CYS HHH HA   
434  H HB2  . CYS B 22  ? 0.440 0.525 0.521 -0.050 0.008  0.024  22  CYS HHH HB2  
435  H HB3  . CYS B 22  ? 0.446 0.524 0.526 -0.052 0.015  0.026  22  CYS HHH HB3  
436  N N    . LYS B 23  ? 0.419 0.483 0.521 -0.068 -0.007 0.015  23  LYS HHH N    
437  C CA   . LYS B 23  ? 0.431 0.481 0.530 -0.073 -0.009 0.013  23  LYS HHH CA   
438  C C    . LYS B 23  ? 0.426 0.457 0.493 -0.070 -0.008 0.011  23  LYS HHH C    
439  O O    . LYS B 23  ? 0.429 0.453 0.479 -0.067 -0.014 0.009  23  LYS HHH O    
440  C CB   . LYS B 23  ? 0.462 0.508 0.575 -0.080 -0.026 0.009  23  LYS HHH CB   
441  C CG   . LYS B 23  ? 0.493 0.522 0.605 -0.087 -0.031 0.006  23  LYS HHH CG   
442  C CD   . LYS B 23  ? 0.500 0.541 0.652 -0.093 -0.029 0.008  23  LYS HHH CD   
443  C CE   . LYS B 23  ? 0.528 0.553 0.680 -0.100 -0.030 0.006  23  LYS HHH CE   
444  N NZ   . LYS B 23  ? 0.559 0.567 0.709 -0.107 -0.053 -0.000 23  LYS HHH NZ   
445  H H    . LYS B 23  ? 0.421 0.488 0.527 -0.068 -0.016 0.013  23  LYS HHH H    
446  H HA   . LYS B 23  ? 0.429 0.482 0.537 -0.074 -0.001 0.016  23  LYS HHH HA   
447  H HB2  . LYS B 23  ? 0.452 0.512 0.590 -0.081 -0.026 0.010  23  LYS HHH HB2  
448  H HB3  . LYS B 23  ? 0.467 0.507 0.567 -0.079 -0.035 0.006  23  LYS HHH HB3  
449  H HG2  . LYS B 23  ? 0.508 0.525 0.610 -0.089 -0.044 0.002  23  LYS HHH HG2  
450  H HG3  . LYS B 23  ? 0.495 0.516 0.592 -0.085 -0.022 0.006  23  LYS HHH HG3  
451  H HD2  . LYS B 23  ? 0.487 0.539 0.648 -0.090 -0.015 0.012  23  LYS HHH HD2  
452  H HD3  . LYS B 23  ? 0.499 0.548 0.671 -0.096 -0.039 0.007  23  LYS HHH HD3  
453  H HE2  . LYS B 23  ? 0.532 0.546 0.659 -0.097 -0.023 0.006  23  LYS HHH HE2  
454  H HE3  . LYS B 23  ? 0.522 0.555 0.697 -0.103 -0.022 0.009  23  LYS HHH HE3  
455  H HZ1  . LYS B 23  ? 0.553 0.572 0.729 -0.110 -0.061 0.000  23  LYS HHH HZ1  
456  H HZ2  . LYS B 23  ? 0.569 0.566 0.717 -0.111 -0.054 -0.002 23  LYS HHH HZ2  
457  H HZ3  . LYS B 23  ? 0.566 0.563 0.691 -0.105 -0.060 -0.003 23  LYS HHH HZ3  
458  N N    . THR B 24  ? 0.417 0.440 0.478 -0.069 0.002  0.013  24  THR HHH N    
459  C CA   . THR B 24  ? 0.426 0.430 0.462 -0.066 0.008  0.013  24  THR HHH CA   
460  C C    . THR B 24  ? 0.445 0.427 0.469 -0.071 0.003  0.008  24  THR HHH C    
461  O O    . THR B 24  ? 0.450 0.434 0.491 -0.078 -0.002 0.007  24  THR HHH O    
462  C CB   . THR B 24  ? 0.415 0.424 0.453 -0.061 0.021  0.019  24  THR HHH CB   
463  O OG1  . THR B 24  ? 0.421 0.433 0.473 -0.065 0.025  0.021  24  THR HHH OG1  
464  C CG2  . THR B 24  ? 0.395 0.420 0.438 -0.056 0.023  0.023  24  THR HHH CG2  
465  H H    . THR B 24  ? 0.416 0.443 0.488 -0.071 0.007  0.016  24  THR HHH H    
466  H HA   . THR B 24  ? 0.428 0.429 0.452 -0.063 0.005  0.012  24  THR HHH HA   
467  H HB   . THR B 24  ? 0.426 0.422 0.452 -0.059 0.025  0.019  24  THR HHH HB   
469  H HG21 . THR B 24  ? 0.397 0.419 0.432 -0.052 0.023  0.023  24  THR HHH HG21 
470  H HG22 . THR B 24  ? 0.391 0.419 0.439 -0.054 0.028  0.027  24  THR HHH HG22 
471  H HG23 . THR B 24  ? 0.389 0.424 0.441 -0.057 0.018  0.022  24  THR HHH HG23 
472  N N    . SER B 25  ? 0.463 0.421 0.460 -0.068 0.007  0.006  25  SER HHH N    
473  C CA   . SER B 25  ? 0.496 0.424 0.472 -0.072 0.004  0.001  25  SER HHH CA   
474  C C    . SER B 25  ? 0.518 0.422 0.466 -0.065 0.018  0.001  25  SER HHH C    
475  O O    . SER B 25  ? 0.516 0.421 0.455 -0.059 0.024  0.003  25  SER HHH O    
476  C CB   . SER B 25  ? 0.517 0.430 0.481 -0.078 -0.015 -0.006 25  SER HHH CB   
477  O OG   . SER B 25  ? 0.530 0.430 0.466 -0.073 -0.017 -0.008 25  SER HHH OG   
478  H H    . SER B 25  ? 0.462 0.419 0.450 -0.063 0.013  0.008  25  SER HHH H    
479  H HA   . SER B 25  ? 0.494 0.425 0.483 -0.075 0.006  0.002  25  SER HHH HA   
480  H HB2  . SER B 25  ? 0.539 0.433 0.492 -0.082 -0.019 -0.010 25  SER HHH HB2  
481  H HB3  . SER B 25  ? 0.503 0.434 0.490 -0.081 -0.023 -0.006 25  SER HHH HB3  
483  N N    . GLY B 26  ? 0.543 0.426 0.480 -0.067 0.025  -0.000 26  GLY HHH N    
484  C CA   . GLY B 26  ? 0.572 0.425 0.481 -0.060 0.040  -0.001 26  GLY HHH CA   
485  C C    . GLY B 26  ? 0.553 0.419 0.482 -0.053 0.058  0.007  26  GLY HHH C    
486  O O    . GLY B 26  ? 0.569 0.418 0.484 -0.046 0.073  0.009  26  GLY HHH O    
487  H H    . GLY B 26  ? 0.542 0.427 0.490 -0.071 0.022  -0.001 26  GLY HHH H    
488  H HA2  . GLY B 26  ? 0.596 0.426 0.490 -0.064 0.037  -0.005 26  GLY HHH HA2  
489  H HA3  . GLY B 26  ? 0.582 0.425 0.474 -0.057 0.040  -0.002 26  GLY HHH HA3  
490  N N    . TYR B 27  ? 0.524 0.416 0.483 -0.055 0.056  0.012  27  TYR HHH N    
491  C CA   . TYR B 27  ? 0.508 0.414 0.487 -0.049 0.068  0.021  27  TYR HHH CA   
492  C C    . TYR B 27  ? 0.496 0.422 0.497 -0.053 0.063  0.024  27  TYR HHH C    
493  O O    . TYR B 27  ? 0.479 0.419 0.487 -0.059 0.052  0.022  27  TYR HHH O    
494  C CB   . TYR B 27  ? 0.488 0.408 0.475 -0.042 0.072  0.026  27  TYR HHH CB   
495  C CG   . TYR B 27  ? 0.457 0.406 0.461 -0.043 0.062  0.028  27  TYR HHH CG   
496  C CD1  . TYR B 27  ? 0.440 0.406 0.464 -0.041 0.062  0.035  27  TYR HHH CD1  
497  C CD2  . TYR B 27  ? 0.451 0.406 0.449 -0.046 0.052  0.024  27  TYR HHH CD2  
498  C CE1  . TYR B 27  ? 0.425 0.411 0.459 -0.042 0.054  0.037  27  TYR HHH CE1  
499  C CE2  . TYR B 27  ? 0.428 0.407 0.441 -0.047 0.045  0.026  27  TYR HHH CE2  
500  C CZ   . TYR B 27  ? 0.415 0.409 0.445 -0.045 0.046  0.032  27  TYR HHH CZ   
501  O OH   . TYR B 27  ? 0.394 0.406 0.433 -0.045 0.040  0.034  27  TYR HHH OH   
502  H H    . TYR B 27  ? 0.518 0.419 0.486 -0.060 0.048  0.011  27  TYR HHH H    
503  H HA   . TYR B 27  ? 0.524 0.413 0.496 -0.047 0.077  0.021  27  TYR HHH HA   
504  H HB2  . TYR B 27  ? 0.487 0.407 0.483 -0.037 0.081  0.031  27  TYR HHH HB2  
505  H HB3  . TYR B 27  ? 0.501 0.409 0.473 -0.041 0.074  0.022  27  TYR HHH HB3  
506  H HD1  . TYR B 27  ? 0.444 0.406 0.473 -0.039 0.067  0.038  27  TYR HHH HD1  
507  H HD2  . TYR B 27  ? 0.467 0.408 0.449 -0.048 0.050  0.019  27  TYR HHH HD2  
508  H HE1  . TYR B 27  ? 0.415 0.409 0.458 -0.041 0.053  0.041  27  TYR HHH HE1  
509  H HE2  . TYR B 27  ? 0.426 0.409 0.436 -0.049 0.038  0.023  27  TYR HHH HE2  
511  N N    . ASN B 28  ? 0.510 0.437 0.521 -0.050 0.071  0.030  28  ASN HHH N    
512  C CA   . ASN B 28  ? 0.510 0.452 0.537 -0.052 0.069  0.036  28  ASN HHH CA   
513  C C    . ASN B 28  ? 0.486 0.450 0.523 -0.050 0.063  0.039  28  ASN HHH C    
514  O O    . ASN B 28  ? 0.476 0.445 0.518 -0.043 0.065  0.045  28  ASN HHH O    
515  C CB   . ASN B 28  ? 0.536 0.468 0.567 -0.048 0.077  0.042  28  ASN HHH CB   
516  C CG   . ASN B 28  ? 0.552 0.492 0.593 -0.050 0.077  0.048  28  ASN HHH CG   
517  O OD1  . ASN B 28  ? 0.541 0.495 0.585 -0.051 0.072  0.049  28  ASN HHH OD1  
518  N ND2  . ASN B 28  ? 0.592 0.518 0.632 -0.049 0.083  0.051  28  ASN HHH ND2  
519  H H    . ASN B 28  ? 0.518 0.434 0.527 -0.046 0.078  0.032  28  ASN HHH H    
520  H HA   . ASN B 28  ? 0.515 0.454 0.542 -0.058 0.065  0.032  28  ASN HHH HA   
521  H HB2  . ASN B 28  ? 0.552 0.469 0.576 -0.049 0.082  0.039  28  ASN HHH HB2  
522  H HB3  . ASN B 28  ? 0.532 0.467 0.568 -0.042 0.080  0.046  28  ASN HHH HB3  
524  N N    . PHE B 29  ? 0.476 0.451 0.518 -0.055 0.057  0.037  29  PHE HHH N    
525  C CA   . PHE B 29  ? 0.461 0.454 0.509 -0.053 0.053  0.040  29  PHE HHH CA   
526  C C    . PHE B 29  ? 0.454 0.449 0.502 -0.047 0.055  0.048  29  PHE HHH C    
527  O O    . PHE B 29  ? 0.447 0.453 0.497 -0.044 0.050  0.050  29  PHE HHH O    
528  C CB   . PHE B 29  ? 0.461 0.462 0.517 -0.060 0.051  0.038  29  PHE HHH CB   
529  C CG   . PHE B 29  ? 0.449 0.465 0.509 -0.058 0.048  0.039  29  PHE HHH CG   
530  C CD1  . PHE B 29  ? 0.445 0.469 0.504 -0.057 0.041  0.035  29  PHE HHH CD1  
531  C CD2  . PHE B 29  ? 0.448 0.466 0.510 -0.058 0.054  0.044  29  PHE HHH CD2  
532  C CE1  . PHE B 29  ? 0.439 0.475 0.502 -0.055 0.039  0.036  29  PHE HHH CE1  
533  C CE2  . PHE B 29  ? 0.447 0.474 0.509 -0.056 0.053  0.045  29  PHE HHH CE2  
534  C CZ   . PHE B 29  ? 0.441 0.479 0.505 -0.055 0.045  0.041  29  PHE HHH CZ   
535  H H    . PHE B 29  ? 0.483 0.455 0.525 -0.060 0.056  0.034  29  PHE HHH H    
536  H HA   . PHE B 29  ? 0.456 0.453 0.501 -0.052 0.049  0.037  29  PHE HHH HA   
537  H HB2  . PHE B 29  ? 0.465 0.463 0.523 -0.064 0.048  0.033  29  PHE HHH HB2  
538  H HB3  . PHE B 29  ? 0.467 0.463 0.525 -0.061 0.056  0.041  29  PHE HHH HB3  
539  H HD1  . PHE B 29  ? 0.447 0.467 0.501 -0.057 0.039  0.032  29  PHE HHH HD1  
540  H HD2  . PHE B 29  ? 0.459 0.470 0.520 -0.059 0.059  0.047  29  PHE HHH HD2  
541  H HE1  . PHE B 29  ? 0.432 0.473 0.494 -0.054 0.035  0.034  29  PHE HHH HE1  
542  H HE2  . PHE B 29  ? 0.452 0.478 0.512 -0.055 0.058  0.048  29  PHE HHH HE2  
543  H HZ   . PHE B 29  ? 0.435 0.479 0.500 -0.053 0.045  0.041  29  PHE HHH HZ   
544  N N    . SER B 30  ? 0.457 0.443 0.505 -0.046 0.059  0.053  30  SER HHH N    
545  C CA   . SER B 30  ? 0.455 0.439 0.501 -0.041 0.058  0.061  30  SER HHH CA   
546  C C    . SER B 30  ? 0.449 0.431 0.503 -0.034 0.056  0.065  30  SER HHH C    
547  O O    . SER B 30  ? 0.449 0.430 0.505 -0.030 0.051  0.073  30  SER HHH O    
548  C CB   . SER B 30  ? 0.471 0.442 0.514 -0.043 0.064  0.065  30  SER HHH CB   
549  O OG   . SER B 30  ? 0.481 0.454 0.522 -0.049 0.068  0.063  30  SER HHH OG   
550  H H    . SER B 30  ? 0.465 0.443 0.513 -0.049 0.063  0.051  30  SER HHH H    
551  H HA   . SER B 30  ? 0.451 0.441 0.494 -0.041 0.054  0.062  30  SER HHH HA   
552  H HB2  . SER B 30  ? 0.478 0.442 0.523 -0.043 0.068  0.064  30  SER HHH HB2  
553  H HB3  . SER B 30  ? 0.479 0.445 0.517 -0.039 0.062  0.071  30  SER HHH HB3  
555  N N    . HIS B 31  ? 0.442 0.423 0.501 -0.033 0.060  0.061  31  HIS HHH N    
556  C CA   . HIS B 31  ? 0.442 0.421 0.514 -0.027 0.063  0.066  31  HIS HHH CA   
557  C C    . HIS B 31  ? 0.427 0.420 0.509 -0.024 0.055  0.068  31  HIS HHH C    
558  O O    . HIS B 31  ? 0.424 0.419 0.525 -0.018 0.053  0.075  31  HIS HHH O    
559  C CB   . HIS B 31  ? 0.452 0.418 0.521 -0.026 0.074  0.062  31  HIS HHH CB   
560  C CG   . HIS B 31  ? 0.468 0.418 0.535 -0.026 0.082  0.063  31  HIS HHH CG   
561  N ND1  . HIS B 31  ? 0.481 0.414 0.549 -0.022 0.094  0.063  31  HIS HHH ND1  
562  C CD2  . HIS B 31  ? 0.473 0.418 0.536 -0.029 0.080  0.066  31  HIS HHH CD2  
563  C CE1  . HIS B 31  ? 0.497 0.418 0.563 -0.023 0.098  0.065  31  HIS HHH CE1  
564  N NE2  . HIS B 31  ? 0.491 0.419 0.554 -0.027 0.089  0.067  31  HIS HHH NE2  
565  H H    . HIS B 31  ? 0.443 0.423 0.498 -0.037 0.062  0.056  31  HIS HHH H    
566  H HA   . HIS B 31  ? 0.447 0.422 0.524 -0.024 0.062  0.072  31  HIS HHH HA   
567  H HB2  . HIS B 31  ? 0.453 0.417 0.511 -0.030 0.074  0.055  31  HIS HHH HB2  
568  H HB3  . HIS B 31  ? 0.452 0.417 0.530 -0.022 0.078  0.064  31  HIS HHH HB3  
570  H HD2  . HIS B 31  ? 0.469 0.421 0.529 -0.032 0.075  0.066  31  HIS HHH HD2  
571  H HE1  . HIS B 31  ? 0.509 0.417 0.575 -0.020 0.106  0.065  31  HIS HHH HE1  
573  N N    . PHE B 32  ? 0.413 0.415 0.486 -0.027 0.051  0.063  32  PHE HHH N    
574  C CA   . PHE B 32  ? 0.399 0.412 0.479 -0.025 0.045  0.063  32  PHE HHH CA   
575  C C    . PHE B 32  ? 0.390 0.412 0.460 -0.028 0.036  0.061  32  PHE HHH C    
576  O O    . PHE B 32  ? 0.389 0.411 0.449 -0.033 0.038  0.056  32  PHE HHH O    
577  C CB   . PHE B 32  ? 0.399 0.410 0.477 -0.025 0.052  0.058  32  PHE HHH CB   
578  C CG   . PHE B 32  ? 0.408 0.407 0.494 -0.021 0.064  0.060  32  PHE HHH CG   
579  C CD1  . PHE B 32  ? 0.406 0.408 0.515 -0.015 0.068  0.067  32  PHE HHH CD1  
580  C CD2  . PHE B 32  ? 0.422 0.403 0.492 -0.023 0.073  0.055  32  PHE HHH CD2  
581  C CE1  . PHE B 32  ? 0.418 0.407 0.536 -0.010 0.083  0.069  32  PHE HHH CE1  
582  C CE2  . PHE B 32  ? 0.436 0.402 0.509 -0.018 0.087  0.057  32  PHE HHH CE2  
583  C CZ   . PHE B 32  ? 0.434 0.403 0.530 -0.012 0.094  0.064  32  PHE HHH CZ   
584  H H    . PHE B 32  ? 0.414 0.416 0.478 -0.031 0.051  0.058  32  PHE HHH H    
585  H HA   . PHE B 32  ? 0.399 0.413 0.492 -0.021 0.042  0.069  32  PHE HHH HA   
586  H HB2  . PHE B 32  ? 0.400 0.409 0.466 -0.029 0.052  0.053  32  PHE HHH HB2  
587  H HB3  . PHE B 32  ? 0.391 0.409 0.474 -0.024 0.048  0.059  32  PHE HHH HB3  
588  H HD1  . PHE B 32  ? 0.397 0.409 0.517 -0.014 0.060  0.070  32  PHE HHH HD1  
589  H HD2  . PHE B 32  ? 0.424 0.404 0.482 -0.028 0.070  0.051  32  PHE HHH HD2  
590  H HE1  . PHE B 32  ? 0.416 0.408 0.556 -0.006 0.087  0.075  32  PHE HHH HE1  
591  H HE2  . PHE B 32  ? 0.451 0.402 0.509 -0.020 0.093  0.053  32  PHE HHH HE2  
592  H HZ   . PHE B 32  ? 0.447 0.404 0.547 -0.008 0.106  0.066  32  PHE HHH HZ   
593  N N    . ALA B 33  ? 0.381 0.408 0.457 -0.026 0.026  0.066  33  ALA HHH N    
594  C CA   . ALA B 33  ? 0.378 0.409 0.442 -0.027 0.018  0.064  33  ALA HHH CA   
595  C C    . ALA B 33  ? 0.368 0.408 0.430 -0.030 0.021  0.057  33  ALA HHH C    
596  O O    . ALA B 33  ? 0.371 0.412 0.440 -0.029 0.025  0.055  33  ALA HHH O    
597  C CB   . ALA B 33  ? 0.379 0.411 0.451 -0.024 0.005  0.070  33  ALA HHH CB   
598  H H    . ALA B 33  ? 0.383 0.410 0.471 -0.022 0.023  0.070  33  ALA HHH H    
599  H HA   . ALA B 33  ? 0.386 0.412 0.439 -0.028 0.019  0.064  33  ALA HHH HA   
600  H HB1  . ALA B 33  ? 0.379 0.413 0.442 -0.024 0.001  0.068  33  ALA HHH HB1  
601  H HB2  . ALA B 33  ? 0.389 0.414 0.460 -0.022 0.001  0.074  33  ALA HHH HB2  
602  H HB3  . ALA B 33  ? 0.373 0.410 0.460 -0.022 0.006  0.071  33  ALA HHH HB3  
603  N N    . ILE B 34  ? 0.368 0.411 0.419 -0.032 0.019  0.054  34  ILE HHH N    
604  C CA   . ILE B 34  ? 0.355 0.406 0.405 -0.034 0.019  0.048  34  ILE HHH CA   
605  C C    . ILE B 34  ? 0.351 0.405 0.397 -0.032 0.011  0.050  34  ILE HHH C    
606  O O    . ILE B 34  ? 0.358 0.406 0.394 -0.031 0.008  0.052  34  ILE HHH O    
607  C CB   . ILE B 34  ? 0.356 0.409 0.402 -0.038 0.023  0.044  34  ILE HHH CB   
608  C CG1  . ILE B 34  ? 0.358 0.405 0.407 -0.041 0.029  0.042  34  ILE HHH CG1  
609  C CG2  . ILE B 34  ? 0.351 0.413 0.399 -0.039 0.021  0.040  34  ILE HHH CG2  
610  C CD1  . ILE B 34  ? 0.358 0.403 0.407 -0.042 0.028  0.038  34  ILE HHH CD1  
611  H H    . ILE B 34  ? 0.374 0.412 0.417 -0.032 0.019  0.055  34  ILE HHH H    
612  H HA   . ILE B 34  ? 0.352 0.404 0.406 -0.034 0.020  0.047  34  ILE HHH HA   
613  H HB   . ILE B 34  ? 0.363 0.412 0.403 -0.038 0.024  0.047  34  ILE HHH HB   
614  H HG12 . ILE B 34  ? 0.364 0.406 0.413 -0.040 0.031  0.046  34  ILE HHH HG12 
615  H HG13 . ILE B 34  ? 0.360 0.409 0.411 -0.044 0.031  0.040  34  ILE HHH HG13 
616  H HG21 . ILE B 34  ? 0.351 0.414 0.395 -0.038 0.019  0.041  34  ILE HHH HG21 
617  H HG22 . ILE B 34  ? 0.351 0.414 0.402 -0.042 0.023  0.037  34  ILE HHH HG22 
618  H HG23 . ILE B 34  ? 0.347 0.410 0.395 -0.038 0.018  0.039  34  ILE HHH HG23 
619  H HD11 . ILE B 34  ? 0.354 0.404 0.403 -0.043 0.025  0.035  34  ILE HHH HD11 
620  H HD12 . ILE B 34  ? 0.364 0.403 0.413 -0.044 0.031  0.036  34  ILE HHH HD12 
621  H HD13 . ILE B 34  ? 0.357 0.401 0.407 -0.039 0.029  0.040  34  ILE HHH HD13 
622  N N    . ASN B 35  ? 0.339 0.400 0.393 -0.031 0.008  0.048  35  ASN HHH N    
623  C CA   . ASN B 35  ? 0.339 0.402 0.391 -0.029 -0.000 0.049  35  ASN HHH CA   
624  C C    . ASN B 35  ? 0.337 0.407 0.384 -0.030 0.001  0.043  35  ASN HHH C    
625  O O    . ASN B 35  ? 0.340 0.413 0.390 -0.032 0.006  0.040  35  ASN HHH O    
626  C CB   . ASN B 35  ? 0.330 0.396 0.399 -0.027 -0.004 0.052  35  ASN HHH CB   
627  C CG   . ASN B 35  ? 0.329 0.390 0.410 -0.025 -0.008 0.059  35  ASN HHH CG   
628  O OD1  . ASN B 35  ? 0.325 0.385 0.413 -0.024 -0.019 0.063  35  ASN HHH OD1  
629  N ND2  . ASN B 35  ? 0.333 0.391 0.417 -0.025 -0.000 0.060  35  ASN HHH ND2  
630  H H    . ASN B 35  ? 0.337 0.399 0.395 -0.031 0.011  0.047  35  ASN HHH H    
631  H HA   . ASN B 35  ? 0.347 0.405 0.391 -0.028 -0.004 0.051  35  ASN HHH HA   
632  H HB2  . ASN B 35  ? 0.325 0.394 0.399 -0.027 0.002  0.050  35  ASN HHH HB2  
633  H HB3  . ASN B 35  ? 0.328 0.396 0.396 -0.027 -0.009 0.052  35  ASN HHH HB3  
636  N N    . TRP B 36  ? 0.352 0.420 0.390 -0.029 -0.004 0.043  36  TRP HHH N    
637  C CA   . TRP B 36  ? 0.355 0.429 0.391 -0.029 -0.003 0.039  36  TRP HHH CA   
638  C C    . TRP B 36  ? 0.372 0.447 0.411 -0.028 -0.010 0.039  36  TRP HHH C    
639  O O    . TRP B 36  ? 0.389 0.456 0.423 -0.027 -0.018 0.042  36  TRP HHH O    
640  C CB   . TRP B 36  ? 0.360 0.429 0.385 -0.029 0.001  0.038  36  TRP HHH CB   
641  C CG   . TRP B 36  ? 0.351 0.421 0.380 -0.031 0.010  0.037  36  TRP HHH CG   
642  C CD1  . TRP B 36  ? 0.360 0.422 0.383 -0.032 0.015  0.040  36  TRP HHH CD1  
643  C CD2  . TRP B 36  ? 0.340 0.420 0.383 -0.034 0.013  0.034  36  TRP HHH CD2  
644  N NE1  . TRP B 36  ? 0.359 0.426 0.393 -0.035 0.022  0.039  36  TRP HHH NE1  
645  C CE2  . TRP B 36  ? 0.345 0.423 0.393 -0.036 0.020  0.035  36  TRP HHH CE2  
646  C CE3  . TRP B 36  ? 0.332 0.421 0.383 -0.034 0.009  0.030  36  TRP HHH CE3  
647  C CZ2  . TRP B 36  ? 0.341 0.426 0.405 -0.040 0.022  0.032  36  TRP HHH CZ2  
648  C CZ3  . TRP B 36  ? 0.333 0.428 0.398 -0.037 0.010  0.028  36  TRP HHH CZ3  
649  C CH2  . TRP B 36  ? 0.336 0.430 0.409 -0.040 0.016  0.029  36  TRP HHH CH2  
650  H H    . TRP B 36  ? 0.359 0.421 0.392 -0.028 -0.008 0.045  36  TRP HHH H    
651  H HA   . TRP B 36  ? 0.351 0.429 0.392 -0.031 0.000  0.037  36  TRP HHH HA   
652  H HB2  . TRP B 36  ? 0.370 0.429 0.384 -0.028 -0.001 0.040  36  TRP HHH HB2  
653  H HB3  . TRP B 36  ? 0.357 0.429 0.382 -0.028 0.001  0.036  36  TRP HHH HB3  
654  H HD1  . TRP B 36  ? 0.370 0.423 0.384 -0.031 0.012  0.043  36  TRP HHH HD1  
655  H HE1  . TRP B 36  ? 0.365 0.427 0.398 -0.036 0.027  0.040  36  TRP HHH HE1  
656  H HE3  . TRP B 36  ? 0.330 0.420 0.379 -0.032 0.006  0.030  36  TRP HHH HE3  
657  H HZ2  . TRP B 36  ? 0.346 0.429 0.415 -0.042 0.027  0.033  36  TRP HHH HZ2  
658  H HZ3  . TRP B 36  ? 0.329 0.427 0.399 -0.037 0.006  0.026  36  TRP HHH HZ3  
659  H HH2  . TRP B 36  ? 0.335 0.433 0.420 -0.043 0.014  0.027  36  TRP HHH HH2  
660  N N    . VAL B 37  ? 0.379 0.460 0.423 -0.028 -0.009 0.037  37  VAL HHH N    
661  C CA   . VAL B 37  ? 0.386 0.468 0.435 -0.027 -0.014 0.037  37  VAL HHH CA   
662  C C    . VAL B 37  ? 0.398 0.483 0.442 -0.026 -0.013 0.033  37  VAL HHH C    
663  O O    . VAL B 37  ? 0.396 0.485 0.441 -0.027 -0.010 0.031  37  VAL HHH O    
664  C CB   . VAL B 37  ? 0.388 0.470 0.449 -0.026 -0.010 0.040  37  VAL HHH CB   
665  C CG1  . VAL B 37  ? 0.392 0.475 0.459 -0.025 -0.011 0.040  37  VAL HHH CG1  
666  C CG2  . VAL B 37  ? 0.393 0.473 0.465 -0.026 -0.012 0.045  37  VAL HHH CG2  
667  H H    . VAL B 37  ? 0.375 0.459 0.420 -0.029 -0.006 0.034  37  VAL HHH H    
668  H HA   . VAL B 37  ? 0.392 0.471 0.439 -0.026 -0.019 0.039  37  VAL HHH HA   
669  H HB   . VAL B 37  ? 0.389 0.471 0.446 -0.027 -0.005 0.038  37  VAL HHH HB   
670  H HG11 . VAL B 37  ? 0.390 0.473 0.450 -0.025 -0.009 0.038  37  VAL HHH HG11 
671  H HG12 . VAL B 37  ? 0.390 0.472 0.467 -0.025 -0.008 0.043  37  VAL HHH HG12 
672  H HG13 . VAL B 37  ? 0.391 0.474 0.457 -0.025 -0.017 0.041  37  VAL HHH HG13 
673  H HG21 . VAL B 37  ? 0.394 0.473 0.469 -0.026 -0.019 0.047  37  VAL HHH HG21 
674  H HG22 . VAL B 37  ? 0.391 0.471 0.473 -0.026 -0.007 0.047  37  VAL HHH HG22 
675  H HG23 . VAL B 37  ? 0.394 0.473 0.462 -0.027 -0.010 0.045  37  VAL HHH HG23 
676  N N    . ARG B 38  ? 0.415 0.498 0.455 -0.025 -0.018 0.033  38  ARG HHH N    
677  C CA   . ARG B 38  ? 0.419 0.505 0.457 -0.023 -0.017 0.029  38  ARG HHH CA   
678  C C    . ARG B 38  ? 0.411 0.497 0.452 -0.023 -0.021 0.030  38  ARG HHH C    
679  O O    . ARG B 38  ? 0.399 0.482 0.447 -0.023 -0.024 0.033  38  ARG HHH O    
680  C CB   . ARG B 38  ? 0.443 0.525 0.471 -0.022 -0.017 0.028  38  ARG HHH CB   
681  C CG   . ARG B 38  ? 0.474 0.546 0.493 -0.020 -0.023 0.028  38  ARG HHH CG   
682  C CD   . ARG B 38  ? 0.508 0.573 0.515 -0.018 -0.018 0.025  38  ARG HHH CD   
683  N NE   . ARG B 38  ? 0.542 0.595 0.536 -0.016 -0.025 0.024  38  ARG HHH NE   
684  C CZ   . ARG B 38  ? 0.574 0.612 0.550 -0.014 -0.021 0.022  38  ARG HHH CZ   
685  N NH1  . ARG B 38  ? 0.589 0.626 0.561 -0.011 -0.009 0.022  38  ARG HHH NH1  
686  N NH2  . ARG B 38  ? 0.591 0.615 0.553 -0.013 -0.029 0.021  38  ARG HHH NH2  
687  H H    . ARG B 38  ? 0.417 0.496 0.456 -0.025 -0.022 0.034  38  ARG HHH H    
688  H HA   . ARG B 38  ? 0.416 0.507 0.457 -0.024 -0.015 0.028  38  ARG HHH HA   
689  H HB2  . ARG B 38  ? 0.442 0.529 0.473 -0.021 -0.014 0.026  38  ARG HHH HB2  
690  H HB3  . ARG B 38  ? 0.449 0.528 0.473 -0.022 -0.014 0.028  38  ARG HHH HB3  
691  H HG2  . ARG B 38  ? 0.480 0.546 0.494 -0.021 -0.027 0.030  38  ARG HHH HG2  
692  H HG3  . ARG B 38  ? 0.469 0.544 0.493 -0.021 -0.025 0.028  38  ARG HHH HG3  
693  H HD2  . ARG B 38  ? 0.501 0.574 0.515 -0.017 -0.015 0.024  38  ARG HHH HD2  
694  H HD3  . ARG B 38  ? 0.515 0.576 0.515 -0.017 -0.014 0.026  38  ARG HHH HD3  
695  H HE   . ARG B 38  ? 0.538 0.592 0.537 -0.018 -0.031 0.025  38  ARG HHH HE   
696  H HH11 . ARG B 38  ? 0.576 0.622 0.559 -0.012 -0.005 0.022  38  ARG HHH HH11 
697  H HH12 . ARG B 38  ? 0.600 0.625 0.559 -0.009 -0.005 0.020  38  ARG HHH HH12 
698  H HH21 . ARG B 38  ? 0.585 0.611 0.554 -0.015 -0.037 0.022  38  ARG HHH HH21 
699  H HH22 . ARG B 38  ? 0.605 0.617 0.552 -0.011 -0.026 0.020  38  ARG HHH HH22 
700  N N    . GLN B 39  ? 0.412 0.499 0.452 -0.021 -0.020 0.028  39  GLN HHH N    
701  C CA   . GLN B 39  ? 0.410 0.495 0.451 -0.020 -0.022 0.029  39  GLN HHH CA   
702  C C    . GLN B 39  ? 0.415 0.501 0.452 -0.018 -0.024 0.026  39  GLN HHH C    
703  O O    . GLN B 39  ? 0.400 0.489 0.437 -0.017 -0.024 0.025  39  GLN HHH O    
704  C CB   . GLN B 39  ? 0.411 0.492 0.450 -0.020 -0.018 0.030  39  GLN HHH CB   
705  C CG   . GLN B 39  ? 0.416 0.490 0.453 -0.019 -0.016 0.032  39  GLN HHH CG   
706  C CD   . GLN B 39  ? 0.426 0.490 0.459 -0.019 -0.008 0.034  39  GLN HHH CD   
707  O OE1  . GLN B 39  ? 0.437 0.494 0.457 -0.018 -0.006 0.033  39  GLN HHH OE1  
708  N NE2  . GLN B 39  ? 0.432 0.493 0.476 -0.018 -0.002 0.039  39  GLN HHH NE2  
709  H H    . GLN B 39  ? 0.410 0.501 0.450 -0.021 -0.019 0.026  39  GLN HHH H    
710  H HA   . GLN B 39  ? 0.411 0.494 0.456 -0.021 -0.023 0.031  39  GLN HHH HA   
711  H HB2  . GLN B 39  ? 0.411 0.491 0.453 -0.021 -0.014 0.031  39  GLN HHH HB2  
712  H HB3  . GLN B 39  ? 0.413 0.495 0.447 -0.020 -0.018 0.028  39  GLN HHH HB3  
713  H HG2  . GLN B 39  ? 0.419 0.492 0.450 -0.017 -0.019 0.030  39  GLN HHH HG2  
714  H HG3  . GLN B 39  ? 0.414 0.489 0.458 -0.019 -0.017 0.033  39  GLN HHH HG3  
717  N N    . ALA B 40  ? 0.428 0.509 0.462 -0.017 -0.027 0.026  40  ALA HHH N    
718  C CA   . ALA B 40  ? 0.441 0.521 0.472 -0.014 -0.028 0.024  40  ALA HHH CA   
719  C C    . ALA B 40  ? 0.448 0.526 0.480 -0.013 -0.029 0.025  40  ALA HHH C    
720  O O    . ALA B 40  ? 0.437 0.512 0.471 -0.014 -0.028 0.028  40  ALA HHH O    
721  C CB   . ALA B 40  ? 0.451 0.521 0.474 -0.013 -0.030 0.023  40  ALA HHH CB   
722  H H    . ALA B 40  ? 0.430 0.508 0.464 -0.018 -0.029 0.027  40  ALA HHH H    
723  H HA   . ALA B 40  ? 0.440 0.523 0.472 -0.012 -0.025 0.022  40  ALA HHH HA   
724  H HB1  . ALA B 40  ? 0.455 0.522 0.475 -0.011 -0.031 0.022  40  ALA HHH HB1  
725  H HB2  . ALA B 40  ? 0.456 0.524 0.473 -0.012 -0.028 0.022  40  ALA HHH HB2  
726  H HB3  . ALA B 40  ? 0.452 0.519 0.476 -0.015 -0.034 0.025  40  ALA HHH HB3  
727  N N    . PRO B 41  ? 0.471 0.548 0.501 -0.009 -0.030 0.024  41  PRO HHH N    
728  C CA   . PRO B 41  ? 0.479 0.551 0.506 -0.008 -0.032 0.025  41  PRO HHH CA   
729  C C    . PRO B 41  ? 0.490 0.554 0.516 -0.009 -0.030 0.028  41  PRO HHH C    
730  O O    . PRO B 41  ? 0.496 0.558 0.524 -0.009 -0.032 0.028  41  PRO HHH O    
731  C CB   . PRO B 41  ? 0.481 0.554 0.510 -0.004 -0.035 0.024  41  PRO HHH CB   
732  C CG   . PRO B 41  ? 0.480 0.562 0.518 -0.003 -0.032 0.022  41  PRO HHH CG   
733  C CD   . PRO B 41  ? 0.473 0.554 0.507 -0.006 -0.029 0.021  41  PRO HHH CD   
734  H HA   . PRO B 41  ? 0.480 0.553 0.505 -0.009 -0.032 0.026  41  PRO HHH HA   
735  H HB2  . PRO B 41  ? 0.485 0.554 0.513 -0.003 -0.035 0.024  41  PRO HHH HB2  
736  H HB3  . PRO B 41  ? 0.486 0.558 0.514 -0.002 -0.038 0.024  41  PRO HHH HB3  
737  H HG2  . PRO B 41  ? 0.481 0.563 0.522 -0.000 -0.031 0.021  41  PRO HHH HG2  
738  H HG3  . PRO B 41  ? 0.476 0.563 0.519 -0.004 -0.034 0.022  41  PRO HHH HG3  
739  H HD2  . PRO B 41  ? 0.479 0.554 0.508 -0.005 -0.029 0.021  41  PRO HHH HD2  
740  H HD3  . PRO B 41  ? 0.472 0.556 0.509 -0.007 -0.026 0.021  41  PRO HHH HD3  
741  N N    . GLY B 42  ? 0.495 0.554 0.518 -0.010 -0.026 0.031  42  GLY HHH N    
742  C CA   . GLY B 42  ? 0.503 0.553 0.530 -0.011 -0.022 0.035  42  GLY HHH CA   
743  C C    . GLY B 42  ? 0.508 0.563 0.551 -0.015 -0.022 0.037  42  GLY HHH C    
744  O O    . GLY B 42  ? 0.537 0.588 0.592 -0.016 -0.020 0.040  42  GLY HHH O    
745  H H    . GLY B 42  ? 0.498 0.555 0.516 -0.010 -0.025 0.031  42  GLY HHH H    
746  H HA2  . GLY B 42  ? 0.512 0.556 0.533 -0.011 -0.016 0.037  42  GLY HHH HA2  
747  H HA3  . GLY B 42  ? 0.509 0.556 0.534 -0.010 -0.023 0.035  42  GLY HHH HA3  
748  N N    . GLN B 43  ? 0.490 0.553 0.536 -0.016 -0.025 0.035  43  GLN HHH N    
749  C CA   . GLN B 43  ? 0.476 0.541 0.536 -0.020 -0.028 0.037  43  GLN HHH CA   
750  C C    . GLN B 43  ? 0.453 0.521 0.522 -0.021 -0.022 0.040  43  GLN HHH C    
751  O O    . GLN B 43  ? 0.440 0.506 0.499 -0.019 -0.015 0.039  43  GLN HHH O    
752  C CB   . GLN B 43  ? 0.489 0.556 0.540 -0.020 -0.035 0.033  43  GLN HHH CB   
753  C CG   . GLN B 43  ? 0.501 0.562 0.541 -0.018 -0.040 0.029  43  GLN HHH CG   
754  C CD   . GLN B 43  ? 0.517 0.570 0.562 -0.019 -0.046 0.031  43  GLN HHH CD   
755  O OE1  . GLN B 43  ? 0.527 0.575 0.578 -0.023 -0.054 0.032  43  GLN HHH OE1  
756  N NE2  . GLN B 43  ? 0.530 0.580 0.575 -0.018 -0.043 0.031  43  GLN HHH NE2  
757  H H    . GLN B 43  ? 0.488 0.554 0.528 -0.015 -0.025 0.033  43  GLN HHH H    
758  H HA   . GLN B 43  ? 0.479 0.542 0.548 -0.021 -0.031 0.038  43  GLN HHH HA   
759  H HB2  . GLN B 43  ? 0.483 0.554 0.530 -0.019 -0.032 0.032  43  GLN HHH HB2  
760  H HB3  . GLN B 43  ? 0.488 0.554 0.546 -0.022 -0.040 0.034  43  GLN HHH HB3  
761  H HG2  . GLN B 43  ? 0.501 0.564 0.537 -0.015 -0.036 0.028  43  GLN HHH HG2  
762  H HG3  . GLN B 43  ? 0.505 0.565 0.537 -0.017 -0.041 0.027  43  GLN HHH HG3  
765  N N    . GLY B 44  ? 0.439 0.509 0.527 -0.023 -0.025 0.043  44  GLY HHH N    
766  C CA   . GLY B 44  ? 0.430 0.504 0.532 -0.024 -0.019 0.047  44  GLY HHH CA   
767  C C    . GLY B 44  ? 0.420 0.497 0.509 -0.024 -0.022 0.044  44  GLY HHH C    
768  O O    . GLY B 44  ? 0.425 0.502 0.497 -0.023 -0.027 0.039  44  GLY HHH O    
769  H H    . GLY B 44  ? 0.442 0.511 0.537 -0.025 -0.032 0.044  44  GLY HHH H    
770  H HA2  . GLY B 44  ? 0.433 0.503 0.532 -0.022 -0.009 0.048  44  GLY HHH HA2  
771  H HA3  . GLY B 44  ? 0.430 0.504 0.550 -0.025 -0.022 0.050  44  GLY HHH HA3  
772  N N    . LEU B 45  ? 0.412 0.491 0.511 -0.024 -0.017 0.047  45  LEU HHH N    
773  C CA   . LEU B 45  ? 0.401 0.482 0.491 -0.024 -0.019 0.045  45  LEU HHH CA   
774  C C    . LEU B 45  ? 0.395 0.476 0.488 -0.026 -0.032 0.046  45  LEU HHH C    
775  O O    . LEU B 45  ? 0.384 0.464 0.496 -0.027 -0.038 0.050  45  LEU HHH O    
776  C CB   . LEU B 45  ? 0.402 0.482 0.501 -0.024 -0.009 0.048  45  LEU HHH CB   
777  C CG   . LEU B 45  ? 0.412 0.485 0.500 -0.022 0.004  0.047  45  LEU HHH CG   
778  C CD1  . LEU B 45  ? 0.420 0.488 0.517 -0.021 0.016  0.051  45  LEU HHH CD1  
779  C CD2  . LEU B 45  ? 0.410 0.481 0.474 -0.022 0.002  0.041  45  LEU HHH CD2  
780  H H    . LEU B 45  ? 0.412 0.490 0.525 -0.024 -0.012 0.050  45  LEU HHH H    
781  H HA   . LEU B 45  ? 0.401 0.483 0.476 -0.024 -0.018 0.041  45  LEU HHH HA   
782  H HB2  . LEU B 45  ? 0.402 0.484 0.520 -0.024 -0.009 0.052  45  LEU HHH HB2  
783  H HB3  . LEU B 45  ? 0.402 0.483 0.495 -0.024 -0.010 0.047  45  LEU HHH HB3  
784  H HG   . LEU B 45  ? 0.413 0.484 0.507 -0.021 0.006  0.049  45  LEU HHH HG   
785  H HD11 . LEU B 45  ? 0.418 0.488 0.535 -0.021 0.018  0.055  45  LEU HHH HD11 
786  H HD12 . LEU B 45  ? 0.429 0.487 0.513 -0.019 0.024  0.050  45  LEU HHH HD12 
787  H HD13 . LEU B 45  ? 0.417 0.487 0.509 -0.021 0.014  0.049  45  LEU HHH HD13 
788  H HD21 . LEU B 45  ? 0.408 0.483 0.470 -0.023 -0.001 0.040  45  LEU HHH HD21 
789  H HD22 . LEU B 45  ? 0.419 0.483 0.474 -0.021 0.008  0.041  45  LEU HHH HD22 
790  H HD23 . LEU B 45  ? 0.410 0.483 0.470 -0.022 -0.003 0.040  45  LEU HHH HD23 
791  N N    . GLN B 46  ? 0.404 0.481 0.475 -0.026 -0.035 0.042  46  GLN HHH N    
792  C CA   . GLN B 46  ? 0.413 0.483 0.475 -0.026 -0.046 0.042  46  GLN HHH CA   
793  C C    . GLN B 46  ? 0.410 0.479 0.466 -0.026 -0.043 0.043  46  GLN HHH C    
794  O O    . GLN B 46  ? 0.407 0.481 0.456 -0.025 -0.033 0.040  46  GLN HHH O    
795  C CB   . GLN B 46  ? 0.425 0.487 0.465 -0.025 -0.049 0.037  46  GLN HHH CB   
796  C CG   . GLN B 46  ? 0.448 0.493 0.473 -0.026 -0.062 0.037  46  GLN HHH CG   
797  C CD   . GLN B 46  ? 0.464 0.496 0.464 -0.024 -0.061 0.033  46  GLN HHH CD   
798  O OE1  . GLN B 46  ? 0.452 0.493 0.453 -0.022 -0.051 0.030  46  GLN HHH OE1  
799  N NE2  . GLN B 46  ? 0.489 0.499 0.465 -0.024 -0.071 0.032  46  GLN HHH NE2  
800  H H    . GLN B 46  ? 0.401 0.480 0.463 -0.025 -0.031 0.039  46  GLN HHH H    
801  H HA   . GLN B 46  ? 0.416 0.483 0.490 -0.027 -0.054 0.045  46  GLN HHH HA   
802  H HB2  . GLN B 46  ? 0.421 0.485 0.465 -0.025 -0.047 0.036  46  GLN HHH HB2  
803  H HB3  . GLN B 46  ? 0.425 0.487 0.455 -0.024 -0.042 0.035  46  GLN HHH HB3  
804  H HG2  . GLN B 46  ? 0.455 0.494 0.474 -0.026 -0.064 0.039  46  GLN HHH HG2  
805  H HG3  . GLN B 46  ? 0.449 0.492 0.487 -0.027 -0.070 0.040  46  GLN HHH HG3  
808  N N    . TRP B 47  ? 0.399 0.463 0.461 -0.027 -0.051 0.047  47  TRP HHH N    
809  C CA   . TRP B 47  ? 0.393 0.453 0.447 -0.026 -0.049 0.048  47  TRP HHH CA   
810  C C    . TRP B 47  ? 0.412 0.457 0.436 -0.026 -0.053 0.046  47  TRP HHH C    
811  O O    . TRP B 47  ? 0.437 0.467 0.447 -0.026 -0.065 0.046  47  TRP HHH O    
812  C CB   . TRP B 47  ? 0.386 0.446 0.463 -0.027 -0.057 0.055  47  TRP HHH CB   
813  C CG   . TRP B 47  ? 0.382 0.439 0.454 -0.026 -0.053 0.057  47  TRP HHH CG   
814  C CD1  . TRP B 47  ? 0.366 0.430 0.443 -0.026 -0.039 0.056  47  TRP HHH CD1  
815  C CD2  . TRP B 47  ? 0.398 0.440 0.455 -0.026 -0.064 0.060  47  TRP HHH CD2  
816  N NE1  . TRP B 47  ? 0.374 0.431 0.444 -0.025 -0.039 0.059  47  TRP HHH NE1  
817  C CE2  . TRP B 47  ? 0.393 0.436 0.451 -0.025 -0.054 0.062  47  TRP HHH CE2  
818  C CE3  . TRP B 47  ? 0.417 0.441 0.459 -0.026 -0.082 0.062  47  TRP HHH CE3  
819  C CZ2  . TRP B 47  ? 0.406 0.435 0.450 -0.024 -0.061 0.065  47  TRP HHH CZ2  
820  C CZ3  . TRP B 47  ? 0.434 0.441 0.458 -0.025 -0.090 0.065  47  TRP HHH CZ3  
821  C CH2  . TRP B 47  ? 0.432 0.442 0.458 -0.024 -0.079 0.067  47  TRP HHH CH2  
822  H H    . TRP B 47  ? 0.405 0.465 0.475 -0.027 -0.060 0.049  47  TRP HHH H    
823  H HA   . TRP B 47  ? 0.385 0.451 0.441 -0.026 -0.039 0.047  47  TRP HHH HA   
824  H HB2  . TRP B 47  ? 0.376 0.444 0.473 -0.027 -0.052 0.056  47  TRP HHH HB2  
825  H HB3  . TRP B 47  ? 0.397 0.449 0.472 -0.027 -0.069 0.056  47  TRP HHH HB3  
826  H HD1  . TRP B 47  ? 0.358 0.428 0.439 -0.026 -0.031 0.054  47  TRP HHH HD1  
827  H HE1  . TRP B 47  ? 0.371 0.430 0.442 -0.025 -0.032 0.059  47  TRP HHH HE1  
828  H HE3  . TRP B 47  ? 0.421 0.442 0.462 -0.026 -0.090 0.061  47  TRP HHH HE3  
829  H HZ2  . TRP B 47  ? 0.406 0.436 0.451 -0.023 -0.054 0.066  47  TRP HHH HZ2  
830  H HZ3  . TRP B 47  ? 0.457 0.448 0.466 -0.025 -0.104 0.066  47  TRP HHH HZ3  
831  H HH2  . TRP B 47  ? 0.448 0.446 0.461 -0.023 -0.085 0.070  47  TRP HHH HH2  
832  N N    . MET B 48  ? 0.410 0.453 0.421 -0.025 -0.042 0.045  48  MET HHH N    
833  C CA   . MET B 48  ? 0.429 0.457 0.411 -0.024 -0.038 0.043  48  MET HHH CA   
834  C C    . MET B 48  ? 0.442 0.456 0.411 -0.023 -0.040 0.047  48  MET HHH C    
835  O O    . MET B 48  ? 0.474 0.465 0.412 -0.022 -0.042 0.047  48  MET HHH O    
836  C CB   . MET B 48  ? 0.427 0.465 0.411 -0.023 -0.022 0.039  48  MET HHH CB   
837  C CG   . MET B 48  ? 0.419 0.471 0.418 -0.023 -0.021 0.036  48  MET HHH CG   
838  S SD   . MET B 48  ? 0.434 0.492 0.433 -0.022 -0.008 0.032  48  MET HHH SD   
839  C CE   . MET B 48  ? 0.421 0.491 0.437 -0.025 -0.001 0.032  48  MET HHH CE   
840  H H    . MET B 48  ? 0.400 0.452 0.421 -0.026 -0.035 0.045  48  MET HHH H    
841  H HA   . MET B 48  ? 0.442 0.460 0.412 -0.023 -0.044 0.042  48  MET HHH HA   
842  H HB2  . MET B 48  ? 0.419 0.464 0.412 -0.024 -0.017 0.040  48  MET HHH HB2  
843  H HB3  . MET B 48  ? 0.442 0.469 0.409 -0.022 -0.018 0.038  48  MET HHH HB3  
844  H HG2  . MET B 48  ? 0.427 0.473 0.420 -0.023 -0.028 0.035  48  MET HHH HG2  
845  H HG3  . MET B 48  ? 0.408 0.470 0.421 -0.025 -0.021 0.036  48  MET HHH HG3  
846  H HE1  . MET B 48  ? 0.413 0.491 0.438 -0.025 0.002  0.030  48  MET HHH HE1  
847  H HE2  . MET B 48  ? 0.414 0.487 0.435 -0.026 -0.005 0.033  48  MET HHH HE2  
848  H HE3  . MET B 48  ? 0.428 0.493 0.438 -0.025 0.003  0.034  48  MET HHH HE3  
849  N N    . GLY B 49  ? 0.423 0.447 0.411 -0.024 -0.038 0.050  49  GLY HHH N    
850  C CA   . GLY B 49  ? 0.431 0.443 0.409 -0.024 -0.039 0.054  49  GLY HHH CA   
851  C C    . GLY B 49  ? 0.405 0.430 0.402 -0.025 -0.028 0.055  49  GLY HHH C    
852  O O    . GLY B 49  ? 0.376 0.418 0.392 -0.026 -0.021 0.052  49  GLY HHH O    
853  H H    . GLY B 49  ? 0.406 0.443 0.413 -0.025 -0.035 0.049  49  GLY HHH H    
854  H HA2  . GLY B 49  ? 0.439 0.444 0.419 -0.023 -0.051 0.057  49  GLY HHH HA2  
855  H HA3  . GLY B 49  ? 0.448 0.446 0.403 -0.023 -0.035 0.053  49  GLY HHH HA3  
856  N N    . TRP B 50  ? 0.411 0.426 0.401 -0.024 -0.027 0.059  50  TRP HHH N    
857  C CA   . TRP B 50  ? 0.398 0.421 0.403 -0.026 -0.017 0.059  50  TRP HHH CA   
858  C C    . TRP B 50  ? 0.423 0.433 0.408 -0.026 -0.008 0.061  50  TRP HHH C    
859  O O    . TRP B 50  ? 0.446 0.436 0.405 -0.024 -0.012 0.063  50  TRP HHH O    
860  C CB   . TRP B 50  ? 0.383 0.410 0.410 -0.024 -0.023 0.064  50  TRP HHH CB   
861  C CG   . TRP B 50  ? 0.397 0.409 0.418 -0.022 -0.038 0.071  50  TRP HHH CG   
862  C CD1  . TRP B 50  ? 0.413 0.414 0.424 -0.021 -0.055 0.073  50  TRP HHH CD1  
863  C CD2  . TRP B 50  ? 0.404 0.408 0.430 -0.021 -0.040 0.077  50  TRP HHH CD2  
864  N NE1  . TRP B 50  ? 0.431 0.418 0.440 -0.020 -0.069 0.079  50  TRP HHH NE1  
865  C CE2  . TRP B 50  ? 0.426 0.415 0.445 -0.019 -0.060 0.082  50  TRP HHH CE2  
866  C CE3  . TRP B 50  ? 0.399 0.406 0.433 -0.021 -0.028 0.078  50  TRP HHH CE3  
867  C CZ2  . TRP B 50  ? 0.440 0.417 0.460 -0.016 -0.068 0.089  50  TRP HHH CZ2  
868  C CZ3  . TRP B 50  ? 0.413 0.409 0.449 -0.018 -0.034 0.084  50  TRP HHH CZ3  
869  C CH2  . TRP B 50  ? 0.433 0.415 0.464 -0.016 -0.054 0.091  50  TRP HHH CH2  
870  H H    . TRP B 50  ? 0.431 0.431 0.404 -0.023 -0.032 0.061  50  TRP HHH H    
871  H HA   . TRP B 50  ? 0.384 0.419 0.398 -0.027 -0.010 0.056  50  TRP HHH HA   
872  H HB2  . TRP B 50  ? 0.378 0.409 0.413 -0.025 -0.015 0.064  50  TRP HHH HB2  
873  H HB3  . TRP B 50  ? 0.372 0.409 0.414 -0.025 -0.026 0.063  50  TRP HHH HB3  
874  H HD1  . TRP B 50  ? 0.411 0.413 0.418 -0.022 -0.058 0.070  50  TRP HHH HD1  
875  H HE1  . TRP B 50  ? 0.446 0.422 0.448 -0.019 -0.083 0.082  50  TRP HHH HE1  
876  H HE3  . TRP B 50  ? 0.387 0.403 0.426 -0.022 -0.017 0.074  50  TRP HHH HE3  
877  H HZ2  . TRP B 50  ? 0.459 0.423 0.473 -0.015 -0.084 0.093  50  TRP HHH HZ2  
878  H HZ3  . TRP B 50  ? 0.411 0.407 0.453 -0.018 -0.025 0.085  50  TRP HHH HZ3  
879  H HH2  . TRP B 50  ? 0.445 0.418 0.477 -0.014 -0.059 0.096  50  TRP HHH HH2  
880  N N    . ILE B 51  ? 0.431 0.449 0.429 -0.028 0.003  0.059  51  ILE HHH N    
881  C CA   . ILE B 51  ? 0.457 0.464 0.445 -0.029 0.013  0.062  51  ILE HHH CA   
882  C C    . ILE B 51  ? 0.459 0.464 0.458 -0.028 0.011  0.066  51  ILE HHH C    
883  O O    . ILE B 51  ? 0.437 0.455 0.457 -0.029 0.012  0.064  51  ILE HHH O    
884  C CB   . ILE B 51  ? 0.450 0.468 0.449 -0.033 0.026  0.057  51  ILE HHH CB   
885  C CG1  . ILE B 51  ? 0.456 0.479 0.451 -0.033 0.029  0.053  51  ILE HHH CG1  
886  C CG2  . ILE B 51  ? 0.464 0.473 0.459 -0.035 0.038  0.059  51  ILE HHH CG2  
887  C CD1  . ILE B 51  ? 0.447 0.486 0.463 -0.036 0.036  0.048  51  ILE HHH CD1  
888  H H    . ILE B 51  ? 0.414 0.444 0.427 -0.029 0.006  0.057  51  ILE HHH H    
889  H HA   . ILE B 51  ? 0.474 0.467 0.443 -0.028 0.013  0.064  51  ILE HHH HA   
890  H HB   . ILE B 51  ? 0.436 0.465 0.450 -0.034 0.025  0.054  51  ILE HHH HB   
891  H HG12 . ILE B 51  ? 0.473 0.483 0.452 -0.031 0.034  0.055  51  ILE HHH HG12 
892  H HG13 . ILE B 51  ? 0.452 0.477 0.446 -0.031 0.021  0.052  51  ILE HHH HG13 
893  H HG21 . ILE B 51  ? 0.461 0.470 0.463 -0.035 0.037  0.060  51  ILE HHH HG21 
894  H HG22 . ILE B 51  ? 0.459 0.474 0.462 -0.037 0.045  0.056  51  ILE HHH HG22 
895  H HG23 . ILE B 51  ? 0.482 0.476 0.459 -0.033 0.039  0.062  51  ILE HHH HG23 
896  H HD11 . ILE B 51  ? 0.433 0.479 0.458 -0.037 0.031  0.046  51  ILE HHH HD11 
897  H HD12 . ILE B 51  ? 0.445 0.486 0.459 -0.035 0.037  0.047  51  ILE HHH HD12 
898  H HD13 . ILE B 51  ? 0.449 0.485 0.469 -0.038 0.043  0.049  51  ILE HHH HD13 
899  N N    . ASN B 52  ? 0.487 0.473 0.469 -0.026 0.008  0.072  52  ASN HHH N    
900  C CA   . ASN B 52  ? 0.493 0.475 0.484 -0.025 0.008  0.076  52  ASN HHH CA   
901  C C    . ASN B 52  ? 0.498 0.478 0.489 -0.029 0.024  0.075  52  ASN HHH C    
902  O O    . ASN B 52  ? 0.522 0.484 0.491 -0.028 0.029  0.078  52  ASN HHH O    
903  C CB   . ASN B 52  ? 0.516 0.478 0.491 -0.021 -0.005 0.084  52  ASN HHH CB   
904  C CG   . ASN B 52  ? 0.518 0.476 0.508 -0.019 -0.007 0.090  52  ASN HHH CG   
905  O OD1  . ASN B 52  ? 0.508 0.474 0.512 -0.021 0.006  0.088  52  ASN HHH OD1  
906  N ND2  . ASN B 52  ? 0.541 0.485 0.526 -0.015 -0.023 0.097  52  ASN HHH ND2  
907  H H    . ASN B 52  ? 0.503 0.477 0.466 -0.025 0.006  0.073  52  ASN HHH H    
908  H HA   . ASN B 52  ? 0.478 0.471 0.489 -0.025 0.006  0.076  52  ASN HHH HA   
909  H HB2  . ASN B 52  ? 0.516 0.479 0.494 -0.020 -0.017 0.085  52  ASN HHH HB2  
910  H HB3  . ASN B 52  ? 0.536 0.482 0.487 -0.021 -0.002 0.085  52  ASN HHH HB3  
913  N N    . THR B 53  ? 0.486 0.480 0.496 -0.032 0.031  0.070  53  THR HHH N    
914  C CA   . THR B 53  ? 0.495 0.489 0.509 -0.036 0.043  0.067  53  THR HHH CA   
915  C C    . THR B 53  ? 0.518 0.497 0.528 -0.036 0.048  0.072  53  THR HHH C    
916  O O    . THR B 53  ? 0.522 0.499 0.538 -0.040 0.058  0.070  53  THR HHH O    
917  C CB   . THR B 53  ? 0.477 0.484 0.509 -0.040 0.045  0.060  53  THR HHH CB   
918  O OG1  . THR B 53  ? 0.474 0.480 0.514 -0.037 0.042  0.062  53  THR HHH OG1  
919  C CG2  . THR B 53  ? 0.465 0.485 0.501 -0.041 0.041  0.055  53  THR HHH CG2  
920  H H    . THR B 53  ? 0.474 0.477 0.496 -0.031 0.028  0.068  53  THR HHH H    
921  H HA   . THR B 53  ? 0.499 0.492 0.507 -0.038 0.048  0.066  53  THR HHH HA   
922  H HB   . THR B 53  ? 0.480 0.485 0.516 -0.043 0.051  0.059  53  THR HHH HB   
924  H HG21 . THR B 53  ? 0.468 0.488 0.500 -0.042 0.044  0.055  53  THR HHH HG21 
925  H HG22 . THR B 53  ? 0.458 0.483 0.501 -0.043 0.042  0.051  53  THR HHH HG22 
926  H HG23 . THR B 53  ? 0.461 0.484 0.496 -0.038 0.035  0.057  53  THR HHH HG23 
927  N N    . LYS B 54  ? 0.536 0.504 0.540 -0.031 0.039  0.079  54  LYS HHH N    
928  C CA   . LYS B 54  ? 0.562 0.515 0.562 -0.029 0.042  0.085  54  LYS HHH CA   
929  C C    . LYS B 54  ? 0.591 0.522 0.562 -0.027 0.040  0.092  54  LYS HHH C    
930  O O    . LYS B 54  ? 0.603 0.519 0.563 -0.028 0.050  0.094  54  LYS HHH O    
931  C CB   . LYS B 54  ? 0.559 0.514 0.576 -0.024 0.033  0.089  54  LYS HHH CB   
932  C CG   . LYS B 54  ? 0.576 0.516 0.593 -0.021 0.034  0.096  54  LYS HHH CG   
933  C CD   . LYS B 54  ? 0.578 0.518 0.613 -0.015 0.022  0.103  54  LYS HHH CD   
934  C CE   . LYS B 54  ? 0.599 0.524 0.636 -0.011 0.022  0.110  54  LYS HHH CE   
935  N NZ   . LYS B 54  ? 0.598 0.528 0.665 -0.005 0.013  0.116  54  LYS HHH NZ   
936  H H    . LYS B 54  ? 0.535 0.505 0.538 -0.028 0.031  0.080  54  LYS HHH H    
937  H HA   . LYS B 54  ? 0.559 0.512 0.564 -0.032 0.051  0.083  54  LYS HHH HA   
938  H HB2  . LYS B 54  ? 0.544 0.510 0.576 -0.025 0.036  0.085  54  LYS HHH HB2  
939  H HB3  . LYS B 54  ? 0.560 0.516 0.576 -0.022 0.022  0.091  54  LYS HHH HB3  
940  H HG2  . LYS B 54  ? 0.594 0.520 0.593 -0.021 0.034  0.099  54  LYS HHH HG2  
941  H HG3  . LYS B 54  ? 0.572 0.514 0.597 -0.024 0.043  0.093  54  LYS HHH HG3  
942  H HD2  . LYS B 54  ? 0.563 0.515 0.617 -0.015 0.025  0.100  54  LYS HHH HD2  
943  H HD3  . LYS B 54  ? 0.583 0.522 0.613 -0.013 0.011  0.105  54  LYS HHH HD3  
944  H HE2  . LYS B 54  ? 0.617 0.528 0.635 -0.011 0.018  0.114  54  LYS HHH HE2  
945  H HE3  . LYS B 54  ? 0.597 0.521 0.637 -0.014 0.034  0.107  54  LYS HHH HE3  
946  H HZ1  . LYS B 54  ? 0.583 0.523 0.667 -0.005 0.020  0.113  54  LYS HHH HZ1  
947  H HZ2  . LYS B 54  ? 0.610 0.529 0.678 -0.003 0.012  0.121  54  LYS HHH HZ2  
948  H HZ3  . LYS B 54  ? 0.599 0.530 0.667 -0.004 0.001  0.119  54  LYS HHH HZ3  
949  N N    . THR B 55  ? 0.606 0.530 0.561 -0.023 0.027  0.094  55  THR HHH N    
950  C CA   . THR B 55  ? 0.636 0.532 0.554 -0.020 0.022  0.100  55  THR HHH CA   
951  C C    . THR B 55  ? 0.637 0.527 0.534 -0.022 0.035  0.096  55  THR HHH C    
952  O O    . THR B 55  ? 0.670 0.533 0.535 -0.020 0.043  0.100  55  THR HHH O    
953  C CB   . THR B 55  ? 0.652 0.538 0.561 -0.015 -0.001 0.104  55  THR HHH CB   
954  O OG1  . THR B 55  ? 0.625 0.526 0.541 -0.016 -0.008 0.099  55  THR HHH OG1  
955  C CG2  . THR B 55  ? 0.646 0.540 0.585 -0.012 -0.013 0.109  55  THR HHH CG2  
956  H H    . THR B 55  ? 0.590 0.525 0.556 -0.022 0.019  0.092  55  THR HHH H    
957  H HA   . THR B 55  ? 0.651 0.534 0.562 -0.019 0.027  0.104  55  THR HHH HA   
958  H HB   . THR B 55  ? 0.680 0.543 0.560 -0.013 -0.005 0.108  55  THR HHH HB   
960  H HG21 . THR B 55  ? 0.657 0.540 0.591 -0.011 -0.009 0.113  55  THR HHH HG21 
961  H HG22 . THR B 55  ? 0.655 0.543 0.591 -0.010 -0.029 0.113  55  THR HHH HG22 
962  H HG23 . THR B 55  ? 0.619 0.533 0.584 -0.014 -0.009 0.105  55  THR HHH HG23 
963  N N    . ALA B 56  ? 0.606 0.519 0.522 -0.025 0.039  0.089  56  ALA HHH N    
964  C CA   . ALA B 56  ? 0.608 0.522 0.514 -0.027 0.051  0.085  56  ALA HHH CA   
965  C C    . ALA B 56  ? 0.628 0.529 0.508 -0.023 0.039  0.085  56  ALA HHH C    
966  O O    . ALA B 56  ? 0.639 0.533 0.504 -0.023 0.049  0.082  56  ALA HHH O    
967  C CB   . ALA B 56  ? 0.629 0.524 0.520 -0.028 0.071  0.088  56  ALA HHH CB   
968  H H    . ALA B 56  ? 0.585 0.515 0.522 -0.026 0.035  0.086  56  ALA HHH H    
969  H HA   . ALA B 56  ? 0.584 0.518 0.513 -0.030 0.053  0.080  56  ALA HHH HA   
970  H HB1  . ALA B 56  ? 0.623 0.527 0.522 -0.030 0.081  0.084  56  ALA HHH HB1  
971  H HB2  . ALA B 56  ? 0.626 0.524 0.529 -0.030 0.075  0.089  56  ALA HHH HB2  
972  H HB3  . ALA B 56  ? 0.659 0.531 0.520 -0.024 0.070  0.092  56  ALA HHH HB3  
973  N N    . ASN B 57  ? 0.645 0.540 0.520 -0.020 0.018  0.088  57  ASN HHH N    
974  C CA   . ASN B 57  ? 0.664 0.545 0.515 -0.017 0.001  0.088  57  ASN HHH CA   
975  C C    . ASN B 57  ? 0.631 0.539 0.506 -0.019 0.001  0.081  57  ASN HHH C    
976  O O    . ASN B 57  ? 0.584 0.520 0.497 -0.021 -0.000 0.078  57  ASN HHH O    
977  C CB   . ASN B 57  ? 0.678 0.544 0.523 -0.014 -0.024 0.094  57  ASN HHH CB   
978  C CG   . ASN B 57  ? 0.707 0.553 0.525 -0.011 -0.044 0.094  57  ASN HHH CG   
979  O OD1  . ASN B 57  ? 0.745 0.554 0.519 -0.008 -0.054 0.099  57  ASN HHH OD1  
980  N ND2  . ASN B 57  ? 0.686 0.554 0.526 -0.013 -0.050 0.090  57  ASN HHH ND2  
981  H H    . ASN B 57  ? 0.636 0.535 0.524 -0.019 0.011  0.090  57  ASN HHH H    
982  H HA   . ASN B 57  ? 0.690 0.549 0.511 -0.015 0.008  0.089  57  ASN HHH HA   
983  H HB2  . ASN B 57  ? 0.701 0.550 0.530 -0.012 -0.022 0.099  57  ASN HHH HB2  
984  H HB3  . ASN B 57  ? 0.654 0.541 0.531 -0.014 -0.029 0.094  57  ASN HHH HB3  
987  N N    . LEU B 58  ? 0.653 0.549 0.505 -0.018 0.003  0.078  58  LEU HHH N    
988  C CA   . LEU B 58  ? 0.637 0.554 0.505 -0.019 0.003  0.072  58  LEU HHH CA   
989  C C    . LEU B 58  ? 0.656 0.559 0.506 -0.017 -0.018 0.072  58  LEU HHH C    
990  O O    . LEU B 58  ? 0.697 0.564 0.503 -0.014 -0.023 0.075  58  LEU HHH O    
991  C CB   . LEU B 58  ? 0.644 0.558 0.503 -0.019 0.024  0.068  58  LEU HHH CB   
992  C CG   . LEU B 58  ? 0.639 0.559 0.512 -0.022 0.045  0.069  58  LEU HHH CG   
993  C CD1  . LEU B 58  ? 0.650 0.560 0.512 -0.021 0.066  0.068  58  LEU HHH CD1  
994  C CD2  . LEU B 58  ? 0.599 0.553 0.516 -0.026 0.045  0.066  58  LEU HHH CD2  
995  H H    . LEU B 58  ? 0.683 0.555 0.504 -0.016 0.006  0.080  58  LEU HHH H    
996  H HA   . LEU B 58  ? 0.607 0.547 0.505 -0.021 0.002  0.070  58  LEU HHH HA   
997  H HB2  . LEU B 58  ? 0.674 0.563 0.501 -0.017 0.025  0.069  58  LEU HHH HB2  
998  H HB3  . LEU B 58  ? 0.624 0.555 0.499 -0.020 0.024  0.064  58  LEU HHH HB3  
999  H HG   . LEU B 58  ? 0.655 0.560 0.515 -0.021 0.044  0.073  58  LEU HHH HG   
1000 H HD11 . LEU B 58  ? 0.684 0.568 0.514 -0.018 0.070  0.071  58  LEU HHH HD11 
1001 H HD12 . LEU B 58  ? 0.642 0.562 0.523 -0.024 0.078  0.068  58  LEU HHH HD12 
1002 H HD13 . LEU B 58  ? 0.640 0.561 0.510 -0.021 0.066  0.064  58  LEU HHH HD13 
1003 H HD21 . LEU B 58  ? 0.583 0.551 0.512 -0.027 0.044  0.062  58  LEU HHH HD21 
1004 H HD22 . LEU B 58  ? 0.597 0.554 0.523 -0.028 0.056  0.066  58  LEU HHH HD22 
1005 H HD23 . LEU B 58  ? 0.591 0.549 0.515 -0.026 0.034  0.067  58  LEU HHH HD23 
1006 N N    . THR B 59  ? 0.635 0.560 0.515 -0.018 -0.030 0.070  59  THR HHH N    
1007 C CA   . THR B 59  ? 0.649 0.565 0.521 -0.018 -0.052 0.070  59  THR HHH CA   
1008 C C    . THR B 59  ? 0.630 0.562 0.512 -0.019 -0.046 0.063  59  THR HHH C    
1009 O O    . THR B 59  ? 0.592 0.554 0.509 -0.021 -0.038 0.061  59  THR HHH O    
1010 C CB   . THR B 59  ? 0.641 0.569 0.545 -0.018 -0.070 0.074  59  THR HHH CB   
1011 O OG1  . THR B 59  ? 0.670 0.586 0.569 -0.017 -0.072 0.080  59  THR HHH OG1  
1012 C CG2  . THR B 59  ? 0.661 0.576 0.560 -0.018 -0.096 0.076  59  THR HHH CG2  
1013 H H    . THR B 59  ? 0.607 0.554 0.514 -0.020 -0.026 0.068  59  THR HHH H    
1014 H HA   . THR B 59  ? 0.683 0.572 0.521 -0.016 -0.057 0.071  59  THR HHH HA   
1015 H HB   . THR B 59  ? 0.613 0.565 0.547 -0.019 -0.064 0.073  59  THR HHH HB   
1017 H HG21 . THR B 59  ? 0.646 0.573 0.556 -0.019 -0.095 0.072  59  THR HHH HG21 
1018 H HG22 . THR B 59  ? 0.656 0.576 0.577 -0.018 -0.107 0.080  59  THR HHH HG22 
1019 H HG23 . THR B 59  ? 0.693 0.582 0.556 -0.016 -0.101 0.076  59  THR HHH HG23 
1020 N N    . TYR B 60  ? 0.664 0.574 0.514 -0.017 -0.051 0.061  60  TYR HHH N    
1021 C CA   . TYR B 60  ? 0.655 0.576 0.511 -0.018 -0.049 0.055  60  TYR HHH CA   
1022 C C    . TYR B 60  ? 0.662 0.577 0.521 -0.018 -0.073 0.056  60  TYR HHH C    
1023 O O    . TYR B 60  ? 0.691 0.578 0.523 -0.018 -0.091 0.059  60  TYR HHH O    
1024 C CB   . TYR B 60  ? 0.692 0.589 0.510 -0.015 -0.033 0.052  60  TYR HHH CB   
1025 C CG   . TYR B 60  ? 0.703 0.602 0.520 -0.014 -0.009 0.053  60  TYR HHH CG   
1026 C CD1  . TYR B 60  ? 0.677 0.603 0.525 -0.015 0.008  0.050  60  TYR HHH CD1  
1027 C CD2  . TYR B 60  ? 0.738 0.608 0.523 -0.012 -0.004 0.058  60  TYR HHH CD2  
1028 C CE1  . TYR B 60  ? 0.676 0.605 0.531 -0.015 0.028  0.051  60  TYR HHH CE1  
1029 C CE2  . TYR B 60  ? 0.745 0.617 0.533 -0.012 0.020  0.059  60  TYR HHH CE2  
1030 C CZ   . TYR B 60  ? 0.713 0.615 0.538 -0.014 0.035  0.056  60  TYR HHH CZ   
1031 O OH   . TYR B 60  ? 0.720 0.624 0.555 -0.015 0.057  0.057  60  TYR HHH OH   
1032 H H    . TYR B 60  ? 0.694 0.579 0.515 -0.015 -0.057 0.063  60  TYR HHH H    
1033 H HA   . TYR B 60  ? 0.626 0.571 0.510 -0.019 -0.040 0.054  60  TYR HHH HA   
1034 H HB2  . TYR B 60  ? 0.726 0.595 0.512 -0.013 -0.042 0.054  60  TYR HHH HB2  
1035 H HB3  . TYR B 60  ? 0.682 0.588 0.507 -0.015 -0.031 0.049  60  TYR HHH HB3  
1036 H HD1  . TYR B 60  ? 0.654 0.598 0.522 -0.016 0.004  0.047  60  TYR HHH HD1  
1037 H HD2  . TYR B 60  ? 0.765 0.614 0.527 -0.011 -0.017 0.060  60  TYR HHH HD2  
1038 H HE1  . TYR B 60  ? 0.656 0.604 0.534 -0.017 0.037  0.049  60  TYR HHH HE1  
1039 H HE2  . TYR B 60  ? 0.770 0.620 0.535 -0.010 0.024  0.062  60  TYR HHH HE2  
1041 N N    . ALA B 61  ? 0.636 0.577 0.528 -0.020 -0.074 0.053  61  ALA HHH N    
1042 C CA   . ALA B 61  ? 0.646 0.584 0.545 -0.022 -0.093 0.052  61  ALA HHH CA   
1043 C C    . ALA B 61  ? 0.708 0.611 0.558 -0.020 -0.098 0.049  61  ALA HHH C    
1044 O O    . ALA B 61  ? 0.721 0.610 0.541 -0.017 -0.080 0.047  61  ALA HHH O    
1045 C CB   . ALA B 61  ? 0.603 0.571 0.536 -0.023 -0.086 0.049  61  ALA HHH CB   
1046 H H    . ALA B 61  ? 0.611 0.573 0.525 -0.021 -0.064 0.052  61  ALA HHH H    
1047 H HA   . ALA B 61  ? 0.651 0.587 0.561 -0.023 -0.108 0.056  61  ALA HHH HA   
1048 H HB1  . ALA B 61  ? 0.608 0.573 0.547 -0.024 -0.097 0.049  61  ALA HHH HB1  
1049 H HB2  . ALA B 61  ? 0.584 0.569 0.543 -0.024 -0.082 0.051  61  ALA HHH HB2  
1050 H HB3  . ALA B 61  ? 0.601 0.571 0.526 -0.022 -0.073 0.046  61  ALA HHH HB3  
1051 N N    . GLN B 62  ? 0.758 0.645 0.601 -0.021 -0.121 0.049  62  GLN HHH N    
1052 C CA   . GLN B 62  ? 0.825 0.672 0.617 -0.020 -0.130 0.046  62  GLN HHH CA   
1053 C C    . GLN B 62  ? 0.831 0.679 0.608 -0.017 -0.106 0.039  62  GLN HHH C    
1054 O O    . GLN B 62  ? 0.852 0.673 0.587 -0.013 -0.092 0.038  62  GLN HHH O    
1055 C CB   . GLN B 62  ? 0.853 0.693 0.656 -0.023 -0.159 0.046  62  GLN HHH CB   
1056 C CG   . GLN B 62  ? 0.920 0.710 0.665 -0.023 -0.175 0.043  62  GLN HHH CG   
1057 C CD   . GLN B 62  ? 0.979 0.728 0.678 -0.021 -0.190 0.046  62  GLN HHH CD   
1058 O OE1  . GLN B 62  ? 1.003 0.734 0.700 -0.024 -0.221 0.050  62  GLN HHH OE1  
1059 N NE2  . GLN B 62  ? 0.995 0.730 0.659 -0.016 -0.166 0.046  62  GLN HHH NE2  
1060 H H    . GLN B 62  ? 0.741 0.641 0.612 -0.024 -0.133 0.051  62  GLN HHH H    
1061 H HA   . GLN B 62  ? 0.857 0.679 0.618 -0.018 -0.133 0.047  62  GLN HHH HA   
1062 H HB2  . GLN B 62  ? 0.847 0.692 0.670 -0.025 -0.173 0.051  62  GLN HHH HB2  
1063 H HB3  . GLN B 62  ? 0.824 0.685 0.654 -0.025 -0.155 0.044  62  GLN HHH HB3  
1064 H HG2  . GLN B 62  ? 0.921 0.711 0.680 -0.026 -0.193 0.042  62  GLN HHH HG2  
1065 H HG3  . GLN B 62  ? 0.927 0.710 0.650 -0.020 -0.159 0.038  62  GLN HHH HG3  
1068 N N    . THR B 63  ? 0.809 0.687 0.622 -0.019 -0.101 0.037  63  THR HHH N    
1069 C CA   . THR B 63  ? 0.820 0.699 0.625 -0.016 -0.086 0.031  63  THR HHH CA   
1070 C C    . THR B 63  ? 0.802 0.693 0.609 -0.013 -0.057 0.030  63  THR HHH C    
1071 O O    . THR B 63  ? 0.810 0.697 0.608 -0.010 -0.043 0.027  63  THR HHH O    
1072 C CB   . THR B 63  ? 0.795 0.702 0.640 -0.019 -0.090 0.030  63  THR HHH CB   
1073 O OG1  . THR B 63  ? 0.767 0.711 0.654 -0.020 -0.081 0.032  63  THR HHH OG1  
1074 C CG2  . THR B 63  ? 0.807 0.706 0.660 -0.023 -0.117 0.031  63  THR HHH CG2  
1075 H H    . THR B 63  ? 0.782 0.682 0.629 -0.021 -0.106 0.039  63  THR HHH H    
1076 H HA   . THR B 63  ? 0.852 0.702 0.623 -0.015 -0.091 0.029  63  THR HHH HA   
1077 H HB   . THR B 63  ? 0.798 0.703 0.636 -0.017 -0.081 0.026  63  THR HHH HB   
1079 H HG21 . THR B 63  ? 0.840 0.710 0.662 -0.022 -0.127 0.030  63  THR HHH HG21 
1080 H HG22 . THR B 63  ? 0.789 0.701 0.663 -0.024 -0.117 0.030  63  THR HHH HG22 
1081 H HG23 . THR B 63  ? 0.796 0.704 0.669 -0.025 -0.125 0.035  63  THR HHH HG23 
1082 N N    . PHE B 64  ? 0.774 0.680 0.597 -0.014 -0.050 0.034  64  PHE HHH N    
1083 C CA   . PHE B 64  ? 0.733 0.656 0.570 -0.012 -0.026 0.034  64  PHE HHH CA   
1084 C C    . PHE B 64  ? 0.766 0.663 0.571 -0.010 -0.014 0.036  64  PHE HHH C    
1085 O O    . PHE B 64  ? 0.760 0.670 0.579 -0.009 0.007  0.037  64  PHE HHH O    
1086 C CB   . PHE B 64  ? 0.670 0.630 0.552 -0.016 -0.026 0.035  64  PHE HHH CB   
1087 C CG   . PHE B 64  ? 0.624 0.608 0.537 -0.017 -0.030 0.033  64  PHE HHH CG   
1088 C CD1  . PHE B 64  ? 0.605 0.601 0.529 -0.016 -0.018 0.030  64  PHE HHH CD1  
1089 C CD2  . PHE B 64  ? 0.601 0.593 0.532 -0.020 -0.046 0.035  64  PHE HHH CD2  
1090 C CE1  . PHE B 64  ? 0.579 0.593 0.525 -0.016 -0.022 0.028  64  PHE HHH CE1  
1091 C CE2  . PHE B 64  ? 0.582 0.593 0.537 -0.021 -0.047 0.034  64  PHE HHH CE2  
1092 C CZ   . PHE B 64  ? 0.571 0.592 0.531 -0.019 -0.035 0.030  64  PHE HHH CZ   
1093 H H    . PHE B 64  ? 0.771 0.677 0.599 -0.015 -0.060 0.037  64  PHE HHH H    
1094 H HA   . PHE B 64  ? 0.731 0.657 0.570 -0.010 -0.017 0.031  64  PHE HHH HA   
1095 H HB2  . PHE B 64  ? 0.673 0.630 0.556 -0.017 -0.036 0.038  64  PHE HHH HB2  
1096 H HB3  . PHE B 64  ? 0.664 0.631 0.553 -0.015 -0.013 0.036  64  PHE HHH HB3  
1097 H HD1  . PHE B 64  ? 0.614 0.606 0.530 -0.014 -0.006 0.029  64  PHE HHH HD1  
1098 H HD2  . PHE B 64  ? 0.613 0.598 0.541 -0.021 -0.055 0.038  64  PHE HHH HD2  
1099 H HE1  . PHE B 64  ? 0.573 0.595 0.527 -0.015 -0.015 0.026  64  PHE HHH HE1  
1100 H HE2  . PHE B 64  ? 0.574 0.590 0.544 -0.022 -0.055 0.035  64  PHE HHH HE2  
1101 H HZ   . PHE B 64  ? 0.557 0.588 0.531 -0.020 -0.037 0.029  64  PHE HHH HZ   
1102 N N    . THR B 65  ? 0.811 0.671 0.574 -0.008 -0.026 0.038  65  THR HHH N    
1103 C CA   . THR B 65  ? 0.846 0.672 0.566 -0.005 -0.013 0.041  65  THR HHH CA   
1104 C C    . THR B 65  ? 0.866 0.666 0.555 -0.000 0.009  0.038  65  THR HHH C    
1105 O O    . THR B 65  ? 0.878 0.657 0.541 0.002  0.002  0.034  65  THR HHH O    
1106 C CB   . THR B 65  ? 0.889 0.678 0.569 -0.005 -0.036 0.044  65  THR HHH CB   
1107 O OG1  . THR B 65  ? 0.862 0.677 0.580 -0.009 -0.055 0.048  65  THR HHH OG1  
1108 C CG2  . THR B 65  ? 0.931 0.683 0.566 -0.002 -0.022 0.048  65  THR HHH CG2  
1109 H H    . THR B 65  ? 0.819 0.669 0.573 -0.010 -0.043 0.038  65  THR HHH H    
1110 H HA   . THR B 65  ? 0.826 0.669 0.567 -0.006 -0.003 0.043  65  THR HHH HA   
1111 H HB   . THR B 65  ? 0.911 0.681 0.569 -0.005 -0.047 0.042  65  THR HHH HB   
1113 H HG21 . THR B 65  ? 0.966 0.689 0.565 0.002  -0.013 0.046  65  THR HHH HG21 
1114 H HG22 . THR B 65  ? 0.951 0.687 0.570 -0.002 -0.039 0.051  65  THR HHH HG22 
1115 H HG23 . THR B 65  ? 0.912 0.682 0.568 -0.002 -0.006 0.049  65  THR HHH HG23 
1116 N N    . GLY B 66  ? 0.855 0.658 0.549 0.002  0.037  0.040  66  GLY HHH N    
1117 C CA   . GLY B 66  ? 0.868 0.648 0.539 0.008  0.065  0.038  66  GLY HHH CA   
1118 C C    . GLY B 66  ? 0.810 0.629 0.536 0.008  0.087  0.039  66  GLY HHH C    
1119 O O    . GLY B 66  ? 0.818 0.637 0.551 0.008  0.106  0.043  66  GLY HHH O    
1120 H H    . GLY B 66  ? 0.837 0.655 0.550 0.000  0.041  0.042  66  GLY HHH H    
1121 H HA2  . GLY B 66  ? 0.906 0.655 0.542 0.011  0.073  0.041  66  GLY HHH HA2  
1122 H HA3  . GLY B 66  ? 0.880 0.649 0.537 0.010  0.060  0.035  66  GLY HHH HA3  
1123 N N    . ARG B 67  ? 0.747 0.596 0.509 0.007  0.084  0.035  67  ARG HHH N    
1124 C CA   . ARG B 67  ? 0.697 0.579 0.509 0.007  0.103  0.035  67  ARG HHH CA   
1125 C C    . ARG B 67  ? 0.638 0.561 0.499 0.001  0.094  0.036  67  ARG HHH C    
1126 O O    . ARG B 67  ? 0.624 0.573 0.527 0.000  0.105  0.037  67  ARG HHH O    
1127 C CB   . ARG B 67  ? 0.680 0.572 0.506 0.010  0.101  0.031  67  ARG HHH CB   
1128 C CG   . ARG B 67  ? 0.724 0.576 0.507 0.017  0.116  0.030  67  ARG HHH CG   
1129 C CD   . ARG B 67  ? 0.708 0.573 0.512 0.019  0.117  0.026  67  ARG HHH CD   
1130 N NE   . ARG B 67  ? 0.675 0.562 0.493 0.015  0.089  0.023  67  ARG HHH NE   
1131 C CZ   . ARG B 67  ? 0.626 0.554 0.493 0.012  0.081  0.022  67  ARG HHH CZ   
1132 N NH1  . ARG B 67  ? 0.607 0.560 0.516 0.012  0.094  0.025  67  ARG HHH NH1  
1133 N NH2  . ARG B 67  ? 0.602 0.541 0.474 0.008  0.058  0.020  67  ARG HHH NH2  
1134 H H    . ARG B 67  ? 0.744 0.595 0.503 0.006  0.070  0.033  67  ARG HHH H    
1135 H HA   . ARG B 67  ? 0.718 0.586 0.523 0.010  0.123  0.037  67  ARG HHH HA   
1136 H HB2  . ARG B 67  ? 0.664 0.566 0.494 0.007  0.082  0.029  67  ARG HHH HB2  
1137 H HB3  . ARG B 67  ? 0.656 0.573 0.519 0.009  0.109  0.031  67  ARG HHH HB3  
1138 H HG2  . ARG B 67  ? 0.745 0.584 0.521 0.020  0.137  0.032  67  ARG HHH HG2  
1139 H HG3  . ARG B 67  ? 0.750 0.577 0.495 0.017  0.104  0.029  67  ARG HHH HG3  
1140 H HD2  . ARG B 67  ? 0.689 0.575 0.529 0.020  0.129  0.027  67  ARG HHH HD2  
1141 H HD3  . ARG B 67  ? 0.743 0.578 0.514 0.024  0.126  0.025  67  ARG HHH HD3  
1142 H HE   . ARG B 67  ? 0.690 0.560 0.482 0.014  0.077  0.021  67  ARG HHH HE   
1143 H HH11 . ARG B 67  ? 0.619 0.565 0.528 0.014  0.110  0.026  67  ARG HHH HH11 
1144 H HH12 . ARG B 67  ? 0.579 0.555 0.516 0.010  0.087  0.024  67  ARG HHH HH12 
1145 H HH21 . ARG B 67  ? 0.619 0.542 0.467 0.007  0.048  0.019  67  ARG HHH HH21 
1146 H HH22 . ARG B 67  ? 0.577 0.540 0.477 0.006  0.053  0.020  67  ARG HHH HH22 
1147 N N    . PHE B 68  ? 0.611 0.538 0.467 -0.003 0.073  0.037  68  PHE HHH N    
1148 C CA   . PHE B 68  ? 0.559 0.518 0.453 -0.009 0.064  0.038  68  PHE HHH CA   
1149 C C    . PHE B 68  ? 0.567 0.515 0.450 -0.010 0.069  0.042  68  PHE HHH C    
1150 O O    . PHE B 68  ? 0.608 0.526 0.451 -0.009 0.064  0.044  68  PHE HHH O    
1151 C CB   . PHE B 68  ? 0.532 0.505 0.434 -0.012 0.040  0.036  68  PHE HHH CB   
1152 C CG   . PHE B 68  ? 0.519 0.502 0.432 -0.010 0.036  0.032  68  PHE HHH CG   
1153 C CD1  . PHE B 68  ? 0.549 0.507 0.431 -0.006 0.036  0.030  68  PHE HHH CD1  
1154 C CD2  . PHE B 68  ? 0.484 0.498 0.434 -0.012 0.033  0.030  68  PHE HHH CD2  
1155 C CE1  . PHE B 68  ? 0.539 0.506 0.431 -0.005 0.033  0.027  68  PHE HHH CE1  
1156 C CE2  . PHE B 68  ? 0.476 0.496 0.433 -0.011 0.029  0.027  68  PHE HHH CE2  
1157 C CZ   . PHE B 68  ? 0.501 0.500 0.431 -0.007 0.029  0.026  68  PHE HHH CZ   
1158 H H    . PHE B 68  ? 0.630 0.539 0.459 -0.003 0.062  0.037  68  PHE HHH H    
1159 H HA   . PHE B 68  ? 0.541 0.519 0.464 -0.010 0.072  0.037  68  PHE HHH HA   
1160 H HB2  . PHE B 68  ? 0.550 0.507 0.429 -0.011 0.031  0.037  68  PHE HHH HB2  
1161 H HB3  . PHE B 68  ? 0.511 0.502 0.436 -0.015 0.037  0.036  68  PHE HHH HB3  
1162 H HD1  . PHE B 68  ? 0.577 0.512 0.429 -0.005 0.038  0.031  68  PHE HHH HD1  
1163 H HD2  . PHE B 68  ? 0.469 0.496 0.436 -0.015 0.032  0.031  68  PHE HHH HD2  
1164 H HE1  . PHE B 68  ? 0.560 0.508 0.429 -0.002 0.032  0.025  68  PHE HHH HE1  
1165 H HE2  . PHE B 68  ? 0.456 0.494 0.434 -0.012 0.026  0.027  68  PHE HHH HE2  
1166 H HZ   . PHE B 68  ? 0.496 0.499 0.432 -0.006 0.027  0.024  68  PHE HHH HZ   
1167 N N    . VAL B 69  ? 0.534 0.502 0.449 -0.013 0.079  0.044  69  VAL HHH N    
1168 C CA   . VAL B 69  ? 0.541 0.499 0.451 -0.015 0.087  0.048  69  VAL HHH CA   
1169 C C    . VAL B 69  ? 0.507 0.494 0.454 -0.021 0.079  0.048  69  VAL HHH C    
1170 O O    . VAL B 69  ? 0.483 0.494 0.465 -0.023 0.081  0.045  69  VAL HHH O    
1171 C CB   . VAL B 69  ? 0.566 0.510 0.474 -0.013 0.115  0.051  69  VAL HHH CB   
1172 C CG1  . VAL B 69  ? 0.589 0.512 0.477 -0.013 0.124  0.056  69  VAL HHH CG1  
1173 C CG2  . VAL B 69  ? 0.599 0.517 0.477 -0.006 0.127  0.050  69  VAL HHH CG2  
1174 H H    . VAL B 69  ? 0.514 0.502 0.458 -0.015 0.080  0.042  69  VAL HHH H    
1175 H HA   . VAL B 69  ? 0.562 0.501 0.443 -0.014 0.080  0.050  69  VAL HHH HA   
1176 H HB   . VAL B 69  ? 0.544 0.510 0.488 -0.015 0.120  0.050  69  VAL HHH HB   
1177 H HG11 . VAL B 69  ? 0.571 0.512 0.488 -0.017 0.127  0.057  69  VAL HHH HG11 
1178 H HG12 . VAL B 69  ? 0.619 0.520 0.487 -0.010 0.140  0.059  69  VAL HHH HG12 
1179 H HG13 . VAL B 69  ? 0.596 0.509 0.463 -0.013 0.110  0.057  69  VAL HHH HG13 
1180 H HG21 . VAL B 69  ? 0.619 0.516 0.462 -0.005 0.117  0.050  69  VAL HHH HG21 
1181 H HG22 . VAL B 69  ? 0.620 0.524 0.492 -0.004 0.146  0.053  69  VAL HHH HG22 
1182 H HG23 . VAL B 69  ? 0.582 0.516 0.479 -0.006 0.125  0.047  69  VAL HHH HG23 
1183 N N    . PHE B 70  ? 0.506 0.487 0.442 -0.022 0.068  0.050  70  PHE HHH N    
1184 C CA   . PHE B 70  ? 0.477 0.478 0.441 -0.027 0.062  0.050  70  PHE HHH CA   
1185 C C    . PHE B 70  ? 0.492 0.485 0.459 -0.029 0.077  0.053  70  PHE HHH C    
1186 O O    . PHE B 70  ? 0.515 0.483 0.453 -0.026 0.087  0.058  70  PHE HHH O    
1187 C CB   . PHE B 70  ? 0.472 0.472 0.428 -0.027 0.044  0.051  70  PHE HHH CB   
1188 C CG   . PHE B 70  ? 0.462 0.467 0.417 -0.026 0.029  0.049  70  PHE HHH CG   
1189 C CD1  . PHE B 70  ? 0.444 0.467 0.417 -0.026 0.029  0.044  70  PHE HHH CD1  
1190 C CD2  . PHE B 70  ? 0.473 0.466 0.412 -0.024 0.014  0.051  70  PHE HHH CD2  
1191 C CE1  . PHE B 70  ? 0.436 0.463 0.409 -0.025 0.016  0.042  70  PHE HHH CE1  
1192 C CE2  . PHE B 70  ? 0.464 0.462 0.407 -0.023 0.001  0.050  70  PHE HHH CE2  
1193 C CZ   . PHE B 70  ? 0.449 0.464 0.407 -0.024 0.003  0.045  70  PHE HHH CZ   
1194 H H    . PHE B 70  ? 0.525 0.489 0.436 -0.020 0.063  0.052  70  PHE HHH H    
1195 H HA   . PHE B 70  ? 0.458 0.477 0.445 -0.029 0.061  0.047  70  PHE HHH HA   
1196 H HB2  . PHE B 70  ? 0.493 0.474 0.427 -0.025 0.044  0.054  70  PHE HHH HB2  
1197 H HB3  . PHE B 70  ? 0.458 0.469 0.431 -0.030 0.043  0.051  70  PHE HHH HB3  
1198 H HD1  . PHE B 70  ? 0.436 0.468 0.423 -0.028 0.037  0.043  70  PHE HHH HD1  
1199 H HD2  . PHE B 70  ? 0.489 0.468 0.414 -0.023 0.013  0.055  70  PHE HHH HD2  
1200 H HE1  . PHE B 70  ? 0.425 0.462 0.408 -0.025 0.016  0.040  70  PHE HHH HE1  
1201 H HE2  . PHE B 70  ? 0.474 0.464 0.410 -0.023 -0.010 0.052  70  PHE HHH HE2  
1202 H HZ   . PHE B 70  ? 0.442 0.461 0.404 -0.024 -0.005 0.044  70  PHE HHH HZ   
1203 N N    . SER B 71  ? 0.472 0.486 0.472 -0.034 0.078  0.052  71  SER HHH N    
1204 C CA   . SER B 71  ? 0.479 0.488 0.488 -0.037 0.089  0.055  71  SER HHH CA   
1205 C C    . SER B 71  ? 0.456 0.485 0.494 -0.043 0.079  0.052  71  SER HHH C    
1206 O O    . SER B 71  ? 0.430 0.474 0.479 -0.044 0.067  0.047  71  SER HHH O    
1207 C CB   . SER B 71  ? 0.491 0.497 0.513 -0.038 0.110  0.057  71  SER HHH CB   
1208 O OG   . SER B 71  ? 0.481 0.506 0.530 -0.038 0.110  0.053  71  SER HHH OG   
1209 H H    . SER B 71  ? 0.453 0.482 0.471 -0.036 0.072  0.049  71  SER HHH H    
1210 H HA   . SER B 71  ? 0.495 0.488 0.482 -0.036 0.088  0.058  71  SER HHH HA   
1211 H HB2  . SER B 71  ? 0.492 0.500 0.529 -0.041 0.115  0.058  71  SER HHH HB2  
1212 H HB3  . SER B 71  ? 0.516 0.503 0.513 -0.034 0.118  0.060  71  SER HHH HB3  
1214 N N    . PHE B 72  ? 0.469 0.493 0.513 -0.046 0.085  0.054  72  PHE HHH N    
1215 C CA   . PHE B 72  ? 0.458 0.492 0.523 -0.052 0.078  0.051  72  PHE HHH CA   
1216 C C    . PHE B 72  ? 0.470 0.501 0.552 -0.057 0.091  0.053  72  PHE HHH C    
1217 O O    . PHE B 72  ? 0.484 0.501 0.556 -0.055 0.106  0.059  72  PHE HHH O    
1218 C CB   . PHE B 72  ? 0.458 0.487 0.507 -0.050 0.068  0.051  72  PHE HHH CB   
1219 C CG   . PHE B 72  ? 0.475 0.485 0.504 -0.047 0.073  0.058  72  PHE HHH CG   
1220 C CD1  . PHE B 72  ? 0.489 0.484 0.491 -0.042 0.072  0.062  72  PHE HHH CD1  
1221 C CD2  . PHE B 72  ? 0.481 0.484 0.515 -0.051 0.078  0.059  72  PHE HHH CD2  
1222 C CE1  . PHE B 72  ? 0.511 0.485 0.491 -0.039 0.074  0.068  72  PHE HHH CE1  
1223 C CE2  . PHE B 72  ? 0.500 0.484 0.515 -0.048 0.082  0.066  72  PHE HHH CE2  
1224 C CZ   . PHE B 72  ? 0.517 0.485 0.503 -0.042 0.080  0.070  72  PHE HHH CZ   
1225 H H    . PHE B 72  ? 0.484 0.495 0.518 -0.045 0.094  0.058  72  PHE HHH H    
1226 H HA   . PHE B 72  ? 0.445 0.492 0.525 -0.053 0.072  0.047  72  PHE HHH HA   
1227 H HB2  . PHE B 72  ? 0.450 0.483 0.511 -0.053 0.064  0.049  72  PHE HHH HB2  
1228 H HB3  . PHE B 72  ? 0.451 0.483 0.494 -0.047 0.061  0.050  72  PHE HHH HB3  
1229 H HD1  . PHE B 72  ? 0.487 0.485 0.484 -0.040 0.069  0.060  72  PHE HHH HD1  
1230 H HD2  . PHE B 72  ? 0.472 0.483 0.523 -0.055 0.077  0.056  72  PHE HHH HD2  
1231 H HE1  . PHE B 72  ? 0.527 0.488 0.486 -0.036 0.072  0.071  72  PHE HHH HE1  
1232 H HE2  . PHE B 72  ? 0.505 0.484 0.524 -0.050 0.085  0.067  72  PHE HHH HE2  
1233 H HZ   . PHE B 72  ? 0.534 0.487 0.505 -0.040 0.081  0.075  72  PHE HHH HZ   
1234 N N    . ASP B 73  ? 0.472 0.512 0.578 -0.063 0.085  0.049  73  ASP HHH N    
1235 C CA   . ASP B 73  ? 0.486 0.521 0.610 -0.069 0.092  0.051  73  ASP HHH CA   
1236 C C    . ASP B 73  ? 0.489 0.519 0.606 -0.071 0.081  0.048  73  ASP HHH C    
1237 O O    . ASP B 73  ? 0.480 0.518 0.606 -0.074 0.068  0.042  73  ASP HHH O    
1238 C CB   . ASP B 73  ? 0.483 0.532 0.647 -0.075 0.094  0.049  73  ASP HHH CB   
1239 C CG   . ASP B 73  ? 0.498 0.542 0.686 -0.081 0.106  0.053  73  ASP HHH CG   
1240 O OD1  . ASP B 73  ? 0.516 0.548 0.692 -0.083 0.106  0.053  73  ASP HHH OD1  
1241 O OD2  . ASP B 73  ? 0.506 0.558 0.727 -0.084 0.116  0.055  73  ASP HHH OD2  
1242 H H    . ASP B 73  ? 0.459 0.508 0.571 -0.064 0.074  0.045  73  ASP HHH H    
1243 H HA   . ASP B 73  ? 0.500 0.524 0.613 -0.067 0.104  0.056  73  ASP HHH HA   
1244 H HB2  . ASP B 73  ? 0.483 0.536 0.650 -0.072 0.101  0.051  73  ASP HHH HB2  
1245 H HB3  . ASP B 73  ? 0.474 0.531 0.647 -0.077 0.081  0.045  73  ASP HHH HB3  
1246 N N    . THR B 74  ? 0.507 0.523 0.607 -0.070 0.087  0.052  74  THR HHH N    
1247 C CA   . THR B 74  ? 0.517 0.525 0.611 -0.071 0.080  0.050  74  THR HHH CA   
1248 C C    . THR B 74  ? 0.521 0.530 0.640 -0.080 0.077  0.045  74  THR HHH C    
1249 O O    . THR B 74  ? 0.536 0.541 0.650 -0.082 0.067  0.040  74  THR HHH O    
1250 C CB   . THR B 74  ? 0.535 0.526 0.610 -0.067 0.087  0.056  74  THR HHH CB   
1251 O OG1  . THR B 74  ? 0.545 0.534 0.599 -0.060 0.083  0.059  74  THR HHH OG1  
1252 C CG2  . THR B 74  ? 0.538 0.519 0.612 -0.069 0.084  0.055  74  THR HHH CG2  
1253 H H    . THR B 74  ? 0.518 0.525 0.607 -0.067 0.095  0.057  74  THR HHH H    
1254 H HA   . THR B 74  ? 0.509 0.520 0.596 -0.069 0.072  0.047  74  THR HHH HA   
1255 H HB   . THR B 74  ? 0.546 0.532 0.624 -0.069 0.097  0.060  74  THR HHH HB   
1257 H HG21 . THR B 74  ? 0.545 0.523 0.630 -0.074 0.089  0.054  74  THR HHH HG21 
1258 H HG22 . THR B 74  ? 0.545 0.518 0.607 -0.065 0.086  0.059  74  THR HHH HG22 
1259 H HG23 . THR B 74  ? 0.531 0.517 0.606 -0.070 0.077  0.050  74  THR HHH HG23 
1260 N N    . SER B 75  ? 0.521 0.533 0.663 -0.085 0.086  0.047  75  SER HHH N    
1261 C CA   . SER B 75  ? 0.529 0.542 0.700 -0.095 0.082  0.044  75  SER HHH CA   
1262 C C    . SER B 75  ? 0.527 0.550 0.711 -0.099 0.063  0.036  75  SER HHH C    
1263 O O    . SER B 75  ? 0.542 0.558 0.737 -0.106 0.052  0.031  75  SER HHH O    
1264 C CB   . SER B 75  ? 0.524 0.540 0.726 -0.099 0.097  0.049  75  SER HHH CB   
1265 O OG   . SER B 75  ? 0.504 0.537 0.732 -0.100 0.096  0.048  75  SER HHH OG   
1266 H H    . SER B 75  ? 0.525 0.539 0.669 -0.083 0.095  0.051  75  SER HHH H    
1267 H HA   . SER B 75  ? 0.536 0.537 0.698 -0.096 0.081  0.043  75  SER HHH HA   
1268 H HB2  . SER B 75  ? 0.531 0.543 0.749 -0.105 0.096  0.048  75  SER HHH HB2  
1269 H HB3  . SER B 75  ? 0.532 0.540 0.720 -0.095 0.110  0.055  75  SER HHH HB3  
1271 N N    . VAL B 76  ? 0.520 0.554 0.698 -0.094 0.057  0.035  76  VAL HHH N    
1272 C CA   . VAL B 76  ? 0.517 0.559 0.703 -0.096 0.038  0.028  76  VAL HHH CA   
1273 C C    . VAL B 76  ? 0.502 0.539 0.654 -0.089 0.031  0.025  76  VAL HHH C    
1274 O O    . VAL B 76  ? 0.494 0.535 0.645 -0.090 0.018  0.021  76  VAL HHH O    
1275 C CB   . VAL B 76  ? 0.519 0.579 0.736 -0.097 0.039  0.030  76  VAL HHH CB   
1276 C CG1  . VAL B 76  ? 0.526 0.591 0.769 -0.104 0.018  0.024  76  VAL HHH CG1  
1277 C CG2  . VAL B 76  ? 0.525 0.590 0.769 -0.098 0.059  0.037  76  VAL HHH CG2  
1278 H H    . VAL B 76  ? 0.515 0.552 0.684 -0.089 0.064  0.038  76  VAL HHH H    
1279 H HA   . VAL B 76  ? 0.525 0.561 0.719 -0.102 0.030  0.025  76  VAL HHH HA   
1280 H HB   . VAL B 76  ? 0.510 0.575 0.714 -0.091 0.040  0.030  76  VAL HHH HB   
1281 H HG11 . VAL B 76  ? 0.527 0.585 0.748 -0.102 0.007  0.020  76  VAL HHH HG11 
1282 H HG12 . VAL B 76  ? 0.518 0.595 0.783 -0.103 0.019  0.026  76  VAL HHH HG12 
1283 H HG13 . VAL B 76  ? 0.534 0.593 0.790 -0.110 0.015  0.023  76  VAL HHH HG13 
1284 H HG21 . VAL B 76  ? 0.532 0.591 0.786 -0.103 0.060  0.037  76  VAL HHH HG21 
1285 H HG22 . VAL B 76  ? 0.519 0.595 0.789 -0.099 0.059  0.037  76  VAL HHH HG22 
1286 H HG23 . VAL B 76  ? 0.524 0.585 0.749 -0.093 0.070  0.040  76  VAL HHH HG23 
1287 N N    . SER B 77  ? 0.484 0.514 0.612 -0.083 0.040  0.029  77  SER HHH N    
1288 C CA   . SER B 77  ? 0.470 0.496 0.572 -0.077 0.037  0.027  77  SER HHH CA   
1289 C C    . SER B 77  ? 0.444 0.484 0.547 -0.073 0.032  0.027  77  SER HHH C    
1290 O O    . SER B 77  ? 0.445 0.482 0.535 -0.071 0.023  0.023  77  SER HHH O    
1291 C CB   . SER B 77  ? 0.484 0.494 0.571 -0.079 0.028  0.022  77  SER HHH CB   
1292 O OG   . SER B 77  ? 0.505 0.501 0.584 -0.079 0.036  0.023  77  SER HHH OG   
1293 H H    . SER B 77  ? 0.490 0.516 0.617 -0.083 0.049  0.032  77  SER HHH H    
1294 H HA   . SER B 77  ? 0.470 0.493 0.562 -0.073 0.044  0.032  77  SER HHH HA   
1295 H HB2  . SER B 77  ? 0.492 0.501 0.587 -0.084 0.020  0.018  77  SER HHH HB2  
1296 H HB3  . SER B 77  ? 0.483 0.493 0.557 -0.075 0.026  0.021  77  SER HHH HB3  
1298 N N    . THR B 78  ? 0.427 0.478 0.544 -0.072 0.038  0.030  78  THR HHH N    
1299 C CA   . THR B 78  ? 0.415 0.479 0.537 -0.069 0.034  0.029  78  THR HHH CA   
1300 C C    . THR B 78  ? 0.409 0.474 0.518 -0.063 0.044  0.034  78  THR HHH C    
1301 O O    . THR B 78  ? 0.418 0.479 0.529 -0.063 0.056  0.039  78  THR HHH O    
1302 C CB   . THR B 78  ? 0.408 0.483 0.562 -0.074 0.031  0.028  78  THR HHH CB   
1303 O OG1  . THR B 78  ? 0.427 0.497 0.588 -0.080 0.017  0.023  78  THR HHH OG1  
1304 C CG2  . THR B 78  ? 0.394 0.481 0.555 -0.071 0.027  0.028  78  THR HHH CG2  
1305 H H    . THR B 78  ? 0.432 0.483 0.555 -0.073 0.046  0.033  78  THR HHH H    
1306 H HA   . THR B 78  ? 0.412 0.475 0.523 -0.068 0.026  0.026  78  THR HHH HA   
1307 H HB   . THR B 78  ? 0.414 0.489 0.580 -0.075 0.041  0.031  78  THR HHH HB   
1309 H HG21 . THR B 78  ? 0.393 0.482 0.547 -0.066 0.036  0.030  78  THR HHH HG21 
1310 H HG22 . THR B 78  ? 0.395 0.490 0.581 -0.074 0.026  0.027  78  THR HHH HG22 
1311 H HG23 . THR B 78  ? 0.394 0.480 0.543 -0.069 0.018  0.025  78  THR HHH HG23 
1312 N N    . ALA B 79  ? 0.399 0.467 0.493 -0.058 0.038  0.034  79  ALA HHH N    
1313 C CA   . ALA B 79  ? 0.396 0.464 0.478 -0.052 0.043  0.037  79  ALA HHH CA   
1314 C C    . ALA B 79  ? 0.379 0.457 0.474 -0.051 0.043  0.035  79  ALA HHH C    
1315 O O    . ALA B 79  ? 0.367 0.454 0.479 -0.054 0.035  0.032  79  ALA HHH O    
1316 C CB   . ALA B 79  ? 0.392 0.457 0.457 -0.048 0.036  0.037  79  ALA HHH CB   
1317 H H    . ALA B 79  ? 0.396 0.464 0.486 -0.058 0.031  0.031  79  ALA HHH H    
1318 H HA   . ALA B 79  ? 0.403 0.464 0.481 -0.052 0.051  0.040  79  ALA HHH HA   
1319 H HB1  . ALA B 79  ? 0.395 0.457 0.451 -0.045 0.037  0.039  79  ALA HHH HB1  
1320 H HB2  . ALA B 79  ? 0.397 0.455 0.456 -0.048 0.036  0.039  79  ALA HHH HB2  
1321 H HB3  . ALA B 79  ? 0.386 0.455 0.453 -0.048 0.030  0.034  79  ALA HHH HB3  
1322 N N    . TYR B 80  ? 0.380 0.454 0.465 -0.047 0.051  0.038  80  TYR HHH N    
1323 C CA   . TYR B 80  ? 0.377 0.457 0.472 -0.045 0.056  0.038  80  TYR HHH CA   
1324 C C    . TYR B 80  ? 0.376 0.449 0.446 -0.039 0.055  0.038  80  TYR HHH C    
1325 O O    . TYR B 80  ? 0.390 0.449 0.436 -0.037 0.055  0.041  80  TYR HHH O    
1326 C CB   . TYR B 80  ? 0.393 0.470 0.504 -0.046 0.073  0.041  80  TYR HHH CB   
1327 C CG   . TYR B 80  ? 0.393 0.479 0.535 -0.053 0.072  0.041  80  TYR HHH CG   
1328 C CD1  . TYR B 80  ? 0.380 0.481 0.553 -0.057 0.062  0.037  80  TYR HHH CD1  
1329 C CD2  . TYR B 80  ? 0.405 0.482 0.546 -0.056 0.080  0.043  80  TYR HHH CD2  
1330 C CE1  . TYR B 80  ? 0.380 0.486 0.581 -0.064 0.057  0.036  80  TYR HHH CE1  
1331 C CE2  . TYR B 80  ? 0.403 0.485 0.572 -0.063 0.078  0.042  80  TYR HHH CE2  
1332 C CZ   . TYR B 80  ? 0.391 0.487 0.591 -0.067 0.066  0.039  80  TYR HHH CZ   
1333 O OH   . TYR B 80  ? 0.389 0.489 0.617 -0.075 0.060  0.037  80  TYR HHH OH   
1334 H H    . TYR B 80  ? 0.389 0.454 0.457 -0.045 0.054  0.041  80  TYR HHH H    
1335 H HA   . TYR B 80  ? 0.367 0.458 0.478 -0.047 0.048  0.035  80  TYR HHH HA   
1336 H HB2  . TYR B 80  ? 0.406 0.471 0.499 -0.044 0.080  0.044  80  TYR HHH HB2  
1337 H HB3  . TYR B 80  ? 0.394 0.475 0.513 -0.044 0.078  0.041  80  TYR HHH HB3  
1338 H HD1  . TYR B 80  ? 0.375 0.481 0.549 -0.054 0.057  0.036  80  TYR HHH HD1  
1339 H HD2  . TYR B 80  ? 0.415 0.479 0.533 -0.054 0.085  0.046  80  TYR HHH HD2  
1340 H HE1  . TYR B 80  ? 0.375 0.490 0.597 -0.066 0.048  0.034  80  TYR HHH HE1  
1341 H HE2  . TYR B 80  ? 0.410 0.485 0.577 -0.065 0.083  0.044  80  TYR HHH HE2  
1343 N N    . LEU B 81  ? 0.367 0.449 0.445 -0.037 0.051  0.036  81  LEU HHH N    
1344 C CA   . LEU B 81  ? 0.374 0.447 0.431 -0.032 0.052  0.036  81  LEU HHH CA   
1345 C C    . LEU B 81  ? 0.377 0.452 0.448 -0.029 0.064  0.036  81  LEU HHH C    
1346 O O    . LEU B 81  ? 0.363 0.454 0.460 -0.030 0.059  0.034  81  LEU HHH O    
1347 C CB   . LEU B 81  ? 0.359 0.439 0.413 -0.031 0.037  0.033  81  LEU HHH CB   
1348 C CG   . LEU B 81  ? 0.366 0.440 0.405 -0.027 0.035  0.032  81  LEU HHH CG   
1349 C CD1  . LEU B 81  ? 0.388 0.440 0.396 -0.024 0.039  0.035  81  LEU HHH CD1  
1350 C CD2  . LEU B 81  ? 0.356 0.437 0.395 -0.027 0.021  0.030  81  LEU HHH CD2  
1351 H H    . LEU B 81  ? 0.358 0.450 0.454 -0.039 0.047  0.034  81  LEU HHH H    
1352 H HA   . LEU B 81  ? 0.386 0.446 0.423 -0.030 0.055  0.038  81  LEU HHH HA   
1353 H HB2  . LEU B 81  ? 0.358 0.435 0.403 -0.032 0.031  0.034  81  LEU HHH HB2  
1354 H HB3  . LEU B 81  ? 0.349 0.440 0.419 -0.033 0.032  0.031  81  LEU HHH HB3  
1355 H HG   . LEU B 81  ? 0.367 0.445 0.417 -0.025 0.041  0.032  81  LEU HHH HG   
1356 H HD11 . LEU B 81  ? 0.401 0.446 0.406 -0.023 0.050  0.036  81  LEU HHH HD11 
1357 H HD12 . LEU B 81  ? 0.392 0.440 0.389 -0.022 0.034  0.034  81  LEU HHH HD12 
1358 H HD13 . LEU B 81  ? 0.389 0.438 0.391 -0.025 0.034  0.036  81  LEU HHH HD13 
1359 H HD21 . LEU B 81  ? 0.353 0.433 0.388 -0.028 0.017  0.031  81  LEU HHH HD21 
1360 H HD22 . LEU B 81  ? 0.360 0.436 0.389 -0.024 0.020  0.030  81  LEU HHH HD22 
1361 H HD23 . LEU B 81  ? 0.346 0.437 0.400 -0.028 0.019  0.028  81  LEU HHH HD23 
1362 N N    . HIS B 82  ? 0.395 0.452 0.449 -0.026 0.080  0.039  82  HIS HHH N    
1363 C CA   . HIS B 82  ? 0.408 0.461 0.470 -0.022 0.097  0.041  82  HIS HHH CA   
1364 C C    . HIS B 82  ? 0.427 0.466 0.460 -0.016 0.094  0.039  82  HIS HHH C    
1365 O O    . HIS B 82  ? 0.443 0.462 0.437 -0.015 0.088  0.039  82  HIS HHH O    
1366 C CB   . HIS B 82  ? 0.429 0.463 0.483 -0.021 0.120  0.045  82  HIS HHH CB   
1367 C CG   . HIS B 82  ? 0.444 0.470 0.507 -0.016 0.142  0.048  82  HIS HHH CG   
1368 N ND1  . HIS B 82  ? 0.428 0.477 0.543 -0.017 0.149  0.048  82  HIS HHH ND1  
1369 C CD2  . HIS B 82  ? 0.476 0.473 0.504 -0.009 0.160  0.049  82  HIS HHH CD2  
1370 C CE1  . HIS B 82  ? 0.450 0.485 0.565 -0.011 0.173  0.051  82  HIS HHH CE1  
1371 N NE2  . HIS B 82  ? 0.482 0.483 0.540 -0.006 0.181  0.051  82  HIS HHH NE2  
1372 H H    . HIS B 82  ? 0.409 0.452 0.443 -0.026 0.083  0.041  82  HIS HHH H    
1373 H HA   . HIS B 82  ? 0.394 0.463 0.487 -0.023 0.096  0.040  82  HIS HHH HA   
1374 H HB2  . HIS B 82  ? 0.420 0.464 0.497 -0.025 0.121  0.046  82  HIS HHH HB2  
1375 H HB3  . HIS B 82  ? 0.446 0.462 0.468 -0.019 0.119  0.046  82  HIS HHH HB3  
1377 H HD2  . HIS B 82  ? 0.497 0.472 0.486 -0.007 0.158  0.049  82  HIS HHH HD2  
1378 H HE1  . HIS B 82  ? 0.446 0.492 0.595 -0.010 0.182  0.053  82  HIS HHH HE1  
1380 N N    . ILE B 83  ? 0.434 0.482 0.484 -0.013 0.097  0.037  83  ILE HHH N    
1381 C CA   . ILE B 83  ? 0.452 0.485 0.476 -0.008 0.097  0.035  83  ILE HHH CA   
1382 C C    . ILE B 83  ? 0.480 0.502 0.511 -0.002 0.122  0.037  83  ILE HHH C    
1383 O O    . ILE B 83  ? 0.472 0.514 0.547 -0.003 0.128  0.038  83  ILE HHH O    
1384 C CB   . ILE B 83  ? 0.428 0.481 0.468 -0.009 0.078  0.031  83  ILE HHH CB   
1385 C CG1  . ILE B 83  ? 0.411 0.471 0.445 -0.014 0.059  0.030  83  ILE HHH CG1  
1386 C CG2  . ILE B 83  ? 0.446 0.484 0.464 -0.003 0.079  0.029  83  ILE HHH CG2  
1387 C CD1  . ILE B 83  ? 0.392 0.468 0.439 -0.014 0.043  0.027  83  ILE HHH CD1  
1388 H H    . ILE B 83  ? 0.420 0.483 0.500 -0.015 0.099  0.037  83  ILE HHH H    
1389 H HA   . ILE B 83  ? 0.468 0.484 0.461 -0.007 0.094  0.035  83  ILE HHH HA   
1390 H HB   . ILE B 83  ? 0.415 0.484 0.486 -0.010 0.080  0.032  83  ILE HHH HB   
1391 H HG12 . ILE B 83  ? 0.424 0.470 0.432 -0.013 0.056  0.030  83  ILE HHH HG12 
1392 H HG13 . ILE B 83  ? 0.404 0.472 0.451 -0.017 0.059  0.031  83  ILE HHH HG13 
1393 H HG21 . ILE B 83  ? 0.453 0.489 0.482 0.000  0.093  0.030  83  ILE HHH HG21 
1394 H HG22 . ILE B 83  ? 0.431 0.479 0.455 -0.004 0.067  0.027  83  ILE HHH HG22 
1395 H HG23 . ILE B 83  ? 0.464 0.482 0.451 -0.002 0.079  0.029  83  ILE HHH HG23 
1396 H HD11 . ILE B 83  ? 0.385 0.471 0.453 -0.014 0.045  0.027  83  ILE HHH HD11 
1397 H HD12 . ILE B 83  ? 0.381 0.463 0.431 -0.018 0.035  0.027  83  ILE HHH HD12 
1398 H HD13 . ILE B 83  ? 0.398 0.465 0.428 -0.012 0.039  0.026  83  ILE HHH HD13 
1399 N N    . HIS B 84  ? 0.527 0.515 0.514 0.003  0.135  0.038  84  HIS HHH N    
1400 C CA   . HIS B 84  ? 0.564 0.532 0.548 0.009  0.164  0.041  84  HIS HHH CA   
1401 C C    . HIS B 84  ? 0.590 0.546 0.558 0.016  0.166  0.037  84  HIS HHH C    
1402 O O    . HIS B 84  ? 0.597 0.539 0.527 0.015  0.147  0.034  84  HIS HHH O    
1403 C CB   . HIS B 84  ? 0.603 0.533 0.540 0.012  0.181  0.044  84  HIS HHH CB   
1404 C CG   . HIS B 84  ? 0.633 0.544 0.574 0.018  0.216  0.048  84  HIS HHH CG   
1405 N ND1  . HIS B 84  ? 0.624 0.550 0.609 0.015  0.234  0.053  84  HIS HHH ND1  
1406 C CD2  . HIS B 84  ? 0.678 0.556 0.589 0.026  0.239  0.049  84  HIS HHH CD2  
1407 C CE1  . HIS B 84  ? 0.663 0.567 0.647 0.022  0.268  0.057  84  HIS HHH CE1  
1408 N NE2  . HIS B 84  ? 0.696 0.570 0.633 0.029  0.272  0.054  84  HIS HHH NE2  
1409 H H    . HIS B 84  ? 0.538 0.511 0.493 0.003  0.126  0.037  84  HIS HHH H    
1410 H HA   . HIS B 84  ? 0.551 0.537 0.574 0.009  0.173  0.043  84  HIS HHH HA   
1411 H HB2  . HIS B 84  ? 0.593 0.531 0.537 0.007  0.175  0.045  84  HIS HHH HB2  
1412 H HB3  . HIS B 84  ? 0.624 0.531 0.520 0.013  0.173  0.042  84  HIS HHH HB3  
1414 H HD2  . HIS B 84  ? 0.694 0.554 0.573 0.029  0.233  0.046  84  HIS HHH HD2  
1415 H HE1  . HIS B 84  ? 0.665 0.574 0.677 0.022  0.287  0.062  84  HIS HHH HE1  
1417 N N    . GLY B 85  ? 0.612 0.572 0.609 0.021  0.186  0.039  85  GLY HHH N    
1418 C CA   . GLY B 85  ? 0.637 0.583 0.623 0.028  0.193  0.037  85  GLY HHH CA   
1419 C C    . GLY B 85  ? 0.608 0.571 0.594 0.025  0.163  0.032  85  GLY HHH C    
1420 O O    . GLY B 85  ? 0.623 0.562 0.563 0.027  0.154  0.028  85  GLY HHH O    
1421 H H    . GLY B 85  ? 0.602 0.575 0.633 0.020  0.197  0.042  85  GLY HHH H    
1422 H HA2  . GLY B 85  ? 0.631 0.589 0.653 0.031  0.207  0.039  85  GLY HHH HA2  
1423 N N    . LEU B 86  ? 0.573 0.576 0.611 0.021  0.149  0.032  86  LEU HHH N    
1424 C CA   . LEU B 86  ? 0.551 0.572 0.593 0.018  0.121  0.028  86  LEU HHH CA   
1425 C C    . LEU B 86  ? 0.567 0.571 0.587 0.024  0.121  0.025  86  LEU HHH C    
1426 O O    . LEU B 86  ? 0.592 0.586 0.620 0.031  0.142  0.027  86  LEU HHH O    
1427 C CB   . LEU B 86  ? 0.517 0.574 0.616 0.015  0.111  0.030  86  LEU HHH CB   
1428 C CG   . LEU B 86  ? 0.497 0.572 0.610 0.007  0.097  0.030  86  LEU HHH CG   
1429 C CD1  . LEU B 86  ? 0.478 0.581 0.645 0.004  0.091  0.032  86  LEU HHH CD1  
1430 C CD2  . LEU B 86  ? 0.484 0.560 0.571 0.003  0.074  0.027  86  LEU HHH CD2  
1431 H H    . LEU B 86  ? 0.562 0.580 0.633 0.020  0.155  0.035  86  LEU HHH H    
1432 H HA   . LEU B 86  ? 0.547 0.564 0.569 0.014  0.109  0.027  86  LEU HHH HA   
1433 H HB2  . LEU B 86  ? 0.521 0.583 0.647 0.017  0.126  0.032  86  LEU HHH HB2  
1434 H HB3  . LEU B 86  ? 0.508 0.571 0.610 0.015  0.100  0.028  86  LEU HHH HB3  
1435 H HG   . LEU B 86  ? 0.508 0.574 0.611 0.006  0.107  0.032  86  LEU HHH HG   
1436 H HD11 . LEU B 86  ? 0.484 0.588 0.673 0.006  0.106  0.035  86  LEU HHH HD11 
1437 H HD12 . LEU B 86  ? 0.465 0.577 0.637 -0.001 0.081  0.032  86  LEU HHH HD12 
1438 H HD13 . LEU B 86  ? 0.469 0.580 0.646 0.006  0.082  0.031  86  LEU HHH HD13 
1439 H HD21 . LEU B 86  ? 0.477 0.558 0.569 0.004  0.066  0.025  86  LEU HHH HD21 
1440 H HD22 . LEU B 86  ? 0.472 0.557 0.568 -0.002 0.067  0.027  86  LEU HHH HD22 
1441 H HD23 . LEU B 86  ? 0.499 0.557 0.555 0.003  0.076  0.026  86  LEU HHH HD23 
1442 N N    . LYS B 87  ? 0.564 0.565 0.560 0.021  0.100  0.022  87  LYS HHH N    
1443 C CA   . LYS B 87  ? 0.583 0.572 0.563 0.025  0.094  0.019  87  LYS HHH CA   
1444 C C    . LYS B 87  ? 0.554 0.571 0.561 0.021  0.073  0.018  87  LYS HHH C    
1445 O O    . LYS B 87  ? 0.532 0.569 0.555 0.015  0.061  0.019  87  LYS HHH O    
1446 C CB   . LYS B 87  ? 0.617 0.572 0.541 0.024  0.088  0.016  87  LYS HHH CB   
1447 C CG   . LYS B 87  ? 0.667 0.584 0.554 0.030  0.111  0.016  87  LYS HHH CG   
1448 C CD   . LYS B 87  ? 0.710 0.591 0.540 0.028  0.100  0.014  87  LYS HHH CD   
1449 C CE   . LYS B 87  ? 0.770 0.614 0.561 0.032  0.122  0.016  87  LYS HHH CE   
1450 N NZ   . LYS B 87  ? 0.824 0.620 0.549 0.032  0.112  0.013  87  LYS HHH NZ   
1451 H H    . LYS B 87  ? 0.556 0.561 0.545 0.016  0.088  0.021  87  LYS HHH H    
1452 H HA   . LYS B 87  ? 0.593 0.579 0.583 0.030  0.109  0.019  87  LYS HHH HA   
1453 H HB2  . LYS B 87  ? 0.608 0.567 0.527 0.019  0.076  0.016  87  LYS HHH HB2  
1454 H HB3  . LYS B 87  ? 0.621 0.570 0.537 0.025  0.081  0.013  87  LYS HHH HB3  
1455 H HG2  . LYS B 87  ? 0.684 0.590 0.568 0.035  0.122  0.015  87  LYS HHH HG2  
1456 H HG3  . LYS B 87  ? 0.665 0.589 0.567 0.029  0.122  0.019  87  LYS HHH HG3  
1457 H HD2  . LYS B 87  ? 0.693 0.586 0.528 0.022  0.084  0.014  87  LYS HHH HD2  
1458 H HD3  . LYS B 87  ? 0.727 0.591 0.536 0.029  0.094  0.011  87  LYS HHH HD3  
1459 H HE2  . LYS B 87  ? 0.779 0.618 0.578 0.037  0.142  0.017  87  LYS HHH HE2  
1460 H HE3  . LYS B 87  ? 0.754 0.611 0.559 0.029  0.123  0.019  87  LYS HHH HE3  
1461 H HZ1  . LYS B 87  ? 0.810 0.613 0.534 0.027  0.092  0.013  87  LYS HHH HZ1  
1462 H HZ2  . LYS B 87  ? 0.850 0.624 0.551 0.034  0.124  0.015  87  LYS HHH HZ2  
1463 H HZ3  . LYS B 87  ? 0.840 0.620 0.549 0.035  0.114  0.011  87  LYS HHH HZ3  
1464 N N    . THR B 88  ? 0.566 0.583 0.576 0.024  0.069  0.016  88  THR HHH N    
1465 C CA   . THR B 88  ? 0.550 0.585 0.578 0.022  0.050  0.016  88  THR HHH CA   
1466 C C    . THR B 88  ? 0.555 0.587 0.559 0.016  0.033  0.014  88  THR HHH C    
1467 O O    . THR B 88  ? 0.526 0.575 0.546 0.012  0.019  0.015  88  THR HHH O    
1468 C CB   . THR B 88  ? 0.561 0.591 0.592 0.028  0.053  0.015  88  THR HHH CB   
1469 O OG1  . THR B 88  ? 0.593 0.591 0.582 0.030  0.058  0.011  88  THR HHH OG1  
1470 C CG2  . THR B 88  ? 0.561 0.599 0.626 0.035  0.069  0.017  88  THR HHH CG2  
1471 H H    . THR B 88  ? 0.585 0.586 0.584 0.029  0.079  0.015  88  THR HHH H    
1472 H HA   . THR B 88  ? 0.533 0.588 0.588 0.021  0.048  0.017  88  THR HHH HA   
1473 H HB   . THR B 88  ? 0.547 0.586 0.584 0.026  0.040  0.014  88  THR HHH HB   
1475 H HG21 . THR B 88  ? 0.542 0.601 0.636 0.033  0.061  0.019  88  THR HHH HG21 
1476 H HG22 . THR B 88  ? 0.573 0.602 0.634 0.039  0.074  0.016  88  THR HHH HG22 
1477 H HG23 . THR B 88  ? 0.572 0.605 0.637 0.036  0.082  0.018  88  THR HHH HG23 
1478 N N    . GLU B 89  ? 0.596 0.604 0.566 0.015  0.033  0.013  89  GLU HHH N    
1479 C CA   . GLU B 89  ? 0.598 0.600 0.549 0.009  0.017  0.012  89  GLU HHH CA   
1480 C C    . GLU B 89  ? 0.551 0.574 0.521 0.004  0.012  0.015  89  GLU HHH C    
1481 O O    . GLU B 89  ? 0.544 0.572 0.515 -0.001 -0.001 0.015  89  GLU HHH O    
1482 C CB   . GLU B 89  ? 0.659 0.629 0.570 0.009  0.018  0.011  89  GLU HHH CB   
1483 C CG   . GLU B 89  ? 0.708 0.650 0.590 0.012  0.016  0.007  89  GLU HHH CG   
1484 C CD   . GLU B 89  ? 0.731 0.665 0.614 0.020  0.035  0.006  89  GLU HHH CD   
1485 O OE1  . GLU B 89  ? 0.734 0.664 0.618 0.024  0.054  0.007  89  GLU HHH OE1  
1486 O OE2  . GLU B 89  ? 0.737 0.670 0.624 0.022  0.031  0.004  89  GLU HHH OE2  
1487 H H    . GLU B 89  ? 0.614 0.605 0.568 0.018  0.044  0.012  89  GLU HHH H    
1488 H HA   . GLU B 89  ? 0.592 0.596 0.546 0.008  0.008  0.011  89  GLU HHH HA   
1489 H HB2  . GLU B 89  ? 0.669 0.632 0.574 0.011  0.030  0.012  89  GLU HHH HB2  
1490 H HB3  . GLU B 89  ? 0.654 0.624 0.560 0.005  0.007  0.012  89  GLU HHH HB3  
1491 H HG2  . GLU B 89  ? 0.730 0.649 0.583 0.012  0.013  0.006  89  GLU HHH HG2  
1492 H HG3  . GLU B 89  ? 0.694 0.643 0.584 0.010  0.004  0.007  89  GLU HHH HG3  
1493 N N    . ASP B 90  ? 0.518 0.551 0.505 0.005  0.024  0.016  90  ASP HHH N    
1494 C CA   . ASP B 90  ? 0.487 0.534 0.486 -0.000 0.021  0.018  90  ASP HHH CA   
1495 C C    . ASP B 90  ? 0.449 0.520 0.478 -0.002 0.013  0.019  90  ASP HHH C    
1496 O O    . ASP B 90  ? 0.437 0.517 0.472 -0.007 0.008  0.020  90  ASP HHH O    
1497 C CB   . ASP B 90  ? 0.490 0.535 0.495 0.001  0.037  0.020  90  ASP HHH CB   
1498 C CG   . ASP B 90  ? 0.522 0.539 0.491 0.003  0.046  0.020  90  ASP HHH CG   
1499 O OD1  . ASP B 90  ? 0.534 0.536 0.476 0.001  0.034  0.020  90  ASP HHH OD1  
1500 O OD2  . ASP B 90  ? 0.535 0.541 0.502 0.007  0.065  0.021  90  ASP HHH OD2  
1501 H H    . ASP B 90  ? 0.528 0.559 0.520 0.008  0.034  0.016  90  ASP HHH H    
1502 H HA   . ASP B 90  ? 0.489 0.530 0.475 -0.003 0.014  0.019  90  ASP HHH HA   
1503 H HB2  . ASP B 90  ? 0.490 0.542 0.512 0.004  0.045  0.020  90  ASP HHH HB2  
1504 H HB3  . ASP B 90  ? 0.479 0.535 0.496 -0.002 0.035  0.021  90  ASP HHH HB3  
1505 N N    . THR B 91  ? 0.434 0.512 0.476 0.000  0.010  0.018  91  THR HHH N    
1506 C CA   . THR B 91  ? 0.415 0.509 0.479 -0.001 0.001  0.019  91  THR HHH CA   
1507 C C    . THR B 91  ? 0.400 0.495 0.454 -0.006 -0.009 0.019  91  THR HHH C    
1508 O O    . THR B 91  ? 0.408 0.493 0.446 -0.006 -0.012 0.019  91  THR HHH O    
1509 C CB   . THR B 91  ? 0.407 0.506 0.487 0.003  -0.001 0.019  91  THR HHH CB   
1510 O OG1  . THR B 91  ? 0.416 0.511 0.484 0.003  -0.011 0.019  91  THR HHH OG1  
1511 C CG2  . THR B 91  ? 0.421 0.512 0.501 0.009  0.012  0.019  91  THR HHH CG2  
1512 H H    . THR B 91  ? 0.445 0.515 0.481 0.004  0.013  0.017  91  THR HHH H    
1513 H HA   . THR B 91  ? 0.409 0.510 0.486 -0.003 0.004  0.020  91  THR HHH HA   
1514 H HB   . THR B 91  ? 0.404 0.514 0.502 0.002  -0.004 0.020  91  THR HHH HB   
1516 H HG21 . THR B 91  ? 0.428 0.515 0.507 0.009  0.021  0.019  91  THR HHH HG21 
1517 H HG22 . THR B 91  ? 0.419 0.517 0.519 0.012  0.011  0.020  91  THR HHH HG22 
1518 H HG23 . THR B 91  ? 0.429 0.509 0.492 0.010  0.011  0.018  91  THR HHH HG23 
1519 N N    . ALA B 92  ? 0.388 0.490 0.449 -0.009 -0.013 0.020  92  ALA HHH N    
1520 C CA   . ALA B 92  ? 0.383 0.483 0.435 -0.013 -0.018 0.021  92  ALA HHH CA   
1521 C C    . ALA B 92  ? 0.376 0.481 0.436 -0.016 -0.021 0.021  92  ALA HHH C    
1522 O O    . ALA B 92  ? 0.371 0.483 0.446 -0.016 -0.018 0.020  92  ALA HHH O    
1523 C CB   . ALA B 92  ? 0.383 0.476 0.423 -0.014 -0.016 0.021  92  ALA HHH CB   
1524 H H    . ALA B 92  ? 0.387 0.495 0.460 -0.010 -0.012 0.020  92  ALA HHH H    
1525 H HA   . ALA B 92  ? 0.382 0.480 0.431 -0.012 -0.022 0.021  92  ALA HHH HA   
1526 H HB1  . ALA B 92  ? 0.381 0.474 0.420 -0.017 -0.017 0.022  92  ALA HHH HB1  
1527 H HB2  . ALA B 92  ? 0.388 0.475 0.422 -0.013 -0.018 0.021  92  ALA HHH HB2  
1528 H HB3  . ALA B 92  ? 0.388 0.480 0.428 -0.014 -0.011 0.021  92  ALA HHH HB3  
1529 N N    . MET B 93  ? 0.377 0.478 0.429 -0.018 -0.025 0.021  93  MET HHH N    
1530 C CA   . MET B 93  ? 0.383 0.482 0.433 -0.021 -0.026 0.021  93  MET HHH CA   
1531 C C    . MET B 93  ? 0.379 0.478 0.429 -0.023 -0.019 0.022  93  MET HHH C    
1532 O O    . MET B 93  ? 0.367 0.462 0.410 -0.023 -0.018 0.024  93  MET HHH O    
1533 C CB   . MET B 93  ? 0.396 0.484 0.433 -0.021 -0.029 0.021  93  MET HHH CB   
1534 C CG   . MET B 93  ? 0.415 0.496 0.445 -0.024 -0.032 0.020  93  MET HHH CG   
1535 S SD   . MET B 93  ? 0.437 0.518 0.475 -0.025 -0.046 0.017  93  MET HHH SD   
1536 C CE   . MET B 93  ? 0.453 0.517 0.467 -0.021 -0.052 0.018  93  MET HHH CE   
1537 H H    . MET B 93  ? 0.380 0.476 0.425 -0.017 -0.026 0.022  93  MET HHH H    
1538 H HA   . MET B 93  ? 0.384 0.487 0.443 -0.022 -0.028 0.020  93  MET HHH HA   
1539 H HB2  . MET B 93  ? 0.401 0.487 0.435 -0.019 -0.033 0.021  93  MET HHH HB2  
1540 H HB3  . MET B 93  ? 0.396 0.481 0.428 -0.021 -0.025 0.023  93  MET HHH HB3  
1541 H HG2  . MET B 93  ? 0.424 0.494 0.441 -0.024 -0.030 0.021  93  MET HHH HG2  
1542 H HG3  . MET B 93  ? 0.411 0.496 0.447 -0.026 -0.028 0.020  93  MET HHH HG3  
1543 H HE1  . MET B 93  ? 0.462 0.523 0.477 -0.021 -0.062 0.017  93  MET HHH HE1  
1544 H HE2  . MET B 93  ? 0.447 0.515 0.464 -0.019 -0.049 0.019  93  MET HHH HE2  
1545 H HE3  . MET B 93  ? 0.464 0.515 0.461 -0.022 -0.049 0.018  93  MET HHH HE3  
1546 N N    . TYR B 94  ? 0.375 0.479 0.433 -0.025 -0.016 0.022  94  TYR HHH N    
1547 C CA   . TYR B 94  ? 0.367 0.469 0.423 -0.027 -0.010 0.023  94  TYR HHH CA   
1548 C C    . TYR B 94  ? 0.365 0.464 0.419 -0.030 -0.011 0.023  94  TYR HHH C    
1549 O O    . TYR B 94  ? 0.357 0.456 0.417 -0.032 -0.014 0.021  94  TYR HHH O    
1550 C CB   . TYR B 94  ? 0.366 0.471 0.429 -0.026 -0.004 0.023  94  TYR HHH CB   
1551 C CG   . TYR B 94  ? 0.363 0.464 0.420 -0.023 0.000  0.024  94  TYR HHH CG   
1552 C CD1  . TYR B 94  ? 0.358 0.463 0.422 -0.020 -0.000 0.022  94  TYR HHH CD1  
1553 C CD2  . TYR B 94  ? 0.366 0.456 0.405 -0.022 0.002  0.025  94  TYR HHH CD2  
1554 C CE1  . TYR B 94  ? 0.364 0.461 0.418 -0.016 0.004  0.022  94  TYR HHH CE1  
1555 C CE2  . TYR B 94  ? 0.376 0.456 0.402 -0.018 0.005  0.025  94  TYR HHH CE2  
1556 C CZ   . TYR B 94  ? 0.373 0.456 0.406 -0.015 0.007  0.023  94  TYR HHH CZ   
1557 O OH   . TYR B 94  ? 0.387 0.457 0.404 -0.012 0.010  0.022  94  TYR HHH OH   
1558 H H    . TYR B 94  ? 0.374 0.482 0.441 -0.025 -0.018 0.021  94  TYR HHH H    
1559 H HA   . TYR B 94  ? 0.368 0.466 0.416 -0.026 -0.010 0.025  94  TYR HHH HA   
1560 H HB2  . TYR B 94  ? 0.364 0.474 0.439 -0.027 -0.004 0.022  94  TYR HHH HB2  
1561 H HB3  . TYR B 94  ? 0.367 0.469 0.428 -0.028 0.000  0.025  94  TYR HHH HB3  
1562 H HD1  . TYR B 94  ? 0.354 0.465 0.430 -0.020 -0.004 0.022  94  TYR HHH HD1  
1563 H HD2  . TYR B 94  ? 0.368 0.455 0.403 -0.023 0.002  0.027  94  TYR HHH HD2  
1564 H HE1  . TYR B 94  ? 0.365 0.464 0.426 -0.014 0.005  0.022  94  TYR HHH HE1  
1565 H HE2  . TYR B 94  ? 0.386 0.456 0.398 -0.018 0.004  0.026  94  TYR HHH HE2  
1567 N N    . TYR B 95  ? 0.375 0.468 0.423 -0.030 -0.008 0.025  95  TYR HHH N    
1568 C CA   . TYR B 95  ? 0.386 0.473 0.431 -0.031 -0.006 0.026  95  TYR HHH CA   
1569 C C    . TYR B 95  ? 0.392 0.478 0.439 -0.033 -0.002 0.028  95  TYR HHH C    
1570 O O    . TYR B 95  ? 0.382 0.468 0.429 -0.032 -0.001 0.031  95  TYR HHH O    
1571 C CB   . TYR B 95  ? 0.390 0.471 0.430 -0.029 -0.005 0.028  95  TYR HHH CB   
1572 C CG   . TYR B 95  ? 0.400 0.475 0.431 -0.028 -0.007 0.026  95  TYR HHH CG   
1573 C CD1  . TYR B 95  ? 0.418 0.480 0.435 -0.029 -0.008 0.024  95  TYR HHH CD1  
1574 C CD2  . TYR B 95  ? 0.400 0.477 0.432 -0.026 -0.009 0.027  95  TYR HHH CD2  
1575 C CE1  . TYR B 95  ? 0.432 0.483 0.435 -0.028 -0.011 0.023  95  TYR HHH CE1  
1576 C CE2  . TYR B 95  ? 0.413 0.481 0.434 -0.024 -0.011 0.026  95  TYR HHH CE2  
1577 C CZ   . TYR B 95  ? 0.430 0.485 0.436 -0.025 -0.012 0.024  95  TYR HHH CZ   
1578 O OH   . TYR B 95  ? 0.440 0.481 0.429 -0.023 -0.015 0.024  95  TYR HHH OH   
1579 H H    . TYR B 95  ? 0.374 0.466 0.420 -0.029 -0.008 0.027  95  TYR HHH H    
1580 H HA   . TYR B 95  ? 0.391 0.476 0.434 -0.033 -0.009 0.023  95  TYR HHH HA   
1581 H HB2  . TYR B 95  ? 0.387 0.470 0.430 -0.028 -0.005 0.030  95  TYR HHH HB2  
1582 H HB3  . TYR B 95  ? 0.394 0.470 0.433 -0.030 -0.001 0.029  95  TYR HHH HB3  
1583 H HD1  . TYR B 95  ? 0.421 0.480 0.438 -0.031 -0.007 0.023  95  TYR HHH HD1  
1584 H HD2  . TYR B 95  ? 0.394 0.476 0.432 -0.025 -0.010 0.028  95  TYR HHH HD2  
1585 H HE1  . TYR B 95  ? 0.446 0.485 0.437 -0.028 -0.013 0.021  95  TYR HHH HE1  
1586 H HE2  . TYR B 95  ? 0.411 0.480 0.433 -0.023 -0.012 0.027  95  TYR HHH HE2  
1588 N N    . CYS B 96  ? 0.418 0.500 0.465 -0.036 -0.001 0.026  96  CYS HHH N    
1589 C CA   . CYS B 96  ? 0.431 0.508 0.478 -0.037 0.004  0.028  96  CYS HHH CA   
1590 C C    . CYS B 96  ? 0.425 0.493 0.467 -0.035 0.008  0.029  96  CYS HHH C    
1591 O O    . CYS B 96  ? 0.443 0.504 0.476 -0.035 0.007  0.027  96  CYS HHH O    
1592 C CB   . CYS B 96  ? 0.457 0.532 0.507 -0.041 0.003  0.025  96  CYS HHH CB   
1593 S SG   . CYS B 96  ? 0.527 0.596 0.579 -0.044 0.010  0.027  96  CYS HHH SG   
1594 H H    . CYS B 96  ? 0.418 0.500 0.465 -0.037 -0.004 0.024  96  CYS HHH H    
1595 H HA   . CYS B 96  ? 0.429 0.508 0.478 -0.036 0.006  0.030  96  CYS HHH HA   
1596 H HB2  . CYS B 96  ? 0.463 0.545 0.521 -0.042 0.002  0.024  96  CYS HHH HB2  
1597 H HB3  . CYS B 96  ? 0.472 0.542 0.517 -0.042 0.000  0.022  96  CYS HHH HB3  
1598 N N    . VAL B 97  ? 0.406 0.472 0.453 -0.034 0.012  0.034  97  VAL HHH N    
1599 C CA   . VAL B 97  ? 0.405 0.463 0.454 -0.031 0.018  0.036  97  VAL HHH CA   
1600 C C    . VAL B 97  ? 0.395 0.450 0.451 -0.031 0.022  0.041  97  VAL HHH C    
1601 O O    . VAL B 97  ? 0.390 0.450 0.452 -0.030 0.017  0.044  97  VAL HHH O    
1602 C CB   . VAL B 97  ? 0.400 0.460 0.455 -0.028 0.019  0.039  97  VAL HHH CB   
1603 C CG1  . VAL B 97  ? 0.397 0.467 0.460 -0.028 0.010  0.041  97  VAL HHH CG1  
1604 C CG2  . VAL B 97  ? 0.399 0.453 0.467 -0.025 0.028  0.045  97  VAL HHH CG2  
1605 H H    . VAL B 97  ? 0.406 0.476 0.456 -0.034 0.011  0.036  97  VAL HHH H    
1606 H HA   . VAL B 97  ? 0.412 0.462 0.452 -0.032 0.021  0.034  97  VAL HHH HA   
1607 H HB   . VAL B 97  ? 0.403 0.461 0.451 -0.028 0.019  0.037  97  VAL HHH HB   
1608 H HG11 . VAL B 97  ? 0.392 0.466 0.449 -0.029 0.007  0.039  97  VAL HHH HG11 
1609 H HG12 . VAL B 97  ? 0.393 0.464 0.465 -0.026 0.010  0.044  97  VAL HHH HG12 
1610 H HG13 . VAL B 97  ? 0.394 0.466 0.459 -0.028 0.008  0.043  97  VAL HHH HG13 
1611 H HG21 . VAL B 97  ? 0.397 0.455 0.476 -0.025 0.026  0.048  97  VAL HHH HG21 
1612 H HG22 . VAL B 97  ? 0.400 0.454 0.473 -0.023 0.029  0.046  97  VAL HHH HG22 
1613 H HG23 . VAL B 97  ? 0.411 0.455 0.470 -0.025 0.034  0.043  97  VAL HHH HG23 
1614 N N    . ARG B 98  ? 0.396 0.440 0.449 -0.030 0.030  0.041  98  ARG HHH N    
1615 C CA   . ARG B 98  ? 0.397 0.437 0.457 -0.029 0.035  0.044  98  ARG HHH CA   
1616 C C    . ARG B 98  ? 0.391 0.434 0.471 -0.025 0.036  0.052  98  ARG HHH C    
1617 O O    . ARG B 98  ? 0.393 0.432 0.481 -0.022 0.042  0.053  98  ARG HHH O    
1618 C CB   . ARG B 98  ? 0.414 0.437 0.463 -0.030 0.043  0.041  98  ARG HHH CB   
1619 C CG   . ARG B 98  ? 0.424 0.443 0.474 -0.032 0.045  0.043  98  ARG HHH CG   
1620 C CD   . ARG B 98  ? 0.446 0.446 0.487 -0.031 0.055  0.041  98  ARG HHH CD   
1621 N NE   . ARG B 98  ? 0.458 0.450 0.507 -0.025 0.066  0.045  98  ARG HHH NE   
1622 C CZ   . ARG B 98  ? 0.478 0.450 0.520 -0.023 0.079  0.045  98  ARG HHH CZ   
1623 N NH1  . ARG B 98  ? 0.493 0.450 0.516 -0.027 0.080  0.039  98  ARG HHH NH1  
1624 N NH2  . ARG B 98  ? 0.490 0.456 0.546 -0.016 0.092  0.050  98  ARG HHH NH2  
1625 H H    . ARG B 98  ? 0.405 0.441 0.451 -0.030 0.034  0.038  98  ARG HHH H    
1626 H HA   . ARG B 98  ? 0.395 0.438 0.454 -0.031 0.030  0.044  98  ARG HHH HA   
1627 H HB2  . ARG B 98  ? 0.420 0.439 0.456 -0.033 0.041  0.036  98  ARG HHH HB2  
1628 H HB3  . ARG B 98  ? 0.421 0.437 0.472 -0.027 0.050  0.043  98  ARG HHH HB3  
1629 H HG2  . ARG B 98  ? 0.419 0.442 0.481 -0.029 0.044  0.047  98  ARG HHH HG2  
1630 H HG3  . ARG B 98  ? 0.421 0.444 0.468 -0.035 0.040  0.040  98  ARG HHH HG3  
1631 H HD2  . ARG B 98  ? 0.449 0.446 0.491 -0.033 0.055  0.041  98  ARG HHH HD2  
1632 H HD3  . ARG B 98  ? 0.455 0.447 0.482 -0.034 0.054  0.035  98  ARG HHH HD3  
1633 H HE   . ARG B 98  ? 0.448 0.449 0.510 -0.023 0.065  0.049  98  ARG HHH HE   
1634 H HH11 . ARG B 98  ? 0.490 0.451 0.508 -0.031 0.072  0.036  98  ARG HHH HH11 
1635 H HH12 . ARG B 98  ? 0.509 0.450 0.525 -0.025 0.088  0.039  98  ARG HHH HH12 
1636 H HH21 . ARG B 98  ? 0.477 0.454 0.549 -0.014 0.090  0.054  98  ARG HHH HH21 
1637 H HH22 . ARG B 98  ? 0.502 0.454 0.553 -0.014 0.102  0.050  98  ARG HHH HH22 
1638 N N    . GLY B 99  ? 0.389 0.436 0.478 -0.024 0.029  0.056  99  GLY HHH N    
1639 C CA   . GLY B 99  ? 0.386 0.436 0.497 -0.021 0.024  0.064  99  GLY HHH CA   
1640 C C    . GLY B 99  ? 0.392 0.435 0.518 -0.017 0.033  0.069  99  GLY HHH C    
1641 O O    . GLY B 99  ? 0.410 0.445 0.533 -0.016 0.047  0.067  99  GLY HHH O    
1642 H H    . GLY B 99  ? 0.391 0.436 0.471 -0.026 0.027  0.055  99  GLY HHH H    
1643 H HA2  . GLY B 99  ? 0.381 0.435 0.501 -0.020 0.024  0.065  99  GLY HHH HA2  
1644 H HA3  . GLY B 99  ? 0.385 0.437 0.493 -0.021 0.015  0.065  99  GLY HHH HA3  
1645 N N    . GLY B 100 ? 0.388 0.432 0.531 -0.015 0.024  0.076  100 GLY HHH N    
1646 C CA   . GLY B 100 ? 0.391 0.432 0.561 -0.011 0.029  0.084  100 GLY HHH CA   
1647 C C    . GLY B 100 ? 0.406 0.437 0.564 -0.011 0.030  0.085  100 GLY HHH C    
1648 O O    . GLY B 100 ? 0.403 0.431 0.536 -0.014 0.024  0.081  100 GLY HHH O    
1649 H H    . GLY B 100 ? 0.388 0.434 0.526 -0.016 0.013  0.077  100 GLY HHH H    
1650 H HA2  . GLY B 100 ? 0.394 0.432 0.570 -0.009 0.041  0.083  100 GLY HHH HA2  
1651 H HA3  . GLY B 100 ? 0.391 0.437 0.580 -0.009 0.019  0.089  100 GLY HHH HA3  
1652 N N    . SER B 101 ? 0.419 0.445 0.597 -0.006 0.039  0.090  101 SER HHH N    
1653 C CA   . SER B 101 ? 0.434 0.448 0.605 -0.005 0.043  0.092  101 SER HHH CA   
1654 C C    . SER B 101 ? 0.441 0.454 0.603 -0.006 0.025  0.096  101 SER HHH C    
1655 O O    . SER B 101 ? 0.437 0.454 0.615 -0.004 0.009  0.102  101 SER HHH O    
1656 C CB   . SER B 101 ? 0.446 0.455 0.647 0.001  0.054  0.098  101 SER HHH CB   
1657 O OG   . SER B 101 ? 0.448 0.459 0.663 0.003  0.069  0.097  101 SER HHH OG   
1658 H H    . SER B 101 ? 0.418 0.444 0.616 -0.003 0.045  0.093  101 SER HHH H    
1659 H HA   . SER B 101 ? 0.438 0.446 0.588 -0.008 0.050  0.086  101 SER HHH HA   
1660 H HB2  . SER B 101 ? 0.446 0.459 0.668 0.004  0.044  0.105  101 SER HHH HB2  
1661 H HB3  . SER B 101 ? 0.455 0.454 0.646 0.001  0.062  0.097  101 SER HHH HB3  
1663 N N    . LEU B 102 ? 0.460 0.463 0.595 -0.009 0.027  0.092  102 LEU HHH N    
1664 C CA   . LEU B 102 ? 0.477 0.471 0.597 -0.010 0.016  0.097  102 LEU HHH CA   
1665 C C    . LEU B 102 ? 0.495 0.478 0.625 -0.006 0.020  0.103  102 LEU HHH C    
1666 O O    . LEU B 102 ? 0.504 0.475 0.619 -0.005 0.012  0.108  102 LEU HHH O    
1667 C CB   . LEU B 102 ? 0.476 0.467 0.564 -0.015 0.020  0.090  102 LEU HHH CB   
1668 C CG   . LEU B 102 ? 0.459 0.460 0.539 -0.019 0.018  0.084  102 LEU HHH CG   
1669 C CD1  . LEU B 102 ? 0.463 0.462 0.521 -0.024 0.025  0.077  102 LEU HHH CD1  
1670 C CD2  . LEU B 102 ? 0.463 0.464 0.541 -0.017 0.001  0.088  102 LEU HHH CD2  
1671 H H    . LEU B 102 ? 0.458 0.459 0.582 -0.012 0.037  0.087  102 LEU HHH H    
1672 H HA   . LEU B 102 ? 0.479 0.474 0.603 -0.008 0.003  0.101  102 LEU HHH HA   
1673 H HB2  . LEU B 102 ? 0.476 0.464 0.562 -0.017 0.030  0.087  102 LEU HHH HB2  
1674 H HB3  . LEU B 102 ? 0.488 0.470 0.563 -0.015 0.014  0.093  102 LEU HHH HB3  
1675 H HG   . LEU B 102 ? 0.451 0.459 0.542 -0.018 0.022  0.081  102 LEU HHH HG   
1676 H HD11 . LEU B 102 ? 0.459 0.459 0.521 -0.026 0.033  0.074  102 LEU HHH HD11 
1677 H HD12 . LEU B 102 ? 0.455 0.461 0.510 -0.025 0.022  0.074  102 LEU HHH HD12 
1678 H HD13 . LEU B 102 ? 0.474 0.464 0.520 -0.024 0.024  0.080  102 LEU HHH HD13 
1679 H HD21 . LEU B 102 ? 0.478 0.468 0.543 -0.016 -0.005 0.091  102 LEU HHH HD21 
1680 H HD22 . LEU B 102 ? 0.458 0.464 0.526 -0.019 0.000  0.084  102 LEU HHH HD22 
1681 H HD23 . LEU B 102 ? 0.459 0.465 0.556 -0.014 -0.004 0.091  102 LEU HHH HD23 
1682 N N    . GLY B 103 ? 0.510 0.494 0.663 -0.002 0.032  0.104  103 GLY HHH N    
1683 C CA   . GLY B 103 ? 0.539 0.514 0.712 0.003  0.037  0.111  103 GLY HHH CA   
1684 C C    . GLY B 103 ? 0.549 0.531 0.762 0.009  0.044  0.117  103 GLY HHH C    
1685 O O    . GLY B 103 ? 0.539 0.534 0.765 0.009  0.041  0.116  103 GLY HHH O    
1686 H H    . GLY B 103 ? 0.501 0.491 0.659 -0.003 0.040  0.100  103 GLY HHH H    
1687 H HA2  . GLY B 103 ? 0.547 0.517 0.718 0.004  0.026  0.117  103 GLY HHH HA2  
1688 H HA3  . GLY B 103 ? 0.544 0.511 0.704 0.001  0.049  0.108  103 GLY HHH HA3  
1689 N N    . ILE B 104 ? 0.574 0.548 0.808 0.015  0.054  0.122  104 ILE HHH N    
1690 C CA   . ILE B 104 ? 0.586 0.564 0.867 0.022  0.063  0.130  104 ILE HHH CA   
1691 C C    . ILE B 104 ? 0.586 0.556 0.860 0.023  0.091  0.123  104 ILE HHH C    
1692 O O    . ILE B 104 ? 0.607 0.561 0.876 0.026  0.106  0.122  104 ILE HHH O    
1693 C CB   . ILE B 104 ? 0.610 0.582 0.919 0.029  0.057  0.141  104 ILE HHH CB   
1694 C CG1  . ILE B 104 ? 0.618 0.591 0.923 0.028  0.027  0.148  104 ILE HHH CG1  
1695 C CG2  . ILE B 104 ? 0.605 0.584 0.971 0.037  0.068  0.150  104 ILE HHH CG2  
1696 C CD1  . ILE B 104 ? 0.606 0.593 0.926 0.026  0.007  0.150  104 ILE HHH CD1  
1697 H H    . ILE B 104 ? 0.583 0.547 0.805 0.015  0.057  0.122  104 ILE HHH H    
1698 H HA   . ILE B 104 ? 0.576 0.565 0.873 0.022  0.054  0.132  104 ILE HHH HA   
1699 H HB   . ILE B 104 ? 0.617 0.577 0.910 0.029  0.067  0.139  104 ILE HHH HB   
1700 H HG12 . ILE B 104 ? 0.621 0.587 0.890 0.024  0.025  0.143  104 ILE HHH HG12 
1701 H HG13 . ILE B 104 ? 0.627 0.594 0.950 0.033  0.023  0.155  104 ILE HHH HG13 
1702 H HG21 . ILE B 104 ? 0.612 0.582 0.976 0.040  0.089  0.147  104 ILE HHH HG21 
1703 H HG22 . ILE B 104 ? 0.613 0.591 1.002 0.041  0.058  0.159  104 ILE HHH HG22 
1704 H HG23 . ILE B 104 ? 0.596 0.586 0.977 0.037  0.064  0.150  104 ILE HHH HG23 
1705 H HD11 . ILE B 104 ? 0.600 0.596 0.956 0.030  0.012  0.154  104 ILE HHH HD11 
1706 H HD12 . ILE B 104 ? 0.616 0.599 0.936 0.027  -0.013 0.155  104 ILE HHH HD12 
1707 H HD13 . ILE B 104 ? 0.599 0.589 0.895 0.022  0.008  0.143  104 ILE HHH HD13 
1708 N N    . PHE B 105 ? 0.568 0.545 0.837 0.021  0.096  0.117  105 PHE HHH N    
1709 C CA   . PHE B 105 ? 0.567 0.531 0.820 0.021  0.121  0.110  105 PHE HHH CA   
1710 C C    . PHE B 105 ? 0.542 0.516 0.793 0.019  0.119  0.106  105 PHE HHH C    
1711 O O    . PHE B 105 ? 0.523 0.513 0.771 0.014  0.099  0.106  105 PHE HHH O    
1712 C CB   . PHE B 105 ? 0.576 0.522 0.781 0.016  0.126  0.099  105 PHE HHH CB   
1713 C CG   . PHE B 105 ? 0.561 0.515 0.738 0.007  0.107  0.094  105 PHE HHH CG   
1714 C CD1  . PHE B 105 ? 0.542 0.506 0.704 0.002  0.099  0.088  105 PHE HHH CD1  
1715 C CD2  . PHE B 105 ? 0.566 0.517 0.733 0.005  0.098  0.095  105 PHE HHH CD2  
1716 C CE1  . PHE B 105 ? 0.530 0.502 0.670 -0.005 0.085  0.083  105 PHE HHH CE1  
1717 C CE2  . PHE B 105 ? 0.557 0.513 0.701 -0.002 0.085  0.091  105 PHE HHH CE2  
1718 C CZ   . PHE B 105 ? 0.538 0.505 0.670 -0.007 0.079  0.085  105 PHE HHH CZ   
1719 H H    . PHE B 105 ? 0.558 0.545 0.831 0.019  0.084  0.118  105 PHE HHH H    
1720 H HA   . PHE B 105 ? 0.575 0.532 0.849 0.027  0.135  0.115  105 PHE HHH HA   
1721 H HB2  . PHE B 105 ? 0.584 0.520 0.774 0.015  0.138  0.094  105 PHE HHH HB2  
1722 H HB3  . PHE B 105 ? 0.587 0.523 0.794 0.018  0.131  0.102  105 PHE HHH HB3  
1723 H HD1  . PHE B 105 ? 0.541 0.507 0.708 0.004  0.106  0.087  105 PHE HHH HD1  
1724 H HD2  . PHE B 105 ? 0.573 0.517 0.751 0.009  0.102  0.100  105 PHE HHH HD2  
1725 H HE1  . PHE B 105 ? 0.524 0.503 0.656 -0.007 0.081  0.079  105 PHE HHH HE1  
1726 H HE2  . PHE B 105 ? 0.561 0.513 0.698 -0.003 0.081  0.093  105 PHE HHH HE2  
1727 H HZ   . PHE B 105 ? 0.536 0.506 0.654 -0.011 0.071  0.083  105 PHE HHH HZ   
1728 N N    . GLY B 106 ? 0.543 0.506 0.794 0.022  0.142  0.105  106 GLY HHH N    
1729 C CA   . GLY B 106 ? 0.532 0.501 0.781 0.021  0.144  0.102  106 GLY HHH CA   
1730 C C    . GLY B 106 ? 0.534 0.489 0.729 0.015  0.147  0.089  106 GLY HHH C    
1731 O O    . GLY B 106 ? 0.511 0.465 0.678 0.009  0.135  0.083  106 GLY HHH O    
1732 H H    . GLY B 106 ? 0.559 0.508 0.809 0.026  0.157  0.105  106 GLY HHH H    
1733 H HA2  . GLY B 106 ? 0.516 0.502 0.779 0.019  0.128  0.105  106 GLY HHH HA2  
1734 H HA3  . GLY B 106 ? 0.540 0.503 0.808 0.026  0.161  0.106  106 GLY HHH HA3  
1735 N N    . GLY B 107 ? 0.552 0.496 0.736 0.016  0.162  0.087  107 GLY HHH N    
1736 C CA   . GLY B 107 ? 0.563 0.493 0.698 0.011  0.161  0.076  107 GLY HHH CA   
1737 C C    . GLY B 107 ? 0.538 0.491 0.667 0.004  0.136  0.072  107 GLY HHH C    
1738 O O    . GLY B 107 ? 0.548 0.494 0.640 -0.002 0.128  0.063  107 GLY HHH O    
1739 H H    . GLY B 107 ? 0.555 0.497 0.760 0.021  0.174  0.092  107 GLY HHH H    
1740 H HA2  . GLY B 107 ? 0.574 0.495 0.706 0.014  0.174  0.076  107 GLY HHH HA2  
1741 H HA3  . GLY B 107 ? 0.579 0.492 0.688 0.010  0.165  0.071  107 GLY HHH HA3  
1742 N N    . SER B 108 ? 0.515 0.493 0.678 0.004  0.123  0.079  108 SER HHH N    
1743 C CA   . SER B 108 ? 0.485 0.483 0.645 -0.001 0.100  0.077  108 SER HHH CA   
1744 C C    . SER B 108 ? 0.472 0.473 0.622 -0.003 0.099  0.073  108 SER HHH C    
1745 O O    . SER B 108 ? 0.452 0.470 0.621 -0.004 0.087  0.076  108 SER HHH O    
1746 C CB   . SER B 108 ? 0.467 0.483 0.664 0.000  0.086  0.086  108 SER HHH CB   
1747 O OG   . SER B 108 ? 0.467 0.488 0.702 0.005  0.092  0.094  108 SER HHH OG   
1748 H H    . SER B 108 ? 0.511 0.493 0.703 0.008  0.128  0.086  108 SER HHH H    
1749 H HA   . SER B 108 ? 0.485 0.480 0.624 -0.005 0.094  0.072  108 SER HHH HA   
1750 H HB2  . SER B 108 ? 0.459 0.483 0.648 -0.003 0.071  0.084  108 SER HHH HB2  
1751 H HB3  . SER B 108 ? 0.473 0.485 0.673 0.001  0.085  0.088  108 SER HHH HB3  
1753 N N    . VAL B 109 ? 0.481 0.463 0.599 -0.003 0.111  0.067  109 VAL HHH N    
1754 C CA   . VAL B 109 ? 0.479 0.459 0.584 -0.004 0.112  0.064  109 VAL HHH CA   
1755 C C    . VAL B 109 ? 0.460 0.454 0.549 -0.010 0.092  0.058  109 VAL HHH C    
1756 O O    . VAL B 109 ? 0.450 0.445 0.525 -0.014 0.082  0.054  109 VAL HHH O    
1757 C CB   . VAL B 109 ? 0.511 0.459 0.584 -0.001 0.132  0.060  109 VAL HHH CB   
1758 C CG1  . VAL B 109 ? 0.533 0.456 0.585 0.000  0.144  0.058  109 VAL HHH CG1  
1759 C CG2  . VAL B 109 ? 0.521 0.462 0.557 -0.005 0.124  0.053  109 VAL HHH CG2  
1760 H H    . VAL B 109 ? 0.496 0.464 0.595 -0.004 0.117  0.063  109 VAL HHH H    
1761 H HA   . VAL B 109 ? 0.470 0.460 0.602 -0.002 0.114  0.070  109 VAL HHH HA   
1762 H HB   . VAL B 109 ? 0.515 0.461 0.605 0.003  0.145  0.066  109 VAL HHH HB   
1763 H HG11 . VAL B 109 ? 0.532 0.458 0.609 0.004  0.152  0.063  109 VAL HHH HG11 
1764 H HG12 . VAL B 109 ? 0.558 0.459 0.586 0.002  0.155  0.055  109 VAL HHH HG12 
1765 H HG13 . VAL B 109 ? 0.530 0.456 0.570 -0.004 0.132  0.053  109 VAL HHH HG13 
1766 H HG21 . VAL B 109 ? 0.518 0.460 0.539 -0.009 0.112  0.048  109 VAL HHH HG21 
1767 H HG22 . VAL B 109 ? 0.546 0.462 0.559 -0.003 0.136  0.051  109 VAL HHH HG22 
1768 H HG23 . VAL B 109 ? 0.506 0.461 0.555 -0.005 0.118  0.054  109 VAL HHH HG23 
1769 N N    . GLY B 110 ? 0.447 0.451 0.541 -0.011 0.086  0.058  110 GLY HHH N    
1770 C CA   . GLY B 110 ? 0.429 0.445 0.510 -0.015 0.070  0.053  110 GLY HHH CA   
1771 C C    . GLY B 110 ? 0.444 0.444 0.489 -0.018 0.070  0.046  110 GLY HHH C    
1772 O O    . GLY B 110 ? 0.459 0.450 0.494 -0.016 0.075  0.046  110 GLY HHH O    
1773 H H    . GLY B 110 ? 0.449 0.451 0.556 -0.008 0.094  0.062  110 GLY HHH H    
1774 H HA2  . GLY B 110 ? 0.422 0.445 0.504 -0.018 0.061  0.053  110 GLY HHH HA2  
1775 H HA3  . GLY B 110 ? 0.421 0.446 0.516 -0.015 0.067  0.056  110 GLY HHH HA3  
1776 N N    . TYR B 111 ? 0.440 0.434 0.467 -0.021 0.065  0.040  111 TYR HHH N    
1777 C CA   . TYR B 111 ? 0.443 0.423 0.439 -0.025 0.058  0.033  111 TYR HHH CA   
1778 C C    . TYR B 111 ? 0.417 0.419 0.420 -0.028 0.042  0.031  111 TYR HHH C    
1779 O O    . TYR B 111 ? 0.393 0.412 0.414 -0.030 0.037  0.033  111 TYR HHH O    
1780 C CB   . TYR B 111 ? 0.460 0.426 0.441 -0.028 0.058  0.028  111 TYR HHH CB   
1781 C CG   . TYR B 111 ? 0.482 0.425 0.454 -0.024 0.075  0.030  111 TYR HHH CG   
1782 C CD1  . TYR B 111 ? 0.511 0.424 0.455 -0.020 0.086  0.028  111 TYR HHH CD1  
1783 C CD2  . TYR B 111 ? 0.475 0.422 0.465 -0.023 0.080  0.034  111 TYR HHH CD2  
1784 C CE1  . TYR B 111 ? 0.539 0.426 0.473 -0.016 0.105  0.030  111 TYR HHH CE1  
1785 C CE2  . TYR B 111 ? 0.494 0.420 0.479 -0.019 0.097  0.036  111 TYR HHH CE2  
1786 C CZ   . TYR B 111 ? 0.527 0.422 0.484 -0.015 0.111  0.034  111 TYR HHH CZ   
1787 O OH   . TYR B 111 ? 0.554 0.424 0.503 -0.010 0.131  0.036  111 TYR HHH OH   
1788 H H    . TYR B 111 ? 0.436 0.433 0.470 -0.022 0.064  0.041  111 TYR HHH H    
1789 H HA   . TYR B 111 ? 0.459 0.426 0.441 -0.022 0.064  0.032  111 TYR HHH HA   
1790 H HB2  . TYR B 111 ? 0.446 0.425 0.440 -0.030 0.052  0.029  111 TYR HHH HB2  
1791 H HB3  . TYR B 111 ? 0.471 0.428 0.434 -0.030 0.051  0.024  111 TYR HHH HB3  
1792 H HD1  . TYR B 111 ? 0.520 0.426 0.448 -0.021 0.082  0.026  111 TYR HHH HD1  
1793 H HD2  . TYR B 111 ? 0.457 0.421 0.463 -0.025 0.073  0.035  111 TYR HHH HD2  
1794 H HE1  . TYR B 111 ? 0.564 0.427 0.475 -0.013 0.115  0.029  111 TYR HHH HE1  
1795 H HE2  . TYR B 111 ? 0.491 0.420 0.489 -0.018 0.100  0.038  111 TYR HHH HE2  
1797 N N    . TRP B 112 ? 0.418 0.415 0.407 -0.028 0.037  0.028  112 TRP HHH N    
1798 C CA   . TRP B 112 ? 0.394 0.409 0.390 -0.030 0.024  0.026  112 TRP HHH CA   
1799 C C    . TRP B 112 ? 0.407 0.416 0.390 -0.035 0.012  0.020  112 TRP HHH C    
1800 O O    . TRP B 112 ? 0.436 0.421 0.394 -0.035 0.012  0.017  112 TRP HHH O    
1801 C CB   . TRP B 112 ? 0.393 0.407 0.386 -0.027 0.026  0.028  112 TRP HHH CB   
1802 C CG   . TRP B 112 ? 0.380 0.402 0.394 -0.024 0.034  0.034  112 TRP HHH CG   
1803 C CD1  . TRP B 112 ? 0.387 0.400 0.408 -0.021 0.048  0.039  112 TRP HHH CD1  
1804 C CD2  . TRP B 112 ? 0.358 0.398 0.391 -0.024 0.027  0.037  112 TRP HHH CD2  
1805 N NE1  . TRP B 112 ? 0.371 0.398 0.420 -0.019 0.049  0.045  112 TRP HHH NE1  
1806 C CE2  . TRP B 112 ? 0.353 0.395 0.407 -0.021 0.035  0.043  112 TRP HHH CE2  
1807 C CE3  . TRP B 112 ? 0.344 0.397 0.380 -0.025 0.016  0.035  112 TRP HHH CE3  
1808 C CZ2  . TRP B 112 ? 0.336 0.391 0.411 -0.021 0.029  0.047  112 TRP HHH CZ2  
1809 C CZ3  . TRP B 112 ? 0.334 0.398 0.385 -0.025 0.012  0.038  112 TRP HHH CZ3  
1810 C CH2  . TRP B 112 ? 0.328 0.393 0.398 -0.023 0.017  0.044  112 TRP HHH CH2  
1811 H H    . TRP B 112 ? 0.435 0.416 0.407 -0.027 0.041  0.027  112 TRP HHH H    
1812 H HA   . TRP B 112 ? 0.380 0.409 0.392 -0.031 0.022  0.028  112 TRP HHH HA   
1813 H HB2  . TRP B 112 ? 0.412 0.408 0.386 -0.026 0.029  0.027  112 TRP HHH HB2  
1814 H HB3  . TRP B 112 ? 0.385 0.408 0.380 -0.028 0.017  0.026  112 TRP HHH HB3  
1815 H HD1  . TRP B 112 ? 0.403 0.400 0.412 -0.020 0.056  0.038  112 TRP HHH HD1  
1816 H HE1  . TRP B 112 ? 0.373 0.397 0.434 -0.017 0.057  0.049  112 TRP HHH HE1  
1817 H HE3  . TRP B 112 ? 0.346 0.400 0.373 -0.027 0.011  0.032  112 TRP HHH HE3  
1818 H HZ2  . TRP B 112 ? 0.336 0.393 0.429 -0.020 0.033  0.052  112 TRP HHH HZ2  
1819 H HZ3  . TRP B 112 ? 0.327 0.398 0.378 -0.025 0.006  0.037  112 TRP HHH HZ3  
1820 H HH2  . TRP B 112 ? 0.323 0.394 0.404 -0.023 0.012  0.046  112 TRP HHH HH2  
1821 N N    . GLY B 113 ? 0.391 0.419 0.389 -0.037 0.003  0.019  113 GLY HHH N    
1822 C CA   . GLY B 113 ? 0.397 0.425 0.394 -0.041 -0.010 0.015  113 GLY HHH CA   
1823 C C    . GLY B 113 ? 0.411 0.433 0.395 -0.039 -0.016 0.014  113 GLY HHH C    
1824 O O    . GLY B 113 ? 0.400 0.422 0.381 -0.035 -0.009 0.017  113 GLY HHH O    
1825 H H    . GLY B 113 ? 0.377 0.417 0.389 -0.037 0.005  0.022  113 GLY HHH H    
1826 H HA2  . GLY B 113 ? 0.413 0.429 0.401 -0.043 -0.012 0.012  113 GLY HHH HA2  
1827 H HA3  . GLY B 113 ? 0.385 0.428 0.399 -0.042 -0.012 0.015  113 GLY HHH HA3  
1828 N N    . GLN B 114 ? 0.436 0.451 0.414 -0.041 -0.030 0.010  114 GLN HHH N    
1829 C CA   . GLN B 114 ? 0.456 0.461 0.419 -0.039 -0.039 0.010  114 GLN HHH CA   
1830 C C    . GLN B 114 ? 0.433 0.461 0.417 -0.036 -0.038 0.012  114 GLN HHH C    
1831 O O    . GLN B 114 ? 0.444 0.466 0.417 -0.033 -0.041 0.013  114 GLN HHH O    
1832 C CB   . GLN B 114 ? 0.481 0.473 0.436 -0.042 -0.058 0.005  114 GLN HHH CB   
1833 C CG   . GLN B 114 ? 0.466 0.483 0.458 -0.046 -0.069 0.005  114 GLN HHH CG   
1834 C CD   . GLN B 114 ? 0.460 0.487 0.474 -0.051 -0.066 0.005  114 GLN HHH CD   
1835 O OE1  . GLN B 114 ? 0.472 0.493 0.477 -0.051 -0.055 0.005  114 GLN HHH OE1  
1836 N NE2  . GLN B 114 ? 0.444 0.487 0.490 -0.054 -0.076 0.005  114 GLN HHH NE2  
1837 H H    . GLN B 114 ? 0.437 0.453 0.422 -0.045 -0.036 0.008  114 GLN HHH H    
1838 H HA   . GLN B 114 ? 0.469 0.459 0.412 -0.036 -0.032 0.010  114 GLN HHH HA   
1839 H HB2  . GLN B 114 ? 0.497 0.476 0.434 -0.040 -0.063 0.005  114 GLN HHH HB2  
1840 H HB3  . GLN B 114 ? 0.496 0.474 0.439 -0.045 -0.058 0.003  114 GLN HHH HB3  
1841 H HG2  . GLN B 114 ? 0.449 0.481 0.454 -0.043 -0.065 0.007  114 GLN HHH HG2  
1842 H HG3  . GLN B 114 ? 0.481 0.489 0.469 -0.047 -0.083 0.003  114 GLN HHH HG3  
1845 N N    . GLY B 115 ? 0.404 0.454 0.414 -0.037 -0.033 0.014  115 GLY HHH N    
1846 C CA   . GLY B 115 ? 0.389 0.457 0.416 -0.034 -0.031 0.016  115 GLY HHH CA   
1847 C C    . GLY B 115 ? 0.387 0.467 0.435 -0.036 -0.040 0.015  115 GLY HHH C    
1848 O O    . GLY B 115 ? 0.407 0.480 0.455 -0.039 -0.050 0.012  115 GLY HHH O    
1849 H H    . GLY B 115 ? 0.403 0.455 0.418 -0.039 -0.029 0.014  115 GLY HHH H    
1850 H HA2  . GLY B 115 ? 0.379 0.454 0.412 -0.034 -0.024 0.018  115 GLY HHH HA2  
1851 H HA3  . GLY B 115 ? 0.392 0.456 0.410 -0.032 -0.032 0.017  115 GLY HHH HA3  
1852 N N    . ALA B 116 ? 0.383 0.478 0.448 -0.034 -0.035 0.016  116 ALA HHH N    
1853 C CA   . ALA B 116 ? 0.384 0.492 0.476 -0.035 -0.038 0.016  116 ALA HHH CA   
1854 C C    . ALA B 116 ? 0.383 0.497 0.480 -0.030 -0.035 0.018  116 ALA HHH C    
1855 O O    . ALA B 116 ? 0.380 0.496 0.473 -0.028 -0.024 0.019  116 ALA HHH O    
1856 C CB   . ALA B 116 ? 0.378 0.492 0.485 -0.037 -0.029 0.017  116 ALA HHH CB   
1857 H H    . ALA B 116 ? 0.376 0.473 0.438 -0.032 -0.029 0.018  116 ALA HHH H    
1858 H HA   . ALA B 116 ? 0.392 0.496 0.487 -0.036 -0.048 0.015  116 ALA HHH HA   
1859 H HB1  . ALA B 116 ? 0.376 0.498 0.503 -0.037 -0.028 0.018  116 ALA HHH HB1  
1860 H HB2  . ALA B 116 ? 0.383 0.493 0.489 -0.041 -0.031 0.016  116 ALA HHH HB2  
1861 H HB3  . ALA B 116 ? 0.374 0.488 0.474 -0.036 -0.020 0.019  116 ALA HHH HB3  
1862 N N    . LEU B 117 ? 0.398 0.513 0.502 -0.028 -0.045 0.017  117 LEU HHH N    
1863 C CA   . LEU B 117 ? 0.403 0.523 0.511 -0.023 -0.044 0.018  117 LEU HHH CA   
1864 C C    . LEU B 117 ? 0.394 0.525 0.528 -0.021 -0.033 0.020  117 LEU HHH C    
1865 O O    . LEU B 117 ? 0.389 0.529 0.552 -0.023 -0.037 0.020  117 LEU HHH O    
1866 C CB   . LEU B 117 ? 0.421 0.535 0.528 -0.021 -0.059 0.018  117 LEU HHH CB   
1867 C CG   . LEU B 117 ? 0.424 0.539 0.529 -0.016 -0.058 0.019  117 LEU HHH CG   
1868 C CD1  . LEU B 117 ? 0.429 0.530 0.504 -0.014 -0.057 0.019  117 LEU HHH CD1  
1869 C CD2  . LEU B 117 ? 0.433 0.550 0.557 -0.013 -0.072 0.020  117 LEU HHH CD2  
1870 H H    . LEU B 117 ? 0.405 0.517 0.511 -0.030 -0.055 0.016  117 LEU HHH H    
1871 H HA   . LEU B 117 ? 0.401 0.516 0.493 -0.021 -0.038 0.019  117 LEU HHH HA   
1872 H HB2  . LEU B 117 ? 0.429 0.532 0.517 -0.022 -0.064 0.017  117 LEU HHH HB2  
1873 H HB3  . LEU B 117 ? 0.422 0.542 0.549 -0.022 -0.065 0.018  117 LEU HHH HB3  
1874 H HG   . LEU B 117 ? 0.416 0.537 0.530 -0.014 -0.048 0.020  117 LEU HHH HG   
1875 H HD11 . LEU B 117 ? 0.425 0.525 0.492 -0.016 -0.049 0.019  117 LEU HHH HD11 
1876 H HD12 . LEU B 117 ? 0.429 0.530 0.503 -0.011 -0.056 0.020  117 LEU HHH HD12 
1877 H HD13 . LEU B 117 ? 0.441 0.532 0.503 -0.015 -0.065 0.019  117 LEU HHH HD13 
1878 H HD21 . LEU B 117 ? 0.443 0.552 0.557 -0.015 -0.083 0.019  117 LEU HHH HD21 
1879 H HD22 . LEU B 117 ? 0.433 0.549 0.553 -0.010 -0.071 0.021  117 LEU HHH HD22 
1880 H HD23 . LEU B 117 ? 0.428 0.555 0.577 -0.014 -0.070 0.021  117 LEU HHH HD23 
1881 N N    . VAL B 118 ? 0.394 0.524 0.519 -0.018 -0.021 0.020  118 VAL HHH N    
1882 C CA   . VAL B 118 ? 0.404 0.538 0.546 -0.014 -0.008 0.022  118 VAL HHH CA   
1883 C C    . VAL B 118 ? 0.412 0.543 0.549 -0.009 -0.007 0.022  118 VAL HHH C    
1884 O O    . VAL B 118 ? 0.407 0.529 0.519 -0.007 -0.005 0.021  118 VAL HHH O    
1885 C CB   . VAL B 118 ? 0.408 0.535 0.535 -0.015 0.006  0.023  118 VAL HHH CB   
1886 C CG1  . VAL B 118 ? 0.422 0.546 0.557 -0.011 0.023  0.024  118 VAL HHH CG1  
1887 C CG2  . VAL B 118 ? 0.402 0.532 0.535 -0.020 0.006  0.023  118 VAL HHH CG2  
1888 H H    . VAL B 118 ? 0.395 0.519 0.502 -0.017 -0.020 0.020  118 VAL HHH H    
1889 H HA   . VAL B 118 ? 0.402 0.544 0.568 -0.015 -0.009 0.023  118 VAL HHH HA   
1890 H HB   . VAL B 118 ? 0.409 0.529 0.515 -0.015 0.005  0.022  118 VAL HHH HB   
1891 H HG11 . VAL B 118 ? 0.425 0.543 0.548 -0.007 0.025  0.024  118 VAL HHH HG11 
1892 H HG12 . VAL B 118 ? 0.426 0.544 0.554 -0.011 0.032  0.025  118 VAL HHH HG12 
1893 H HG13 . VAL B 118 ? 0.418 0.551 0.580 -0.010 0.024  0.025  118 VAL HHH HG13 
1894 H HG21 . VAL B 118 ? 0.401 0.538 0.557 -0.022 0.004  0.023  118 VAL HHH HG21 
1895 H HG22 . VAL B 118 ? 0.408 0.532 0.533 -0.020 0.016  0.024  118 VAL HHH HG22 
1896 H HG23 . VAL B 118 ? 0.401 0.527 0.521 -0.023 -0.002 0.022  118 VAL HHH HG23 
1897 N N    . SER B 119 ? 0.414 0.553 0.579 -0.006 -0.010 0.023  119 SER HHH N    
1898 C CA   . SER B 119 ? 0.421 0.558 0.588 0.001  -0.006 0.023  119 SER HHH CA   
1899 C C    . SER B 119 ? 0.427 0.564 0.613 0.005  0.014  0.025  119 SER HHH C    
1900 O O    . SER B 119 ? 0.421 0.569 0.640 0.004  0.018  0.027  119 SER HHH O    
1901 C CB   . SER B 119 ? 0.422 0.565 0.608 0.002  -0.022 0.024  119 SER HHH CB   
1902 O OG   . SER B 119 ? 0.431 0.567 0.605 0.008  -0.022 0.024  119 SER HHH OG   
1903 H H    . SER B 119 ? 0.412 0.559 0.598 -0.007 -0.014 0.024  119 SER HHH H    
1904 H HA   . SER B 119 ? 0.423 0.551 0.566 0.001  -0.005 0.022  119 SER HHH HA   
1905 H HB2  . SER B 119 ? 0.422 0.563 0.597 -0.001 -0.033 0.023  119 SER HHH HB2  
1906 H HB3  . SER B 119 ? 0.422 0.574 0.637 0.003  -0.022 0.026  119 SER HHH HB3  
1908 N N    . VAL B 120 ? 0.436 0.560 0.599 0.010  0.025  0.024  120 VAL HHH N    
1909 C CA   . VAL B 120 ? 0.451 0.567 0.623 0.016  0.047  0.026  120 VAL HHH CA   
1910 C C    . VAL B 120 ? 0.457 0.569 0.631 0.023  0.046  0.025  120 VAL HHH C    
1911 O O    . VAL B 120 ? 0.463 0.561 0.603 0.023  0.042  0.023  120 VAL HHH O    
1912 C CB   . VAL B 120 ? 0.465 0.560 0.599 0.016  0.061  0.024  120 VAL HHH CB   
1913 H H    . VAL B 120 ? 0.438 0.554 0.577 0.009  0.021  0.023  120 VAL HHH H    
1914 H HA   . VAL B 120 ? 0.448 0.574 0.650 0.016  0.052  0.028  120 VAL HHH HA   
1915 H HB   . VAL B 120 ? 0.481 0.567 0.616 0.021  0.076  0.025  120 VAL HHH HB   
1916 N N    . SER B 121 ? 0.457 0.582 0.674 0.027  0.048  0.028  121 SER HHH N    
1917 C CA   . SER B 121 ? 0.470 0.594 0.697 0.033  0.045  0.029  121 SER HHH CA   
1918 C C    . SER B 121 ? 0.485 0.616 0.758 0.040  0.063  0.033  121 SER HHH C    
1919 O O    . SER B 121 ? 0.474 0.623 0.789 0.038  0.062  0.037  121 SER HHH O    
1920 C CB   . SER B 121 ? 0.455 0.590 0.690 0.031  0.019  0.029  121 SER HHH CB   
1921 O OG   . SER B 121 ? 0.460 0.592 0.703 0.038  0.017  0.030  121 SER HHH OG   
1922 H H    . SER B 121 ? 0.454 0.590 0.699 0.026  0.050  0.031  121 SER HHH H    
1923 H HA   . SER B 121 ? 0.480 0.589 0.677 0.036  0.050  0.027  121 SER HHH HA   
1924 H HB2  . SER B 121 ? 0.452 0.582 0.659 0.027  0.011  0.027  121 SER HHH HB2  
1925 H HB3  . SER B 121 ? 0.448 0.595 0.709 0.029  0.012  0.031  121 SER HHH HB3  
1927 N N    . SER B 122 ? 0.526 0.643 0.793 0.049  0.079  0.033  122 SER HHH N    
1928 C CA   . SER B 122 ? 0.557 0.678 0.869 0.057  0.097  0.038  122 SER HHH CA   
1929 C C    . SER B 122 ? 0.547 0.695 0.915 0.057  0.076  0.042  122 SER HHH C    
1930 O O    . SER B 122 ? 0.545 0.707 0.970 0.061  0.086  0.048  122 SER HHH O    
1931 C CB   . SER B 122 ? 0.587 0.686 0.875 0.066  0.113  0.036  122 SER HHH CB   
1932 O OG   . SER B 122 ? 0.620 0.690 0.852 0.066  0.128  0.032  122 SER HHH OG   
1933 H H    . SER B 122 ? 0.534 0.636 0.767 0.050  0.079  0.030  122 SER HHH H    
1934 H HA   . SER B 122 ? 0.561 0.683 0.886 0.057  0.113  0.040  122 SER HHH HA   
1935 H HB2  . SER B 122 ? 0.583 0.682 0.863 0.066  0.098  0.035  122 SER HHH HB2  
1936 H HB3  . SER B 122 ? 0.596 0.697 0.916 0.072  0.128  0.040  122 SER HHH HB3  
1938 N N    . ALA B 123 ? 0.541 0.693 0.892 0.053  0.047  0.040  123 ALA HHH N    
1939 C CA   . ALA B 123 ? 0.535 0.703 0.923 0.053  0.021  0.044  123 ALA HHH CA   
1940 C C    . ALA B 123 ? 0.534 0.704 0.956 0.063  0.027  0.048  123 ALA HHH C    
1941 O O    . ALA B 123 ? 0.514 0.699 0.984 0.065  0.009  0.053  123 ALA HHH O    
1942 C CB   . ALA B 123 ? 0.527 0.715 0.961 0.047  0.014  0.047  123 ALA HHH CB   
1943 H H    . ALA B 123 ? 0.541 0.682 0.854 0.051  0.042  0.037  123 ALA HHH H    
1944 H HA   . ALA B 123 ? 0.529 0.694 0.891 0.050  0.005  0.042  123 ALA HHH HA   
1945 H HB1  . ALA B 123 ? 0.522 0.716 0.963 0.045  -0.009 0.048  123 ALA HHH HB1  
1946 H HB2  . ALA B 123 ? 0.524 0.709 0.939 0.042  0.019  0.045  123 ALA HHH HB2  
1947 H HB3  . ALA B 123 ? 0.529 0.724 1.003 0.052  0.026  0.051  123 ALA HHH HB3  
1948 N N    . LYS B 124 ? 0.549 0.700 0.944 0.070  0.048  0.046  124 LYS HHH N    
1949 C CA   . LYS B 124 ? 0.557 0.705 0.981 0.081  0.063  0.049  124 LYS HHH CA   
1950 C C    . LYS B 124 ? 0.547 0.689 0.953 0.084  0.042  0.049  124 LYS HHH C    
1951 O O    . LYS B 124 ? 0.549 0.671 0.899 0.082  0.042  0.043  124 LYS HHH O    
1952 C CB   . LYS B 124 ? 0.590 0.714 0.986 0.087  0.098  0.047  124 LYS HHH CB   
1953 C CG   . LYS B 124 ? 0.614 0.738 1.059 0.098  0.126  0.052  124 LYS HHH CG   
1954 C CD   . LYS B 124 ? 0.635 0.749 1.081 0.108  0.127  0.053  124 LYS HHH CD   
1955 C CE   . LYS B 124 ? 0.646 0.772 1.164 0.119  0.144  0.061  124 LYS HHH CE   
1956 N NZ   . LYS B 124 ? 0.672 0.778 1.181 0.130  0.156  0.061  124 LYS HHH NZ   
1957 H H    . LYS B 124 ? 0.553 0.691 0.908 0.068  0.055  0.042  124 LYS HHH H    
1958 H HA   . LYS B 124 ? 0.554 0.717 1.028 0.083  0.062  0.054  124 LYS HHH HA   
1959 H HB2  . LYS B 124 ? 0.589 0.711 0.971 0.082  0.105  0.045  124 LYS HHH HB2  
1960 H HB3  . LYS B 124 ? 0.598 0.705 0.955 0.088  0.096  0.043  124 LYS HHH HB3  
1961 H HG2  . LYS B 124 ? 0.603 0.747 1.098 0.098  0.121  0.057  124 LYS HHH HG2  
1962 H HG3  . LYS B 124 ? 0.629 0.739 1.057 0.100  0.149  0.051  124 LYS HHH HG3  
1963 H HD2  . LYS B 124 ? 0.652 0.742 1.056 0.110  0.141  0.049  124 LYS HHH HD2  
1964 H HD3  . LYS B 124 ? 0.623 0.743 1.064 0.105  0.103  0.053  124 LYS HHH HD3  
1965 H HE2  . LYS B 124 ? 0.630 0.778 1.190 0.117  0.124  0.065  124 LYS HHH HE2  
1966 H HE3  . LYS B 124 ? 0.654 0.778 1.186 0.120  0.167  0.063  124 LYS HHH HE3  
1967 H HZ1  . LYS B 124 ? 0.690 0.775 1.170 0.133  0.178  0.058  124 LYS HHH HZ1  
1968 H HZ2  . LYS B 124 ? 0.670 0.788 1.229 0.136  0.160  0.067  124 LYS HHH HZ2  
1969 H HZ3  . LYS B 124 ? 0.666 0.769 1.152 0.128  0.138  0.059  124 LYS HHH HZ3  
1970 N N    . THR B 125 ? 0.535 0.691 0.987 0.088  0.024  0.054  125 THR HHH N    
1971 C CA   . THR B 125 ? 0.537 0.686 0.977 0.092  0.004  0.055  125 THR HHH CA   
1972 C C    . THR B 125 ? 0.547 0.674 0.956 0.099  0.025  0.052  125 THR HHH C    
1973 O O    . THR B 125 ? 0.563 0.688 1.003 0.108  0.049  0.055  125 THR HHH O    
1974 C CB   . THR B 125 ? 0.534 0.700 1.038 0.097  -0.014 0.063  125 THR HHH CB   
1975 O OG1  . THR B 125 ? 0.523 0.703 1.043 0.089  -0.040 0.064  125 THR HHH OG1  
1976 C CG2  . THR B 125 ? 0.546 0.702 1.040 0.103  -0.030 0.065  125 THR HHH CG2  
1977 H H    . THR B 125 ? 0.532 0.702 1.027 0.088  0.022  0.058  125 THR HHH H    
1978 H HA   . THR B 125 ? 0.531 0.677 0.940 0.085  -0.012 0.053  125 THR HHH HA   
1979 H HB   . THR B 125 ? 0.537 0.710 1.080 0.102  0.003  0.066  125 THR HHH HB   
1981 H HG21 . THR B 125 ? 0.554 0.704 1.055 0.110  -0.013 0.066  125 THR HHH HG21 
1982 H HG22 . THR B 125 ? 0.546 0.711 1.070 0.104  -0.050 0.069  125 THR HHH HG22 
1983 H HG23 . THR B 125 ? 0.547 0.691 0.994 0.099  -0.038 0.061  125 THR HHH HG23 
1984 N N    . THR B 126 ? 0.540 0.649 0.891 0.095  0.019  0.047  126 THR HHH N    
1985 C CA   . THR B 126 ? 0.548 0.632 0.862 0.100  0.034  0.043  126 THR HHH CA   
1986 C C    . THR B 126 ? 0.548 0.624 0.841 0.100  0.013  0.044  126 THR HHH C    
1987 O O    . THR B 126 ? 0.532 0.609 0.800 0.092  -0.007 0.042  126 THR HHH O    
1988 C CB   . THR B 126 ? 0.548 0.615 0.811 0.094  0.048  0.036  126 THR HHH CB   
1989 O OG1  . THR B 126 ? 0.547 0.617 0.828 0.095  0.069  0.037  126 THR HHH OG1  
1990 C CG2  . THR B 126 ? 0.566 0.604 0.787 0.098  0.060  0.032  126 THR HHH CG2  
1991 H H    . THR B 126 ? 0.533 0.643 0.864 0.089  0.003  0.046  126 THR HHH H    
1992 H HA   . THR B 126 ? 0.558 0.640 0.895 0.108  0.049  0.045  126 THR HHH HA   
1993 H HB   . THR B 126 ? 0.537 0.607 0.781 0.087  0.034  0.035  126 THR HHH HB   
1995 H HG21 . THR B 126 ? 0.565 0.598 0.766 0.094  0.046  0.030  126 THR HHH HG21 
1996 H HG22 . THR B 126 ? 0.577 0.602 0.772 0.095  0.071  0.028  126 THR HHH HG22 
1997 H HG23 . THR B 126 ? 0.579 0.612 0.818 0.106  0.070  0.034  126 THR HHH HG23 
1998 N N    . PRO B 127 ? 0.558 0.624 0.860 0.110  0.019  0.046  127 PRO HHH N    
1999 C CA   . PRO B 127 ? 0.558 0.611 0.836 0.110  0.001  0.046  127 PRO HHH CA   
2000 C C    . PRO B 127 ? 0.554 0.586 0.774 0.104  0.007  0.039  127 PRO HHH C    
2001 O O    . PRO B 127 ? 0.554 0.575 0.755 0.103  0.026  0.034  127 PRO HHH O    
2002 C CB   . PRO B 127 ? 0.574 0.623 0.884 0.123  0.009  0.051  127 PRO HHH CB   
2003 C CG   . PRO B 127 ? 0.586 0.631 0.910 0.128  0.041  0.049  127 PRO HHH CG   
2004 C CD   . PRO B 127 ? 0.571 0.632 0.904 0.121  0.044  0.048  127 PRO HHH CD   
2005 H HA   . PRO B 127 ? 0.549 0.611 0.832 0.107  -0.018 0.049  127 PRO HHH HA   
2006 H HB2  . PRO B 127 ? 0.584 0.618 0.870 0.124  0.008  0.049  127 PRO HHH HB2  
2007 H HB3  . PRO B 127 ? 0.570 0.632 0.914 0.126  -0.003 0.056  127 PRO HHH HB3  
2008 H HG2  . PRO B 127 ? 0.599 0.624 0.888 0.129  0.053  0.044  127 PRO HHH HG2  
2009 H HG3  . PRO B 127 ? 0.591 0.641 0.952 0.137  0.048  0.053  127 PRO HHH HG3  
2010 H HD2  . PRO B 127 ? 0.580 0.630 0.893 0.120  0.062  0.044  127 PRO HHH HD2  
2011 H HD3  . PRO B 127 ? 0.565 0.643 0.942 0.124  0.043  0.052  127 PRO HHH HD3  
2012 N N    . PRO B 128 ? 0.552 0.575 0.744 0.100  -0.010 0.039  128 PRO HHH N    
2013 C CA   . PRO B 128 ? 0.558 0.560 0.704 0.094  -0.006 0.034  128 PRO HHH CA   
2014 C C    . PRO B 128 ? 0.579 0.558 0.712 0.101  0.005  0.032  128 PRO HHH C    
2015 O O    . PRO B 128 ? 0.574 0.552 0.725 0.108  0.001  0.036  128 PRO HHH O    
2016 C CB   . PRO B 128 ? 0.551 0.554 0.680 0.088  -0.027 0.036  128 PRO HHH CB   
2017 C CG   . PRO B 128 ? 0.555 0.565 0.713 0.095  -0.040 0.043  128 PRO HHH CG   
2018 C CD   . PRO B 128 ? 0.550 0.579 0.752 0.100  -0.033 0.045  128 PRO HHH CD   
2019 H HA   . PRO B 128 ? 0.554 0.557 0.688 0.089  0.001  0.030  128 PRO HHH HA   
2020 H HB2  . PRO B 128 ? 0.559 0.548 0.665 0.086  -0.026 0.035  128 PRO HHH HB2  
2021 H HB3  . PRO B 128 ? 0.540 0.551 0.664 0.082  -0.031 0.035  128 PRO HHH HB3  
2022 H HG2  . PRO B 128 ? 0.567 0.566 0.722 0.100  -0.040 0.044  128 PRO HHH HG2  
2023 H HG3  . PRO B 128 ? 0.552 0.565 0.703 0.091  -0.054 0.045  128 PRO HHH HG3  
2024 H HD2  . PRO B 128 ? 0.557 0.586 0.782 0.108  -0.035 0.049  128 PRO HHH HD2  
2025 H HD3  . PRO B 128 ? 0.539 0.581 0.752 0.097  -0.042 0.046  128 PRO HHH HD3  
2026 N N    . SER B 129 ? 0.596 0.556 0.697 0.098  0.018  0.025  129 SER HHH N    
2027 C CA   . SER B 129 ? 0.618 0.550 0.691 0.100  0.023  0.022  129 SER HHH CA   
2028 C C    . SER B 129 ? 0.610 0.537 0.665 0.092  0.005  0.023  129 SER HHH C    
2029 O O    . SER B 129 ? 0.597 0.531 0.639 0.083  -0.002 0.022  129 SER HHH O    
2030 C CB   . SER B 129 ? 0.640 0.548 0.680 0.097  0.037  0.015  129 SER HHH CB   
2031 O OG   . SER B 129 ? 0.648 0.560 0.701 0.102  0.054  0.014  129 SER HHH OG   
2032 H H    . SER B 129 ? 0.592 0.553 0.684 0.094  0.023  0.023  129 SER HHH H    
2033 H HA   . SER B 129 ? 0.628 0.556 0.716 0.108  0.028  0.024  129 SER HHH HA   
2034 H HB2  . SER B 129 ? 0.633 0.542 0.656 0.089  0.029  0.012  129 SER HHH HB2  
2035 H HB3  . SER B 129 ? 0.660 0.548 0.684 0.100  0.041  0.012  129 SER HHH HB3  
2037 N N    . VAL B 130 ? 0.618 0.535 0.674 0.097  0.001  0.026  130 VAL HHH N    
2038 C CA   . VAL B 130 ? 0.615 0.527 0.657 0.092  -0.013 0.029  130 VAL HHH CA   
2039 C C    . VAL B 130 ? 0.636 0.520 0.654 0.091  -0.009 0.026  130 VAL HHH C    
2040 O O    . VAL B 130 ? 0.660 0.530 0.682 0.100  -0.002 0.026  130 VAL HHH O    
2041 C CB   . VAL B 130 ? 0.611 0.532 0.673 0.098  -0.025 0.037  130 VAL HHH CB   
2042 C CG1  . VAL B 130 ? 0.617 0.529 0.660 0.093  -0.036 0.041  130 VAL HHH CG1  
2043 C CG2  . VAL B 130 ? 0.591 0.538 0.680 0.099  -0.031 0.040  130 VAL HHH CG2  
2044 H H    . VAL B 130 ? 0.630 0.541 0.695 0.105  0.008  0.027  130 VAL HHH H    
2045 H HA   . VAL B 130 ? 0.604 0.522 0.637 0.084  -0.018 0.029  130 VAL HHH HA   
2046 H HB   . VAL B 130 ? 0.623 0.537 0.695 0.106  -0.020 0.038  130 VAL HHH HB   
2047 H HG11 . VAL B 130 ? 0.628 0.524 0.658 0.092  -0.033 0.040  130 VAL HHH HG11 
2048 H HG12 . VAL B 130 ? 0.619 0.534 0.671 0.097  -0.045 0.046  130 VAL HHH HG12 
2049 H HG13 . VAL B 130 ? 0.606 0.524 0.640 0.086  -0.039 0.040  130 VAL HHH HG13 
2050 H HG21 . VAL B 130 ? 0.581 0.534 0.662 0.092  -0.031 0.038  130 VAL HHH HG21 
2051 H HG22 . VAL B 130 ? 0.592 0.542 0.688 0.101  -0.042 0.045  130 VAL HHH HG22 
2052 H HG23 . VAL B 130 ? 0.593 0.544 0.701 0.105  -0.023 0.040  130 VAL HHH HG23 
2053 N N    . TYR B 131 ? 0.632 0.507 0.627 0.080  -0.013 0.023  131 TYR HHH N    
2054 C CA   . TYR B 131 ? 0.646 0.494 0.620 0.076  -0.012 0.019  131 TYR HHH CA   
2055 C C    . TYR B 131 ? 0.642 0.485 0.611 0.070  -0.021 0.023  131 TYR HHH C    
2056 O O    . TYR B 131 ? 0.625 0.483 0.598 0.065  -0.027 0.027  131 TYR HHH O    
2057 C CB   . TYR B 131 ? 0.647 0.486 0.601 0.069  -0.010 0.011  131 TYR HHH CB   
2058 C CG   . TYR B 131 ? 0.652 0.488 0.603 0.076  0.003  0.007  131 TYR HHH CG   
2059 C CD1  . TYR B 131 ? 0.675 0.491 0.622 0.086  0.016  0.005  131 TYR HHH CD1  
2060 C CD2  . TYR B 131 ? 0.639 0.489 0.591 0.072  0.004  0.005  131 TYR HHH CD2  
2061 C CE1  . TYR B 131 ? 0.686 0.497 0.631 0.092  0.031  0.001  131 TYR HHH CE1  
2062 C CE2  . TYR B 131 ? 0.647 0.492 0.596 0.078  0.019  0.002  131 TYR HHH CE2  
2063 C CZ   . TYR B 131 ? 0.672 0.496 0.616 0.088  0.033  0.000  131 TYR HHH CZ   
2064 O OH   . TYR B 131 ? 0.688 0.504 0.628 0.095  0.051  -0.002 131 TYR HHH OH   
2065 H H    . TYR B 131 ? 0.618 0.503 0.612 0.074  -0.018 0.023  131 TYR HHH H    
2066 H HA   . TYR B 131 ? 0.661 0.498 0.635 0.083  -0.006 0.018  131 TYR HHH HA   
2067 H HB2  . TYR B 131 ? 0.632 0.483 0.588 0.063  -0.015 0.012  131 TYR HHH HB2  
2068 H HB3  . TYR B 131 ? 0.664 0.483 0.604 0.066  -0.011 0.008  131 TYR HHH HB3  
2069 H HD1  . TYR B 131 ? 0.686 0.491 0.633 0.089  0.015  0.006  131 TYR HHH HD1  
2070 H HD2  . TYR B 131 ? 0.622 0.484 0.576 0.065  -0.004 0.007  131 TYR HHH HD2  
2071 H HE1  . TYR B 131 ? 0.706 0.502 0.648 0.100  0.042  0.000  131 TYR HHH HE1  
2072 H HE2  . TYR B 131 ? 0.639 0.493 0.587 0.075  0.020  0.001  131 TYR HHH HE2  
2074 N N    . PRO B 132 ? 0.663 0.483 0.622 0.070  -0.021 0.023  132 PRO HHH N    
2075 C CA   . PRO B 132 ? 0.668 0.480 0.624 0.064  -0.026 0.028  132 PRO HHH CA   
2076 C C    . PRO B 132 ? 0.669 0.477 0.620 0.051  -0.031 0.025  132 PRO HHH C    
2077 O O    . PRO B 132 ? 0.692 0.488 0.633 0.047  -0.031 0.018  132 PRO HHH O    
2078 C CB   . PRO B 132 ? 0.693 0.480 0.643 0.070  -0.023 0.027  132 PRO HHH CB   
2079 C CG   . PRO B 132 ? 0.707 0.480 0.645 0.072  -0.017 0.018  132 PRO HHH CG   
2080 C CD   . PRO B 132 ? 0.689 0.485 0.637 0.076  -0.013 0.017  132 PRO HHH CD   
2081 H HA   . PRO B 132 ? 0.659 0.482 0.622 0.066  -0.029 0.033  132 PRO HHH HA   
2082 H HB2  . PRO B 132 ? 0.701 0.476 0.646 0.065  -0.025 0.029  132 PRO HHH HB2  
2083 H HB3  . PRO B 132 ? 0.695 0.485 0.652 0.078  -0.022 0.031  132 PRO HHH HB3  
2084 H HG2  . PRO B 132 ? 0.714 0.477 0.642 0.064  -0.020 0.014  132 PRO HHH HG2  
2085 H HG3  . PRO B 132 ? 0.724 0.483 0.660 0.078  -0.012 0.018  132 PRO HHH HG3  
2086 H HD2  . PRO B 132 ? 0.695 0.484 0.631 0.073  -0.011 0.012  132 PRO HHH HD2  
2087 H HD3  . PRO B 132 ? 0.692 0.490 0.649 0.085  -0.008 0.019  132 PRO HHH HD3  
2088 N N    . LEU B 133 ? 0.660 0.475 0.617 0.045  -0.033 0.031  133 LEU HHH N    
2089 C CA   . LEU B 133 ? 0.656 0.469 0.617 0.032  -0.037 0.031  133 LEU HHH CA   
2090 C C    . LEU B 133 ? 0.669 0.464 0.633 0.029  -0.035 0.037  133 LEU HHH C    
2091 O O    . LEU B 133 ? 0.663 0.461 0.630 0.030  -0.031 0.045  133 LEU HHH O    
2092 C CB   . LEU B 133 ? 0.636 0.471 0.606 0.028  -0.037 0.035  133 LEU HHH CB   
2093 C CG   . LEU B 133 ? 0.622 0.475 0.591 0.031  -0.038 0.030  133 LEU HHH CG   
2094 C CD1  . LEU B 133 ? 0.599 0.471 0.576 0.026  -0.038 0.033  133 LEU HHH CD1  
2095 C CD2  . LEU B 133 ? 0.635 0.479 0.596 0.028  -0.041 0.022  133 LEU HHH CD2  
2096 H H    . LEU B 133 ? 0.656 0.476 0.616 0.048  -0.033 0.037  133 LEU HHH H    
2097 H HA   . LEU B 133 ? 0.662 0.468 0.619 0.029  -0.040 0.025  133 LEU HHH HA   
2098 H HB2  . LEU B 133 ? 0.635 0.472 0.605 0.031  -0.034 0.040  133 LEU HHH HB2  
2099 H HB3  . LEU B 133 ? 0.634 0.468 0.611 0.021  -0.039 0.035  133 LEU HHH HB3  
2100 H HG   . LEU B 133 ? 0.622 0.478 0.590 0.038  -0.036 0.031  133 LEU HHH HG   
2101 H HD11 . LEU B 133 ? 0.599 0.472 0.576 0.028  -0.036 0.039  133 LEU HHH HD11 
2102 H HD12 . LEU B 133 ? 0.590 0.473 0.567 0.027  -0.039 0.031  133 LEU HHH HD12 
2103 H HD13 . LEU B 133 ? 0.599 0.469 0.581 0.019  -0.040 0.033  133 LEU HHH HD13 
2104 H HD21 . LEU B 133 ? 0.640 0.475 0.602 0.021  -0.045 0.021  133 LEU HHH HD21 
2105 H HD22 . LEU B 133 ? 0.623 0.478 0.584 0.028  -0.041 0.020  133 LEU HHH HD22 
2106 H HD23 . LEU B 133 ? 0.647 0.480 0.600 0.034  -0.038 0.019  133 LEU HHH HD23 
2107 N N    . ALA B 134 ? 0.692 0.465 0.652 0.026  -0.038 0.032  134 ALA HHH N    
2108 C CA   . ALA B 134 ? 0.712 0.465 0.678 0.021  -0.037 0.036  134 ALA HHH CA   
2109 C C    . ALA B 134 ? 0.718 0.468 0.698 0.007  -0.044 0.034  134 ALA HHH C    
2110 O O    . ALA B 134 ? 0.709 0.464 0.686 0.003  -0.052 0.027  134 ALA HHH O    
2111 C CB   . ALA B 134 ? 0.733 0.463 0.686 0.027  -0.036 0.033  134 ALA HHH CB   
2112 H H    . ALA B 134 ? 0.700 0.467 0.652 0.027  -0.040 0.026  134 ALA HHH H    
2113 H HA   . ALA B 134 ? 0.708 0.466 0.678 0.022  -0.032 0.043  134 ALA HHH HA   
2114 H HB1  . ALA B 134 ? 0.746 0.463 0.703 0.023  -0.036 0.036  134 ALA HHH HB1  
2115 H HB2  . ALA B 134 ? 0.734 0.467 0.682 0.036  -0.032 0.035  134 ALA HHH HB2  
2116 H HB3  . ALA B 134 ? 0.742 0.464 0.687 0.026  -0.040 0.026  134 ALA HHH HB3  
2117 N N    . PRO B 135 ? 0.731 0.473 0.729 -0.001 -0.042 0.040  135 PRO HHH N    
2118 C CA   . PRO B 135 ? 0.733 0.472 0.753 -0.014 -0.052 0.039  135 PRO HHH CA   
2119 C C    . PRO B 135 ? 0.758 0.471 0.768 -0.019 -0.065 0.030  135 PRO HHH C    
2120 O O    . PRO B 135 ? 0.775 0.471 0.762 -0.011 -0.063 0.026  135 PRO HHH O    
2121 C CB   . PRO B 135 ? 0.739 0.474 0.783 -0.019 -0.042 0.050  135 PRO HHH CB   
2122 C CG   . PRO B 135 ? 0.736 0.474 0.764 -0.008 -0.027 0.057  135 PRO HHH CG   
2123 C CD   . PRO B 135 ? 0.741 0.475 0.741 0.003  -0.031 0.050  135 PRO HHH CD   
2124 H HA   . PRO B 135 ? 0.718 0.472 0.745 -0.017 -0.055 0.038  135 PRO HHH HA   
2125 H HB2  . PRO B 135 ? 0.755 0.473 0.804 -0.023 -0.044 0.049  135 PRO HHH HB2  
2126 H HB3  . PRO B 135 ? 0.728 0.473 0.792 -0.026 -0.042 0.053  135 PRO HHH HB3  
2127 H HG2  . PRO B 135 ? 0.750 0.475 0.781 -0.008 -0.020 0.062  135 PRO HHH HG2  
2128 H HG3  . PRO B 135 ? 0.722 0.475 0.753 -0.008 -0.022 0.060  135 PRO HHH HG3  
2129 H HD2  . PRO B 135 ? 0.758 0.475 0.751 0.005  -0.031 0.049  135 PRO HHH HD2  
2130 H HD3  . PRO B 135 ? 0.733 0.476 0.724 0.010  -0.026 0.053  135 PRO HHH HD3  
2131 N N    . GLY B 136 ? 0.760 0.469 0.788 -0.031 -0.079 0.028  136 GLY HHH N    
2132 C CA   . GLY B 136 ? 0.784 0.463 0.805 -0.038 -0.096 0.020  136 GLY HHH CA   
2133 C C    . GLY B 136 ? 0.794 0.456 0.837 -0.045 -0.094 0.025  136 GLY HHH C    
2134 O O    . GLY B 136 ? 0.824 0.457 0.858 -0.050 -0.108 0.019  136 GLY HHH O    
2135 H H    . GLY B 136 ? 0.744 0.468 0.791 -0.036 -0.080 0.031  136 GLY HHH H    
2136 H HA2  . GLY B 136 ? 0.798 0.464 0.790 -0.032 -0.096 0.014  136 GLY HHH HA2  
2137 H HA3  . GLY B 136 ? 0.784 0.465 0.813 -0.045 -0.108 0.017  136 GLY HHH HA3  
2138 N N    . GLY B 142 ? 0.909 0.582 1.166 -0.060 0.083  0.134  142 GLY HHH N    
2139 C CA   . GLY B 142 ? 0.918 0.585 1.145 -0.050 0.109  0.143  142 GLY HHH CA   
2140 C C    . GLY B 142 ? 0.948 0.587 1.119 -0.038 0.118  0.146  142 GLY HHH C    
2141 O O    . GLY B 142 ? 0.952 0.586 1.101 -0.035 0.100  0.138  142 GLY HHH O    
2142 H H    . GLY B 142 ? 0.893 0.580 1.144 -0.060 0.067  0.126  142 GLY HHH H    
2143 H HA2  . GLY B 142 ? 0.925 0.589 1.182 -0.054 0.127  0.152  142 GLY HHH HA2  
2144 H HA3  . GLY B 142 ? 0.901 0.584 1.116 -0.047 0.103  0.139  142 GLY HHH HA3  
2145 N N    . SER B 143 ? 0.969 0.588 1.118 -0.031 0.146  0.157  143 SER HHH N    
2146 C CA   . SER B 143 ? 0.992 0.581 1.081 -0.019 0.155  0.162  143 SER HHH CA   
2147 C C    . SER B 143 ? 0.965 0.566 1.007 -0.008 0.136  0.152  143 SER HHH C    
2148 O O    . SER B 143 ? 0.978 0.560 0.976 0.002  0.131  0.153  143 SER HHH O    
2149 C CB   . SER B 143 ? 1.032 0.591 1.104 -0.015 0.189  0.176  143 SER HHH CB   
2150 O OG   . SER B 143 ? 1.029 0.596 1.078 -0.009 0.196  0.177  143 SER HHH OG   
2151 H H    . SER B 143 ? 0.969 0.590 1.136 -0.034 0.162  0.164  143 SER HHH H    
2152 H HA   . SER B 143 ? 1.003 0.580 1.091 -0.019 0.149  0.161  143 SER HHH HA   
2153 H HB2  . SER B 143 ? 1.058 0.593 1.096 -0.008 0.194  0.180  143 SER HHH HB2  
2154 H HB3  . SER B 143 ? 1.035 0.593 1.146 -0.022 0.203  0.182  143 SER HHH HB3  
2156 N N    . SER B 144 ? 0.921 0.553 0.977 -0.011 0.125  0.145  144 SER HHH N    
2157 C CA   . SER B 144 ? 0.894 0.541 0.915 -0.003 0.108  0.137  144 SER HHH CA   
2158 C C    . SER B 144 ? 0.843 0.518 0.884 -0.007 0.081  0.123  144 SER HHH C    
2159 O O    . SER B 144 ? 0.825 0.511 0.909 -0.018 0.076  0.121  144 SER HHH O    
2160 C CB   . SER B 144 ? 0.893 0.549 0.906 -0.001 0.119  0.140  144 SER HHH CB   
2161 O OG   . SER B 144 ? 0.934 0.559 0.898 0.009  0.134  0.148  144 SER HHH OG   
2162 H H    . SER B 144 ? 0.909 0.553 0.998 -0.018 0.128  0.146  144 SER HHH H    
2163 H HA   . SER B 144 ? 0.911 0.542 0.898 0.005  0.106  0.138  144 SER HHH HA   
2164 H HB2  . SER B 144 ? 0.888 0.549 0.934 -0.008 0.130  0.143  144 SER HHH HB2  
2165 H HB3  . SER B 144 ? 0.871 0.546 0.881 0.000  0.105  0.132  144 SER HHH HB3  
2167 N N    . VAL B 145 ? 0.820 0.500 0.829 0.002  0.065  0.116  145 VAL HHH N    
2168 C CA   . VAL B 145 ? 0.785 0.487 0.802 0.001  0.043  0.103  145 VAL HHH CA   
2169 C C    . VAL B 145 ? 0.765 0.484 0.757 0.009  0.035  0.099  145 VAL HHH C    
2170 O O    . VAL B 145 ? 0.780 0.486 0.739 0.018  0.039  0.103  145 VAL HHH O    
2171 C CB   . VAL B 145 ? 0.795 0.481 0.803 0.004  0.034  0.099  145 VAL HHH CB   
2172 C CG1  . VAL B 145 ? 0.818 0.484 0.789 0.016  0.038  0.104  145 VAL HHH CG1  
2173 C CG2  . VAL B 145 ? 0.777 0.478 0.788 0.003  0.015  0.087  145 VAL HHH CG2  
2174 H H    . VAL B 145 ? 0.833 0.504 0.814 0.009  0.068  0.119  145 VAL HHH H    
2175 H HA   . VAL B 145 ? 0.772 0.485 0.816 -0.007 0.040  0.101  145 VAL HHH HA   
2176 H HB   . VAL B 145 ? 0.806 0.482 0.832 -0.002 0.039  0.102  145 VAL HHH HB   
2177 H HG11 . VAL B 145 ? 0.833 0.487 0.796 0.017  0.050  0.113  145 VAL HHH HG11 
2178 H HG12 . VAL B 145 ? 0.830 0.484 0.799 0.018  0.035  0.103  145 VAL HHH HG12 
2179 H HG13 . VAL B 145 ? 0.809 0.485 0.765 0.023  0.030  0.101  145 VAL HHH HG13 
2180 H HG21 . VAL B 145 ? 0.771 0.479 0.764 0.011  0.011  0.084  145 VAL HHH HG21 
2181 H HG22 . VAL B 145 ? 0.789 0.478 0.800 0.003  0.011  0.084  145 VAL HHH HG22 
2182 H HG23 . VAL B 145 ? 0.763 0.477 0.793 -0.004 0.011  0.084  145 VAL HHH HG23 
2183 N N    . THR B 146 ? 0.738 0.482 0.744 0.005  0.023  0.090  146 THR HHH N    
2184 C CA   . THR B 146 ? 0.716 0.479 0.706 0.011  0.016  0.086  146 THR HHH CA   
2185 C C    . THR B 146 ? 0.701 0.473 0.686 0.014  0.000  0.075  146 THR HHH C    
2186 O O    . THR B 146 ? 0.685 0.462 0.687 0.008  -0.007 0.069  146 THR HHH O    
2187 C CB   . THR B 146 ? 0.694 0.476 0.704 0.004  0.019  0.086  146 THR HHH CB   
2188 O OG1  . THR B 146 ? 0.710 0.481 0.734 -0.001 0.037  0.095  146 THR HHH OG1  
2189 C CG2  . THR B 146 ? 0.680 0.475 0.669 0.010  0.017  0.084  146 THR HHH CG2  
2190 H H    . THR B 146 ? 0.729 0.479 0.756 -0.002 0.018  0.087  146 THR HHH H    
2191 H HA   . THR B 146 ? 0.727 0.481 0.696 0.017  0.021  0.090  146 THR HHH HA   
2192 H HB   . THR B 146 ? 0.682 0.474 0.708 -0.002 0.011  0.080  146 THR HHH HB   
2194 H HG21 . THR B 146 ? 0.670 0.475 0.656 0.012  0.007  0.078  146 THR HHH HG21 
2195 H HG22 . THR B 146 ? 0.672 0.475 0.672 0.006  0.022  0.085  146 THR HHH HG22 
2196 H HG23 . THR B 146 ? 0.697 0.479 0.664 0.016  0.022  0.088  146 THR HHH HG23 
2197 N N    . LEU B 147 ? 0.702 0.475 0.665 0.025  -0.004 0.075  147 LEU HHH N    
2198 C CA   . LEU B 147 ? 0.691 0.473 0.650 0.031  -0.015 0.066  147 LEU HHH CA   
2199 C C    . LEU B 147 ? 0.671 0.476 0.627 0.034  -0.019 0.064  147 LEU HHH C    
2200 O O    . LEU B 147 ? 0.674 0.482 0.626 0.032  -0.015 0.069  147 LEU HHH O    
2201 C CB   . LEU B 147 ? 0.708 0.473 0.652 0.041  -0.016 0.069  147 LEU HHH CB   
2202 C CG   . LEU B 147 ? 0.730 0.470 0.673 0.039  -0.009 0.075  147 LEU HHH CG   
2203 C CD1  . LEU B 147 ? 0.754 0.476 0.680 0.050  -0.011 0.079  147 LEU HHH CD1  
2204 C CD2  . LEU B 147 ? 0.729 0.464 0.688 0.031  -0.012 0.068  147 LEU HHH CD2  
2205 H H    . LEU B 147 ? 0.711 0.478 0.660 0.029  -0.000 0.080  147 LEU HHH H    
2206 H HA   . LEU B 147 ? 0.687 0.471 0.656 0.027  -0.018 0.061  147 LEU HHH HA   
2207 H HB2  . LEU B 147 ? 0.712 0.477 0.645 0.046  -0.017 0.074  147 LEU HHH HB2  
2208 H HB3  . LEU B 147 ? 0.705 0.475 0.651 0.045  -0.021 0.064  147 LEU HHH HB3  
2209 H HG   . LEU B 147 ? 0.735 0.470 0.678 0.035  -0.002 0.080  147 LEU HHH HG   
2210 H HD11 . LEU B 147 ? 0.757 0.479 0.671 0.055  -0.012 0.083  147 LEU HHH HD11 
2211 H HD12 . LEU B 147 ? 0.770 0.475 0.694 0.049  -0.006 0.083  147 LEU HHH HD12 
2212 H HD13 . LEU B 147 ? 0.750 0.476 0.679 0.055  -0.016 0.074  147 LEU HHH HD13 
2213 H HD21 . LEU B 147 ? 0.726 0.465 0.682 0.035  -0.018 0.062  147 LEU HHH HD21 
2214 H HD22 . LEU B 147 ? 0.746 0.464 0.705 0.030  -0.008 0.071  147 LEU HHH HD22 
2215 H HD23 . LEU B 147 ? 0.718 0.462 0.689 0.024  -0.012 0.067  147 LEU HHH HD23 
2216 N N    . GLY B 148 ? 0.660 0.476 0.617 0.038  -0.026 0.057  148 GLY HHH N    
2217 C CA   . GLY B 148 ? 0.641 0.480 0.600 0.040  -0.030 0.054  148 GLY HHH CA   
2218 C C    . GLY B 148 ? 0.642 0.488 0.604 0.048  -0.035 0.049  148 GLY HHH C    
2219 O O    . GLY B 148 ? 0.648 0.482 0.609 0.051  -0.034 0.045  148 GLY HHH O    
2220 H H    . GLY B 148 ? 0.666 0.477 0.624 0.040  -0.028 0.053  148 GLY HHH H    
2221 H HA2  . GLY B 148 ? 0.645 0.483 0.596 0.043  -0.030 0.059  148 GLY HHH HA2  
2222 H HA3  . GLY B 148 ? 0.630 0.477 0.596 0.034  -0.030 0.052  148 GLY HHH HA3  
2223 N N    . CYS B 149 ? 0.631 0.495 0.596 0.052  -0.038 0.048  149 CYS HHH N    
2224 C CA   . CYS B 149 ? 0.622 0.498 0.597 0.058  -0.040 0.044  149 CYS HHH CA   
2225 C C    . CYS B 149 ? 0.584 0.479 0.564 0.053  -0.040 0.039  149 CYS HHH C    
2226 O O    . CYS B 149 ? 0.567 0.472 0.546 0.049  -0.042 0.042  149 CYS HHH O    
2227 C CB   . CYS B 149 ? 0.641 0.521 0.620 0.068  -0.047 0.049  149 CYS HHH CB   
2228 S SG   . CYS B 149 ? 0.702 0.563 0.682 0.078  -0.046 0.051  149 CYS HHH SG   
2229 H H    . CYS B 149 ? 0.626 0.494 0.588 0.050  -0.039 0.051  149 CYS HHH H    
2230 H HA   . CYS B 149 ? 0.630 0.497 0.604 0.060  -0.037 0.040  149 CYS HHH HA   
2231 H HB2  . CYS B 149 ? 0.649 0.527 0.620 0.067  -0.050 0.053  149 CYS HHH HB2  
2232 H HB3  . CYS B 149 ? 0.636 0.530 0.626 0.070  -0.048 0.046  149 CYS HHH HB3  
2233 N N    . LEU B 150 ? 0.566 0.462 0.548 0.053  -0.036 0.032  150 LEU HHH N    
2234 C CA   . LEU B 150 ? 0.548 0.459 0.534 0.049  -0.035 0.028  150 LEU HHH CA   
2235 C C    . LEU B 150 ? 0.541 0.465 0.540 0.058  -0.033 0.028  150 LEU HHH C    
2236 O O    . LEU B 150 ? 0.558 0.473 0.560 0.065  -0.027 0.026  150 LEU HHH O    
2237 C CB   . LEU B 150 ? 0.555 0.452 0.530 0.045  -0.032 0.021  150 LEU HHH CB   
2238 C CG   . LEU B 150 ? 0.541 0.448 0.514 0.042  -0.030 0.017  150 LEU HHH CG   
2239 C CD1  . LEU B 150 ? 0.523 0.445 0.501 0.034  -0.035 0.019  150 LEU HHH CD1  
2240 C CD2  . LEU B 150 ? 0.563 0.448 0.517 0.040  -0.029 0.010  150 LEU HHH CD2  
2241 H H    . LEU B 150 ? 0.581 0.465 0.560 0.055  -0.034 0.030  150 LEU HHH H    
2242 H HA   . LEU B 150 ? 0.537 0.456 0.524 0.045  -0.037 0.030  150 LEU HHH HA   
2243 H HB2  . LEU B 150 ? 0.557 0.448 0.528 0.039  -0.035 0.022  150 LEU HHH HB2  
2244 H HB3  . LEU B 150 ? 0.568 0.454 0.539 0.049  -0.029 0.019  150 LEU HHH HB3  
2245 H HG   . LEU B 150 ? 0.539 0.454 0.519 0.048  -0.026 0.017  150 LEU HHH HG   
2246 H HD11 . LEU B 150 ? 0.513 0.447 0.499 0.037  -0.035 0.023  150 LEU HHH HD11 
2247 H HD12 . LEU B 150 ? 0.519 0.445 0.495 0.032  -0.034 0.016  150 LEU HHH HD12 
2248 H HD13 . LEU B 150 ? 0.525 0.442 0.502 0.029  -0.038 0.021  150 LEU HHH HD13 
2249 H HD21 . LEU B 150 ? 0.567 0.444 0.517 0.033  -0.035 0.010  150 LEU HHH HD21 
2250 H HD22 . LEU B 150 ? 0.560 0.449 0.510 0.038  -0.028 0.007  150 LEU HHH HD22 
2251 H HD23 . LEU B 150 ? 0.577 0.450 0.527 0.045  -0.024 0.008  150 LEU HHH HD23 
2252 N N    . VAL B 151 ? 0.527 0.469 0.536 0.057  -0.037 0.030  151 VAL HHH N    
2253 C CA   . VAL B 151 ? 0.522 0.480 0.551 0.064  -0.036 0.031  151 VAL HHH CA   
2254 C C    . VAL B 151 ? 0.509 0.478 0.541 0.060  -0.030 0.026  151 VAL HHH C    
2255 O O    . VAL B 151 ? 0.493 0.473 0.523 0.053  -0.034 0.027  151 VAL HHH O    
2256 C CB   . VAL B 151 ? 0.514 0.481 0.551 0.065  -0.048 0.037  151 VAL HHH CB   
2257 C CG1  . VAL B 151 ? 0.506 0.489 0.572 0.072  -0.051 0.039  151 VAL HHH CG1  
2258 C CG2  . VAL B 151 ? 0.528 0.478 0.553 0.068  -0.054 0.042  151 VAL HHH CG2  
2259 H H    . VAL B 151 ? 0.520 0.466 0.525 0.052  -0.040 0.032  151 VAL HHH H    
2260 H HA   . VAL B 151 ? 0.530 0.483 0.566 0.070  -0.032 0.031  151 VAL HHH HA   
2261 H HB   . VAL B 151 ? 0.505 0.477 0.536 0.060  -0.050 0.037  151 VAL HHH HB   
2262 H HG11 . VAL B 151 ? 0.498 0.490 0.571 0.070  -0.046 0.036  151 VAL HHH HG11 
2263 H HG12 . VAL B 151 ? 0.507 0.493 0.575 0.072  -0.062 0.042  151 VAL HHH HG12 
2264 H HG13 . VAL B 151 ? 0.516 0.494 0.591 0.078  -0.048 0.040  151 VAL HHH HG13 
2265 H HG21 . VAL B 151 ? 0.537 0.480 0.565 0.072  -0.050 0.041  151 VAL HHH HG21 
2266 H HG22 . VAL B 151 ? 0.532 0.484 0.561 0.071  -0.063 0.046  151 VAL HHH HG22 
2267 H HG23 . VAL B 151 ? 0.530 0.473 0.540 0.063  -0.053 0.042  151 VAL HHH HG23 
2268 N N    . LYS B 152 ? 0.524 0.486 0.555 0.064  -0.019 0.022  152 LYS HHH N    
2269 C CA   . LYS B 152 ? 0.536 0.497 0.558 0.060  -0.011 0.017  152 LYS HHH CA   
2270 C C    . LYS B 152 ? 0.534 0.507 0.577 0.066  -0.001 0.018  152 LYS HHH C    
2271 O O    . LYS B 152 ? 0.538 0.509 0.598 0.075  0.007  0.019  152 LYS HHH O    
2272 C CB   . LYS B 152 ? 0.572 0.505 0.568 0.059  -0.005 0.012  152 LYS HHH CB   
2273 C CG   . LYS B 152 ? 0.591 0.514 0.565 0.054  -0.001 0.007  152 LYS HHH CG   
2274 C CD   . LYS B 152 ? 0.636 0.526 0.581 0.056  0.005  0.001  152 LYS HHH CD   
2275 C CE   . LYS B 152 ? 0.668 0.542 0.587 0.052  0.009  -0.004 152 LYS HHH CE   
2276 N NZ   . LYS B 152 ? 0.717 0.552 0.600 0.054  0.013  -0.010 152 LYS HHH NZ   
2277 H H    . LYS B 152 ? 0.537 0.491 0.572 0.069  -0.014 0.022  152 LYS HHH H    
2278 H HA   . LYS B 152 ? 0.526 0.493 0.542 0.053  -0.016 0.017  152 LYS HHH HA   
2279 H HB2  . LYS B 152 ? 0.575 0.501 0.563 0.056  -0.011 0.012  152 LYS HHH HB2  
2280 H HB3  . LYS B 152 ? 0.584 0.510 0.583 0.066  0.003  0.011  152 LYS HHH HB3  
2281 H HG2  . LYS B 152 ? 0.586 0.518 0.567 0.056  0.005  0.007  152 LYS HHH HG2  
2282 H HG3  . LYS B 152 ? 0.582 0.509 0.552 0.047  -0.010 0.007  152 LYS HHH HG3  
2283 H HD2  . LYS B 152 ? 0.642 0.523 0.578 0.052  -0.003 0.000  152 LYS HHH HD2  
2284 H HD3  . LYS B 152 ? 0.647 0.532 0.597 0.063  0.014  0.001  152 LYS HHH HD3  
2285 H HE2  . LYS B 152 ? 0.662 0.545 0.590 0.056  0.018  -0.003 152 LYS HHH HE2  
2286 H HE3  . LYS B 152 ? 0.656 0.536 0.572 0.045  -0.001 -0.004 152 LYS HHH HE3  
2287 H HZ1  . LYS B 152 ? 0.719 0.546 0.594 0.050  0.003  -0.011 152 LYS HHH HZ1  
2288 H HZ2  . LYS B 152 ? 0.728 0.551 0.593 0.053  0.016  -0.013 152 LYS HHH HZ2  
2289 H HZ3  . LYS B 152 ? 0.725 0.553 0.611 0.061  0.023  -0.010 152 LYS HHH HZ3  
2290 N N    . GLY B 153 ? 0.522 0.508 0.567 0.061  0.000  0.017  153 GLY HHH N    
2291 C CA   . GLY B 153 ? 0.523 0.517 0.583 0.064  0.013  0.016  153 GLY HHH CA   
2292 C C    . GLY B 153 ? 0.515 0.528 0.617 0.071  0.013  0.021  153 GLY HHH C    
2293 O O    . GLY B 153 ? 0.525 0.534 0.643 0.079  0.028  0.022  153 GLY HHH O    
2294 H H    . GLY B 153 ? 0.513 0.503 0.551 0.055  -0.007 0.017  153 GLY HHH H    
2295 H HA2  . GLY B 153 ? 0.515 0.514 0.570 0.059  0.011  0.015  153 GLY HHH HA2  
2296 H HA3  . GLY B 153 ? 0.541 0.518 0.588 0.068  0.024  0.014  153 GLY HHH HA3  
2297 N N    . TYR B 154 ? 0.504 0.536 0.622 0.067  -0.002 0.025  154 TYR HHH N    
2298 C CA   . TYR B 154 ? 0.505 0.555 0.664 0.072  -0.009 0.030  154 TYR HHH CA   
2299 C C    . TYR B 154 ? 0.500 0.569 0.674 0.066  -0.016 0.031  154 TYR HHH C    
2300 O O    . TYR B 154 ? 0.495 0.561 0.643 0.058  -0.017 0.028  154 TYR HHH O    
2301 C CB   . TYR B 154 ? 0.504 0.551 0.664 0.075  -0.026 0.034  154 TYR HHH CB   
2302 C CG   . TYR B 154 ? 0.496 0.539 0.627 0.067  -0.041 0.034  154 TYR HHH CG   
2303 C CD1  . TYR B 154 ? 0.498 0.525 0.597 0.063  -0.039 0.032  154 TYR HHH CD1  
2304 C CD2  . TYR B 154 ? 0.489 0.543 0.628 0.063  -0.056 0.037  154 TYR HHH CD2  
2305 C CE1  . TYR B 154 ? 0.495 0.517 0.572 0.057  -0.049 0.033  154 TYR HHH CE1  
2306 C CE2  . TYR B 154 ? 0.488 0.534 0.598 0.057  -0.066 0.037  154 TYR HHH CE2  
2307 C CZ   . TYR B 154 ? 0.487 0.518 0.568 0.054  -0.060 0.035  154 TYR HHH CZ   
2308 O OH   . TYR B 154 ? 0.480 0.502 0.536 0.048  -0.066 0.036  154 TYR HHH OH   
2309 H H    . TYR B 154 ? 0.498 0.530 0.602 0.062  -0.010 0.025  154 TYR HHH H    
2310 H HA   . TYR B 154 ? 0.511 0.561 0.688 0.078  0.003  0.031  154 TYR HHH HA   
2311 H HB2  . TYR B 154 ? 0.502 0.560 0.690 0.078  -0.033 0.038  154 TYR HHH HB2  
2312 H HB3  . TYR B 154 ? 0.515 0.551 0.668 0.079  -0.021 0.034  154 TYR HHH HB3  
2313 H HD1  . TYR B 154 ? 0.506 0.524 0.598 0.065  -0.031 0.030  154 TYR HHH HD1  
2314 H HD2  . TYR B 154 ? 0.485 0.550 0.649 0.065  -0.059 0.039  154 TYR HHH HD2  
2315 H HE1  . TYR B 154 ? 0.499 0.511 0.558 0.054  -0.046 0.032  154 TYR HHH HE1  
2316 H HE2  . TYR B 154 ? 0.486 0.536 0.598 0.055  -0.075 0.038  154 TYR HHH HE2  
2318 N N    . PHE B 155 ? 0.516 0.601 0.732 0.070  -0.020 0.036  155 PHE HHH N    
2319 C CA   . PHE B 155 ? 0.512 0.614 0.749 0.064  -0.031 0.037  155 PHE HHH CA   
2320 C C    . PHE B 155 ? 0.519 0.634 0.799 0.069  -0.048 0.043  155 PHE HHH C    
2321 O O    . PHE B 155 ? 0.513 0.629 0.823 0.077  -0.041 0.046  155 PHE HHH O    
2322 C CB   . PHE B 155 ? 0.512 0.622 0.763 0.063  -0.011 0.036  155 PHE HHH CB   
2323 C CG   . PHE B 155 ? 0.501 0.625 0.763 0.056  -0.021 0.036  155 PHE HHH CG   
2324 C CD1  . PHE B 155 ? 0.499 0.617 0.725 0.047  -0.023 0.032  155 PHE HHH CD1  
2325 C CD2  . PHE B 155 ? 0.502 0.643 0.813 0.056  -0.028 0.041  155 PHE HHH CD2  
2326 C CE1  . PHE B 155 ? 0.494 0.624 0.729 0.041  -0.031 0.033  155 PHE HHH CE1  
2327 C CE2  . PHE B 155 ? 0.497 0.649 0.817 0.049  -0.038 0.040  155 PHE HHH CE2  
2328 C CZ   . PHE B 155 ? 0.496 0.641 0.775 0.041  -0.039 0.036  155 PHE HHH CZ   
2329 H H    . PHE B 155 ? 0.519 0.605 0.756 0.076  -0.017 0.038  155 PHE HHH H    
2330 H HA   . PHE B 155 ? 0.509 0.608 0.722 0.059  -0.040 0.036  155 PHE HHH HA   
2331 H HB2  . PHE B 155 ? 0.516 0.614 0.739 0.062  -0.001 0.032  155 PHE HHH HB2  
2332 H HB3  . PHE B 155 ? 0.516 0.630 0.795 0.069  -0.002 0.038  155 PHE HHH HB3  
2333 H HD1  . PHE B 155 ? 0.503 0.611 0.700 0.047  -0.020 0.030  155 PHE HHH HD1  
2334 H HD2  . PHE B 155 ? 0.506 0.652 0.846 0.062  -0.027 0.044  155 PHE HHH HD2  
2335 H HE1  . PHE B 155 ? 0.491 0.616 0.702 0.036  -0.032 0.030  155 PHE HHH HE1  
2336 H HE2  . PHE B 155 ? 0.494 0.658 0.850 0.049  -0.044 0.043  155 PHE HHH HE2  
2337 H HZ   . PHE B 155 ? 0.488 0.639 0.773 0.036  -0.045 0.036  155 PHE HHH HZ   
2338 N N    . PRO B 156 ? 0.540 0.661 0.825 0.064  -0.071 0.045  156 PRO HHH N    
2339 C CA   . PRO B 156 ? 0.552 0.666 0.798 0.055  -0.080 0.042  156 PRO HHH CA   
2340 C C    . PRO B 156 ? 0.579 0.674 0.781 0.054  -0.091 0.042  156 PRO HHH C    
2341 O O    . PRO B 156 ? 0.592 0.678 0.788 0.060  -0.087 0.043  156 PRO HHH O    
2342 C CB   . PRO B 156 ? 0.545 0.671 0.819 0.051  -0.098 0.044  156 PRO HHH CB   
2343 C CG   . PRO B 156 ? 0.552 0.684 0.867 0.058  -0.112 0.050  156 PRO HHH CG   
2344 C CD   . PRO B 156 ? 0.548 0.682 0.881 0.066  -0.089 0.050  156 PRO HHH CD   
2345 H HA   . PRO B 156 ? 0.543 0.659 0.778 0.052  -0.066 0.039  156 PRO HHH HA   
2346 H HB2  . PRO B 156 ? 0.550 0.669 0.800 0.047  -0.111 0.043  156 PRO HHH HB2  
2347 H HB3  . PRO B 156 ? 0.537 0.674 0.828 0.049  -0.089 0.043  156 PRO HHH HB3  
2348 H HG2  . PRO B 156 ? 0.564 0.684 0.860 0.059  -0.127 0.051  156 PRO HHH HG2  
2349 H HG3  . PRO B 156 ? 0.550 0.693 0.897 0.057  -0.121 0.052  156 PRO HHH HG3  
2350 H HD2  . PRO B 156 ? 0.556 0.685 0.895 0.072  -0.096 0.053  156 PRO HHH HD2  
2351 H HD3  . PRO B 156 ? 0.541 0.688 0.908 0.068  -0.079 0.052  156 PRO HHH HD3  
2352 N N    . GLU B 157 ? 0.596 0.683 0.770 0.047  -0.102 0.040  157 GLU HHH N    
2353 C CA   . GLU B 157 ? 0.613 0.681 0.740 0.045  -0.102 0.039  157 GLU HHH CA   
2354 C C    . GLU B 157 ? 0.633 0.683 0.747 0.050  -0.116 0.043  157 GLU HHH C    
2355 O O    . GLU B 157 ? 0.644 0.680 0.730 0.050  -0.108 0.043  157 GLU HHH O    
2356 C CB   . GLU B 157 ? 0.622 0.684 0.725 0.037  -0.108 0.038  157 GLU HHH CB   
2357 C CG   . GLU B 157 ? 0.628 0.682 0.700 0.033  -0.094 0.035  157 GLU HHH CG   
2358 C CD   . GLU B 157 ? 0.649 0.686 0.696 0.035  -0.089 0.037  157 GLU HHH CD   
2359 O OE1  . GLU B 157 ? 0.641 0.678 0.699 0.040  -0.086 0.037  157 GLU HHH OE1  
2360 O OE2  . GLU B 157 ? 0.665 0.688 0.685 0.031  -0.088 0.037  157 GLU HHH OE2  
2361 H H    . GLU B 157 ? 0.593 0.685 0.775 0.044  -0.110 0.041  157 GLU HHH H    
2362 H HA   . GLU B 157 ? 0.606 0.674 0.727 0.044  -0.089 0.037  157 GLU HHH HA   
2363 H HB2  . GLU B 157 ? 0.614 0.688 0.735 0.035  -0.108 0.037  157 GLU HHH HB2  
2364 H HB3  . GLU B 157 ? 0.638 0.689 0.728 0.038  -0.121 0.040  157 GLU HHH HB3  
2365 H HG2  . GLU B 157 ? 0.614 0.678 0.697 0.032  -0.083 0.033  157 GLU HHH HG2  
2366 H HG3  . GLU B 157 ? 0.630 0.680 0.689 0.029  -0.097 0.035  157 GLU HHH HG3  
2367 N N    . SER B 158 ? 0.636 0.687 0.770 0.054  -0.135 0.047  158 SER HHH N    
2368 C CA   . SER B 158 ? 0.653 0.684 0.772 0.059  -0.152 0.052  158 SER HHH CA   
2369 C C    . SER B 158 ? 0.640 0.668 0.763 0.066  -0.140 0.053  158 SER HHH C    
2370 O O    . SER B 158 ? 0.635 0.678 0.798 0.072  -0.135 0.054  158 SER HHH O    
2371 C CB   . SER B 158 ? 0.678 0.712 0.824 0.062  -0.178 0.056  158 SER HHH CB   
2372 O OG   . SER B 158 ? 0.672 0.726 0.872 0.068  -0.175 0.059  158 SER HHH OG   
2373 H H    . SER B 158 ? 0.631 0.694 0.791 0.053  -0.140 0.048  158 SER HHH H    
2374 H HA   . SER B 158 ? 0.666 0.680 0.749 0.056  -0.154 0.052  158 SER HHH HA   
2375 H HB2  . SER B 158 ? 0.699 0.714 0.823 0.064  -0.191 0.059  158 SER HHH HB2  
2376 H HB3  . SER B 158 ? 0.674 0.712 0.822 0.057  -0.184 0.055  158 SER HHH HB3  
2378 N N    . VAL B 159 ? 0.632 0.640 0.717 0.065  -0.134 0.054  159 VAL HHH N    
2379 C CA   . VAL B 159 ? 0.631 0.626 0.711 0.072  -0.130 0.056  159 VAL HHH CA   
2380 C C    . VAL B 159 ? 0.640 0.606 0.676 0.072  -0.137 0.060  159 VAL HHH C    
2381 O O    . VAL B 159 ? 0.639 0.596 0.645 0.065  -0.134 0.058  159 VAL HHH O    
2382 C CB   . VAL B 159 ? 0.621 0.622 0.704 0.072  -0.107 0.052  159 VAL HHH CB   
2383 C CG1  . VAL B 159 ? 0.605 0.628 0.726 0.074  -0.096 0.049  159 VAL HHH CG1  
2384 C CG2  . VAL B 159 ? 0.614 0.607 0.666 0.064  -0.095 0.049  159 VAL HHH CG2  
2385 H H    . VAL B 159 ? 0.635 0.635 0.695 0.061  -0.131 0.052  159 VAL HHH H    
2386 H HA   . VAL B 159 ? 0.635 0.635 0.739 0.078  -0.138 0.059  159 VAL HHH HA   
2387 H HB   . VAL B 159 ? 0.630 0.622 0.711 0.076  -0.106 0.054  159 VAL HHH HB   
2388 H HG11 . VAL B 159 ? 0.608 0.636 0.753 0.079  -0.102 0.052  159 VAL HHH HG11 
2389 H HG12 . VAL B 159 ? 0.601 0.622 0.718 0.074  -0.083 0.047  159 VAL HHH HG12 
2390 H HG13 . VAL B 159 ? 0.594 0.626 0.718 0.069  -0.096 0.047  159 VAL HHH HG13 
2391 H HG21 . VAL B 159 ? 0.610 0.607 0.657 0.059  -0.099 0.048  159 VAL HHH HG21 
2392 H HG22 . VAL B 159 ? 0.604 0.603 0.661 0.063  -0.084 0.045  159 VAL HHH HG22 
2393 H HG23 . VAL B 159 ? 0.627 0.605 0.659 0.064  -0.096 0.051  159 VAL HHH HG23 
2394 N N    . THR B 160 ? 0.653 0.603 0.684 0.079  -0.146 0.065  160 THR HHH N    
2395 C CA   . THR B 160 ? 0.670 0.588 0.657 0.080  -0.149 0.069  160 THR HHH CA   
2396 C C    . THR B 160 ? 0.659 0.572 0.648 0.084  -0.134 0.070  160 THR HHH C    
2397 O O    . THR B 160 ? 0.639 0.566 0.662 0.089  -0.132 0.069  160 THR HHH O    
2398 C CB   . THR B 160 ? 0.703 0.599 0.675 0.085  -0.175 0.075  160 THR HHH CB   
2399 O OG1  . THR B 160 ? 0.696 0.604 0.707 0.093  -0.188 0.078  160 THR HHH OG1  
2400 C CG2  . THR B 160 ? 0.710 0.605 0.672 0.080  -0.190 0.074  160 THR HHH CG2  
2401 H H    . THR B 160 ? 0.651 0.609 0.707 0.084  -0.150 0.066  160 THR HHH H    
2402 H HA   . THR B 160 ? 0.670 0.582 0.635 0.074  -0.142 0.067  160 THR HHH HA   
2403 H HB   . THR B 160 ? 0.725 0.597 0.665 0.086  -0.174 0.078  160 THR HHH HB   
2405 H HG21 . THR B 160 ? 0.712 0.598 0.647 0.075  -0.181 0.072  160 THR HHH HG21 
2406 H HG22 . THR B 160 ? 0.737 0.615 0.686 0.083  -0.209 0.078  160 THR HHH HG22 
2407 H HG23 . THR B 160 ? 0.688 0.607 0.683 0.079  -0.191 0.071  160 THR HHH HG23 
2408 N N    . VAL B 161 ? 0.665 0.556 0.619 0.080  -0.124 0.071  161 VAL HHH N    
2409 C CA   . VAL B 161 ? 0.668 0.547 0.618 0.083  -0.112 0.072  161 VAL HHH CA   
2410 C C    . VAL B 161 ? 0.699 0.544 0.611 0.086  -0.117 0.079  161 VAL HHH C    
2411 O O    . VAL B 161 ? 0.710 0.538 0.590 0.081  -0.115 0.081  161 VAL HHH O    
2412 C CB   . VAL B 161 ? 0.651 0.538 0.602 0.075  -0.092 0.067  161 VAL HHH CB   
2413 C CG1  . VAL B 161 ? 0.660 0.536 0.612 0.077  -0.082 0.067  161 VAL HHH CG1  
2414 C CG2  . VAL B 161 ? 0.622 0.538 0.601 0.072  -0.087 0.060  161 VAL HHH CG2  
2415 H H    . VAL B 161 ? 0.674 0.555 0.606 0.076  -0.123 0.071  161 VAL HHH H    
2416 H HA   . VAL B 161 ? 0.664 0.551 0.636 0.088  -0.114 0.072  161 VAL HHH HA   
2417 H HB   . VAL B 161 ? 0.657 0.535 0.589 0.070  -0.088 0.068  161 VAL HHH HB   
2418 H HG11 . VAL B 161 ? 0.679 0.536 0.611 0.078  -0.082 0.071  161 VAL HHH HG11 
2419 H HG12 . VAL B 161 ? 0.647 0.529 0.602 0.072  -0.072 0.063  161 VAL HHH HG12 
2420 H HG13 . VAL B 161 ? 0.659 0.540 0.627 0.083  -0.085 0.067  161 VAL HHH HG13 
2421 H HG21 . VAL B 161 ? 0.618 0.543 0.617 0.077  -0.091 0.060  161 VAL HHH HG21 
2422 H HG22 . VAL B 161 ? 0.613 0.530 0.591 0.068  -0.077 0.057  161 VAL HHH HG22 
2423 H HG23 . VAL B 161 ? 0.617 0.538 0.593 0.069  -0.091 0.060  161 VAL HHH HG23 
2424 N N    . THR B 162 ? 0.714 0.546 0.629 0.094  -0.122 0.084  162 THR HHH N    
2425 C CA   . THR B 162 ? 0.753 0.548 0.630 0.098  -0.127 0.091  162 THR HHH CA   
2426 C C    . THR B 162 ? 0.749 0.536 0.631 0.099  -0.112 0.092  162 THR HHH C    
2427 O O    . THR B 162 ? 0.722 0.530 0.638 0.102  -0.108 0.088  162 THR HHH O    
2428 C CB   . THR B 162 ? 0.776 0.558 0.650 0.107  -0.153 0.097  162 THR HHH CB   
2429 O OG1  . THR B 162 ? 0.760 0.561 0.676 0.114  -0.158 0.097  162 THR HHH OG1  
2430 C CG2  . THR B 162 ? 0.774 0.564 0.647 0.104  -0.170 0.096  162 THR HHH CG2  
2431 H H    . THR B 162 ? 0.705 0.548 0.644 0.097  -0.123 0.082  162 THR HHH H    
2432 H HA   . THR B 162 ? 0.762 0.544 0.613 0.093  -0.122 0.092  162 THR HHH HA   
2433 H HB   . THR B 162 ? 0.806 0.561 0.650 0.109  -0.156 0.102  162 THR HHH HB   
2435 H HG21 . THR B 162 ? 0.780 0.560 0.627 0.099  -0.164 0.095  162 THR HHH HG21 
2436 H HG22 . THR B 162 ? 0.799 0.575 0.663 0.109  -0.189 0.100  162 THR HHH HG22 
2437 H HG23 . THR B 162 ? 0.747 0.564 0.653 0.103  -0.170 0.092  162 THR HHH HG23 
2438 N N    . TRP B 163 ? 0.776 0.533 0.624 0.098  -0.103 0.097  163 TRP HHH N    
2439 C CA   . TRP B 163 ? 0.779 0.525 0.629 0.098  -0.089 0.098  163 TRP HHH CA   
2440 C C    . TRP B 163 ? 0.829 0.540 0.654 0.107  -0.097 0.107  163 TRP HHH C    
2441 O O    . TRP B 163 ? 0.866 0.552 0.655 0.109  -0.107 0.113  163 TRP HHH O    
2442 C CB   . TRP B 163 ? 0.768 0.506 0.606 0.088  -0.069 0.097  163 TRP HHH CB   
2443 C CG   . TRP B 163 ? 0.719 0.488 0.582 0.080  -0.061 0.089  163 TRP HHH CG   
2444 C CD1  . TRP B 163 ? 0.702 0.482 0.561 0.074  -0.060 0.087  163 TRP HHH CD1  
2445 C CD2  . TRP B 163 ? 0.690 0.476 0.581 0.076  -0.053 0.082  163 TRP HHH CD2  
2446 N NE1  . TRP B 163 ? 0.668 0.474 0.554 0.067  -0.053 0.080  163 TRP HHH NE1  
2447 C CE2  . TRP B 163 ? 0.660 0.469 0.563 0.068  -0.050 0.077  163 TRP HHH CE2  
2448 C CE3  . TRP B 163 ? 0.690 0.472 0.593 0.078  -0.050 0.080  163 TRP HHH CE3  
2449 C CZ2  . TRP B 163 ? 0.633 0.458 0.558 0.063  -0.044 0.069  163 TRP HHH CZ2  
2450 C CZ3  . TRP B 163 ? 0.669 0.467 0.593 0.073  -0.044 0.073  163 TRP HHH CZ3  
2451 C CH2  . TRP B 163 ? 0.641 0.458 0.573 0.065  -0.042 0.067  163 TRP HHH CH2  
2452 H H    . TRP B 163 ? 0.795 0.535 0.617 0.097  -0.105 0.100  163 TRP HHH H    
2453 H HA   . TRP B 163 ? 0.761 0.523 0.637 0.099  -0.088 0.094  163 TRP HHH HA   
2454 H HB2  . TRP B 163 ? 0.787 0.508 0.599 0.088  -0.068 0.102  163 TRP HHH HB2  
2455 H HB3  . TRP B 163 ? 0.775 0.503 0.613 0.088  -0.061 0.099  163 TRP HHH HB3  
2456 H HD1  . TRP B 163 ? 0.718 0.487 0.557 0.075  -0.064 0.090  163 TRP HHH HD1  
2457 H HE1  . TRP B 163 ? 0.655 0.472 0.544 0.063  -0.051 0.077  163 TRP HHH HE1  
2458 H HE3  . TRP B 163 ? 0.709 0.476 0.605 0.083  -0.053 0.084  163 TRP HHH HE3  
2459 H HZ2  . TRP B 163 ? 0.619 0.457 0.550 0.058  -0.042 0.066  163 TRP HHH HZ2  
2460 H HZ3  . TRP B 163 ? 0.673 0.464 0.602 0.074  -0.042 0.071  163 TRP HHH HZ3  
2461 H HH2  . TRP B 163 ? 0.631 0.455 0.574 0.062  -0.039 0.062  163 TRP HHH HH2  
2462 N N    . ASN B 164 ? 0.848 0.554 0.685 0.111  -0.092 0.108  164 ASN HHH N    
2463 C CA   . ASN B 164 ? 0.899 0.570 0.712 0.117  -0.093 0.117  164 ASN HHH CA   
2464 C C    . ASN B 164 ? 0.904 0.567 0.720 0.112  -0.072 0.115  164 ASN HHH C    
2465 O O    . ASN B 164 ? 0.859 0.546 0.705 0.107  -0.064 0.107  164 ASN HHH O    
2466 C CB   . ASN B 164 ? 0.911 0.581 0.739 0.130  -0.112 0.120  164 ASN HHH CB   
2467 C CG   . ASN B 164 ? 0.921 0.597 0.749 0.135  -0.136 0.122  164 ASN HHH CG   
2468 O OD1  . ASN B 164 ? 0.924 0.613 0.782 0.143  -0.152 0.123  164 ASN HHH OD1  
2469 N ND2  . ASN B 164 ? 0.927 0.593 0.724 0.130  -0.140 0.123  164 ASN HHH ND2  
2470 H H    . ASN B 164 ? 0.826 0.549 0.688 0.110  -0.088 0.103  164 ASN HHH H    
2471 H HA   . ASN B 164 ? 0.923 0.573 0.705 0.117  -0.096 0.121  164 ASN HHH HA   
2472 H HB2  . ASN B 164 ? 0.890 0.579 0.748 0.131  -0.108 0.115  164 ASN HHH HB2  
2473 H HB3  . ASN B 164 ? 0.939 0.585 0.749 0.134  -0.112 0.126  164 ASN HHH HB3  
2476 N N    . SER B 165 ? 0.955 0.582 0.739 0.112  -0.063 0.123  165 SER HHH N    
2477 C CA   . SER B 165 ? 0.964 0.578 0.750 0.105  -0.043 0.124  165 SER HHH CA   
2478 C C    . SER B 165 ? 1.000 0.575 0.760 0.112  -0.042 0.134  165 SER HHH C    
2479 O O    . SER B 165 ? 1.027 0.573 0.748 0.117  -0.047 0.142  165 SER HHH O    
2480 C CB   . SER B 165 ? 0.965 0.578 0.744 0.094  -0.026 0.124  165 SER HHH CB   
2481 O OG   . SER B 165 ? 1.007 0.591 0.744 0.096  -0.024 0.132  165 SER HHH OG   
2482 H H    . SER B 165 ? 0.979 0.586 0.737 0.115  -0.069 0.129  165 SER HHH H    
2483 H HA   . SER B 165 ? 0.941 0.572 0.753 0.104  -0.042 0.118  165 SER HHH HA   
2484 H HB2  . SER B 165 ? 0.968 0.573 0.754 0.089  -0.014 0.125  165 SER HHH HB2  
2485 H HB3  . SER B 165 ? 0.937 0.575 0.734 0.090  -0.027 0.118  165 SER HHH HB3  
2487 N N    . SER B 170 ? 1.192 0.694 0.835 0.072  0.072  0.154  170 SER HHH N    
2488 C CA   . SER B 170 ? 1.124 0.679 0.826 0.066  0.061  0.143  170 SER HHH CA   
2489 C C    . SER B 170 ? 1.095 0.678 0.800 0.065  0.045  0.135  170 SER HHH C    
2490 O O    . SER B 170 ? 1.110 0.695 0.799 0.072  0.021  0.133  170 SER HHH O    
2491 C CB   . SER B 170 ? 1.114 0.677 0.831 0.070  0.045  0.141  170 SER HHH CB   
2492 O OG   . SER B 170 ? 1.145 0.673 0.846 0.072  0.057  0.150  170 SER HHH OG   
2493 H H    . SER B 170 ? 1.209 0.697 0.832 0.079  0.060  0.156  170 SER HHH H    
2494 H HA   . SER B 170 ? 1.111 0.675 0.840 0.059  0.076  0.144  170 SER HHH HA   
2495 H HB2  . SER B 170 ? 1.115 0.679 0.818 0.076  0.027  0.139  170 SER HHH HB2  
2496 H HB3  . SER B 170 ? 1.077 0.667 0.831 0.064  0.043  0.135  170 SER HHH HB3  
2498 N N    . SER B 171 ? 1.063 0.667 0.792 0.058  0.057  0.132  171 SER HHH N    
2499 C CA   . SER B 171 ? 1.037 0.657 0.760 0.057  0.049  0.127  171 SER HHH CA   
2500 C C    . SER B 171 ? 0.965 0.634 0.733 0.052  0.033  0.116  171 SER HHH C    
2501 O O    . SER B 171 ? 0.933 0.623 0.741 0.046  0.037  0.113  171 SER HHH O    
2502 C CB   . SER B 171 ? 1.052 0.661 0.770 0.052  0.074  0.131  171 SER HHH CB   
2503 O OG   . SER B 171 ? 1.026 0.657 0.795 0.043  0.089  0.131  171 SER HHH OG   
2504 H H    . SER B 171 ? 1.053 0.662 0.805 0.052  0.070  0.133  171 SER HHH H    
2505 H HA   . SER B 171 ? 1.059 0.663 0.749 0.063  0.037  0.128  171 SER HHH HA   
2506 H HB2  . SER B 171 ? 1.043 0.661 0.756 0.052  0.068  0.127  171 SER HHH HB2  
2507 H HB3  . SER B 171 ? 1.092 0.666 0.777 0.056  0.085  0.138  171 SER HHH HB3  
2509 N N    . VAL B 172 ? 0.942 0.625 0.702 0.055  0.015  0.111  172 VAL HHH N    
2510 C CA   . VAL B 172 ? 0.887 0.612 0.682 0.053  -0.001 0.101  172 VAL HHH CA   
2511 C C    . VAL B 172 ? 0.866 0.609 0.671 0.047  0.005  0.097  172 VAL HHH C    
2512 O O    . VAL B 172 ? 0.895 0.618 0.669 0.048  0.010  0.100  172 VAL HHH O    
2513 C CB   . VAL B 172 ? 0.886 0.611 0.667 0.061  -0.025 0.099  172 VAL HHH CB   
2514 C CG1  . VAL B 172 ? 0.843 0.607 0.657 0.060  -0.038 0.090  172 VAL HHH CG1  
2515 C CG2  . VAL B 172 ? 0.902 0.612 0.679 0.068  -0.031 0.103  172 VAL HHH CG2  
2516 H H    . VAL B 172 ? 0.966 0.631 0.696 0.058  0.013  0.113  172 VAL HHH H    
2517 H HA   . VAL B 172 ? 0.870 0.607 0.689 0.050  0.001  0.099  172 VAL HHH HA   
2518 H HB   . VAL B 172 ? 0.911 0.617 0.663 0.064  -0.028 0.102  172 VAL HHH HB   
2519 H HG11 . VAL B 172 ? 0.840 0.608 0.648 0.058  -0.039 0.089  172 VAL HHH HG11 
2520 H HG12 . VAL B 172 ? 0.846 0.612 0.661 0.065  -0.051 0.090  172 VAL HHH HG12 
2521 H HG13 . VAL B 172 ? 0.821 0.601 0.659 0.055  -0.032 0.087  172 VAL HHH HG13 
2522 H HG21 . VAL B 172 ? 0.882 0.607 0.685 0.065  -0.028 0.100  172 VAL HHH HG21 
2523 H HG22 . VAL B 172 ? 0.908 0.618 0.680 0.073  -0.046 0.102  172 VAL HHH HG22 
2524 H HG23 . VAL B 172 ? 0.932 0.614 0.685 0.069  -0.022 0.109  172 VAL HHH HG23 
2525 N N    . HIS B 173 ? 0.832 0.610 0.677 0.041  0.003  0.090  173 HIS HHH N    
2526 C CA   . HIS B 173 ? 0.810 0.611 0.670 0.036  0.004  0.086  173 HIS HHH CA   
2527 C C    . HIS B 173 ? 0.777 0.607 0.655 0.037  -0.014 0.077  173 HIS HHH C    
2528 O O    . HIS B 173 ? 0.765 0.609 0.666 0.036  -0.018 0.074  173 HIS HHH O    
2529 C CB   . HIS B 173 ? 0.801 0.613 0.692 0.027  0.019  0.086  173 HIS HHH CB   
2530 C CG   . HIS B 173 ? 0.840 0.626 0.721 0.025  0.040  0.095  173 HIS HHH CG   
2531 N ND1  . HIS B 173 ? 0.870 0.641 0.759 0.024  0.051  0.100  173 HIS HHH ND1  
2532 C CD2  . HIS B 173 ? 0.867 0.638 0.732 0.025  0.056  0.099  173 HIS HHH CD2  
2533 C CE1  . HIS B 173 ? 0.903 0.651 0.784 0.023  0.073  0.108  173 HIS HHH CE1  
2534 N NE2  . HIS B 173 ? 0.906 0.653 0.770 0.024  0.077  0.108  173 HIS HHH NE2  
2535 H H    . HIS B 173 ? 0.819 0.606 0.682 0.040  0.000  0.088  173 HIS HHH H    
2536 H HA   . HIS B 173 ? 0.827 0.615 0.664 0.037  0.006  0.088  173 HIS HHH HA   
2537 H HB2  . HIS B 173 ? 0.791 0.611 0.700 0.025  0.015  0.084  173 HIS HHH HB2  
2538 H HB3  . HIS B 173 ? 0.783 0.612 0.685 0.024  0.017  0.083  173 HIS HHH HB3  
2540 H HD2  . HIS B 173 ? 0.864 0.640 0.721 0.026  0.053  0.097  173 HIS HHH HD2  
2541 H HE1  . HIS B 173 ? 0.916 0.650 0.801 0.022  0.085  0.114  173 HIS HHH HE1  
2543 N N    . THR B 174 ? 0.765 0.601 0.631 0.039  -0.023 0.075  174 THR HHH N    
2544 C CA   . THR B 174 ? 0.730 0.593 0.615 0.040  -0.038 0.068  174 THR HHH CA   
2545 C C    . THR B 174 ? 0.683 0.567 0.583 0.034  -0.035 0.064  174 THR HHH C    
2546 O O    . THR B 174 ? 0.688 0.565 0.570 0.033  -0.034 0.065  174 THR HHH O    
2547 C CB   . THR B 174 ? 0.755 0.608 0.621 0.047  -0.055 0.070  174 THR HHH CB   
2548 O OG1  . THR B 174 ? 0.772 0.614 0.637 0.053  -0.060 0.073  174 THR HHH OG1  
2549 C CG2  . THR B 174 ? 0.733 0.613 0.621 0.047  -0.068 0.064  174 THR HHH CG2  
2550 H H    . THR B 174 ? 0.781 0.604 0.628 0.039  -0.021 0.078  174 THR HHH H    
2551 H HA   . THR B 174 ? 0.718 0.589 0.619 0.040  -0.040 0.066  174 THR HHH HA   
2552 H HB   . THR B 174 ? 0.776 0.611 0.618 0.047  -0.054 0.073  174 THR HHH HB   
2554 H HG21 . THR B 174 ? 0.730 0.612 0.612 0.044  -0.067 0.063  174 THR HHH HG21 
2555 H HG22 . THR B 174 ? 0.743 0.619 0.628 0.052  -0.080 0.065  174 THR HHH HG22 
2556 H HG23 . THR B 174 ? 0.711 0.608 0.621 0.046  -0.065 0.061  174 THR HHH HG23 
2557 N N    . PHE B 175 ? 0.640 0.546 0.567 0.030  -0.034 0.059  175 PHE HHH N    
2558 C CA   . PHE B 175 ? 0.626 0.551 0.568 0.024  -0.030 0.055  175 PHE HHH CA   
2559 C C    . PHE B 175 ? 0.624 0.566 0.571 0.025  -0.040 0.051  175 PHE HHH C    
2560 O O    . PHE B 175 ? 0.624 0.572 0.577 0.030  -0.049 0.049  175 PHE HHH O    
2561 C CB   . PHE B 175 ? 0.600 0.535 0.565 0.019  -0.027 0.052  175 PHE HHH CB   
2562 C CG   . PHE B 175 ? 0.605 0.524 0.573 0.016  -0.018 0.057  175 PHE HHH CG   
2563 C CD1  . PHE B 175 ? 0.600 0.517 0.577 0.010  -0.008 0.061  175 PHE HHH CD1  
2564 C CD2  . PHE B 175 ? 0.617 0.523 0.580 0.020  -0.020 0.058  175 PHE HHH CD2  
2565 C CE1  . PHE B 175 ? 0.614 0.517 0.599 0.008  0.002  0.066  175 PHE HHH CE1  
2566 C CE2  . PHE B 175 ? 0.624 0.515 0.591 0.017  -0.011 0.063  175 PHE HHH CE2  
2567 C CZ   . PHE B 175 ? 0.622 0.511 0.601 0.010  0.000  0.067  175 PHE HHH CZ   
2568 H H    . PHE B 175 ? 0.641 0.551 0.578 0.031  -0.037 0.057  175 PHE HHH H    
2569 H HA   . PHE B 175 ? 0.632 0.549 0.567 0.021  -0.023 0.058  175 PHE HHH HA   
2570 H HB2  . PHE B 175 ? 0.597 0.536 0.566 0.022  -0.033 0.049  175 PHE HHH HB2  
2571 H HB3  . PHE B 175 ? 0.587 0.533 0.561 0.015  -0.026 0.050  175 PHE HHH HB3  
2572 H HD1  . PHE B 175 ? 0.592 0.518 0.572 0.008  -0.006 0.060  175 PHE HHH HD1  
2573 H HD2  . PHE B 175 ? 0.617 0.524 0.576 0.024  -0.026 0.056  175 PHE HHH HD2  
2574 H HE1  . PHE B 175 ? 0.612 0.514 0.607 0.004  0.010  0.069  175 PHE HHH HE1  
2575 H HE2  . PHE B 175 ? 0.636 0.517 0.600 0.019  -0.011 0.064  175 PHE HHH HE2  
2576 H HZ   . PHE B 175 ? 0.633 0.513 0.619 0.008  0.007  0.071  175 PHE HHH HZ   
2577 N N    . PRO B 176 ? 0.623 0.573 0.571 0.021  -0.037 0.050  176 PRO HHH N    
2578 C CA   . PRO B 176 ? 0.607 0.572 0.560 0.022  -0.046 0.046  176 PRO HHH CA   
2579 C C    . PRO B 176 ? 0.582 0.567 0.558 0.021  -0.047 0.041  176 PRO HHH C    
2580 O O    . PRO B 176 ? 0.567 0.553 0.551 0.018  -0.041 0.040  176 PRO HHH O    
2581 C CB   . PRO B 176 ? 0.613 0.577 0.559 0.017  -0.040 0.046  176 PRO HHH CB   
2582 C CG   . PRO B 176 ? 0.616 0.578 0.571 0.013  -0.027 0.049  176 PRO HHH CG   
2583 C CD   . PRO B 176 ? 0.634 0.579 0.581 0.016  -0.025 0.052  176 PRO HHH CD   
2584 H HA   . PRO B 176 ? 0.620 0.579 0.565 0.026  -0.054 0.047  176 PRO HHH HA   
2585 H HB2  . PRO B 176 ? 0.599 0.577 0.555 0.016  -0.042 0.043  176 PRO HHH HB2  
2586 H HB3  . PRO B 176 ? 0.631 0.581 0.558 0.019  -0.041 0.049  176 PRO HHH HB3  
2587 H HG2  . PRO B 176 ? 0.599 0.574 0.569 0.010  -0.027 0.046  176 PRO HHH HG2  
2588 H HG3  . PRO B 176 ? 0.620 0.576 0.569 0.011  -0.020 0.051  176 PRO HHH HG3  
2589 H HD2  . PRO B 176 ? 0.625 0.573 0.585 0.013  -0.021 0.052  176 PRO HHH HD2  
2590 H HD3  . PRO B 176 ? 0.650 0.578 0.580 0.017  -0.020 0.056  176 PRO HHH HD3  
2591 N N    . ALA B 177 ? 0.570 0.567 0.556 0.024  -0.054 0.038  177 ALA HHH N    
2592 C CA   . ALA B 177 ? 0.560 0.571 0.564 0.025  -0.053 0.034  177 ALA HHH CA   
2593 C C    . ALA B 177 ? 0.549 0.571 0.559 0.020  -0.047 0.031  177 ALA HHH C    
2594 O O    . ALA B 177 ? 0.545 0.569 0.550 0.016  -0.047 0.032  177 ALA HHH O    
2595 C CB   . ALA B 177 ? 0.564 0.584 0.583 0.031  -0.060 0.034  177 ALA HHH CB   
2596 H H    . ALA B 177 ? 0.577 0.573 0.560 0.025  -0.060 0.039  177 ALA HHH H    
2597 H HA   . ALA B 177 ? 0.565 0.570 0.569 0.026  -0.050 0.034  177 ALA HHH HA   
2598 H HB1  . ALA B 177 ? 0.557 0.584 0.587 0.032  -0.056 0.032  177 ALA HHH HB1  
2599 H HB2  . ALA B 177 ? 0.574 0.586 0.589 0.034  -0.065 0.036  177 ALA HHH HB2  
2600 H HB3  . ALA B 177 ? 0.559 0.585 0.579 0.029  -0.063 0.034  177 ALA HHH HB3  
2601 N N    . LEU B 178 ? 0.558 0.582 0.573 0.020  -0.043 0.028  178 LEU HHH N    
2602 C CA   . LEU B 178 ? 0.554 0.584 0.570 0.015  -0.039 0.025  178 LEU HHH CA   
2603 C C    . LEU B 178 ? 0.551 0.589 0.576 0.018  -0.036 0.022  178 LEU HHH C    
2604 O O    . LEU B 178 ? 0.562 0.596 0.590 0.024  -0.034 0.021  178 LEU HHH O    
2605 C CB   . LEU B 178 ? 0.571 0.589 0.581 0.012  -0.039 0.023  178 LEU HHH CB   
2606 C CG   . LEU B 178 ? 0.573 0.591 0.580 0.007  -0.039 0.021  178 LEU HHH CG   
2607 C CD1  . LEU B 178 ? 0.568 0.588 0.580 0.001  -0.041 0.024  178 LEU HHH CD1  
2608 C CD2  . LEU B 178 ? 0.591 0.593 0.587 0.007  -0.040 0.017  178 LEU HHH CD2  
2609 H H    . LEU B 178 ? 0.562 0.582 0.578 0.023  -0.042 0.027  178 LEU HHH H    
2610 H HA   . LEU B 178 ? 0.549 0.583 0.565 0.012  -0.040 0.026  178 LEU HHH HA   
2611 H HB2  . LEU B 178 ? 0.572 0.585 0.581 0.010  -0.040 0.026  178 LEU HHH HB2  
2612 H HB3  . LEU B 178 ? 0.578 0.590 0.586 0.015  -0.038 0.022  178 LEU HHH HB3  
2613 H HG   . LEU B 178 ? 0.568 0.593 0.577 0.008  -0.037 0.020  178 LEU HHH HG   
2614 H HD11 . LEU B 178 ? 0.561 0.588 0.576 0.001  -0.039 0.026  178 LEU HHH HD11 
2615 H HD12 . LEU B 178 ? 0.567 0.587 0.579 -0.002 -0.043 0.023  178 LEU HHH HD12 
2616 H HD13 . LEU B 178 ? 0.573 0.586 0.587 -0.000 -0.042 0.025  178 LEU HHH HD13 
2617 H HD21 . LEU B 178 ? 0.596 0.590 0.592 0.006  -0.043 0.018  178 LEU HHH HD21 
2618 H HD22 . LEU B 178 ? 0.593 0.592 0.584 0.004  -0.042 0.016  178 LEU HHH HD22 
2619 H HD23 . LEU B 178 ? 0.597 0.596 0.590 0.012  -0.036 0.015  178 LEU HHH HD23 
2620 N N    . LEU B 179 ? 0.555 0.602 0.583 0.015  -0.034 0.021  179 LEU HHH N    
2621 C CA   . LEU B 179 ? 0.550 0.603 0.586 0.018  -0.028 0.019  179 LEU HHH CA   
2622 C C    . LEU B 179 ? 0.556 0.597 0.576 0.016  -0.022 0.016  179 LEU HHH C    
2623 O O    . LEU B 179 ? 0.563 0.602 0.575 0.010  -0.026 0.016  179 LEU HHH O    
2624 C CB   . LEU B 179 ? 0.535 0.602 0.582 0.015  -0.030 0.020  179 LEU HHH CB   
2625 C CG   . LEU B 179 ? 0.534 0.610 0.597 0.017  -0.023 0.019  179 LEU HHH CG   
2626 C CD1  . LEU B 179 ? 0.541 0.616 0.618 0.025  -0.018 0.020  179 LEU HHH CD1  
2627 C CD2  . LEU B 179 ? 0.521 0.609 0.599 0.015  -0.029 0.021  179 LEU HHH CD2  
2628 H H    . LEU B 179 ? 0.546 0.595 0.571 0.011  -0.036 0.021  179 LEU HHH H    
2629 H HA   . LEU B 179 ? 0.554 0.607 0.598 0.022  -0.026 0.019  179 LEU HHH HA   
2630 H HB2  . LEU B 179 ? 0.535 0.604 0.585 0.015  -0.036 0.022  179 LEU HHH HB2  
2631 H HB3  . LEU B 179 ? 0.532 0.598 0.572 0.011  -0.030 0.020  179 LEU HHH HB3  
2632 H HG   . LEU B 179 ? 0.535 0.607 0.590 0.016  -0.017 0.018  179 LEU HHH HG   
2633 H HD11 . LEU B 179 ? 0.550 0.615 0.616 0.026  -0.011 0.018  179 LEU HHH HD11 
2634 H HD12 . LEU B 179 ? 0.539 0.622 0.633 0.026  -0.014 0.020  179 LEU HHH HD12 
2635 H HD13 . LEU B 179 ? 0.542 0.617 0.623 0.026  -0.024 0.021  179 LEU HHH HD13 
2636 H HD21 . LEU B 179 ? 0.523 0.613 0.606 0.016  -0.036 0.022  179 LEU HHH HD21 
2637 H HD22 . LEU B 179 ? 0.520 0.615 0.612 0.016  -0.023 0.021  179 LEU HHH HD22 
2638 H HD23 . LEU B 179 ? 0.518 0.606 0.586 0.011  -0.030 0.020  179 LEU HHH HD23 
2639 N N    . GLN B 180 ? 0.580 0.611 0.596 0.021  -0.014 0.013  180 GLN HHH N    
2640 C CA   . GLN B 180 ? 0.620 0.632 0.613 0.021  -0.009 0.010  180 GLN HHH CA   
2641 C C    . GLN B 180 ? 0.630 0.638 0.627 0.028  0.007  0.009  180 GLN HHH C    
2642 O O    . GLN B 180 ? 0.631 0.638 0.639 0.034  0.012  0.010  180 GLN HHH O    
2643 C CB   . GLN B 180 ? 0.660 0.652 0.635 0.020  -0.014 0.008  180 GLN HHH CB   
2644 C CG   . GLN B 180 ? 0.699 0.667 0.645 0.017  -0.016 0.005  180 GLN HHH CG   
2645 C CD   . GLN B 180 ? 0.727 0.678 0.661 0.014  -0.027 0.003  180 GLN HHH CD   
2646 O OE1  . GLN B 180 ? 0.732 0.682 0.673 0.017  -0.026 0.003  180 GLN HHH OE1  
2647 N NE2  . GLN B 180 ? 0.740 0.675 0.657 0.009  -0.037 0.001  180 GLN HHH NE2  
2648 H H    . GLN B 180 ? 0.584 0.617 0.610 0.025  -0.012 0.014  180 GLN HHH H    
2649 H HA   . GLN B 180 ? 0.616 0.630 0.604 0.017  -0.011 0.010  180 GLN HHH HA   
2650 H HB2  . GLN B 180 ? 0.648 0.646 0.629 0.017  -0.022 0.010  180 GLN HHH HB2  
2651 H HB3  . GLN B 180 ? 0.665 0.653 0.642 0.025  -0.010 0.008  180 GLN HHH HB3  
2652 H HG2  . GLN B 180 ? 0.714 0.671 0.650 0.021  -0.007 0.003  180 GLN HHH HG2  
2653 H HG3  . GLN B 180 ? 0.692 0.665 0.638 0.013  -0.020 0.005  180 GLN HHH HG3  
2656 N N    . SER B 181 ? 0.637 0.642 0.626 0.027  0.015  0.009  181 SER HHH N    
2657 C CA   . SER B 181 ? 0.653 0.652 0.646 0.033  0.034  0.009  181 SER HHH CA   
2658 C C    . SER B 181 ? 0.620 0.641 0.654 0.037  0.038  0.012  181 SER HHH C    
2659 O O    . SER B 181 ? 0.625 0.640 0.670 0.045  0.053  0.013  181 SER HHH O    
2660 C CB   . SER B 181 ? 0.696 0.663 0.659 0.038  0.043  0.005  181 SER HHH CB   
2661 O OG   . SER B 181 ? 0.726 0.670 0.651 0.033  0.033  0.002  181 SER HHH OG   
2662 H H    . SER B 181 ? 0.632 0.639 0.616 0.022  0.010  0.009  181 SER HHH H    
2663 H HA   . SER B 181 ? 0.653 0.650 0.639 0.031  0.037  0.009  181 SER HHH HA   
2664 H HB2  . SER B 181 ? 0.696 0.664 0.667 0.041  0.042  0.005  181 SER HHH HB2  
2665 H HB3  . SER B 181 ? 0.711 0.670 0.673 0.042  0.059  0.006  181 SER HHH HB3  
2667 N N    . GLY B 182 ? 0.577 0.623 0.635 0.033  0.026  0.015  182 GLY HHH N    
2668 C CA   . GLY B 182 ? 0.555 0.621 0.653 0.036  0.024  0.018  182 GLY HHH CA   
2669 C C    . GLY B 182 ? 0.542 0.609 0.652 0.041  0.018  0.019  182 GLY HHH C    
2670 O O    . GLY B 182 ? 0.537 0.620 0.682 0.044  0.014  0.023  182 GLY HHH O    
2671 H H    . GLY B 182 ? 0.571 0.619 0.620 0.028  0.017  0.014  182 GLY HHH H    
2672 H HA2  . GLY B 182 ? 0.540 0.618 0.644 0.031  0.015  0.019  182 GLY HHH HA2  
2673 H HA3  . GLY B 182 ? 0.558 0.626 0.670 0.038  0.036  0.019  182 GLY HHH HA3  
2674 N N    . LEU B 183 ? 0.540 0.590 0.624 0.042  0.017  0.017  183 LEU HHH N    
2675 C CA   . LEU B 183 ? 0.531 0.578 0.622 0.047  0.011  0.018  183 LEU HHH CA   
2676 C C    . LEU B 183 ? 0.511 0.557 0.586 0.042  -0.005 0.019  183 LEU HHH C    
2677 O O    . LEU B 183 ? 0.510 0.551 0.564 0.035  -0.009 0.017  183 LEU HHH O    
2678 C CB   . LEU B 183 ? 0.554 0.578 0.628 0.053  0.025  0.016  183 LEU HHH CB   
2679 C CG   . LEU B 183 ? 0.569 0.592 0.665 0.062  0.044  0.017  183 LEU HHH CG   
2680 C CD1  . LEU B 183 ? 0.598 0.590 0.666 0.068  0.058  0.014  183 LEU HHH CD1  
2681 C CD2  . LEU B 183 ? 0.558 0.601 0.699 0.067  0.039  0.022  183 LEU HHH CD2  
2682 H H    . LEU B 183 ? 0.548 0.586 0.609 0.040  0.019  0.015  183 LEU HHH H    
2683 H HA   . LEU B 183 ? 0.525 0.584 0.643 0.050  0.009  0.021  183 LEU HHH HA   
2684 H HB2  . LEU B 183 ? 0.564 0.575 0.612 0.050  0.027  0.013  183 LEU HHH HB2  
2685 H HB3  . LEU B 183 ? 0.557 0.577 0.628 0.055  0.019  0.016  183 LEU HHH HB3  
2686 H HG   . LEU B 183 ? 0.568 0.593 0.665 0.060  0.052  0.017  183 LEU HHH HG   
2687 H HD11 . LEU B 183 ? 0.609 0.587 0.646 0.064  0.058  0.010  183 LEU HHH HD11 
2688 H HD12 . LEU B 183 ? 0.609 0.599 0.690 0.074  0.074  0.015  183 LEU HHH HD12 
2689 H HD13 . LEU B 183 ? 0.600 0.589 0.667 0.069  0.052  0.014  183 LEU HHH HD13 
2690 H HD21 . LEU B 183 ? 0.554 0.597 0.692 0.067  0.027  0.023  183 LEU HHH HD21 
2691 H HD22 . LEU B 183 ? 0.569 0.607 0.723 0.074  0.052  0.023  183 LEU HHH HD22 
2692 H HD23 . LEU B 183 ? 0.544 0.603 0.705 0.065  0.034  0.024  183 LEU HHH HD23 
2693 N N    . TYR B 184 ? 0.492 0.540 0.577 0.045  -0.015 0.021  184 TYR HHH N    
2694 C CA   . TYR B 184 ? 0.473 0.517 0.543 0.041  -0.028 0.023  184 TYR HHH CA   
2695 C C    . TYR B 184 ? 0.469 0.496 0.524 0.043  -0.026 0.022  184 TYR HHH C    
2696 O O    . TYR B 184 ? 0.478 0.500 0.542 0.050  -0.021 0.022  184 TYR HHH O    
2697 C CB   . TYR B 184 ? 0.471 0.524 0.556 0.042  -0.041 0.027  184 TYR HHH CB   
2698 C CG   . TYR B 184 ? 0.469 0.535 0.562 0.038  -0.046 0.027  184 TYR HHH CG   
2699 C CD1  . TYR B 184 ? 0.465 0.529 0.539 0.031  -0.050 0.027  184 TYR HHH CD1  
2700 C CD2  . TYR B 184 ? 0.464 0.544 0.587 0.040  -0.044 0.028  184 TYR HHH CD2  
2701 C CE1  . TYR B 184 ? 0.455 0.528 0.535 0.027  -0.054 0.027  184 TYR HHH CE1  
2702 C CE2  . TYR B 184 ? 0.457 0.549 0.588 0.035  -0.049 0.028  184 TYR HHH CE2  
2703 C CZ   . TYR B 184 ? 0.454 0.540 0.560 0.028  -0.055 0.027  184 TYR HHH CZ   
2704 O OH   . TYR B 184 ? 0.464 0.558 0.576 0.023  -0.059 0.027  184 TYR HHH OH   
2705 H H    . TYR B 184 ? 0.495 0.546 0.597 0.050  -0.013 0.023  184 TYR HHH H    
2706 H HA   . TYR B 184 ? 0.468 0.512 0.527 0.035  -0.029 0.022  184 TYR HHH HA   
2707 H HB2  . TYR B 184 ? 0.477 0.533 0.579 0.048  -0.040 0.029  184 TYR HHH HB2  
2708 H HB3  . TYR B 184 ? 0.477 0.523 0.549 0.041  -0.047 0.028  184 TYR HHH HB3  
2709 H HD1  . TYR B 184 ? 0.468 0.523 0.527 0.029  -0.050 0.027  184 TYR HHH HD1  
2710 H HD2  . TYR B 184 ? 0.468 0.551 0.608 0.045  -0.039 0.029  184 TYR HHH HD2  
2711 H HE1  . TYR B 184 ? 0.456 0.525 0.521 0.023  -0.056 0.027  184 TYR HHH HE1  
2712 H HE2  . TYR B 184 ? 0.453 0.554 0.607 0.036  -0.049 0.029  184 TYR HHH HE2  
2714 N N    . THR B 185 ? 0.460 0.477 0.495 0.038  -0.031 0.022  185 THR HHH N    
2715 C CA   . THR B 185 ? 0.469 0.471 0.492 0.038  -0.032 0.022  185 THR HHH CA   
2716 C C    . THR B 185 ? 0.463 0.463 0.480 0.034  -0.040 0.026  185 THR HHH C    
2717 O O    . THR B 185 ? 0.457 0.462 0.471 0.028  -0.041 0.026  185 THR HHH O    
2718 C CB   . THR B 185 ? 0.480 0.467 0.486 0.034  -0.028 0.018  185 THR HHH CB   
2719 O OG1  . THR B 185 ? 0.495 0.477 0.499 0.039  -0.019 0.014  185 THR HHH OG1  
2720 C CG2  . THR B 185 ? 0.493 0.463 0.489 0.033  -0.031 0.018  185 THR HHH CG2  
2721 H H    . THR B 185 ? 0.454 0.476 0.486 0.033  -0.033 0.022  185 THR HHH H    
2722 H HA   . THR B 185 ? 0.477 0.475 0.505 0.044  -0.031 0.023  185 THR HHH HA   
2723 H HB   . THR B 185 ? 0.473 0.464 0.476 0.029  -0.030 0.017  185 THR HHH HB   
2725 H HG21 . THR B 185 ? 0.488 0.459 0.483 0.028  -0.035 0.020  185 THR HHH HG21 
2726 H HG22 . THR B 185 ? 0.505 0.462 0.490 0.032  -0.029 0.014  185 THR HHH HG22 
2727 H HG23 . THR B 185 ? 0.498 0.466 0.498 0.037  -0.031 0.019  185 THR HHH HG23 
2728 N N    . MET B 186 ? 0.468 0.458 0.483 0.038  -0.043 0.029  186 MET HHH N    
2729 C CA   . MET B 186 ? 0.475 0.456 0.478 0.035  -0.047 0.034  186 MET HHH CA   
2730 C C    . MET B 186 ? 0.485 0.449 0.482 0.037  -0.045 0.035  186 MET HHH C    
2731 O O    . MET B 186 ? 0.491 0.450 0.491 0.042  -0.043 0.033  186 MET HHH O    
2732 C CB   . MET B 186 ? 0.484 0.467 0.486 0.039  -0.055 0.038  186 MET HHH CB   
2733 C CG   . MET B 186 ? 0.499 0.480 0.510 0.047  -0.061 0.040  186 MET HHH CG   
2734 S SD   . MET B 186 ? 0.517 0.475 0.513 0.051  -0.063 0.045  186 MET HHH SD   
2735 C CE   . MET B 186 ? 0.533 0.477 0.503 0.049  -0.070 0.050  186 MET HHH CE   
2736 H H    . MET B 186 ? 0.476 0.463 0.496 0.043  -0.042 0.029  186 MET HHH H    
2737 H HA   . MET B 186 ? 0.469 0.452 0.469 0.030  -0.045 0.033  186 MET HHH HA   
2738 H HB2  . MET B 186 ? 0.492 0.465 0.481 0.037  -0.055 0.041  186 MET HHH HB2  
2739 H HB3  . MET B 186 ? 0.475 0.469 0.482 0.037  -0.056 0.037  186 MET HHH HB3  
2740 H HG2  . MET B 186 ? 0.496 0.483 0.511 0.048  -0.068 0.042  186 MET HHH HG2  
2741 H HG3  . MET B 186 ? 0.492 0.479 0.515 0.050  -0.057 0.037  186 MET HHH HG3  
2742 H HE1  . MET B 186 ? 0.549 0.479 0.509 0.052  -0.072 0.054  186 MET HHH HE1  
2743 H HE2  . MET B 186 ? 0.528 0.472 0.492 0.044  -0.063 0.050  186 MET HHH HE2  
2744 H HE3  . MET B 186 ? 0.531 0.482 0.505 0.050  -0.077 0.050  186 MET HHH HE3  
2745 N N    . SER B 187 ? 0.485 0.438 0.471 0.034  -0.044 0.039  187 SER HHH N    
2746 C CA   . SER B 187 ? 0.495 0.430 0.476 0.034  -0.042 0.042  187 SER HHH CA   
2747 C C    . SER B 187 ? 0.504 0.425 0.471 0.037  -0.042 0.049  187 SER HHH C    
2748 O O    . SER B 187 ? 0.511 0.434 0.470 0.035  -0.043 0.051  187 SER HHH O    
2749 C CB   . SER B 187 ? 0.494 0.424 0.478 0.026  -0.038 0.040  187 SER HHH CB   
2750 O OG   . SER B 187 ? 0.495 0.425 0.482 0.025  -0.039 0.034  187 SER HHH OG   
2751 H H    . SER B 187 ? 0.483 0.437 0.466 0.031  -0.044 0.041  187 SER HHH H    
2752 H HA   . SER B 187 ? 0.500 0.432 0.483 0.038  -0.042 0.040  187 SER HHH HA   
2753 H HB2  . SER B 187 ? 0.485 0.423 0.472 0.022  -0.037 0.041  187 SER HHH HB2  
2754 H HB3  . SER B 187 ? 0.505 0.423 0.486 0.025  -0.035 0.044  187 SER HHH HB3  
2756 N N    . SER B 188 ? 0.519 0.423 0.479 0.041  -0.042 0.052  188 SER HHH N    
2757 C CA   . SER B 188 ? 0.541 0.425 0.483 0.043  -0.041 0.059  188 SER HHH CA   
2758 C C    . SER B 188 ? 0.552 0.419 0.494 0.041  -0.034 0.061  188 SER HHH C    
2759 O O    . SER B 188 ? 0.547 0.415 0.499 0.042  -0.035 0.057  188 SER HHH O    
2760 C CB   . SER B 188 ? 0.555 0.434 0.488 0.052  -0.052 0.062  188 SER HHH CB   
2761 O OG   . SER B 188 ? 0.583 0.436 0.490 0.055  -0.052 0.069  188 SER HHH OG   
2762 H H    . SER B 188 ? 0.521 0.424 0.487 0.042  -0.042 0.050  188 SER HHH H    
2763 H HA   . SER B 188 ? 0.541 0.424 0.476 0.040  -0.037 0.061  188 SER HHH HA   
2764 H HB2  . SER B 188 ? 0.545 0.436 0.483 0.053  -0.057 0.060  188 SER HHH HB2  
2765 H HB3  . SER B 188 ? 0.555 0.435 0.497 0.056  -0.054 0.060  188 SER HHH HB3  
2767 N N    . SER B 189 ? 0.569 0.420 0.500 0.037  -0.025 0.067  189 SER HHH N    
2768 C CA   . SER B 189 ? 0.584 0.416 0.517 0.035  -0.016 0.071  189 SER HHH CA   
2769 C C    . SER B 189 ? 0.618 0.423 0.525 0.040  -0.011 0.080  189 SER HHH C    
2770 O O    . SER B 189 ? 0.628 0.427 0.514 0.043  -0.012 0.083  189 SER HHH O    
2771 C CB   . SER B 189 ? 0.571 0.409 0.524 0.025  -0.007 0.071  189 SER HHH CB   
2772 O OG   . SER B 189 ? 0.577 0.408 0.521 0.023  0.003  0.077  189 SER HHH OG   
2773 H H    . SER B 189 ? 0.572 0.420 0.494 0.037  -0.022 0.070  189 SER HHH H    
2774 H HA   . SER B 189 ? 0.583 0.416 0.523 0.036  -0.020 0.068  189 SER HHH HA   
2775 H HB2  . SER B 189 ? 0.579 0.407 0.539 0.022  -0.004 0.073  189 SER HHH HB2  
2776 H HB3  . SER B 189 ? 0.554 0.407 0.518 0.022  -0.012 0.066  189 SER HHH HB3  
2778 N N    . VAL B 190 ? 0.638 0.425 0.544 0.041  -0.007 0.083  190 VAL HHH N    
2779 C CA   . VAL B 190 ? 0.674 0.428 0.553 0.046  -0.000 0.093  190 VAL HHH CA   
2780 C C    . VAL B 190 ? 0.687 0.428 0.579 0.039  0.014  0.097  190 VAL HHH C    
2781 O O    . VAL B 190 ? 0.678 0.425 0.591 0.036  0.011  0.092  190 VAL HHH O    
2782 C CB   . VAL B 190 ? 0.690 0.434 0.553 0.056  -0.013 0.094  190 VAL HHH CB   
2783 C CG1  . VAL B 190 ? 0.672 0.429 0.559 0.057  -0.020 0.087  190 VAL HHH CG1  
2784 C CG2  . VAL B 190 ? 0.732 0.439 0.566 0.061  -0.007 0.103  190 VAL HHH CG2  
2785 H H    . VAL B 190 ? 0.631 0.421 0.551 0.039  -0.008 0.080  190 VAL HHH H    
2786 H HA   . VAL B 190 ? 0.684 0.432 0.547 0.046  0.004  0.096  190 VAL HHH HA   
2787 H HB   . VAL B 190 ? 0.687 0.438 0.543 0.060  -0.022 0.092  190 VAL HHH HB   
2788 H HG11 . VAL B 190 ? 0.651 0.428 0.551 0.056  -0.024 0.081  190 VAL HHH HG11 
2789 H HG12 . VAL B 190 ? 0.686 0.434 0.565 0.064  -0.026 0.089  190 VAL HHH HG12 
2790 H HG13 . VAL B 190 ? 0.674 0.425 0.570 0.053  -0.012 0.087  190 VAL HHH HG13 
2791 H HG21 . VAL B 190 ? 0.736 0.436 0.578 0.059  -0.001 0.104  190 VAL HHH HG21 
2792 H HG22 . VAL B 190 ? 0.744 0.445 0.564 0.068  -0.018 0.105  190 VAL HHH HG22 
2793 H HG23 . VAL B 190 ? 0.745 0.440 0.563 0.059  0.002  0.107  190 VAL HHH HG23 
2794 N N    . THR B 191 ? 0.710 0.430 0.590 0.037  0.031  0.105  191 THR HHH N    
2795 C CA   . THR B 191 ? 0.729 0.432 0.624 0.031  0.048  0.111  191 THR HHH CA   
2796 C C    . THR B 191 ? 0.778 0.445 0.641 0.039  0.054  0.120  191 THR HHH C    
2797 O O    . THR B 191 ? 0.808 0.452 0.632 0.045  0.058  0.125  191 THR HHH O    
2798 C CB   . THR B 191 ? 0.724 0.429 0.633 0.024  0.066  0.116  191 THR HHH CB   
2799 O OG1  . THR B 191 ? 0.682 0.420 0.626 0.017  0.057  0.108  191 THR HHH OG1  
2800 C CG2  . THR B 191 ? 0.743 0.429 0.671 0.019  0.086  0.124  191 THR HHH CG2  
2801 H H    . THR B 191 ? 0.721 0.434 0.582 0.039  0.034  0.108  191 THR HHH H    
2802 H HA   . THR B 191 ? 0.714 0.429 0.632 0.027  0.042  0.107  191 THR HHH HA   
2803 H HB   . THR B 191 ? 0.737 0.432 0.622 0.028  0.070  0.119  191 THR HHH HB   
2805 H HG21 . THR B 191 ? 0.773 0.433 0.673 0.023  0.097  0.131  191 THR HHH HG21 
2806 H HG22 . THR B 191 ? 0.733 0.428 0.684 0.013  0.095  0.126  191 THR HHH HG22 
2807 H HG23 . THR B 191 ? 0.740 0.427 0.682 0.016  0.080  0.122  191 THR HHH HG23 
2808 N N    . VAL B 192 ? 0.791 0.450 0.667 0.038  0.053  0.120  192 VAL HHH N    
2809 C CA   . VAL B 192 ? 0.833 0.458 0.682 0.045  0.057  0.128  192 VAL HHH CA   
2810 C C    . VAL B 192 ? 0.851 0.460 0.722 0.037  0.076  0.134  192 VAL HHH C    
2811 O O    . VAL B 192 ? 0.827 0.456 0.739 0.026  0.079  0.130  192 VAL HHH O    
2812 C CB   . VAL B 192 ? 0.832 0.460 0.677 0.052  0.038  0.123  192 VAL HHH CB   
2813 C CG1  . VAL B 192 ? 0.821 0.467 0.654 0.059  0.020  0.117  192 VAL HHH CG1  
2814 C CG2  . VAL B 192 ? 0.810 0.454 0.691 0.045  0.034  0.115  192 VAL HHH CG2  
2815 H H    . VAL B 192 ? 0.772 0.445 0.673 0.033  0.049  0.115  192 VAL HHH H    
2816 H HA   . VAL B 192 ? 0.856 0.464 0.676 0.049  0.061  0.133  192 VAL HHH HA   
2817 H HB   . VAL B 192 ? 0.861 0.464 0.686 0.057  0.041  0.129  192 VAL HHH HB   
2818 H HG11 . VAL B 192 ? 0.836 0.471 0.646 0.062  0.022  0.121  192 VAL HHH HG11 
2819 H HG12 . VAL B 192 ? 0.824 0.468 0.655 0.065  0.010  0.116  192 VAL HHH HG12 
2820 H HG13 . VAL B 192 ? 0.792 0.462 0.646 0.055  0.017  0.111  192 VAL HHH HG13 
2821 H HG21 . VAL B 192 ? 0.788 0.450 0.690 0.039  0.034  0.111  192 VAL HHH HG21 
2822 H HG22 . VAL B 192 ? 0.804 0.454 0.684 0.051  0.022  0.110  192 VAL HHH HG22 
2823 H HG23 . VAL B 192 ? 0.826 0.453 0.711 0.043  0.042  0.119  192 VAL HHH HG23 
2824 N N    . PRO B 193 ? 0.894 0.467 0.741 0.041  0.088  0.144  193 PRO HHH N    
2825 C CA   . PRO B 193 ? 0.907 0.464 0.778 0.034  0.104  0.149  193 PRO HHH CA   
2826 C C    . PRO B 193 ? 0.881 0.454 0.783 0.030  0.089  0.141  193 PRO HHH C    
2827 O O    . PRO B 193 ? 0.877 0.451 0.763 0.038  0.072  0.135  193 PRO HHH O    
2828 C CB   . PRO B 193 ? 0.964 0.476 0.793 0.042  0.118  0.161  193 PRO HHH CB   
2829 C CG   . PRO B 193 ? 0.981 0.483 0.760 0.053  0.110  0.162  193 PRO HHH CG   
2830 C CD   . PRO B 193 ? 0.936 0.478 0.730 0.053  0.086  0.150  193 PRO HHH CD   
2831 H HA   . PRO B 193 ? 0.900 0.464 0.793 0.027  0.117  0.151  193 PRO HHH HA   
2832 H HB2  . PRO B 193 ? 0.970 0.475 0.797 0.045  0.111  0.161  193 PRO HHH HB2  
2833 H HB3  . PRO B 193 ? 0.979 0.476 0.814 0.038  0.138  0.168  193 PRO HHH HB3  
2834 H HG2  . PRO B 193 ? 1.009 0.487 0.758 0.060  0.106  0.167  193 PRO HHH HG2  
2835 H HG3  . PRO B 193 ? 0.994 0.485 0.761 0.052  0.125  0.167  193 PRO HHH HG3  
2836 H HD2  . PRO B 193 ? 0.935 0.478 0.723 0.058  0.071  0.147  193 PRO HHH HD2  
2837 H HD3  . PRO B 193 ? 0.937 0.480 0.713 0.056  0.084  0.150  193 PRO HHH HD3  
2838 N N    . SER B 194 ? 0.866 0.448 0.812 0.018  0.094  0.140  194 SER HHH N    
2839 C CA   . SER B 194 ? 0.851 0.443 0.825 0.011  0.079  0.130  194 SER HHH CA   
2840 C C    . SER B 194 ? 0.885 0.450 0.842 0.017  0.078  0.133  194 SER HHH C    
2841 O O    . SER B 194 ? 0.880 0.449 0.849 0.016  0.063  0.124  194 SER HHH O    
2842 C CB   . SER B 194 ? 0.835 0.438 0.860 -0.003 0.084  0.131  194 SER HHH CB   
2843 O OG   . SER B 194 ? 0.821 0.434 0.866 -0.009 0.064  0.120  194 SER HHH OG   
2844 H H    . SER B 194 ? 0.871 0.450 0.832 0.012  0.108  0.145  194 SER HHH H    
2845 H HA   . SER B 194 ? 0.831 0.442 0.803 0.014  0.065  0.122  194 SER HHH HA   
2846 H HB2  . SER B 194 ? 0.822 0.439 0.856 -0.006 0.087  0.131  194 SER HHH HB2  
2847 H HB3  . SER B 194 ? 0.856 0.441 0.888 -0.006 0.098  0.138  194 SER HHH HB3  
2849 N N    . SER B 195 ? 0.923 0.458 0.851 0.024  0.092  0.144  195 SER HHH N    
2850 C CA   . SER B 195 ? 0.952 0.457 0.856 0.032  0.092  0.148  195 SER HHH CA   
2851 C C    . SER B 195 ? 0.950 0.461 0.826 0.045  0.072  0.142  195 SER HHH C    
2852 O O    . SER B 195 ? 0.962 0.463 0.836 0.050  0.064  0.139  195 SER HHH O    
2853 C CB   . SER B 195 ? 0.990 0.458 0.868 0.036  0.114  0.163  195 SER HHH CB   
2854 O OG   . SER B 195 ? 0.996 0.464 0.852 0.039  0.123  0.168  195 SER HHH OG   
2855 H H    . SER B 195 ? 0.932 0.459 0.850 0.025  0.105  0.151  195 SER HHH H    
2856 H HA   . SER B 195 ? 0.950 0.454 0.877 0.026  0.090  0.145  195 SER HHH HA   
2857 H HB2  . SER B 195 ? 1.013 0.463 0.866 0.044  0.111  0.166  195 SER HHH HB2  
2858 H HB3  . SER B 195 ? 0.999 0.459 0.900 0.028  0.127  0.167  195 SER HHH HB3  
2860 N N    . THR B 196 ? 0.937 0.464 0.795 0.051  0.065  0.140  196 THR HHH N    
2861 C CA   . THR B 196 ? 0.938 0.469 0.772 0.064  0.047  0.137  196 THR HHH CA   
2862 C C    . THR B 196 ? 0.902 0.467 0.761 0.063  0.031  0.124  196 THR HHH C    
2863 O O    . THR B 196 ? 0.896 0.467 0.745 0.074  0.017  0.121  196 THR HHH O    
2864 C CB   . THR B 196 ? 0.946 0.475 0.748 0.070  0.045  0.142  196 THR HHH CB   
2865 O OG1  . THR B 196 ? 0.908 0.471 0.727 0.065  0.040  0.134  196 THR HHH OG1  
2866 C CG2  . THR B 196 ? 0.982 0.478 0.758 0.069  0.066  0.154  196 THR HHH CG2  
2867 H H    . THR B 196 ? 0.927 0.464 0.790 0.047  0.070  0.141  196 THR HHH H    
2868 H HA   . THR B 196 ? 0.961 0.472 0.782 0.070  0.046  0.141  196 THR HHH HA   
2869 H HB   . THR B 196 ? 0.956 0.479 0.741 0.079  0.034  0.143  196 THR HHH HB   
2871 H HG21 . THR B 196 ? 1.004 0.479 0.777 0.069  0.074  0.159  196 THR HHH HG21 
2872 H HG22 . THR B 196 ? 1.000 0.484 0.745 0.076  0.062  0.158  196 THR HHH HG22 
2873 H HG23 . THR B 196 ? 0.969 0.475 0.762 0.061  0.076  0.154  196 THR HHH HG23 
2874 N N    . TRP B 197 ? 0.880 0.462 0.770 0.051  0.032  0.116  197 TRP HHH N    
2875 C CA   . TRP B 197 ? 0.855 0.462 0.762 0.050  0.018  0.104  197 TRP HHH CA   
2876 C C    . TRP B 197 ? 0.855 0.459 0.788 0.038  0.019  0.098  197 TRP HHH C    
2877 O O    . TRP B 197 ? 0.855 0.460 0.807 0.027  0.027  0.101  197 TRP HHH O    
2878 C CB   . TRP B 197 ? 0.825 0.461 0.736 0.049  0.013  0.099  197 TRP HHH CB   
2879 C CG   . TRP B 197 ? 0.802 0.459 0.724 0.050  0.001  0.087  197 TRP HHH CG   
2880 C CD1  . TRP B 197 ? 0.796 0.461 0.710 0.061  -0.008 0.084  197 TRP HHH CD1  
2881 C CD2  . TRP B 197 ? 0.786 0.454 0.727 0.040  -0.003 0.078  197 TRP HHH CD2  
2882 N NE1  . TRP B 197 ? 0.775 0.455 0.700 0.059  -0.013 0.073  197 TRP HHH NE1  
2883 C CE2  . TRP B 197 ? 0.772 0.452 0.710 0.047  -0.012 0.069  197 TRP HHH CE2  
2884 C CE3  . TRP B 197 ? 0.782 0.449 0.744 0.027  -0.001 0.077  197 TRP HHH CE3  
2885 C CZ2  . TRP B 197 ? 0.766 0.452 0.712 0.040  -0.017 0.059  197 TRP HHH CZ2  
2886 C CZ3  . TRP B 197 ? 0.770 0.446 0.743 0.020  -0.010 0.067  197 TRP HHH CZ3  
2887 C CH2  . TRP B 197 ? 0.766 0.449 0.727 0.027  -0.018 0.058  197 TRP HHH CH2  
2888 H H    . TRP B 197 ? 0.881 0.460 0.783 0.044  0.041  0.119  197 TRP HHH H    
2889 H HA   . TRP B 197 ? 0.862 0.464 0.760 0.059  0.012  0.102  197 TRP HHH HA   
2890 H HB2  . TRP B 197 ? 0.830 0.465 0.724 0.056  0.011  0.103  197 TRP HHH HB2  
2891 H HB3  . TRP B 197 ? 0.817 0.459 0.739 0.041  0.018  0.100  197 TRP HHH HB3  
2892 H HD1  . TRP B 197 ? 0.805 0.466 0.708 0.069  -0.010 0.088  197 TRP HHH HD1  
2893 H HE1  . TRP B 197 ? 0.773 0.459 0.697 0.065  -0.017 0.070  197 TRP HHH HE1  
2894 H HE3  . TRP B 197 ? 0.790 0.449 0.757 0.023  0.007  0.083  197 TRP HHH HE3  
2895 H HZ2  . TRP B 197 ? 0.761 0.453 0.704 0.045  -0.021 0.053  197 TRP HHH HZ2  
2896 H HZ3  . TRP B 197 ? 0.770 0.445 0.759 0.011  -0.012 0.066  197 TRP HHH HZ3  
2897 H HH2  . TRP B 197 ? 0.762 0.447 0.727 0.022  -0.024 0.051  197 TRP HHH HH2  
2898 N N    . PRO B 198 ? 0.862 0.461 0.797 0.040  0.010  0.089  198 PRO HHH N    
2899 C CA   . PRO B 198 ? 0.863 0.464 0.783 0.053  0.003  0.085  198 PRO HHH CA   
2900 C C    . PRO B 198 ? 0.889 0.465 0.793 0.065  0.005  0.092  198 PRO HHH C    
2901 O O    . PRO B 198 ? 0.891 0.468 0.789 0.076  -0.000 0.089  198 PRO HHH O    
2902 C CB   . PRO B 198 ? 0.861 0.463 0.790 0.049  -0.004 0.073  198 PRO HHH CB   
2903 C CG   . PRO B 198 ? 0.878 0.459 0.819 0.037  -0.001 0.074  198 PRO HHH CG   
2904 C CD   . PRO B 198 ? 0.870 0.459 0.824 0.029  0.007  0.083  198 PRO HHH CD   
2905 H HA   . PRO B 198 ? 0.848 0.466 0.764 0.057  -0.000 0.085  198 PRO HHH HA   
2906 H HB2  . PRO B 198 ? 0.871 0.464 0.792 0.057  -0.006 0.070  198 PRO HHH HB2  
2907 H HB3  . PRO B 198 ? 0.842 0.461 0.776 0.046  -0.008 0.068  198 PRO HHH HB3  
2908 H HG2  . PRO B 198 ? 0.898 0.460 0.834 0.040  0.002  0.076  198 PRO HHH HG2  
2909 H HG3  . PRO B 198 ? 0.874 0.457 0.822 0.030  -0.007 0.066  198 PRO HHH HG3  
2910 H HD2  . PRO B 198 ? 0.886 0.459 0.844 0.026  0.014  0.088  198 PRO HHH HD2  
2911 H HD3  . PRO B 198 ? 0.854 0.457 0.822 0.021  0.004  0.080  198 PRO HHH HD3  
2912 N N    . SER B 199 ? 0.911 0.464 0.810 0.062  0.015  0.102  199 SER HHH N    
2913 C CA   . SER B 199 ? 0.944 0.467 0.824 0.072  0.018  0.110  199 SER HHH CA   
2914 C C    . SER B 199 ? 0.948 0.476 0.811 0.087  0.009  0.114  199 SER HHH C    
2915 O O    . SER B 199 ? 0.960 0.476 0.818 0.098  0.005  0.114  199 SER HHH O    
2916 C CB   . SER B 199 ? 0.962 0.461 0.836 0.066  0.032  0.122  199 SER HHH CB   
2917 O OG   . SER B 199 ? 0.958 0.458 0.814 0.069  0.037  0.130  199 SER HHH OG   
2918 H H    . SER B 199 ? 0.910 0.462 0.817 0.054  0.021  0.105  199 SER HHH H    
2919 H HA   . SER B 199 ? 0.950 0.465 0.836 0.072  0.016  0.105  199 SER HHH HA   
2920 H HB2  . SER B 199 ? 0.986 0.463 0.850 0.072  0.034  0.126  199 SER HHH HB2  
2921 H HB3  . SER B 199 ? 0.957 0.457 0.849 0.056  0.037  0.120  199 SER HHH HB3  
2923 N N    . GLN B 200 ? 0.942 0.488 0.798 0.088  0.006  0.116  200 GLN HHH N    
2924 C CA   . GLN B 200 ? 0.946 0.500 0.789 0.101  -0.006 0.118  200 GLN HHH CA   
2925 C C    . GLN B 200 ? 0.911 0.501 0.772 0.099  -0.014 0.109  200 GLN HHH C    
2926 O O    . GLN B 200 ? 0.883 0.489 0.758 0.088  -0.009 0.102  200 GLN HHH O    
2927 C CB   . GLN B 200 ? 0.973 0.509 0.786 0.104  -0.005 0.130  200 GLN HHH CB   
2928 C CG   . GLN B 200 ? 1.022 0.517 0.812 0.108  0.003  0.141  200 GLN HHH CG   
2929 C CD   . GLN B 200 ? 1.043 0.527 0.832 0.121  -0.008 0.142  200 GLN HHH CD   
2930 O OE1  . GLN B 200 ? 1.039 0.541 0.836 0.130  -0.023 0.139  200 GLN HHH OE1  
2931 N NE2  . GLN B 200 ? 1.066 0.521 0.848 0.122  -0.000 0.147  200 GLN HHH NE2  
2932 H H    . GLN B 200 ? 0.931 0.484 0.790 0.080  0.011  0.116  200 GLN HHH H    
2933 H HA   . GLN B 200 ? 0.958 0.503 0.801 0.109  -0.010 0.119  200 GLN HHH HA   
2934 H HB2  . GLN B 200 ? 0.965 0.506 0.778 0.096  0.002  0.130  200 GLN HHH HB2  
2935 H HB3  . GLN B 200 ? 0.972 0.515 0.779 0.111  -0.015 0.131  200 GLN HHH HB3  
2936 H HG2  . GLN B 200 ? 1.024 0.512 0.822 0.100  0.014  0.140  200 GLN HHH HG2  
2937 H HG3  . GLN B 200 ? 1.041 0.522 0.807 0.110  0.004  0.148  200 GLN HHH HG3  
2940 N N    . THR B 201 ? 0.916 0.517 0.778 0.111  -0.026 0.109  201 THR HHH N    
2941 C CA   . THR B 201 ? 0.886 0.520 0.768 0.112  -0.033 0.101  201 THR HHH CA   
2942 C C    . THR B 201 ? 0.872 0.523 0.747 0.107  -0.037 0.102  201 THR HHH C    
2943 O O    . THR B 201 ? 0.885 0.522 0.738 0.111  -0.042 0.110  201 THR HHH O    
2944 C CB   . THR B 201 ? 0.894 0.533 0.787 0.126  -0.044 0.102  201 THR HHH CB   
2945 O OG1  . THR B 201 ? 0.913 0.530 0.808 0.132  -0.039 0.103  201 THR HHH OG1  
2946 C CG2  . THR B 201 ? 0.866 0.536 0.784 0.128  -0.046 0.093  201 THR HHH CG2  
2947 H H    . THR B 201 ? 0.933 0.522 0.785 0.119  -0.031 0.115  201 THR HHH H    
2948 H HA   . THR B 201 ? 0.874 0.515 0.768 0.107  -0.028 0.094  201 THR HHH HA   
2949 H HB   . THR B 201 ? 0.905 0.539 0.788 0.131  -0.052 0.109  201 THR HHH HB   
2951 H HG21 . THR B 201 ? 0.858 0.540 0.777 0.130  -0.054 0.096  201 THR HHH HG21 
2952 H HG22 . THR B 201 ? 0.870 0.539 0.801 0.136  -0.046 0.092  201 THR HHH HG22 
2953 H HG23 . THR B 201 ? 0.852 0.529 0.773 0.120  -0.040 0.087  201 THR HHH HG23 
2954 N N    . VAL B 202 ? 0.853 0.530 0.744 0.099  -0.034 0.093  202 VAL HHH N    
2955 C CA   . VAL B 202 ? 0.832 0.529 0.722 0.095  -0.038 0.092  202 VAL HHH CA   
2956 C C    . VAL B 202 ? 0.805 0.530 0.717 0.099  -0.045 0.085  202 VAL HHH C    
2957 O O    . VAL B 202 ? 0.791 0.524 0.717 0.096  -0.040 0.077  202 VAL HHH O    
2958 C CB   . VAL B 202 ? 0.817 0.518 0.707 0.081  -0.028 0.090  202 VAL HHH CB   
2959 C CG1  . VAL B 202 ? 0.798 0.521 0.689 0.078  -0.031 0.088  202 VAL HHH CG1  
2960 C CG2  . VAL B 202 ? 0.846 0.519 0.719 0.078  -0.017 0.099  202 VAL HHH CG2  
2961 H H    . VAL B 202 ? 0.842 0.522 0.743 0.095  -0.030 0.087  202 VAL HHH H    
2962 H HA   . VAL B 202 ? 0.845 0.534 0.720 0.099  -0.043 0.098  202 VAL HHH HA   
2963 H HB   . VAL B 202 ? 0.808 0.515 0.712 0.077  -0.025 0.084  202 VAL HHH HB   
2964 H HG11 . VAL B 202 ? 0.777 0.518 0.683 0.076  -0.032 0.081  202 VAL HHH HG11 
2965 H HG12 . VAL B 202 ? 0.798 0.517 0.685 0.071  -0.024 0.090  202 VAL HHH HG12 
2966 H HG13 . VAL B 202 ? 0.804 0.526 0.686 0.084  -0.038 0.091  202 VAL HHH HG13 
2967 H HG21 . VAL B 202 ? 0.858 0.523 0.714 0.081  -0.019 0.104  202 VAL HHH HG21 
2968 H HG22 . VAL B 202 ? 0.836 0.514 0.718 0.069  -0.010 0.097  202 VAL HHH HG22 
2969 H HG23 . VAL B 202 ? 0.860 0.519 0.732 0.080  -0.016 0.100  202 VAL HHH HG23 
2970 N N    . THR B 203 ? 0.807 0.543 0.720 0.105  -0.057 0.088  203 THR HHH N    
2971 C CA   . THR B 203 ? 0.788 0.551 0.727 0.110  -0.063 0.083  203 THR HHH CA   
2972 C C    . THR B 203 ? 0.775 0.555 0.712 0.107  -0.071 0.083  203 THR HHH C    
2973 O O    . THR B 203 ? 0.799 0.565 0.714 0.108  -0.079 0.090  203 THR HHH O    
2974 C CB   . THR B 203 ? 0.800 0.558 0.753 0.124  -0.072 0.087  203 THR HHH CB   
2975 O OG1  . THR B 203 ? 0.822 0.564 0.776 0.127  -0.063 0.086  203 THR HHH OG1  
2976 C CG2  . THR B 203 ? 0.779 0.564 0.764 0.130  -0.078 0.084  203 THR HHH CG2  
2977 H H    . THR B 203 ? 0.820 0.547 0.718 0.107  -0.062 0.093  203 THR HHH H    
2978 H HA   . THR B 203 ? 0.775 0.545 0.724 0.107  -0.056 0.077  203 THR HHH HA   
2979 H HB   . THR B 203 ? 0.819 0.566 0.758 0.127  -0.081 0.094  203 THR HHH HB   
2981 H HG21 . THR B 203 ? 0.778 0.570 0.763 0.130  -0.089 0.087  203 THR HHH HG21 
2982 H HG22 . THR B 203 ? 0.787 0.570 0.787 0.138  -0.078 0.086  203 THR HHH HG22 
2983 H HG23 . THR B 203 ? 0.762 0.559 0.754 0.125  -0.069 0.078  203 THR HHH HG23 
2984 N N    . CYS B 204 ? 0.748 0.553 0.703 0.103  -0.068 0.076  204 CYS HHH N    
2985 C CA   . CYS B 204 ? 0.734 0.558 0.693 0.100  -0.076 0.075  204 CYS HHH CA   
2986 C C    . CYS B 204 ? 0.714 0.557 0.704 0.109  -0.085 0.075  204 CYS HHH C    
2987 O O    . CYS B 204 ? 0.692 0.541 0.703 0.114  -0.077 0.071  204 CYS HHH O    
2988 C CB   . CYS B 204 ? 0.719 0.558 0.679 0.089  -0.066 0.068  204 CYS HHH CB   
2989 S SG   . CYS B 204 ? 0.710 0.576 0.700 0.090  -0.061 0.060  204 CYS HHH SG   
2990 H H    . CYS B 204 ? 0.739 0.550 0.705 0.102  -0.061 0.071  204 CYS HHH H    
2991 H HA   . CYS B 204 ? 0.747 0.560 0.688 0.100  -0.082 0.080  204 CYS HHH HA   
2992 H HB2  . CYS B 204 ? 0.719 0.560 0.670 0.086  -0.070 0.070  204 CYS HHH HB2  
2993 H HB3  . CYS B 204 ? 0.724 0.554 0.677 0.085  -0.059 0.068  204 CYS HHH HB3  
2994 N N    . SER B 205 ? 0.718 0.566 0.709 0.111  -0.101 0.079  205 SER HHH N    
2995 C CA   . SER B 205 ? 0.715 0.584 0.742 0.118  -0.113 0.080  205 SER HHH CA   
2996 C C    . SER B 205 ? 0.690 0.581 0.724 0.110  -0.114 0.076  205 SER HHH C    
2997 O O    . SER B 205 ? 0.696 0.578 0.701 0.105  -0.121 0.077  205 SER HHH O    
2998 C CB   . SER B 205 ? 0.746 0.602 0.771 0.126  -0.135 0.089  205 SER HHH CB   
2999 O OG   . SER B 205 ? 0.774 0.604 0.783 0.132  -0.134 0.094  205 SER HHH OG   
3000 H H    . SER B 205 ? 0.730 0.568 0.700 0.109  -0.107 0.082  205 SER HHH H    
3001 H HA   . SER B 205 ? 0.707 0.584 0.756 0.122  -0.105 0.078  205 SER HHH HA   
3002 H HB2  . SER B 205 ? 0.754 0.603 0.758 0.122  -0.144 0.090  205 SER HHH HB2  
3003 H HB3  . SER B 205 ? 0.739 0.610 0.796 0.131  -0.143 0.090  205 SER HHH HB3  
3005 N N    . VAL B 206 ? 0.666 0.580 0.732 0.111  -0.106 0.071  206 VAL HHH N    
3006 C CA   . VAL B 206 ? 0.647 0.582 0.721 0.104  -0.104 0.066  206 VAL HHH CA   
3007 C C    . VAL B 206 ? 0.639 0.594 0.754 0.109  -0.117 0.069  206 VAL HHH C    
3008 O O    . VAL B 206 ? 0.640 0.605 0.791 0.116  -0.109 0.069  206 VAL HHH O    
3009 C CB   . VAL B 206 ? 0.631 0.575 0.708 0.099  -0.083 0.059  206 VAL HHH CB   
3010 C CG1  . VAL B 206 ? 0.612 0.577 0.698 0.092  -0.082 0.055  206 VAL HHH CG1  
3011 C CG2  . VAL B 206 ? 0.638 0.564 0.682 0.093  -0.074 0.056  206 VAL HHH CG2  
3012 H H    . VAL B 206 ? 0.666 0.584 0.751 0.116  -0.099 0.070  206 VAL HHH H    
3013 H HA   . VAL B 206 ? 0.650 0.578 0.702 0.099  -0.109 0.067  206 VAL HHH HA   
3014 H HB   . VAL B 206 ? 0.632 0.579 0.728 0.105  -0.077 0.058  206 VAL HHH HB   
3015 H HG11 . VAL B 206 ? 0.606 0.583 0.719 0.096  -0.082 0.055  206 VAL HHH HG11 
3016 H HG12 . VAL B 206 ? 0.604 0.568 0.681 0.088  -0.071 0.050  206 VAL HHH HG12 
3017 H HG13 . VAL B 206 ? 0.613 0.576 0.687 0.089  -0.091 0.057  206 VAL HHH HG13 
3018 H HG21 . VAL B 206 ? 0.641 0.561 0.668 0.088  -0.079 0.058  206 VAL HHH HG21 
3019 H HG22 . VAL B 206 ? 0.628 0.558 0.671 0.089  -0.064 0.051  206 VAL HHH HG22 
3020 H HG23 . VAL B 206 ? 0.651 0.564 0.692 0.097  -0.072 0.058  206 VAL HHH HG23 
3021 N N    . ALA B 207 ? 0.640 0.596 0.749 0.106  -0.135 0.071  207 ALA HHH N    
3022 C CA   . ALA B 207 ? 0.635 0.609 0.783 0.109  -0.152 0.074  207 ALA HHH CA   
3023 C C    . ALA B 207 ? 0.610 0.607 0.774 0.101  -0.143 0.069  207 ALA HHH C    
3024 O O    . ALA B 207 ? 0.603 0.594 0.733 0.093  -0.139 0.065  207 ALA HHH O    
3025 C CB   . ALA B 207 ? 0.664 0.620 0.791 0.109  -0.180 0.080  207 ALA HHH CB   
3026 H H    . ALA B 207 ? 0.647 0.592 0.727 0.101  -0.138 0.071  207 ALA HHH H    
3027 H HA   . ALA B 207 ? 0.636 0.617 0.815 0.116  -0.151 0.077  207 ALA HHH HA   
3028 H HB1  . ALA B 207 ? 0.667 0.631 0.823 0.113  -0.194 0.083  207 ALA HHH HB1  
3029 H HB2  . ALA B 207 ? 0.682 0.618 0.785 0.112  -0.182 0.083  207 ALA HHH HB2  
3030 H HB3  . ALA B 207 ? 0.663 0.615 0.767 0.103  -0.182 0.078  207 ALA HHH HB3  
3031 N N    . HIS B 208 ? 0.597 0.616 0.811 0.105  -0.138 0.069  208 HIS HHH N    
3032 C CA   . HIS B 208 ? 0.583 0.624 0.819 0.099  -0.130 0.065  208 HIS HHH CA   
3033 C C    . HIS B 208 ? 0.599 0.658 0.888 0.103  -0.148 0.070  208 HIS HHH C    
3034 O O    . HIS B 208 ? 0.605 0.680 0.943 0.109  -0.137 0.072  208 HIS HHH O    
3035 C CB   . HIS B 208 ? 0.560 0.609 0.804 0.100  -0.100 0.060  208 HIS HHH CB   
3036 C CG   . HIS B 208 ? 0.534 0.600 0.791 0.094  -0.090 0.056  208 HIS HHH CG   
3037 N ND1  . HIS B 208 ? 0.524 0.591 0.756 0.084  -0.098 0.054  208 HIS HHH ND1  
3038 C CD2  . HIS B 208 ? 0.519 0.600 0.809 0.096  -0.071 0.055  208 HIS HHH CD2  
3039 C CE1  . HIS B 208 ? 0.504 0.587 0.755 0.081  -0.086 0.051  208 HIS HHH CE1  
3040 N NE2  . HIS B 208 ? 0.504 0.594 0.789 0.088  -0.069 0.052  208 HIS HHH NE2  
3041 H H    . HIS B 208 ? 0.602 0.625 0.842 0.112  -0.138 0.072  208 HIS HHH H    
3042 H HA   . HIS B 208 ? 0.581 0.618 0.790 0.093  -0.134 0.063  208 HIS HHH HA   
3043 H HB2  . HIS B 208 ? 0.563 0.599 0.775 0.098  -0.093 0.057  208 HIS HHH HB2  
3044 H HB3  . HIS B 208 ? 0.564 0.616 0.834 0.107  -0.094 0.062  208 HIS HHH HB3  
3046 H HD2  . HIS B 208 ? 0.524 0.606 0.835 0.103  -0.060 0.056  208 HIS HHH HD2  
3047 H HE1  . HIS B 208 ? 0.499 0.585 0.740 0.075  -0.088 0.049  208 HIS HHH HE1  
3049 N N    . PRO B 209 ? 0.623 0.677 0.903 0.098  -0.175 0.073  209 PRO HHH N    
3050 C CA   . PRO B 209 ? 0.626 0.693 0.956 0.102  -0.200 0.078  209 PRO HHH CA   
3051 C C    . PRO B 209 ? 0.599 0.695 0.990 0.101  -0.187 0.078  209 PRO HHH C    
3052 O O    . PRO B 209 ? 0.601 0.712 1.051 0.107  -0.195 0.084  209 PRO HHH O    
3053 C CB   . PRO B 209 ? 0.650 0.699 0.943 0.094  -0.228 0.078  209 PRO HHH CB   
3054 C CG   . PRO B 209 ? 0.664 0.686 0.886 0.091  -0.219 0.075  209 PRO HHH CG   
3055 C CD   . PRO B 209 ? 0.635 0.668 0.856 0.091  -0.184 0.070  209 PRO HHH CD   
3056 H HA   . PRO B 209 ? 0.639 0.701 0.983 0.109  -0.208 0.083  209 PRO HHH HA   
3057 H HB2  . PRO B 209 ? 0.638 0.699 0.940 0.088  -0.228 0.076  209 PRO HHH HB2  
3058 H HB3  . PRO B 209 ? 0.668 0.711 0.972 0.097  -0.251 0.083  209 PRO HHH HB3  
3059 H HG2  . PRO B 209 ? 0.669 0.682 0.863 0.085  -0.226 0.073  209 PRO HHH HG2  
3060 H HG3  . PRO B 209 ? 0.682 0.688 0.889 0.096  -0.228 0.079  209 PRO HHH HG3  
3061 H HD2  . PRO B 209 ? 0.622 0.663 0.837 0.084  -0.176 0.066  209 PRO HHH HD2  
3062 H HD3  . PRO B 209 ? 0.643 0.662 0.833 0.091  -0.178 0.070  209 PRO HHH HD3  
3063 N N    . ALA B 210 ? 0.575 0.680 0.952 0.093  -0.167 0.072  210 ALA HHH N    
3064 C CA   . ALA B 210 ? 0.547 0.676 0.972 0.091  -0.152 0.071  210 ALA HHH CA   
3065 C C    . ALA B 210 ? 0.534 0.675 1.006 0.101  -0.127 0.074  210 ALA HHH C    
3066 O O    . ALA B 210 ? 0.519 0.680 1.051 0.103  -0.121 0.077  210 ALA HHH O    
3067 C CB   . ALA B 210 ? 0.531 0.660 0.919 0.083  -0.134 0.064  210 ALA HHH CB   
3068 H H    . ALA B 210 ? 0.573 0.668 0.909 0.089  -0.162 0.068  210 ALA HHH H    
3069 H HA   . ALA B 210 ? 0.549 0.687 1.002 0.090  -0.170 0.074  210 ALA HHH HA   
3070 H HB1  . ALA B 210 ? 0.521 0.664 0.938 0.081  -0.123 0.064  210 ALA HHH HB1  
3071 H HB2  . ALA B 210 ? 0.536 0.658 0.897 0.077  -0.148 0.062  210 ALA HHH HB2  
3072 H HB3  . ALA B 210 ? 0.531 0.651 0.891 0.084  -0.118 0.061  210 ALA HHH HB3  
3073 N N    . SER B 211 ? 0.539 0.666 0.984 0.107  -0.111 0.072  211 SER HHH N    
3074 C CA   . SER B 211 ? 0.542 0.671 1.021 0.118  -0.086 0.074  211 SER HHH CA   
3075 C C    . SER B 211 ? 0.557 0.679 1.056 0.128  -0.101 0.081  211 SER HHH C    
3076 O O    . SER B 211 ? 0.561 0.686 1.094 0.138  -0.082 0.084  211 SER HHH O    
3077 C CB   . SER B 211 ? 0.544 0.657 0.977 0.118  -0.056 0.067  211 SER HHH CB   
3078 O OG   . SER B 211 ? 0.555 0.647 0.946 0.120  -0.060 0.066  211 SER HHH OG   
3079 H H    . SER B 211 ? 0.545 0.657 0.948 0.105  -0.114 0.070  211 SER HHH H    
3080 H HA   . SER B 211 ? 0.535 0.680 1.057 0.119  -0.078 0.077  211 SER HHH HA   
3081 H HB2  . SER B 211 ? 0.545 0.661 1.002 0.123  -0.035 0.068  211 SER HHH HB2  
3082 H HB3  . SER B 211 ? 0.535 0.649 0.943 0.110  -0.053 0.063  211 SER HHH HB3  
3084 N N    . SER B 212 ? 0.565 0.678 1.043 0.126  -0.134 0.084  212 SER HHH N    
3085 C CA   . SER B 212 ? 0.585 0.689 1.080 0.135  -0.157 0.091  212 SER HHH CA   
3086 C C    . SER B 212 ? 0.594 0.679 1.060 0.142  -0.138 0.090  212 SER HHH C    
3087 O O    . SER B 212 ? 0.603 0.687 1.104 0.153  -0.143 0.097  212 SER HHH O    
3088 C CB   . SER B 212 ? 0.581 0.707 1.160 0.142  -0.164 0.100  212 SER HHH CB   
3089 O OG   . SER B 212 ? 0.572 0.717 1.183 0.134  -0.177 0.100  212 SER HHH OG   
3090 H H    . SER B 212 ? 0.566 0.673 1.013 0.119  -0.145 0.081  212 SER HHH H    
3091 H HA   . SER B 212 ? 0.594 0.688 1.063 0.131  -0.180 0.092  212 SER HHH HA   
3092 H HB2  . SER B 212 ? 0.577 0.710 1.182 0.148  -0.140 0.100  212 SER HHH HB2  
3093 H HB3  . SER B 212 ? 0.597 0.717 1.185 0.147  -0.185 0.105  212 SER HHH HB3  
3095 N N    . THR B 213 ? 0.586 0.657 0.996 0.136  -0.119 0.082  213 THR HHH N    
3096 C CA   . THR B 213 ? 0.592 0.643 0.971 0.142  -0.100 0.080  213 THR HHH CA   
3097 C C    . THR B 213 ? 0.602 0.629 0.919 0.136  -0.113 0.078  213 THR HHH C    
3098 O O    . THR B 213 ? 0.595 0.619 0.874 0.126  -0.115 0.074  213 THR HHH O    
3099 C CB   . THR B 213 ? 0.580 0.630 0.946 0.140  -0.066 0.072  213 THR HHH CB   
3100 O OG1  . THR B 213 ? 0.563 0.615 0.893 0.127  -0.066 0.066  213 THR HHH OG1  
3101 C CG2  . THR B 213 ? 0.573 0.640 0.996 0.146  -0.045 0.074  213 THR HHH CG2  
3102 H H    . THR B 213 ? 0.578 0.649 0.964 0.129  -0.118 0.078  213 THR HHH H    
3103 H HA   . THR B 213 ? 0.600 0.652 1.009 0.150  -0.100 0.084  213 THR HHH HA   
3104 H HB   . THR B 213 ? 0.589 0.624 0.932 0.142  -0.056 0.070  213 THR HHH HB   
3106 H HG21 . THR B 213 ? 0.582 0.651 1.036 0.155  -0.047 0.079  213 THR HHH HG21 
3107 H HG22 . THR B 213 ? 0.575 0.635 0.983 0.147  -0.023 0.070  213 THR HHH HG22 
3108 H HG23 . THR B 213 ? 0.563 0.646 1.008 0.143  -0.052 0.075  213 THR HHH HG23 
3109 N N    . THR B 214 ? 0.623 0.634 0.935 0.144  -0.122 0.083  214 THR HHH N    
3110 C CA   . THR B 214 ? 0.642 0.625 0.897 0.141  -0.125 0.082  214 THR HHH CA   
3111 C C    . THR B 214 ? 0.646 0.618 0.892 0.145  -0.098 0.078  214 THR HHH C    
3112 O O    . THR B 214 ? 0.652 0.628 0.936 0.156  -0.088 0.080  214 THR HHH O    
3113 C CB   . THR B 214 ? 0.667 0.635 0.918 0.147  -0.152 0.091  214 THR HHH CB   
3114 O OG1  . THR B 214 ? 0.663 0.641 0.931 0.145  -0.178 0.095  214 THR HHH OG1  
3115 C CG2  . THR B 214 ? 0.685 0.623 0.875 0.143  -0.155 0.091  214 THR HHH CG2  
3116 H H    . THR B 214 ? 0.630 0.644 0.974 0.151  -0.127 0.088  214 THR HHH H    
3117 H HA   . THR B 214 ? 0.636 0.617 0.862 0.133  -0.125 0.079  214 THR HHH HA   
3118 H HB   . THR B 214 ? 0.673 0.641 0.950 0.156  -0.150 0.094  214 THR HHH HB   
3120 H HG21 . THR B 214 ? 0.687 0.617 0.868 0.145  -0.140 0.089  214 THR HHH HG21 
3121 H HG22 . THR B 214 ? 0.705 0.631 0.889 0.147  -0.173 0.096  214 THR HHH HG22 
3122 H HG23 . THR B 214 ? 0.679 0.616 0.844 0.135  -0.154 0.087  214 THR HHH HG23 
3123 N N    . VAL B 215 ? 0.647 0.603 0.845 0.138  -0.088 0.072  215 VAL HHH N    
3124 C CA   . VAL B 215 ? 0.659 0.596 0.839 0.140  -0.068 0.068  215 VAL HHH CA   
3125 C C    . VAL B 215 ? 0.674 0.588 0.808 0.135  -0.075 0.069  215 VAL HHH C    
3126 O O    . VAL B 215 ? 0.674 0.588 0.783 0.126  -0.082 0.068  215 VAL HHH O    
3127 C CB   . VAL B 215 ? 0.648 0.588 0.820 0.136  -0.045 0.060  215 VAL HHH CB   
3128 C CG1  . VAL B 215 ? 0.648 0.602 0.863 0.144  -0.029 0.059  215 VAL HHH CG1  
3129 C CG2  . VAL B 215 ? 0.627 0.578 0.780 0.123  -0.048 0.055  215 VAL HHH CG2  
3130 H H    . VAL B 215 ? 0.643 0.598 0.818 0.131  -0.093 0.071  215 VAL HHH H    
3131 H HA   . VAL B 215 ? 0.668 0.604 0.870 0.149  -0.066 0.071  215 VAL HHH HA   
3132 H HB   . VAL B 215 ? 0.658 0.582 0.809 0.135  -0.036 0.057  215 VAL HHH HB   
3133 H HG11 . VAL B 215 ? 0.660 0.606 0.887 0.152  -0.025 0.062  215 VAL HHH HG11 
3134 H HG12 . VAL B 215 ? 0.645 0.596 0.849 0.141  -0.014 0.054  215 VAL HHH HG12 
3135 H HG13 . VAL B 215 ? 0.637 0.608 0.878 0.145  -0.038 0.063  215 VAL HHH HG13 
3136 H HG21 . VAL B 215 ? 0.619 0.585 0.790 0.123  -0.057 0.058  215 VAL HHH HG21 
3137 H HG22 . VAL B 215 ? 0.624 0.575 0.772 0.121  -0.034 0.050  215 VAL HHH HG22 
3138 H HG23 . VAL B 215 ? 0.631 0.572 0.757 0.118  -0.054 0.055  215 VAL HHH HG23 
3139 N N    . ASP B 216 ? 0.692 0.586 0.819 0.142  -0.071 0.071  216 ASP HHH N    
3140 C CA   . ASP B 216 ? 0.707 0.576 0.795 0.137  -0.072 0.072  216 ASP HHH CA   
3141 C C    . ASP B 216 ? 0.708 0.564 0.779 0.133  -0.053 0.064  216 ASP HHH C    
3142 O O    . ASP B 216 ? 0.705 0.560 0.793 0.140  -0.040 0.061  216 ASP HHH O    
3143 C CB   . ASP B 216 ? 0.736 0.587 0.826 0.147  -0.083 0.080  216 ASP HHH CB   
3144 C CG   . ASP B 216 ? 0.742 0.602 0.852 0.153  -0.106 0.089  216 ASP HHH CG   
3145 O OD1  . ASP B 216 ? 0.739 0.603 0.832 0.147  -0.119 0.090  216 ASP HHH OD1  
3146 O OD2  . ASP B 216 ? 0.750 0.612 0.893 0.165  -0.112 0.094  216 ASP HHH OD2  
3147 H H    . ASP B 216 ? 0.698 0.592 0.847 0.150  -0.067 0.073  216 ASP HHH H    
3148 H HA   . ASP B 216 ? 0.704 0.573 0.773 0.131  -0.079 0.073  216 ASP HHH HA   
3149 H HB2  . ASP B 216 ? 0.741 0.589 0.845 0.154  -0.075 0.080  216 ASP HHH HB2  
3150 H HB3  . ASP B 216 ? 0.747 0.581 0.809 0.144  -0.084 0.082  216 ASP HHH HB3  
3151 N N    . LYS B 217 ? 0.713 0.558 0.752 0.123  -0.050 0.061  217 LYS HHH N    
3152 C CA   . LYS B 217 ? 0.721 0.550 0.743 0.117  -0.037 0.054  217 LYS HHH CA   
3153 C C    . LYS B 217 ? 0.731 0.538 0.728 0.113  -0.039 0.057  217 LYS HHH C    
3154 O O    . LYS B 217 ? 0.730 0.537 0.713 0.104  -0.044 0.060  217 LYS HHH O    
3155 C CB   . LYS B 217 ? 0.709 0.551 0.725 0.107  -0.031 0.047  217 LYS HHH CB   
3156 C CG   . LYS B 217 ? 0.728 0.555 0.731 0.104  -0.019 0.038  217 LYS HHH CG   
3157 C CD   . LYS B 217 ? 0.745 0.569 0.761 0.114  -0.006 0.035  217 LYS HHH CD   
3158 C CE   . LYS B 217 ? 0.776 0.571 0.770 0.114  0.005  0.028  217 LYS HHH CE   
3159 N NZ   . LYS B 217 ? 0.791 0.582 0.789 0.121  0.021  0.022  217 LYS HHH NZ   
3160 H H    . LYS B 217 ? 0.710 0.555 0.738 0.118  -0.058 0.064  217 LYS HHH H    
3161 H HA   . LYS B 217 ? 0.730 0.553 0.760 0.124  -0.029 0.052  217 LYS HHH HA   
3162 H HB2  . LYS B 217 ? 0.698 0.556 0.730 0.110  -0.032 0.047  217 LYS HHH HB2  
3163 H HB3  . LYS B 217 ? 0.704 0.547 0.708 0.100  -0.036 0.048  217 LYS HHH HB3  
3164 H HG2  . LYS B 217 ? 0.718 0.550 0.713 0.097  -0.019 0.035  217 LYS HHH HG2  
3165 H HG3  . LYS B 217 ? 0.742 0.551 0.732 0.103  -0.019 0.039  217 LYS HHH HG3  
3166 H HD2  . LYS B 217 ? 0.748 0.575 0.781 0.123  -0.008 0.039  217 LYS HHH HD2  
3167 H HD3  . LYS B 217 ? 0.732 0.570 0.756 0.113  -0.004 0.033  217 LYS HHH HD3  
3168 H HE2  . LYS B 217 ? 0.775 0.564 0.752 0.105  0.002  0.024  217 LYS HHH HE2  
3169 H HE3  . LYS B 217 ? 0.790 0.571 0.783 0.118  0.004  0.030  217 LYS HHH HE3  
3170 H HZ1  . LYS B 217 ? 0.785 0.587 0.805 0.129  0.023  0.026  217 LYS HHH HZ1  
3171 H HZ2  . LYS B 217 ? 0.811 0.580 0.795 0.123  0.027  0.019  217 LYS HHH HZ2  
3172 H HZ3  . LYS B 217 ? 0.783 0.578 0.773 0.116  0.022  0.019  217 LYS HHH HZ3  
3173 N N    . LYS B 218 ? 0.747 0.532 0.740 0.118  -0.034 0.057  218 LYS HHH N    
3174 C CA   . LYS B 218 ? 0.764 0.524 0.736 0.113  -0.033 0.060  218 LYS HHH CA   
3175 C C    . LYS B 218 ? 0.754 0.509 0.714 0.101  -0.027 0.053  218 LYS HHH C    
3176 O O    . LYS B 218 ? 0.755 0.507 0.716 0.100  -0.020 0.045  218 LYS HHH O    
3177 C CB   . LYS B 218 ? 0.791 0.530 0.765 0.124  -0.030 0.062  218 LYS HHH CB   
3178 C CG   . LYS B 218 ? 0.817 0.528 0.772 0.120  -0.029 0.066  218 LYS HHH CG   
3179 C CD   . LYS B 218 ? 0.848 0.538 0.806 0.130  -0.025 0.068  218 LYS HHH CD   
3180 C CE   . LYS B 218 ? 0.871 0.532 0.811 0.125  -0.022 0.070  218 LYS HHH CE   
3181 N NZ   . LYS B 218 ? 0.897 0.536 0.839 0.136  -0.018 0.072  218 LYS HHH NZ   
3182 H H    . LYS B 218 ? 0.754 0.537 0.758 0.125  -0.029 0.056  218 LYS HHH H    
3183 H HA   . LYS B 218 ? 0.764 0.524 0.730 0.112  -0.040 0.066  218 LYS HHH HA   
3184 H HB2  . LYS B 218 ? 0.793 0.538 0.780 0.132  -0.036 0.068  218 LYS HHH HB2  
3185 H HB3  . LYS B 218 ? 0.794 0.530 0.773 0.126  -0.023 0.057  218 LYS HHH HB3  
3186 H HG2  . LYS B 218 ? 0.815 0.522 0.763 0.111  -0.025 0.061  218 LYS HHH HG2  
3187 H HG3  . LYS B 218 ? 0.818 0.529 0.767 0.118  -0.035 0.072  218 LYS HHH HG3  
3188 H HD2  . LYS B 218 ? 0.850 0.544 0.817 0.139  -0.031 0.074  218 LYS HHH HD2  
3189 H HD3  . LYS B 218 ? 0.848 0.537 0.812 0.133  -0.019 0.062  218 LYS HHH HD3  
3190 H HE2  . LYS B 218 ? 0.868 0.526 0.802 0.116  -0.018 0.065  218 LYS HHH HE2  
3191 H HE3  . LYS B 218 ? 0.874 0.532 0.806 0.123  -0.027 0.077  218 LYS HHH HE3  
3192 H HZ1  . LYS B 218 ? 0.899 0.543 0.850 0.145  -0.022 0.076  218 LYS HHH HZ1  
3193 H HZ2  . LYS B 218 ? 0.912 0.533 0.843 0.134  -0.018 0.075  218 LYS HHH HZ2  
3194 H HZ3  . LYS B 218 ? 0.900 0.534 0.843 0.136  -0.012 0.065  218 LYS HHH HZ3  
3195 N N    . ILE B 219 ? 0.751 0.500 0.700 0.091  -0.029 0.056  219 ILE HHH N    
3196 C CA   . ILE B 219 ? 0.749 0.493 0.692 0.078  -0.026 0.050  219 ILE HHH CA   
3197 C C    . ILE B 219 ? 0.779 0.494 0.714 0.076  -0.022 0.049  219 ILE HHH C    
3198 O O    . ILE B 219 ? 0.783 0.484 0.715 0.076  -0.022 0.057  219 ILE HHH O    
3199 C CB   . ILE B 219 ? 0.733 0.486 0.675 0.068  -0.027 0.055  219 ILE HHH CB   
3200 C CG1  . ILE B 219 ? 0.714 0.490 0.659 0.071  -0.032 0.057  219 ILE HHH CG1  
3201 C CG2  . ILE B 219 ? 0.726 0.479 0.671 0.055  -0.026 0.050  219 ILE HHH CG2  
3202 C CD1  . ILE B 219 ? 0.695 0.492 0.650 0.071  -0.032 0.050  219 ILE HHH CD1  
3203 H H    . ILE B 219 ? 0.756 0.503 0.700 0.092  -0.032 0.062  219 ILE HHH H    
3204 H HA   . ILE B 219 ? 0.741 0.493 0.687 0.076  -0.025 0.044  219 ILE HHH HA   
3205 H HB   . ILE B 219 ? 0.747 0.487 0.683 0.069  -0.026 0.061  219 ILE HHH HB   
3206 H HG12 . ILE B 219 ? 0.722 0.496 0.665 0.079  -0.035 0.062  219 ILE HHH HG12 
3207 H HG13 . ILE B 219 ? 0.710 0.488 0.651 0.066  -0.031 0.060  219 ILE HHH HG13 
3208 H HG21 . ILE B 219 ? 0.740 0.477 0.684 0.052  -0.025 0.050  219 ILE HHH HG21 
3209 H HG22 . ILE B 219 ? 0.714 0.478 0.662 0.051  -0.026 0.052  219 ILE HHH HG22 
3210 H HG23 . ILE B 219 ? 0.722 0.479 0.668 0.055  -0.028 0.043  219 ILE HHH HG23 
3211 H HD11 . ILE B 219 ? 0.691 0.487 0.645 0.064  -0.031 0.045  219 ILE HHH HD11 
3212 H HD12 . ILE B 219 ? 0.683 0.494 0.641 0.072  -0.035 0.051  219 ILE HHH HD12 
3213 H HD13 . ILE B 219 ? 0.701 0.495 0.659 0.078  -0.031 0.047  219 ILE HHH HD13 
3214 N N    . GLU B 220 ? 0.803 0.507 0.735 0.075  -0.020 0.040  220 GLU HHH N    
3215 C CA   . GLU B 220 ? 0.842 0.515 0.764 0.074  -0.018 0.037  220 GLU HHH CA   
3216 C C    . GLU B 220 ? 0.852 0.517 0.774 0.058  -0.023 0.033  220 GLU HHH C    
3217 O O    . GLU B 220 ? 0.833 0.511 0.756 0.052  -0.027 0.028  220 GLU HHH O    
3218 C CB   . GLU B 220 ? 0.861 0.520 0.776 0.083  -0.013 0.030  220 GLU HHH CB   
3219 C CG   . GLU B 220 ? 0.867 0.535 0.793 0.099  -0.008 0.035  220 GLU HHH CG   
3220 C CD   . GLU B 220 ? 0.896 0.547 0.823 0.107  -0.007 0.042  220 GLU HHH CD   
3221 O OE1  . GLU B 220 ? 0.912 0.549 0.832 0.099  -0.010 0.046  220 GLU HHH OE1  
3222 O OE2  . GLU B 220 ? 0.906 0.559 0.843 0.120  -0.004 0.046  220 GLU HHH OE2  
3223 H H    . GLU B 220 ? 0.795 0.507 0.727 0.076  -0.020 0.035  220 GLU HHH H    
3224 H HA   . GLU B 220 ? 0.851 0.516 0.774 0.077  -0.017 0.043  220 GLU HHH HA   
3225 H HB2  . GLU B 220 ? 0.856 0.521 0.768 0.080  -0.013 0.024  220 GLU HHH HB2  
3226 H HB3  . GLU B 220 ? 0.883 0.520 0.789 0.081  -0.012 0.027  220 GLU HHH HB3  
3227 H HG2  . GLU B 220 ? 0.848 0.537 0.783 0.100  -0.011 0.038  220 GLU HHH HG2  
3228 H HG3  . GLU B 220 ? 0.876 0.538 0.799 0.104  -0.002 0.029  220 GLU HHH HG3  
3229 N N    . PRO B 221 ? 0.891 0.533 0.812 0.052  -0.023 0.036  221 PRO HHH N    
3230 C CA   . PRO B 221 ? 0.905 0.537 0.831 0.037  -0.030 0.032  221 PRO HHH CA   
3231 C C    . PRO B 221 ? 0.934 0.546 0.844 0.035  -0.036 0.020  221 PRO HHH C    
3232 O O    . PRO B 221 ? 0.953 0.549 0.846 0.045  -0.030 0.016  221 PRO HHH O    
3233 C CB   . PRO B 221 ? 0.924 0.536 0.856 0.033  -0.027 0.039  221 PRO HHH CB   
3234 C CG   . PRO B 221 ? 0.939 0.539 0.859 0.048  -0.020 0.041  221 PRO HHH CG   
3235 C CD   . PRO B 221 ? 0.914 0.539 0.833 0.059  -0.018 0.043  221 PRO HHH CD   
3236 H HA   . PRO B 221 ? 0.886 0.536 0.822 0.032  -0.032 0.034  221 PRO HHH HA   
3237 H HB2  . PRO B 221 ? 0.938 0.534 0.871 0.026  -0.031 0.035  221 PRO HHH HB2  
3238 H HB3  . PRO B 221 ? 0.912 0.535 0.856 0.030  -0.024 0.046  221 PRO HHH HB3  
3239 H HG2  . PRO B 221 ? 0.957 0.538 0.868 0.050  -0.021 0.035  221 PRO HHH HG2  
3240 H HG3  . PRO B 221 ? 0.946 0.538 0.869 0.048  -0.016 0.049  221 PRO HHH HG3  
3241 H HD2  . PRO B 221 ? 0.924 0.542 0.837 0.068  -0.016 0.041  221 PRO HHH HD2  
3242 H HD3  . PRO B 221 ? 0.906 0.540 0.829 0.061  -0.016 0.050  221 PRO HHH HD3  
3243 N N    . ARG B 222 ? 0.948 0.557 0.861 0.022  -0.046 0.015  222 ARG HHH N    
3244 C CA   . ARG B 222 ? 0.982 0.566 0.872 0.018  -0.056 0.003  222 ARG HHH CA   
3245 C C    . ARG B 222 ? 1.022 0.569 0.906 0.011  -0.063 -0.000 222 ARG HHH C    
3246 O O    . ARG B 222 ? 1.058 0.573 0.914 0.015  -0.063 -0.009 222 ARG HHH O    
3247 C CB   . ARG B 222 ? 0.969 0.569 0.867 0.007  -0.067 0.000  222 ARG HHH CB   
3248 C CG   . ARG B 222 ? 0.935 0.572 0.841 0.013  -0.060 0.004  222 ARG HHH CG   
3249 C CD   . ARG B 222 ? 0.920 0.574 0.838 0.002  -0.071 0.003  222 ARG HHH CD   
3250 N NE   . ARG B 222 ? 0.892 0.578 0.814 0.009  -0.064 0.006  222 ARG HHH NE   
3251 C CZ   . ARG B 222 ? 0.889 0.579 0.793 0.014  -0.062 0.000  222 ARG HHH CZ   
3252 N NH1  . ARG B 222 ? 0.918 0.579 0.793 0.014  -0.067 -0.009 222 ARG HHH NH1  
3253 N NH2  . ARG B 222 ? 0.863 0.582 0.775 0.019  -0.056 0.004  222 ARG HHH NH2  
3254 O OXT  . ARG B 222 ? 1.022 0.569 0.930 0.002  -0.067 0.006  222 ARG HHH OXT  
3255 H H    . ARG B 222 ? 0.934 0.554 0.863 0.014  -0.049 0.019  222 ARG HHH H    
3256 H HA   . ARG B 222 ? 0.988 0.569 0.862 0.027  -0.049 -0.001 222 ARG HHH HA   
3257 H HB2  . ARG B 222 ? 0.965 0.568 0.882 -0.002 -0.073 0.004  222 ARG HHH HB2  
3258 H HB3  . ARG B 222 ? 0.989 0.571 0.867 0.006  -0.074 -0.007 222 ARG HHH HB3  
3259 H HG2  . ARG B 222 ? 0.940 0.575 0.830 0.021  -0.055 0.000  222 ARG HHH HG2  
3260 H HG3  . ARG B 222 ? 0.920 0.571 0.840 0.016  -0.054 0.011  222 ARG HHH HG3  
3261 H HD2  . ARG B 222 ? 0.913 0.573 0.852 -0.005 -0.075 0.008  222 ARG HHH HD2  
3262 H HD3  . ARG B 222 ? 0.938 0.576 0.840 -0.001 -0.080 -0.004 222 ARG HHH HD3  
3263 H HE   . ARG B 222 ? 0.873 0.576 0.810 0.009  -0.059 0.012  222 ARG HHH HE   
3264 H HH11 . ARG B 222 ? 0.942 0.580 0.809 0.011  -0.072 -0.012 222 ARG HHH HH11 
3265 H HH12 . ARG B 222 ? 0.921 0.582 0.783 0.018  -0.064 -0.013 222 ARG HHH HH12 
3266 H HH21 . ARG B 222 ? 0.845 0.580 0.772 0.019  -0.053 0.010  222 ARG HHH HH21 
3267 H HH22 . ARG B 222 ? 0.861 0.583 0.764 0.022  -0.054 0.000  222 ARG HHH HH22 
3268 N N    . ASN C 1   ? 0.629 0.463 0.517 0.089  -0.012 0.028  1   ASN LLL N    
3269 C CA   . ASN C 1   ? 0.619 0.470 0.520 0.081  0.008  0.034  1   ASN LLL CA   
3270 C C    . ASN C 1   ? 0.582 0.465 0.521 0.069  0.010  0.032  1   ASN LLL C    
3271 O O    . ASN C 1   ? 0.600 0.488 0.549 0.068  -0.002 0.027  1   ASN LLL O    
3272 C CB   . ASN C 1   ? 0.642 0.480 0.519 0.086  0.025  0.041  1   ASN LLL CB   
3273 C CG   . ASN C 1   ? 0.640 0.488 0.525 0.083  0.028  0.040  1   ASN LLL CG   
3274 O OD1  . ASN C 1   ? 0.614 0.485 0.527 0.075  0.022  0.037  1   ASN LLL OD1  
3275 N ND2  . ASN C 1   ? 0.671 0.502 0.531 0.090  0.038  0.044  1   ASN LLL ND2  
3276 H H1   . ASN C 1   ? 0.632 0.466 0.519 0.089  -0.013 0.026  1   ASN LLL H1   
3277 H H2   . ASN C 1   ? 0.621 0.464 0.527 0.086  -0.021 0.023  1   ASN LLL H2   
3278 H H3   . ASN C 1   ? 0.659 0.470 0.520 0.097  -0.014 0.028  1   ASN LLL H3   
3279 H HA   . ASN C 1   ? 0.621 0.470 0.521 0.081  0.010  0.036  1   ASN LLL HA   
3280 H HB2  . ASN C 1   ? 0.636 0.480 0.520 0.083  0.037  0.045  1   ASN LLL HB2  
3281 H HB3  . ASN C 1   ? 0.671 0.485 0.520 0.095  0.022  0.041  1   ASN LLL HB3  
3284 N N    . LEU C 2   ? 0.548 0.450 0.505 0.061  0.022  0.036  2   LEU LLL N    
3285 C CA   . LEU C 2   ? 0.508 0.436 0.498 0.051  0.023  0.034  2   LEU LLL CA   
3286 C C    . LEU C 2   ? 0.487 0.427 0.485 0.047  0.031  0.036  2   LEU LLL C    
3287 O O    . LEU C 2   ? 0.478 0.419 0.474 0.046  0.043  0.041  2   LEU LLL O    
3288 C CB   . LEU C 2   ? 0.496 0.435 0.500 0.046  0.029  0.036  2   LEU LLL CB   
3289 C CG   . LEU C 2   ? 0.467 0.428 0.498 0.037  0.032  0.035  2   LEU LLL CG   
3290 C CD1  . LEU C 2   ? 0.462 0.428 0.507 0.034  0.021  0.029  2   LEU LLL CD1  
3291 C CD2  . LEU C 2   ? 0.454 0.422 0.495 0.033  0.038  0.037  2   LEU LLL CD2  
3292 H H    . LEU C 2   ? 0.554 0.452 0.505 0.063  0.031  0.040  2   LEU LLL H    
3293 H HA   . LEU C 2   ? 0.506 0.436 0.504 0.051  0.013  0.030  2   LEU LLL HA   
3294 H HB2  . LEU C 2   ? 0.503 0.435 0.504 0.049  0.024  0.035  2   LEU LLL HB2  
3295 H HB3  . LEU C 2   ? 0.500 0.436 0.497 0.047  0.038  0.041  2   LEU LLL HB3  
3296 H HG   . LEU C 2   ? 0.461 0.427 0.495 0.034  0.036  0.036  2   LEU LLL HG   
3297 H HD11 . LEU C 2   ? 0.467 0.429 0.508 0.037  0.016  0.027  2   LEU LLL HD11 
3298 H HD12 . LEU C 2   ? 0.447 0.425 0.507 0.029  0.024  0.028  2   LEU LLL HD12 
3299 H HD13 . LEU C 2   ? 0.466 0.428 0.513 0.036  0.016  0.027  2   LEU LLL HD13 
3300 H HD21 . LEU C 2   ? 0.461 0.424 0.500 0.035  0.034  0.036  2   LEU LLL HD21 
3301 H HD22 . LEU C 2   ? 0.441 0.421 0.496 0.028  0.039  0.036  2   LEU LLL HD22 
3302 H HD23 . LEU C 2   ? 0.459 0.424 0.495 0.034  0.045  0.041  2   LEU LLL HD23 
3303 N N    . THR C 3   ? 0.479 0.428 0.490 0.043  0.024  0.032  3   THR LLL N    
3304 C CA   . THR C 3   ? 0.465 0.429 0.490 0.036  0.030  0.032  3   THR LLL CA   
3305 C C    . THR C 3   ? 0.449 0.428 0.496 0.029  0.029  0.030  3   THR LLL C    
3306 O O    . THR C 3   ? 0.451 0.429 0.506 0.029  0.022  0.026  3   THR LLL O    
3307 C CB   . THR C 3   ? 0.459 0.420 0.479 0.039  0.026  0.030  3   THR LLL CB   
3308 O OG1  . THR C 3   ? 0.466 0.425 0.492 0.039  0.014  0.025  3   THR LLL OG1  
3309 C CG2  . THR C 3   ? 0.478 0.422 0.473 0.047  0.029  0.033  3   THR LLL CG2  
3310 H H    . THR C 3   ? 0.483 0.429 0.495 0.045  0.016  0.028  3   THR LLL H    
3311 H HA   . THR C 3   ? 0.461 0.427 0.485 0.036  0.038  0.036  3   THR LLL HA   
3312 H HB   . THR C 3   ? 0.450 0.420 0.479 0.034  0.029  0.031  3   THR LLL HB   
3314 H HG21 . THR C 3   ? 0.477 0.423 0.472 0.046  0.038  0.037  3   THR LLL HG21 
3315 H HG22 . THR C 3   ? 0.480 0.423 0.473 0.047  0.026  0.032  3   THR LLL HG22 
3316 H HG23 . THR C 3   ? 0.493 0.425 0.476 0.052  0.024  0.032  3   THR LLL HG23 
3317 N N    . LEU C 4   ? 0.433 0.423 0.491 0.023  0.035  0.031  4   LEU LLL N    
3318 C CA   . LEU C 4   ? 0.421 0.421 0.495 0.017  0.036  0.029  4   LEU LLL CA   
3319 C C    . LEU C 4   ? 0.418 0.421 0.495 0.014  0.036  0.028  4   LEU LLL C    
3320 O O    . LEU C 4   ? 0.430 0.433 0.501 0.014  0.039  0.030  4   LEU LLL O    
3321 C CB   . LEU C 4   ? 0.416 0.421 0.493 0.014  0.043  0.032  4   LEU LLL CB   
3322 C CG   . LEU C 4   ? 0.419 0.423 0.498 0.015  0.044  0.033  4   LEU LLL CG   
3323 C CD1  . LEU C 4   ? 0.411 0.421 0.497 0.011  0.048  0.034  4   LEU LLL CD1  
3324 C CD2  . LEU C 4   ? 0.424 0.428 0.510 0.014  0.038  0.029  4   LEU LLL CD2  
3325 H H    . LEU C 4   ? 0.434 0.424 0.488 0.023  0.040  0.033  4   LEU LLL H    
3326 H HA   . LEU C 4   ? 0.422 0.422 0.501 0.017  0.033  0.027  4   LEU LLL HA   
3327 H HB2  . LEU C 4   ? 0.418 0.422 0.491 0.015  0.046  0.034  4   LEU LLL HB2  
3328 H HB3  . LEU C 4   ? 0.411 0.420 0.494 0.010  0.044  0.031  4   LEU LLL HB3  
3329 H HG   . LEU C 4   ? 0.427 0.426 0.498 0.018  0.044  0.035  4   LEU LLL HG   
3330 H HD11 . LEU C 4   ? 0.411 0.421 0.496 0.010  0.050  0.036  4   LEU LLL HD11 
3331 H HD12 . LEU C 4   ? 0.413 0.422 0.499 0.012  0.049  0.036  4   LEU LLL HD12 
3332 H HD13 . LEU C 4   ? 0.407 0.420 0.499 0.008  0.048  0.032  4   LEU LLL HD13 
3333 H HD21 . LEU C 4   ? 0.418 0.426 0.511 0.012  0.038  0.027  4   LEU LLL HD21 
3334 H HD22 . LEU C 4   ? 0.421 0.426 0.510 0.014  0.039  0.029  4   LEU LLL HD22 
3335 H HD23 . LEU C 4   ? 0.430 0.428 0.511 0.018  0.034  0.028  4   LEU LLL HD23 
3336 N N    . ILE C 5   ? 0.420 0.424 0.507 0.012  0.033  0.024  5   ILE LLL N    
3337 C CA   . ILE C 5   ? 0.422 0.427 0.511 0.010  0.033  0.023  5   ILE LLL CA   
3338 C C    . ILE C 5   ? 0.412 0.420 0.507 0.004  0.040  0.023  5   ILE LLL C    
3339 O O    . ILE C 5   ? 0.412 0.422 0.518 0.002  0.042  0.022  5   ILE LLL O    
3340 C CB   . ILE C 5   ? 0.434 0.436 0.532 0.012  0.025  0.019  5   ILE LLL CB   
3341 C CG1  . ILE C 5   ? 0.446 0.439 0.532 0.019  0.017  0.018  5   ILE LLL CG1  
3342 C CG2  . ILE C 5   ? 0.434 0.436 0.536 0.009  0.026  0.018  5   ILE LLL CG2  
3343 C CD1  . ILE C 5   ? 0.451 0.440 0.548 0.022  0.006  0.013  5   ILE LLL CD1  
3344 H H    . ILE C 5   ? 0.419 0.424 0.513 0.012  0.031  0.022  5   ILE LLL H    
3345 H HA   . ILE C 5   ? 0.424 0.427 0.505 0.011  0.033  0.025  5   ILE LLL HA   
3346 H HB   . ILE C 5   ? 0.431 0.434 0.540 0.010  0.025  0.017  5   ILE LLL HB   
3347 H HG12 . ILE C 5   ? 0.449 0.439 0.526 0.021  0.017  0.019  5   ILE LLL HG12 
3348 H HG13 . ILE C 5   ? 0.447 0.439 0.526 0.020  0.019  0.020  5   ILE LLL HG13 
3349 H HG21 . ILE C 5   ? 0.430 0.435 0.542 0.006  0.031  0.017  5   ILE LLL HG21 
3350 H HG22 . ILE C 5   ? 0.437 0.437 0.543 0.012  0.020  0.016  5   ILE LLL HG22 
3351 H HG23 . ILE C 5   ? 0.433 0.435 0.526 0.009  0.029  0.020  5   ILE LLL HG23 
3352 H HD11 . ILE C 5   ? 0.450 0.440 0.554 0.021  0.006  0.012  5   ILE LLL HD11 
3353 H HD12 . ILE C 5   ? 0.462 0.442 0.547 0.027  -0.000 0.013  5   ILE LLL HD12 
3354 H HD13 . ILE C 5   ? 0.448 0.439 0.557 0.019  0.005  0.011  5   ILE LLL HD13 
3355 N N    . GLN C 6   ? 0.409 0.416 0.497 0.003  0.043  0.025  6   GLN LLL N    
3356 C CA   . GLN C 6   ? 0.409 0.415 0.496 -0.001 0.048  0.025  6   GLN LLL CA   
3357 C C    . GLN C 6   ? 0.413 0.415 0.498 -0.002 0.048  0.024  6   GLN LLL C    
3358 O O    . GLN C 6   ? 0.405 0.408 0.485 0.001  0.044  0.025  6   GLN LLL O    
3359 C CB   . GLN C 6   ? 0.409 0.414 0.488 -0.001 0.049  0.027  6   GLN LLL CB   
3360 C CG   . GLN C 6   ? 0.415 0.420 0.495 -0.002 0.051  0.027  6   GLN LLL CG   
3361 C CD   . GLN C 6   ? 0.421 0.424 0.496 -0.001 0.049  0.029  6   GLN LLL CD   
3362 O OE1  . GLN C 6   ? 0.421 0.428 0.498 0.001  0.047  0.030  6   GLN LLL OE1  
3363 N NE2  . GLN C 6   ? 0.421 0.419 0.492 -0.003 0.051  0.028  6   GLN LLL NE2  
3364 H H    . GLN C 6   ? 0.411 0.418 0.493 0.005  0.041  0.026  6   GLN LLL H    
3365 H HA   . GLN C 6   ? 0.410 0.415 0.503 -0.002 0.051  0.024  6   GLN LLL HA   
3366 H HB2  . GLN C 6   ? 0.410 0.416 0.486 0.001  0.046  0.028  6   GLN LLL HB2  
3367 H HB3  . GLN C 6   ? 0.415 0.415 0.488 -0.002 0.050  0.027  6   GLN LLL HB3  
3368 H HG2  . GLN C 6   ? 0.417 0.420 0.499 -0.003 0.054  0.026  6   GLN LLL HG2  
3369 H HG3  . GLN C 6   ? 0.412 0.420 0.496 -0.000 0.049  0.027  6   GLN LLL HG3  
3372 N N    . SER C 7   ? 0.422 0.419 0.509 -0.005 0.054  0.024  7   SER LLL N    
3373 C CA   . SER C 7   ? 0.433 0.423 0.514 -0.006 0.056  0.024  7   SER LLL CA   
3374 C C    . SER C 7   ? 0.442 0.428 0.507 -0.005 0.054  0.026  7   SER LLL C    
3375 O O    . SER C 7   ? 0.448 0.434 0.508 -0.005 0.054  0.026  7   SER LLL O    
3376 C CB   . SER C 7   ? 0.446 0.429 0.532 -0.009 0.065  0.024  7   SER LLL CB   
3377 O OG   . SER C 7   ? 0.450 0.438 0.557 -0.009 0.065  0.022  7   SER LLL OG   
3378 H H    . SER C 7   ? 0.423 0.419 0.516 -0.006 0.058  0.023  7   SER LLL H    
3379 H HA   . SER C 7   ? 0.432 0.425 0.516 -0.005 0.052  0.023  7   SER LLL HA   
3380 H HB2  . SER C 7   ? 0.450 0.430 0.532 -0.009 0.069  0.024  7   SER LLL HB2  
3381 H HB3  . SER C 7   ? 0.452 0.430 0.531 -0.009 0.067  0.024  7   SER LLL HB3  
3383 N N    . ARG C 8   ? 0.452 0.434 0.510 -0.005 0.052  0.026  8   ARG LLL N    
3384 C CA   . ARG C 8   ? 0.461 0.438 0.506 -0.004 0.048  0.027  8   ARG LLL CA   
3385 C C    . ARG C 8   ? 0.462 0.424 0.492 -0.004 0.051  0.027  8   ARG LLL C    
3386 O O    . ARG C 8   ? 0.463 0.420 0.484 -0.003 0.046  0.027  8   ARG LLL O    
3387 C CB   . ARG C 8   ? 0.474 0.453 0.518 -0.002 0.043  0.027  8   ARG LLL CB   
3388 C CG   . ARG C 8   ? 0.481 0.470 0.533 0.001  0.039  0.027  8   ARG LLL CG   
3389 C CD   . ARG C 8   ? 0.504 0.493 0.554 0.003  0.035  0.027  8   ARG LLL CD   
3390 N NE   . ARG C 8   ? 0.524 0.507 0.566 0.003  0.033  0.027  8   ARG LLL NE   
3391 C CZ   . ARG C 8   ? 0.530 0.514 0.573 0.004  0.030  0.027  8   ARG LLL CZ   
3392 N NH1  . ARG C 8   ? 0.531 0.521 0.582 0.005  0.031  0.028  8   ARG LLL NH1  
3393 N NH2  . ARG C 8   ? 0.544 0.520 0.581 0.004  0.026  0.026  8   ARG LLL NH2  
3394 H H    . ARG C 8   ? 0.452 0.434 0.513 -0.005 0.052  0.026  8   ARG LLL H    
3395 H HA   . ARG C 8   ? 0.456 0.437 0.503 -0.003 0.045  0.027  8   ARG LLL HA   
3396 H HB2  . ARG C 8   ? 0.476 0.453 0.522 -0.003 0.045  0.026  8   ARG LLL HB2  
3397 H HB3  . ARG C 8   ? 0.480 0.454 0.516 -0.002 0.041  0.027  8   ARG LLL HB3  
3398 H HG2  . ARG C 8   ? 0.481 0.472 0.533 0.001  0.039  0.028  8   ARG LLL HG2  
3399 H HG3  . ARG C 8   ? 0.479 0.472 0.537 0.001  0.040  0.027  8   ARG LLL HG3  
3400 H HD2  . ARG C 8   ? 0.499 0.492 0.551 0.005  0.034  0.027  8   ARG LLL HD2  
3401 H HD3  . ARG C 8   ? 0.502 0.491 0.554 0.002  0.035  0.026  8   ARG LLL HD3  
3402 H HE   . ARG C 8   ? 0.527 0.506 0.565 0.002  0.033  0.026  8   ARG LLL HE   
3403 H HH11 . ARG C 8   ? 0.525 0.518 0.578 0.005  0.034  0.028  8   ARG LLL HH11 
3404 H HH12 . ARG C 8   ? 0.529 0.519 0.582 0.006  0.029  0.028  8   ARG LLL HH12 
3405 H HH21 . ARG C 8   ? 0.546 0.517 0.577 0.003  0.026  0.026  8   ARG LLL HH21 
3406 H HH22 . ARG C 8   ? 0.541 0.518 0.581 0.005  0.023  0.026  8   ARG LLL HH22 
3407 N N    . SER C 9   ? 0.462 0.416 0.490 -0.006 0.059  0.027  9   SER LLL N    
3408 C CA   . SER C 9   ? 0.478 0.412 0.486 -0.006 0.065  0.028  9   SER LLL CA   
3409 C C    . SER C 9   ? 0.475 0.403 0.485 -0.008 0.077  0.028  9   SER LLL C    
3410 O O    . SER C 9   ? 0.473 0.406 0.499 -0.010 0.084  0.028  9   SER LLL O    
3411 C CB   . SER C 9   ? 0.490 0.414 0.488 -0.006 0.065  0.028  9   SER LLL CB   
3412 O OG   . SER C 9   ? 0.524 0.425 0.500 -0.005 0.073  0.029  9   SER LLL OG   
3413 H H    . SER C 9   ? 0.459 0.417 0.497 -0.007 0.063  0.027  9   SER LLL H    
3414 H HA   . SER C 9   ? 0.482 0.411 0.480 -0.005 0.060  0.028  9   SER LLL HA   
3415 H HB2  . SER C 9   ? 0.490 0.415 0.484 -0.005 0.057  0.028  9   SER LLL HB2  
3416 H HB3  . SER C 9   ? 0.486 0.416 0.495 -0.008 0.068  0.029  9   SER LLL HB3  
3418 N N    . VAL C 10  ? 0.475 0.390 0.469 -0.006 0.080  0.028  10  VAL LLL N    
3419 C CA   . VAL C 10  ? 0.487 0.387 0.474 -0.007 0.093  0.029  10  VAL LLL CA   
3420 C C    . VAL C 10  ? 0.516 0.388 0.467 -0.003 0.094  0.030  10  VAL LLL C    
3421 O O    . VAL C 10  ? 0.516 0.385 0.455 -0.001 0.081  0.029  10  VAL LLL O    
3422 C CB   . VAL C 10  ? 0.473 0.382 0.471 -0.007 0.095  0.028  10  VAL LLL CB   
3423 C CG1  . VAL C 10  ? 0.496 0.387 0.482 -0.006 0.109  0.029  10  VAL LLL CG1  
3424 C CG2  . VAL C 10  ? 0.450 0.382 0.480 -0.010 0.094  0.027  10  VAL LLL CG2  
3425 H H    . VAL C 10  ? 0.478 0.392 0.465 -0.005 0.073  0.028  10  VAL LLL H    
3426 H HA   . VAL C 10  ? 0.487 0.388 0.483 -0.008 0.101  0.030  10  VAL LLL HA   
3427 H HB   . VAL C 10  ? 0.471 0.383 0.465 -0.006 0.087  0.027  10  VAL LLL HB   
3428 H HG11 . VAL C 10  ? 0.511 0.387 0.475 -0.004 0.107  0.029  10  VAL LLL HG11 
3429 H HG12 . VAL C 10  ? 0.487 0.387 0.486 -0.007 0.111  0.028  10  VAL LLL HG12 
3430 H HG13 . VAL C 10  ? 0.503 0.388 0.491 -0.007 0.119  0.030  10  VAL LLL HG13 
3431 H HG21 . VAL C 10  ? 0.452 0.383 0.491 -0.011 0.102  0.027  10  VAL LLL HG21 
3432 H HG22 . VAL C 10  ? 0.445 0.382 0.482 -0.009 0.094  0.027  10  VAL LLL HG22 
3433 H HG23 . VAL C 10  ? 0.439 0.381 0.474 -0.009 0.086  0.027  10  VAL LLL HG23 
3434 N N    . SER C 11  ? 0.538 0.389 0.475 -0.003 0.109  0.031  11  SER LLL N    
3435 C CA   . SER C 11  ? 0.569 0.387 0.466 0.002  0.112  0.032  11  SER LLL CA   
3436 C C    . SER C 11  ? 0.589 0.386 0.472 0.003  0.132  0.034  11  SER LLL C    
3437 O O    . SER C 11  ? 0.578 0.387 0.488 -0.001 0.145  0.035  11  SER LLL O    
3438 C CB   . SER C 11  ? 0.581 0.388 0.465 0.002  0.110  0.033  11  SER LLL CB   
3439 O OG   . SER C 11  ? 0.580 0.389 0.479 -0.001 0.126  0.036  11  SER LLL OG   
3440 H H    . SER C 11  ? 0.535 0.389 0.485 -0.005 0.120  0.032  11  SER LLL H    
3441 H HA   . SER C 11  ? 0.572 0.386 0.458 0.004  0.101  0.031  11  SER LLL HA   
3442 H HB2  . SER C 11  ? 0.606 0.389 0.461 0.006  0.109  0.034  11  SER LLL HB2  
3443 H HB3  . SER C 11  ? 0.564 0.385 0.458 0.002  0.098  0.032  11  SER LLL HB3  
3445 N N    . GLY C 12  ? 0.623 0.387 0.466 0.008  0.133  0.034  12  GLY LLL N    
3446 C CA   . GLY C 12  ? 0.658 0.393 0.478 0.011  0.153  0.036  12  GLY LLL CA   
3447 C C    . GLY C 12  ? 0.702 0.396 0.469 0.019  0.148  0.036  12  GLY LLL C    
3448 O O    . GLY C 12  ? 0.701 0.395 0.457 0.022  0.126  0.033  12  GLY LLL O    
3449 H H    . GLY C 12  ? 0.631 0.387 0.458 0.011  0.121  0.033  12  GLY LLL H    
3450 H HA2  . GLY C 12  ? 0.661 0.394 0.489 0.009  0.167  0.038  12  GLY LLL HA2  
3451 H HA3  . GLY C 12  ? 0.649 0.393 0.481 0.011  0.155  0.035  12  GLY LLL HA3  
3452 N N    . SER C 13  ? 0.741 0.400 0.477 0.023  0.168  0.039  13  SER LLL N    
3453 C CA   . SER C 13  ? 0.787 0.397 0.463 0.032  0.166  0.039  13  SER LLL CA   
3454 C C    . SER C 13  ? 0.795 0.394 0.453 0.037  0.157  0.035  13  SER LLL C    
3455 O O    . SER C 13  ? 0.767 0.393 0.457 0.033  0.158  0.034  13  SER LLL O    
3456 C CB   . SER C 13  ? 0.824 0.399 0.473 0.035  0.193  0.043  13  SER LLL CB   
3457 O OG   . SER C 13  ? 0.807 0.395 0.479 0.029  0.202  0.046  13  SER LLL OG   
3458 H H    . SER C 13  ? 0.740 0.400 0.488 0.021  0.185  0.041  13  SER LLL H    
3459 H HA   . SER C 13  ? 0.787 0.395 0.454 0.034  0.151  0.037  13  SER LLL HA   
3460 H HB2  . SER C 13  ? 0.828 0.401 0.483 0.034  0.208  0.044  13  SER LLL HB2  
3461 H HB3  . SER C 13  ? 0.862 0.402 0.467 0.042  0.190  0.043  13  SER LLL HB3  
3463 N N    . PRO C 14  ? 0.830 0.388 0.436 0.046  0.146  0.033  14  PRO LLL N    
3464 C CA   . PRO C 14  ? 0.840 0.383 0.426 0.052  0.137  0.030  14  PRO LLL CA   
3465 C C    . PRO C 14  ? 0.859 0.385 0.434 0.054  0.165  0.033  14  PRO LLL C    
3466 O O    . PRO C 14  ? 0.891 0.386 0.438 0.057  0.187  0.037  14  PRO LLL O    
3467 C CB   . PRO C 14  ? 0.889 0.387 0.419 0.062  0.119  0.027  14  PRO LLL CB   
3468 C CG   . PRO C 14  ? 0.884 0.386 0.418 0.060  0.112  0.028  14  PRO LLL CG   
3469 C CD   . PRO C 14  ? 0.864 0.387 0.428 0.052  0.139  0.034  14  PRO LLL CD   
3470 H HA   . PRO C 14  ? 0.809 0.381 0.424 0.049  0.124  0.027  14  PRO LLL HA   
3471 H HB2  . PRO C 14  ? 0.930 0.392 0.422 0.068  0.130  0.028  14  PRO LLL HB2  
3472 H HB3  . PRO C 14  ? 0.883 0.385 0.416 0.064  0.100  0.023  14  PRO LLL HB3  
3473 H HG2  . PRO C 14  ? 0.923 0.389 0.416 0.067  0.108  0.028  14  PRO LLL HG2  
3474 H HG3  . PRO C 14  ? 0.855 0.382 0.414 0.057  0.094  0.025  14  PRO LLL HG3  
3475 H HD2  . PRO C 14  ? 0.897 0.391 0.434 0.056  0.156  0.037  14  PRO LLL HD2  
3476 H HD3  . PRO C 14  ? 0.842 0.384 0.427 0.048  0.133  0.034  14  PRO LLL HD3  
3477 N N    . GLY C 15  ? 0.836 0.382 0.434 0.052  0.164  0.031  15  GLY LLL N    
3478 C CA   . GLY C 15  ? 0.850 0.388 0.448 0.052  0.189  0.033  15  GLY LLL CA   
3479 C C    . GLY C 15  ? 0.803 0.385 0.462 0.042  0.203  0.035  15  GLY LLL C    
3480 O O    . GLY C 15  ? 0.798 0.389 0.474 0.041  0.215  0.034  15  GLY LLL O    
3481 H H    . GLY C 15  ? 0.813 0.380 0.429 0.050  0.147  0.028  15  GLY LLL H    
3482 H HA2  . GLY C 15  ? 0.857 0.389 0.445 0.056  0.182  0.030  15  GLY LLL HA2  
3483 H HA3  . GLY C 15  ? 0.887 0.392 0.454 0.057  0.205  0.035  15  GLY LLL HA3  
3484 N N    . GLN C 16  ? 0.772 0.382 0.463 0.036  0.201  0.036  16  GLN LLL N    
3485 C CA   . GLN C 16  ? 0.735 0.384 0.483 0.027  0.212  0.037  16  GLN LLL CA   
3486 C C    . GLN C 16  ? 0.701 0.391 0.488 0.022  0.195  0.034  16  GLN LLL C    
3487 O O    . GLN C 16  ? 0.699 0.389 0.473 0.025  0.173  0.031  16  GLN LLL O    
3488 C CB   . GLN C 16  ? 0.715 0.378 0.482 0.022  0.213  0.039  16  GLN LLL CB   
3489 C CG   . GLN C 16  ? 0.755 0.379 0.490 0.025  0.235  0.044  16  GLN LLL CG   
3490 C CD   . GLN C 16  ? 0.726 0.368 0.490 0.019  0.240  0.046  16  GLN LLL CD   
3491 O OE1  . GLN C 16  ? 0.683 0.356 0.474 0.015  0.221  0.044  16  GLN LLL OE1  
3492 N NE2  . GLN C 16  ? 0.745 0.366 0.506 0.019  0.266  0.050  16  GLN LLL NE2  
3493 H H    . GLN C 16  ? 0.776 0.382 0.457 0.036  0.191  0.036  16  GLN LLL H    
3494 H HA   . GLN C 16  ? 0.748 0.388 0.498 0.027  0.232  0.039  16  GLN LLL HA   
3495 H HB2  . GLN C 16  ? 0.707 0.375 0.468 0.022  0.195  0.038  16  GLN LLL HB2  
3496 H HB3  . GLN C 16  ? 0.687 0.376 0.492 0.016  0.216  0.039  16  GLN LLL HB3  
3497 H HG2  . GLN C 16  ? 0.769 0.382 0.502 0.026  0.253  0.045  16  GLN LLL HG2  
3498 H HG3  . GLN C 16  ? 0.781 0.379 0.477 0.031  0.228  0.044  16  GLN LLL HG3  
3501 N N    . THR C 17  ? 0.680 0.400 0.514 0.016  0.204  0.034  17  THR LLL N    
3502 C CA   . THR C 17  ? 0.639 0.398 0.513 0.011  0.190  0.031  17  THR LLL CA   
3503 C C    . THR C 17  ? 0.609 0.399 0.520 0.005  0.183  0.031  17  THR LLL C    
3504 O O    . THR C 17  ? 0.608 0.402 0.539 0.002  0.197  0.033  17  THR LLL O    
3505 C CB   . THR C 17  ? 0.637 0.402 0.533 0.010  0.205  0.031  17  THR LLL CB   
3506 O OG1  . THR C 17  ? 0.668 0.404 0.527 0.016  0.210  0.030  17  THR LLL OG1  
3507 C CG2  . THR C 17  ? 0.596 0.399 0.534 0.005  0.192  0.028  17  THR LLL CG2  
3508 H H    . THR C 17  ? 0.682 0.400 0.527 0.014  0.220  0.036  17  THR LLL H    
3509 H HA   . THR C 17  ? 0.640 0.397 0.500 0.014  0.176  0.029  17  THR LLL HA   
3510 H HB   . THR C 17  ? 0.642 0.404 0.550 0.008  0.222  0.032  17  THR LLL HB   
3512 H HG21 . THR C 17  ? 0.578 0.398 0.544 0.002  0.195  0.028  17  THR LLL HG21 
3513 H HG22 . THR C 17  ? 0.598 0.400 0.540 0.006  0.198  0.027  17  THR LLL HG22 
3514 H HG23 . THR C 17  ? 0.586 0.396 0.518 0.006  0.176  0.027  17  THR LLL HG23 
3515 N N    . VAL C 18  ? 0.594 0.404 0.513 0.004  0.161  0.029  18  VAL LLL N    
3516 C CA   . VAL C 18  ? 0.564 0.404 0.516 -0.001 0.151  0.029  18  VAL LLL CA   
3517 C C    . VAL C 18  ? 0.530 0.397 0.508 -0.003 0.140  0.027  18  VAL LLL C    
3518 O O    . VAL C 18  ? 0.540 0.401 0.505 0.000  0.134  0.026  18  VAL LLL O    
3519 C CB   . VAL C 18  ? 0.574 0.410 0.508 0.001  0.138  0.029  18  VAL LLL CB   
3520 C CG1  . VAL C 18  ? 0.555 0.410 0.498 0.000  0.117  0.027  18  VAL LLL CG1  
3521 C CG2  . VAL C 18  ? 0.573 0.414 0.521 -0.002 0.143  0.031  18  VAL LLL CG2  
3522 H H    . VAL C 18  ? 0.596 0.402 0.501 0.007  0.151  0.028  18  VAL LLL H    
3523 H HA   . VAL C 18  ? 0.561 0.405 0.529 -0.003 0.162  0.030  18  VAL LLL HA   
3524 H HB   . VAL C 18  ? 0.600 0.412 0.504 0.004  0.139  0.030  18  VAL LLL HB   
3525 H HG11 . VAL C 18  ? 0.559 0.409 0.493 0.002  0.113  0.026  18  VAL LLL HG11 
3526 H HG12 . VAL C 18  ? 0.556 0.408 0.490 0.001  0.110  0.028  18  VAL LLL HG12 
3527 H HG13 . VAL C 18  ? 0.531 0.407 0.500 -0.002 0.115  0.027  18  VAL LLL HG13 
3528 H HG21 . VAL C 18  ? 0.550 0.411 0.525 -0.005 0.141  0.030  18  VAL LLL HG21 
3529 H HG22 . VAL C 18  ? 0.574 0.411 0.510 -0.001 0.134  0.031  18  VAL LLL HG22 
3530 H HG23 . VAL C 18  ? 0.590 0.415 0.530 -0.002 0.157  0.033  18  VAL LLL HG23 
3531 N N    . SER C 19  ? 0.504 0.396 0.516 -0.006 0.136  0.026  19  SER LLL N    
3532 C CA   . SER C 19  ? 0.481 0.397 0.515 -0.008 0.124  0.025  19  SER LLL CA   
3533 C C    . SER C 19  ? 0.465 0.398 0.512 -0.009 0.112  0.024  19  SER LLL C    
3534 O O    . SER C 19  ? 0.469 0.405 0.528 -0.011 0.116  0.025  19  SER LLL O    
3535 C CB   . SER C 19  ? 0.468 0.393 0.529 -0.009 0.132  0.023  19  SER LLL CB   
3536 O OG   . SER C 19  ? 0.490 0.407 0.561 -0.011 0.149  0.024  19  SER LLL OG   
3537 H H    . SER C 19  ? 0.501 0.397 0.524 -0.008 0.140  0.027  19  SER LLL H    
3538 H HA   . SER C 19  ? 0.483 0.396 0.504 -0.006 0.118  0.024  19  SER LLL HA   
3539 H HB2  . SER C 19  ? 0.454 0.396 0.533 -0.010 0.125  0.022  19  SER LLL HB2  
3540 H HB3  . SER C 19  ? 0.477 0.398 0.531 -0.008 0.134  0.023  19  SER LLL HB3  
3542 N N    . ILE C 20  ? 0.460 0.402 0.504 -0.008 0.098  0.024  20  ILE LLL N    
3543 C CA   . ILE C 20  ? 0.450 0.408 0.505 -0.008 0.087  0.024  20  ILE LLL CA   
3544 C C    . ILE C 20  ? 0.444 0.418 0.523 -0.009 0.085  0.023  20  ILE LLL C    
3545 O O    . ILE C 20  ? 0.451 0.427 0.532 -0.009 0.085  0.023  20  ILE LLL O    
3546 C CB   . ILE C 20  ? 0.450 0.406 0.491 -0.006 0.077  0.025  20  ILE LLL CB   
3547 C CG1  . ILE C 20  ? 0.470 0.406 0.486 -0.005 0.077  0.025  20  ILE LLL CG1  
3548 C CG2  . ILE C 20  ? 0.434 0.404 0.486 -0.006 0.068  0.025  20  ILE LLL CG2  
3549 C CD1  . ILE C 20  ? 0.473 0.406 0.479 -0.002 0.065  0.025  20  ILE LLL CD1  
3550 H H    . ILE C 20  ? 0.464 0.402 0.499 -0.007 0.096  0.024  20  ILE LLL H    
3551 H HA   . ILE C 20  ? 0.452 0.408 0.508 -0.009 0.089  0.025  20  ILE LLL HA   
3552 H HB   . ILE C 20  ? 0.449 0.406 0.490 -0.006 0.075  0.024  20  ILE LLL HB   
3553 H HG12 . ILE C 20  ? 0.472 0.407 0.488 -0.005 0.080  0.026  20  ILE LLL HG12 
3554 H HG13 . ILE C 20  ? 0.483 0.408 0.490 -0.004 0.084  0.025  20  ILE LLL HG13 
3555 H HG21 . ILE C 20  ? 0.425 0.404 0.489 -0.007 0.067  0.025  20  ILE LLL HG21 
3556 H HG22 . ILE C 20  ? 0.435 0.404 0.481 -0.005 0.062  0.026  20  ILE LLL HG22 
3557 H HG23 . ILE C 20  ? 0.435 0.405 0.487 -0.007 0.069  0.025  20  ILE LLL HG23 
3558 H HD11 . ILE C 20  ? 0.466 0.405 0.479 -0.002 0.062  0.024  20  ILE LLL HD11 
3559 H HD12 . ILE C 20  ? 0.490 0.407 0.478 -0.001 0.065  0.024  20  ILE LLL HD12 
3560 H HD13 . ILE C 20  ? 0.465 0.405 0.476 -0.003 0.061  0.025  20  ILE LLL HD13 
3561 N N    . SER C 21  ? 0.452 0.435 0.545 -0.010 0.081  0.023  21  SER LLL N    
3562 C CA   . SER C 21  ? 0.445 0.441 0.558 -0.009 0.076  0.021  21  SER LLL CA   
3563 C C    . SER C 21  ? 0.441 0.444 0.553 -0.007 0.066  0.022  21  SER LLL C    
3564 O O    . SER C 21  ? 0.434 0.434 0.534 -0.007 0.063  0.023  21  SER LLL O    
3565 C CB   . SER C 21  ? 0.450 0.446 0.584 -0.011 0.081  0.019  21  SER LLL CB   
3566 O OG   . SER C 21  ? 0.459 0.453 0.603 -0.012 0.090  0.018  21  SER LLL OG   
3567 H H    . SER C 21  ? 0.450 0.432 0.541 -0.010 0.080  0.023  21  SER LLL H    
3568 H HA   . SER C 21  ? 0.445 0.441 0.559 -0.009 0.077  0.021  21  SER LLL HA   
3569 H HB2  . SER C 21  ? 0.455 0.447 0.587 -0.011 0.085  0.019  21  SER LLL HB2  
3570 H HB3  . SER C 21  ? 0.444 0.447 0.588 -0.009 0.074  0.017  21  SER LLL HB3  
3572 N N    . CYS C 22  ? 0.451 0.460 0.571 -0.005 0.060  0.021  22  CYS LLL N    
3573 C CA   . CYS C 22  ? 0.459 0.471 0.573 -0.002 0.052  0.022  22  CYS LLL CA   
3574 C C    . CYS C 22  ? 0.454 0.468 0.579 0.000  0.046  0.020  22  CYS LLL C    
3575 O O    . CYS C 22  ? 0.464 0.480 0.592 0.001  0.046  0.019  22  CYS LLL O    
3576 C CB   . CYS C 22  ? 0.477 0.489 0.582 -0.002 0.053  0.024  22  CYS LLL CB   
3577 S SG   . CYS C 22  ? 0.500 0.514 0.599 0.002  0.048  0.027  22  CYS LLL SG   
3578 H H    . CYS C 22  ? 0.449 0.459 0.580 -0.006 0.061  0.019  22  CYS LLL H    
3579 H HA   . CYS C 22  ? 0.460 0.471 0.569 -0.001 0.051  0.023  22  CYS LLL HA   
3580 H HB2  . CYS C 22  ? 0.480 0.489 0.577 -0.003 0.055  0.025  22  CYS LLL HB2  
3581 H HB3  . CYS C 22  ? 0.478 0.490 0.587 -0.003 0.056  0.023  22  CYS LLL HB3  
3582 N N    . THR C 23  ? 0.447 0.460 0.578 0.002  0.041  0.017  23  THR LLL N    
3583 C CA   . THR C 23  ? 0.447 0.459 0.588 0.006  0.032  0.014  23  THR LLL CA   
3584 C C    . THR C 23  ? 0.447 0.454 0.571 0.011  0.025  0.016  23  THR LLL C    
3585 O O    . THR C 23  ? 0.436 0.440 0.546 0.013  0.025  0.018  23  THR LLL O    
3586 C CB   . THR C 23  ? 0.450 0.460 0.605 0.006  0.026  0.010  23  THR LLL CB   
3587 O OG1  . THR C 23  ? 0.449 0.462 0.621 0.001  0.036  0.010  23  THR LLL OG1  
3588 C CG2  . THR C 23  ? 0.454 0.460 0.621 0.010  0.014  0.006  23  THR LLL CG2  
3589 H H    . THR C 23  ? 0.449 0.461 0.578 0.002  0.041  0.018  23  THR LLL H    
3590 H HA   . THR C 23  ? 0.445 0.458 0.596 0.004  0.033  0.013  23  THR LLL HA   
3591 H HB   . THR C 23  ? 0.452 0.460 0.597 0.007  0.025  0.012  23  THR LLL HB   
3593 H HG21 . THR C 23  ? 0.461 0.462 0.614 0.015  0.007  0.006  23  THR LLL HG21 
3594 H HG22 . THR C 23  ? 0.455 0.461 0.638 0.010  0.012  0.003  23  THR LLL HG22 
3595 H HG23 . THR C 23  ? 0.453 0.461 0.627 0.010  0.015  0.005  23  THR LLL HG23 
3596 N N    . ALA C 24  ? 0.451 0.456 0.577 0.013  0.021  0.015  24  ALA LLL N    
3597 C CA   . ALA C 24  ? 0.461 0.457 0.569 0.019  0.016  0.017  24  ALA LLL CA   
3598 C C    . ALA C 24  ? 0.467 0.452 0.571 0.025  0.003  0.013  24  ALA LLL C    
3599 O O    . ALA C 24  ? 0.456 0.442 0.580 0.025  -0.004 0.008  24  ALA LLL O    
3600 C CB   . ALA C 24  ? 0.469 0.465 0.579 0.020  0.016  0.017  24  ALA LLL CB   
3601 H H    . ALA C 24  ? 0.448 0.455 0.585 0.012  0.022  0.013  24  ALA LLL H    
3602 H HA   . ALA C 24  ? 0.462 0.457 0.558 0.020  0.020  0.020  24  ALA LLL HA   
3603 H HB1  . ALA C 24  ? 0.476 0.464 0.574 0.024  0.013  0.018  24  ALA LLL HB1  
3604 H HB2  . ALA C 24  ? 0.460 0.461 0.570 0.016  0.023  0.020  24  ALA LLL HB2  
3605 H HB3  . ALA C 24  ? 0.465 0.463 0.589 0.019  0.013  0.014  24  ALA LLL HB3  
3606 N N    . ASN C 25  ? 0.487 0.461 0.568 0.031  0.001  0.015  25  ASN LLL N    
3607 C CA   . ASN C 25  ? 0.509 0.469 0.580 0.038  -0.012 0.012  25  ASN LLL CA   
3608 C C    . ASN C 25  ? 0.527 0.468 0.568 0.047  -0.015 0.014  25  ASN LLL C    
3609 O O    . ASN C 25  ? 0.539 0.477 0.562 0.048  -0.005 0.020  25  ASN LLL O    
3610 C CB   . ASN C 25  ? 0.522 0.483 0.589 0.037  -0.010 0.012  25  ASN LLL CB   
3611 C CG   . ASN C 25  ? 0.549 0.501 0.618 0.042  -0.024 0.007  25  ASN LLL CG   
3612 O OD1  . ASN C 25  ? 0.589 0.524 0.644 0.050  -0.036 0.004  25  ASN LLL OD1  
3613 N ND2  . ASN C 25  ? 0.543 0.504 0.631 0.037  -0.024 0.005  25  ASN LLL ND2  
3614 H H    . ASN C 25  ? 0.487 0.461 0.557 0.031  0.007  0.019  25  ASN LLL H    
3615 H HA   . ASN C 25  ? 0.510 0.470 0.596 0.038  -0.020 0.008  25  ASN LLL HA   
3616 H HB2  . ASN C 25  ? 0.508 0.481 0.589 0.031  -0.003 0.013  25  ASN LLL HB2  
3617 H HB3  . ASN C 25  ? 0.527 0.484 0.577 0.039  -0.005 0.016  25  ASN LLL HB3  
3620 N N    . GLY C 26  ? 0.541 0.469 0.579 0.053  -0.028 0.010  26  GLY LLL N    
3621 C CA   . GLY C 26  ? 0.565 0.469 0.570 0.062  -0.032 0.012  26  GLY LLL CA   
3622 C C    . GLY C 26  ? 0.559 0.464 0.562 0.061  -0.025 0.015  26  GLY LLL C    
3623 O O    . GLY C 26  ? 0.589 0.476 0.563 0.068  -0.022 0.019  26  GLY LLL O    
3624 H H    . GLY C 26  ? 0.537 0.468 0.592 0.051  -0.035 0.006  26  GLY LLL H    
3625 H HA2  . GLY C 26  ? 0.579 0.471 0.580 0.067  -0.045 0.008  26  GLY LLL HA2  
3626 H HA3  . GLY C 26  ? 0.573 0.471 0.560 0.065  -0.026 0.016  26  GLY LLL HA3  
3627 N N    . ALA C 27  ? 0.528 0.452 0.560 0.053  -0.022 0.014  27  ALA LLL N    
3628 C CA   . ALA C 27  ? 0.511 0.439 0.547 0.051  -0.018 0.016  27  ALA LLL CA   
3629 C C    . ALA C 27  ? 0.480 0.428 0.550 0.043  -0.017 0.013  27  ALA LLL C    
3630 O O    . ALA C 27  ? 0.459 0.419 0.546 0.038  -0.013 0.011  27  ALA LLL O    
3631 C CB   . ALA C 27  ? 0.504 0.434 0.526 0.049  -0.002 0.024  27  ALA LLL CB   
3632 H H    . ALA C 27  ? 0.513 0.449 0.564 0.048  -0.022 0.012  27  ALA LLL H    
3633 H HA   . ALA C 27  ? 0.527 0.441 0.552 0.057  -0.026 0.014  27  ALA LLL HA   
3634 H HB1  . ALA C 27  ? 0.505 0.435 0.529 0.049  -0.000 0.025  27  ALA LLL HB1  
3635 H HB2  . ALA C 27  ? 0.521 0.438 0.523 0.055  -0.001 0.026  27  ALA LLL HB2  
3636 H HB3  . ALA C 27  ? 0.489 0.433 0.524 0.044  0.005  0.025  27  ALA LLL HB3  
3637 N N    . HIS C 28  ? 0.475 0.422 0.553 0.043  -0.020 0.011  28  HIS LLL N    
3638 C CA   . HIS C 28  ? 0.462 0.427 0.572 0.036  -0.017 0.008  28  HIS LLL CA   
3639 C C    . HIS C 28  ? 0.453 0.432 0.565 0.029  -0.001 0.013  28  HIS LLL C    
3640 O O    . HIS C 28  ? 0.458 0.433 0.553 0.030  0.005  0.018  28  HIS LLL O    
3641 C CB   . HIS C 28  ? 0.470 0.428 0.586 0.039  -0.027 0.005  28  HIS LLL CB   
3642 C CG   . HIS C 28  ? 0.455 0.426 0.605 0.034  -0.026 0.000  28  HIS LLL CG   
3643 N ND1  . HIS C 28  ? 0.434 0.422 0.599 0.026  -0.012 0.002  28  HIS LLL ND1  
3644 C CD2  . HIS C 28  ? 0.460 0.430 0.633 0.036  -0.037 -0.006 28  HIS LLL CD2  
3645 C CE1  . HIS C 28  ? 0.425 0.419 0.618 0.024  -0.012 -0.003 28  HIS LLL CE1  
3646 N NE2  . HIS C 28  ? 0.437 0.422 0.638 0.029  -0.028 -0.008 28  HIS LLL NE2  
3647 H H    . HIS C 28  ? 0.490 0.427 0.555 0.048  -0.024 0.012  28  HIS LLL H    
3648 H HA   . HIS C 28  ? 0.458 0.427 0.583 0.035  -0.020 0.005  28  HIS LLL HA   
3649 H HB2  . HIS C 28  ? 0.485 0.430 0.593 0.045  -0.038 0.002  28  HIS LLL HB2  
3650 H HB3  . HIS C 28  ? 0.473 0.428 0.576 0.040  -0.022 0.008  28  HIS LLL HB3  
3652 H HD2  . HIS C 28  ? 0.471 0.430 0.640 0.041  -0.050 -0.009 28  HIS LLL HD2  
3653 H HE1  . HIS C 28  ? 0.416 0.419 0.621 0.019  -0.003 -0.002 28  HIS LLL HE1  
3655 N N    . ILE C 29  ? 0.442 0.434 0.575 0.023  0.005  0.012  29  ILE LLL N    
3656 C CA   . ILE C 29  ? 0.428 0.430 0.561 0.017  0.018  0.015  29  ILE LLL CA   
3657 C C    . ILE C 29  ? 0.415 0.420 0.549 0.015  0.022  0.017  29  ILE LLL C    
3658 O O    . ILE C 29  ? 0.415 0.423 0.543 0.013  0.030  0.021  29  ILE LLL O    
3659 C CB   . ILE C 29  ? 0.423 0.433 0.573 0.012  0.023  0.013  29  ILE LLL CB   
3660 C CG1  . ILE C 29  ? 0.415 0.430 0.559 0.007  0.035  0.016  29  ILE LLL CG1  
3661 C CG2  . ILE C 29  ? 0.424 0.437 0.599 0.010  0.022  0.008  29  ILE LLL CG2  
3662 C CD1  . ILE C 29  ? 0.416 0.430 0.545 0.008  0.036  0.020  29  ILE LLL CD1  
3663 H H    . ILE C 29  ? 0.439 0.433 0.586 0.022  0.001  0.008  29  ILE LLL H    
3664 H HA   . ILE C 29  ? 0.430 0.430 0.549 0.018  0.021  0.019  29  ILE LLL HA   
3665 H HB   . ILE C 29  ? 0.426 0.434 0.575 0.013  0.020  0.012  29  ILE LLL HB   
3666 H HG12 . ILE C 29  ? 0.412 0.430 0.567 0.004  0.039  0.015  29  ILE LLL HG12 
3667 H HG13 . ILE C 29  ? 0.414 0.430 0.556 0.007  0.037  0.018  29  ILE LLL HG13 
3668 H HG21 . ILE C 29  ? 0.429 0.438 0.608 0.014  0.013  0.005  29  ILE LLL HG21 
3669 H HG22 . ILE C 29  ? 0.419 0.436 0.604 0.007  0.027  0.007  29  ILE LLL HG22 
3670 H HG23 . ILE C 29  ? 0.421 0.436 0.597 0.009  0.025  0.009  29  ILE LLL HG23 
3671 H HD11 . ILE C 29  ? 0.421 0.431 0.540 0.011  0.033  0.022  29  ILE LLL HD11 
3672 H HD12 . ILE C 29  ? 0.413 0.429 0.538 0.005  0.041  0.022  29  ILE LLL HD12 
3673 H HD13 . ILE C 29  ? 0.417 0.430 0.547 0.008  0.035  0.019  29  ILE LLL HD13 
3674 N N    . GLY C 30  ? 0.411 0.413 0.555 0.017  0.016  0.014  30  GLY LLL N    
3675 C CA   . GLY C 30  ? 0.405 0.410 0.554 0.016  0.019  0.014  30  GLY LLL CA   
3676 C C    . GLY C 30  ? 0.409 0.404 0.540 0.020  0.016  0.018  30  GLY LLL C    
3677 O O    . GLY C 30  ? 0.405 0.402 0.538 0.019  0.018  0.019  30  GLY LLL O    
3678 H H    . GLY C 30  ? 0.417 0.416 0.567 0.019  0.009  0.010  30  GLY LLL H    
3679 H HA2  . GLY C 30  ? 0.397 0.408 0.547 0.012  0.027  0.016  30  GLY LLL HA2  
3680 H HA3  . GLY C 30  ? 0.403 0.410 0.566 0.016  0.016  0.011  30  GLY LLL HA3  
3681 N N    . ASP C 31  ? 0.421 0.405 0.533 0.025  0.012  0.020  31  ASP LLL N    
3682 C CA   . ASP C 31  ? 0.437 0.407 0.527 0.031  0.011  0.024  31  ASP LLL CA   
3683 C C    . ASP C 31  ? 0.436 0.411 0.522 0.028  0.023  0.030  31  ASP LLL C    
3684 O O    . ASP C 31  ? 0.451 0.418 0.526 0.030  0.026  0.034  31  ASP LLL O    
3685 C CB   . ASP C 31  ? 0.449 0.402 0.518 0.038  0.004  0.024  31  ASP LLL CB   
3686 C CG   . ASP C 31  ? 0.463 0.396 0.506 0.046  0.002  0.027  31  ASP LLL CG   
3687 O OD1  . ASP C 31  ? 0.455 0.385 0.501 0.046  0.000  0.027  31  ASP LLL OD1  
3688 O OD2  . ASP C 31  ? 0.473 0.391 0.492 0.051  0.003  0.030  31  ASP LLL OD2  
3689 H H    . ASP C 31  ? 0.423 0.406 0.534 0.026  0.009  0.019  31  ASP LLL H    
3690 H HA   . ASP C 31  ? 0.440 0.407 0.534 0.032  0.006  0.022  31  ASP LLL HA   
3691 H HB2  . ASP C 31  ? 0.450 0.402 0.526 0.039  -0.004 0.020  31  ASP LLL HB2  
3692 H HB3  . ASP C 31  ? 0.446 0.402 0.510 0.037  0.010  0.027  31  ASP LLL HB3  
3693 N N    . SER C 32  ? 0.427 0.413 0.520 0.023  0.030  0.031  32  SER LLL N    
3694 C CA   . SER C 32  ? 0.427 0.418 0.519 0.020  0.039  0.035  32  SER LLL CA   
3695 C C    . SER C 32  ? 0.415 0.419 0.522 0.014  0.042  0.034  32  SER LLL C    
3696 O O    . SER C 32  ? 0.434 0.441 0.547 0.012  0.040  0.030  32  SER LLL O    
3697 C CB   . SER C 32  ? 0.440 0.423 0.518 0.023  0.043  0.039  32  SER LLL CB   
3698 O OG   . SER C 32  ? 0.439 0.430 0.523 0.020  0.051  0.042  32  SER LLL OG   
3699 H H    . SER C 32  ? 0.421 0.413 0.522 0.021  0.028  0.028  32  SER LLL H    
3700 H HA   . SER C 32  ? 0.430 0.418 0.521 0.020  0.041  0.038  32  SER LLL HA   
3701 H HB2  . SER C 32  ? 0.453 0.426 0.519 0.027  0.043  0.041  32  SER LLL HB2  
3702 H HB3  . SER C 32  ? 0.441 0.424 0.518 0.024  0.039  0.037  32  SER LLL HB3  
3704 N N    . TYR C 33  ? 0.416 0.424 0.527 0.011  0.047  0.036  33  TYR LLL N    
3705 C CA   . TYR C 33  ? 0.407 0.422 0.526 0.006  0.049  0.034  33  TYR LLL CA   
3706 C C    . TYR C 33  ? 0.390 0.406 0.506 0.005  0.050  0.034  33  TYR LLL C    
3707 O O    . TYR C 33  ? 0.390 0.403 0.499 0.008  0.051  0.037  33  TYR LLL O    
3708 C CB   . TYR C 33  ? 0.417 0.432 0.541 0.005  0.052  0.037  33  TYR LLL CB   
3709 C CG   . TYR C 33  ? 0.431 0.446 0.559 0.006  0.051  0.037  33  TYR LLL CG   
3710 C CD1  . TYR C 33  ? 0.441 0.457 0.573 0.005  0.048  0.033  33  TYR LLL CD1  
3711 C CD2  . TYR C 33  ? 0.449 0.460 0.578 0.007  0.053  0.041  33  TYR LLL CD2  
3712 C CE1  . TYR C 33  ? 0.449 0.463 0.584 0.006  0.046  0.032  33  TYR LLL CE1  
3713 C CE2  . TYR C 33  ? 0.457 0.466 0.589 0.008  0.052  0.041  33  TYR LLL CE2  
3714 C CZ   . TYR C 33  ? 0.453 0.464 0.587 0.007  0.048  0.036  33  TYR LLL CZ   
3715 O OH   . TYR C 33  ? 0.461 0.470 0.599 0.008  0.046  0.036  33  TYR LLL OH   
3716 H H    . TYR C 33  ? 0.418 0.423 0.527 0.012  0.050  0.039  33  TYR LLL H    
3717 H HA   . TYR C 33  ? 0.404 0.420 0.528 0.005  0.048  0.031  33  TYR LLL HA   
3718 H HB2  . TYR C 33  ? 0.419 0.433 0.542 0.006  0.054  0.040  33  TYR LLL HB2  
3719 H HB3  . TYR C 33  ? 0.414 0.432 0.541 0.003  0.051  0.035  33  TYR LLL HB3  
3720 H HD1  . TYR C 33  ? 0.438 0.456 0.571 0.004  0.048  0.030  33  TYR LLL HD1  
3721 H HD2  . TYR C 33  ? 0.449 0.459 0.578 0.008  0.056  0.044  33  TYR LLL HD2  
3722 H HE1  . TYR C 33  ? 0.446 0.461 0.585 0.005  0.045  0.030  33  TYR LLL HE1  
3723 H HE2  . TYR C 33  ? 0.459 0.465 0.591 0.009  0.054  0.044  33  TYR LLL HE2  
3725 N N    . VAL C 34  ? 0.369 0.387 0.487 0.003  0.051  0.032  34  VAL LLL N    
3726 C CA   . VAL C 34  ? 0.361 0.380 0.476 0.001  0.052  0.031  34  VAL LLL CA   
3727 C C    . VAL C 34  ? 0.349 0.366 0.463 -0.000 0.052  0.031  34  VAL LLL C    
3728 O O    . VAL C 34  ? 0.345 0.360 0.460 -0.002 0.052  0.029  34  VAL LLL O    
3729 C CB   . VAL C 34  ? 0.369 0.388 0.484 0.001  0.052  0.028  34  VAL LLL CB   
3730 C CG1  . VAL C 34  ? 0.368 0.385 0.477 -0.001 0.053  0.028  34  VAL LLL CG1  
3731 C CG2  . VAL C 34  ? 0.374 0.392 0.491 0.003  0.049  0.027  34  VAL LLL CG2  
3732 H H    . VAL C 34  ? 0.370 0.389 0.492 0.001  0.051  0.030  34  VAL LLL H    
3733 H HA   . VAL C 34  ? 0.363 0.381 0.475 0.003  0.052  0.033  34  VAL LLL HA   
3734 H HB   . VAL C 34  ? 0.368 0.386 0.486 -0.001 0.054  0.026  34  VAL LLL HB   
3735 H HG11 . VAL C 34  ? 0.371 0.385 0.478 -0.002 0.054  0.028  34  VAL LLL HG11 
3736 H HG12 . VAL C 34  ? 0.369 0.386 0.480 -0.001 0.053  0.027  34  VAL LLL HG12 
3737 H HG13 . VAL C 34  ? 0.369 0.386 0.475 0.001  0.052  0.030  34  VAL LLL HG13 
3738 H HG21 . VAL C 34  ? 0.375 0.392 0.487 0.005  0.047  0.029  34  VAL LLL HG21 
3739 H HG22 . VAL C 34  ? 0.373 0.391 0.494 0.002  0.049  0.025  34  VAL LLL HG22 
3740 H HG23 . VAL C 34  ? 0.373 0.392 0.494 0.004  0.048  0.027  34  VAL LLL HG23 
3741 N N    . GLN C 35  ? 0.344 0.360 0.457 -0.000 0.051  0.033  35  GLN LLL N    
3742 C CA   . GLN C 35  ? 0.346 0.358 0.459 -0.001 0.048  0.032  35  GLN LLL CA   
3743 C C    . GLN C 35  ? 0.353 0.362 0.458 -0.002 0.047  0.030  35  GLN LLL C    
3744 O O    . GLN C 35  ? 0.357 0.369 0.460 -0.001 0.049  0.031  35  GLN LLL O    
3745 C CB   . GLN C 35  ? 0.340 0.355 0.464 -0.000 0.047  0.034  35  GLN LLL CB   
3746 C CG   . GLN C 35  ? 0.343 0.353 0.473 -0.001 0.040  0.033  35  GLN LLL CG   
3747 C CD   . GLN C 35  ? 0.341 0.354 0.489 -0.001 0.040  0.035  35  GLN LLL CD   
3748 O OE1  . GLN C 35  ? 0.352 0.361 0.507 -0.001 0.034  0.033  35  GLN LLL OE1  
3749 N NE2  . GLN C 35  ? 0.339 0.357 0.494 0.000  0.046  0.039  35  GLN LLL NE2  
3750 H H    . GLN C 35  ? 0.344 0.362 0.457 0.001  0.052  0.034  35  GLN LLL H    
3751 H HA   . GLN C 35  ? 0.349 0.358 0.461 -0.002 0.047  0.030  35  GLN LLL HA   
3752 H HB2  . GLN C 35  ? 0.339 0.356 0.469 -0.000 0.049  0.036  35  GLN LLL HB2  
3753 H HB3  . GLN C 35  ? 0.340 0.356 0.465 0.000  0.048  0.036  35  GLN LLL HB3  
3754 H HG2  . GLN C 35  ? 0.346 0.354 0.472 -0.001 0.038  0.032  35  GLN LLL HG2  
3755 H HG3  . GLN C 35  ? 0.347 0.353 0.471 -0.001 0.038  0.030  35  GLN LLL HG3  
3758 N N    . TRP C 36  ? 0.363 0.363 0.460 -0.002 0.044  0.028  36  TRP LLL N    
3759 C CA   . TRP C 36  ? 0.372 0.366 0.459 -0.002 0.042  0.027  36  TRP LLL CA   
3760 C C    . TRP C 36  ? 0.375 0.363 0.464 -0.000 0.034  0.026  36  TRP LLL C    
3761 O O    . TRP C 36  ? 0.367 0.349 0.456 0.000  0.029  0.025  36  TRP LLL O    
3762 C CB   . TRP C 36  ? 0.386 0.369 0.458 -0.002 0.046  0.025  36  TRP LLL CB   
3763 C CG   . TRP C 36  ? 0.379 0.368 0.455 -0.003 0.053  0.025  36  TRP LLL CG   
3764 C CD1  . TRP C 36  ? 0.373 0.366 0.456 -0.004 0.057  0.025  36  TRP LLL CD1  
3765 C CD2  . TRP C 36  ? 0.376 0.368 0.452 -0.004 0.056  0.026  36  TRP LLL CD2  
3766 N NE1  . TRP C 36  ? 0.368 0.365 0.457 -0.004 0.061  0.024  36  TRP LLL NE1  
3767 C CE2  . TRP C 36  ? 0.370 0.367 0.456 -0.005 0.061  0.025  36  TRP LLL CE2  
3768 C CE3  . TRP C 36  ? 0.381 0.370 0.451 -0.004 0.055  0.026  36  TRP LLL CE3  
3769 C CZ2  . TRP C 36  ? 0.367 0.367 0.458 -0.005 0.063  0.024  36  TRP LLL CZ2  
3770 C CZ3  . TRP C 36  ? 0.377 0.369 0.450 -0.005 0.058  0.026  36  TRP LLL CZ3  
3771 C CH2  . TRP C 36  ? 0.370 0.367 0.454 -0.005 0.062  0.025  36  TRP LLL CH2  
3772 H H    . TRP C 36  ? 0.367 0.363 0.464 -0.002 0.042  0.027  36  TRP LLL H    
3773 H HA   . TRP C 36  ? 0.367 0.365 0.456 -0.002 0.044  0.028  36  TRP LLL HA   
3774 H HB2  . TRP C 36  ? 0.391 0.368 0.459 -0.001 0.045  0.024  36  TRP LLL HB2  
3775 H HB3  . TRP C 36  ? 0.392 0.368 0.455 -0.001 0.045  0.024  36  TRP LLL HB3  
3776 H HD1  . TRP C 36  ? 0.374 0.367 0.459 -0.003 0.056  0.025  36  TRP LLL HD1  
3777 H HE1  . TRP C 36  ? 0.366 0.367 0.462 -0.005 0.063  0.024  36  TRP LLL HE1  
3778 H HE3  . TRP C 36  ? 0.383 0.369 0.449 -0.003 0.051  0.026  36  TRP LLL HE3  
3779 H HZ2  . TRP C 36  ? 0.365 0.368 0.465 -0.006 0.065  0.023  36  TRP LLL HZ2  
3780 H HZ3  . TRP C 36  ? 0.378 0.369 0.448 -0.004 0.057  0.026  36  TRP LLL HZ3  
3781 H HH2  . TRP C 36  ? 0.369 0.368 0.458 -0.006 0.063  0.025  36  TRP LLL HH2  
3782 N N    . PHE C 37  ? 0.382 0.372 0.474 -0.000 0.032  0.027  37  PHE LLL N    
3783 C CA   . PHE C 37  ? 0.397 0.381 0.494 0.001  0.023  0.025  37  PHE LLL CA   
3784 C C    . PHE C 37  ? 0.416 0.388 0.495 0.002  0.019  0.023  37  PHE LLL C    
3785 O O    . PHE C 37  ? 0.418 0.392 0.490 0.002  0.024  0.024  37  PHE LLL O    
3786 C CB   . PHE C 37  ? 0.390 0.385 0.507 0.001  0.025  0.028  37  PHE LLL CB   
3787 C CG   . PHE C 37  ? 0.382 0.386 0.514 0.001  0.030  0.031  37  PHE LLL CG   
3788 C CD1  . PHE C 37  ? 0.385 0.388 0.527 0.001  0.027  0.030  37  PHE LLL CD1  
3789 C CD2  . PHE C 37  ? 0.377 0.390 0.514 0.001  0.039  0.034  37  PHE LLL CD2  
3790 C CE1  . PHE C 37  ? 0.382 0.392 0.537 0.001  0.033  0.033  37  PHE LLL CE1  
3791 C CE2  . PHE C 37  ? 0.379 0.396 0.527 0.002  0.045  0.038  37  PHE LLL CE2  
3792 C CZ   . PHE C 37  ? 0.379 0.395 0.537 0.001  0.042  0.037  37  PHE LLL CZ   
3793 H H    . PHE C 37  ? 0.378 0.372 0.469 -0.000 0.035  0.028  37  PHE LLL H    
3794 H HA   . PHE C 37  ? 0.401 0.381 0.501 0.002  0.018  0.024  37  PHE LLL HA   
3795 H HB2  . PHE C 37  ? 0.387 0.385 0.499 0.001  0.028  0.029  37  PHE LLL HB2  
3796 H HB3  . PHE C 37  ? 0.393 0.385 0.516 0.002  0.019  0.027  37  PHE LLL HB3  
3797 H HD1  . PHE C 37  ? 0.392 0.388 0.529 0.001  0.021  0.028  37  PHE LLL HD1  
3798 H HD2  . PHE C 37  ? 0.378 0.391 0.509 0.002  0.040  0.035  37  PHE LLL HD2  
3799 H HE1  . PHE C 37  ? 0.382 0.392 0.544 0.000  0.031  0.033  37  PHE LLL HE1  
3800 H HE2  . PHE C 37  ? 0.377 0.396 0.523 0.003  0.050  0.040  37  PHE LLL HE2  
3801 H HZ   . PHE C 37  ? 0.377 0.395 0.541 0.002  0.047  0.040  37  PHE LLL HZ   
3802 N N    . GLN C 38  ? 0.431 0.387 0.500 0.005  0.009  0.020  38  GLN LLL N    
3803 C CA   . GLN C 38  ? 0.448 0.387 0.498 0.007  0.003  0.017  38  GLN LLL CA   
3804 C C    . GLN C 38  ? 0.443 0.383 0.510 0.008  -0.008 0.016  38  GLN LLL C    
3805 O O    . GLN C 38  ? 0.443 0.386 0.529 0.009  -0.016 0.015  38  GLN LLL O    
3806 C CB   . GLN C 38  ? 0.478 0.394 0.503 0.010  -0.002 0.014  38  GLN LLL CB   
3807 C CG   . GLN C 38  ? 0.504 0.397 0.503 0.013  -0.010 0.012  38  GLN LLL CG   
3808 C CD   . GLN C 38  ? 0.536 0.402 0.508 0.018  -0.016 0.008  38  GLN LLL CD   
3809 O OE1  . GLN C 38  ? 0.540 0.401 0.520 0.020  -0.028 0.005  38  GLN LLL OE1  
3810 N NE2  . GLN C 38  ? 0.563 0.411 0.504 0.019  -0.007 0.009  38  GLN LLL NE2  
3811 H H    . GLN C 38  ? 0.434 0.387 0.507 0.005  0.005  0.019  38  GLN LLL H    
3812 H HA   . GLN C 38  ? 0.447 0.387 0.489 0.006  0.009  0.019  38  GLN LLL HA   
3813 H HB2  . GLN C 38  ? 0.477 0.393 0.493 0.009  0.007  0.016  38  GLN LLL HB2  
3814 H HB3  . GLN C 38  ? 0.478 0.393 0.511 0.011  -0.008 0.013  38  GLN LLL HB3  
3815 H HG2  . GLN C 38  ? 0.503 0.397 0.512 0.014  -0.019 0.010  38  GLN LLL HG2  
3816 H HG3  . GLN C 38  ? 0.505 0.397 0.494 0.012  -0.002 0.013  38  GLN LLL HG3  
3819 N N    . GLN C 39  ? 0.443 0.382 0.506 0.009  -0.010 0.016  39  GLN LLL N    
3820 C CA   . GLN C 39  ? 0.455 0.391 0.532 0.011  -0.022 0.013  39  GLN LLL CA   
3821 C C    . GLN C 39  ? 0.498 0.413 0.548 0.013  -0.030 0.010  39  GLN LLL C    
3822 O O    . GLN C 39  ? 0.494 0.410 0.530 0.012  -0.022 0.013  39  GLN LLL O    
3823 C CB   . GLN C 39  ? 0.425 0.380 0.527 0.009  -0.015 0.016  39  GLN LLL CB   
3824 C CG   . GLN C 39  ? 0.418 0.372 0.538 0.011  -0.026 0.014  39  GLN LLL CG   
3825 C CD   . GLN C 39  ? 0.391 0.362 0.538 0.009  -0.018 0.017  39  GLN LLL CD   
3826 O OE1  . GLN C 39  ? 0.384 0.364 0.525 0.008  -0.006 0.020  39  GLN LLL OE1  
3827 N NE2  . GLN C 39  ? 0.379 0.355 0.558 0.010  -0.023 0.015  39  GLN LLL NE2  
3828 H H    . GLN C 39  ? 0.444 0.384 0.497 0.008  -0.004 0.017  39  GLN LLL H    
3829 H HA   . GLN C 39  ? 0.459 0.392 0.546 0.012  -0.030 0.011  39  GLN LLL HA   
3830 H HB2  . GLN C 39  ? 0.415 0.380 0.532 0.007  -0.011 0.018  39  GLN LLL HB2  
3831 H HB3  . GLN C 39  ? 0.422 0.380 0.514 0.008  -0.008 0.018  39  GLN LLL HB3  
3832 H HG2  . GLN C 39  ? 0.427 0.371 0.531 0.012  -0.030 0.012  39  GLN LLL HG2  
3833 H HG3  . GLN C 39  ? 0.425 0.372 0.553 0.012  -0.036 0.011  39  GLN LLL HG3  
3836 N N    . ARG C 40  ? 0.542 0.436 0.582 0.018  -0.046 0.006  40  ARG LLL N    
3837 C CA   . ARG C 40  ? 0.582 0.451 0.594 0.022  -0.056 0.003  40  ARG LLL CA   
3838 C C    . ARG C 40  ? 0.581 0.457 0.615 0.022  -0.065 0.001  40  ARG LLL C    
3839 O O    . ARG C 40  ? 0.556 0.448 0.627 0.021  -0.068 0.001  40  ARG LLL O    
3840 C CB   . ARG C 40  ? 0.626 0.466 0.616 0.027  -0.072 -0.002 40  ARG LLL CB   
3841 C CG   . ARG C 40  ? 0.644 0.478 0.618 0.027  -0.064 -0.001 40  ARG LLL CG   
3842 C CD   . ARG C 40  ? 0.697 0.493 0.628 0.034  -0.073 -0.005 40  ARG LLL CD   
3843 N NE   . ARG C 40  ? 0.711 0.504 0.634 0.034  -0.067 -0.005 40  ARG LLL NE   
3844 C CZ   . ARG C 40  ? 0.735 0.518 0.663 0.038  -0.081 -0.009 40  ARG LLL CZ   
3845 N NH1  . ARG C 40  ? 0.753 0.528 0.695 0.041  -0.103 -0.014 40  ARG LLL NH1  
3846 N NH2  . ARG C 40  ? 0.736 0.518 0.656 0.038  -0.074 -0.008 40  ARG LLL NH2  
3847 H H    . ARG C 40  ? 0.541 0.434 0.591 0.019  -0.052 0.004  40  ARG LLL H    
3848 H HA   . ARG C 40  ? 0.587 0.452 0.579 0.021  -0.047 0.005  40  ARG LLL HA   
3849 H HB2  . ARG C 40  ? 0.624 0.466 0.635 0.029  -0.083 -0.005 40  ARG LLL HB2  
3850 H HB3  . ARG C 40  ? 0.646 0.466 0.612 0.030  -0.077 -0.004 40  ARG LLL HB3  
3851 H HG2  . ARG C 40  ? 0.633 0.477 0.604 0.024  -0.050 0.002  40  ARG LLL HG2  
3852 H HG3  . ARG C 40  ? 0.633 0.478 0.629 0.027  -0.067 -0.002 40  ARG LLL HG3  
3853 H HD2  . ARG C 40  ? 0.710 0.494 0.641 0.038  -0.089 -0.009 40  ARG LLL HD2  
3854 H HD3  . ARG C 40  ? 0.707 0.493 0.615 0.035  -0.066 -0.004 40  ARG LLL HD3  
3855 H HE   . ARG C 40  ? 0.708 0.506 0.624 0.032  -0.054 -0.002 40  ARG LLL HE   
3856 H HH11 . ARG C 40  ? 0.747 0.524 0.696 0.042  -0.108 -0.015 40  ARG LLL HH11 
3857 H HH12 . ARG C 40  ? 0.756 0.525 0.703 0.044  -0.113 -0.017 40  ARG LLL HH12 
3858 H HH21 . ARG C 40  ? 0.731 0.518 0.644 0.035  -0.060 -0.005 40  ARG LLL HH21 
3859 H HH22 . ARG C 40  ? 0.744 0.519 0.666 0.040  -0.084 -0.011 40  ARG LLL HH22 
3860 N N    . PRO C 41  ? 0.607 0.470 0.621 0.024  -0.068 0.000  41  PRO LLL N    
3861 C CA   . PRO C 41  ? 0.604 0.474 0.640 0.024  -0.076 -0.001 41  PRO LLL CA   
3862 C C    . PRO C 41  ? 0.619 0.481 0.678 0.028  -0.096 -0.007 41  PRO LLL C    
3863 O O    . PRO C 41  ? 0.653 0.491 0.691 0.033  -0.110 -0.011 41  PRO LLL O    
3864 C CB   . PRO C 41  ? 0.628 0.478 0.630 0.027  -0.078 -0.002 41  PRO LLL CB   
3865 C CG   . PRO C 41  ? 0.655 0.479 0.615 0.029  -0.076 -0.002 41  PRO LLL CG   
3866 C CD   . PRO C 41  ? 0.635 0.474 0.606 0.026  -0.064 0.001  41  PRO LLL CD   
3867 H HA   . PRO C 41  ? 0.585 0.475 0.640 0.021  -0.066 0.002  41  PRO LLL HA   
3868 H HB2  . PRO C 41  ? 0.637 0.478 0.642 0.030  -0.091 -0.005 41  PRO LLL HB2  
3869 H HB3  . PRO C 41  ? 0.615 0.476 0.618 0.024  -0.067 0.002  41  PRO LLL HB3  
3870 H HG2  . PRO C 41  ? 0.675 0.479 0.624 0.034  -0.090 -0.006 41  PRO LLL HG2  
3871 H HG3  . PRO C 41  ? 0.661 0.478 0.601 0.029  -0.069 0.000  41  PRO LLL HG3  
3872 H HD2  . PRO C 41  ? 0.652 0.475 0.605 0.029  -0.068 -0.001 41  PRO LLL HD2  
3873 H HD3  . PRO C 41  ? 0.625 0.474 0.592 0.023  -0.050 0.005  41  PRO LLL HD3  
3874 N N    . GLY C 42  ? 0.596 0.479 0.699 0.026  -0.097 -0.007 42  GLY LLL N    
3875 C CA   . GLY C 42  ? 0.594 0.474 0.730 0.029  -0.115 -0.013 42  GLY LLL CA   
3876 C C    . GLY C 42  ? 0.579 0.474 0.744 0.027  -0.110 -0.011 42  GLY LLL C    
3877 O O    . GLY C 42  ? 0.568 0.479 0.779 0.026  -0.109 -0.011 42  GLY LLL O    
3878 H H    . GLY C 42  ? 0.579 0.478 0.693 0.024  -0.085 -0.004 42  GLY LLL H    
3879 H HA2  . GLY C 42  ? 0.587 0.476 0.746 0.029  -0.116 -0.013 42  GLY LLL HA2  
3880 H HA3  . GLY C 42  ? 0.617 0.476 0.736 0.033  -0.130 -0.017 42  GLY LLL HA3  
3881 N N    . SER C 43  ? 0.584 0.473 0.726 0.026  -0.105 -0.010 43  SER LLL N    
3882 C CA   . SER C 43  ? 0.572 0.470 0.737 0.025  -0.103 -0.009 43  SER LLL CA   
3883 C C    . SER C 43  ? 0.523 0.449 0.707 0.020  -0.080 -0.002 43  SER LLL C    
3884 O O    . SER C 43  ? 0.504 0.440 0.678 0.017  -0.066 0.002  43  SER LLL O    
3885 C CB   . SER C 43  ? 0.600 0.477 0.731 0.028  -0.110 -0.012 43  SER LLL CB   
3886 O OG   . SER C 43  ? 0.605 0.482 0.701 0.026  -0.093 -0.007 43  SER LLL OG   
3887 H H    . SER C 43  ? 0.593 0.472 0.704 0.027  -0.102 -0.009 43  SER LLL H    
3888 H HA   . SER C 43  ? 0.570 0.469 0.764 0.026  -0.114 -0.013 43  SER LLL HA   
3889 H HB2  . SER C 43  ? 0.594 0.477 0.742 0.027  -0.111 -0.012 43  SER LLL HB2  
3890 H HB3  . SER C 43  ? 0.621 0.478 0.737 0.032  -0.125 -0.016 43  SER LLL HB3  
3892 N N    . ALA C 44  ? 0.497 0.433 0.706 0.018  -0.077 -0.001 44  ALA LLL N    
3893 C CA   . ALA C 44  ? 0.460 0.417 0.683 0.014  -0.056 0.005  44  ALA LLL CA   
3894 C C    . ALA C 44  ? 0.449 0.404 0.639 0.012  -0.047 0.008  44  ALA LLL C    
3895 O O    . ALA C 44  ? 0.464 0.401 0.627 0.015  -0.057 0.005  44  ALA LLL O    
3896 C CB   . ALA C 44  ? 0.450 0.417 0.716 0.013  -0.058 0.005  44  ALA LLL CB   
3897 H H    . ALA C 44  ? 0.505 0.434 0.723 0.020  -0.088 -0.005 44  ALA LLL H    
3898 H HA   . ALA C 44  ? 0.452 0.418 0.679 0.013  -0.048 0.008  44  ALA LLL HA   
3899 H HB1  . ALA C 44  ? 0.439 0.417 0.712 0.011  -0.044 0.010  44  ALA LLL HB1  
3900 H HB2  . ALA C 44  ? 0.450 0.418 0.741 0.014  -0.063 0.003  44  ALA LLL HB2  
3901 H HB3  . ALA C 44  ? 0.459 0.417 0.722 0.014  -0.067 0.002  44  ALA LLL HB3  
3902 N N    . PRO C 45  ? 0.426 0.397 0.616 0.009  -0.029 0.014  45  PRO LLL N    
3903 C CA   . PRO C 45  ? 0.427 0.396 0.589 0.008  -0.021 0.016  45  PRO LLL CA   
3904 C C    . PRO C 45  ? 0.431 0.399 0.601 0.008  -0.024 0.015  45  PRO LLL C    
3905 O O    . PRO C 45  ? 0.420 0.394 0.620 0.008  -0.026 0.015  45  PRO LLL O    
3906 C CB   . PRO C 45  ? 0.409 0.394 0.574 0.006  -0.004 0.021  45  PRO LLL CB   
3907 C CG   . PRO C 45  ? 0.404 0.396 0.591 0.006  -0.003 0.022  45  PRO LLL CG   
3908 C CD   . PRO C 45  ? 0.410 0.397 0.623 0.008  -0.016 0.018  45  PRO LLL CD   
3909 H HA   . PRO C 45  ? 0.437 0.396 0.577 0.009  -0.024 0.014  45  PRO LLL HA   
3910 H HB2  . PRO C 45  ? 0.403 0.395 0.576 0.005  0.002  0.023  45  PRO LLL HB2  
3911 H HB3  . PRO C 45  ? 0.411 0.394 0.556 0.005  -0.000 0.022  45  PRO LLL HB3  
3912 H HG2  . PRO C 45  ? 0.395 0.397 0.593 0.005  0.007  0.026  45  PRO LLL HG2  
3913 H HG3  . PRO C 45  ? 0.406 0.396 0.582 0.007  -0.003 0.022  45  PRO LLL HG3  
3914 H HD2  . PRO C 45  ? 0.404 0.398 0.638 0.007  -0.013 0.020  45  PRO LLL HD2  
3915 H HD3  . PRO C 45  ? 0.410 0.398 0.634 0.008  -0.019 0.017  45  PRO LLL HD3  
3916 N N    . ARG C 46  ? 0.446 0.405 0.589 0.008  -0.023 0.014  46  ARG LLL N    
3917 C CA   . ARG C 46  ? 0.456 0.414 0.601 0.008  -0.023 0.014  46  ARG LLL CA   
3918 C C    . ARG C 46  ? 0.448 0.412 0.576 0.006  -0.009 0.017  46  ARG LLL C    
3919 O O    . ARG C 46  ? 0.452 0.414 0.560 0.005  -0.003 0.018  46  ARG LLL O    
3920 C CB   . ARG C 46  ? 0.486 0.422 0.614 0.012  -0.039 0.008  46  ARG LLL CB   
3921 C CG   . ARG C 46  ? 0.515 0.432 0.602 0.014  -0.038 0.007  46  ARG LLL CG   
3922 C CD   . ARG C 46  ? 0.553 0.445 0.618 0.019  -0.051 0.002  46  ARG LLL CD   
3923 N NE   . ARG C 46  ? 0.589 0.461 0.613 0.021  -0.047 0.001  46  ARG LLL NE   
3924 C CZ   . ARG C 46  ? 0.620 0.469 0.612 0.025  -0.048 -0.001 46  ARG LLL CZ   
3925 N NH1  . ARG C 46  ? 0.638 0.481 0.633 0.027  -0.054 -0.003 46  ARG LLL NH1  
3926 N NH2  . ARG C 46  ? 0.635 0.465 0.592 0.027  -0.041 -0.001 46  ARG LLL NH2  
3927 H H    . ARG C 46  ? 0.453 0.406 0.575 0.009  -0.021 0.014  46  ARG LLL H    
3928 H HA   . ARG C 46  ? 0.447 0.414 0.616 0.007  -0.022 0.015  46  ARG LLL HA   
3929 H HB2  . ARG C 46  ? 0.487 0.423 0.619 0.012  -0.039 0.008  46  ARG LLL HB2  
3930 H HB3  . ARG C 46  ? 0.492 0.423 0.632 0.014  -0.049 0.006  46  ARG LLL HB3  
3931 H HG2  . ARG C 46  ? 0.518 0.433 0.601 0.015  -0.040 0.007  46  ARG LLL HG2  
3932 H HG3  . ARG C 46  ? 0.509 0.432 0.588 0.012  -0.027 0.010  46  ARG LLL HG3  
3933 H HD2  . ARG C 46  ? 0.552 0.446 0.620 0.018  -0.049 0.002  46  ARG LLL HD2  
3934 H HD3  . ARG C 46  ? 0.562 0.446 0.636 0.021  -0.064 -0.002 46  ARG LLL HD3  
3935 H HE   . ARG C 46  ? 0.585 0.459 0.605 0.020  -0.044 0.002  46  ARG LLL HE   
3936 H HH11 . ARG C 46  ? 0.620 0.475 0.639 0.025  -0.058 -0.003 46  ARG LLL HH11 
3937 H HH12 . ARG C 46  ? 0.650 0.477 0.623 0.030  -0.054 -0.005 46  ARG LLL HH12 
3938 H HH21 . ARG C 46  ? 0.633 0.466 0.588 0.026  -0.037 0.001  46  ARG LLL HH21 
3939 H HH22 . ARG C 46  ? 0.655 0.468 0.590 0.030  -0.040 -0.002 46  ARG LLL HH22 
3940 N N    . SER C 47  ? 0.438 0.409 0.576 0.005  -0.005 0.019  47  SER LLL N    
3941 C CA   . SER C 47  ? 0.435 0.409 0.558 0.003  0.006  0.021  47  SER LLL CA   
3942 C C    . SER C 47  ? 0.451 0.408 0.546 0.005  0.002  0.017  47  SER LLL C    
3943 O O    . SER C 47  ? 0.466 0.408 0.555 0.008  -0.009 0.014  47  SER LLL O    
3944 C CB   . SER C 47  ? 0.429 0.413 0.569 0.002  0.010  0.023  47  SER LLL CB   
3945 O OG   . SER C 47  ? 0.429 0.415 0.556 0.001  0.018  0.024  47  SER LLL OG   
3946 H H    . SER C 47  ? 0.436 0.410 0.591 0.005  -0.008 0.019  47  SER LLL H    
3947 H HA   . SER C 47  ? 0.429 0.409 0.549 0.002  0.013  0.023  47  SER LLL HA   
3948 H HB2  . SER C 47  ? 0.420 0.413 0.575 0.001  0.013  0.026  47  SER LLL HB2  
3949 H HB3  . SER C 47  ? 0.435 0.413 0.579 0.003  0.002  0.021  47  SER LLL HB3  
3951 N N    . VAL C 48  ? 0.460 0.417 0.540 0.004  0.012  0.019  48  VAL LLL N    
3952 C CA   . VAL C 48  ? 0.483 0.422 0.535 0.006  0.014  0.016  48  VAL LLL CA   
3953 C C    . VAL C 48  ? 0.471 0.416 0.522 0.005  0.025  0.017  48  VAL LLL C    
3954 O O    . VAL C 48  ? 0.492 0.423 0.528 0.007  0.025  0.015  48  VAL LLL O    
3955 C CB   . VAL C 48  ? 0.499 0.429 0.533 0.007  0.016  0.016  48  VAL LLL CB   
3956 C CG1  . VAL C 48  ? 0.509 0.436 0.529 0.006  0.029  0.017  48  VAL LLL CG1  
3957 C CG2  . VAL C 48  ? 0.521 0.429 0.538 0.011  0.004  0.013  48  VAL LLL CG2  
3958 H H    . VAL C 48  ? 0.448 0.415 0.533 0.002  0.019  0.021  48  VAL LLL H    
3959 H HA   . VAL C 48  ? 0.495 0.422 0.540 0.009  0.006  0.014  48  VAL LLL HA   
3960 H HB   . VAL C 48  ? 0.486 0.428 0.533 0.005  0.017  0.018  48  VAL LLL HB   
3961 H HG11 . VAL C 48  ? 0.493 0.433 0.525 0.003  0.035  0.019  48  VAL LLL HG11 
3962 H HG12 . VAL C 48  ? 0.515 0.435 0.524 0.006  0.030  0.017  48  VAL LLL HG12 
3963 H HG13 . VAL C 48  ? 0.519 0.435 0.528 0.007  0.031  0.016  48  VAL LLL HG13 
3964 H HG21 . VAL C 48  ? 0.537 0.431 0.537 0.013  0.003  0.011  48  VAL LLL HG21 
3965 H HG22 . VAL C 48  ? 0.527 0.430 0.533 0.011  0.005  0.013  48  VAL LLL HG22 
3966 H HG23 . VAL C 48  ? 0.518 0.429 0.548 0.011  -0.005 0.012  48  VAL LLL HG23 
3967 N N    . ILE C 49  ? 0.448 0.410 0.513 0.002  0.033  0.020  49  ILE LLL N    
3968 C CA   . ILE C 49  ? 0.437 0.408 0.510 0.000  0.040  0.021  49  ILE LLL CA   
3969 C C    . ILE C 49  ? 0.420 0.406 0.513 -0.001 0.039  0.024  49  ILE LLL C    
3970 O O    . ILE C 49  ? 0.410 0.402 0.510 -0.001 0.038  0.026  49  ILE LLL O    
3971 C CB   . ILE C 49  ? 0.435 0.406 0.502 -0.001 0.050  0.021  49  ILE LLL CB   
3972 C CG1  . ILE C 49  ? 0.451 0.403 0.497 0.001  0.054  0.019  49  ILE LLL CG1  
3973 C CG2  . ILE C 49  ? 0.422 0.404 0.503 -0.002 0.055  0.022  49  ILE LLL CG2  
3974 C CD1  . ILE C 49  ? 0.457 0.400 0.497 0.003  0.057  0.017  49  ILE LLL CD1  
3975 H H    . ILE C 49  ? 0.442 0.410 0.512 0.001  0.034  0.022  49  ILE LLL H    
3976 H HA   . ILE C 49  ? 0.445 0.408 0.513 0.002  0.038  0.019  49  ILE LLL HA   
3977 H HB   . ILE C 49  ? 0.429 0.405 0.499 -0.001 0.050  0.022  49  ILE LLL HB   
3978 H HG12 . ILE C 49  ? 0.460 0.403 0.496 0.002  0.049  0.018  49  ILE LLL HG12 
3979 H HG13 . ILE C 49  ? 0.451 0.404 0.496 0.000  0.061  0.019  49  ILE LLL HG13 
3980 H HG21 . ILE C 49  ? 0.413 0.404 0.503 -0.003 0.054  0.023  49  ILE LLL HG21 
3981 H HG22 . ILE C 49  ? 0.426 0.405 0.505 -0.002 0.060  0.021  49  ILE LLL HG22 
3982 H HG23 . ILE C 49  ? 0.424 0.405 0.507 -0.001 0.052  0.021  49  ILE LLL HG23 
3983 H HD11 . ILE C 49  ? 0.451 0.402 0.500 0.001  0.063  0.017  49  ILE LLL HD11 
3984 H HD12 . ILE C 49  ? 0.475 0.403 0.498 0.004  0.059  0.016  49  ILE LLL HD12 
3985 H HD13 . ILE C 49  ? 0.457 0.401 0.500 0.003  0.050  0.017  49  ILE LLL HD13 
3986 N N    . PHE C 50  ? 0.420 0.410 0.521 -0.001 0.039  0.024  50  PHE LLL N    
3987 C CA   . PHE C 50  ? 0.408 0.409 0.525 -0.002 0.041  0.027  50  PHE LLL CA   
3988 C C    . PHE C 50  ? 0.404 0.408 0.523 -0.002 0.045  0.027  50  PHE LLL C    
3989 O O    . PHE C 50  ? 0.400 0.398 0.512 -0.002 0.046  0.024  50  PHE LLL O    
3990 C CB   . PHE C 50  ? 0.406 0.407 0.536 -0.001 0.035  0.028  50  PHE LLL CB   
3991 C CG   . PHE C 50  ? 0.413 0.410 0.545 -0.001 0.031  0.026  50  PHE LLL CG   
3992 C CD1  . PHE C 50  ? 0.413 0.414 0.553 -0.001 0.033  0.027  50  PHE LLL CD1  
3993 C CD2  . PHE C 50  ? 0.432 0.415 0.554 0.001  0.023  0.022  50  PHE LLL CD2  
3994 C CE1  . PHE C 50  ? 0.418 0.414 0.560 -0.000 0.029  0.025  50  PHE LLL CE1  
3995 C CE2  . PHE C 50  ? 0.441 0.418 0.563 0.002  0.018  0.020  50  PHE LLL CE2  
3996 C CZ   . PHE C 50  ? 0.429 0.413 0.562 0.001  0.021  0.022  50  PHE LLL CZ   
3997 H H    . PHE C 50  ? 0.425 0.409 0.522 -0.000 0.039  0.022  50  PHE LLL H    
3998 H HA   . PHE C 50  ? 0.403 0.409 0.522 -0.002 0.043  0.029  50  PHE LLL HA   
3999 H HB2  . PHE C 50  ? 0.401 0.408 0.540 -0.001 0.038  0.031  50  PHE LLL HB2  
4000 H HB3  . PHE C 50  ? 0.410 0.408 0.540 -0.001 0.031  0.027  50  PHE LLL HB3  
4001 H HD1  . PHE C 50  ? 0.406 0.413 0.550 -0.001 0.038  0.030  50  PHE LLL HD1  
4002 H HD2  . PHE C 50  ? 0.437 0.415 0.552 0.002  0.021  0.021  50  PHE LLL HD2  
4003 H HE1  . PHE C 50  ? 0.414 0.414 0.562 -0.001 0.031  0.027  50  PHE LLL HE1  
4004 H HE2  . PHE C 50  ? 0.451 0.416 0.564 0.004  0.012  0.017  50  PHE LLL HE2  
4005 H HZ   . PHE C 50  ? 0.435 0.415 0.568 0.002  0.018  0.020  50  PHE LLL HZ   
4006 N N    . GLU C 51  ? 0.406 0.418 0.533 -0.002 0.047  0.029  51  GLU LLL N    
4007 C CA   . GLU C 51  ? 0.406 0.420 0.536 -0.001 0.049  0.029  51  GLU LLL CA   
4008 C C    . GLU C 51  ? 0.410 0.423 0.535 -0.002 0.052  0.026  51  GLU LLL C    
4009 O O    . GLU C 51  ? 0.412 0.423 0.539 -0.002 0.054  0.023  51  GLU LLL O    
4010 C CB   . GLU C 51  ? 0.410 0.424 0.546 -0.001 0.047  0.029  51  GLU LLL CB   
4011 C CG   . GLU C 51  ? 0.410 0.426 0.554 -0.001 0.046  0.033  51  GLU LLL CG   
4012 C CD   . GLU C 51  ? 0.414 0.428 0.566 -0.001 0.043  0.033  51  GLU LLL CD   
4013 O OE1  . GLU C 51  ? 0.414 0.425 0.563 -0.001 0.041  0.030  51  GLU LLL OE1  
4014 O OE2  . GLU C 51  ? 0.405 0.420 0.568 -0.001 0.043  0.036  51  GLU LLL OE2  
4015 H H    . GLU C 51  ? 0.402 0.416 0.533 -0.001 0.047  0.032  51  GLU LLL H    
4016 H HA   . GLU C 51  ? 0.404 0.421 0.536 -0.000 0.050  0.031  51  GLU LLL HA   
4017 H HB2  . GLU C 51  ? 0.414 0.423 0.547 -0.001 0.045  0.027  51  GLU LLL HB2  
4018 H HB3  . GLU C 51  ? 0.410 0.424 0.546 -0.001 0.048  0.028  51  GLU LLL HB3  
4019 H HG2  . GLU C 51  ? 0.409 0.426 0.553 0.000  0.048  0.034  51  GLU LLL HG2  
4020 H HG3  . GLU C 51  ? 0.410 0.426 0.555 -0.001 0.046  0.034  51  GLU LLL HG3  
4021 N N    . ASP C 52  ? 0.414 0.427 0.535 -0.002 0.054  0.026  52  ASP LLL N    
4022 C CA   . ASP C 52  ? 0.427 0.439 0.549 -0.003 0.058  0.023  52  ASP LLL CA   
4023 C C    . ASP C 52  ? 0.452 0.454 0.564 -0.003 0.062  0.021  52  ASP LLL C    
4024 O O    . ASP C 52  ? 0.451 0.450 0.558 -0.004 0.066  0.021  52  ASP LLL O    
4025 C CB   . ASP C 52  ? 0.420 0.436 0.553 -0.002 0.058  0.021  52  ASP LLL CB   
4026 C CG   . ASP C 52  ? 0.422 0.442 0.559 -0.000 0.053  0.023  52  ASP LLL CG   
4027 O OD1  . ASP C 52  ? 0.416 0.436 0.549 0.001  0.051  0.024  52  ASP LLL OD1  
4028 O OD2  . ASP C 52  ? 0.439 0.459 0.581 0.001  0.051  0.022  52  ASP LLL OD2  
4029 H H    . ASP C 52  ? 0.415 0.428 0.534 -0.002 0.052  0.027  52  ASP LLL H    
4030 H HA   . ASP C 52  ? 0.425 0.439 0.546 -0.003 0.057  0.024  52  ASP LLL HA   
4031 H HB2  . ASP C 52  ? 0.424 0.438 0.558 -0.002 0.059  0.021  52  ASP LLL HB2  
4032 H HB3  . ASP C 52  ? 0.424 0.439 0.560 -0.003 0.062  0.019  52  ASP LLL HB3  
4033 N N    . ASP C 53  ? 0.469 0.466 0.577 -0.003 0.062  0.020  53  ASP LLL N    
4034 C CA   . ASP C 53  ? 0.492 0.475 0.587 -0.002 0.069  0.018  53  ASP LLL CA   
4035 C C    . ASP C 53  ? 0.499 0.471 0.581 -0.000 0.064  0.017  53  ASP LLL C    
4036 O O    . ASP C 53  ? 0.524 0.482 0.593 0.001  0.069  0.015  53  ASP LLL O    
4037 C CB   . ASP C 53  ? 0.503 0.487 0.608 -0.003 0.077  0.016  53  ASP LLL CB   
4038 C CG   . ASP C 53  ? 0.500 0.490 0.616 -0.002 0.074  0.015  53  ASP LLL CG   
4039 O OD1  . ASP C 53  ? 0.498 0.489 0.611 -0.002 0.067  0.016  53  ASP LLL OD1  
4040 O OD2  . ASP C 53  ? 0.511 0.504 0.640 -0.003 0.079  0.013  53  ASP LLL OD2  
4041 H H    . ASP C 53  ? 0.466 0.464 0.577 -0.003 0.059  0.020  53  ASP LLL H    
4042 H HA   . ASP C 53  ? 0.496 0.475 0.584 -0.002 0.071  0.018  53  ASP LLL HA   
4043 H HB2  . ASP C 53  ? 0.513 0.487 0.609 -0.002 0.083  0.015  53  ASP LLL HB2  
4044 H HB3  . ASP C 53  ? 0.495 0.485 0.609 -0.004 0.078  0.016  53  ASP LLL HB3  
4045 N N    . LYS C 54  ? 0.498 0.474 0.585 -0.000 0.055  0.018  54  LYS LLL N    
4046 C CA   . LYS C 54  ? 0.512 0.478 0.592 0.002  0.048  0.017  54  LYS LLL CA   
4047 C C    . LYS C 54  ? 0.516 0.472 0.584 0.003  0.040  0.016  54  LYS LLL C    
4048 O O    . LYS C 54  ? 0.511 0.475 0.587 0.002  0.039  0.018  54  LYS LLL O    
4049 C CB   . LYS C 54  ? 0.508 0.485 0.605 0.001  0.043  0.018  54  LYS LLL CB   
4050 C CG   . LYS C 54  ? 0.521 0.498 0.622 0.001  0.046  0.017  54  LYS LLL CG   
4051 C CD   . LYS C 54  ? 0.526 0.516 0.644 0.000  0.044  0.019  54  LYS LLL CD   
4052 C CE   . LYS C 54  ? 0.529 0.523 0.653 -0.000 0.049  0.018  54  LYS LLL CE   
4053 N NZ   . LYS C 54  ? 0.525 0.522 0.650 -0.001 0.056  0.017  54  LYS LLL NZ   
4054 H H    . LYS C 54  ? 0.489 0.473 0.583 -0.001 0.052  0.020  54  LYS LLL H    
4055 H HA   . LYS C 54  ? 0.522 0.479 0.593 0.003  0.051  0.015  54  LYS LLL HA   
4056 H HB2  . LYS C 54  ? 0.498 0.485 0.605 -0.000 0.044  0.020  54  LYS LLL HB2  
4057 H HB3  . LYS C 54  ? 0.513 0.486 0.610 0.002  0.036  0.018  54  LYS LLL HB3  
4058 H HG2  . LYS C 54  ? 0.532 0.500 0.625 0.003  0.043  0.015  54  LYS LLL HG2  
4059 H HG3  . LYS C 54  ? 0.524 0.501 0.622 0.001  0.052  0.016  54  LYS LLL HG3  
4060 H HD2  . LYS C 54  ? 0.516 0.512 0.639 -0.001 0.044  0.021  54  LYS LLL HD2  
4061 H HD3  . LYS C 54  ? 0.524 0.513 0.646 0.001  0.039  0.019  54  LYS LLL HD3  
4062 H HE2  . LYS C 54  ? 0.520 0.521 0.653 -0.000 0.047  0.020  54  LYS LLL HE2  
4063 H HE3  . LYS C 54  ? 0.534 0.522 0.654 0.001  0.050  0.016  54  LYS LLL HE3  
4064 H HZ1  . LYS C 54  ? 0.532 0.524 0.651 -0.000 0.060  0.016  54  LYS LLL HZ1  
4065 H HZ2  . LYS C 54  ? 0.520 0.523 0.653 -0.001 0.056  0.018  54  LYS LLL HZ2  
4066 H HZ3  . LYS C 54  ? 0.523 0.522 0.646 -0.001 0.055  0.019  54  LYS LLL HZ3  
4067 N N    . ARG C 55  ? 0.534 0.471 0.584 0.007  0.035  0.013  55  ARG LLL N    
4068 C CA   . ARG C 55  ? 0.552 0.474 0.588 0.009  0.026  0.011  55  ARG LLL CA   
4069 C C    . ARG C 55  ? 0.541 0.463 0.590 0.011  0.012  0.010  55  ARG LLL C    
4070 O O    . ARG C 55  ? 0.538 0.455 0.587 0.012  0.009  0.008  55  ARG LLL O    
4071 C CB   . ARG C 55  ? 0.595 0.492 0.600 0.013  0.029  0.009  55  ARG LLL CB   
4072 C CG   . ARG C 55  ? 0.607 0.503 0.603 0.012  0.044  0.010  55  ARG LLL CG   
4073 C CD   . ARG C 55  ? 0.646 0.514 0.609 0.016  0.051  0.009  55  ARG LLL CD   
4074 N NE   . ARG C 55  ? 0.665 0.521 0.618 0.019  0.055  0.007  55  ARG LLL NE   
4075 C CZ   . ARG C 55  ? 0.695 0.530 0.628 0.024  0.046  0.004  55  ARG LLL CZ   
4076 N NH1  . ARG C 55  ? 0.711 0.531 0.631 0.028  0.030  0.002  55  ARG LLL NH1  
4077 N NH2  . ARG C 55  ? 0.708 0.534 0.633 0.027  0.051  0.002  55  ARG LLL NH2  
4078 H H    . ARG C 55  ? 0.542 0.473 0.587 0.008  0.037  0.012  55  ARG LLL H    
4079 H HA   . ARG C 55  ? 0.545 0.474 0.586 0.008  0.026  0.013  55  ARG LLL HA   
4080 H HB2  . ARG C 55  ? 0.603 0.492 0.601 0.015  0.029  0.007  55  ARG LLL HB2  
4081 H HB3  . ARG C 55  ? 0.607 0.491 0.600 0.016  0.021  0.007  55  ARG LLL HB3  
4082 H HG2  . ARG C 55  ? 0.599 0.501 0.599 0.010  0.044  0.012  55  ARG LLL HG2  
4083 H HG3  . ARG C 55  ? 0.594 0.502 0.603 0.010  0.051  0.012  55  ARG LLL HG3  
4084 H HD2  . ARG C 55  ? 0.661 0.514 0.608 0.019  0.044  0.007  55  ARG LLL HD2  
4085 H HD3  . ARG C 55  ? 0.645 0.514 0.606 0.015  0.062  0.010  55  ARG LLL HD3  
4086 H HE   . ARG C 55  ? 0.658 0.522 0.621 0.017  0.064  0.008  55  ARG LLL HE   
4087 H HH11 . ARG C 55  ? 0.703 0.529 0.628 0.026  0.027  0.002  55  ARG LLL HH11 
4088 H HH12 . ARG C 55  ? 0.727 0.532 0.633 0.032  0.023  -0.001 55  ARG LLL HH12 
4089 H HH21 . ARG C 55  ? 0.699 0.533 0.634 0.025  0.061  0.003  55  ARG LLL HH21 
4090 H HH22 . ARG C 55  ? 0.725 0.534 0.635 0.031  0.044  -0.000 55  ARG LLL HH22 
4091 N N    . PRO C 56  ? 0.540 0.467 0.603 0.010  0.003  0.010  56  PRO LLL N    
4092 C CA   . PRO C 56  ? 0.541 0.463 0.616 0.012  -0.012 0.008  56  PRO LLL CA   
4093 C C    . PRO C 56  ? 0.569 0.462 0.615 0.018  -0.022 0.003  56  PRO LLL C    
4094 O O    . PRO C 56  ? 0.586 0.464 0.603 0.020  -0.017 0.002  56  PRO LLL O    
4095 C CB   . PRO C 56  ? 0.529 0.460 0.622 0.011  -0.016 0.009  56  PRO LLL CB   
4096 C CG   . PRO C 56  ? 0.511 0.458 0.608 0.007  -0.002 0.014  56  PRO LLL CG   
4097 C CD   . PRO C 56  ? 0.522 0.461 0.593 0.008  0.007  0.013  56  PRO LLL CD   
4098 H HA   . PRO C 56  ? 0.532 0.462 0.621 0.011  -0.011 0.009  56  PRO LLL HA   
4099 H HB2  . PRO C 56  ? 0.543 0.461 0.624 0.013  -0.023 0.007  56  PRO LLL HB2  
4100 H HB3  . PRO C 56  ? 0.522 0.460 0.637 0.010  -0.021 0.010  56  PRO LLL HB3  
4101 H HG2  . PRO C 56  ? 0.510 0.459 0.609 0.007  -0.003 0.014  56  PRO LLL HG2  
4102 H HG3  . PRO C 56  ? 0.498 0.458 0.611 0.005  0.002  0.016  56  PRO LLL HG3  
4103 H HD2  . PRO C 56  ? 0.533 0.462 0.589 0.009  0.006  0.012  56  PRO LLL HD2  
4104 H HD3  . PRO C 56  ? 0.511 0.461 0.588 0.005  0.016  0.016  56  PRO LLL HD3  
4105 N N    . SER C 57  ? 0.579 0.464 0.633 0.020  -0.037 -0.001 57  SER LLL N    
4106 C CA   . SER C 57  ? 0.615 0.468 0.642 0.027  -0.051 -0.007 57  SER LLL CA   
4107 C C    . SER C 57  ? 0.627 0.462 0.632 0.031  -0.059 -0.009 57  SER LLL C    
4108 O O    . SER C 57  ? 0.612 0.457 0.637 0.029  -0.064 -0.008 57  SER LLL O    
4109 C CB   . SER C 57  ? 0.626 0.478 0.676 0.029  -0.068 -0.010 57  SER LLL CB   
4110 O OG   . SER C 57  ? 0.613 0.490 0.695 0.024  -0.060 -0.006 57  SER LLL OG   
4111 H H    . SER C 57  ? 0.566 0.463 0.644 0.018  -0.039 0.000  57  SER LLL H    
4112 H HA   . SER C 57  ? 0.625 0.469 0.632 0.029  -0.045 -0.007 57  SER LLL HA   
4113 H HB2  . SER C 57  ? 0.626 0.478 0.690 0.029  -0.078 -0.011 57  SER LLL HB2  
4114 H HB3  . SER C 57  ? 0.648 0.481 0.679 0.033  -0.076 -0.014 57  SER LLL HB3  
4116 N N    . GLY C 58  ? 0.659 0.464 0.621 0.037  -0.058 -0.012 58  GLY LLL N    
4117 C CA   . GLY C 58  ? 0.689 0.468 0.621 0.042  -0.066 -0.014 58  GLY LLL CA   
4118 C C    . GLY C 58  ? 0.680 0.469 0.607 0.038  -0.051 -0.010 58  GLY LLL C    
4119 O O    . GLY C 58  ? 0.715 0.487 0.623 0.041  -0.058 -0.011 58  GLY LLL O    
4120 H H    . GLY C 58  ? 0.668 0.466 0.615 0.038  -0.052 -0.012 58  GLY LLL H    
4121 H HA2  . GLY C 58  ? 0.717 0.470 0.618 0.047  -0.069 -0.017 58  GLY LLL HA2  
4122 H HA3  . GLY C 58  ? 0.689 0.467 0.636 0.043  -0.081 -0.017 58  GLY LLL HA3  
4123 N N    . VAL C 59  ? 0.646 0.461 0.590 0.032  -0.032 -0.005 59  VAL LLL N    
4124 C CA   . VAL C 59  ? 0.645 0.465 0.578 0.029  -0.015 -0.001 59  VAL LLL CA   
4125 C C    . VAL C 59  ? 0.666 0.465 0.566 0.032  -0.001 -0.001 59  VAL LLL C    
4126 O O    . VAL C 59  ? 0.664 0.469 0.571 0.031  0.006  -0.001 59  VAL LLL O    
4127 C CB   . VAL C 59  ? 0.607 0.462 0.575 0.022  -0.004 0.004  59  VAL LLL CB   
4128 C CG1  . VAL C 59  ? 0.601 0.459 0.559 0.019  0.012  0.007  59  VAL LLL CG1  
4129 C CG2  . VAL C 59  ? 0.585 0.458 0.583 0.019  -0.015 0.004  59  VAL LLL CG2  
4130 H H    . VAL C 59  ? 0.632 0.462 0.594 0.029  -0.028 -0.003 59  VAL LLL H    
4131 H HA   . VAL C 59  ? 0.654 0.464 0.578 0.031  -0.021 -0.002 59  VAL LLL HA   
4132 H HB   . VAL C 59  ? 0.597 0.461 0.575 0.020  0.000  0.004  59  VAL LLL HB   
4133 H HG11 . VAL C 59  ? 0.605 0.461 0.557 0.019  0.022  0.007  59  VAL LLL HG11 
4134 H HG12 . VAL C 59  ? 0.581 0.459 0.559 0.016  0.015  0.009  59  VAL LLL HG12 
4135 H HG13 . VAL C 59  ? 0.619 0.461 0.558 0.022  0.010  0.006  59  VAL LLL HG13 
4136 H HG21 . VAL C 59  ? 0.594 0.459 0.584 0.021  -0.019 0.004  59  VAL LLL HG21 
4137 H HG22 . VAL C 59  ? 0.565 0.457 0.581 0.015  -0.007 0.007  59  VAL LLL HG22 
4138 H HG23 . VAL C 59  ? 0.588 0.459 0.595 0.021  -0.024 0.002  59  VAL LLL HG23 
4139 N N    . PRO C 60  ? 0.692 0.464 0.557 0.036  0.004  -0.001 60  PRO LLL N    
4140 C CA   . PRO C 60  ? 0.722 0.472 0.555 0.039  0.021  -0.001 60  PRO LLL CA   
4141 C C    . PRO C 60  ? 0.700 0.473 0.554 0.033  0.042  0.004  60  PRO LLL C    
4142 O O    . PRO C 60  ? 0.672 0.471 0.552 0.027  0.047  0.006  60  PRO LLL O    
4143 C CB   . PRO C 60  ? 0.756 0.475 0.552 0.044  0.023  -0.001 60  PRO LLL CB   
4144 C CG   . PRO C 60  ? 0.754 0.473 0.556 0.045  0.000  -0.003 60  PRO LLL CG   
4145 C CD   . PRO C 60  ? 0.706 0.467 0.559 0.038  -0.005 -0.002 60  PRO LLL CD   
4146 H HA   . PRO C 60  ? 0.738 0.473 0.559 0.043  0.015  -0.003 60  PRO LLL HA   
4147 H HB2  . PRO C 60  ? 0.748 0.475 0.548 0.041  0.036  0.003  60  PRO LLL HB2  
4148 H HB3  . PRO C 60  ? 0.788 0.478 0.552 0.050  0.024  -0.002 60  PRO LLL HB3  
4149 H HG2  . PRO C 60  ? 0.760 0.473 0.552 0.045  0.003  -0.002 60  PRO LLL HG2  
4150 H HG3  . PRO C 60  ? 0.776 0.474 0.561 0.051  -0.013 -0.007 60  PRO LLL HG3  
4151 H HD2  . PRO C 60  ? 0.687 0.465 0.555 0.034  0.002  0.001  60  PRO LLL HD2  
4152 H HD3  . PRO C 60  ? 0.706 0.466 0.567 0.039  -0.020 -0.004 60  PRO LLL HD3  
4153 N N    . ASP C 61  ? 0.715 0.477 0.558 0.035  0.055  0.003  61  ASP LLL N    
4154 C CA   . ASP C 61  ? 0.691 0.475 0.558 0.030  0.074  0.006  61  ASP LLL CA   
4155 C C    . ASP C 61  ? 0.694 0.477 0.560 0.028  0.091  0.009  61  ASP LLL C    
4156 O O    . ASP C 61  ? 0.685 0.488 0.576 0.023  0.105  0.011  61  ASP LLL O    
4157 C CB   . ASP C 61  ? 0.707 0.476 0.562 0.033  0.084  0.004  61  ASP LLL CB   
4158 C CG   . ASP C 61  ? 0.755 0.483 0.565 0.041  0.097  0.004  61  ASP LLL CG   
4159 O OD1  . ASP C 61  ? 0.783 0.487 0.562 0.045  0.093  0.004  61  ASP LLL OD1  
4160 O OD2  . ASP C 61  ? 0.773 0.493 0.579 0.042  0.112  0.004  61  ASP LLL OD2  
4161 H H    . ASP C 61  ? 0.739 0.479 0.558 0.040  0.053  0.001  61  ASP LLL H    
4162 H HA   . ASP C 61  ? 0.664 0.472 0.559 0.026  0.069  0.007  61  ASP LLL HA   
4163 H HB2  . ASP C 61  ? 0.689 0.476 0.566 0.030  0.093  0.006  61  ASP LLL HB2  
4164 H HB3  . ASP C 61  ? 0.708 0.476 0.563 0.035  0.071  0.002  61  ASP LLL HB3  
4165 N N    . ARG C 62  ? 0.711 0.475 0.552 0.030  0.089  0.010  62  ARG LLL N    
4166 C CA   . ARG C 62  ? 0.715 0.479 0.555 0.028  0.104  0.013  62  ARG LLL CA   
4167 C C    . ARG C 62  ? 0.673 0.470 0.548 0.021  0.097  0.014  62  ARG LLL C    
4168 O O    . ARG C 62  ? 0.656 0.460 0.541 0.018  0.109  0.017  62  ARG LLL O    
4169 C CB   . ARG C 62  ? 0.763 0.487 0.557 0.035  0.104  0.013  62  ARG LLL CB   
4170 C CG   . ARG C 62  ? 0.768 0.488 0.552 0.037  0.082  0.011  62  ARG LLL CG   
4171 C CD   . ARG C 62  ? 0.818 0.492 0.550 0.045  0.077  0.009  62  ARG LLL CD   
4172 N NE   . ARG C 62  ? 0.817 0.488 0.546 0.048  0.053  0.006  62  ARG LLL NE   
4173 C CZ   . ARG C 62  ? 0.807 0.490 0.548 0.044  0.048  0.007  62  ARG LLL CZ   
4174 N NH1  . ARG C 62  ? 0.786 0.485 0.543 0.039  0.065  0.012  62  ARG LLL NH1  
4175 N NH2  . ARG C 62  ? 0.811 0.490 0.551 0.047  0.025  0.004  62  ARG LLL NH2  
4176 H H    . ARG C 62  ? 0.729 0.477 0.551 0.034  0.077  0.008  62  ARG LLL H    
4177 H HA   . ARG C 62  ? 0.715 0.480 0.562 0.027  0.119  0.014  62  ARG LLL HA   
4178 H HB2  . ARG C 62  ? 0.767 0.488 0.559 0.033  0.118  0.015  62  ARG LLL HB2  
4179 H HB3  . ARG C 62  ? 0.789 0.490 0.558 0.040  0.107  0.011  62  ARG LLL HB3  
4180 H HG2  . ARG C 62  ? 0.754 0.485 0.552 0.036  0.069  0.009  62  ARG LLL HG2  
4181 H HG3  . ARG C 62  ? 0.749 0.485 0.550 0.033  0.082  0.012  62  ARG LLL HG3  
4182 H HD2  . ARG C 62  ? 0.832 0.493 0.550 0.046  0.091  0.011  62  ARG LLL HD2  
4183 H HD3  . ARG C 62  ? 0.839 0.494 0.552 0.050  0.078  0.007  62  ARG LLL HD3  
4184 H HE   . ARG C 62  ? 0.831 0.490 0.550 0.051  0.040  0.003  62  ARG LLL HE   
4185 H HH11 . ARG C 62  ? 0.785 0.488 0.546 0.037  0.079  0.013  62  ARG LLL HH11 
4186 H HH12 . ARG C 62  ? 0.778 0.485 0.542 0.037  0.061  0.012  62  ARG LLL HH12 
4187 H HH21 . ARG C 62  ? 0.822 0.490 0.554 0.051  0.013  0.001  62  ARG LLL HH21 
4188 H HH22 . ARG C 62  ? 0.801 0.488 0.549 0.045  0.022  0.005  62  ARG LLL HH22 
4189 N N    . LEU C 63  ? 0.655 0.470 0.548 0.020  0.079  0.013  63  LEU LLL N    
4190 C CA   . LEU C 63  ? 0.613 0.463 0.543 0.014  0.075  0.015  63  LEU LLL CA   
4191 C C    . LEU C 63  ? 0.574 0.444 0.531 0.011  0.081  0.015  63  LEU LLL C    
4192 O O    . LEU C 63  ? 0.597 0.461 0.549 0.013  0.079  0.013  63  LEU LLL O    
4193 C CB   . LEU C 63  ? 0.610 0.467 0.547 0.014  0.055  0.013  63  LEU LLL CB   
4194 C CG   . LEU C 63  ? 0.635 0.480 0.557 0.016  0.048  0.013  63  LEU LLL CG   
4195 C CD1  . LEU C 63  ? 0.674 0.486 0.563 0.023  0.037  0.010  63  LEU LLL CD1  
4196 C CD2  . LEU C 63  ? 0.614 0.483 0.564 0.013  0.037  0.014  63  LEU LLL CD2  
4197 H H    . LEU C 63  ? 0.662 0.469 0.546 0.023  0.069  0.011  63  LEU LLL H    
4198 H HA   . LEU C 63  ? 0.609 0.461 0.541 0.012  0.081  0.016  63  LEU LLL HA   
4199 H HB2  . LEU C 63  ? 0.621 0.469 0.551 0.017  0.048  0.011  63  LEU LLL HB2  
4200 H HB3  . LEU C 63  ? 0.588 0.466 0.549 0.011  0.054  0.015  63  LEU LLL HB3  
4201 H HG   . LEU C 63  ? 0.639 0.480 0.555 0.015  0.058  0.015  63  LEU LLL HG   
4202 H HD11 . LEU C 63  ? 0.692 0.488 0.561 0.026  0.045  0.010  63  LEU LLL HD11 
4203 H HD12 . LEU C 63  ? 0.681 0.485 0.560 0.024  0.032  0.010  63  LEU LLL HD12 
4204 H HD13 . LEU C 63  ? 0.669 0.484 0.566 0.024  0.026  0.008  63  LEU LLL HD13 
4205 H HD21 . LEU C 63  ? 0.608 0.480 0.566 0.014  0.028  0.013  63  LEU LLL HD21 
4206 H HD22 . LEU C 63  ? 0.620 0.481 0.561 0.014  0.032  0.014  63  LEU LLL HD22 
4207 H HD23 . LEU C 63  ? 0.594 0.480 0.560 0.010  0.044  0.016  63  LEU LLL HD23 
4208 N N    . SER C 64  ? 0.531 0.424 0.514 0.006  0.087  0.017  64  SER LLL N    
4209 C CA   . SER C 64  ? 0.504 0.412 0.511 0.004  0.095  0.017  64  SER LLL CA   
4210 C C    . SER C 64  ? 0.474 0.407 0.509 -0.000 0.093  0.018  64  SER LLL C    
4211 O O    . SER C 64  ? 0.485 0.419 0.520 -0.002 0.095  0.019  64  SER LLL O    
4212 C CB   . SER C 64  ? 0.519 0.412 0.518 0.005  0.113  0.016  64  SER LLL CB   
4213 O OG   . SER C 64  ? 0.502 0.412 0.530 0.001  0.121  0.017  64  SER LLL OG   
4214 H H    . SER C 64  ? 0.525 0.424 0.513 0.005  0.086  0.018  64  SER LLL H    
4215 H HA   . SER C 64  ? 0.503 0.413 0.512 0.004  0.091  0.016  64  SER LLL HA   
4216 H HB2  . SER C 64  ? 0.532 0.414 0.520 0.007  0.115  0.015  64  SER LLL HB2  
4217 H HB3  . SER C 64  ? 0.534 0.414 0.517 0.006  0.117  0.017  64  SER LLL HB3  
4219 N N    . GLY C 65  ? 0.454 0.403 0.508 -0.002 0.087  0.018  65  GLY LLL N    
4220 C CA   . GLY C 65  ? 0.431 0.400 0.507 -0.004 0.083  0.019  65  GLY LLL CA   
4221 C C    . GLY C 65  ? 0.423 0.400 0.520 -0.005 0.089  0.017  65  GLY LLL C    
4222 O O    . GLY C 65  ? 0.440 0.415 0.539 -0.004 0.091  0.016  65  GLY LLL O    
4223 H H    . GLY C 65  ? 0.456 0.403 0.509 -0.001 0.086  0.017  65  GLY LLL H    
4224 H HA2  . GLY C 65  ? 0.431 0.400 0.506 -0.004 0.084  0.019  65  GLY LLL HA2  
4225 H HA3  . GLY C 65  ? 0.424 0.399 0.503 -0.004 0.076  0.019  65  GLY LLL HA3  
4226 N N    . SER C 66  ? 0.418 0.403 0.530 -0.006 0.091  0.017  66  SER LLL N    
4227 C CA   . SER C 66  ? 0.418 0.412 0.555 -0.007 0.093  0.015  66  SER LLL CA   
4228 C C    . SER C 66  ? 0.408 0.413 0.558 -0.007 0.083  0.015  66  SER LLL C    
4229 O O    . SER C 66  ? 0.413 0.419 0.552 -0.007 0.079  0.017  66  SER LLL O    
4230 C CB   . SER C 66  ? 0.434 0.421 0.580 -0.008 0.107  0.013  66  SER LLL CB   
4231 O OG   . SER C 66  ? 0.435 0.421 0.580 -0.009 0.107  0.014  66  SER LLL OG   
4232 H H    . SER C 66  ? 0.418 0.404 0.528 -0.007 0.089  0.018  66  SER LLL H    
4233 H HA   . SER C 66  ? 0.418 0.412 0.558 -0.007 0.093  0.014  66  SER LLL HA   
4234 H HB2  . SER C 66  ? 0.428 0.421 0.593 -0.009 0.108  0.011  66  SER LLL HB2  
4235 H HB3  . SER C 66  ? 0.445 0.421 0.578 -0.008 0.114  0.014  66  SER LLL HB3  
4237 N N    . THR C 67  ? 0.401 0.413 0.570 -0.006 0.079  0.012  67  THR LLL N    
4238 C CA   . THR C 67  ? 0.396 0.415 0.577 -0.005 0.069  0.011  67  THR LLL CA   
4239 C C    . THR C 67  ? 0.398 0.419 0.607 -0.006 0.071  0.007  67  THR LLL C    
4240 O O    . THR C 67  ? 0.398 0.418 0.618 -0.006 0.078  0.005  67  THR LLL O    
4241 C CB   . THR C 67  ? 0.392 0.413 0.566 -0.003 0.059  0.012  67  THR LLL CB   
4242 O OG1  . THR C 67  ? 0.394 0.417 0.577 -0.002 0.059  0.011  67  THR LLL OG1  
4243 C CG2  . THR C 67  ? 0.388 0.408 0.541 -0.002 0.059  0.016  67  THR LLL CG2  
4244 H H    . THR C 67  ? 0.402 0.415 0.579 -0.006 0.082  0.011  67  THR LLL H    
4245 H HA   . THR C 67  ? 0.397 0.414 0.571 -0.005 0.069  0.012  67  THR LLL HA   
4246 H HB   . THR C 67  ? 0.391 0.414 0.570 -0.001 0.053  0.012  67  THR LLL HB   
4248 H HG21 . THR C 67  ? 0.390 0.409 0.538 -0.003 0.060  0.017  67  THR LLL HG21 
4249 H HG22 . THR C 67  ? 0.388 0.409 0.538 -0.001 0.053  0.018  67  THR LLL HG22 
4250 H HG23 . THR C 67  ? 0.391 0.409 0.540 -0.003 0.062  0.017  67  THR LLL HG23 
4251 N N    . ASP C 68  ? 0.404 0.427 0.624 -0.005 0.065  0.005  68  ASP LLL N    
4252 C CA   . ASP C 68  ? 0.407 0.432 0.658 -0.005 0.063  0.001  68  ASP LLL CA   
4253 C C    . ASP C 68  ? 0.403 0.429 0.659 -0.001 0.046  -0.002 68  ASP LLL C    
4254 O O    . ASP C 68  ? 0.407 0.430 0.651 0.001  0.039  -0.001 68  ASP LLL O    
4255 C CB   . ASP C 68  ? 0.418 0.441 0.678 -0.008 0.073  0.001  68  ASP LLL CB   
4256 C CG   . ASP C 68  ? 0.424 0.450 0.723 -0.008 0.073  -0.004 68  ASP LLL CG   
4257 O OD1  . ASP C 68  ? 0.439 0.466 0.760 -0.008 0.076  -0.007 68  ASP LLL OD1  
4258 O OD2  . ASP C 68  ? 0.427 0.452 0.736 -0.008 0.069  -0.006 68  ASP LLL OD2  
4259 H H    . ASP C 68  ? 0.403 0.425 0.611 -0.004 0.060  0.007  68  ASP LLL H    
4260 H HA   . ASP C 68  ? 0.408 0.433 0.671 -0.005 0.067  -0.001 68  ASP LLL HA   
4261 H HB2  . ASP C 68  ? 0.421 0.441 0.674 -0.009 0.084  0.003  68  ASP LLL HB2  
4262 H HB3  . ASP C 68  ? 0.417 0.440 0.666 -0.007 0.068  0.002  68  ASP LLL HB3  
4263 N N    . PHE C 69  ? 0.406 0.432 0.676 0.001  0.038  -0.006 69  PHE LLL N    
4264 C CA   . PHE C 69  ? 0.416 0.438 0.688 0.007  0.019  -0.009 69  PHE LLL CA   
4265 C C    . PHE C 69  ? 0.431 0.452 0.725 0.008  0.011  -0.013 69  PHE LLL C    
4266 O O    . PHE C 69  ? 0.447 0.461 0.728 0.012  -0.003 -0.014 69  PHE LLL O    
4267 C CB   . PHE C 69  ? 0.413 0.435 0.697 0.009  0.013  -0.012 69  PHE LLL CB   
4268 C CG   . PHE C 69  ? 0.414 0.435 0.673 0.009  0.016  -0.007 69  PHE LLL CG   
4269 C CD1  . PHE C 69  ? 0.408 0.429 0.640 0.007  0.025  -0.002 69  PHE LLL CD1  
4270 C CD2  . PHE C 69  ? 0.418 0.437 0.684 0.011  0.010  -0.010 69  PHE LLL CD2  
4271 C CE1  . PHE C 69  ? 0.405 0.426 0.621 0.008  0.027  0.002  69  PHE LLL CE1  
4272 C CE2  . PHE C 69  ? 0.415 0.433 0.661 0.012  0.013  -0.006 69  PHE LLL CE2  
4273 C CZ   . PHE C 69  ? 0.409 0.428 0.631 0.010  0.022  0.000  69  PHE LLL CZ   
4274 H H    . PHE C 69  ? 0.405 0.433 0.685 0.000  0.043  -0.006 69  PHE LLL H    
4275 H HA   . PHE C 69  ? 0.419 0.438 0.667 0.009  0.015  -0.006 69  PHE LLL HA   
4276 H HB2  . PHE C 69  ? 0.412 0.437 0.718 0.007  0.019  -0.014 69  PHE LLL HB2  
4277 H HB3  . PHE C 69  ? 0.420 0.437 0.708 0.013  -0.000 -0.015 69  PHE LLL HB3  
4278 H HD1  . PHE C 69  ? 0.407 0.429 0.635 0.006  0.028  -0.000 69  PHE LLL HD1  
4279 H HD2  . PHE C 69  ? 0.419 0.437 0.704 0.013  0.003  -0.014 69  PHE LLL HD2  
4280 H HE1  . PHE C 69  ? 0.405 0.426 0.605 0.006  0.032  0.006  69  PHE LLL HE1  
4281 H HE2  . PHE C 69  ? 0.417 0.434 0.667 0.013  0.009  -0.007 69  PHE LLL HE2  
4282 H HZ   . PHE C 69  ? 0.409 0.428 0.620 0.010  0.023  0.003  69  PHE LLL HZ   
4283 N N    . SER C 70  ? 0.435 0.461 0.761 0.004  0.021  -0.016 70  SER LLL N    
4284 C CA   . SER C 70  ? 0.442 0.468 0.797 0.004  0.014  -0.021 70  SER LLL CA   
4285 C C    . SER C 70  ? 0.439 0.461 0.773 0.005  0.010  -0.018 70  SER LLL C    
4286 O O    . SER C 70  ? 0.441 0.458 0.782 0.009  -0.006 -0.022 70  SER LLL O    
4287 C CB   . SER C 70  ? 0.445 0.475 0.837 -0.001 0.030  -0.023 70  SER LLL CB   
4288 O OG   . SER C 70  ? 0.446 0.476 0.879 0.001  0.019  -0.029 70  SER LLL OG   
4289 H H    . SER C 70  ? 0.432 0.460 0.763 0.001  0.032  -0.015 70  SER LLL H    
4290 H HA   . SER C 70  ? 0.446 0.468 0.811 0.008  -0.000 -0.025 70  SER LLL HA   
4291 H HB2  . SER C 70  ? 0.442 0.474 0.840 -0.001 0.036  -0.023 70  SER LLL HB2  
4292 H HB3  . SER C 70  ? 0.442 0.473 0.825 -0.003 0.042  -0.019 70  SER LLL HB3  
4294 N N    . SER C 71  ? 0.434 0.457 0.743 0.002  0.024  -0.012 71  SER LLL N    
4295 C CA   . SER C 71  ? 0.429 0.450 0.719 0.002  0.023  -0.010 71  SER LLL CA   
4296 C C    . SER C 71  ? 0.427 0.444 0.678 0.005  0.017  -0.005 71  SER LLL C    
4297 O O    . SER C 71  ? 0.422 0.437 0.655 0.006  0.017  -0.003 71  SER LLL O    
4298 C CB   . SER C 71  ? 0.422 0.444 0.711 -0.003 0.042  -0.006 71  SER LLL CB   
4299 O OG   . SER C 71  ? 0.413 0.435 0.681 -0.005 0.053  -0.002 71  SER LLL OG   
4300 H H    . SER C 71  ? 0.430 0.456 0.734 -0.001 0.035  -0.010 71  SER LLL H    
4301 H HA   . SER C 71  ? 0.431 0.450 0.735 0.004  0.014  -0.013 71  SER LLL HA   
4302 H HB2  . SER C 71  ? 0.422 0.443 0.702 -0.003 0.040  -0.005 71  SER LLL HB2  
4303 H HB3  . SER C 71  ? 0.421 0.445 0.736 -0.005 0.047  -0.008 71  SER LLL HB3  
4305 N N    . ASN C 72  ? 0.423 0.439 0.664 0.008  0.014  -0.005 72  ASN LLL N    
4306 C CA   . ASN C 72  ? 0.419 0.430 0.627 0.011  0.010  -0.001 72  ASN LLL CA   
4307 C C    . ASN C 72  ? 0.415 0.429 0.603 0.008  0.022  0.005  72  ASN LLL C    
4308 O O    . ASN C 72  ? 0.431 0.441 0.599 0.010  0.019  0.007  72  ASN LLL O    
4309 C CB   . ASN C 72  ? 0.424 0.425 0.619 0.018  -0.005 -0.002 72  ASN LLL CB   
4310 C CG   . ASN C 72  ? 0.426 0.418 0.594 0.023  -0.010 0.001  72  ASN LLL CG   
4311 O OD1  . ASN C 72  ? 0.430 0.423 0.601 0.023  -0.009 0.001  72  ASN LLL OD1  
4312 N ND2  . ASN C 72  ? 0.428 0.412 0.571 0.027  -0.013 0.003  72  ASN LLL ND2  
4313 H H    . ASN C 72  ? 0.421 0.439 0.676 0.007  0.014  -0.007 72  ASN LLL H    
4314 H HA   . ASN C 72  ? 0.419 0.430 0.626 0.011  0.010  -0.000 72  ASN LLL HA   
4315 H HB2  . ASN C 72  ? 0.427 0.426 0.640 0.020  -0.014 -0.007 72  ASN LLL HB2  
4316 H HB3  . ASN C 72  ? 0.424 0.424 0.612 0.018  -0.005 -0.001 72  ASN LLL HB3  
4319 N N    . SER C 73  ? 0.402 0.421 0.596 0.003  0.035  0.006  73  SER LLL N    
4320 C CA   . SER C 73  ? 0.397 0.416 0.574 -0.000 0.044  0.011  73  SER LLL CA   
4321 C C    . SER C 73  ? 0.386 0.405 0.557 -0.002 0.052  0.013  73  SER LLL C    
4322 O O    . SER C 73  ? 0.380 0.401 0.565 -0.003 0.055  0.010  73  SER LLL O    
4323 C CB   . SER C 73  ? 0.407 0.425 0.594 -0.003 0.051  0.010  73  SER LLL CB   
4324 O OG   . SER C 73  ? 0.416 0.435 0.624 -0.006 0.060  0.007  73  SER LLL OG   
4325 H H    . SER C 73  ? 0.401 0.422 0.608 0.002  0.038  0.005  73  SER LLL H    
4326 H HA   . SER C 73  ? 0.398 0.416 0.561 0.002  0.041  0.013  73  SER LLL HA   
4327 H HB2  . SER C 73  ? 0.407 0.424 0.581 -0.004 0.057  0.012  73  SER LLL HB2  
4328 H HB3  . SER C 73  ? 0.408 0.426 0.600 -0.002 0.045  0.008  73  SER LLL HB3  
4330 N N    . ALA C 74  ? 0.381 0.399 0.533 -0.003 0.056  0.016  74  ALA LLL N    
4331 C CA   . ALA C 74  ? 0.378 0.393 0.520 -0.005 0.063  0.018  74  ALA LLL CA   
4332 C C    . ALA C 74  ? 0.377 0.386 0.511 -0.007 0.070  0.019  74  ALA LLL C    
4333 O O    . ALA C 74  ? 0.378 0.388 0.511 -0.007 0.068  0.019  74  ALA LLL O    
4334 C CB   . ALA C 74  ? 0.377 0.393 0.507 -0.003 0.059  0.020  74  ALA LLL CB   
4335 H H    . ALA C 74  ? 0.381 0.399 0.524 -0.002 0.053  0.018  74  ALA LLL H    
4336 H HA   . ALA C 74  ? 0.378 0.394 0.530 -0.005 0.066  0.016  74  ALA LLL HA   
4337 H HB1  . ALA C 74  ? 0.379 0.393 0.505 -0.004 0.062  0.021  74  ALA LLL HB1  
4338 H HB2  . ALA C 74  ? 0.375 0.393 0.509 -0.001 0.054  0.020  74  ALA LLL HB2  
4339 H HB3  . ALA C 74  ? 0.377 0.392 0.499 -0.003 0.058  0.022  74  ALA LLL HB3  
4340 N N    . SER C 75  ? 0.382 0.384 0.508 -0.008 0.078  0.019  75  SER LLL N    
4341 C CA   . SER C 75  ? 0.386 0.377 0.497 -0.009 0.085  0.020  75  SER LLL CA   
4342 C C    . SER C 75  ? 0.394 0.375 0.485 -0.007 0.085  0.021  75  SER LLL C    
4343 O O    . SER C 75  ? 0.391 0.371 0.484 -0.007 0.086  0.020  75  SER LLL O    
4344 C CB   . SER C 75  ? 0.387 0.372 0.509 -0.010 0.097  0.018  75  SER LLL CB   
4345 O OG   . SER C 75  ? 0.378 0.370 0.519 -0.011 0.095  0.017  75  SER LLL OG   
4346 H H    . SER C 75  ? 0.381 0.383 0.508 -0.007 0.079  0.018  75  SER LLL H    
4347 H HA   . SER C 75  ? 0.384 0.376 0.492 -0.008 0.082  0.021  75  SER LLL HA   
4348 H HB2  . SER C 75  ? 0.388 0.374 0.518 -0.010 0.100  0.017  75  SER LLL HB2  
4349 H HB3  . SER C 75  ? 0.399 0.374 0.508 -0.010 0.103  0.019  75  SER LLL HB3  
4351 N N    . LEU C 76  ? 0.407 0.380 0.481 -0.007 0.083  0.022  76  LEU LLL N    
4352 C CA   . LEU C 76  ? 0.426 0.382 0.477 -0.005 0.083  0.022  76  LEU LLL CA   
4353 C C    . LEU C 76  ? 0.440 0.379 0.478 -0.005 0.095  0.022  76  LEU LLL C    
4354 O O    . LEU C 76  ? 0.427 0.365 0.466 -0.006 0.098  0.023  76  LEU LLL O    
4355 C CB   . LEU C 76  ? 0.429 0.386 0.472 -0.004 0.073  0.023  76  LEU LLL CB   
4356 C CG   . LEU C 76  ? 0.453 0.391 0.473 -0.001 0.068  0.022  76  LEU LLL CG   
4357 C CD1  . LEU C 76  ? 0.456 0.391 0.474 0.000  0.067  0.020  76  LEU LLL CD1  
4358 C CD2  . LEU C 76  ? 0.449 0.391 0.470 -0.000 0.056  0.022  76  LEU LLL CD2  
4359 H H    . LEU C 76  ? 0.403 0.378 0.477 -0.007 0.081  0.022  76  LEU LLL H    
4360 H HA   . LEU C 76  ? 0.426 0.382 0.478 -0.004 0.083  0.021  76  LEU LLL HA   
4361 H HB2  . LEU C 76  ? 0.418 0.385 0.470 -0.004 0.067  0.023  76  LEU LLL HB2  
4362 H HB3  . LEU C 76  ? 0.429 0.385 0.471 -0.004 0.073  0.023  76  LEU LLL HB3  
4363 H HG   . LEU C 76  ? 0.466 0.391 0.472 -0.000 0.073  0.022  76  LEU LLL HG   
4364 H HD11 . LEU C 76  ? 0.466 0.392 0.478 0.001  0.075  0.020  76  LEU LLL HD11 
4365 H HD12 . LEU C 76  ? 0.466 0.391 0.473 0.002  0.060  0.020  76  LEU LLL HD12 
4366 H HD13 . LEU C 76  ? 0.443 0.390 0.476 -0.001 0.065  0.021  76  LEU LLL HD13 
4367 H HD21 . LEU C 76  ? 0.436 0.390 0.471 -0.001 0.052  0.023  76  LEU LLL HD21 
4368 H HD22 . LEU C 76  ? 0.461 0.391 0.470 0.002  0.051  0.021  76  LEU LLL HD22 
4369 H HD23 . LEU C 76  ? 0.446 0.390 0.468 -0.001 0.056  0.023  76  LEU LLL HD23 
4370 N N    . THR C 77  ? 0.464 0.388 0.489 -0.003 0.103  0.021  77  THR LLL N    
4371 C CA   . THR C 77  ? 0.496 0.397 0.501 -0.001 0.117  0.022  77  THR LLL CA   
4372 C C    . THR C 77  ? 0.532 0.409 0.502 0.003  0.112  0.021  77  THR LLL C    
4373 O O    . THR C 77  ? 0.529 0.406 0.496 0.005  0.104  0.020  77  THR LLL O    
4374 C CB   . THR C 77  ? 0.500 0.400 0.519 -0.002 0.132  0.021  77  THR LLL CB   
4375 O OG1  . THR C 77  ? 0.478 0.400 0.531 -0.006 0.132  0.020  77  THR LLL OG1  
4376 C CG2  . THR C 77  ? 0.528 0.403 0.529 -0.000 0.150  0.022  77  THR LLL CG2  
4377 H H    . THR C 77  ? 0.462 0.388 0.489 -0.002 0.100  0.020  77  THR LLL H    
4378 H HA   . THR C 77  ? 0.498 0.398 0.503 -0.002 0.119  0.023  77  THR LLL HA   
4379 H HB   . THR C 77  ? 0.502 0.400 0.517 -0.001 0.130  0.020  77  THR LLL HB   
4381 H HG21 . THR C 77  ? 0.548 0.405 0.524 0.003  0.151  0.022  77  THR LLL HG21 
4382 H HG22 . THR C 77  ? 0.527 0.405 0.544 -0.002 0.160  0.022  77  THR LLL HG22 
4383 H HG23 . THR C 77  ? 0.531 0.403 0.527 -0.001 0.150  0.023  77  THR LLL HG23 
4384 N N    . ILE C 78  ? 0.562 0.417 0.506 0.006  0.115  0.022  78  ILE LLL N    
4385 C CA   . ILE C 78  ? 0.602 0.426 0.506 0.011  0.109  0.021  78  ILE LLL CA   
4386 C C    . ILE C 78  ? 0.651 0.445 0.527 0.015  0.128  0.022  78  ILE LLL C    
4387 O O    . ILE C 78  ? 0.661 0.449 0.533 0.014  0.135  0.024  78  ILE LLL O    
4388 C CB   . ILE C 78  ? 0.599 0.424 0.496 0.012  0.093  0.020  78  ILE LLL CB   
4389 C CG1  . ILE C 78  ? 0.567 0.423 0.497 0.009  0.080  0.020  78  ILE LLL CG1  
4390 C CG2  . ILE C 78  ? 0.631 0.426 0.493 0.019  0.082  0.018  78  ILE LLL CG2  
4391 C CD1  . ILE C 78  ? 0.562 0.420 0.490 0.010  0.065  0.020  78  ILE LLL CD1  
4392 H H    . ILE C 78  ? 0.562 0.417 0.509 0.004  0.121  0.023  78  ILE LLL H    
4393 H HA   . ILE C 78  ? 0.604 0.428 0.507 0.013  0.105  0.020  78  ILE LLL HA   
4394 H HB   . ILE C 78  ? 0.604 0.425 0.498 0.012  0.098  0.022  78  ILE LLL HB   
4395 H HG12 . ILE C 78  ? 0.560 0.422 0.496 0.009  0.076  0.019  78  ILE LLL HG12 
4396 H HG13 . ILE C 78  ? 0.549 0.421 0.498 0.005  0.086  0.021  78  ILE LLL HG13 
4397 H HG21 . ILE C 78  ? 0.656 0.429 0.495 0.022  0.091  0.019  78  ILE LLL HG21 
4398 H HG22 . ILE C 78  ? 0.633 0.425 0.489 0.020  0.072  0.018  78  ILE LLL HG22 
4399 H HG23 . ILE C 78  ? 0.625 0.425 0.493 0.020  0.074  0.017  78  ILE LLL HG23 
4400 H HD11 . ILE C 78  ? 0.580 0.421 0.489 0.011  0.066  0.020  78  ILE LLL HD11 
4401 H HD12 . ILE C 78  ? 0.542 0.419 0.489 0.007  0.063  0.020  78  ILE LLL HD12 
4402 H HD13 . ILE C 78  ? 0.566 0.420 0.490 0.012  0.055  0.018  78  ILE LLL HD13 
4403 N N    . SER C 79  ? 0.689 0.462 0.545 0.019  0.135  0.022  79  SER LLL N    
4404 C CA   . SER C 79  ? 0.739 0.477 0.562 0.023  0.155  0.023  79  SER LLL CA   
4405 C C    . SER C 79  ? 0.792 0.491 0.564 0.031  0.145  0.022  79  SER LLL C    
4406 O O    . SER C 79  ? 0.806 0.506 0.572 0.033  0.123  0.019  79  SER LLL O    
4407 C CB   . SER C 79  ? 0.750 0.481 0.574 0.025  0.168  0.023  79  SER LLL CB   
4408 O OG   . SER C 79  ? 0.730 0.492 0.600 0.019  0.178  0.023  79  SER LLL OG   
4409 H H    . SER C 79  ? 0.681 0.460 0.543 0.019  0.130  0.020  79  SER LLL H    
4410 H HA   . SER C 79  ? 0.738 0.478 0.570 0.021  0.166  0.025  79  SER LLL HA   
4411 H HB2  . SER C 79  ? 0.753 0.483 0.570 0.027  0.156  0.020  79  SER LLL HB2  
4412 H HB3  . SER C 79  ? 0.784 0.488 0.582 0.029  0.182  0.024  79  SER LLL HB3  
4414 N N    . GLY C 80  ? 0.829 0.496 0.568 0.035  0.160  0.025  80  GLY LLL N    
4415 C CA   . GLY C 80  ? 0.871 0.494 0.556 0.044  0.152  0.024  80  GLY LLL CA   
4416 C C    . GLY C 80  ? 0.857 0.490 0.544 0.043  0.124  0.021  80  GLY LLL C    
4417 O O    . GLY C 80  ? 0.875 0.497 0.546 0.048  0.104  0.017  80  GLY LLL O    
4418 H H    . GLY C 80  ? 0.829 0.496 0.577 0.033  0.176  0.027  80  GLY LLL H    
4419 H HA2  . GLY C 80  ? 0.893 0.497 0.560 0.045  0.166  0.026  80  GLY LLL HA2  
4420 H HA3  . GLY C 80  ? 0.893 0.498 0.556 0.049  0.150  0.022  80  GLY LLL HA3  
4421 N N    . LEU C 81  ? 0.829 0.483 0.539 0.038  0.123  0.023  81  LEU LLL N    
4422 C CA   . LEU C 81  ? 0.814 0.480 0.531 0.037  0.100  0.021  81  LEU LLL CA   
4423 C C    . LEU C 81  ? 0.868 0.492 0.537 0.047  0.085  0.018  81  LEU LLL C    
4424 O O    . LEU C 81  ? 0.915 0.499 0.540 0.052  0.097  0.020  81  LEU LLL O    
4425 C CB   . LEU C 81  ? 0.793 0.476 0.530 0.032  0.107  0.024  81  LEU LLL CB   
4426 C CG   . LEU C 81  ? 0.748 0.474 0.536 0.023  0.115  0.026  81  LEU LLL CG   
4427 C CD1  . LEU C 81  ? 0.743 0.477 0.544 0.019  0.125  0.029  81  LEU LLL CD1  
4428 C CD2  . LEU C 81  ? 0.707 0.466 0.527 0.020  0.095  0.023  81  LEU LLL CD2  
4429 H H    . LEU C 81  ? 0.823 0.484 0.546 0.035  0.138  0.026  81  LEU LLL H    
4430 H HA   . LEU C 81  ? 0.789 0.479 0.531 0.035  0.089  0.019  81  LEU LLL HA   
4431 H HB2  . LEU C 81  ? 0.819 0.480 0.534 0.034  0.120  0.026  81  LEU LLL HB2  
4432 H HB3  . LEU C 81  ? 0.791 0.475 0.526 0.033  0.093  0.023  81  LEU LLL HB3  
4433 H HG   . LEU C 81  ? 0.749 0.475 0.542 0.023  0.127  0.026  81  LEU LLL HG   
4434 H HD11 . LEU C 81  ? 0.766 0.479 0.549 0.021  0.139  0.030  81  LEU LLL HD11 
4435 H HD12 . LEU C 81  ? 0.715 0.474 0.547 0.015  0.128  0.029  81  LEU LLL HD12 
4436 H HD13 . LEU C 81  ? 0.743 0.474 0.536 0.020  0.113  0.028  81  LEU LLL HD13 
4437 H HD21 . LEU C 81  ? 0.708 0.466 0.524 0.021  0.084  0.022  81  LEU LLL HD21 
4438 H HD22 . LEU C 81  ? 0.683 0.465 0.531 0.015  0.100  0.024  81  LEU LLL HD22 
4439 H HD23 . LEU C 81  ? 0.712 0.468 0.528 0.022  0.091  0.021  81  LEU LLL HD23 
4440 N N    . GLU C 82  ? 0.876 0.506 0.551 0.048  0.059  0.014  82  GLU LLL N    
4441 C CA   . GLU C 82  ? 0.923 0.520 0.563 0.057  0.037  0.010  82  GLU LLL CA   
4442 C C    . GLU C 82  ? 0.894 0.515 0.562 0.053  0.021  0.009  82  GLU LLL C    
4443 O O    . GLU C 82  ? 0.858 0.521 0.571 0.044  0.024  0.010  82  GLU LLL O    
4444 C CB   . GLU C 82  ? 0.951 0.534 0.580 0.062  0.019  0.005  82  GLU LLL CB   
4445 C CG   . GLU C 82  ? 1.001 0.549 0.589 0.069  0.033  0.005  82  GLU LLL CG   
4446 C CD   . GLU C 82  ? 1.006 0.562 0.606 0.070  0.026  0.002  82  GLU LLL CD   
4447 O OE1  . GLU C 82  ? 1.005 0.569 0.621 0.071  0.001  -0.003 82  GLU LLL OE1  
4448 O OE2  . GLU C 82  ? 1.027 0.581 0.624 0.069  0.046  0.004  82  GLU LLL OE2  
4449 H H    . GLU C 82  ? 0.845 0.502 0.551 0.044  0.052  0.013  82  GLU LLL H    
4450 H HA   . GLU C 82  ? 0.957 0.523 0.561 0.061  0.045  0.011  82  GLU LLL HA   
4451 H HB2  . GLU C 82  ? 0.917 0.530 0.581 0.057  0.016  0.004  82  GLU LLL HB2  
4452 H HB3  . GLU C 82  ? 0.967 0.534 0.581 0.067  0.001  0.001  82  GLU LLL HB3  
4453 H HG2  . GLU C 82  ? 1.042 0.553 0.590 0.076  0.028  0.003  82  GLU LLL HG2  
4454 H HG3  . GLU C 82  ? 0.998 0.551 0.589 0.066  0.054  0.009  82  GLU LLL HG3  
4455 N N    . SER C 83  ? 0.921 0.514 0.561 0.059  0.004  0.006  83  SER LLL N    
4456 C CA   . SER C 83  ? 0.899 0.511 0.564 0.056  -0.013 0.004  83  SER LLL CA   
4457 C C    . SER C 83  ? 0.858 0.512 0.575 0.051  -0.025 0.002  83  SER LLL C    
4458 O O    . SER C 83  ? 0.824 0.511 0.577 0.044  -0.024 0.004  83  SER LLL O    
4459 C CB   . SER C 83  ? 0.937 0.510 0.565 0.065  -0.035 -0.000 83  SER LLL CB   
4460 O OG   . SER C 83  ? 0.981 0.513 0.557 0.071  -0.023 0.002  83  SER LLL OG   
4461 H H    . SER C 83  ? 0.959 0.518 0.562 0.065  0.001  0.004  83  SER LLL H    
4462 H HA   . SER C 83  ? 0.887 0.510 0.560 0.052  -0.001 0.008  83  SER LLL HA   
4463 H HB2  . SER C 83  ? 0.952 0.512 0.571 0.070  -0.048 -0.004 83  SER LLL HB2  
4464 H HB3  . SER C 83  ? 0.921 0.508 0.569 0.063  -0.046 -0.002 83  SER LLL HB3  
4466 N N    . GLU C 84  ? 0.867 0.518 0.587 0.053  -0.035 -0.001 84  GLU LLL N    
4467 C CA   . GLU C 84  ? 0.834 0.518 0.601 0.050  -0.048 -0.004 84  GLU LLL CA   
4468 C C    . GLU C 84  ? 0.772 0.499 0.580 0.040  -0.030 0.001  84  GLU LLL C    
4469 O O    . GLU C 84  ? 0.740 0.498 0.589 0.036  -0.038 0.001  84  GLU LLL O    
4470 C CB   . GLU C 84  ? 0.875 0.542 0.631 0.054  -0.058 -0.007 84  GLU LLL CB   
4471 C CG   . GLU C 84  ? 0.883 0.565 0.647 0.051  -0.039 -0.004 84  GLU LLL CG   
4472 C CD   . GLU C 84  ? 0.921 0.584 0.669 0.056  -0.046 -0.008 84  GLU LLL CD   
4473 O OE1  . GLU C 84  ? 0.951 0.593 0.690 0.062  -0.070 -0.014 84  GLU LLL OE1  
4474 O OE2  . GLU C 84  ? 0.930 0.597 0.676 0.054  -0.030 -0.005 84  GLU LLL OE2  
4475 H H    . GLU C 84  ? 0.893 0.520 0.586 0.058  -0.034 -0.002 84  GLU LLL H    
4476 H HA   . GLU C 84  ? 0.833 0.518 0.609 0.051  -0.062 -0.006 84  GLU LLL HA   
4477 H HB2  . GLU C 84  ? 0.862 0.541 0.643 0.054  -0.072 -0.010 84  GLU LLL HB2  
4478 H HB3  . GLU C 84  ? 0.911 0.545 0.631 0.061  -0.064 -0.010 84  GLU LLL HB3  
4479 H HG2  . GLU C 84  ? 0.890 0.565 0.637 0.050  -0.023 -0.001 84  GLU LLL HG2  
4480 H HG3  . GLU C 84  ? 0.847 0.561 0.646 0.045  -0.035 -0.002 84  GLU LLL HG3  
4481 N N    . ASP C 85  ? 0.754 0.483 0.553 0.037  -0.008 0.006  85  ASP LLL N    
4482 C CA   . ASP C 85  ? 0.704 0.471 0.538 0.029  0.008  0.010  85  ASP LLL CA   
4483 C C    . ASP C 85  ? 0.678 0.465 0.532 0.025  0.010  0.012  85  ASP LLL C    
4484 O O    . ASP C 85  ? 0.655 0.472 0.540 0.019  0.018  0.014  85  ASP LLL O    
4485 C CB   . ASP C 85  ? 0.706 0.466 0.527 0.028  0.030  0.013  85  ASP LLL CB   
4486 C CG   . ASP C 85  ? 0.725 0.467 0.528 0.032  0.031  0.011  85  ASP LLL CG   
4487 O OD1  . ASP C 85  ? 0.721 0.468 0.535 0.034  0.015  0.008  85  ASP LLL OD1  
4488 O OD2  . ASP C 85  ? 0.740 0.463 0.519 0.034  0.047  0.013  85  ASP LLL OD2  
4489 H H    . ASP C 85  ? 0.781 0.487 0.551 0.040  -0.001 0.006  85  ASP LLL H    
4490 H HA   . ASP C 85  ? 0.686 0.469 0.542 0.028  0.003  0.009  85  ASP LLL HA   
4491 H HB2  . ASP C 85  ? 0.727 0.469 0.526 0.030  0.036  0.014  85  ASP LLL HB2  
4492 H HB3  . ASP C 85  ? 0.682 0.465 0.527 0.023  0.038  0.015  85  ASP LLL HB3  
4493 N N    . GLU C 86  ? 0.694 0.463 0.529 0.028  0.002  0.011  86  GLU LLL N    
4494 C CA   . GLU C 86  ? 0.671 0.458 0.525 0.025  0.001  0.012  86  GLU LLL CA   
4495 C C    . GLU C 86  ? 0.633 0.448 0.526 0.022  -0.011 0.011  86  GLU LLL C    
4496 O O    . GLU C 86  ? 0.641 0.447 0.535 0.026  -0.028 0.007  86  GLU LLL O    
4497 C CB   . GLU C 86  ? 0.707 0.468 0.534 0.029  -0.008 0.011  86  GLU LLL CB   
4498 C CG   . GLU C 86  ? 0.692 0.471 0.537 0.025  -0.007 0.012  86  GLU LLL CG   
4499 C CD   . GLU C 86  ? 0.730 0.483 0.544 0.028  -0.006 0.013  86  GLU LLL CD   
4500 O OE1  . GLU C 86  ? 0.752 0.482 0.536 0.030  0.008  0.015  86  GLU LLL OE1  
4501 O OE2  . GLU C 86  ? 0.736 0.491 0.556 0.029  -0.017 0.012  86  GLU LLL OE2  
4502 H H    . GLU C 86  ? 0.722 0.465 0.530 0.033  -0.003 0.009  86  GLU LLL H    
4503 H HA   . GLU C 86  ? 0.659 0.458 0.521 0.021  0.014  0.015  86  GLU LLL HA   
4504 H HB2  . GLU C 86  ? 0.729 0.469 0.529 0.031  0.001  0.012  86  GLU LLL HB2  
4505 H HB3  . GLU C 86  ? 0.719 0.467 0.539 0.033  -0.022 0.007  86  GLU LLL HB3  
4506 H HG2  . GLU C 86  ? 0.683 0.471 0.545 0.026  -0.019 0.010  86  GLU LLL HG2  
4507 H HG3  . GLU C 86  ? 0.672 0.471 0.535 0.021  0.003  0.015  86  GLU LLL HG3  
4508 N N    . ALA C 87  ? 0.589 0.434 0.511 0.017  -0.002 0.014  87  ALA LLL N    
4509 C CA   . ALA C 87  ? 0.555 0.427 0.513 0.014  -0.006 0.014  87  ALA LLL CA   
4510 C C    . ALA C 87  ? 0.526 0.424 0.505 0.009  0.006  0.017  87  ALA LLL C    
4511 O O    . ALA C 87  ? 0.532 0.428 0.500 0.008  0.018  0.019  87  ALA LLL O    
4512 C CB   . ALA C 87  ? 0.559 0.431 0.521 0.015  -0.008 0.013  87  ALA LLL CB   
4513 H H    . ALA C 87  ? 0.585 0.436 0.507 0.014  0.008  0.016  87  ALA LLL H    
4514 H HA   . ALA C 87  ? 0.557 0.428 0.522 0.016  -0.016 0.012  87  ALA LLL HA   
4515 H HB1  . ALA C 87  ? 0.538 0.429 0.524 0.012  -0.006 0.014  87  ALA LLL HB1  
4516 H HB2  . ALA C 87  ? 0.572 0.431 0.528 0.018  -0.019 0.010  87  ALA LLL HB2  
4517 H HB3  . ALA C 87  ? 0.565 0.430 0.514 0.015  0.000  0.014  87  ALA LLL HB3  
4518 N N    . ASP C 88  ? 0.497 0.415 0.504 0.008  0.004  0.018  88  ASP LLL N    
4519 C CA   . ASP C 88  ? 0.464 0.405 0.490 0.005  0.014  0.021  88  ASP LLL CA   
4520 C C    . ASP C 88  ? 0.445 0.394 0.479 0.003  0.019  0.022  88  ASP LLL C    
4521 O O    . ASP C 88  ? 0.449 0.396 0.491 0.005  0.012  0.021  88  ASP LLL O    
4522 C CB   . ASP C 88  ? 0.454 0.408 0.500 0.005  0.011  0.022  88  ASP LLL CB   
4523 C CG   . ASP C 88  ? 0.461 0.409 0.500 0.006  0.006  0.021  88  ASP LLL CG   
4524 O OD1  . ASP C 88  ? 0.467 0.406 0.487 0.005  0.010  0.021  88  ASP LLL OD1  
4525 O OD2  . ASP C 88  ? 0.465 0.416 0.518 0.007  -0.001 0.020  88  ASP LLL OD2  
4526 H H    . ASP C 88  ? 0.496 0.415 0.512 0.009  -0.004 0.017  88  ASP LLL H    
4527 H HA   . ASP C 88  ? 0.466 0.405 0.483 0.004  0.020  0.022  88  ASP LLL HA   
4528 H HB2  . ASP C 88  ? 0.452 0.408 0.509 0.006  0.005  0.021  88  ASP LLL HB2  
4529 H HB3  . ASP C 88  ? 0.442 0.408 0.496 0.003  0.017  0.024  88  ASP LLL HB3  
4530 N N    . TYR C 89  ? 0.424 0.380 0.458 0.001  0.029  0.024  89  TYR LLL N    
4531 C CA   . TYR C 89  ? 0.410 0.374 0.453 0.000  0.034  0.025  89  TYR LLL CA   
4532 C C    . TYR C 89  ? 0.394 0.375 0.453 -0.001 0.038  0.027  89  TYR LLL C    
4533 O O    . TYR C 89  ? 0.400 0.384 0.458 -0.001 0.042  0.027  89  TYR LLL O    
4534 C CB   . TYR C 89  ? 0.416 0.370 0.445 -0.000 0.041  0.024  89  TYR LLL CB   
4535 C CG   . TYR C 89  ? 0.434 0.367 0.442 0.002  0.037  0.022  89  TYR LLL CG   
4536 C CD1  . TYR C 89  ? 0.448 0.364 0.436 0.004  0.036  0.021  89  TYR LLL CD1  
4537 C CD2  . TYR C 89  ? 0.436 0.363 0.441 0.004  0.034  0.021  89  TYR LLL CD2  
4538 C CE1  . TYR C 89  ? 0.476 0.366 0.438 0.007  0.032  0.019  89  TYR LLL CE1  
4539 C CE2  . TYR C 89  ? 0.459 0.363 0.442 0.007  0.029  0.018  89  TYR LLL CE2  
4540 C CZ   . TYR C 89  ? 0.481 0.365 0.440 0.009  0.027  0.017  89  TYR LLL CZ   
4541 O OH   . TYR C 89  ? 0.509 0.365 0.439 0.014  0.022  0.015  89  TYR LLL OH   
4542 H H    . TYR C 89  ? 0.425 0.382 0.456 0.001  0.033  0.024  89  TYR LLL H    
4543 H HA   . TYR C 89  ? 0.412 0.375 0.459 0.001  0.029  0.024  89  TYR LLL HA   
4544 H HB2  . TYR C 89  ? 0.417 0.371 0.443 -0.001 0.046  0.025  89  TYR LLL HB2  
4545 H HB3  . TYR C 89  ? 0.410 0.370 0.446 -0.001 0.044  0.024  89  TYR LLL HB3  
4546 H HD1  . TYR C 89  ? 0.446 0.365 0.435 0.003  0.038  0.022  89  TYR LLL HD1  
4547 H HD2  . TYR C 89  ? 0.425 0.363 0.444 0.003  0.035  0.021  89  TYR LLL HD2  
4548 H HE1  . TYR C 89  ? 0.490 0.367 0.436 0.009  0.031  0.019  89  TYR LLL HE1  
4549 H HE2  . TYR C 89  ? 0.465 0.364 0.446 0.008  0.026  0.017  89  TYR LLL HE2  
4551 N N    . TYR C 90  ? 0.388 0.377 0.460 -0.001 0.038  0.028  90  TYR LLL N    
4552 C CA   . TYR C 90  ? 0.381 0.382 0.464 -0.000 0.042  0.030  90  TYR LLL CA   
4553 C C    . TYR C 90  ? 0.388 0.392 0.474 -0.001 0.045  0.030  90  TYR LLL C    
4554 O O    . TYR C 90  ? 0.390 0.391 0.479 -0.001 0.043  0.030  90  TYR LLL O    
4555 C CB   . TYR C 90  ? 0.371 0.376 0.466 0.001  0.040  0.032  90  TYR LLL CB   
4556 C CG   . TYR C 90  ? 0.367 0.370 0.463 0.002  0.037  0.031  90  TYR LLL CG   
4557 C CD1  . TYR C 90  ? 0.371 0.367 0.466 0.002  0.029  0.029  90  TYR LLL CD1  
4558 C CD2  . TYR C 90  ? 0.366 0.374 0.462 0.003  0.040  0.033  90  TYR LLL CD2  
4559 C CE1  . TYR C 90  ? 0.372 0.366 0.468 0.003  0.025  0.028  90  TYR LLL CE1  
4560 C CE2  . TYR C 90  ? 0.367 0.373 0.464 0.004  0.037  0.032  90  TYR LLL CE2  
4561 C CZ   . TYR C 90  ? 0.368 0.368 0.466 0.004  0.030  0.030  90  TYR LLL CZ   
4562 O OH   . TYR C 90  ? 0.375 0.373 0.475 0.005  0.026  0.029  90  TYR LLL OH   
4563 H H    . TYR C 90  ? 0.390 0.378 0.465 -0.000 0.035  0.027  90  TYR LLL H    
4564 H HA   . TYR C 90  ? 0.380 0.382 0.460 -0.000 0.044  0.030  90  TYR LLL HA   
4565 H HB2  . TYR C 90  ? 0.371 0.376 0.473 0.001  0.038  0.032  90  TYR LLL HB2  
4566 H HB3  . TYR C 90  ? 0.367 0.377 0.466 0.002  0.044  0.034  90  TYR LLL HB3  
4567 H HD1  . TYR C 90  ? 0.376 0.367 0.469 0.002  0.026  0.028  90  TYR LLL HD1  
4568 H HD2  . TYR C 90  ? 0.363 0.374 0.458 0.004  0.044  0.034  90  TYR LLL HD2  
4569 H HE1  . TYR C 90  ? 0.380 0.367 0.475 0.004  0.019  0.026  90  TYR LLL HE1  
4570 H HE2  . TYR C 90  ? 0.365 0.373 0.461 0.005  0.040  0.033  90  TYR LLL HE2  
4572 N N    . CYS C 91  ? 0.398 0.406 0.485 -0.001 0.048  0.031  91  CYS LLL N    
4573 C CA   . CYS C 91  ? 0.406 0.418 0.499 -0.000 0.050  0.031  91  CYS LLL CA   
4574 C C    . CYS C 91  ? 0.388 0.403 0.486 0.002  0.051  0.034  91  CYS LLL C    
4575 O O    . CYS C 91  ? 0.375 0.391 0.472 0.004  0.051  0.036  91  CYS LLL O    
4576 C CB   . CYS C 91  ? 0.432 0.445 0.525 -0.000 0.051  0.030  91  CYS LLL CB   
4577 S SG   . CYS C 91  ? 0.482 0.496 0.573 0.001  0.050  0.030  91  CYS LLL SG   
4578 H H    . CYS C 91  ? 0.397 0.406 0.482 -0.001 0.049  0.031  91  CYS LLL H    
4579 H HA   . CYS C 91  ? 0.407 0.417 0.501 -0.001 0.050  0.031  91  CYS LLL HA   
4580 H HB2  . CYS C 91  ? 0.435 0.450 0.532 0.001  0.051  0.030  91  CYS LLL HB2  
4581 H HB3  . CYS C 91  ? 0.438 0.449 0.531 -0.002 0.053  0.028  91  CYS LLL HB3  
4582 N N    . GLN C 92  ? 0.384 0.401 0.487 0.003  0.052  0.036  92  GLN LLL N    
4583 C CA   . GLN C 92  ? 0.382 0.399 0.489 0.005  0.055  0.039  92  GLN LLL CA   
4584 C C    . GLN C 92  ? 0.379 0.395 0.484 0.006  0.055  0.039  92  GLN LLL C    
4585 O O    . GLN C 92  ? 0.374 0.392 0.483 0.004  0.054  0.037  92  GLN LLL O    
4586 C CB   . GLN C 92  ? 0.383 0.401 0.502 0.004  0.056  0.041  92  GLN LLL CB   
4587 C CG   . GLN C 92  ? 0.388 0.405 0.513 0.007  0.062  0.045  92  GLN LLL CG   
4588 C CD   . GLN C 92  ? 0.394 0.410 0.521 0.006  0.062  0.045  92  GLN LLL CD   
4589 O OE1  . GLN C 92  ? 0.399 0.418 0.532 0.004  0.058  0.043  92  GLN LLL OE1  
4590 N NE2  . GLN C 92  ? 0.393 0.405 0.513 0.010  0.067  0.048  92  GLN LLL NE2  
4591 H H    . GLN C 92  ? 0.384 0.400 0.488 0.001  0.051  0.034  92  GLN LLL H    
4592 H HA   . GLN C 92  ? 0.385 0.400 0.487 0.007  0.056  0.040  92  GLN LLL HA   
4593 H HB2  . GLN C 92  ? 0.383 0.401 0.503 0.004  0.055  0.040  92  GLN LLL HB2  
4594 H HB3  . GLN C 92  ? 0.382 0.400 0.503 0.003  0.053  0.039  92  GLN LLL HB3  
4595 H HG2  . GLN C 92  ? 0.393 0.408 0.510 0.009  0.065  0.046  92  GLN LLL HG2  
4596 H HG3  . GLN C 92  ? 0.388 0.406 0.523 0.007  0.063  0.046  92  GLN LLL HG3  
4599 N N    . SER C 93  ? 0.383 0.395 0.481 0.010  0.057  0.041  93  SER LLL N    
4600 C CA   . SER C 93  ? 0.386 0.393 0.480 0.012  0.057  0.042  93  SER LLL CA   
4601 C C    . SER C 93  ? 0.390 0.388 0.475 0.017  0.062  0.046  93  SER LLL C    
4602 O O    . SER C 93  ? 0.387 0.384 0.471 0.018  0.067  0.049  93  SER LLL O    
4603 C CB   . SER C 93  ? 0.390 0.396 0.481 0.013  0.051  0.038  93  SER LLL CB   
4604 O OG   . SER C 93  ? 0.397 0.400 0.488 0.015  0.049  0.038  93  SER LLL OG   
4605 H H    . SER C 93  ? 0.387 0.396 0.479 0.012  0.058  0.042  93  SER LLL H    
4606 H HA   . SER C 93  ? 0.382 0.392 0.483 0.010  0.057  0.042  93  SER LLL HA   
4607 H HB2  . SER C 93  ? 0.384 0.395 0.481 0.010  0.050  0.035  93  SER LLL HB2  
4608 H HB3  . SER C 93  ? 0.395 0.397 0.479 0.015  0.049  0.038  93  SER LLL HB3  
4610 N N    . TYR C 94  ? 0.397 0.387 0.474 0.021  0.061  0.047  94  TYR LLL N    
4611 C CA   . TYR C 94  ? 0.411 0.388 0.475 0.026  0.068  0.052  94  TYR LLL CA   
4612 C C    . TYR C 94  ? 0.428 0.391 0.471 0.033  0.063  0.051  94  TYR LLL C    
4613 O O    . TYR C 94  ? 0.426 0.389 0.468 0.033  0.053  0.046  94  TYR LLL O    
4614 C CB   . TYR C 94  ? 0.407 0.383 0.478 0.025  0.072  0.055  94  TYR LLL CB   
4615 C CG   . TYR C 94  ? 0.389 0.377 0.482 0.020  0.075  0.055  94  TYR LLL CG   
4616 C CD1  . TYR C 94  ? 0.375 0.374 0.480 0.015  0.069  0.051  94  TYR LLL CD1  
4617 C CD2  . TYR C 94  ? 0.391 0.377 0.492 0.020  0.085  0.060  94  TYR LLL CD2  
4618 C CE1  . TYR C 94  ? 0.366 0.372 0.488 0.011  0.069  0.051  94  TYR LLL CE1  
4619 C CE2  . TYR C 94  ? 0.381 0.377 0.506 0.016  0.086  0.060  94  TYR LLL CE2  
4620 C CZ   . TYR C 94  ? 0.371 0.376 0.505 0.011  0.077  0.055  94  TYR LLL CZ   
4621 O OH   . TYR C 94  ? 0.372 0.383 0.525 0.008  0.075  0.055  94  TYR LLL OH   
4622 H H    . TYR C 94  ? 0.395 0.386 0.474 0.020  0.057  0.045  94  TYR LLL H    
4623 H HA   . TYR C 94  ? 0.411 0.388 0.478 0.026  0.074  0.054  94  TYR LLL HA   
4624 H HB2  . TYR C 94  ? 0.406 0.383 0.476 0.025  0.066  0.052  94  TYR LLL HB2  
4625 H HB3  . TYR C 94  ? 0.421 0.386 0.481 0.029  0.077  0.058  94  TYR LLL HB3  
4626 H HD1  . TYR C 94  ? 0.373 0.373 0.474 0.014  0.063  0.048  94  TYR LLL HD1  
4627 H HD2  . TYR C 94  ? 0.404 0.381 0.496 0.024  0.092  0.064  94  TYR LLL HD2  
4628 H HE1  . TYR C 94  ? 0.360 0.371 0.487 0.008  0.065  0.048  94  TYR LLL HE1  
4629 H HE2  . TYR C 94  ? 0.384 0.378 0.518 0.016  0.093  0.063  94  TYR LLL HE2  
4631 N N    . TYR C 95  ? 0.453 0.400 0.478 0.039  0.070  0.055  95  TYR LLL N    
4632 C CA   . TYR C 95  ? 0.485 0.410 0.481 0.047  0.066  0.055  95  TYR LLL CA   
4633 C C    . TYR C 95  ? 0.513 0.420 0.492 0.053  0.080  0.062  95  TYR LLL C    
4634 O O    . TYR C 95  ? 0.506 0.413 0.488 0.053  0.092  0.066  95  TYR LLL O    
4635 C CB   . TYR C 95  ? 0.485 0.406 0.471 0.050  0.059  0.052  95  TYR LLL CB   
4636 C CG   . TYR C 95  ? 0.510 0.408 0.467 0.059  0.050  0.050  95  TYR LLL CG   
4637 C CD1  . TYR C 95  ? 0.513 0.408 0.472 0.061  0.035  0.044  95  TYR LLL CD1  
4638 C CD2  . TYR C 95  ? 0.538 0.413 0.467 0.068  0.056  0.053  95  TYR LLL CD2  
4639 C CE1  . TYR C 95  ? 0.539 0.411 0.472 0.070  0.024  0.042  95  TYR LLL CE1  
4640 C CE2  . TYR C 95  ? 0.571 0.420 0.469 0.078  0.045  0.051  95  TYR LLL CE2  
4641 C CZ   . TYR C 95  ? 0.572 0.419 0.472 0.079  0.028  0.045  95  TYR LLL CZ   
4642 O OH   . TYR C 95  ? 0.610 0.429 0.480 0.089  0.015  0.042  95  TYR LLL OH   
4643 H H    . TYR C 95  ? 0.453 0.401 0.481 0.038  0.078  0.058  95  TYR LLL H    
4644 H HA   . TYR C 95  ? 0.486 0.409 0.480 0.048  0.058  0.053  95  TYR LLL HA   
4645 H HB2  . TYR C 95  ? 0.470 0.404 0.470 0.046  0.053  0.048  95  TYR LLL HB2  
4646 H HB3  . TYR C 95  ? 0.487 0.408 0.471 0.050  0.067  0.055  95  TYR LLL HB3  
4647 H HD1  . TYR C 95  ? 0.496 0.405 0.473 0.055  0.032  0.042  95  TYR LLL HD1  
4648 H HD2  . TYR C 95  ? 0.538 0.415 0.468 0.067  0.066  0.057  95  TYR LLL HD2  
4649 H HE1  . TYR C 95  ? 0.541 0.411 0.478 0.071  0.012  0.037  95  TYR LLL HE1  
4650 H HE2  . TYR C 95  ? 0.591 0.423 0.467 0.084  0.050  0.053  95  TYR LLL HE2  
4652 N N    . ARG C 96  ? 0.552 0.442 0.514 0.058  0.079  0.064  96  ARG LLL N    
4653 C CA   . ARG C 96  ? 0.590 0.459 0.533 0.064  0.094  0.071  96  ARG LLL CA   
4654 C C    . ARG C 96  ? 0.563 0.446 0.533 0.058  0.109  0.076  96  ARG LLL C    
4655 O O    . ARG C 96  ? 0.584 0.455 0.548 0.062  0.125  0.082  96  ARG LLL O    
4656 C CB   . ARG C 96  ? 0.645 0.490 0.557 0.073  0.099  0.074  96  ARG LLL CB   
4657 C CG   . ARG C 96  ? 0.700 0.519 0.576 0.083  0.084  0.070  96  ARG LLL CG   
4658 C CD   . ARG C 96  ? 0.765 0.548 0.602 0.094  0.093  0.075  96  ARG LLL CD   
4659 N NE   . ARG C 96  ? 0.817 0.569 0.613 0.105  0.087  0.074  96  ARG LLL NE   
4660 C CZ   . ARG C 96  ? 0.837 0.584 0.624 0.108  0.095  0.075  96  ARG LLL CZ   
4661 N NH1  . ARG C 96  ? 0.812 0.583 0.629 0.100  0.109  0.078  96  ARG LLL NH1  
4662 N NH2  . ARG C 96  ? 0.878 0.595 0.625 0.119  0.087  0.073  96  ARG LLL NH2  
4663 H H    . ARG C 96  ? 0.548 0.439 0.510 0.058  0.069  0.060  96  ARG LLL H    
4664 H HA   . ARG C 96  ? 0.601 0.460 0.534 0.067  0.089  0.071  96  ARG LLL HA   
4665 H HB2  . ARG C 96  ? 0.633 0.488 0.554 0.071  0.099  0.072  96  ARG LLL HB2  
4666 H HB3  . ARG C 96  ? 0.660 0.493 0.564 0.076  0.113  0.079  96  ARG LLL HB3  
4667 H HG2  . ARG C 96  ? 0.688 0.515 0.573 0.080  0.073  0.065  96  ARG LLL HG2  
4668 H HG3  . ARG C 96  ? 0.701 0.519 0.571 0.085  0.080  0.067  96  ARG LLL HG3  
4669 H HD2  . ARG C 96  ? 0.767 0.548 0.607 0.093  0.109  0.081  96  ARG LLL HD2  
4670 H HD3  . ARG C 96  ? 0.767 0.546 0.601 0.095  0.087  0.074  96  ARG LLL HD3  
4671 H HE   . ARG C 96  ? 0.835 0.571 0.612 0.111  0.077  0.071  96  ARG LLL HE   
4672 H HH11 . ARG C 96  ? 0.789 0.578 0.631 0.093  0.113  0.079  96  ARG LLL HH11 
4673 H HH12 . ARG C 96  ? 0.817 0.584 0.627 0.102  0.114  0.079  96  ARG LLL HH12 
4674 H HH21 . ARG C 96  ? 0.894 0.594 0.621 0.125  0.076  0.071  96  ARG LLL HH21 
4675 H HH22 . ARG C 96  ? 0.881 0.594 0.621 0.121  0.093  0.074  96  ARG LLL HH22 
4676 N N    . GLY C 97  ? 0.518 0.425 0.520 0.049  0.104  0.073  97  GLY LLL N    
4677 C CA   . GLY C 97  ? 0.488 0.409 0.519 0.043  0.114  0.076  97  GLY LLL CA   
4678 C C    . GLY C 97  ? 0.464 0.400 0.515 0.039  0.117  0.075  97  GLY LLL C    
4679 O O    . GLY C 97  ? 0.449 0.398 0.528 0.034  0.121  0.076  97  GLY LLL O    
4680 H H    . GLY C 97  ? 0.508 0.423 0.514 0.047  0.093  0.069  97  GLY LLL H    
4681 H HA2  . GLY C 97  ? 0.476 0.408 0.520 0.039  0.108  0.074  97  GLY LLL HA2  
4682 H HA3  . GLY C 97  ? 0.504 0.414 0.530 0.046  0.125  0.081  97  GLY LLL HA3  
4683 N N    . ASP C 98  ? 0.462 0.394 0.498 0.042  0.113  0.073  98  ASP LLL N    
4684 C CA   . ASP C 98  ? 0.449 0.391 0.500 0.039  0.116  0.073  98  ASP LLL CA   
4685 C C    . ASP C 98  ? 0.418 0.379 0.482 0.033  0.102  0.066  98  ASP LLL C    
4686 O O    . ASP C 98  ? 0.417 0.378 0.471 0.033  0.091  0.062  98  ASP LLL O    
4687 C CB   . ASP C 98  ? 0.471 0.397 0.497 0.046  0.121  0.074  98  ASP LLL CB   
4688 C CG   . ASP C 98  ? 0.505 0.408 0.510 0.054  0.136  0.081  98  ASP LLL CG   
4689 O OD1  . ASP C 98  ? 0.513 0.412 0.525 0.053  0.145  0.085  98  ASP LLL OD1  
4690 O OD2  . ASP C 98  ? 0.536 0.420 0.514 0.061  0.140  0.082  98  ASP LLL OD2  
4691 H H    . ASP C 98  ? 0.474 0.397 0.491 0.046  0.108  0.072  98  ASP LLL H    
4692 H HA   . ASP C 98  ? 0.444 0.391 0.513 0.037  0.124  0.075  98  ASP LLL HA   
4693 H HB2  . ASP C 98  ? 0.474 0.397 0.486 0.048  0.111  0.071  98  ASP LLL HB2  
4694 H HB3  . ASP C 98  ? 0.464 0.398 0.501 0.044  0.124  0.074  98  ASP LLL HB3  
4695 N N    . TRP C 99  ? 0.402 0.376 0.486 0.028  0.102  0.065  99  TRP LLL N    
4696 C CA   . TRP C 99  ? 0.384 0.371 0.477 0.023  0.091  0.060  99  TRP LLL CA   
4697 C C    . TRP C 99  ? 0.387 0.370 0.463 0.026  0.086  0.057  99  TRP LLL C    
4698 O O    . TRP C 99  ? 0.396 0.370 0.462 0.031  0.093  0.060  99  TRP LLL O    
4699 C CB   . TRP C 99  ? 0.369 0.367 0.487 0.019  0.091  0.059  99  TRP LLL CB   
4700 C CG   . TRP C 99  ? 0.353 0.358 0.489 0.015  0.088  0.058  99  TRP LLL CG   
4701 C CD1  . TRP C 99  ? 0.357 0.359 0.493 0.015  0.089  0.059  99  TRP LLL CD1  
4702 C CD2  . TRP C 99  ? 0.341 0.354 0.497 0.011  0.081  0.055  99  TRP LLL CD2  
4703 N NE1  . TRP C 99  ? 0.348 0.358 0.503 0.011  0.084  0.057  99  TRP LLL NE1  
4704 C CE2  . TRP C 99  ? 0.339 0.355 0.506 0.008  0.079  0.055  99  TRP LLL CE2  
4705 C CE3  . TRP C 99  ? 0.339 0.356 0.503 0.009  0.077  0.052  99  TRP LLL CE3  
4706 C CZ2  . TRP C 99  ? 0.335 0.355 0.518 0.005  0.071  0.051  99  TRP LLL CZ2  
4707 C CZ3  . TRP C 99  ? 0.334 0.355 0.514 0.006  0.068  0.049  99  TRP LLL CZ3  
4708 C CH2  . TRP C 99  ? 0.333 0.355 0.522 0.005  0.065  0.049  99  TRP LLL CH2  
4709 H H    . TRP C 99  ? 0.404 0.378 0.499 0.028  0.110  0.068  99  TRP LLL H    
4710 H HA   . TRP C 99  ? 0.378 0.369 0.472 0.021  0.085  0.057  99  TRP LLL HA   
4711 H HB2  . TRP C 99  ? 0.374 0.369 0.497 0.021  0.099  0.062  99  TRP LLL HB2  
4712 H HB3  . TRP C 99  ? 0.363 0.365 0.480 0.018  0.086  0.056  99  TRP LLL HB3  
4713 H HD1  . TRP C 99  ? 0.365 0.361 0.489 0.017  0.092  0.061  99  TRP LLL HD1  
4714 H HE1  . TRP C 99  ? 0.346 0.357 0.505 0.010  0.083  0.058  99  TRP LLL HE1  
4715 H HE3  . TRP C 99  ? 0.341 0.357 0.498 0.011  0.078  0.053  99  TRP LLL HE3  
4716 H HZ2  . TRP C 99  ? 0.333 0.354 0.523 0.004  0.068  0.051  99  TRP LLL HZ2  
4717 H HZ3  . TRP C 99  ? 0.332 0.354 0.517 0.006  0.064  0.047  99  TRP LLL HZ3  
4718 H HH2  . TRP C 99  ? 0.331 0.353 0.530 0.003  0.058  0.046  99  TRP LLL HH2  
4719 N N    . VAL C 100 ? 0.382 0.371 0.456 0.023  0.076  0.052  100 VAL LLL N    
4720 C CA   . VAL C 100 ? 0.386 0.375 0.452 0.024  0.070  0.049  100 VAL LLL CA   
4721 C C    . VAL C 100 ? 0.376 0.377 0.456 0.018  0.065  0.046  100 VAL LLL C    
4722 O O    . VAL C 100 ? 0.375 0.381 0.463 0.014  0.062  0.044  100 VAL LLL O    
4723 C CB   . VAL C 100 ? 0.389 0.371 0.440 0.027  0.062  0.046  100 VAL LLL CB   
4724 C CG1  . VAL C 100 ? 0.390 0.372 0.436 0.028  0.056  0.043  100 VAL LLL CG1  
4725 C CG2  . VAL C 100 ? 0.409 0.374 0.441 0.034  0.065  0.049  100 VAL LLL CG2  
4726 H H    . VAL C 100 ? 0.377 0.370 0.455 0.021  0.072  0.051  100 VAL LLL H    
4727 H HA   . VAL C 100 ? 0.391 0.376 0.453 0.026  0.074  0.051  100 VAL LLL HA   
4728 H HB   . VAL C 100 ? 0.383 0.370 0.441 0.025  0.058  0.044  100 VAL LLL HB   
4729 H HG11 . VAL C 100 ? 0.379 0.369 0.435 0.024  0.054  0.041  100 VAL LLL HG11 
4730 H HG12 . VAL C 100 ? 0.398 0.372 0.435 0.031  0.051  0.042  100 VAL LLL HG12 
4731 H HG13 . VAL C 100 ? 0.394 0.373 0.436 0.030  0.060  0.045  100 VAL LLL HG13 
4732 H HG21 . VAL C 100 ? 0.418 0.377 0.443 0.037  0.071  0.052  100 VAL LLL HG21 
4733 H HG22 . VAL C 100 ? 0.416 0.375 0.439 0.037  0.058  0.047  100 VAL LLL HG22 
4734 H HG23 . VAL C 100 ? 0.410 0.375 0.445 0.034  0.068  0.051  100 VAL LLL HG23 
4735 N N    . LEU C 101 ? 0.374 0.378 0.455 0.017  0.064  0.045  101 LEU LLL N    
4736 C CA   . LEU C 101 ? 0.366 0.377 0.456 0.013  0.060  0.042  101 LEU LLL CA   
4737 C C    . LEU C 101 ? 0.369 0.378 0.450 0.013  0.055  0.039  101 LEU LLL C    
4738 O O    . LEU C 101 ? 0.377 0.382 0.449 0.016  0.056  0.040  101 LEU LLL O    
4739 C CB   . LEU C 101 ? 0.369 0.381 0.469 0.012  0.062  0.044  101 LEU LLL CB   
4740 C CG   . LEU C 101 ? 0.371 0.385 0.487 0.011  0.066  0.046  101 LEU LLL CG   
4741 C CD1  . LEU C 101 ? 0.370 0.388 0.503 0.010  0.065  0.046  101 LEU LLL CD1  
4742 C CD2  . LEU C 101 ? 0.368 0.385 0.487 0.008  0.061  0.043  101 LEU LLL CD2  
4743 H H    . LEU C 101 ? 0.381 0.380 0.456 0.020  0.067  0.046  101 LEU LLL H    
4744 H HA   . LEU C 101 ? 0.363 0.376 0.457 0.010  0.058  0.041  101 LEU LLL HA   
4745 H HB2  . LEU C 101 ? 0.373 0.383 0.471 0.015  0.066  0.045  101 LEU LLL HB2  
4746 H HB3  . LEU C 101 ? 0.365 0.380 0.467 0.010  0.058  0.041  101 LEU LLL HB3  
4747 H HG   . LEU C 101 ? 0.376 0.387 0.490 0.014  0.071  0.048  101 LEU LLL HG   
4748 H HD11 . LEU C 101 ? 0.373 0.389 0.505 0.012  0.069  0.047  101 LEU LLL HD11 
4749 H HD12 . LEU C 101 ? 0.369 0.387 0.514 0.010  0.067  0.047  101 LEU LLL HD12 
4750 H HD13 . LEU C 101 ? 0.367 0.385 0.499 0.008  0.059  0.043  101 LEU LLL HD13 
4751 H HD21 . LEU C 101 ? 0.365 0.383 0.481 0.006  0.056  0.041  101 LEU LLL HD21 
4752 H HD22 . LEU C 101 ? 0.366 0.384 0.497 0.007  0.061  0.044  101 LEU LLL HD22 
4753 H HD23 . LEU C 101 ? 0.369 0.385 0.482 0.009  0.062  0.044  101 LEU LLL HD23 
4754 N N    . GLY C 102 ? 0.360 0.372 0.443 0.009  0.051  0.037  102 GLY LLL N    
4755 C CA   . GLY C 102 ? 0.358 0.369 0.437 0.008  0.048  0.034  102 GLY LLL CA   
4756 C C    . GLY C 102 ? 0.356 0.367 0.435 0.008  0.048  0.035  102 GLY LLL C    
4757 O O    . GLY C 102 ? 0.366 0.378 0.451 0.008  0.050  0.036  102 GLY LLL O    
4758 H H    . GLY C 102 ? 0.358 0.371 0.445 0.007  0.051  0.036  102 GLY LLL H    
4759 H HA2  . GLY C 102 ? 0.361 0.370 0.436 0.010  0.047  0.034  102 GLY LLL HA2  
4760 H HA3  . GLY C 102 ? 0.356 0.368 0.437 0.005  0.048  0.033  102 GLY LLL HA3  
4761 N N    . GLY C 103 ? 0.348 0.357 0.422 0.008  0.046  0.033  103 GLY LLL N    
4762 C CA   . GLY C 103 ? 0.344 0.352 0.416 0.008  0.045  0.033  103 GLY LLL CA   
4763 C C    . GLY C 103 ? 0.340 0.347 0.414 0.005  0.043  0.032  103 GLY LLL C    
4764 O O    . GLY C 103 ? 0.343 0.347 0.417 0.005  0.040  0.032  103 GLY LLL O    
4765 H H    . GLY C 103 ? 0.350 0.358 0.422 0.008  0.045  0.032  103 GLY LLL H    
4766 H HA2  . GLY C 103 ? 0.345 0.354 0.420 0.010  0.047  0.035  103 GLY LLL HA2  
4767 H HA3  . GLY C 103 ? 0.346 0.353 0.414 0.009  0.044  0.033  103 GLY LLL HA3  
4768 N N    . GLY C 104 ? 0.343 0.348 0.416 0.003  0.043  0.031  104 GLY LLL N    
4769 C CA   . GLY C 104 ? 0.355 0.353 0.423 0.001  0.041  0.030  104 GLY LLL CA   
4770 C C    . GLY C 104 ? 0.370 0.361 0.428 -0.001 0.042  0.028  104 GLY LLL C    
4771 O O    . GLY C 104 ? 0.375 0.367 0.432 -0.000 0.042  0.028  104 GLY LLL O    
4772 H H    . GLY C 104 ? 0.343 0.349 0.417 0.003  0.045  0.031  104 GLY LLL H    
4773 H HA2  . GLY C 104 ? 0.356 0.354 0.425 0.000  0.041  0.030  104 GLY LLL HA2  
4774 H HA3  . GLY C 104 ? 0.357 0.354 0.427 0.002  0.037  0.030  104 GLY LLL HA3  
4775 N N    . THR C 105 ? 0.387 0.368 0.436 -0.002 0.043  0.027  105 THR LLL N    
4776 C CA   . THR C 105 ? 0.399 0.369 0.436 -0.003 0.047  0.027  105 THR LLL CA   
4777 C C    . THR C 105 ? 0.417 0.372 0.438 -0.001 0.042  0.026  105 THR LLL C    
4778 O O    . THR C 105 ? 0.421 0.373 0.442 -0.000 0.037  0.025  105 THR LLL O    
4779 C CB   . THR C 105 ? 0.403 0.371 0.441 -0.004 0.054  0.027  105 THR LLL CB   
4780 O OG1  . THR C 105 ? 0.400 0.380 0.453 -0.005 0.056  0.027  105 THR LLL OG1  
4781 C CG2  . THR C 105 ? 0.416 0.369 0.442 -0.005 0.062  0.026  105 THR LLL CG2  
4782 H H    . THR C 105 ? 0.386 0.367 0.436 -0.002 0.042  0.027  105 THR LLL H    
4783 H HA   . THR C 105 ? 0.398 0.370 0.436 -0.003 0.047  0.027  105 THR LLL HA   
4784 H HB   . THR C 105 ? 0.406 0.372 0.442 -0.004 0.054  0.026  105 THR LLL HB   
4786 H HG21 . THR C 105 ? 0.429 0.371 0.441 -0.004 0.061  0.026  105 THR LLL HG21 
4787 H HG22 . THR C 105 ? 0.415 0.371 0.448 -0.006 0.068  0.026  105 THR LLL HG22 
4788 H HG23 . THR C 105 ? 0.418 0.370 0.441 -0.005 0.061  0.027  105 THR LLL HG23 
4789 N N    . LYS C 106 ? 0.433 0.375 0.440 -0.001 0.041  0.026  106 LYS LLL N    
4790 C CA   . LYS C 106 ? 0.462 0.384 0.448 0.001  0.036  0.024  106 LYS LLL CA   
4791 C C    . LYS C 106 ? 0.489 0.393 0.456 0.001  0.046  0.025  106 LYS LLL C    
4792 O O    . LYS C 106 ? 0.495 0.396 0.459 -0.000 0.054  0.026  106 LYS LLL O    
4793 C CB   . LYS C 106 ? 0.472 0.387 0.451 0.003  0.029  0.024  106 LYS LLL CB   
4794 C CG   . LYS C 106 ? 0.496 0.392 0.458 0.007  0.018  0.021  106 LYS LLL CG   
4795 C CD   . LYS C 106 ? 0.515 0.396 0.463 0.009  0.011  0.020  106 LYS LLL CD   
4796 C CE   . LYS C 106 ? 0.542 0.405 0.477 0.013  -0.004 0.017  106 LYS LLL CE   
4797 N NZ   . LYS C 106 ? 0.564 0.412 0.486 0.016  -0.012 0.015  106 LYS LLL NZ   
4798 H H    . LYS C 106 ? 0.431 0.376 0.440 -0.002 0.044  0.026  106 LYS LLL H    
4799 H HA   . LYS C 106 ? 0.462 0.385 0.451 0.003  0.031  0.023  106 LYS LLL HA   
4800 H HB2  . LYS C 106 ? 0.458 0.387 0.452 0.003  0.026  0.024  106 LYS LLL HB2  
4801 H HB3  . LYS C 106 ? 0.478 0.388 0.449 0.002  0.034  0.024  106 LYS LLL HB3  
4802 H HG2  . LYS C 106 ? 0.510 0.393 0.458 0.008  0.020  0.021  106 LYS LLL HG2  
4803 H HG3  . LYS C 106 ? 0.489 0.392 0.463 0.007  0.011  0.020  106 LYS LLL HG3  
4804 H HD2  . LYS C 106 ? 0.502 0.397 0.464 0.008  0.009  0.021  106 LYS LLL HD2  
4805 H HD3  . LYS C 106 ? 0.527 0.398 0.460 0.008  0.018  0.021  106 LYS LLL HD3  
4806 H HE2  . LYS C 106 ? 0.558 0.406 0.476 0.015  -0.003 0.016  106 LYS LLL HE2  
4807 H HE3  . LYS C 106 ? 0.530 0.404 0.484 0.013  -0.010 0.016  106 LYS LLL HE3  
4808 H HZ1  . LYS C 106 ? 0.548 0.410 0.485 0.014  -0.013 0.016  106 LYS LLL HZ1  
4809 H HZ2  . LYS C 106 ? 0.575 0.411 0.490 0.019  -0.023 0.013  106 LYS LLL HZ2  
4810 H HZ3  . LYS C 106 ? 0.574 0.411 0.479 0.016  -0.006 0.017  106 LYS LLL HZ3  
4811 N N    . LEU C 107 ? 0.500 0.393 0.456 0.003  0.046  0.024  107 LEU LLL N    
4812 C CA   . LEU C 107 ? 0.526 0.395 0.457 0.005  0.055  0.024  107 LEU LLL CA   
4813 C C    . LEU C 107 ? 0.558 0.400 0.459 0.009  0.048  0.023  107 LEU LLL C    
4814 O O    . LEU C 107 ? 0.572 0.406 0.465 0.012  0.034  0.020  107 LEU LLL O    
4815 C CB   . LEU C 107 ? 0.531 0.397 0.460 0.006  0.055  0.023  107 LEU LLL CB   
4816 C CG   . LEU C 107 ? 0.560 0.399 0.461 0.009  0.065  0.023  107 LEU LLL CG   
4817 C CD1  . LEU C 107 ? 0.570 0.403 0.468 0.007  0.082  0.026  107 LEU LLL CD1  
4818 C CD2  . LEU C 107 ? 0.561 0.402 0.467 0.009  0.067  0.022  107 LEU LLL CD2  
4819 H H    . LEU C 107 ? 0.494 0.393 0.457 0.004  0.040  0.023  107 LEU LLL H    
4820 H HA   . LEU C 107 ? 0.525 0.396 0.460 0.003  0.065  0.026  107 LEU LLL HA   
4821 H HB2  . LEU C 107 ? 0.513 0.396 0.461 0.004  0.059  0.024  107 LEU LLL HB2  
4822 H HB3  . LEU C 107 ? 0.531 0.396 0.459 0.008  0.044  0.021  107 LEU LLL HB3  
4823 H HG   . LEU C 107 ? 0.582 0.401 0.460 0.013  0.058  0.022  107 LEU LLL HG   
4824 H HD11 . LEU C 107 ? 0.580 0.402 0.465 0.008  0.080  0.026  107 LEU LLL HD11 
4825 H HD12 . LEU C 107 ? 0.585 0.404 0.471 0.008  0.091  0.026  107 LEU LLL HD12 
4826 H HD13 . LEU C 107 ? 0.548 0.401 0.470 0.004  0.085  0.026  107 LEU LLL HD13 
4827 H HD21 . LEU C 107 ? 0.543 0.401 0.468 0.006  0.074  0.023  107 LEU LLL HD21 
4828 H HD22 . LEU C 107 ? 0.582 0.404 0.467 0.012  0.073  0.022  107 LEU LLL HD22 
4829 H HD23 . LEU C 107 ? 0.554 0.401 0.465 0.010  0.056  0.021  107 LEU LLL HD23 
4830 N N    . THR C 108 ? 0.572 0.401 0.459 0.009  0.057  0.025  108 THR LLL N    
4831 C CA   . THR C 108 ? 0.602 0.400 0.454 0.013  0.053  0.024  108 THR LLL CA   
4832 C C    . THR C 108 ? 0.631 0.397 0.451 0.017  0.065  0.025  108 THR LLL C    
4833 O O    . THR C 108 ? 0.623 0.392 0.449 0.014  0.084  0.028  108 THR LLL O    
4834 C CB   . THR C 108 ? 0.602 0.404 0.459 0.011  0.055  0.026  108 THR LLL CB   
4835 O OG1  . THR C 108 ? 0.583 0.414 0.470 0.009  0.046  0.025  108 THR LLL OG1  
4836 C CG2  . THR C 108 ? 0.632 0.402 0.454 0.016  0.048  0.025  108 THR LLL CG2  
4837 H H    . THR C 108 ? 0.563 0.400 0.461 0.006  0.066  0.026  108 THR LLL H    
4838 H HA   . THR C 108 ? 0.606 0.400 0.454 0.016  0.039  0.022  108 THR LLL HA   
4839 H HB   . THR C 108 ? 0.602 0.405 0.463 0.009  0.068  0.028  108 THR LLL HB   
4841 H HG21 . THR C 108 ? 0.657 0.405 0.456 0.018  0.057  0.027  108 THR LLL HG21 
4842 H HG22 . THR C 108 ? 0.627 0.402 0.454 0.015  0.048  0.026  108 THR LLL HG22 
4843 H HG23 . THR C 108 ? 0.637 0.403 0.454 0.019  0.035  0.023  108 THR LLL HG23 
4844 N N    . VAL C 109 ? 0.657 0.394 0.444 0.023  0.055  0.023  109 VAL LLL N    
4845 C CA   . VAL C 109 ? 0.697 0.395 0.442 0.029  0.065  0.024  109 VAL LLL CA   
4846 C C    . VAL C 109 ? 0.725 0.394 0.438 0.032  0.067  0.025  109 VAL LLL C    
4847 O O    . VAL C 109 ? 0.740 0.395 0.437 0.036  0.047  0.022  109 VAL LLL O    
4848 C CB   . VAL C 109 ? 0.721 0.398 0.443 0.035  0.052  0.020  109 VAL LLL CB   
4849 C CG1  . VAL C 109 ? 0.770 0.400 0.441 0.042  0.063  0.021  109 VAL LLL CG1  
4850 C CG2  . VAL C 109 ? 0.692 0.398 0.447 0.031  0.051  0.019  109 VAL LLL CG2  
4851 H H    . VAL C 109 ? 0.654 0.394 0.444 0.025  0.041  0.021  109 VAL LLL H    
4852 H HA   . VAL C 109 ? 0.695 0.396 0.446 0.026  0.081  0.026  109 VAL LLL HA   
4853 H HB   . VAL C 109 ? 0.723 0.397 0.442 0.037  0.035  0.018  109 VAL LLL HB   
4854 H HG11 . VAL C 109 ? 0.796 0.403 0.441 0.046  0.056  0.020  109 VAL LLL HG11 
4855 H HG12 . VAL C 109 ? 0.780 0.402 0.443 0.045  0.057  0.019  109 VAL LLL HG12 
4856 H HG13 . VAL C 109 ? 0.772 0.403 0.445 0.040  0.081  0.024  109 VAL LLL HG13 
4857 H HG21 . VAL C 109 ? 0.688 0.399 0.448 0.029  0.067  0.021  109 VAL LLL HG21 
4858 H HG22 . VAL C 109 ? 0.706 0.399 0.447 0.035  0.042  0.017  109 VAL LLL HG22 
4859 H HG23 . VAL C 109 ? 0.663 0.395 0.446 0.027  0.045  0.019  109 VAL LLL HG23 
4860 N N    . LEU C 110 ? 0.731 0.389 0.436 0.030  0.089  0.030  110 LEU LLL N    
4861 C CA   . LEU C 110 ? 0.753 0.390 0.436 0.032  0.094  0.032  110 LEU LLL CA   
4862 C C    . LEU C 110 ? 0.807 0.392 0.432 0.041  0.089  0.031  110 LEU LLL C    
4863 O O    . LEU C 110 ? 0.848 0.404 0.443 0.046  0.104  0.033  110 LEU LLL O    
4864 C CB   . LEU C 110 ? 0.750 0.393 0.448 0.027  0.121  0.037  110 LEU LLL CB   
4865 C CG   . LEU C 110 ? 0.699 0.389 0.454 0.018  0.125  0.037  110 LEU LLL CG   
4866 C CD1  . LEU C 110 ? 0.700 0.391 0.470 0.014  0.151  0.041  110 LEU LLL CD1  
4867 C CD2  . LEU C 110 ? 0.673 0.385 0.450 0.015  0.114  0.037  110 LEU LLL CD2  
4868 H H    . LEU C 110 ? 0.729 0.392 0.442 0.028  0.103  0.031  110 LEU LLL H    
4869 H HA   . LEU C 110 ? 0.734 0.387 0.433 0.030  0.083  0.031  110 LEU LLL HA   
4870 H HB2  . LEU C 110 ? 0.770 0.395 0.453 0.029  0.134  0.038  110 LEU LLL HB2  
4871 H HB3  . LEU C 110 ? 0.764 0.393 0.450 0.027  0.125  0.039  110 LEU LLL HB3  
4872 H HG   . LEU C 110 ? 0.682 0.387 0.450 0.018  0.117  0.035  110 LEU LLL HG   
4873 H HD11 . LEU C 110 ? 0.715 0.393 0.473 0.017  0.159  0.041  110 LEU LLL HD11 
4874 H HD12 . LEU C 110 ? 0.669 0.389 0.474 0.010  0.151  0.040  110 LEU LLL HD12 
4875 H HD13 . LEU C 110 ? 0.717 0.393 0.476 0.015  0.161  0.043  110 LEU LLL HD13 
4876 H HD21 . LEU C 110 ? 0.690 0.387 0.454 0.015  0.121  0.039  110 LEU LLL HD21 
4877 H HD22 . LEU C 110 ? 0.645 0.384 0.454 0.010  0.116  0.037  110 LEU LLL HD22 
4878 H HD23 . LEU C 110 ? 0.670 0.384 0.442 0.017  0.097  0.034  110 LEU LLL HD23 
4879 N N    . GLY C 111 ? 0.814 0.386 0.421 0.045  0.070  0.029  111 GLY LLL N    
4880 C CA   . GLY C 111 ? 0.867 0.386 0.416 0.055  0.062  0.028  111 GLY LLL CA   
4881 C C    . GLY C 111 ? 0.887 0.386 0.415 0.056  0.071  0.031  111 GLY LLL C    
4882 O O    . GLY C 111 ? 0.938 0.391 0.416 0.064  0.063  0.030  111 GLY LLL O    
4883 H H    . GLY C 111 ? 0.789 0.383 0.420 0.042  0.059  0.027  111 GLY LLL H    
4884 H HA2  . GLY C 111 ? 0.895 0.390 0.418 0.059  0.072  0.029  111 GLY LLL HA2  
4885 H HA3  . GLY C 111 ? 0.869 0.386 0.415 0.058  0.041  0.023  111 GLY LLL HA3  
4886 N N    . GLN C 112 ? 0.850 0.381 0.417 0.047  0.085  0.035  112 GLN LLL N    
4887 C CA   . GLN C 112 ? 0.859 0.377 0.415 0.046  0.095  0.039  112 GLN LLL CA   
4888 C C    . GLN C 112 ? 0.817 0.371 0.419 0.037  0.116  0.043  112 GLN LLL C    
4889 O O    . GLN C 112 ? 0.769 0.361 0.413 0.031  0.116  0.041  112 GLN LLL O    
4890 C CB   . GLN C 112 ? 0.853 0.375 0.410 0.048  0.070  0.035  112 GLN LLL CB   
4891 C CG   . GLN C 112 ? 0.798 0.372 0.410 0.041  0.055  0.032  112 GLN LLL CG   
4892 C CD   . GLN C 112 ? 0.797 0.372 0.410 0.042  0.034  0.029  112 GLN LLL CD   
4893 O OE1  . GLN C 112 ? 0.810 0.376 0.414 0.042  0.039  0.031  112 GLN LLL OE1  
4894 N NE2  . GLN C 112 ? 0.787 0.374 0.413 0.045  0.010  0.023  112 GLN LLL NE2  
4895 H H    . GLN C 112 ? 0.816 0.378 0.417 0.042  0.089  0.035  112 GLN LLL H    
4896 H HA   . GLN C 112 ? 0.900 0.381 0.417 0.051  0.105  0.041  112 GLN LLL HA   
4897 H HB2  . GLN C 112 ? 0.867 0.376 0.412 0.048  0.077  0.038  112 GLN LLL HB2  
4898 H HB3  . GLN C 112 ? 0.879 0.377 0.408 0.054  0.056  0.032  112 GLN LLL HB3  
4899 H HG2  . GLN C 112 ? 0.786 0.371 0.409 0.041  0.048  0.029  112 GLN LLL HG2  
4900 H HG3  . GLN C 112 ? 0.773 0.371 0.413 0.035  0.068  0.035  112 GLN LLL HG3  
4903 N N    . PRO C 113 ? 0.833 0.375 0.430 0.035  0.134  0.047  113 PRO LLL N    
4904 C CA   . PRO C 113 ? 0.800 0.374 0.444 0.026  0.152  0.050  113 PRO LLL CA   
4905 C C    . PRO C 113 ? 0.748 0.369 0.440 0.020  0.135  0.047  113 PRO LLL C    
4906 O O    . PRO C 113 ? 0.739 0.363 0.425 0.022  0.113  0.044  113 PRO LLL O    
4907 C CB   . PRO C 113 ? 0.831 0.376 0.455 0.027  0.170  0.056  113 PRO LLL CB   
4908 C CG   . PRO C 113 ? 0.892 0.381 0.448 0.037  0.168  0.056  113 PRO LLL CG   
4909 C CD   . PRO C 113 ? 0.885 0.378 0.430 0.041  0.138  0.050  113 PRO LLL CD   
4910 H HA   . PRO C 113 ? 0.796 0.375 0.451 0.025  0.164  0.051  113 PRO LLL HA   
4911 H HB2  . PRO C 113 ? 0.816 0.374 0.453 0.025  0.161  0.055  113 PRO LLL HB2  
4912 H HB3  . PRO C 113 ? 0.831 0.378 0.469 0.024  0.189  0.059  113 PRO LLL HB3  
4913 H HG2  . PRO C 113 ? 0.911 0.382 0.449 0.039  0.170  0.058  113 PRO LLL HG2  
4914 H HG3  . PRO C 113 ? 0.915 0.384 0.455 0.039  0.185  0.059  113 PRO LLL HG3  
4915 H HD2  . PRO C 113 ? 0.880 0.376 0.425 0.042  0.122  0.048  113 PRO LLL HD2  
4916 H HD3  . PRO C 113 ? 0.919 0.381 0.428 0.048  0.137  0.049  113 PRO LLL HD3  
4917 N N    . LYS C 114 ? 0.715 0.371 0.454 0.013  0.144  0.048  114 LYS LLL N    
4918 C CA   . LYS C 114 ? 0.672 0.370 0.456 0.007  0.131  0.046  114 LYS LLL CA   
4919 C C    . LYS C 114 ? 0.670 0.362 0.447 0.007  0.125  0.046  114 LYS LLL C    
4920 O O    . LYS C 114 ? 0.703 0.365 0.456 0.009  0.139  0.050  114 LYS LLL O    
4921 C CB   . LYS C 114 ? 0.654 0.380 0.482 0.001  0.144  0.046  114 LYS LLL CB   
4922 C CG   . LYS C 114 ? 0.644 0.389 0.491 -0.000 0.145  0.045  114 LYS LLL CG   
4923 C CD   . LYS C 114 ? 0.683 0.405 0.517 0.001  0.166  0.047  114 LYS LLL CD   
4924 C CE   . LYS C 114 ? 0.668 0.409 0.521 0.000  0.166  0.045  114 LYS LLL CE   
4925 N NZ   . LYS C 114 ? 0.630 0.411 0.530 -0.005 0.157  0.043  114 LYS LLL NZ   
4926 H H    . LYS C 114 ? 0.719 0.373 0.465 0.011  0.160  0.050  114 LYS LLL H    
4927 H HA   . LYS C 114 ? 0.659 0.368 0.445 0.008  0.117  0.043  114 LYS LLL HA   
4928 H HB2  . LYS C 114 ? 0.670 0.382 0.496 0.000  0.161  0.049  114 LYS LLL HB2  
4929 H HB3  . LYS C 114 ? 0.631 0.377 0.482 -0.002 0.137  0.045  114 LYS LLL HB3  
4930 H HG2  . LYS C 114 ? 0.618 0.388 0.498 -0.004 0.143  0.043  114 LYS LLL HG2  
4931 H HG3  . LYS C 114 ? 0.642 0.388 0.479 0.002  0.131  0.042  114 LYS LLL HG3  
4932 H HD2  . LYS C 114 ? 0.710 0.405 0.509 0.006  0.168  0.048  114 LYS LLL HD2  
4933 H HD3  . LYS C 114 ? 0.683 0.404 0.531 -0.001 0.180  0.049  114 LYS LLL HD3  
4934 H HE2  . LYS C 114 ? 0.674 0.409 0.508 0.003  0.155  0.043  114 LYS LLL HE2  
4935 H HE3  . LYS C 114 ? 0.683 0.412 0.534 0.000  0.182  0.047  114 LYS LLL HE3  
4936 H HZ1  . LYS C 114 ? 0.623 0.409 0.540 -0.008 0.163  0.043  114 LYS LLL HZ1  
4937 H HZ2  . LYS C 114 ? 0.621 0.410 0.534 -0.006 0.161  0.042  114 LYS LLL HZ2  
4938 H HZ3  . LYS C 114 ? 0.616 0.407 0.516 -0.005 0.143  0.041  114 LYS LLL HZ3  
4939 N N    . SER C 115 ? 0.633 0.351 0.431 0.006  0.106  0.043  115 SER LLL N    
4940 C CA   . SER C 115 ? 0.627 0.345 0.422 0.006  0.096  0.043  115 SER LLL CA   
4941 C C    . SER C 115 ? 0.577 0.334 0.415 0.002  0.087  0.040  115 SER LLL C    
4942 O O    . SER C 115 ? 0.559 0.337 0.411 0.002  0.075  0.037  115 SER LLL O    
4943 C CB   . SER C 115 ? 0.647 0.343 0.409 0.012  0.078  0.040  115 SER LLL CB   
4944 O OG   . SER C 115 ? 0.651 0.341 0.406 0.013  0.071  0.040  115 SER LLL OG   
4945 H H    . SER C 115 ? 0.612 0.350 0.427 0.005  0.098  0.041  115 SER LLL H    
4946 H HA   . SER C 115 ? 0.642 0.346 0.431 0.005  0.108  0.046  115 SER LLL HA   
4947 H HB2  . SER C 115 ? 0.676 0.346 0.409 0.016  0.083  0.041  115 SER LLL HB2  
4948 H HB3  . SER C 115 ? 0.629 0.342 0.403 0.013  0.066  0.037  115 SER LLL HB3  
4950 N N    . SER C 116 ? 0.564 0.330 0.422 -0.002 0.095  0.042  116 SER LLL N    
4951 C CA   . SER C 116 ? 0.526 0.325 0.421 -0.005 0.086  0.040  116 SER LLL CA   
4952 C C    . SER C 116 ? 0.516 0.319 0.404 -0.003 0.068  0.037  116 SER LLL C    
4953 O O    . SER C 116 ? 0.534 0.314 0.396 -0.000 0.065  0.038  116 SER LLL O    
4954 C CB   . SER C 116 ? 0.523 0.326 0.441 -0.009 0.098  0.042  116 SER LLL CB   
4955 O OG   . SER C 116 ? 0.524 0.327 0.456 -0.012 0.114  0.043  116 SER LLL OG   
4956 H H    . SER C 116 ? 0.581 0.332 0.431 -0.002 0.105  0.045  116 SER LLL H    
4957 H HA   . SER C 116 ? 0.509 0.324 0.419 -0.006 0.084  0.038  116 SER LLL HA   
4958 H HB2  . SER C 116 ? 0.541 0.327 0.444 -0.009 0.102  0.044  116 SER LLL HB2  
4959 H HB3  . SER C 116 ? 0.502 0.324 0.441 -0.011 0.091  0.040  116 SER LLL HB3  
4961 N N    . PRO C 117 ? 0.489 0.318 0.399 -0.003 0.056  0.034  117 PRO LLL N    
4962 C CA   . PRO C 117 ? 0.487 0.320 0.394 -0.000 0.040  0.032  117 PRO LLL CA   
4963 C C    . PRO C 117 ? 0.491 0.320 0.398 -0.001 0.039  0.033  117 PRO LLL C    
4964 O O    . PRO C 117 ? 0.476 0.314 0.402 -0.004 0.047  0.034  117 PRO LLL O    
4965 C CB   . PRO C 117 ? 0.457 0.320 0.391 -0.001 0.033  0.030  117 PRO LLL CB   
4966 C CG   . PRO C 117 ? 0.445 0.319 0.399 -0.004 0.044  0.031  117 PRO LLL CG   
4967 C CD   . PRO C 117 ? 0.463 0.318 0.402 -0.005 0.058  0.033  117 PRO LLL CD   
4968 H HA   . PRO C 117 ? 0.500 0.320 0.389 0.002  0.035  0.031  117 PRO LLL HA   
4969 H HB2  . PRO C 117 ? 0.449 0.319 0.389 -0.000 0.027  0.028  117 PRO LLL HB2  
4970 H HB3  . PRO C 117 ? 0.456 0.320 0.386 0.001  0.029  0.029  117 PRO LLL HB3  
4971 H HG2  . PRO C 117 ? 0.439 0.319 0.404 -0.006 0.045  0.031  117 PRO LLL HG2  
4972 H HG3  . PRO C 117 ? 0.430 0.319 0.396 -0.004 0.042  0.030  117 PRO LLL HG3  
4973 H HD2  . PRO C 117 ? 0.462 0.319 0.414 -0.008 0.066  0.034  117 PRO LLL HD2  
4974 H HD3  . PRO C 117 ? 0.464 0.319 0.400 -0.005 0.058  0.033  117 PRO LLL HD3  
4975 N N    . SER C 118 ? 0.510 0.326 0.399 0.002  0.030  0.032  118 SER LLL N    
4976 C CA   . SER C 118 ? 0.512 0.329 0.404 0.002  0.023  0.031  118 SER LLL CA   
4977 C C    . SER C 118 ? 0.483 0.326 0.397 0.003  0.012  0.028  118 SER LLL C    
4978 O O    . SER C 118 ? 0.473 0.320 0.387 0.006  0.003  0.025  118 SER LLL O    
4979 C CB   . SER C 118 ? 0.545 0.335 0.407 0.006  0.017  0.031  118 SER LLL CB   
4980 O OG   . SER C 118 ? 0.580 0.349 0.428 0.004  0.029  0.035  118 SER LLL OG   
4981 H H    . SER C 118 ? 0.523 0.326 0.395 0.005  0.025  0.031  118 SER LLL H    
4982 H HA   . SER C 118 ? 0.510 0.329 0.411 -0.000 0.031  0.032  118 SER LLL HA   
4983 H HB2  . SER C 118 ? 0.559 0.337 0.406 0.008  0.013  0.030  118 SER LLL HB2  
4984 H HB3  . SER C 118 ? 0.540 0.336 0.407 0.007  0.007  0.029  118 SER LLL HB3  
4986 N N    . VAL C 119 ? 0.469 0.326 0.402 0.002  0.012  0.027  119 VAL LLL N    
4987 C CA   . VAL C 119 ? 0.447 0.328 0.400 0.003  0.004  0.024  119 VAL LLL CA   
4988 C C    . VAL C 119 ? 0.447 0.328 0.402 0.005  -0.003 0.023  119 VAL LLL C    
4989 O O    . VAL C 119 ? 0.452 0.327 0.408 0.003  0.001  0.024  119 VAL LLL O    
4990 C CB   . VAL C 119 ? 0.427 0.324 0.400 0.002  0.009  0.024  119 VAL LLL CB   
4991 C CG1  . VAL C 119 ? 0.409 0.324 0.396 0.004  0.002  0.022  119 VAL LLL CG1  
4992 C CG2  . VAL C 119 ? 0.427 0.323 0.400 -0.000 0.018  0.026  119 VAL LLL CG2  
4993 H H    . VAL C 119 ? 0.473 0.326 0.408 0.000  0.017  0.028  119 VAL LLL H    
4994 H HA   . VAL C 119 ? 0.444 0.327 0.396 0.005  -0.001 0.023  119 VAL LLL HA   
4995 H HB   . VAL C 119 ? 0.429 0.324 0.408 0.000  0.012  0.025  119 VAL LLL HB   
4996 H HG11 . VAL C 119 ? 0.409 0.325 0.398 0.006  -0.001 0.021  119 VAL LLL HG11 
4997 H HG12 . VAL C 119 ? 0.402 0.325 0.397 0.004  0.005  0.022  119 VAL LLL HG12 
4998 H HG13 . VAL C 119 ? 0.409 0.325 0.392 0.006  -0.001 0.022  119 VAL LLL HG13 
4999 H HG21 . VAL C 119 ? 0.430 0.323 0.395 0.001  0.015  0.026  119 VAL LLL HG21 
5000 H HG22 . VAL C 119 ? 0.416 0.323 0.403 -0.001 0.019  0.025  119 VAL LLL HG22 
5001 H HG23 . VAL C 119 ? 0.439 0.323 0.406 -0.002 0.024  0.028  119 VAL LLL HG23 
5002 N N    . THR C 120 ? 0.445 0.332 0.402 0.008  -0.013 0.021  120 THR LLL N    
5003 C CA   . THR C 120 ? 0.445 0.335 0.406 0.011  -0.020 0.019  120 THR LLL CA   
5004 C C    . THR C 120 ? 0.429 0.338 0.407 0.013  -0.022 0.017  120 THR LLL C    
5005 O O    . THR C 120 ? 0.420 0.334 0.401 0.015  -0.024 0.016  120 THR LLL O    
5006 C CB   . THR C 120 ? 0.461 0.336 0.408 0.013  -0.029 0.018  120 THR LLL CB   
5007 O OG1  . THR C 120 ? 0.487 0.341 0.414 0.011  -0.025 0.020  120 THR LLL OG1  
5008 C CG2  . THR C 120 ? 0.464 0.338 0.412 0.014  -0.034 0.016  120 THR LLL CG2  
5009 H H    . THR C 120 ? 0.443 0.332 0.400 0.010  -0.015 0.020  120 THR LLL H    
5010 H HA   . THR C 120 ? 0.447 0.335 0.409 0.009  -0.017 0.020  120 THR LLL HA   
5011 H HB   . THR C 120 ? 0.459 0.338 0.410 0.015  -0.033 0.016  120 THR LLL HB   
5013 H HG21 . THR C 120 ? 0.452 0.338 0.412 0.016  -0.036 0.015  120 THR LLL HG21 
5014 H HG22 . THR C 120 ? 0.475 0.338 0.413 0.016  -0.040 0.016  120 THR LLL HG22 
5015 H HG23 . THR C 120 ? 0.465 0.337 0.413 0.012  -0.030 0.018  120 THR LLL HG23 
5016 N N    . LEU C 121 ? 0.425 0.340 0.410 0.015  -0.023 0.016  121 LEU LLL N    
5017 C CA   . LEU C 121 ? 0.419 0.346 0.413 0.019  -0.025 0.014  121 LEU LLL CA   
5018 C C    . LEU C 121 ? 0.431 0.356 0.425 0.022  -0.032 0.012  121 LEU LLL C    
5019 O O    . LEU C 121 ? 0.442 0.360 0.431 0.021  -0.035 0.012  121 LEU LLL O    
5020 C CB   . LEU C 121 ? 0.411 0.344 0.411 0.019  -0.023 0.014  121 LEU LLL CB   
5021 C CG   . LEU C 121 ? 0.405 0.346 0.409 0.025  -0.024 0.012  121 LEU LLL CG   
5022 C CD1  . LEU C 121 ? 0.398 0.345 0.405 0.027  -0.020 0.013  121 LEU LLL CD1  
5023 C CD2  . LEU C 121 ? 0.406 0.347 0.412 0.026  -0.025 0.011  121 LEU LLL CD2  
5024 H H    . LEU C 121 ? 0.429 0.340 0.413 0.013  -0.022 0.016  121 LEU LLL H    
5025 H HA   . LEU C 121 ? 0.415 0.347 0.413 0.020  -0.023 0.014  121 LEU LLL HA   
5026 H HB2  . LEU C 121 ? 0.409 0.344 0.411 0.017  -0.019 0.015  121 LEU LLL HB2  
5027 H HB3  . LEU C 121 ? 0.415 0.344 0.415 0.018  -0.025 0.013  121 LEU LLL HB3  
5028 H HG   . LEU C 121 ? 0.408 0.347 0.410 0.027  -0.027 0.011  121 LEU LLL HG   
5029 H HD11 . LEU C 121 ? 0.400 0.346 0.407 0.027  -0.021 0.013  121 LEU LLL HD11 
5030 H HD12 . LEU C 121 ? 0.398 0.348 0.406 0.030  -0.018 0.013  121 LEU LLL HD12 
5031 H HD13 . LEU C 121 ? 0.396 0.344 0.404 0.024  -0.017 0.014  121 LEU LLL HD13 
5032 H HD21 . LEU C 121 ? 0.403 0.346 0.412 0.024  -0.022 0.012  121 LEU LLL HD21 
5033 H HD22 . LEU C 121 ? 0.407 0.349 0.411 0.031  -0.025 0.010  121 LEU LLL HD22 
5034 H HD23 . LEU C 121 ? 0.409 0.346 0.416 0.025  -0.028 0.010  121 LEU LLL HD23 
5035 N N    . PHE C 122 ? 0.439 0.369 0.439 0.026  -0.033 0.011  122 PHE LLL N    
5036 C CA   . PHE C 122 ? 0.450 0.379 0.453 0.030  -0.038 0.009  122 PHE LLL CA   
5037 C C    . PHE C 122 ? 0.448 0.385 0.456 0.035  -0.035 0.008  122 PHE LLL C    
5038 O O    . PHE C 122 ? 0.437 0.381 0.451 0.036  -0.028 0.009  122 PHE LLL O    
5039 C CB   . PHE C 122 ? 0.456 0.383 0.465 0.030  -0.043 0.007  122 PHE LLL CB   
5040 C CG   . PHE C 122 ? 0.466 0.378 0.462 0.027  -0.049 0.007  122 PHE LLL CG   
5041 C CD1  . PHE C 122 ? 0.478 0.379 0.463 0.027  -0.055 0.007  122 PHE LLL CD1  
5042 C CD2  . PHE C 122 ? 0.471 0.379 0.465 0.026  -0.050 0.008  122 PHE LLL CD2  
5043 C CE1  . PHE C 122 ? 0.497 0.381 0.466 0.025  -0.060 0.007  122 PHE LLL CE1  
5044 C CE2  . PHE C 122 ? 0.490 0.380 0.467 0.025  -0.056 0.008  122 PHE LLL CE2  
5045 C CZ   . PHE C 122 ? 0.504 0.381 0.468 0.025  -0.061 0.008  122 PHE LLL CZ   
5046 H H    . PHE C 122 ? 0.434 0.369 0.439 0.026  -0.030 0.011  122 PHE LLL H    
5047 H HA   . PHE C 122 ? 0.455 0.378 0.452 0.029  -0.042 0.008  122 PHE LLL HA   
5048 H HB2  . PHE C 122 ? 0.450 0.382 0.466 0.031  -0.040 0.008  122 PHE LLL HB2  
5049 H HB3  . PHE C 122 ? 0.455 0.383 0.470 0.033  -0.046 0.006  122 PHE LLL HB3  
5050 H HD1  . PHE C 122 ? 0.476 0.380 0.464 0.028  -0.055 0.006  122 PHE LLL HD1  
5051 H HD2  . PHE C 122 ? 0.464 0.380 0.466 0.026  -0.047 0.008  122 PHE LLL HD2  
5052 H HE1  . PHE C 122 ? 0.505 0.380 0.466 0.025  -0.063 0.007  122 PHE LLL HE1  
5053 H HE2  . PHE C 122 ? 0.494 0.379 0.467 0.024  -0.057 0.008  122 PHE LLL HE2  
5054 H HZ   . PHE C 122 ? 0.518 0.380 0.467 0.024  -0.064 0.008  122 PHE LLL HZ   
5055 N N    . PRO C 123 ? 0.457 0.391 0.462 0.038  -0.038 0.006  123 PRO LLL N    
5056 C CA   . PRO C 123 ? 0.461 0.398 0.468 0.044  -0.034 0.005  123 PRO LLL CA   
5057 C C    . PRO C 123 ? 0.461 0.402 0.481 0.047  -0.031 0.004  123 PRO LLL C    
5058 O O    . PRO C 123 ? 0.460 0.401 0.488 0.045  -0.035 0.004  123 PRO LLL O    
5059 C CB   . PRO C 123 ? 0.467 0.398 0.467 0.046  -0.040 0.003  123 PRO LLL CB   
5060 C CG   . PRO C 123 ? 0.469 0.395 0.469 0.042  -0.047 0.003  123 PRO LLL CG   
5061 C CD   . PRO C 123 ? 0.464 0.390 0.463 0.036  -0.045 0.005  123 PRO LLL CD   
5062 H HA   . PRO C 123 ? 0.459 0.398 0.464 0.045  -0.030 0.006  123 PRO LLL HA   
5063 H HB2  . PRO C 123 ? 0.471 0.401 0.472 0.051  -0.039 0.002  123 PRO LLL HB2  
5064 H HB3  . PRO C 123 ? 0.469 0.398 0.464 0.046  -0.041 0.003  123 PRO LLL HB3  
5065 H HG2  . PRO C 123 ? 0.470 0.396 0.474 0.043  -0.049 0.002  123 PRO LLL HG2  
5066 H HG3  . PRO C 123 ? 0.473 0.394 0.467 0.041  -0.051 0.002  123 PRO LLL HG3  
5067 H HD2  . PRO C 123 ? 0.467 0.389 0.465 0.034  -0.048 0.005  123 PRO LLL HD2  
5068 H HD3  . PRO C 123 ? 0.465 0.389 0.460 0.034  -0.044 0.006  123 PRO LLL HD3  
5069 N N    . PRO C 124 ? 0.473 0.415 0.495 0.054  -0.024 0.004  124 PRO LLL N    
5070 C CA   . PRO C 124 ? 0.477 0.422 0.516 0.057  -0.019 0.003  124 PRO LLL CA   
5071 C C    . PRO C 124 ? 0.485 0.427 0.529 0.058  -0.027 0.000  124 PRO LLL C    
5072 O O    . PRO C 124 ? 0.495 0.431 0.525 0.058  -0.033 -0.000 124 PRO LLL O    
5073 C CB   . PRO C 124 ? 0.485 0.429 0.520 0.064  -0.006 0.005  124 PRO LLL CB   
5074 C CG   . PRO C 124 ? 0.488 0.427 0.502 0.064  -0.007 0.006  124 PRO LLL CG   
5075 C CD   . PRO C 124 ? 0.481 0.419 0.490 0.059  -0.019 0.004  124 PRO LLL CD   
5076 H HA   . PRO C 124 ? 0.472 0.421 0.521 0.054  -0.018 0.004  124 PRO LLL HA   
5077 H HB2  . PRO C 124 ? 0.491 0.431 0.525 0.068  -0.005 0.003  124 PRO LLL HB2  
5078 H HB3  . PRO C 124 ? 0.482 0.430 0.528 0.064  0.001  0.006  124 PRO LLL HB3  
5079 H HG2  . PRO C 124 ? 0.497 0.430 0.501 0.069  -0.004 0.005  124 PRO LLL HG2  
5080 H HG3  . PRO C 124 ? 0.484 0.426 0.499 0.062  -0.003 0.007  124 PRO LLL HG3  
5081 H HD2  . PRO C 124 ? 0.487 0.421 0.490 0.061  -0.023 0.003  124 PRO LLL HD2  
5082 H HD3  . PRO C 124 ? 0.480 0.418 0.482 0.056  -0.020 0.005  124 PRO LLL HD3  
5083 N N    . SER C 125 ? 0.497 0.442 0.561 0.059  -0.027 -0.001 125 SER LLL N    
5084 C CA   . SER C 125 ? 0.505 0.446 0.576 0.062  -0.034 -0.004 125 SER LLL CA   
5085 C C    . SER C 125 ? 0.519 0.459 0.588 0.069  -0.024 -0.005 125 SER LLL C    
5086 O O    . SER C 125 ? 0.521 0.462 0.591 0.072  -0.010 -0.002 125 SER LLL O    
5087 C CB   . SER C 125 ? 0.500 0.444 0.597 0.061  -0.038 -0.007 125 SER LLL CB   
5088 O OG   . SER C 125 ? 0.492 0.444 0.609 0.063  -0.026 -0.005 125 SER LLL OG   
5089 H H    . SER C 125 ? 0.491 0.440 0.567 0.058  -0.024 -0.001 125 SER LLL H    
5090 H HA   . SER C 125 ? 0.507 0.444 0.567 0.059  -0.042 -0.005 125 SER LLL HA   
5091 H HB2  . SER C 125 ? 0.503 0.446 0.607 0.063  -0.041 -0.009 125 SER LLL HB2  
5092 H HB3  . SER C 125 ? 0.498 0.441 0.592 0.057  -0.046 -0.007 125 SER LLL HB3  
5094 N N    . SER C 126 ? 0.539 0.474 0.604 0.072  -0.029 -0.007 126 SER LLL N    
5095 C CA   . SER C 126 ? 0.560 0.491 0.624 0.080  -0.020 -0.008 126 SER LLL CA   
5096 C C    . SER C 126 ? 0.573 0.508 0.666 0.083  -0.010 -0.009 126 SER LLL C    
5097 O O    . SER C 126 ? 0.603 0.536 0.695 0.089  0.006  -0.007 126 SER LLL O    
5098 C CB   . SER C 126 ? 0.561 0.485 0.615 0.081  -0.030 -0.011 126 SER LLL CB   
5099 O OG   . SER C 126 ? 0.555 0.481 0.630 0.080  -0.038 -0.014 126 SER LLL OG   
5100 H H    . SER C 126 ? 0.538 0.470 0.600 0.069  -0.039 -0.009 126 SER LLL H    
5101 H HA   . SER C 126 ? 0.564 0.492 0.614 0.082  -0.014 -0.006 126 SER LLL HA   
5102 H HB2  . SER C 126 ? 0.570 0.490 0.617 0.087  -0.024 -0.011 126 SER LLL HB2  
5103 H HB3  . SER C 126 ? 0.560 0.482 0.601 0.078  -0.038 -0.011 126 SER LLL HB3  
5105 N N    . GLU C 127 ? 0.572 0.514 0.690 0.079  -0.018 -0.011 127 GLU LLL N    
5106 C CA   . GLU C 127 ? 0.571 0.519 0.726 0.080  -0.011 -0.012 127 GLU LLL CA   
5107 C C    . GLU C 127 ? 0.557 0.509 0.715 0.082  0.007  -0.008 127 GLU LLL C    
5108 O O    . GLU C 127 ? 0.570 0.521 0.742 0.088  0.024  -0.007 127 GLU LLL O    
5109 C CB   . GLU C 127 ? 0.581 0.533 0.756 0.075  -0.026 -0.015 127 GLU LLL CB   
5110 C CG   . GLU C 127 ? 0.601 0.548 0.783 0.075  -0.043 -0.019 127 GLU LLL CG   
5111 C CD   . GLU C 127 ? 0.620 0.558 0.772 0.071  -0.059 -0.020 127 GLU LLL CD   
5112 O OE1  . GLU C 127 ? 0.611 0.547 0.735 0.069  -0.056 -0.016 127 GLU LLL OE1  
5113 O OE2  . GLU C 127 ? 0.645 0.578 0.803 0.071  -0.074 -0.024 127 GLU LLL OE2  
5114 H H    . GLU C 127 ? 0.568 0.509 0.682 0.075  -0.030 -0.012 127 GLU LLL H    
5115 H HA   . GLU C 127 ? 0.577 0.524 0.741 0.085  -0.007 -0.014 127 GLU LLL HA   
5116 H HB2  . GLU C 127 ? 0.578 0.528 0.737 0.071  -0.032 -0.013 127 GLU LLL HB2  
5117 H HB3  . GLU C 127 ? 0.578 0.534 0.776 0.076  -0.021 -0.015 127 GLU LLL HB3  
5118 H HG2  . GLU C 127 ? 0.598 0.548 0.803 0.075  -0.048 -0.022 127 GLU LLL HG2  
5119 H HG3  . GLU C 127 ? 0.605 0.551 0.791 0.080  -0.037 -0.020 127 GLU LLL HG3  
5120 N N    . GLU C 128 ? 0.543 0.496 0.687 0.077  0.005  -0.005 128 GLU LLL N    
5121 C CA   . GLU C 128 ? 0.539 0.495 0.685 0.078  0.019  -0.001 128 GLU LLL CA   
5122 C C    . GLU C 128 ? 0.549 0.496 0.673 0.085  0.035  0.001  128 GLU LLL C    
5123 O O    . GLU C 128 ? 0.559 0.505 0.694 0.089  0.053  0.004  128 GLU LLL O    
5124 C CB   . GLU C 128 ? 0.534 0.492 0.665 0.071  0.011  0.001  128 GLU LLL CB   
5125 C CG   . GLU C 128 ? 0.536 0.497 0.670 0.071  0.025  0.004  128 GLU LLL CG   
5126 C CD   . GLU C 128 ? 0.536 0.500 0.658 0.065  0.018  0.006  128 GLU LLL CD   
5127 O OE1  . GLU C 128 ? 0.534 0.496 0.640 0.061  0.004  0.005  128 GLU LLL OE1  
5128 O OE2  . GLU C 128 ? 0.537 0.505 0.666 0.064  0.027  0.009  128 GLU LLL OE2  
5129 H H    . GLU C 128 ? 0.541 0.493 0.674 0.073  -0.006 -0.006 128 GLU LLL H    
5130 H HA   . GLU C 128 ? 0.537 0.498 0.709 0.078  0.024  -0.002 128 GLU LLL HA   
5131 H HB2  . GLU C 128 ? 0.528 0.489 0.670 0.067  0.001  -0.001 128 GLU LLL HB2  
5132 H HB3  . GLU C 128 ? 0.537 0.491 0.645 0.071  0.007  0.001  128 GLU LLL HB3  
5133 H HG2  . GLU C 128 ? 0.545 0.502 0.667 0.076  0.035  0.006  128 GLU LLL HG2  
5134 H HG3  . GLU C 128 ? 0.535 0.501 0.694 0.072  0.030  0.004  128 GLU LLL HG3  
5135 N N    . LEU C 129 ? 0.547 0.486 0.641 0.087  0.029  0.001  129 LEU LLL N    
5136 C CA   . LEU C 129 ? 0.556 0.482 0.620 0.094  0.039  0.003  129 LEU LLL CA   
5137 C C    . LEU C 129 ? 0.562 0.482 0.635 0.103  0.056  0.003  129 LEU LLL C    
5138 O O    . LEU C 129 ? 0.574 0.480 0.626 0.111  0.071  0.005  129 LEU LLL O    
5139 C CB   . LEU C 129 ? 0.567 0.486 0.603 0.094  0.025  0.000  129 LEU LLL CB   
5140 C CG   . LEU C 129 ? 0.560 0.482 0.583 0.087  0.013  0.001  129 LEU LLL CG   
5141 C CD1  . LEU C 129 ? 0.561 0.477 0.566 0.087  -0.001 -0.001 129 LEU LLL CD1  
5142 C CD2  . LEU C 129 ? 0.566 0.484 0.575 0.090  0.022  0.004  129 LEU LLL CD2  
5143 H H    . LEU C 129 ? 0.543 0.483 0.632 0.084  0.017  -0.001 129 LEU LLL H    
5144 H HA   . LEU C 129 ? 0.558 0.484 0.615 0.094  0.045  0.005  129 LEU LLL HA   
5145 H HB2  . LEU C 129 ? 0.563 0.484 0.607 0.093  0.018  -0.002 129 LEU LLL HB2  
5146 H HB3  . LEU C 129 ? 0.580 0.489 0.598 0.101  0.031  0.001  129 LEU LLL HB3  
5147 H HG   . LEU C 129 ? 0.547 0.478 0.586 0.082  0.008  0.001  129 LEU LLL HG   
5148 H HD11 . LEU C 129 ? 0.559 0.477 0.572 0.086  -0.006 -0.003 129 LEU LLL HD11 
5149 H HD12 . LEU C 129 ? 0.555 0.474 0.556 0.082  -0.008 -0.001 129 LEU LLL HD12 
5150 H HD13 . LEU C 129 ? 0.574 0.481 0.563 0.093  0.001  -0.002 129 LEU LLL HD13 
5151 H HD21 . LEU C 129 ? 0.581 0.489 0.575 0.096  0.029  0.005  129 LEU LLL HD21 
5152 H HD22 . LEU C 129 ? 0.562 0.481 0.561 0.086  0.014  0.004  129 LEU LLL HD22 
5153 H HD23 . LEU C 129 ? 0.560 0.484 0.583 0.088  0.028  0.006  129 LEU LLL HD23 
5154 N N    . GLU C 130 ? 0.552 0.478 0.653 0.103  0.053  -0.000 130 GLU LLL N    
5155 C CA   . GLU C 130 ? 0.565 0.484 0.680 0.110  0.069  -0.001 130 GLU LLL CA   
5156 C C    . GLU C 130 ? 0.563 0.485 0.704 0.112  0.091  0.002  130 GLU LLL C    
5157 O O    . GLU C 130 ? 0.574 0.489 0.728 0.119  0.109  0.003  130 GLU LLL O    
5158 C CB   . GLU C 130 ? 0.558 0.484 0.699 0.109  0.057  -0.006 130 GLU LLL CB   
5159 C CG   . GLU C 130 ? 0.560 0.482 0.675 0.108  0.039  -0.009 130 GLU LLL CG   
5160 C CD   . GLU C 130 ? 0.579 0.486 0.666 0.117  0.045  -0.009 130 GLU LLL CD   
5161 O OE1  . GLU C 130 ? 0.587 0.489 0.687 0.123  0.055  -0.011 130 GLU LLL OE1  
5162 O OE2  . GLU C 130 ? 0.590 0.487 0.641 0.118  0.041  -0.008 130 GLU LLL OE2  
5163 H H    . GLU C 130 ? 0.542 0.475 0.655 0.098  0.041  -0.002 130 GLU LLL H    
5164 H HA   . GLU C 130 ? 0.580 0.487 0.670 0.116  0.074  -0.000 130 GLU LLL HA   
5165 H HB2  . GLU C 130 ? 0.545 0.481 0.709 0.103  0.050  -0.007 130 GLU LLL HB2  
5166 H HB3  . GLU C 130 ? 0.566 0.490 0.721 0.114  0.069  -0.006 130 GLU LLL HB3  
5167 H HG2  . GLU C 130 ? 0.554 0.477 0.654 0.103  0.030  -0.008 130 GLU LLL HG2  
5168 H HG3  . GLU C 130 ? 0.552 0.479 0.685 0.105  0.029  -0.012 130 GLU LLL HG3  
5169 N N    . THR C 131 ? 0.548 0.478 0.697 0.106  0.089  0.005  131 THR LLL N    
5170 C CA   . THR C 131 ? 0.553 0.486 0.727 0.107  0.109  0.009  131 THR LLL CA   
5171 C C    . THR C 131 ? 0.569 0.491 0.707 0.110  0.120  0.014  131 THR LLL C    
5172 O O    . THR C 131 ? 0.562 0.487 0.716 0.109  0.132  0.017  131 THR LLL O    
5173 C CB   . THR C 131 ? 0.531 0.480 0.745 0.099  0.099  0.007  131 THR LLL CB   
5174 O OG1  . THR C 131 ? 0.514 0.467 0.708 0.092  0.085  0.008  131 THR LLL OG1  
5175 C CG2  . THR C 131 ? 0.522 0.479 0.766 0.096  0.084  0.001  131 THR LLL CG2  
5176 H H    . THR C 131 ? 0.539 0.474 0.682 0.101  0.077  0.004  131 THR LLL H    
5177 H HA   . THR C 131 ? 0.564 0.492 0.749 0.113  0.123  0.009  131 THR LLL HA   
5178 H HB   . THR C 131 ? 0.532 0.483 0.767 0.100  0.114  0.009  131 THR LLL HB   
5180 H HG21 . THR C 131 ? 0.530 0.484 0.783 0.101  0.092  0.000  131 THR LLL HG21 
5181 H HG22 . THR C 131 ? 0.512 0.477 0.785 0.093  0.080  -0.000 131 THR LLL HG22 
5182 H HG23 . THR C 131 ? 0.517 0.474 0.743 0.094  0.068  -0.001 131 THR LLL HG23 
5183 N N    . ASN C 132 ? 0.588 0.496 0.681 0.114  0.114  0.014  132 ASN LLL N    
5184 C CA   . ASN C 132 ? 0.614 0.507 0.667 0.118  0.121  0.017  132 ASN LLL CA   
5185 C C    . ASN C 132 ? 0.592 0.497 0.648 0.110  0.111  0.018  132 ASN LLL C    
5186 O O    . ASN C 132 ? 0.598 0.494 0.634 0.113  0.119  0.022  132 ASN LLL O    
5187 C CB   . ASN C 132 ? 0.649 0.526 0.697 0.128  0.149  0.022  132 ASN LLL CB   
5188 C CG   . ASN C 132 ? 0.685 0.552 0.739 0.136  0.164  0.021  132 ASN LLL CG   
5189 O OD1  . ASN C 132 ? 0.681 0.562 0.771 0.133  0.159  0.018  132 ASN LLL OD1  
5190 N ND2  . ASN C 132 ? 0.724 0.565 0.743 0.148  0.182  0.024  132 ASN LLL ND2  
5191 H H    . ASN C 132 ? 0.590 0.496 0.674 0.115  0.105  0.011  132 ASN LLL H    
5192 H HA   . ASN C 132 ? 0.622 0.506 0.649 0.121  0.113  0.016  132 ASN LLL HA   
5193 H HB2  . ASN C 132 ? 0.643 0.528 0.715 0.125  0.157  0.024  132 ASN LLL HB2  
5194 H HB3  . ASN C 132 ? 0.667 0.530 0.682 0.132  0.151  0.024  132 ASN LLL HB3  
5197 N N    . LYS C 133 ? 0.571 0.493 0.649 0.100  0.093  0.016  133 LYS LLL N    
5198 C CA   . LYS C 133 ? 0.551 0.484 0.633 0.092  0.082  0.016  133 LYS LLL CA   
5199 C C    . LYS C 133 ? 0.532 0.468 0.599 0.087  0.060  0.013  133 LYS LLL C    
5200 O O    . LYS C 133 ? 0.525 0.461 0.596 0.087  0.051  0.010  133 LYS LLL O    
5201 C CB   . LYS C 133 ? 0.544 0.491 0.668 0.086  0.082  0.016  133 LYS LLL CB   
5202 C CG   . LYS C 133 ? 0.563 0.510 0.713 0.090  0.104  0.019  133 LYS LLL CG   
5203 C CD   . LYS C 133 ? 0.581 0.525 0.719 0.090  0.115  0.024  133 LYS LLL CD   
5204 C CE   . LYS C 133 ? 0.595 0.539 0.764 0.093  0.137  0.027  133 LYS LLL CE   
5205 N NZ   . LYS C 133 ? 0.607 0.546 0.763 0.093  0.148  0.032  133 LYS LLL NZ   
5206 H H    . LYS C 133 ? 0.564 0.490 0.654 0.099  0.086  0.013  133 LYS LLL H    
5207 H HA   . LYS C 133 ? 0.558 0.485 0.625 0.094  0.088  0.019  133 LYS LLL HA   
5208 H HB2  . LYS C 133 ? 0.538 0.491 0.677 0.085  0.074  0.013  133 LYS LLL HB2  
5209 H HB3  . LYS C 133 ? 0.534 0.488 0.658 0.081  0.075  0.016  133 LYS LLL HB3  
5210 H HG2  . LYS C 133 ? 0.577 0.515 0.721 0.096  0.115  0.019  133 LYS LLL HG2  
5211 H HG3  . LYS C 133 ? 0.554 0.510 0.734 0.087  0.101  0.017  133 LYS LLL HG3  
5212 H HD2  . LYS C 133 ? 0.567 0.518 0.707 0.085  0.104  0.023  133 LYS LLL HD2  
5213 H HD3  . LYS C 133 ? 0.593 0.525 0.701 0.095  0.119  0.025  133 LYS LLL HD3  
5214 H HE2  . LYS C 133 ? 0.610 0.544 0.775 0.099  0.150  0.028  133 LYS LLL HE2  
5215 H HE3  . LYS C 133 ? 0.582 0.537 0.784 0.089  0.133  0.025  133 LYS LLL HE3  
5216 H HZ1  . LYS C 133 ? 0.592 0.539 0.751 0.088  0.136  0.031  133 LYS LLL HZ1  
5217 H HZ2  . LYS C 133 ? 0.609 0.548 0.785 0.095  0.161  0.034  133 LYS LLL HZ2  
5218 H HZ3  . LYS C 133 ? 0.619 0.546 0.744 0.097  0.151  0.033  133 LYS LLL HZ3  
5219 N N    . ALA C 134 ? 0.519 0.457 0.572 0.082  0.052  0.014  134 ALA LLL N    
5220 C CA   . ALA C 134 ? 0.506 0.447 0.548 0.076  0.034  0.012  134 ALA LLL CA   
5221 C C    . ALA C 134 ? 0.489 0.438 0.535 0.069  0.030  0.013  134 ALA LLL C    
5222 O O    . ALA C 134 ? 0.497 0.443 0.531 0.070  0.035  0.015  134 ALA LLL O    
5223 C CB   . ALA C 134 ? 0.522 0.450 0.532 0.081  0.031  0.011  134 ALA LLL CB   
5224 H H    . ALA C 134 ? 0.521 0.459 0.571 0.082  0.059  0.016  134 ALA LLL H    
5225 H HA   . ALA C 134 ? 0.502 0.446 0.553 0.074  0.028  0.010  134 ALA LLL HA   
5226 H HB1  . ALA C 134 ? 0.516 0.446 0.523 0.077  0.020  0.009  134 ALA LLL HB1  
5227 H HB2  . ALA C 134 ? 0.533 0.454 0.537 0.087  0.036  0.011  134 ALA LLL HB2  
5228 H HB3  . ALA C 134 ? 0.525 0.450 0.525 0.082  0.034  0.013  134 ALA LLL HB3  
5229 N N    . THR C 135 ? 0.466 0.424 0.530 0.063  0.020  0.011  135 THR LLL N    
5230 C CA   . THR C 135 ? 0.446 0.409 0.514 0.056  0.015  0.012  135 THR LLL CA   
5231 C C    . THR C 135 ? 0.435 0.395 0.489 0.051  0.002  0.011  135 THR LLL C    
5232 O O    . THR C 135 ? 0.436 0.395 0.494 0.049  -0.007 0.009  135 THR LLL O    
5233 C CB   . THR C 135 ? 0.439 0.408 0.535 0.053  0.014  0.012  135 THR LLL CB   
5234 O OG1  . THR C 135 ? 0.441 0.412 0.554 0.058  0.028  0.013  135 THR LLL OG1  
5235 C CG2  . THR C 135 ? 0.431 0.405 0.530 0.048  0.010  0.012  135 THR LLL CG2  
5236 H H    . THR C 135 ? 0.466 0.423 0.537 0.062  0.015  0.010  135 THR LLL H    
5237 H HA   . THR C 135 ? 0.447 0.410 0.509 0.057  0.021  0.014  135 THR LLL HA   
5238 H HB   . THR C 135 ? 0.438 0.407 0.540 0.053  0.007  0.009  135 THR LLL HB   
5240 H HG21 . THR C 135 ? 0.430 0.401 0.520 0.045  0.001  0.011  135 THR LLL HG21 
5241 H HG22 . THR C 135 ? 0.429 0.405 0.545 0.047  0.011  0.012  135 THR LLL HG22 
5242 H HG23 . THR C 135 ? 0.431 0.405 0.521 0.048  0.016  0.015  135 THR LLL HG23 
5243 N N    . LEU C 136 ? 0.434 0.393 0.472 0.049  0.001  0.012  136 LEU LLL N    
5244 C CA   . LEU C 136 ? 0.433 0.390 0.462 0.044  -0.008 0.012  136 LEU LLL CA   
5245 C C    . LEU C 136 ? 0.429 0.389 0.466 0.038  -0.010 0.012  136 LEU LLL C    
5246 O O    . LEU C 136 ? 0.427 0.393 0.473 0.039  -0.003 0.014  136 LEU LLL O    
5247 C CB   . LEU C 136 ? 0.435 0.389 0.450 0.044  -0.007 0.012  136 LEU LLL CB   
5248 C CG   . LEU C 136 ? 0.450 0.397 0.454 0.049  -0.010 0.010  136 LEU LLL CG   
5249 C CD1  . LEU C 136 ? 0.462 0.405 0.460 0.057  -0.002 0.011  136 LEU LLL CD1  
5250 C CD2  . LEU C 136 ? 0.451 0.394 0.446 0.047  -0.017 0.010  136 LEU LLL CD2  
5251 H H    . LEU C 136 ? 0.437 0.395 0.470 0.051  0.007  0.014  136 LEU LLL H    
5252 H HA   . LEU C 136 ? 0.435 0.389 0.463 0.044  -0.013 0.010  136 LEU LLL HA   
5253 H HB2  . LEU C 136 ? 0.436 0.392 0.451 0.046  -0.002 0.014  136 LEU LLL HB2  
5254 H HB3  . LEU C 136 ? 0.433 0.388 0.447 0.040  -0.011 0.012  136 LEU LLL HB3  
5255 H HG   . LEU C 136 ? 0.450 0.396 0.456 0.049  -0.014 0.009  136 LEU LLL HG   
5256 H HD11 . LEU C 136 ? 0.461 0.406 0.467 0.059  0.002  0.011  136 LEU LLL HD11 
5257 H HD12 . LEU C 136 ? 0.470 0.406 0.457 0.061  -0.005 0.010  136 LEU LLL HD12 
5258 H HD13 . LEU C 136 ? 0.461 0.405 0.457 0.058  0.002  0.012  136 LEU LLL HD13 
5259 H HD21 . LEU C 136 ? 0.450 0.395 0.444 0.047  -0.014 0.011  136 LEU LLL HD21 
5260 H HD22 . LEU C 136 ? 0.458 0.396 0.447 0.051  -0.020 0.008  136 LEU LLL HD22 
5261 H HD23 . LEU C 136 ? 0.447 0.392 0.446 0.043  -0.020 0.010  136 LEU LLL HD23 
5262 N N    . VAL C 137 ? 0.438 0.393 0.471 0.034  -0.018 0.012  137 VAL LLL N    
5263 C CA   . VAL C 137 ? 0.443 0.397 0.479 0.030  -0.021 0.012  137 VAL LLL CA   
5264 C C    . VAL C 137 ? 0.449 0.396 0.470 0.026  -0.023 0.013  137 VAL LLL C    
5265 O O    . VAL C 137 ? 0.459 0.399 0.471 0.025  -0.027 0.012  137 VAL LLL O    
5266 C CB   . VAL C 137 ? 0.451 0.399 0.494 0.031  -0.030 0.009  137 VAL LLL CB   
5267 C CG1  . VAL C 137 ? 0.454 0.396 0.494 0.028  -0.036 0.009  137 VAL LLL CG1  
5268 C CG2  . VAL C 137 ? 0.450 0.406 0.514 0.035  -0.027 0.008  137 VAL LLL CG2  
5269 H H    . VAL C 137 ? 0.441 0.392 0.468 0.034  -0.022 0.011  137 VAL LLL H    
5270 H HA   . VAL C 137 ? 0.439 0.397 0.481 0.030  -0.017 0.013  137 VAL LLL HA   
5271 H HB   . VAL C 137 ? 0.455 0.399 0.491 0.031  -0.034 0.008  137 VAL LLL HB   
5272 H HG11 . VAL C 137 ? 0.461 0.394 0.487 0.026  -0.038 0.009  137 VAL LLL HG11 
5273 H HG12 . VAL C 137 ? 0.457 0.397 0.506 0.030  -0.041 0.007  137 VAL LLL HG12 
5274 H HG13 . VAL C 137 ? 0.450 0.396 0.493 0.027  -0.031 0.010  137 VAL LLL HG13 
5275 H HG21 . VAL C 137 ? 0.444 0.406 0.516 0.035  -0.021 0.009  137 VAL LLL HG21 
5276 H HG22 . VAL C 137 ? 0.452 0.405 0.524 0.036  -0.033 0.006  137 VAL LLL HG22 
5277 H HG23 . VAL C 137 ? 0.450 0.407 0.513 0.038  -0.024 0.008  137 VAL LLL HG23 
5278 N N    . CYS C 138 ? 0.449 0.398 0.469 0.023  -0.018 0.015  138 CYS LLL N    
5279 C CA   . CYS C 138 ? 0.453 0.396 0.462 0.019  -0.017 0.016  138 CYS LLL CA   
5280 C C    . CYS C 138 ? 0.455 0.389 0.458 0.017  -0.020 0.016  138 CYS LLL C    
5281 O O    . CYS C 138 ? 0.443 0.382 0.452 0.017  -0.017 0.017  138 CYS LLL O    
5282 C CB   . CYS C 138 ? 0.451 0.401 0.463 0.018  -0.010 0.017  138 CYS LLL CB   
5283 S SG   . CYS C 138 ? 0.476 0.420 0.481 0.014  -0.007 0.018  138 CYS LLL SG   
5284 H H    . CYS C 138 ? 0.444 0.398 0.471 0.024  -0.015 0.015  138 CYS LLL H    
5285 H HA   . CYS C 138 ? 0.458 0.395 0.461 0.018  -0.019 0.016  138 CYS LLL HA   
5286 H HB2  . CYS C 138 ? 0.452 0.407 0.467 0.021  -0.009 0.017  138 CYS LLL HB2  
5287 H HB3  . CYS C 138 ? 0.452 0.405 0.467 0.018  -0.008 0.018  138 CYS LLL HB3  
5288 N N    . THR C 139 ? 0.471 0.391 0.462 0.017  -0.025 0.015  139 THR LLL N    
5289 C CA   . THR C 139 ? 0.484 0.389 0.462 0.016  -0.030 0.015  139 THR LLL CA   
5290 C C    . THR C 139 ? 0.488 0.385 0.452 0.013  -0.021 0.018  139 THR LLL C    
5291 O O    . THR C 139 ? 0.494 0.390 0.456 0.011  -0.016 0.019  139 THR LLL O    
5292 C CB   . THR C 139 ? 0.505 0.392 0.469 0.018  -0.039 0.014  139 THR LLL CB   
5293 O OG1  . THR C 139 ? 0.520 0.401 0.473 0.016  -0.035 0.015  139 THR LLL OG1  
5294 C CG2  . THR C 139 ? 0.501 0.394 0.481 0.021  -0.048 0.010  139 THR LLL CG2  
5295 H H    . THR C 139 ? 0.474 0.390 0.461 0.017  -0.027 0.015  139 THR LLL H    
5296 H HA   . THR C 139 ? 0.481 0.390 0.467 0.017  -0.032 0.014  139 THR LLL HA   
5297 H HB   . THR C 139 ? 0.519 0.393 0.471 0.018  -0.042 0.013  139 THR LLL HB   
5299 H HG21 . THR C 139 ? 0.496 0.395 0.487 0.022  -0.050 0.009  139 THR LLL HG21 
5300 H HG22 . THR C 139 ? 0.513 0.394 0.483 0.023  -0.056 0.009  139 THR LLL HG22 
5301 H HG23 . THR C 139 ? 0.492 0.395 0.479 0.022  -0.045 0.011  139 THR LLL HG23 
5302 N N    . ILE C 140 ? 0.493 0.384 0.451 0.012  -0.021 0.018  140 ILE LLL N    
5303 C CA   . ILE C 140 ? 0.499 0.382 0.446 0.010  -0.012 0.021  140 ILE LLL CA   
5304 C C    . ILE C 140 ? 0.524 0.383 0.448 0.012  -0.017 0.020  140 ILE LLL C    
5305 O O    . ILE C 140 ? 0.529 0.389 0.458 0.014  -0.025 0.018  140 ILE LLL O    
5306 C CB   . ILE C 140 ? 0.481 0.381 0.444 0.008  -0.005 0.021  140 ILE LLL CB   
5307 C CG1  . ILE C 140 ? 0.462 0.382 0.444 0.009  -0.004 0.021  140 ILE LLL CG1  
5308 C CG2  . ILE C 140 ? 0.490 0.384 0.446 0.005  0.006  0.024  140 ILE LLL CG2  
5309 C CD1  . ILE C 140 ? 0.445 0.380 0.441 0.008  0.000  0.021  140 ILE LLL CD1  
5310 H H    . ILE C 140 ? 0.494 0.384 0.455 0.014  -0.026 0.017  140 ILE LLL H    
5311 H HA   . ILE C 140 ? 0.503 0.382 0.445 0.008  -0.007 0.022  140 ILE LLL HA   
5312 H HB   . ILE C 140 ? 0.482 0.382 0.446 0.009  -0.009 0.020  140 ILE LLL HB   
5313 H HG12 . ILE C 140 ? 0.462 0.381 0.443 0.008  -0.002 0.021  140 ILE LLL HG12 
5314 H HG13 . ILE C 140 ? 0.460 0.382 0.446 0.011  -0.010 0.020  140 ILE LLL HG13 
5315 H HG21 . ILE C 140 ? 0.504 0.383 0.445 0.005  0.006  0.024  140 ILE LLL HG21 
5316 H HG22 . ILE C 140 ? 0.479 0.383 0.444 0.004  0.009  0.024  140 ILE LLL HG22 
5317 H HG23 . ILE C 140 ? 0.487 0.383 0.446 0.004  0.010  0.024  140 ILE LLL HG23 
5318 H HD11 . ILE C 140 ? 0.446 0.381 0.443 0.009  -0.001 0.021  140 ILE LLL HD11 
5319 H HD12 . ILE C 140 ? 0.438 0.382 0.442 0.010  0.000  0.021  140 ILE LLL HD12 
5320 H HD13 . ILE C 140 ? 0.446 0.380 0.441 0.006  0.006  0.023  140 ILE LLL HD13 
5321 N N    . THR C 141 ? 0.543 0.379 0.442 0.011  -0.012 0.022  141 THR LLL N    
5322 C CA   . THR C 141 ? 0.572 0.379 0.442 0.015  -0.018 0.021  141 THR LLL CA   
5323 C C    . THR C 141 ? 0.590 0.378 0.439 0.014  -0.004 0.024  141 THR LLL C    
5324 O O    . THR C 141 ? 0.591 0.386 0.448 0.010  0.009  0.027  141 THR LLL O    
5325 C CB   . THR C 141 ? 0.591 0.381 0.446 0.018  -0.028 0.020  141 THR LLL CB   
5326 O OG1  . THR C 141 ? 0.587 0.376 0.440 0.015  -0.018 0.023  141 THR LLL OG1  
5327 C CG2  . THR C 141 ? 0.579 0.384 0.455 0.020  -0.042 0.016  141 THR LLL CG2  
5328 H H    . THR C 141 ? 0.543 0.380 0.443 0.009  -0.004 0.024  141 THR LLL H    
5329 H HA   . THR C 141 ? 0.571 0.379 0.444 0.017  -0.026 0.019  141 THR LLL HA   
5330 H HB   . THR C 141 ? 0.615 0.381 0.446 0.020  -0.032 0.019  141 THR LLL HB   
5332 H HG21 . THR C 141 ? 0.577 0.383 0.458 0.021  -0.049 0.014  141 THR LLL HG21 
5333 H HG22 . THR C 141 ? 0.590 0.383 0.456 0.022  -0.048 0.015  141 THR LLL HG22 
5334 H HG23 . THR C 141 ? 0.557 0.382 0.453 0.018  -0.037 0.016  141 THR LLL HG23 
5335 N N    . ASP C 142 ? 0.614 0.378 0.437 0.017  -0.008 0.024  142 ASP LLL N    
5336 C CA   . ASP C 142 ? 0.649 0.384 0.440 0.018  0.005  0.027  142 ASP LLL CA   
5337 C C    . ASP C 142 ? 0.630 0.381 0.438 0.013  0.022  0.030  142 ASP LLL C    
5338 O O    . ASP C 142 ? 0.644 0.383 0.444 0.011  0.039  0.034  142 ASP LLL O    
5339 C CB   . ASP C 142 ? 0.674 0.385 0.442 0.019  0.011  0.030  142 ASP LLL CB   
5340 C CG   . ASP C 142 ? 0.691 0.391 0.448 0.023  -0.007 0.026  142 ASP LLL CG   
5341 O OD1  . ASP C 142 ? 0.716 0.391 0.447 0.029  -0.021 0.024  142 ASP LLL OD1  
5342 O OD2  . ASP C 142 ? 0.677 0.394 0.454 0.020  -0.009 0.026  142 ASP LLL OD2  
5343 H H    . ASP C 142 ? 0.617 0.380 0.440 0.020  -0.019 0.021  142 ASP LLL H    
5344 H HA   . ASP C 142 ? 0.666 0.384 0.439 0.022  -0.002 0.025  142 ASP LLL HA   
5345 H HB2  . ASP C 142 ? 0.660 0.386 0.446 0.015  0.019  0.031  142 ASP LLL HB2  
5346 H HB3  . ASP C 142 ? 0.702 0.388 0.444 0.021  0.018  0.031  142 ASP LLL HB3  
5347 N N    . PHE C 143 ? 0.593 0.369 0.426 0.012  0.020  0.028  143 PHE LLL N    
5348 C CA   . PHE C 143 ? 0.573 0.362 0.421 0.008  0.034  0.030  143 PHE LLL CA   
5349 C C    . PHE C 143 ? 0.587 0.365 0.420 0.011  0.033  0.029  143 PHE LLL C    
5350 O O    . PHE C 143 ? 0.586 0.361 0.415 0.015  0.017  0.026  143 PHE LLL O    
5351 C CB   . PHE C 143 ? 0.530 0.355 0.416 0.004  0.033  0.029  143 PHE LLL CB   
5352 C CG   . PHE C 143 ? 0.509 0.352 0.411 0.006  0.020  0.026  143 PHE LLL CG   
5353 C CD1  . PHE C 143 ? 0.503 0.351 0.411 0.008  0.008  0.024  143 PHE LLL CD1  
5354 C CD2  . PHE C 143 ? 0.493 0.349 0.407 0.006  0.019  0.026  143 PHE LLL CD2  
5355 C CE1  . PHE C 143 ? 0.484 0.349 0.410 0.009  -0.002 0.022  143 PHE LLL CE1  
5356 C CE2  . PHE C 143 ? 0.477 0.350 0.409 0.007  0.009  0.023  143 PHE LLL CE2  
5357 C CZ   . PHE C 143 ? 0.474 0.351 0.412 0.009  -0.001 0.022  143 PHE LLL CZ   
5358 H H    . PHE C 143 ? 0.584 0.369 0.426 0.013  0.009  0.026  143 PHE LLL H    
5359 H HA   . PHE C 143 ? 0.585 0.364 0.425 0.007  0.045  0.033  143 PHE LLL HA   
5360 H HB2  . PHE C 143 ? 0.524 0.356 0.419 0.002  0.042  0.031  143 PHE LLL HB2  
5361 H HB3  . PHE C 143 ? 0.527 0.355 0.419 0.003  0.035  0.030  143 PHE LLL HB3  
5362 H HD1  . PHE C 143 ? 0.511 0.351 0.411 0.008  0.008  0.025  143 PHE LLL HD1  
5363 H HD2  . PHE C 143 ? 0.497 0.351 0.409 0.005  0.027  0.027  143 PHE LLL HD2  
5364 H HE1  . PHE C 143 ? 0.482 0.350 0.413 0.010  -0.008 0.021  143 PHE LLL HE1  
5365 H HE2  . PHE C 143 ? 0.469 0.350 0.410 0.007  0.009  0.023  143 PHE LLL HE2  
5366 H HZ   . PHE C 143 ? 0.463 0.350 0.415 0.009  -0.006 0.020  143 PHE LLL HZ   
5367 N N    . TYR C 144 ? 0.595 0.365 0.422 0.010  0.049  0.032  144 TYR LLL N    
5368 C CA   . TYR C 144 ? 0.604 0.366 0.421 0.011  0.051  0.031  144 TYR LLL CA   
5369 C C    . TYR C 144 ? 0.592 0.366 0.427 0.007  0.070  0.034  144 TYR LLL C    
5370 O O    . TYR C 144 ? 0.602 0.369 0.438 0.005  0.085  0.037  144 TYR LLL O    
5371 C CB   . TYR C 144 ? 0.649 0.368 0.420 0.018  0.051  0.031  144 TYR LLL CB   
5372 C CG   . TYR C 144 ? 0.660 0.367 0.416 0.021  0.049  0.030  144 TYR LLL CG   
5373 C CD1  . TYR C 144 ? 0.651 0.366 0.413 0.023  0.029  0.026  144 TYR LLL CD1  
5374 C CD2  . TYR C 144 ? 0.681 0.369 0.419 0.022  0.066  0.032  144 TYR LLL CD2  
5375 C CE1  . TYR C 144 ? 0.665 0.369 0.415 0.027  0.026  0.024  144 TYR LLL CE1  
5376 C CE2  . TYR C 144 ? 0.697 0.373 0.419 0.025  0.064  0.031  144 TYR LLL CE2  
5377 C CZ   . TYR C 144 ? 0.689 0.373 0.417 0.028  0.043  0.026  144 TYR LLL CZ   
5378 O OH   . TYR C 144 ? 0.701 0.373 0.416 0.032  0.039  0.024  144 TYR LLL OH   
5379 H H    . TYR C 144 ? 0.596 0.366 0.427 0.007  0.060  0.034  144 TYR LLL H    
5380 H HA   . TYR C 144 ? 0.590 0.364 0.418 0.012  0.041  0.029  144 TYR LLL HA   
5381 H HB2  . TYR C 144 ? 0.657 0.368 0.417 0.020  0.039  0.030  144 TYR LLL HB2  
5382 H HB3  . TYR C 144 ? 0.664 0.369 0.423 0.017  0.064  0.034  144 TYR LLL HB3  
5383 H HD1  . TYR C 144 ? 0.637 0.365 0.414 0.023  0.018  0.024  144 TYR LLL HD1  
5384 H HD2  . TYR C 144 ? 0.689 0.371 0.424 0.020  0.081  0.035  144 TYR LLL HD2  
5385 H HE1  . TYR C 144 ? 0.659 0.368 0.416 0.028  0.012  0.021  144 TYR LLL HE1  
5386 H HE2  . TYR C 144 ? 0.713 0.375 0.422 0.026  0.077  0.033  144 TYR LLL HE2  
5388 N N    . PRO C 145 ? 0.568 0.361 0.423 0.006  0.070  0.033  145 PRO LLL N    
5389 C CA   . PRO C 145 ? 0.552 0.356 0.413 0.007  0.053  0.029  145 PRO LLL CA   
5390 C C    . PRO C 145 ? 0.525 0.350 0.407 0.007  0.040  0.028  145 PRO LLL C    
5391 O O    . PRO C 145 ? 0.510 0.346 0.405 0.004  0.043  0.029  145 PRO LLL O    
5392 C CB   . PRO C 145 ? 0.530 0.355 0.415 0.005  0.060  0.030  145 PRO LLL CB   
5393 C CG   . PRO C 145 ? 0.545 0.357 0.422 0.003  0.079  0.032  145 PRO LLL CG   
5394 C CD   . PRO C 145 ? 0.557 0.359 0.428 0.002  0.086  0.034  145 PRO LLL CD   
5395 H HA   . PRO C 145 ? 0.572 0.357 0.411 0.011  0.048  0.028  145 PRO LLL HA   
5396 H HB2  . PRO C 145 ? 0.507 0.354 0.415 0.002  0.058  0.029  145 PRO LLL HB2  
5397 H HB3  . PRO C 145 ? 0.533 0.355 0.413 0.007  0.054  0.028  145 PRO LLL HB3  
5398 H HG2  . PRO C 145 ? 0.529 0.357 0.427 0.001  0.085  0.032  145 PRO LLL HG2  
5399 H HG3  . PRO C 145 ? 0.567 0.359 0.422 0.006  0.082  0.032  145 PRO LLL HG3  
5400 H HD2  . PRO C 145 ? 0.538 0.358 0.433 -0.001 0.088  0.035  145 PRO LLL HD2  
5401 H HD3  . PRO C 145 ? 0.579 0.361 0.434 0.003  0.097  0.036  145 PRO LLL HD3  
5402 N N    . GLY C 146 ? 0.522 0.352 0.407 0.009  0.025  0.025  146 GLY LLL N    
5403 C CA   . GLY C 146 ? 0.501 0.349 0.407 0.009  0.013  0.023  146 GLY LLL CA   
5404 C C    . GLY C 146 ? 0.471 0.349 0.408 0.006  0.016  0.023  146 GLY LLL C    
5405 O O    . GLY C 146 ? 0.457 0.345 0.409 0.008  0.008  0.021  146 GLY LLL O    
5406 H H    . GLY C 146 ? 0.530 0.352 0.407 0.011  0.023  0.024  146 GLY LLL H    
5407 H HA2  . GLY C 146 ? 0.503 0.350 0.408 0.009  0.013  0.023  146 GLY LLL HA2  
5408 H HA3  . GLY C 146 ? 0.511 0.351 0.411 0.012  0.003  0.021  146 GLY LLL HA3  
5409 N N    . VAL C 147 ? 0.464 0.354 0.412 0.003  0.027  0.025  147 VAL LLL N    
5410 C CA   . VAL C 147 ? 0.444 0.360 0.419 0.001  0.028  0.026  147 VAL LLL CA   
5411 C C    . VAL C 147 ? 0.442 0.365 0.425 -0.000 0.032  0.026  147 VAL LLL C    
5412 O O    . VAL C 147 ? 0.455 0.367 0.430 -0.002 0.039  0.027  147 VAL LLL O    
5413 C CB   . VAL C 147 ? 0.434 0.357 0.417 -0.000 0.036  0.026  147 VAL LLL CB   
5414 C CG1  . VAL C 147 ? 0.411 0.354 0.415 -0.001 0.037  0.027  147 VAL LLL CG1  
5415 C CG2  . VAL C 147 ? 0.440 0.356 0.416 0.001  0.031  0.025  147 VAL LLL CG2  
5416 H H    . VAL C 147 ? 0.472 0.355 0.413 0.002  0.033  0.026  147 VAL LLL H    
5417 H HA   . VAL C 147 ? 0.437 0.359 0.419 0.003  0.022  0.025  147 VAL LLL HA   
5418 H HB   . VAL C 147 ? 0.443 0.357 0.419 -0.001 0.043  0.027  147 VAL LLL HB   
5419 H HG11 . VAL C 147 ? 0.410 0.355 0.418 -0.003 0.041  0.027  147 VAL LLL HG11 
5420 H HG12 . VAL C 147 ? 0.407 0.355 0.417 -0.002 0.039  0.027  147 VAL LLL HG12 
5421 H HG13 . VAL C 147 ? 0.405 0.355 0.415 -0.000 0.032  0.026  147 VAL LLL HG13 
5422 H HG21 . VAL C 147 ? 0.434 0.356 0.418 0.003  0.024  0.024  147 VAL LLL HG21 
5423 H HG22 . VAL C 147 ? 0.435 0.356 0.417 0.000  0.036  0.026  147 VAL LLL HG22 
5424 H HG23 . VAL C 147 ? 0.458 0.357 0.416 0.003  0.031  0.025  147 VAL LLL HG23 
5425 N N    . VAL C 148 ? 0.446 0.383 0.443 0.001  0.027  0.026  148 VAL LLL N    
5426 C CA   . VAL C 148 ? 0.442 0.385 0.445 0.000  0.028  0.026  148 VAL LLL CA   
5427 C C    . VAL C 148 ? 0.429 0.388 0.447 0.002  0.026  0.025  148 VAL LLL C    
5428 O O    . VAL C 148 ? 0.423 0.388 0.446 0.004  0.023  0.025  148 VAL LLL O    
5429 C CB   . VAL C 148 ? 0.454 0.387 0.446 0.002  0.021  0.025  148 VAL LLL CB   
5430 C CG1  . VAL C 148 ? 0.446 0.390 0.449 0.004  0.014  0.024  148 VAL LLL CG1  
5431 C CG2  . VAL C 148 ? 0.469 0.393 0.455 0.000  0.025  0.026  148 VAL LLL CG2  
5432 H H    . VAL C 148 ? 0.435 0.379 0.439 0.002  0.024  0.025  148 VAL LLL H    
5433 H HA   . VAL C 148 ? 0.445 0.385 0.449 -0.001 0.033  0.026  148 VAL LLL HA   
5434 H HB   . VAL C 148 ? 0.465 0.388 0.447 0.002  0.019  0.025  148 VAL LLL HB   
5435 H HG11 . VAL C 148 ? 0.441 0.389 0.449 0.005  0.013  0.024  148 VAL LLL HG11 
5436 H HG12 . VAL C 148 ? 0.452 0.389 0.449 0.005  0.010  0.023  148 VAL LLL HG12 
5437 H HG13 . VAL C 148 ? 0.438 0.389 0.448 0.004  0.016  0.024  148 VAL LLL HG13 
5438 H HG21 . VAL C 148 ? 0.459 0.391 0.456 -0.001 0.028  0.026  148 VAL LLL HG21 
5439 H HG22 . VAL C 148 ? 0.471 0.391 0.453 0.001  0.021  0.025  148 VAL LLL HG22 
5440 H HG23 . VAL C 148 ? 0.478 0.391 0.455 -0.001 0.030  0.027  148 VAL LLL HG23 
5441 N N    . THR C 149 ? 0.427 0.392 0.454 0.001  0.028  0.025  149 THR LLL N    
5442 C CA   . THR C 149 ? 0.420 0.395 0.456 0.004  0.026  0.025  149 THR LLL CA   
5443 C C    . THR C 149 ? 0.423 0.396 0.457 0.006  0.022  0.024  149 THR LLL C    
5444 O O    . THR C 149 ? 0.432 0.401 0.467 0.004  0.022  0.023  149 THR LLL O    
5445 C CB   . THR C 149 ? 0.414 0.394 0.459 0.003  0.028  0.024  149 THR LLL CB   
5446 O OG1  . THR C 149 ? 0.415 0.396 0.461 0.002  0.032  0.025  149 THR LLL OG1  
5447 C CG2  . THR C 149 ? 0.411 0.394 0.459 0.007  0.024  0.023  149 THR LLL CG2  
5448 H H    . THR C 149 ? 0.430 0.391 0.457 -0.001 0.032  0.025  149 THR LLL H    
5449 H HA   . THR C 149 ? 0.417 0.395 0.453 0.006  0.025  0.025  149 THR LLL HA   
5450 H HB   . THR C 149 ? 0.418 0.394 0.465 0.001  0.030  0.024  149 THR LLL HB   
5452 H HG21 . THR C 149 ? 0.413 0.395 0.463 0.008  0.021  0.022  149 THR LLL HG21 
5453 H HG22 . THR C 149 ? 0.409 0.395 0.462 0.008  0.024  0.023  149 THR LLL HG22 
5454 H HG23 . THR C 149 ? 0.411 0.396 0.455 0.010  0.023  0.024  149 THR LLL HG23 
5455 N N    . VAL C 150 ? 0.427 0.404 0.460 0.009  0.018  0.024  150 VAL LLL N    
5456 C CA   . VAL C 150 ? 0.444 0.418 0.474 0.012  0.014  0.023  150 VAL LLL CA   
5457 C C    . VAL C 150 ? 0.454 0.432 0.485 0.016  0.013  0.022  150 VAL LLL C    
5458 O O    . VAL C 150 ? 0.455 0.435 0.486 0.019  0.016  0.023  150 VAL LLL O    
5459 C CB   . VAL C 150 ? 0.447 0.420 0.475 0.013  0.012  0.023  150 VAL LLL CB   
5460 C CG1  . VAL C 150 ? 0.450 0.421 0.476 0.016  0.008  0.021  150 VAL LLL CG1  
5461 C CG2  . VAL C 150 ? 0.452 0.418 0.475 0.010  0.011  0.023  150 VAL LLL CG2  
5462 H H    . VAL C 150 ? 0.427 0.406 0.461 0.011  0.019  0.024  150 VAL LLL H    
5463 H HA   . VAL C 150 ? 0.446 0.417 0.476 0.010  0.014  0.022  150 VAL LLL HA   
5464 H HB   . VAL C 150 ? 0.444 0.421 0.475 0.015  0.014  0.023  150 VAL LLL HB   
5465 H HG11 . VAL C 150 ? 0.449 0.423 0.476 0.020  0.010  0.022  150 VAL LLL HG11 
5466 H HG12 . VAL C 150 ? 0.452 0.421 0.477 0.016  0.006  0.021  150 VAL LLL HG12 
5467 H HG13 . VAL C 150 ? 0.452 0.421 0.476 0.015  0.007  0.021  150 VAL LLL HG13 
5468 H HG21 . VAL C 150 ? 0.456 0.417 0.475 0.008  0.011  0.023  150 VAL LLL HG21 
5469 H HG22 . VAL C 150 ? 0.455 0.418 0.477 0.011  0.007  0.022  150 VAL LLL HG22 
5470 H HG23 . VAL C 150 ? 0.452 0.418 0.475 0.009  0.013  0.023  150 VAL LLL HG23 
5471 N N    . ASP C 151 ? 0.473 0.448 0.504 0.018  0.009  0.020  151 ASP LLL N    
5472 C CA   . ASP C 151 ? 0.497 0.469 0.524 0.023  0.005  0.018  151 ASP LLL CA   
5473 C C    . ASP C 151 ? 0.503 0.470 0.524 0.026  -0.000 0.017  151 ASP LLL C    
5474 O O    . ASP C 151 ? 0.517 0.482 0.543 0.023  -0.004 0.016  151 ASP LLL O    
5475 C CB   . ASP C 151 ? 0.515 0.486 0.550 0.022  0.001  0.017  151 ASP LLL CB   
5476 C CG   . ASP C 151 ? 0.528 0.503 0.567 0.021  0.005  0.018  151 ASP LLL CG   
5477 O OD1  . ASP C 151 ? 0.554 0.530 0.585 0.024  0.008  0.019  151 ASP LLL OD1  
5478 O OD2  . ASP C 151 ? 0.538 0.515 0.588 0.017  0.006  0.017  151 ASP LLL OD2  
5479 H H    . ASP C 151 ? 0.475 0.447 0.507 0.016  0.007  0.020  151 ASP LLL H    
5480 H HA   . ASP C 151 ? 0.498 0.470 0.521 0.026  0.007  0.020  151 ASP LLL HA   
5481 H HB2  . ASP C 151 ? 0.513 0.484 0.555 0.019  0.001  0.016  151 ASP LLL HB2  
5482 H HB3  . ASP C 151 ? 0.521 0.488 0.552 0.026  -0.004 0.015  151 ASP LLL HB3  
5483 N N    . TRP C 152 ? 0.497 0.461 0.509 0.033  0.000  0.017  152 TRP LLL N    
5484 C CA   . TRP C 152 ? 0.500 0.458 0.505 0.037  -0.004 0.015  152 TRP LLL CA   
5485 C C    . TRP C 152 ? 0.507 0.456 0.504 0.043  -0.011 0.013  152 TRP LLL C    
5486 O O    . TRP C 152 ? 0.511 0.455 0.500 0.047  -0.010 0.013  152 TRP LLL O    
5487 C CB   . TRP C 152 ? 0.501 0.458 0.501 0.041  0.002  0.017  152 TRP LLL CB   
5488 C CG   . TRP C 152 ? 0.485 0.449 0.494 0.036  0.005  0.018  152 TRP LLL CG   
5489 C CD1  . TRP C 152 ? 0.477 0.446 0.494 0.033  0.009  0.020  152 TRP LLL CD1  
5490 C CD2  . TRP C 152 ? 0.485 0.448 0.496 0.035  0.001  0.017  152 TRP LLL CD2  
5491 N NE1  . TRP C 152 ? 0.473 0.444 0.496 0.030  0.008  0.020  152 TRP LLL NE1  
5492 C CE2  . TRP C 152 ? 0.482 0.450 0.502 0.031  0.003  0.018  152 TRP LLL CE2  
5493 C CE3  . TRP C 152 ? 0.487 0.445 0.493 0.037  -0.004 0.015  152 TRP LLL CE3  
5494 C CZ2  . TRP C 152 ? 0.484 0.450 0.506 0.029  -0.001 0.018  152 TRP LLL CZ2  
5495 C CZ3  . TRP C 152 ? 0.484 0.442 0.494 0.035  -0.007 0.015  152 TRP LLL CZ3  
5496 C CH2  . TRP C 152 ? 0.484 0.445 0.501 0.031  -0.005 0.016  152 TRP LLL CH2  
5497 H H    . TRP C 152 ? 0.499 0.464 0.509 0.034  0.004  0.018  152 TRP LLL H    
5498 H HA   . TRP C 152 ? 0.497 0.456 0.506 0.034  -0.006 0.015  152 TRP LLL HA   
5499 H HB2  . TRP C 152 ? 0.503 0.459 0.499 0.044  0.006  0.018  152 TRP LLL HB2  
5500 H HB3  . TRP C 152 ? 0.508 0.459 0.500 0.045  -0.000 0.016  152 TRP LLL HB3  
5501 H HD1  . TRP C 152 ? 0.475 0.447 0.494 0.032  0.012  0.021  152 TRP LLL HD1  
5502 H HE1  . TRP C 152 ? 0.471 0.444 0.499 0.028  0.009  0.021  152 TRP LLL HE1  
5503 H HE3  . TRP C 152 ? 0.494 0.448 0.494 0.040  -0.007 0.014  152 TRP LLL HE3  
5504 H HZ2  . TRP C 152 ? 0.480 0.447 0.507 0.027  -0.001 0.018  152 TRP LLL HZ2  
5505 H HZ3  . TRP C 152 ? 0.490 0.445 0.496 0.037  -0.010 0.014  152 TRP LLL HZ3  
5506 H HH2  . TRP C 152 ? 0.485 0.445 0.503 0.031  -0.009 0.015  152 TRP LLL HH2  
5507 N N    . LYS C 153 ? 0.513 0.457 0.511 0.043  -0.020 0.010  153 LYS LLL N    
5508 C CA   . LYS C 153 ? 0.534 0.466 0.523 0.050  -0.030 0.006  153 LYS LLL CA   
5509 C C    . LYS C 153 ? 0.522 0.446 0.497 0.056  -0.032 0.005  153 LYS LLL C    
5510 O O    . LYS C 153 ? 0.501 0.431 0.483 0.052  -0.029 0.006  153 LYS LLL O    
5511 C CB   . LYS C 153 ? 0.551 0.483 0.556 0.047  -0.039 0.003  153 LYS LLL CB   
5512 C CG   . LYS C 153 ? 0.568 0.503 0.584 0.045  -0.040 0.002  153 LYS LLL CG   
5513 C CD   . LYS C 153 ? 0.604 0.532 0.631 0.047  -0.054 -0.003 153 LYS LLL CD   
5514 C CE   . LYS C 153 ? 0.618 0.552 0.667 0.042  -0.054 -0.004 153 LYS LLL CE   
5515 N NZ   . LYS C 153 ? 0.634 0.566 0.673 0.045  -0.052 -0.003 153 LYS LLL NZ   
5516 H H    . LYS C 153 ? 0.509 0.456 0.514 0.039  -0.020 0.010  153 LYS LLL H    
5517 H HA   . LYS C 153 ? 0.539 0.467 0.519 0.055  -0.029 0.006  153 LYS LLL HA   
5518 H HB2  . LYS C 153 ? 0.543 0.481 0.558 0.041  -0.037 0.004  153 LYS LLL HB2  
5519 H HB3  . LYS C 153 ? 0.562 0.485 0.561 0.052  -0.047 -0.000 153 LYS LLL HB3  
5520 H HG2  . LYS C 153 ? 0.574 0.506 0.579 0.048  -0.038 0.003  153 LYS LLL HG2  
5521 H HG3  . LYS C 153 ? 0.558 0.502 0.585 0.039  -0.034 0.004  153 LYS LLL HG3  
5522 H HD2  . LYS C 153 ? 0.601 0.529 0.636 0.045  -0.057 -0.004 153 LYS LLL HD2  
5523 H HD3  . LYS C 153 ? 0.615 0.533 0.628 0.054  -0.061 -0.005 153 LYS LLL HD3  
5524 H HE2  . LYS C 153 ? 0.605 0.547 0.665 0.035  -0.046 -0.002 153 LYS LLL HE2  
5525 H HE3  . LYS C 153 ? 0.620 0.550 0.681 0.043  -0.064 -0.008 153 LYS LLL HE3  
5526 H HZ1  . LYS C 153 ? 0.642 0.565 0.666 0.052  -0.058 -0.005 153 LYS LLL HZ1  
5527 H HZ2  . LYS C 153 ? 0.627 0.561 0.680 0.043  -0.055 -0.005 153 LYS LLL HZ2  
5528 H HZ3  . LYS C 153 ? 0.624 0.561 0.657 0.043  -0.043 0.000  153 LYS LLL HZ3  
5529 N N    . VAL C 154 ? 0.523 0.433 0.480 0.065  -0.036 0.003  154 VAL LLL N    
5530 C CA   . VAL C 154 ? 0.532 0.431 0.474 0.072  -0.040 0.001  154 VAL LLL CA   
5531 C C    . VAL C 154 ? 0.540 0.422 0.469 0.080  -0.054 -0.004 154 VAL LLL C    
5532 O O    . VAL C 154 ? 0.556 0.424 0.466 0.088  -0.055 -0.004 154 VAL LLL O    
5533 C CB   . VAL C 154 ? 0.541 0.436 0.468 0.078  -0.027 0.005  154 VAL LLL CB   
5534 C CG1  . VAL C 154 ? 0.556 0.437 0.465 0.086  -0.029 0.003  154 VAL LLL CG1  
5535 C CG2  . VAL C 154 ? 0.520 0.432 0.464 0.070  -0.016 0.008  154 VAL LLL CG2  
5536 H H    . VAL C 154 ? 0.534 0.438 0.483 0.069  -0.038 0.003  154 VAL LLL H    
5537 H HA   . VAL C 154 ? 0.522 0.427 0.474 0.068  -0.041 0.001  154 VAL LLL HA   
5538 H HB   . VAL C 154 ? 0.549 0.437 0.465 0.082  -0.024 0.006  154 VAL LLL HB   
5539 H HG11 . VAL C 154 ? 0.574 0.441 0.468 0.093  -0.035 0.001  154 VAL LLL HG11 
5540 H HG12 . VAL C 154 ? 0.559 0.440 0.465 0.088  -0.019 0.005  154 VAL LLL HG12 
5541 H HG13 . VAL C 154 ? 0.551 0.436 0.468 0.083  -0.034 0.001  154 VAL LLL HG13 
5542 H HG21 . VAL C 154 ? 0.511 0.429 0.465 0.065  -0.019 0.008  154 VAL LLL HG21 
5543 H HG22 . VAL C 154 ? 0.526 0.435 0.464 0.073  -0.009 0.010  154 VAL LLL HG22 
5544 H HG23 . VAL C 154 ? 0.514 0.431 0.463 0.067  -0.012 0.010  154 VAL LLL HG23 
5545 N N    . ASP C 155 ? 0.526 0.407 0.466 0.078  -0.066 -0.007 155 ASP LLL N    
5546 C CA   . ASP C 155 ? 0.541 0.406 0.475 0.085  -0.084 -0.013 155 ASP LLL CA   
5547 C C    . ASP C 155 ? 0.549 0.411 0.489 0.085  -0.089 -0.015 155 ASP LLL C    
5548 O O    . ASP C 155 ? 0.564 0.407 0.484 0.095  -0.100 -0.018 155 ASP LLL O    
5549 C CB   . ASP C 155 ? 0.561 0.404 0.463 0.098  -0.088 -0.015 155 ASP LLL CB   
5550 C CG   . ASP C 155 ? 0.552 0.396 0.450 0.098  -0.084 -0.015 155 ASP LLL CG   
5551 O OD1  . ASP C 155 ? 0.537 0.394 0.459 0.090  -0.087 -0.015 155 ASP LLL OD1  
5552 O OD2  . ASP C 155 ? 0.557 0.387 0.429 0.107  -0.079 -0.014 155 ASP LLL OD2  
5553 H H    . ASP C 155 ? 0.517 0.407 0.469 0.073  -0.065 -0.007 155 ASP LLL H    
5554 H HA   . ASP C 155 ? 0.535 0.404 0.485 0.081  -0.090 -0.015 155 ASP LLL HA   
5555 H HB2  . ASP C 155 ? 0.569 0.406 0.455 0.102  -0.079 -0.013 155 ASP LLL HB2  
5556 H HB3  . ASP C 155 ? 0.576 0.405 0.472 0.103  -0.101 -0.020 155 ASP LLL HB3  
5557 N N    . GLY C 156 ? 0.541 0.421 0.505 0.075  -0.081 -0.012 156 GLY LLL N    
5558 C CA   . GLY C 156 ? 0.549 0.431 0.525 0.074  -0.086 -0.013 156 GLY LLL CA   
5559 C C    . GLY C 156 ? 0.574 0.446 0.526 0.080  -0.081 -0.011 156 GLY LLL C    
5560 O O    . GLY C 156 ? 0.588 0.456 0.544 0.082  -0.089 -0.014 156 GLY LLL O    
5561 H H    . GLY C 156 ? 0.525 0.418 0.499 0.069  -0.073 -0.009 156 GLY LLL H    
5562 H HA2  . GLY C 156 ? 0.533 0.428 0.528 0.066  -0.079 -0.011 156 GLY LLL HA2  
5563 H HA3  . GLY C 156 ? 0.558 0.432 0.540 0.077  -0.099 -0.018 156 GLY LLL HA3  
5564 N N    . THR C 157 ? 0.587 0.457 0.517 0.084  -0.068 -0.007 157 THR LLL N    
5565 C CA   . THR C 157 ? 0.600 0.464 0.511 0.088  -0.058 -0.004 157 THR LLL CA   
5566 C C    . THR C 157 ? 0.580 0.465 0.508 0.079  -0.042 0.002  157 THR LLL C    
5567 O O    . THR C 157 ? 0.574 0.468 0.507 0.075  -0.034 0.004  157 THR LLL O    
5568 C CB   . THR C 157 ? 0.627 0.467 0.502 0.101  -0.056 -0.003 157 THR LLL CB   
5569 O OG1  . THR C 157 ? 0.627 0.469 0.492 0.101  -0.038 0.003  157 THR LLL OG1  
5570 C CG2  . THR C 157 ? 0.629 0.465 0.497 0.104  -0.056 -0.004 157 THR LLL CG2  
5571 H H    . THR C 157 ? 0.583 0.456 0.511 0.083  -0.064 -0.006 157 THR LLL H    
5572 H HA   . THR C 157 ? 0.604 0.463 0.517 0.089  -0.065 -0.006 157 THR LLL HA   
5573 H HB   . THR C 157 ? 0.645 0.470 0.507 0.107  -0.066 -0.006 157 THR LLL HB   
5575 H HG21 . THR C 157 ? 0.630 0.465 0.506 0.103  -0.069 -0.008 157 THR LLL HG21 
5576 H HG22 . THR C 157 ? 0.651 0.471 0.495 0.112  -0.054 -0.004 157 THR LLL HG22 
5577 H HG23 . THR C 157 ? 0.613 0.463 0.494 0.097  -0.047 -0.001 157 THR LLL HG23 
5578 N N    . PRO C 158 ? 0.582 0.476 0.521 0.074  -0.038 0.004  158 PRO LLL N    
5579 C CA   . PRO C 158 ? 0.574 0.485 0.527 0.066  -0.025 0.008  158 PRO LLL CA   
5580 C C    . PRO C 158 ? 0.592 0.500 0.531 0.070  -0.011 0.013  158 PRO LLL C    
5581 O O    . PRO C 158 ? 0.624 0.517 0.542 0.078  -0.008 0.014  158 PRO LLL O    
5582 C CB   . PRO C 158 ? 0.561 0.476 0.524 0.062  -0.026 0.008  158 PRO LLL CB   
5583 C CG   . PRO C 158 ? 0.572 0.476 0.536 0.067  -0.042 0.003  158 PRO LLL CG   
5584 C CD   . PRO C 158 ? 0.592 0.477 0.531 0.077  -0.049 0.000  158 PRO LLL CD   
5585 H HA   . PRO C 158 ? 0.560 0.481 0.527 0.060  -0.024 0.008  158 PRO LLL HA   
5586 H HB2  . PRO C 158 ? 0.567 0.479 0.521 0.065  -0.020 0.010  158 PRO LLL HB2  
5587 H HB3  . PRO C 158 ? 0.546 0.474 0.526 0.055  -0.022 0.009  158 PRO LLL HB3  
5588 H HG2  . PRO C 158 ? 0.576 0.476 0.538 0.068  -0.044 0.002  158 PRO LLL HG2  
5589 H HG3  . PRO C 158 ? 0.561 0.473 0.543 0.061  -0.046 0.001  158 PRO LLL HG3  
5590 H HD2  . PRO C 158 ? 0.609 0.481 0.528 0.084  -0.048 0.001  158 PRO LLL HD2  
5591 H HD3  . PRO C 158 ? 0.597 0.478 0.541 0.078  -0.060 -0.004 158 PRO LLL HD3  
5592 N N    . VAL C 159 ? 0.590 0.510 0.540 0.064  -0.002 0.015  159 VAL LLL N    
5593 C CA   . VAL C 159 ? 0.609 0.529 0.555 0.067  0.012  0.019  159 VAL LLL CA   
5594 C C    . VAL C 159 ? 0.624 0.553 0.580 0.063  0.021  0.023  159 VAL LLL C    
5595 O O    . VAL C 159 ? 0.604 0.547 0.579 0.054  0.019  0.023  159 VAL LLL O    
5596 C CB   . VAL C 159 ? 0.597 0.525 0.553 0.064  0.015  0.020  159 VAL LLL CB   
5597 C CG1  . VAL C 159 ? 0.600 0.526 0.555 0.068  0.029  0.023  159 VAL LLL CG1  
5598 C CG2  . VAL C 159 ? 0.603 0.524 0.552 0.067  0.005  0.016  159 VAL LLL CG2  
5599 H H    . VAL C 159 ? 0.578 0.508 0.542 0.059  -0.004 0.015  159 VAL LLL H    
5600 H HA   . VAL C 159 ? 0.628 0.535 0.556 0.074  0.014  0.020  159 VAL LLL HA   
5601 H HB   . VAL C 159 ? 0.582 0.521 0.553 0.057  0.014  0.020  159 VAL LLL HB   
5602 H HG11 . VAL C 159 ? 0.594 0.526 0.558 0.065  0.035  0.025  159 VAL LLL HG11 
5603 H HG12 . VAL C 159 ? 0.596 0.526 0.558 0.067  0.029  0.023  159 VAL LLL HG12 
5604 H HG13 . VAL C 159 ? 0.618 0.531 0.556 0.075  0.032  0.023  159 VAL LLL HG13 
5605 H HG21 . VAL C 159 ? 0.620 0.528 0.553 0.073  0.003  0.015  159 VAL LLL HG21 
5606 H HG22 . VAL C 159 ? 0.601 0.525 0.554 0.066  0.008  0.017  159 VAL LLL HG22 
5607 H HG23 . VAL C 159 ? 0.596 0.521 0.553 0.062  -0.002 0.014  159 VAL LLL HG23 
5608 N N    . THR C 160 ? 0.658 0.577 0.601 0.069  0.030  0.026  160 THR LLL N    
5609 C CA   . THR C 160 ? 0.664 0.589 0.615 0.066  0.039  0.029  160 THR LLL CA   
5610 C C    . THR C 160 ? 0.679 0.606 0.638 0.067  0.054  0.033  160 THR LLL C    
5611 O O    . THR C 160 ? 0.686 0.621 0.658 0.063  0.061  0.036  160 THR LLL O    
5612 C CB   . THR C 160 ? 0.682 0.591 0.613 0.072  0.038  0.029  160 THR LLL CB   
5613 O OG1  . THR C 160 ? 0.706 0.595 0.611 0.083  0.045  0.031  160 THR LLL OG1  
5614 C CG2  . THR C 160 ? 0.673 0.579 0.600 0.072  0.022  0.025  160 THR LLL CG2  
5615 H H    . THR C 160 ? 0.673 0.579 0.600 0.075  0.031  0.026  160 THR LLL H    
5616 H HA   . THR C 160 ? 0.649 0.585 0.614 0.059  0.036  0.028  160 THR LLL HA   
5617 H HB   . THR C 160 ? 0.674 0.588 0.612 0.070  0.044  0.032  160 THR LLL HB   
5619 H HG21 . THR C 160 ? 0.658 0.578 0.604 0.065  0.018  0.024  160 THR LLL HG21 
5620 H HG22 . THR C 160 ? 0.686 0.584 0.604 0.075  0.020  0.025  160 THR LLL HG22 
5621 H HG23 . THR C 160 ? 0.685 0.584 0.604 0.076  0.016  0.022  160 THR LLL HG23 
5622 N N    . GLN C 161 ? 0.712 0.631 0.663 0.072  0.059  0.033  161 GLN LLL N    
5623 C CA   . GLN C 161 ? 0.726 0.647 0.689 0.074  0.074  0.036  161 GLN LLL CA   
5624 C C    . GLN C 161 ? 0.710 0.636 0.683 0.073  0.070  0.034  161 GLN LLL C    
5625 O O    . GLN C 161 ? 0.715 0.632 0.670 0.077  0.063  0.031  161 GLN LLL O    
5626 C CB   . GLN C 161 ? 0.777 0.676 0.716 0.085  0.088  0.040  161 GLN LLL CB   
5627 C CG   . GLN C 161 ? 0.804 0.694 0.731 0.087  0.092  0.042  161 GLN LLL CG   
5628 C CD   . GLN C 161 ? 0.799 0.701 0.750 0.082  0.105  0.046  161 GLN LLL CD   
5629 O OE1  . GLN C 161 ? 0.818 0.721 0.785 0.083  0.119  0.049  161 GLN LLL OE1  
5630 N NE2  . GLN C 161 ? 0.773 0.682 0.730 0.077  0.099  0.046  161 GLN LLL NE2  
5631 H H    . GLN C 161 ? 0.717 0.629 0.657 0.075  0.053  0.031  161 GLN LLL H    
5632 H HA   . GLN C 161 ? 0.714 0.644 0.694 0.069  0.077  0.038  161 GLN LLL HA   
5633 H HB2  . GLN C 161 ? 0.790 0.677 0.710 0.090  0.084  0.038  161 GLN LLL HB2  
5634 H HB3  . GLN C 161 ? 0.777 0.677 0.727 0.085  0.099  0.042  161 GLN LLL HB3  
5635 H HG2  . GLN C 161 ? 0.795 0.688 0.719 0.084  0.081  0.040  161 GLN LLL HG2  
5636 H HG3  . GLN C 161 ? 0.825 0.697 0.728 0.095  0.097  0.044  161 GLN LLL HG3  
5639 N N    . GLY C 162 ? 0.682 0.621 0.682 0.068  0.074  0.035  162 GLY LLL N    
5640 C CA   . GLY C 162 ? 0.668 0.614 0.682 0.066  0.071  0.032  162 GLY LLL CA   
5641 C C    . GLY C 162 ? 0.648 0.607 0.678 0.058  0.058  0.030  162 GLY LLL C    
5642 O O    . GLY C 162 ? 0.627 0.591 0.670 0.056  0.055  0.028  162 GLY LLL O    
5643 H H    . GLY C 162 ? 0.676 0.622 0.690 0.065  0.078  0.036  162 GLY LLL H    
5644 H HA2  . GLY C 162 ? 0.672 0.618 0.698 0.068  0.080  0.034  162 GLY LLL HA2  
5645 H HA3  . GLY C 162 ? 0.680 0.617 0.678 0.070  0.068  0.031  162 GLY LLL HA3  
5646 N N    . MET C 163 ? 0.654 0.617 0.681 0.053  0.051  0.029  163 MET LLL N    
5647 C CA   . MET C 163 ? 0.643 0.616 0.681 0.045  0.040  0.027  163 MET LLL CA   
5648 C C    . MET C 163 ? 0.598 0.579 0.654 0.041  0.043  0.029  163 MET LLL C    
5649 O O    . MET C 163 ? 0.585 0.565 0.640 0.042  0.050  0.031  163 MET LLL O    
5650 C CB   . MET C 163 ? 0.683 0.654 0.708 0.042  0.032  0.026  163 MET LLL CB   
5651 C CG   . MET C 163 ? 0.745 0.708 0.753 0.047  0.033  0.026  163 MET LLL CG   
5652 S SD   . MET C 163 ? 0.806 0.769 0.814 0.048  0.042  0.030  163 MET LLL SD   
5653 C CE   . MET C 163 ? 0.796 0.768 0.813 0.040  0.035  0.028  163 MET LLL CE   
5654 H H    . MET C 163 ? 0.656 0.616 0.675 0.054  0.053  0.030  163 MET LLL H    
5655 H HA   . MET C 163 ? 0.640 0.614 0.683 0.044  0.037  0.026  163 MET LLL HA   
5656 H HB2  . MET C 163 ? 0.676 0.653 0.708 0.038  0.030  0.026  163 MET LLL HB2  
5657 H HB3  . MET C 163 ? 0.684 0.654 0.706 0.041  0.026  0.024  163 MET LLL HB3  
5658 H HG2  . MET C 163 ? 0.744 0.706 0.748 0.045  0.027  0.025  163 MET LLL HG2  
5659 H HG3  . MET C 163 ? 0.755 0.711 0.754 0.052  0.036  0.026  163 MET LLL HG3  
5660 H HE1  . MET C 163 ? 0.795 0.767 0.812 0.040  0.038  0.030  163 MET LLL HE1  
5661 H HE2  . MET C 163 ? 0.787 0.765 0.814 0.036  0.034  0.028  163 MET LLL HE2  
5662 H HE3  . MET C 163 ? 0.796 0.766 0.807 0.039  0.029  0.027  163 MET LLL HE3  
5663 N N    . GLU C 164 ? 0.565 0.551 0.636 0.036  0.036  0.027  164 GLU LLL N    
5664 C CA   . GLU C 164 ? 0.549 0.540 0.634 0.032  0.034  0.027  164 GLU LLL CA   
5665 C C    . GLU C 164 ? 0.511 0.500 0.592 0.028  0.022  0.024  164 GLU LLL C    
5666 O O    . GLU C 164 ? 0.495 0.481 0.573 0.028  0.017  0.022  164 GLU LLL O    
5667 C CB   . GLU C 164 ? 0.566 0.561 0.677 0.034  0.039  0.027  164 GLU LLL CB   
5668 C CG   . GLU C 164 ? 0.590 0.583 0.704 0.039  0.054  0.030  164 GLU LLL CG   
5669 C CD   . GLU C 164 ? 0.599 0.591 0.707 0.041  0.064  0.033  164 GLU LLL CD   
5670 O OE1  . GLU C 164 ? 0.598 0.592 0.702 0.037  0.059  0.033  164 GLU LLL OE1  
5671 O OE2  . GLU C 164 ? 0.597 0.582 0.702 0.046  0.077  0.036  164 GLU LLL OE2  
5672 H H    . GLU C 164 ? 0.570 0.555 0.640 0.036  0.032  0.025  164 GLU LLL H    
5673 H HA   . GLU C 164 ? 0.546 0.538 0.627 0.032  0.037  0.028  164 GLU LLL HA   
5674 H HB2  . GLU C 164 ? 0.566 0.560 0.682 0.034  0.034  0.025  164 GLU LLL HB2  
5675 H HB3  . GLU C 164 ? 0.562 0.559 0.681 0.031  0.038  0.027  164 GLU LLL HB3  
5676 H HG2  . GLU C 164 ? 0.593 0.582 0.695 0.042  0.055  0.030  164 GLU LLL HG2  
5677 H HG3  . GLU C 164 ? 0.587 0.582 0.721 0.040  0.057  0.030  164 GLU LLL HG3  
5678 N N    . THR C 165 ? 0.482 0.471 0.560 0.024  0.019  0.024  165 THR LLL N    
5679 C CA   . THR C 165 ? 0.472 0.455 0.543 0.020  0.010  0.022  165 THR LLL CA   
5680 C C    . THR C 165 ? 0.460 0.443 0.544 0.019  0.005  0.021  165 THR LLL C    
5681 O O    . THR C 165 ? 0.449 0.438 0.545 0.019  0.010  0.022  165 THR LLL O    
5682 C CB   . THR C 165 ? 0.469 0.449 0.524 0.017  0.010  0.023  165 THR LLL CB   
5683 O OG1  . THR C 165 ? 0.474 0.458 0.524 0.019  0.015  0.024  165 THR LLL OG1  
5684 C CG2  . THR C 165 ? 0.472 0.443 0.515 0.015  0.004  0.022  165 THR LLL CG2  
5685 H H    . THR C 165 ? 0.483 0.475 0.562 0.023  0.023  0.026  165 THR LLL H    
5686 H HA   . THR C 165 ? 0.474 0.454 0.543 0.021  0.006  0.021  165 THR LLL HA   
5687 H HB   . THR C 165 ? 0.468 0.450 0.526 0.016  0.012  0.024  165 THR LLL HB   
5689 H HG21 . THR C 165 ? 0.477 0.443 0.521 0.014  -0.000 0.021  165 THR LLL HG21 
5690 H HG22 . THR C 165 ? 0.474 0.443 0.509 0.013  0.006  0.022  165 THR LLL HG22 
5691 H HG23 . THR C 165 ? 0.475 0.444 0.517 0.016  0.002  0.021  165 THR LLL HG23 
5692 N N    . THR C 166 ? 0.464 0.438 0.546 0.019  -0.005 0.018  166 THR LLL N    
5693 C CA   . THR C 166 ? 0.478 0.446 0.568 0.019  -0.014 0.016  166 THR LLL CA   
5694 C C    . THR C 166 ? 0.484 0.447 0.559 0.016  -0.014 0.017  166 THR LLL C    
5695 O O    . THR C 166 ? 0.488 0.448 0.544 0.014  -0.010 0.018  166 THR LLL O    
5696 C CB   . THR C 166 ? 0.495 0.451 0.582 0.020  -0.028 0.012  166 THR LLL CB   
5697 O OG1  . THR C 166 ? 0.515 0.459 0.574 0.019  -0.030 0.012  166 THR LLL OG1  
5698 C CG2  . THR C 166 ? 0.496 0.458 0.600 0.023  -0.028 0.011  166 THR LLL CG2  
5699 H H    . THR C 166 ? 0.471 0.441 0.545 0.019  -0.009 0.017  166 THR LLL H    
5700 H HA   . THR C 166 ? 0.472 0.448 0.582 0.020  -0.012 0.016  166 THR LLL HA   
5701 H HB   . THR C 166 ? 0.501 0.453 0.595 0.021  -0.035 0.010  166 THR LLL HB   
5703 H HG21 . THR C 166 ? 0.488 0.459 0.611 0.024  -0.022 0.012  166 THR LLL HG21 
5704 H HG22 . THR C 166 ? 0.502 0.457 0.609 0.024  -0.037 0.008  166 THR LLL HG22 
5705 H HG23 . THR C 166 ? 0.493 0.457 0.587 0.023  -0.023 0.013  166 THR LLL HG23 
5706 N N    . GLN C 167 ? 0.495 0.457 0.580 0.016  -0.017 0.016  167 GLN LLL N    
5707 C CA   . GLN C 167 ? 0.513 0.466 0.580 0.014  -0.019 0.016  167 GLN LLL CA   
5708 C C    . GLN C 167 ? 0.538 0.471 0.581 0.015  -0.028 0.014  167 GLN LLL C    
5709 O O    . GLN C 167 ? 0.544 0.469 0.589 0.017  -0.038 0.011  167 GLN LLL O    
5710 C CB   . GLN C 167 ? 0.517 0.471 0.602 0.015  -0.024 0.014  167 GLN LLL CB   
5711 C CG   . GLN C 167 ? 0.525 0.472 0.594 0.014  -0.023 0.015  167 GLN LLL CG   
5712 C CD   . GLN C 167 ? 0.535 0.478 0.619 0.015  -0.032 0.012  167 GLN LLL CD   
5713 O OE1  . GLN C 167 ? 0.544 0.483 0.642 0.017  -0.044 0.009  167 GLN LLL OE1  
5714 N NE2  . GLN C 167 ? 0.538 0.483 0.619 0.014  -0.028 0.013  167 GLN LLL NE2  
5715 H H    . GLN C 167 ? 0.492 0.458 0.594 0.017  -0.019 0.015  167 GLN LLL H    
5716 H HA   . GLN C 167 ? 0.508 0.465 0.569 0.013  -0.011 0.018  167 GLN LLL HA   
5717 H HB2  . GLN C 167 ? 0.507 0.472 0.609 0.015  -0.019 0.015  167 GLN LLL HB2  
5718 H HB3  . GLN C 167 ? 0.525 0.471 0.613 0.017  -0.034 0.011  167 GLN LLL HB3  
5719 H HG2  . GLN C 167 ? 0.537 0.472 0.586 0.014  -0.025 0.014  167 GLN LLL HG2  
5720 H HG3  . GLN C 167 ? 0.516 0.473 0.588 0.012  -0.013 0.017  167 GLN LLL HG3  
5723 N N    . PRO C 168 ? 0.541 0.465 0.560 0.013  -0.023 0.015  168 PRO LLL N    
5724 C CA   . PRO C 168 ? 0.559 0.460 0.550 0.015  -0.029 0.014  168 PRO LLL CA   
5725 C C    . PRO C 168 ? 0.577 0.459 0.561 0.018  -0.044 0.010  168 PRO LLL C    
5726 O O    . PRO C 168 ? 0.582 0.467 0.576 0.019  -0.046 0.009  168 PRO LLL O    
5727 C CB   . PRO C 168 ? 0.564 0.460 0.537 0.012  -0.017 0.017  168 PRO LLL CB   
5728 C CG   . PRO C 168 ? 0.541 0.460 0.533 0.009  -0.006 0.019  168 PRO LLL CG   
5729 C CD   . PRO C 168 ? 0.526 0.458 0.542 0.011  -0.011 0.018  168 PRO LLL CD   
5730 H HA   . PRO C 168 ? 0.560 0.461 0.550 0.015  -0.029 0.014  168 PRO LLL HA   
5731 H HB2  . PRO C 168 ? 0.573 0.460 0.538 0.013  -0.018 0.016  168 PRO LLL HB2  
5732 H HB3  . PRO C 168 ? 0.574 0.459 0.532 0.012  -0.015 0.018  168 PRO LLL HB3  
5733 H HG2  . PRO C 168 ? 0.540 0.459 0.528 0.008  -0.000 0.021  168 PRO LLL HG2  
5734 H HG3  . PRO C 168 ? 0.535 0.459 0.530 0.009  -0.004 0.020  168 PRO LLL HG3  
5735 H HD2  . PRO C 168 ? 0.529 0.460 0.546 0.010  -0.011 0.018  168 PRO LLL HD2  
5736 H HD3  . PRO C 168 ? 0.515 0.460 0.543 0.010  -0.005 0.020  168 PRO LLL HD3  
5737 N N    . SER C 169 ? 0.593 0.456 0.561 0.021  -0.054 0.008  169 SER LLL N    
5738 C CA   . SER C 169 ? 0.618 0.459 0.578 0.026  -0.073 0.003  169 SER LLL CA   
5739 C C    . SER C 169 ? 0.656 0.464 0.573 0.029  -0.077 0.003  169 SER LLL C    
5740 O O    . SER C 169 ? 0.661 0.466 0.565 0.028  -0.069 0.005  169 SER LLL O    
5741 C CB   . SER C 169 ? 0.613 0.463 0.601 0.028  -0.084 -0.001 169 SER LLL CB   
5742 O OG   . SER C 169 ? 0.650 0.473 0.624 0.033  -0.104 -0.006 169 SER LLL OG   
5743 H H    . SER C 169 ? 0.597 0.457 0.556 0.021  -0.052 0.009  169 SER LLL H    
5744 H HA   . SER C 169 ? 0.619 0.460 0.583 0.027  -0.074 0.002  169 SER LLL HA   
5745 H HB2  . SER C 169 ? 0.600 0.465 0.613 0.027  -0.084 -0.001 169 SER LLL HB2  
5746 H HB3  . SER C 169 ? 0.606 0.464 0.597 0.027  -0.079 0.001  169 SER LLL HB3  
5748 N N    . LYS C 170 ? 0.691 0.472 0.585 0.034  -0.088 -0.000 170 LYS LLL N    
5749 C CA   . LYS C 170 ? 0.742 0.485 0.588 0.038  -0.090 -0.000 170 LYS LLL CA   
5750 C C    . LYS C 170 ? 0.755 0.483 0.590 0.041  -0.102 -0.003 170 LYS LLL C    
5751 O O    . LYS C 170 ? 0.741 0.480 0.604 0.043  -0.116 -0.007 170 LYS LLL O    
5752 C CB   . LYS C 170 ? 0.782 0.496 0.605 0.044  -0.104 -0.004 170 LYS LLL CB   
5753 C CG   . LYS C 170 ? 0.788 0.504 0.604 0.042  -0.091 -0.002 170 LYS LLL CG   
5754 C CD   . LYS C 170 ? 0.841 0.517 0.617 0.050  -0.103 -0.005 170 LYS LLL CD   
5755 C CE   . LYS C 170 ? 0.840 0.523 0.626 0.049  -0.102 -0.006 170 LYS LLL CE   
5756 N NZ   . LYS C 170 ? 0.808 0.518 0.609 0.042  -0.078 -0.000 170 LYS LLL NZ   
5757 H H    . LYS C 170 ? 0.690 0.473 0.596 0.035  -0.095 -0.003 170 LYS LLL H    
5758 H HA   . LYS C 170 ? 0.740 0.484 0.574 0.035  -0.076 0.004  170 LYS LLL HA   
5759 H HB2  . LYS C 170 ? 0.776 0.496 0.620 0.046  -0.118 -0.008 170 LYS LLL HB2  
5760 H HB3  . LYS C 170 ? 0.811 0.497 0.602 0.048  -0.109 -0.005 170 LYS LLL HB3  
5761 H HG2  . LYS C 170 ? 0.784 0.504 0.592 0.039  -0.075 0.002  170 LYS LLL HG2  
5762 H HG3  . LYS C 170 ? 0.765 0.504 0.610 0.040  -0.091 -0.002 170 LYS LLL HG3  
5763 H HD2  . LYS C 170 ? 0.856 0.517 0.628 0.054  -0.120 -0.009 170 LYS LLL HD2  
5764 H HD3  . LYS C 170 ? 0.861 0.517 0.605 0.051  -0.093 -0.002 170 LYS LLL HD3  
5765 H HE2  . LYS C 170 ? 0.824 0.520 0.638 0.049  -0.114 -0.009 170 LYS LLL HE2  
5766 H HE3  . LYS C 170 ? 0.869 0.523 0.624 0.055  -0.107 -0.008 170 LYS LLL HE3  
5767 H HZ1  . LYS C 170 ? 0.815 0.519 0.600 0.041  -0.067 0.003  170 LYS LLL HZ1  
5768 H HZ2  . LYS C 170 ? 0.815 0.520 0.610 0.043  -0.076 -0.000 170 LYS LLL HZ2  
5769 H HZ3  . LYS C 170 ? 0.781 0.517 0.613 0.039  -0.076 0.000  170 LYS LLL HZ3  
5770 N N    . GLN C 171 ? 0.785 0.486 0.581 0.043  -0.095 0.000  171 GLN LLL N    
5771 C CA   . GLN C 171 ? 0.814 0.489 0.585 0.047  -0.107 -0.002 171 GLN LLL CA   
5772 C C    . GLN C 171 ? 0.866 0.495 0.593 0.056  -0.122 -0.005 171 GLN LLL C    
5773 O O    . GLN C 171 ? 0.876 0.500 0.600 0.058  -0.124 -0.007 171 GLN LLL O    
5774 C CB   . GLN C 171 ? 0.812 0.486 0.568 0.044  -0.088 0.004  171 GLN LLL CB   
5775 C CG   . GLN C 171 ? 0.763 0.479 0.559 0.036  -0.073 0.007  171 GLN LLL CG   
5776 C CD   . GLN C 171 ? 0.761 0.476 0.545 0.032  -0.056 0.012  171 GLN LLL CD   
5777 O OE1  . GLN C 171 ? 0.729 0.468 0.538 0.029  -0.052 0.013  171 GLN LLL OE1  
5778 N NE2  . GLN C 171 ? 0.795 0.480 0.542 0.034  -0.046 0.016  171 GLN LLL NE2  
5779 H H    . GLN C 171 ? 0.789 0.486 0.570 0.041  -0.082 0.004  171 GLN LLL H    
5780 H HA   . GLN C 171 ? 0.801 0.489 0.596 0.047  -0.117 -0.005 171 GLN LLL HA   
5781 H HB2  . GLN C 171 ? 0.830 0.487 0.561 0.044  -0.078 0.007  171 GLN LLL HB2  
5782 H HB3  . GLN C 171 ? 0.828 0.487 0.570 0.046  -0.096 0.003  171 GLN LLL HB3  
5783 H HG2  . GLN C 171 ? 0.748 0.479 0.567 0.036  -0.082 0.005  171 GLN LLL HG2  
5784 H HG3  . GLN C 171 ? 0.749 0.479 0.557 0.034  -0.066 0.008  171 GLN LLL HG3  
5787 N N    . SER C 172 ? 0.906 0.501 0.600 0.062  -0.133 -0.007 172 SER LLL N    
5788 C CA   . SER C 172 ? 0.966 0.509 0.607 0.071  -0.147 -0.010 172 SER LLL CA   
5789 C C    . SER C 172 ? 0.995 0.517 0.598 0.072  -0.127 -0.005 172 SER LLL C    
5790 O O    . SER C 172 ? 1.023 0.519 0.602 0.078  -0.137 -0.008 172 SER LLL O    
5791 C CB   . SER C 172 ? 1.007 0.517 0.614 0.077  -0.157 -0.011 172 SER LLL CB   
5792 O OG   . SER C 172 ? 0.988 0.525 0.634 0.074  -0.166 -0.013 172 SER LLL OG   
5793 H H    . SER C 172 ? 0.900 0.501 0.600 0.060  -0.133 -0.007 172 SER LLL H    
5794 H HA   . SER C 172 ? 0.970 0.511 0.622 0.075  -0.165 -0.015 172 SER LLL HA   
5795 H HB2  . SER C 172 ? 1.020 0.518 0.603 0.075  -0.140 -0.006 172 SER LLL HB2  
5796 H HB3  . SER C 172 ? 1.043 0.520 0.623 0.084  -0.173 -0.015 172 SER LLL HB3  
5798 N N    . ASN C 173 ? 0.981 0.516 0.584 0.065  -0.100 0.002  173 ASN LLL N    
5799 C CA   . ASN C 173 ? 1.004 0.516 0.570 0.066  -0.076 0.008  173 ASN LLL CA   
5800 C C    . ASN C 173 ? 0.972 0.515 0.568 0.060  -0.061 0.010  173 ASN LLL C    
5801 O O    . ASN C 173 ? 0.985 0.521 0.565 0.058  -0.038 0.015  173 ASN LLL O    
5802 C CB   . ASN C 173 ? 1.009 0.514 0.562 0.062  -0.056 0.014  173 ASN LLL CB   
5803 C CG   . ASN C 173 ? 0.955 0.510 0.559 0.053  -0.046 0.017  173 ASN LLL CG   
5804 O OD1  . ASN C 173 ? 0.920 0.511 0.567 0.049  -0.056 0.013  173 ASN LLL OD1  
5805 N ND2  . ASN C 173 ? 0.956 0.510 0.555 0.049  -0.026 0.022  173 ASN LLL ND2  
5806 H H    . ASN C 173 ? 0.954 0.513 0.582 0.060  -0.094 0.004  173 ASN LLL H    
5807 H HA   . ASN C 173 ? 1.043 0.519 0.572 0.073  -0.084 0.006  173 ASN LLL HA   
5808 H HB2  . ASN C 173 ? 1.026 0.516 0.558 0.063  -0.039 0.018  173 ASN LLL HB2  
5809 H HB3  . ASN C 173 ? 1.036 0.516 0.564 0.067  -0.066 0.013  173 ASN LLL HB3  
5812 N N    . ASN C 174 ? 0.935 0.512 0.573 0.057  -0.074 0.006  174 ASN LLL N    
5813 C CA   . ASN C 174 ? 0.901 0.506 0.567 0.052  -0.063 0.007  174 ASN LLL CA   
5814 C C    . ASN C 174 ? 0.862 0.500 0.555 0.043  -0.039 0.013  174 ASN LLL C    
5815 O O    . ASN C 174 ? 0.850 0.504 0.557 0.040  -0.026 0.015  174 ASN LLL O    
5816 C CB   . ASN C 174 ? 0.936 0.508 0.565 0.058  -0.062 0.007  174 ASN LLL CB   
5817 C CG   . ASN C 174 ? 0.960 0.514 0.581 0.065  -0.089 -0.001 174 ASN LLL CG   
5818 O OD1  . ASN C 174 ? 0.997 0.516 0.587 0.073  -0.107 -0.004 174 ASN LLL OD1  
5819 N ND2  . ASN C 174 ? 0.938 0.515 0.589 0.063  -0.094 -0.003 174 ASN LLL ND2  
5820 H H    . ASN C 174 ? 0.927 0.510 0.580 0.058  -0.089 0.002  174 ASN LLL H    
5821 H HA   . ASN C 174 ? 0.880 0.505 0.575 0.051  -0.076 0.004  174 ASN LLL HA   
5822 H HB2  . ASN C 174 ? 0.968 0.512 0.562 0.061  -0.054 0.009  174 ASN LLL HB2  
5823 H HB3  . ASN C 174 ? 0.918 0.509 0.563 0.054  -0.049 0.009  174 ASN LLL HB3  
5826 N N    . LYS C 175 ? 0.844 0.492 0.546 0.040  -0.034 0.015  175 LYS LLL N    
5827 C CA   . LYS C 175 ? 0.798 0.484 0.537 0.032  -0.019 0.019  175 LYS LLL CA   
5828 C C    . LYS C 175 ? 0.754 0.474 0.534 0.030  -0.032 0.016  175 LYS LLL C    
5829 O O    . LYS C 175 ? 0.763 0.476 0.544 0.034  -0.051 0.011  175 LYS LLL O    
5830 C CB   . LYS C 175 ? 0.806 0.483 0.533 0.031  -0.009 0.022  175 LYS LLL CB   
5831 C CG   . LYS C 175 ? 0.840 0.483 0.530 0.032  0.010  0.027  175 LYS LLL CG   
5832 C CD   . LYS C 175 ? 0.837 0.476 0.524 0.029  0.022  0.031  175 LYS LLL CD   
5833 C CE   . LYS C 175 ? 0.864 0.473 0.521 0.030  0.045  0.036  175 LYS LLL CE   
5834 N NZ   . LYS C 175 ? 0.870 0.478 0.531 0.027  0.059  0.040  175 LYS LLL NZ   
5835 H H    . LYS C 175 ? 0.863 0.493 0.548 0.043  -0.041 0.014  175 LYS LLL H    
5836 H HA   . LYS C 175 ? 0.790 0.483 0.534 0.030  -0.007 0.021  175 LYS LLL HA   
5837 H HB2  . LYS C 175 ? 0.816 0.482 0.535 0.033  -0.021 0.020  175 LYS LLL HB2  
5838 H HB3  . LYS C 175 ? 0.778 0.480 0.532 0.026  -0.002 0.024  175 LYS LLL HB3  
5839 H HG2  . LYS C 175 ? 0.832 0.482 0.529 0.030  0.021  0.028  175 LYS LLL HG2  
5840 H HG3  . LYS C 175 ? 0.871 0.484 0.529 0.038  0.002  0.025  175 LYS LLL HG3  
5841 H HD2  . LYS C 175 ? 0.850 0.476 0.524 0.032  0.012  0.029  175 LYS LLL HD2  
5842 H HD3  . LYS C 175 ? 0.806 0.474 0.525 0.024  0.026  0.031  175 LYS LLL HD3  
5843 H HE2  . LYS C 175 ? 0.855 0.475 0.525 0.027  0.056  0.037  175 LYS LLL HE2  
5844 H HE3  . LYS C 175 ? 0.901 0.478 0.523 0.036  0.042  0.036  175 LYS LLL HE3  
5845 H HZ1  . LYS C 175 ? 0.880 0.476 0.529 0.029  0.050  0.039  175 LYS LLL HZ1  
5846 H HZ2  . LYS C 175 ? 0.889 0.478 0.535 0.027  0.074  0.043  175 LYS LLL HZ2  
5847 H HZ3  . LYS C 175 ? 0.838 0.474 0.532 0.022  0.061  0.040  175 LYS LLL HZ3  
5848 N N    . TYR C 176 ? 0.712 0.467 0.527 0.024  -0.022 0.018  176 TYR LLL N    
5849 C CA   . TYR C 176 ? 0.677 0.464 0.531 0.022  -0.030 0.016  176 TYR LLL CA   
5850 C C    . TYR C 176 ? 0.655 0.457 0.524 0.020  -0.030 0.016  176 TYR LLL C    
5851 O O    . TYR C 176 ? 0.665 0.461 0.523 0.018  -0.020 0.019  176 TYR LLL O    
5852 C CB   . TYR C 176 ? 0.658 0.471 0.536 0.018  -0.020 0.017  176 TYR LLL CB   
5853 C CG   . TYR C 176 ? 0.674 0.477 0.545 0.020  -0.024 0.016  176 TYR LLL CG   
5854 C CD1  . TYR C 176 ? 0.703 0.482 0.543 0.022  -0.016 0.017  176 TYR LLL CD1  
5855 C CD2  . TYR C 176 ? 0.663 0.481 0.557 0.021  -0.034 0.013  176 TYR LLL CD2  
5856 C CE1  . TYR C 176 ? 0.716 0.485 0.548 0.024  -0.020 0.015  176 TYR LLL CE1  
5857 C CE2  . TYR C 176 ? 0.676 0.486 0.566 0.023  -0.039 0.011  176 TYR LLL CE2  
5858 C CZ   . TYR C 176 ? 0.705 0.490 0.562 0.025  -0.033 0.012  176 TYR LLL CZ   
5859 O OH   . TYR C 176 ? 0.725 0.501 0.576 0.027  -0.038 0.010  176 TYR LLL OH   
5860 H H    . TYR C 176 ? 0.708 0.468 0.524 0.021  -0.009 0.021  176 TYR LLL H    
5861 H HA   . TYR C 176 ? 0.684 0.465 0.538 0.025  -0.043 0.012  176 TYR LLL HA   
5862 H HB2  . TYR C 176 ? 0.656 0.470 0.530 0.015  -0.007 0.020  176 TYR LLL HB2  
5863 H HB3  . TYR C 176 ? 0.637 0.470 0.538 0.016  -0.022 0.017  176 TYR LLL HB3  
5864 H HD1  . TYR C 176 ? 0.714 0.483 0.540 0.021  -0.007 0.019  176 TYR LLL HD1  
5865 H HD2  . TYR C 176 ? 0.647 0.480 0.562 0.020  -0.038 0.012  176 TYR LLL HD2  
5866 H HE1  . TYR C 176 ? 0.736 0.487 0.546 0.026  -0.014 0.016  176 TYR LLL HE1  
5867 H HE2  . TYR C 176 ? 0.665 0.485 0.574 0.023  -0.046 0.009  176 TYR LLL HE2  
5869 N N    . MET C 177 ? 0.629 0.450 0.525 0.020  -0.040 0.013  177 MET LLL N    
5870 C CA   . MET C 177 ? 0.604 0.441 0.519 0.019  -0.041 0.013  177 MET LLL CA   
5871 C C    . MET C 177 ? 0.555 0.422 0.505 0.018  -0.039 0.013  177 MET LLL C    
5872 O O    . MET C 177 ? 0.538 0.408 0.499 0.019  -0.044 0.011  177 MET LLL O    
5873 C CB   . MET C 177 ? 0.628 0.450 0.535 0.023  -0.056 0.010  177 MET LLL CB   
5874 C CG   . MET C 177 ? 0.637 0.460 0.561 0.027  -0.072 0.005  177 MET LLL CG   
5875 S SD   . MET C 177 ? 0.687 0.483 0.596 0.033  -0.093 0.000  177 MET LLL SD   
5876 C CE   . MET C 177 ? 0.699 0.483 0.614 0.037  -0.111 -0.005 177 MET LLL CE   
5877 H H    . MET C 177 ? 0.627 0.450 0.532 0.022  -0.047 0.011  177 MET LLL H    
5878 H HA   . MET C 177 ? 0.601 0.440 0.511 0.017  -0.031 0.016  177 MET LLL HA   
5879 H HB2  . MET C 177 ? 0.618 0.450 0.536 0.022  -0.055 0.010  177 MET LLL HB2  
5880 H HB3  . MET C 177 ? 0.651 0.451 0.533 0.025  -0.057 0.010  177 MET LLL HB3  
5881 H HG2  . MET C 177 ? 0.645 0.463 0.565 0.027  -0.072 0.005  177 MET LLL HG2  
5882 H HG3  . MET C 177 ? 0.619 0.463 0.570 0.025  -0.070 0.005  177 MET LLL HG3  
5883 H HE1  . MET C 177 ? 0.716 0.484 0.625 0.041  -0.125 -0.009 177 MET LLL HE1  
5884 H HE2  . MET C 177 ? 0.712 0.484 0.607 0.037  -0.107 -0.004 177 MET LLL HE2  
5885 H HE3  . MET C 177 ? 0.679 0.483 0.623 0.036  -0.109 -0.006 177 MET LLL HE3  
5886 N N    . ALA C 178 ? 0.518 0.403 0.483 0.016  -0.032 0.015  178 ALA LLL N    
5887 C CA   . ALA C 178 ? 0.485 0.393 0.477 0.015  -0.029 0.015  178 ALA LLL CA   
5888 C C    . ALA C 178 ? 0.463 0.380 0.464 0.016  -0.029 0.015  178 ALA LLL C    
5889 O O    . ALA C 178 ? 0.463 0.368 0.448 0.016  -0.030 0.015  178 ALA LLL O    
5890 C CB   . ALA C 178 ? 0.474 0.395 0.472 0.013  -0.017 0.017  178 ALA LLL CB   
5891 H H    . ALA C 178 ? 0.523 0.405 0.480 0.015  -0.029 0.016  178 ALA LLL H    
5892 H HA   . ALA C 178 ? 0.484 0.394 0.487 0.017  -0.035 0.013  178 ALA LLL HA   
5893 H HB1  . ALA C 178 ? 0.461 0.395 0.474 0.013  -0.015 0.018  178 ALA LLL HB1  
5894 H HB2  . ALA C 178 ? 0.478 0.394 0.472 0.012  -0.018 0.017  178 ALA LLL HB2  
5895 H HB3  . ALA C 178 ? 0.475 0.394 0.464 0.011  -0.012 0.019  178 ALA LLL HB3  
5896 N N    . SER C 179 ? 0.438 0.371 0.461 0.017  -0.027 0.014  179 SER LLL N    
5897 C CA   . SER C 179 ? 0.425 0.366 0.455 0.019  -0.025 0.014  179 SER LLL CA   
5898 C C    . SER C 179 ? 0.402 0.359 0.447 0.019  -0.015 0.016  179 SER LLL C    
5899 O O    . SER C 179 ? 0.386 0.349 0.444 0.020  -0.012 0.016  179 SER LLL O    
5900 C CB   . SER C 179 ? 0.424 0.361 0.465 0.022  -0.034 0.011  179 SER LLL CB   
5901 O OG   . SER C 179 ? 0.425 0.366 0.485 0.023  -0.038 0.009  179 SER LLL OG   
5902 H H    . SER C 179 ? 0.433 0.372 0.468 0.018  -0.026 0.014  179 SER LLL H    
5903 H HA   . SER C 179 ? 0.427 0.363 0.446 0.018  -0.023 0.015  179 SER LLL HA   
5904 H HB2  . SER C 179 ? 0.421 0.365 0.468 0.023  -0.031 0.011  179 SER LLL HB2  
5905 H HB3  . SER C 179 ? 0.437 0.363 0.465 0.022  -0.040 0.010  179 SER LLL HB3  
5907 N N    . SER C 180 ? 0.397 0.358 0.437 0.020  -0.010 0.017  180 SER LLL N    
5908 C CA   . SER C 180 ? 0.391 0.361 0.438 0.022  -0.002 0.019  180 SER LLL CA   
5909 C C    . SER C 180 ? 0.398 0.369 0.449 0.026  -0.002 0.018  180 SER LLL C    
5910 O O    . SER C 180 ? 0.411 0.376 0.455 0.026  -0.008 0.016  180 SER LLL O    
5911 C CB   . SER C 180 ? 0.385 0.356 0.422 0.021  0.003  0.020  180 SER LLL CB   
5912 O OG   . SER C 180 ? 0.381 0.358 0.422 0.023  0.009  0.022  180 SER LLL OG   
5913 H H    . SER C 180 ? 0.402 0.358 0.432 0.019  -0.011 0.017  180 SER LLL H    
5914 H HA   . SER C 180 ? 0.388 0.362 0.444 0.023  0.001  0.019  180 SER LLL HA   
5915 H HB2  . SER C 180 ? 0.387 0.355 0.420 0.018  0.002  0.020  180 SER LLL HB2  
5916 H HB3  . SER C 180 ? 0.388 0.357 0.420 0.022  0.001  0.020  180 SER LLL HB3  
5918 N N    . TYR C 181 ? 0.396 0.373 0.458 0.030  0.005  0.019  181 TYR LLL N    
5919 C CA   . TYR C 181 ? 0.403 0.380 0.470 0.035  0.008  0.018  181 TYR LLL CA   
5920 C C    . TYR C 181 ? 0.409 0.385 0.467 0.039  0.017  0.020  181 TYR LLL C    
5921 O O    . TYR C 181 ? 0.418 0.397 0.482 0.041  0.026  0.022  181 TYR LLL O    
5922 C CB   . TYR C 181 ? 0.405 0.385 0.495 0.036  0.009  0.017  181 TYR LLL CB   
5923 C CG   . TYR C 181 ? 0.411 0.388 0.509 0.033  -0.003 0.014  181 TYR LLL CG   
5924 C CD1  . TYR C 181 ? 0.417 0.394 0.518 0.030  -0.006 0.014  181 TYR LLL CD1  
5925 C CD2  . TYR C 181 ? 0.419 0.391 0.520 0.034  -0.012 0.011  181 TYR LLL CD2  
5926 C CE1  . TYR C 181 ? 0.425 0.395 0.529 0.029  -0.019 0.011  181 TYR LLL CE1  
5927 C CE2  . TYR C 181 ? 0.423 0.389 0.528 0.032  -0.025 0.008  181 TYR LLL CE2  
5928 C CZ   . TYR C 181 ? 0.425 0.389 0.530 0.030  -0.028 0.008  181 TYR LLL CZ   
5929 O OH   . TYR C 181 ? 0.433 0.385 0.537 0.030  -0.042 0.005  181 TYR LLL OH   
5930 H H    . TYR C 181 ? 0.395 0.374 0.461 0.030  0.010  0.020  181 TYR LLL H    
5931 H HA   . TYR C 181 ? 0.406 0.379 0.466 0.034  0.002  0.016  181 TYR LLL HA   
5932 H HB2  . TYR C 181 ? 0.404 0.387 0.501 0.037  0.015  0.018  181 TYR LLL HB2  
5933 H HB3  . TYR C 181 ? 0.409 0.388 0.502 0.039  0.011  0.016  181 TYR LLL HB3  
5934 H HD1  . TYR C 181 ? 0.412 0.392 0.512 0.029  -0.000 0.016  181 TYR LLL HD1  
5935 H HD2  . TYR C 181 ? 0.420 0.392 0.519 0.036  -0.010 0.011  181 TYR LLL HD2  
5936 H HE1  . TYR C 181 ? 0.422 0.391 0.527 0.027  -0.021 0.011  181 TYR LLL HE1  
5937 H HE2  . TYR C 181 ? 0.428 0.389 0.534 0.033  -0.032 0.006  181 TYR LLL HE2  
5939 N N    . LEU C 182 ? 0.413 0.383 0.456 0.042  0.015  0.019  182 LEU LLL N    
5940 C CA   . LEU C 182 ? 0.421 0.386 0.452 0.048  0.022  0.020  182 LEU LLL CA   
5941 C C    . LEU C 182 ? 0.427 0.389 0.464 0.054  0.028  0.020  182 LEU LLL C    
5942 O O    . LEU C 182 ? 0.424 0.385 0.461 0.054  0.022  0.017  182 LEU LLL O    
5943 C CB   . LEU C 182 ? 0.427 0.386 0.440 0.049  0.015  0.018  182 LEU LLL CB   
5944 C CG   . LEU C 182 ? 0.446 0.395 0.442 0.056  0.019  0.019  182 LEU LLL CG   
5945 C CD1  . LEU C 182 ? 0.451 0.399 0.443 0.057  0.025  0.021  182 LEU LLL CD1  
5946 C CD2  . LEU C 182 ? 0.452 0.395 0.436 0.057  0.008  0.016  182 LEU LLL CD2  
5947 H H    . LEU C 182 ? 0.413 0.382 0.452 0.040  0.009  0.018  182 LEU LLL H    
5948 H HA   . LEU C 182 ? 0.422 0.387 0.453 0.049  0.028  0.022  182 LEU LLL HA   
5949 H HB2  . LEU C 182 ? 0.422 0.384 0.436 0.045  0.012  0.019  182 LEU LLL HB2  
5950 H HB3  . LEU C 182 ? 0.428 0.386 0.441 0.048  0.010  0.017  182 LEU LLL HB3  
5951 H HG   . LEU C 182 ? 0.453 0.398 0.447 0.061  0.024  0.019  182 LEU LLL HG   
5952 H HD11 . LEU C 182 ? 0.449 0.399 0.449 0.058  0.033  0.023  182 LEU LLL HD11 
5953 H HD12 . LEU C 182 ? 0.462 0.401 0.440 0.062  0.025  0.021  182 LEU LLL HD12 
5954 H HD13 . LEU C 182 ? 0.442 0.395 0.438 0.053  0.021  0.021  182 LEU LLL HD13 
5955 H HD21 . LEU C 182 ? 0.446 0.392 0.432 0.053  0.004  0.016  182 LEU LLL HD21 
5956 H HD22 . LEU C 182 ? 0.464 0.398 0.435 0.063  0.009  0.015  182 LEU LLL HD22 
5957 H HD23 . LEU C 182 ? 0.451 0.394 0.437 0.056  0.004  0.015  182 LEU LLL HD23 
5958 N N    . THR C 183 ? 0.435 0.395 0.476 0.059  0.041  0.022  183 THR LLL N    
5959 C CA   . THR C 183 ? 0.444 0.400 0.493 0.065  0.051  0.022  183 THR LLL CA   
5960 C C    . THR C 183 ? 0.463 0.405 0.486 0.073  0.060  0.024  183 THR LLL C    
5961 O O    . THR C 183 ? 0.472 0.407 0.482 0.076  0.067  0.026  183 THR LLL O    
5962 C CB   . THR C 183 ? 0.438 0.401 0.515 0.064  0.061  0.024  183 THR LLL CB   
5963 O OG1  . THR C 183 ? 0.418 0.391 0.514 0.056  0.049  0.022  183 THR LLL OG1  
5964 C CG2  . THR C 183 ? 0.449 0.410 0.542 0.069  0.072  0.024  183 THR LLL CG2  
5965 H H    . THR C 183 ? 0.435 0.395 0.475 0.058  0.046  0.024  183 THR LLL H    
5966 H HA   . THR C 183 ? 0.442 0.399 0.494 0.064  0.045  0.020  183 THR LLL HA   
5967 H HB   . THR C 183 ? 0.440 0.402 0.514 0.064  0.068  0.026  183 THR LLL HB   
5969 H HG21 . THR C 183 ? 0.462 0.413 0.541 0.074  0.083  0.026  183 THR LLL HG21 
5970 H HG22 . THR C 183 ? 0.443 0.409 0.559 0.067  0.075  0.024  183 THR LLL HG22 
5971 H HG23 . THR C 183 ? 0.449 0.408 0.540 0.070  0.066  0.022  183 THR LLL HG23 
5972 N N    . LEU C 184 ? 0.473 0.406 0.485 0.078  0.058  0.022  184 LEU LLL N    
5973 C CA   . LEU C 184 ? 0.497 0.412 0.480 0.088  0.064  0.022  184 LEU LLL CA   
5974 C C    . LEU C 184 ? 0.502 0.412 0.494 0.094  0.076  0.022  184 LEU LLL C    
5975 O O    . LEU C 184 ? 0.484 0.407 0.504 0.090  0.075  0.021  184 LEU LLL O    
5976 C CB   . LEU C 184 ? 0.505 0.413 0.467 0.089  0.048  0.019  184 LEU LLL CB   
5977 C CG   . LEU C 184 ? 0.490 0.409 0.457 0.080  0.034  0.017  184 LEU LLL CG   
5978 C CD1  . LEU C 184 ? 0.489 0.405 0.448 0.079  0.019  0.013  184 LEU LLL CD1  
5979 C CD2  . LEU C 184 ? 0.498 0.413 0.454 0.080  0.035  0.019  184 LEU LLL CD2  
5980 H H    . LEU C 184 ? 0.467 0.405 0.488 0.076  0.052  0.020  184 LEU LLL H    
5981 H HA   . LEU C 184 ? 0.505 0.414 0.479 0.091  0.071  0.024  184 LEU LLL HA   
5982 H HB2  . LEU C 184 ? 0.504 0.413 0.471 0.089  0.045  0.017  184 LEU LLL HB2  
5983 H HB3  . LEU C 184 ? 0.521 0.417 0.463 0.095  0.050  0.019  184 LEU LLL HB3  
5984 H HG   . LEU C 184 ? 0.476 0.406 0.462 0.074  0.033  0.017  184 LEU LLL HG   
5985 H HD11 . LEU C 184 ? 0.487 0.406 0.453 0.078  0.018  0.012  184 LEU LLL HD11 
5986 H HD12 . LEU C 184 ? 0.480 0.402 0.443 0.074  0.012  0.013  184 LEU LLL HD12 
5987 H HD13 . LEU C 184 ? 0.505 0.409 0.446 0.085  0.018  0.012  184 LEU LLL HD13 
5988 H HD21 . LEU C 184 ? 0.514 0.415 0.450 0.087  0.035  0.018  184 LEU LLL HD21 
5989 H HD22 . LEU C 184 ? 0.487 0.408 0.446 0.075  0.026  0.018  184 LEU LLL HD22 
5990 H HD23 . LEU C 184 ? 0.494 0.413 0.458 0.080  0.043  0.021  184 LEU LLL HD23 
5991 N N    . THR C 185 ? 0.527 0.417 0.492 0.104  0.086  0.023  185 THR LLL N    
5992 C CA   . THR C 185 ? 0.544 0.425 0.510 0.111  0.096  0.023  185 THR LLL CA   
5993 C C    . THR C 185 ? 0.547 0.428 0.504 0.110  0.078  0.018  185 THR LLL C    
5994 O O    . THR C 185 ? 0.525 0.410 0.473 0.106  0.062  0.016  185 THR LLL O    
5995 C CB   . THR C 185 ? 0.579 0.435 0.515 0.123  0.114  0.026  185 THR LLL CB   
5996 O OG1  . THR C 185 ? 0.599 0.439 0.496 0.128  0.102  0.024  185 THR LLL OG1  
5997 C CG2  . THR C 185 ? 0.581 0.436 0.526 0.124  0.133  0.031  185 THR LLL CG2  
5998 H H    . THR C 185 ? 0.541 0.420 0.485 0.108  0.088  0.025  185 THR LLL H    
5999 H HA   . THR C 185 ? 0.535 0.426 0.528 0.108  0.102  0.023  185 THR LLL HA   
6000 H HB   . THR C 185 ? 0.589 0.439 0.526 0.128  0.122  0.026  185 THR LLL HB   
6002 H HG21 . THR C 185 ? 0.566 0.435 0.543 0.119  0.137  0.032  185 THR LLL HG21 
6003 H HG22 . THR C 185 ? 0.606 0.443 0.534 0.132  0.147  0.033  185 THR LLL HG22 
6004 H HG23 . THR C 185 ? 0.577 0.434 0.514 0.121  0.126  0.032  185 THR LLL HG23 
6005 N N    . ALA C 186 ? 0.562 0.441 0.526 0.114  0.083  0.016  186 ALA LLL N    
6006 C CA   . ALA C 186 ? 0.574 0.449 0.527 0.116  0.068  0.012  186 ALA LLL CA   
6007 C C    . ALA C 186 ? 0.608 0.461 0.518 0.124  0.063  0.011  186 ALA LLL C    
6008 O O    . ALA C 186 ? 0.606 0.459 0.507 0.122  0.045  0.008  186 ALA LLL O    
6009 C CB   . ALA C 186 ? 0.578 0.452 0.545 0.120  0.076  0.011  186 ALA LLL CB   
6010 H H    . ALA C 186 ? 0.566 0.445 0.544 0.117  0.095  0.018  186 ALA LLL H    
6011 H HA   . ALA C 186 ? 0.556 0.443 0.519 0.108  0.055  0.011  186 ALA LLL HA   
6012 H HB1  . ALA C 186 ? 0.581 0.452 0.539 0.121  0.067  0.008  186 ALA LLL HB1  
6013 H HB2  . ALA C 186 ? 0.562 0.451 0.558 0.114  0.076  0.011  186 ALA LLL HB2  
6014 H HB3  . ALA C 186 ? 0.596 0.459 0.555 0.127  0.091  0.013  186 ALA LLL HB3  
6015 N N    . ARG C 187 ? 0.648 0.481 0.535 0.134  0.079  0.014  187 ARG LLL N    
6016 C CA   . ARG C 187 ? 0.694 0.498 0.536 0.145  0.075  0.013  187 ARG LLL CA   
6017 C C    . ARG C 187 ? 0.679 0.485 0.510 0.141  0.059  0.012  187 ARG LLL C    
6018 O O    . ARG C 187 ? 0.694 0.485 0.500 0.146  0.043  0.008  187 ARG LLL O    
6019 C CB   . ARG C 187 ? 0.745 0.524 0.562 0.158  0.099  0.016  187 ARG LLL CB   
6020 C CG   . ARG C 187 ? 0.784 0.547 0.589 0.167  0.106  0.015  187 ARG LLL CG   
6021 C CD   . ARG C 187 ? 0.830 0.575 0.628 0.177  0.137  0.020  187 ARG LLL CD   
6022 N NE   . ARG C 187 ? 0.829 0.592 0.670 0.173  0.150  0.020  187 ARG LLL NE   
6023 C CZ   . ARG C 187 ? 0.841 0.599 0.696 0.177  0.177  0.025  187 ARG LLL CZ   
6024 N NH1  . ARG C 187 ? 0.876 0.610 0.704 0.186  0.198  0.030  187 ARG LLL NH1  
6025 N NH2  . ARG C 187 ? 0.817 0.594 0.717 0.172  0.185  0.024  187 ARG LLL NH2  
6026 H H    . ARG C 187 ? 0.651 0.484 0.547 0.135  0.094  0.017  187 ARG LLL H    
6027 H HA   . ARG C 187 ? 0.696 0.497 0.532 0.147  0.066  0.010  187 ARG LLL HA   
6028 H HB2  . ARG C 187 ? 0.737 0.525 0.574 0.155  0.112  0.020  187 ARG LLL HB2  
6029 H HB3  . ARG C 187 ? 0.764 0.526 0.553 0.163  0.096  0.017  187 ARG LLL HB3  
6030 H HG2  . ARG C 187 ? 0.803 0.549 0.579 0.174  0.097  0.012  187 ARG LLL HG2  
6031 H HG3  . ARG C 187 ? 0.765 0.544 0.594 0.162  0.101  0.013  187 ARG LLL HG3  
6032 H HD2  . ARG C 187 ? 0.833 0.575 0.628 0.177  0.145  0.023  187 ARG LLL HD2  
6033 H HD3  . ARG C 187 ? 0.860 0.581 0.625 0.187  0.139  0.019  187 ARG LLL HD3  
6034 H HE   . ARG C 187 ? 0.805 0.584 0.665 0.167  0.138  0.018  187 ARG LLL HE   
6035 H HH11 . ARG C 187 ? 0.889 0.608 0.686 0.189  0.192  0.030  187 ARG LLL HH11 
6036 H HH12 . ARG C 187 ? 0.884 0.613 0.722 0.189  0.217  0.033  187 ARG LLL HH12 
6037 H HH21 . ARG C 187 ? 0.799 0.591 0.716 0.167  0.171  0.021  187 ARG LLL HH21 
6038 H HH22 . ARG C 187 ? 0.827 0.600 0.740 0.175  0.204  0.027  187 ARG LLL HH22 
6039 N N    . ALA C 188 ? 0.648 0.471 0.501 0.132  0.062  0.014  188 ALA LLL N    
6040 C CA   . ALA C 188 ? 0.631 0.460 0.481 0.127  0.047  0.013  188 ALA LLL CA   
6041 C C    . ALA C 188 ? 0.604 0.449 0.472 0.118  0.028  0.009  188 ALA LLL C    
6042 O O    . ALA C 188 ? 0.610 0.450 0.466 0.118  0.012  0.006  188 ALA LLL O    
6043 C CB   . ALA C 188 ? 0.614 0.456 0.483 0.121  0.057  0.018  188 ALA LLL CB   
6044 H H    . ALA C 188 ? 0.640 0.472 0.511 0.130  0.073  0.017  188 ALA LLL H    
6045 H HA   . ALA C 188 ? 0.652 0.463 0.476 0.134  0.044  0.012  188 ALA LLL HA   
6046 H HB1  . ALA C 188 ? 0.608 0.453 0.475 0.117  0.048  0.017  188 ALA LLL HB1  
6047 H HB2  . ALA C 188 ? 0.632 0.461 0.489 0.127  0.070  0.020  188 ALA LLL HB2  
6048 H HB3  . ALA C 188 ? 0.596 0.454 0.490 0.114  0.060  0.018  188 ALA LLL HB3  
6049 N N    . TRP C 189 ? 0.575 0.438 0.471 0.110  0.028  0.009  189 TRP LLL N    
6050 C CA   . TRP C 189 ? 0.554 0.430 0.464 0.102  0.012  0.006  189 TRP LLL CA   
6051 C C    . TRP C 189 ? 0.572 0.434 0.463 0.108  -0.000 0.002  189 TRP LLL C    
6052 O O    . TRP C 189 ? 0.569 0.432 0.459 0.104  -0.015 -0.000 189 TRP LLL O    
6053 C CB   . TRP C 189 ? 0.537 0.428 0.475 0.096  0.016  0.007  189 TRP LLL CB   
6054 C CG   . TRP C 189 ? 0.524 0.422 0.470 0.091  0.002  0.004  189 TRP LLL CG   
6055 C CD1  . TRP C 189 ? 0.531 0.425 0.477 0.094  -0.001 0.001  189 TRP LLL CD1  
6056 C CD2  . TRP C 189 ? 0.506 0.414 0.462 0.082  -0.010 0.003  189 TRP LLL CD2  
6057 N NE1  . TRP C 189 ? 0.518 0.419 0.472 0.087  -0.015 -0.001 189 TRP LLL NE1  
6058 C CE2  . TRP C 189 ? 0.505 0.413 0.464 0.080  -0.020 0.000  189 TRP LLL CE2  
6059 C CE3  . TRP C 189 ? 0.497 0.411 0.457 0.076  -0.013 0.004  189 TRP LLL CE3  
6060 C CZ2  . TRP C 189 ? 0.494 0.408 0.461 0.072  -0.030 -0.000 189 TRP LLL CZ2  
6061 C CZ3  . TRP C 189 ? 0.487 0.406 0.455 0.068  -0.022 0.003  189 TRP LLL CZ3  
6062 C CH2  . TRP C 189 ? 0.488 0.407 0.459 0.066  -0.030 0.001  189 TRP LLL CH2  
6063 H H    . TRP C 189 ? 0.574 0.441 0.481 0.110  0.039  0.011  189 TRP LLL H    
6064 H HA   . TRP C 189 ? 0.544 0.427 0.460 0.097  0.007  0.006  189 TRP LLL HA   
6065 H HB2  . TRP C 189 ? 0.524 0.426 0.476 0.091  0.019  0.009  189 TRP LLL HB2  
6066 H HB3  . TRP C 189 ? 0.546 0.432 0.483 0.102  0.025  0.007  189 TRP LLL HB3  
6067 H HD1  . TRP C 189 ? 0.541 0.429 0.483 0.100  0.005  0.001  189 TRP LLL HD1  
6068 H HE1  . TRP C 189 ? 0.519 0.419 0.475 0.087  -0.019 -0.002 189 TRP LLL HE1  
6069 H HE3  . TRP C 189 ? 0.499 0.412 0.456 0.077  -0.007 0.006  189 TRP LLL HE3  
6070 H HZ2  . TRP C 189 ? 0.495 0.407 0.463 0.071  -0.036 -0.002 189 TRP LLL HZ2  
6071 H HZ3  . TRP C 189 ? 0.481 0.404 0.452 0.064  -0.023 0.004  189 TRP LLL HZ3  
6072 H HH2  . TRP C 189 ? 0.481 0.402 0.456 0.061  -0.035 0.001  189 TRP LLL HH2  
6073 N N    . GLU C 190 ? 0.593 0.440 0.468 0.118  0.007  0.001  190 GLU LLL N    
6074 C CA   . GLU C 190 ? 0.614 0.443 0.466 0.125  -0.005 -0.003 190 GLU LLL CA   
6075 C C    . GLU C 190 ? 0.634 0.445 0.459 0.132  -0.015 -0.005 190 GLU LLL C    
6076 O O    . GLU C 190 ? 0.653 0.453 0.467 0.136  -0.031 -0.010 190 GLU LLL O    
6077 C CB   . GLU C 190 ? 0.636 0.452 0.476 0.135  0.008  -0.003 190 GLU LLL CB   
6078 C CG   . GLU C 190 ? 0.620 0.453 0.488 0.129  0.011  -0.003 190 GLU LLL CG   
6079 C CD   . GLU C 190 ? 0.629 0.459 0.504 0.134  0.032  -0.000 190 GLU LLL CD   
6080 O OE1  . GLU C 190 ? 0.663 0.472 0.512 0.145  0.045  0.001  190 GLU LLL OE1  
6081 O OE2  . GLU C 190 ? 0.602 0.451 0.509 0.127  0.036  0.001  190 GLU LLL OE2  
6082 H H    . GLU C 190 ? 0.598 0.443 0.475 0.121  0.019  0.003  190 GLU LLL H    
6083 H HA   . GLU C 190 ? 0.600 0.439 0.466 0.120  -0.015 -0.005 190 GLU LLL HA   
6084 H HB2  . GLU C 190 ? 0.646 0.456 0.480 0.139  0.021  0.000  190 GLU LLL HB2  
6085 H HB3  . GLU C 190 ? 0.655 0.455 0.474 0.142  0.001  -0.005 190 GLU LLL HB3  
6086 H HG2  . GLU C 190 ? 0.624 0.452 0.486 0.131  0.002  -0.006 190 GLU LLL HG2  
6087 H HG3  . GLU C 190 ? 0.598 0.447 0.486 0.121  0.007  -0.002 190 GLU LLL HG3  
6088 N N    . ARG C 191 ? 0.636 0.441 0.451 0.134  -0.007 -0.002 191 ARG LLL N    
6089 C CA   . ARG C 191 ? 0.658 0.441 0.444 0.142  -0.017 -0.005 191 ARG LLL CA   
6090 C C    . ARG C 191 ? 0.633 0.426 0.435 0.134  -0.037 -0.008 191 ARG LLL C    
6091 O O    . ARG C 191 ? 0.640 0.418 0.428 0.140  -0.054 -0.013 191 ARG LLL O    
6092 C CB   . ARG C 191 ? 0.673 0.448 0.446 0.146  -0.003 -0.000 191 ARG LLL CB   
6093 C CG   . ARG C 191 ? 0.711 0.458 0.449 0.156  -0.013 -0.003 191 ARG LLL CG   
6094 C CD   . ARG C 191 ? 0.759 0.474 0.460 0.170  -0.019 -0.007 191 ARG LLL CD   
6095 N NE   . ARG C 191 ? 0.787 0.488 0.471 0.179  0.003  -0.003 191 ARG LLL NE   
6096 C CZ   . ARG C 191 ? 0.824 0.501 0.477 0.189  0.020  0.001  191 ARG LLL CZ   
6097 N NH1  . ARG C 191 ? 0.842 0.505 0.476 0.192  0.016  0.001  191 ARG LLL NH1  
6098 N NH2  . ARG C 191 ? 0.840 0.505 0.481 0.196  0.041  0.004  191 ARG LLL NH2  
6099 H H    . ARG C 191 ? 0.628 0.441 0.454 0.131  0.004  0.001  191 ARG LLL H    
6100 H HA   . ARG C 191 ? 0.681 0.445 0.445 0.151  -0.021 -0.007 191 ARG LLL HA   
6101 H HB2  . ARG C 191 ? 0.684 0.453 0.451 0.150  0.012  0.002  191 ARG LLL HB2  
6102 H HB3  . ARG C 191 ? 0.651 0.444 0.446 0.137  -0.001 0.002  191 ARG LLL HB3  
6103 H HG2  . ARG C 191 ? 0.721 0.461 0.449 0.159  -0.002 0.001  191 ARG LLL HG2  
6104 H HG3  . ARG C 191 ? 0.701 0.454 0.449 0.152  -0.027 -0.005 191 ARG LLL HG3  
6105 H HD2  . ARG C 191 ? 0.781 0.476 0.459 0.177  -0.028 -0.009 191 ARG LLL HD2  
6106 H HD3  . ARG C 191 ? 0.750 0.471 0.461 0.168  -0.031 -0.010 191 ARG LLL HD3  
6107 H HE   . ARG C 191 ? 0.779 0.488 0.473 0.177  0.006  -0.003 191 ARG LLL HE   
6108 H HH11 . ARG C 191 ? 0.828 0.499 0.472 0.188  0.002  -0.001 191 ARG LLL HH11 
6109 H HH12 . ARG C 191 ? 0.863 0.509 0.475 0.200  0.027  0.004  191 ARG LLL HH12 
6110 H HH21 . ARG C 191 ? 0.831 0.505 0.486 0.194  0.044  0.004  191 ARG LLL HH21 
6111 H HH22 . ARG C 191 ? 0.864 0.511 0.484 0.203  0.054  0.007  191 ARG LLL HH22 
6112 N N    . HIS C 192 ? 0.592 0.411 0.425 0.122  -0.035 -0.006 192 HIS LLL N    
6113 C CA   . HIS C 192 ? 0.570 0.400 0.422 0.113  -0.048 -0.008 192 HIS LLL CA   
6114 C C    . HIS C 192 ? 0.554 0.399 0.430 0.105  -0.057 -0.009 192 HIS LLL C    
6115 O O    . HIS C 192 ? 0.540 0.391 0.421 0.103  -0.050 -0.008 192 HIS LLL O    
6116 C CB   . HIS C 192 ? 0.544 0.388 0.410 0.107  -0.039 -0.004 192 HIS LLL CB   
6117 C CG   . HIS C 192 ? 0.556 0.384 0.398 0.115  -0.030 -0.001 192 HIS LLL CG   
6118 N ND1  . HIS C 192 ? 0.558 0.386 0.395 0.118  -0.011 0.003  192 HIS LLL ND1  
6119 C CD2  . HIS C 192 ? 0.571 0.382 0.393 0.122  -0.036 -0.003 192 HIS LLL CD2  
6120 C CE1  . HIS C 192 ? 0.577 0.387 0.390 0.126  -0.004 0.005  192 HIS LLL CE1  
6121 N NE2  . HIS C 192 ? 0.587 0.386 0.389 0.128  -0.021 0.001  192 HIS LLL NE2  
6122 H H    . HIS C 192 ? 0.581 0.411 0.426 0.118  -0.024 -0.003 192 HIS LLL H    
6123 H HA   . HIS C 192 ? 0.586 0.402 0.424 0.119  -0.059 -0.011 192 HIS LLL HA   
6124 H HB2  . HIS C 192 ? 0.528 0.386 0.408 0.101  -0.031 -0.001 192 HIS LLL HB2  
6125 H HB3  . HIS C 192 ? 0.535 0.384 0.412 0.102  -0.047 -0.005 192 HIS LLL HB3  
6127 H HD2  . HIS C 192 ? 0.574 0.382 0.397 0.122  -0.049 -0.006 192 HIS LLL HD2  
6128 H HE1  . HIS C 192 ? 0.586 0.391 0.393 0.129  0.009  0.008  192 HIS LLL HE1  
6130 N N    . SER C 193 ? 0.553 0.400 0.442 0.100  -0.071 -0.012 193 SER LLL N    
6131 C CA   . SER C 193 ? 0.544 0.399 0.452 0.094  -0.081 -0.015 193 SER LLL CA   
6132 C C    . SER C 193 ? 0.523 0.399 0.459 0.081  -0.076 -0.012 193 SER LLL C    
6133 O O    . SER C 193 ? 0.521 0.405 0.468 0.075  -0.074 -0.011 193 SER LLL O    
6134 C CB   . SER C 193 ? 0.557 0.398 0.464 0.098  -0.099 -0.021 193 SER LLL CB   
6135 O OG   . SER C 193 ? 0.586 0.404 0.462 0.111  -0.106 -0.024 193 SER LLL OG   
6136 H H    . SER C 193 ? 0.554 0.399 0.444 0.100  -0.074 -0.013 193 SER LLL H    
6137 H HA   . SER C 193 ? 0.547 0.401 0.451 0.096  -0.079 -0.015 193 SER LLL HA   
6138 H HB2  . SER C 193 ? 0.553 0.397 0.468 0.095  -0.102 -0.021 193 SER LLL HB2  
6139 H HB3  . SER C 193 ? 0.550 0.396 0.471 0.094  -0.105 -0.022 193 SER LLL HB3  
6141 N N    . SER C 194 ? 0.519 0.401 0.464 0.077  -0.073 -0.010 194 SER LLL N    
6142 C CA   . SER C 194 ? 0.510 0.407 0.479 0.065  -0.069 -0.008 194 SER LLL CA   
6143 C C    . SER C 194 ? 0.497 0.403 0.467 0.062  -0.057 -0.004 194 SER LLL C    
6144 O O    . SER C 194 ? 0.499 0.400 0.459 0.067  -0.056 -0.004 194 SER LLL O    
6145 C CB   . SER C 194 ? 0.520 0.415 0.505 0.063  -0.080 -0.011 194 SER LLL CB   
6146 O OG   . SER C 194 ? 0.541 0.434 0.536 0.061  -0.088 -0.014 194 SER LLL OG   
6147 H H    . SER C 194 ? 0.529 0.405 0.464 0.081  -0.073 -0.011 194 SER LLL H    
6148 H HA   . SER C 194 ? 0.503 0.404 0.477 0.062  -0.068 -0.007 194 SER LLL HA   
6149 H HB2  . SER C 194 ? 0.534 0.420 0.510 0.069  -0.087 -0.014 194 SER LLL HB2  
6150 H HB3  . SER C 194 ? 0.511 0.414 0.509 0.057  -0.076 -0.009 194 SER LLL HB3  
6152 N N    . TYR C 195 ? 0.482 0.400 0.463 0.054  -0.049 -0.001 195 TYR LLL N    
6153 C CA   . TYR C 195 ? 0.476 0.403 0.461 0.050  -0.039 0.003  195 TYR LLL CA   
6154 C C    . TYR C 195 ? 0.466 0.401 0.467 0.041  -0.037 0.005  195 TYR LLL C    
6155 O O    . TYR C 195 ? 0.450 0.385 0.457 0.037  -0.038 0.005  195 TYR LLL O    
6156 C CB   . TYR C 195 ? 0.475 0.405 0.456 0.052  -0.031 0.005  195 TYR LLL CB   
6157 C CG   . TYR C 195 ? 0.491 0.412 0.456 0.061  -0.030 0.004  195 TYR LLL CG   
6158 C CD1  . TYR C 195 ? 0.506 0.419 0.465 0.065  -0.037 0.001  195 TYR LLL CD1  
6159 C CD2  . TYR C 195 ? 0.502 0.420 0.459 0.066  -0.021 0.006  195 TYR LLL CD2  
6160 C CE1  . TYR C 195 ? 0.525 0.426 0.466 0.075  -0.035 0.000  195 TYR LLL CE1  
6161 C CE2  . TYR C 195 ? 0.520 0.427 0.461 0.075  -0.017 0.006  195 TYR LLL CE2  
6162 C CZ   . TYR C 195 ? 0.533 0.431 0.465 0.080  -0.024 0.003  195 TYR LLL CZ   
6163 O OH   . TYR C 195 ? 0.551 0.435 0.465 0.090  -0.019 0.002  195 TYR LLL OH   
6164 H H    . TYR C 195 ? 0.479 0.399 0.467 0.051  -0.051 -0.001 195 TYR LLL H    
6165 H HA   . TYR C 195 ? 0.480 0.405 0.459 0.054  -0.037 0.003  195 TYR LLL HA   
6166 H HB2  . TYR C 195 ? 0.472 0.403 0.457 0.048  -0.033 0.005  195 TYR LLL HB2  
6167 H HB3  . TYR C 195 ? 0.469 0.404 0.453 0.049  -0.025 0.007  195 TYR LLL HB3  
6168 H HD1  . TYR C 195 ? 0.502 0.416 0.467 0.062  -0.043 0.000  195 TYR LLL HD1  
6169 H HD2  . TYR C 195 ? 0.495 0.418 0.457 0.063  -0.017 0.008  195 TYR LLL HD2  
6170 H HE1  . TYR C 195 ? 0.532 0.427 0.468 0.078  -0.040 -0.002 195 TYR LLL HE1  
6171 H HE2  . TYR C 195 ? 0.526 0.430 0.461 0.079  -0.009 0.007  195 TYR LLL HE2  
6173 N N    . SER C 196 ? 0.475 0.413 0.480 0.039  -0.033 0.006  196 SER LLL N    
6174 C CA   . SER C 196 ? 0.470 0.415 0.489 0.031  -0.029 0.008  196 SER LLL CA   
6175 C C    . SER C 196 ? 0.465 0.415 0.481 0.029  -0.020 0.011  196 SER LLL C    
6176 O O    . SER C 196 ? 0.462 0.413 0.472 0.033  -0.017 0.011  196 SER LLL O    
6177 C CB   . SER C 196 ? 0.473 0.417 0.503 0.031  -0.033 0.005  196 SER LLL CB   
6178 O OG   . SER C 196 ? 0.479 0.423 0.525 0.024  -0.032 0.006  196 SER LLL OG   
6179 H H    . SER C 196 ? 0.476 0.413 0.476 0.043  -0.032 0.006  196 SER LLL H    
6180 H HA   . SER C 196 ? 0.469 0.413 0.491 0.028  -0.029 0.008  196 SER LLL HA   
6181 H HB2  . SER C 196 ? 0.482 0.420 0.509 0.035  -0.040 0.003  196 SER LLL HB2  
6182 H HB3  . SER C 196 ? 0.472 0.419 0.502 0.031  -0.030 0.006  196 SER LLL HB3  
6184 N N    . CYS C 197 ? 0.470 0.422 0.491 0.023  -0.016 0.013  197 CYS LLL N    
6185 C CA   . CYS C 197 ? 0.477 0.433 0.497 0.020  -0.009 0.015  197 CYS LLL CA   
6186 C C    . CYS C 197 ? 0.472 0.427 0.500 0.014  -0.005 0.016  197 CYS LLL C    
6187 O O    . CYS C 197 ? 0.476 0.426 0.506 0.011  -0.004 0.016  197 CYS LLL O    
6188 C CB   . CYS C 197 ? 0.487 0.440 0.502 0.018  -0.008 0.016  197 CYS LLL CB   
6189 S SG   . CYS C 197 ? 0.510 0.465 0.524 0.015  -0.003 0.018  197 CYS LLL SG   
6190 H H    . CYS C 197 ? 0.472 0.421 0.494 0.021  -0.017 0.013  197 CYS LLL H    
6191 H HA   . CYS C 197 ? 0.473 0.433 0.493 0.022  -0.007 0.015  197 CYS LLL HA   
6192 H HB2  . CYS C 197 ? 0.491 0.446 0.505 0.022  -0.010 0.016  197 CYS LLL HB2  
6193 H HB3  . CYS C 197 ? 0.494 0.443 0.508 0.016  -0.009 0.016  197 CYS LLL HB3  
6194 N N    . GLN C 198 ? 0.468 0.428 0.502 0.014  -0.003 0.016  198 GLN LLL N    
6195 C CA   . GLN C 198 ? 0.470 0.430 0.514 0.009  0.003  0.017  198 GLN LLL CA   
6196 C C    . GLN C 198 ? 0.455 0.416 0.494 0.007  0.009  0.019  198 GLN LLL C    
6197 O O    . GLN C 198 ? 0.451 0.417 0.488 0.009  0.009  0.020  198 GLN LLL O    
6198 C CB   . GLN C 198 ? 0.485 0.448 0.539 0.011  -0.001 0.015  198 GLN LLL CB   
6199 C CG   . GLN C 198 ? 0.509 0.469 0.573 0.014  -0.009 0.011  198 GLN LLL CG   
6200 C CD   . GLN C 198 ? 0.526 0.485 0.592 0.019  -0.017 0.008  198 GLN LLL CD   
6201 O OE1  . GLN C 198 ? 0.548 0.507 0.601 0.023  -0.018 0.009  198 GLN LLL OE1  
6202 N NE2  . GLN C 198 ? 0.526 0.484 0.611 0.018  -0.023 0.005  198 GLN LLL NE2  
6203 H H    . GLN C 198 ? 0.468 0.430 0.500 0.017  -0.003 0.016  198 GLN LLL H    
6204 H HA   . GLN C 198 ? 0.473 0.429 0.521 0.007  0.004  0.017  198 GLN LLL HA   
6205 H HB2  . GLN C 198 ? 0.484 0.450 0.533 0.015  -0.002 0.015  198 GLN LLL HB2  
6206 H HB3  . GLN C 198 ? 0.483 0.448 0.546 0.008  0.003  0.015  198 GLN LLL HB3  
6207 H HG2  . GLN C 198 ? 0.508 0.467 0.583 0.010  -0.007 0.011  198 GLN LLL HG2  
6208 H HG3  . GLN C 198 ? 0.511 0.468 0.566 0.016  -0.012 0.011  198 GLN LLL HG3  
6211 N N    . VAL C 199 ? 0.450 0.404 0.485 0.003  0.015  0.021  199 VAL LLL N    
6212 C CA   . VAL C 199 ? 0.449 0.399 0.475 0.001  0.020  0.023  199 VAL LLL CA   
6213 C C    . VAL C 199 ? 0.452 0.399 0.485 -0.003 0.028  0.024  199 VAL LLL C    
6214 O O    . VAL C 199 ? 0.462 0.401 0.497 -0.005 0.034  0.025  199 VAL LLL O    
6215 C CB   . VAL C 199 ? 0.458 0.397 0.469 0.001  0.019  0.024  199 VAL LLL CB   
6216 C CG1  . VAL C 199 ? 0.463 0.395 0.463 0.000  0.021  0.025  199 VAL LLL CG1  
6217 C CG2  . VAL C 199 ? 0.457 0.398 0.465 0.004  0.011  0.022  199 VAL LLL CG2  
6218 H H    . VAL C 199 ? 0.456 0.405 0.493 0.001  0.016  0.021  199 VAL LLL H    
6219 H HA   . VAL C 199 ? 0.444 0.400 0.471 0.003  0.018  0.023  199 VAL LLL HA   
6220 H HB   . VAL C 199 ? 0.465 0.397 0.475 -0.001 0.022  0.024  199 VAL LLL HB   
6221 H HG11 . VAL C 199 ? 0.468 0.395 0.467 -0.002 0.028  0.026  199 VAL LLL HG11 
6222 H HG12 . VAL C 199 ? 0.471 0.395 0.461 0.001  0.018  0.025  199 VAL LLL HG12 
6223 H HG13 . VAL C 199 ? 0.455 0.396 0.460 0.002  0.020  0.024  199 VAL LLL HG13 
6224 H HG21 . VAL C 199 ? 0.450 0.399 0.462 0.006  0.009  0.022  199 VAL LLL HG21 
6225 H HG22 . VAL C 199 ? 0.464 0.398 0.463 0.004  0.009  0.023  199 VAL LLL HG22 
6226 H HG23 . VAL C 199 ? 0.456 0.399 0.468 0.005  0.009  0.022  199 VAL LLL HG23 
6227 N N    . THR C 200 ? 0.446 0.400 0.485 -0.002 0.030  0.024  200 THR LLL N    
6228 C CA   . THR C 200 ? 0.452 0.405 0.500 -0.005 0.039  0.024  200 THR LLL CA   
6229 C C    . THR C 200 ? 0.458 0.402 0.491 -0.007 0.045  0.026  200 THR LLL C    
6230 O O    . THR C 200 ? 0.442 0.388 0.467 -0.005 0.041  0.026  200 THR LLL O    
6231 C CB   . THR C 200 ? 0.440 0.405 0.503 -0.004 0.036  0.022  200 THR LLL CB   
6232 O OG1  . THR C 200 ? 0.451 0.419 0.521 -0.002 0.028  0.020  200 THR LLL OG1  
6233 C CG2  . THR C 200 ? 0.436 0.401 0.514 -0.007 0.043  0.022  200 THR LLL CG2  
6234 H H    . THR C 200 ? 0.442 0.402 0.480 -0.000 0.027  0.023  200 THR LLL H    
6235 H HA   . THR C 200 ? 0.455 0.404 0.509 -0.007 0.042  0.024  200 THR LLL HA   
6236 H HB   . THR C 200 ? 0.439 0.407 0.496 -0.003 0.034  0.023  200 THR LLL HB   
6238 H HG21 . THR C 200 ? 0.440 0.402 0.511 -0.008 0.048  0.023  200 THR LLL HG21 
6239 H HG22 . THR C 200 ? 0.432 0.403 0.520 -0.006 0.039  0.020  200 THR LLL HG22 
6240 H HG23 . THR C 200 ? 0.442 0.402 0.527 -0.009 0.047  0.022  200 THR LLL HG23 
6241 N N    . HIS C 201 ? 0.482 0.414 0.512 -0.009 0.055  0.028  201 HIS LLL N    
6242 C CA   . HIS C 201 ? 0.512 0.428 0.522 -0.009 0.062  0.030  201 HIS LLL CA   
6243 C C    . HIS C 201 ? 0.547 0.457 0.564 -0.012 0.076  0.031  201 HIS LLL C    
6244 O O    . HIS C 201 ? 0.559 0.460 0.582 -0.014 0.085  0.032  201 HIS LLL O    
6245 C CB   . HIS C 201 ? 0.525 0.424 0.512 -0.008 0.060  0.031  201 HIS LLL CB   
6246 C CG   . HIS C 201 ? 0.541 0.420 0.503 -0.007 0.065  0.032  201 HIS LLL CG   
6247 N ND1  . HIS C 201 ? 0.561 0.420 0.511 -0.008 0.079  0.034  201 HIS LLL ND1  
6248 C CD2  . HIS C 201 ? 0.546 0.418 0.491 -0.004 0.057  0.031  201 HIS LLL CD2  
6249 C CE1  . HIS C 201 ? 0.583 0.422 0.505 -0.005 0.079  0.035  201 HIS LLL CE1  
6250 N NE2  . HIS C 201 ? 0.573 0.421 0.493 -0.003 0.065  0.033  201 HIS LLL NE2  
6251 H H    . HIS C 201 ? 0.484 0.415 0.524 -0.011 0.059  0.028  201 HIS LLL H    
6252 H HA   . HIS C 201 ? 0.509 0.429 0.515 -0.008 0.058  0.029  201 HIS LLL HA   
6253 H HB2  . HIS C 201 ? 0.519 0.423 0.504 -0.006 0.051  0.030  201 HIS LLL HB2  
6254 H HB3  . HIS C 201 ? 0.530 0.424 0.520 -0.009 0.065  0.031  201 HIS LLL HB3  
6256 H HD2  . HIS C 201 ? 0.536 0.418 0.486 -0.003 0.048  0.030  201 HIS LLL HD2  
6257 H HE1  . HIS C 201 ? 0.602 0.424 0.509 -0.004 0.088  0.037  201 HIS LLL HE1  
6259 N N    . GLU C 202 ? 0.576 0.487 0.593 -0.012 0.079  0.031  202 GLU LLL N    
6260 C CA   . GLU C 202 ? 0.599 0.505 0.625 -0.014 0.093  0.032  202 GLU LLL CA   
6261 C C    . GLU C 202 ? 0.603 0.521 0.662 -0.016 0.096  0.030  202 GLU LLL C    
6262 O O    . GLU C 202 ? 0.610 0.518 0.678 -0.019 0.109  0.032  202 GLU LLL O    
6263 C CB   . GLU C 202 ? 0.630 0.510 0.630 -0.013 0.106  0.035  202 GLU LLL CB   
6264 C CG   . GLU C 202 ? 0.650 0.516 0.617 -0.010 0.099  0.035  202 GLU LLL CG   
6265 C CD   . GLU C 202 ? 0.650 0.523 0.617 -0.009 0.095  0.033  202 GLU LLL CD   
6266 O OE1  . GLU C 202 ? 0.674 0.544 0.646 -0.010 0.107  0.034  202 GLU LLL OE1  
6267 O OE2  . GLU C 202 ? 0.630 0.511 0.594 -0.007 0.082  0.032  202 GLU LLL OE2  
6268 H H    . GLU C 202 ? 0.567 0.483 0.579 -0.010 0.073  0.030  202 GLU LLL H    
6269 H HA   . GLU C 202 ? 0.593 0.506 0.621 -0.013 0.092  0.031  202 GLU LLL HA   
6270 H HB2  . GLU C 202 ? 0.638 0.511 0.636 -0.014 0.108  0.035  202 GLU LLL HB2  
6271 H HB3  . GLU C 202 ? 0.636 0.512 0.643 -0.015 0.117  0.035  202 GLU LLL HB3  
6272 H HG2  . GLU C 202 ? 0.646 0.515 0.609 -0.009 0.089  0.034  202 GLU LLL HG2  
6273 H HG3  . GLU C 202 ? 0.672 0.518 0.620 -0.009 0.107  0.037  202 GLU LLL HG3  
6274 N N    . GLY C 203 ? 0.597 0.534 0.672 -0.016 0.083  0.028  203 GLY LLL N    
6275 C CA   . GLY C 203 ? 0.591 0.539 0.698 -0.017 0.080  0.025  203 GLY LLL CA   
6276 C C    . GLY C 203 ? 0.601 0.546 0.718 -0.018 0.080  0.025  203 GLY LLL C    
6277 O O    . GLY C 203 ? 0.617 0.568 0.763 -0.019 0.078  0.022  203 GLY LLL O    
6278 H H    . GLY C 203 ? 0.589 0.531 0.656 -0.014 0.076  0.027  203 GLY LLL H    
6279 H HA2  . GLY C 203 ? 0.581 0.539 0.691 -0.015 0.071  0.023  203 GLY LLL HA2  
6280 H HA3  . GLY C 203 ? 0.593 0.540 0.712 -0.018 0.088  0.025  203 GLY LLL HA3  
6281 N N    . HIS C 204 ? 0.616 0.549 0.712 -0.017 0.082  0.027  204 HIS LLL N    
6282 C CA   . HIS C 204 ? 0.619 0.548 0.721 -0.018 0.080  0.027  204 HIS LLL CA   
6283 C C    . HIS C 204 ? 0.579 0.512 0.666 -0.015 0.066  0.026  204 HIS LLL C    
6284 O O    . HIS C 204 ? 0.560 0.489 0.622 -0.014 0.064  0.027  204 HIS LLL O    
6285 C CB   . HIS C 204 ? 0.670 0.579 0.762 -0.021 0.096  0.031  204 HIS LLL CB   
6286 C CG   . HIS C 204 ? 0.717 0.622 0.832 -0.024 0.113  0.031  204 HIS LLL CG   
6287 N ND1  . HIS C 204 ? 0.723 0.642 0.875 -0.025 0.110  0.028  204 HIS LLL ND1  
6288 C CD2  . HIS C 204 ? 0.757 0.643 0.864 -0.025 0.132  0.035  204 HIS LLL CD2  
6289 C CE1  . HIS C 204 ? 0.735 0.647 0.906 -0.028 0.128  0.030  204 HIS LLL CE1  
6290 N NE2  . HIS C 204 ? 0.758 0.649 0.900 -0.028 0.143  0.034  204 HIS LLL NE2  
6291 H H    . HIS C 204 ? 0.621 0.547 0.696 -0.017 0.082  0.028  204 HIS LLL H    
6292 H HA   . HIS C 204 ? 0.611 0.547 0.738 -0.019 0.078  0.025  204 HIS LLL HA   
6293 H HB2  . HIS C 204 ? 0.681 0.581 0.749 -0.019 0.098  0.032  204 HIS LLL HB2  
6294 H HB3  . HIS C 204 ? 0.675 0.581 0.767 -0.021 0.094  0.031  204 HIS LLL HB3  
6296 H HD2  . HIS C 204 ? 0.769 0.640 0.850 -0.024 0.138  0.038  204 HIS LLL HD2  
6297 H HE1  . HIS C 204 ? 0.728 0.647 0.926 -0.029 0.129  0.028  204 HIS LLL HE1  
6299 N N    . THR C 205 ? 0.550 0.492 0.654 -0.014 0.056  0.023  205 THR LLL N    
6300 C CA   . THR C 205 ? 0.539 0.485 0.631 -0.010 0.043  0.021  205 THR LLL CA   
6301 C C    . THR C 205 ? 0.530 0.467 0.618 -0.011 0.043  0.022  205 THR LLL C    
6302 O O    . THR C 205 ? 0.538 0.473 0.648 -0.014 0.046  0.021  205 THR LLL O    
6303 C CB   . THR C 205 ? 0.531 0.487 0.638 -0.007 0.030  0.017  205 THR LLL CB   
6304 O OG1  . THR C 205 ? 0.527 0.491 0.636 -0.006 0.029  0.017  205 THR LLL OG1  
6305 C CG2  . THR C 205 ? 0.528 0.485 0.621 -0.003 0.019  0.016  205 THR LLL CG2  
6306 H H    . THR C 205 ? 0.551 0.496 0.675 -0.015 0.056  0.021  205 THR LLL H    
6307 H HA   . THR C 205 ? 0.536 0.482 0.612 -0.009 0.041  0.022  205 THR LLL HA   
6308 H HB   . THR C 205 ? 0.531 0.488 0.657 -0.008 0.030  0.016  205 THR LLL HB   
6310 H HG21 . THR C 205 ? 0.531 0.486 0.630 -0.003 0.017  0.016  205 THR LLL HG21 
6311 H HG22 . THR C 205 ? 0.524 0.487 0.619 0.000  0.013  0.015  205 THR LLL HG22 
6312 H HG23 . THR C 205 ? 0.530 0.486 0.608 -0.003 0.021  0.018  205 THR LLL HG23 
6313 N N    . VAL C 206 ? 0.529 0.460 0.594 -0.010 0.040  0.024  206 VAL LLL N    
6314 C CA   . VAL C 206 ? 0.542 0.465 0.599 -0.010 0.037  0.024  206 VAL LLL CA   
6315 C C    . VAL C 206 ? 0.535 0.467 0.587 -0.005 0.024  0.022  206 VAL LLL C    
6316 O O    . VAL C 206 ? 0.541 0.477 0.581 -0.003 0.021  0.022  206 VAL LLL O    
6317 C CB   . VAL C 206 ? 0.559 0.464 0.592 -0.011 0.045  0.028  206 VAL LLL CB   
6318 C CG1  . VAL C 206 ? 0.566 0.469 0.582 -0.009 0.046  0.029  206 VAL LLL CG1  
6319 C CG2  . VAL C 206 ? 0.565 0.464 0.584 -0.009 0.037  0.027  206 VAL LLL CG2  
6320 H H    . VAL C 206 ? 0.531 0.462 0.583 -0.009 0.039  0.024  206 VAL LLL H    
6321 H HA   . VAL C 206 ? 0.542 0.465 0.615 -0.011 0.039  0.024  206 VAL LLL HA   
6322 H HB   . VAL C 206 ? 0.568 0.466 0.606 -0.013 0.054  0.029  206 VAL LLL HB   
6323 H HG11 . VAL C 206 ? 0.565 0.468 0.587 -0.011 0.053  0.029  206 VAL LLL HG11 
6324 H HG12 . VAL C 206 ? 0.578 0.468 0.575 -0.009 0.048  0.030  206 VAL LLL HG12 
6325 H HG13 . VAL C 206 ? 0.555 0.467 0.571 -0.007 0.039  0.027  206 VAL LLL HG13 
6326 H HG21 . VAL C 206 ? 0.559 0.464 0.571 -0.006 0.030  0.026  206 VAL LLL HG21 
6327 H HG22 . VAL C 206 ? 0.579 0.464 0.584 -0.009 0.042  0.029  206 VAL LLL HG22 
6328 H HG23 . VAL C 206 ? 0.561 0.464 0.592 -0.009 0.034  0.026  206 VAL LLL HG23 
6329 N N    . GLU C 207 ? 0.530 0.464 0.592 -0.004 0.017  0.019  207 GLU LLL N    
6330 C CA   . GLU C 207 ? 0.529 0.469 0.585 0.001  0.005  0.017  207 GLU LLL CA   
6331 C C    . GLU C 207 ? 0.515 0.448 0.564 0.002  0.001  0.017  207 GLU LLL C    
6332 O O    . GLU C 207 ? 0.523 0.450 0.581 -0.001 0.003  0.017  207 GLU LLL O    
6333 C CB   . GLU C 207 ? 0.539 0.486 0.610 0.004  -0.003 0.014  207 GLU LLL CB   
6334 C CG   . GLU C 207 ? 0.556 0.500 0.636 0.006  -0.011 0.011  207 GLU LLL CG   
6335 C CD   . GLU C 207 ? 0.571 0.517 0.659 0.011  -0.022 0.006  207 GLU LLL CD   
6336 O OE1  . GLU C 207 ? 0.569 0.520 0.664 0.012  -0.021 0.006  207 GLU LLL OE1  
6337 O OE2  . GLU C 207 ? 0.600 0.542 0.686 0.015  -0.032 0.003  207 GLU LLL OE2  
6338 H H    . GLU C 207 ? 0.535 0.466 0.608 -0.006 0.019  0.019  207 GLU LLL H    
6339 H HA   . GLU C 207 ? 0.525 0.467 0.571 0.003  0.005  0.018  207 GLU LLL HA   
6340 H HB2  . GLU C 207 ? 0.536 0.486 0.598 0.008  -0.006 0.013  207 GLU LLL HB2  
6341 H HB3  . GLU C 207 ? 0.537 0.485 0.619 0.002  0.001  0.014  207 GLU LLL HB3  
6342 H HG2  . GLU C 207 ? 0.559 0.500 0.651 0.003  -0.008 0.011  207 GLU LLL HG2  
6343 H HG3  . GLU C 207 ? 0.559 0.500 0.628 0.008  -0.014 0.011  207 GLU LLL HG3  
6344 N N    . LYS C 208 ? 0.504 0.438 0.538 0.005  -0.004 0.017  208 LYS LLL N    
6345 C CA   . LYS C 208 ? 0.508 0.436 0.535 0.007  -0.010 0.016  208 LYS LLL CA   
6346 C C    . LYS C 208 ? 0.487 0.422 0.516 0.013  -0.019 0.013  208 LYS LLL C    
6347 O O    . LYS C 208 ? 0.482 0.423 0.509 0.016  -0.019 0.012  208 LYS LLL O    
6348 C CB   . LYS C 208 ? 0.520 0.442 0.531 0.007  -0.009 0.018  208 LYS LLL CB   
6349 C CG   . LYS C 208 ? 0.537 0.446 0.539 0.003  -0.001 0.021  208 LYS LLL CG   
6350 C CD   . LYS C 208 ? 0.550 0.451 0.560 -0.001 0.004  0.022  208 LYS LLL CD   
6351 C CE   . LYS C 208 ? 0.571 0.454 0.567 -0.004 0.014  0.025  208 LYS LLL CE   
6352 N NZ   . LYS C 208 ? 0.589 0.460 0.564 -0.001 0.008  0.026  208 LYS LLL NZ   
6353 H H    . LYS C 208 ? 0.503 0.440 0.532 0.007  -0.004 0.017  208 LYS LLL H    
6354 H HA   . LYS C 208 ? 0.510 0.434 0.544 0.005  -0.009 0.016  208 LYS LLL HA   
6355 H HB2  . LYS C 208 ? 0.515 0.442 0.523 0.009  -0.010 0.017  208 LYS LLL HB2  
6356 H HB3  . LYS C 208 ? 0.522 0.442 0.530 0.009  -0.014 0.017  208 LYS LLL HB3  
6357 H HG2  . LYS C 208 ? 0.535 0.446 0.538 0.002  0.003  0.021  208 LYS LLL HG2  
6358 H HG3  . LYS C 208 ? 0.543 0.446 0.534 0.004  -0.004 0.021  208 LYS LLL HG3  
6359 H HD2  . LYS C 208 ? 0.550 0.451 0.563 0.001  -0.001 0.020  208 LYS LLL HD2  
6360 H HD3  . LYS C 208 ? 0.544 0.451 0.568 -0.002 0.006  0.021  208 LYS LLL HD3  
6361 H HE2  . LYS C 208 ? 0.576 0.455 0.581 -0.006 0.019  0.026  208 LYS LLL HE2  
6362 H HE3  . LYS C 208 ? 0.572 0.455 0.566 -0.004 0.019  0.026  208 LYS LLL HE3  
6363 H HZ1  . LYS C 208 ? 0.587 0.458 0.553 -0.000 0.006  0.025  208 LYS LLL HZ1  
6364 H HZ2  . LYS C 208 ? 0.601 0.459 0.566 -0.003 0.014  0.028  208 LYS LLL HZ2  
6365 H HZ3  . LYS C 208 ? 0.583 0.459 0.561 0.000  0.002  0.024  208 LYS LLL HZ3  
6366 N N    . SER C 209 ? 0.480 0.411 0.511 0.015  -0.025 0.011  209 SER LLL N    
6367 C CA   . SER C 209 ? 0.477 0.409 0.507 0.021  -0.034 0.007  209 SER LLL CA   
6368 C C    . SER C 209 ? 0.469 0.397 0.491 0.024  -0.040 0.006  209 SER LLL C    
6369 O O    . SER C 209 ? 0.476 0.399 0.498 0.020  -0.038 0.008  209 SER LLL O    
6370 C CB   . SER C 209 ? 0.486 0.417 0.532 0.021  -0.040 0.005  209 SER LLL CB   
6371 O OG   . SER C 209 ? 0.497 0.432 0.555 0.017  -0.033 0.006  209 SER LLL OG   
6372 H H    . SER C 209 ? 0.486 0.412 0.518 0.013  -0.025 0.011  209 SER LLL H    
6373 H HA   . SER C 209 ? 0.474 0.410 0.499 0.024  -0.034 0.007  209 SER LLL HA   
6374 H HB2  . SER C 209 ? 0.491 0.418 0.543 0.019  -0.042 0.004  209 SER LLL HB2  
6375 H HB3  . SER C 209 ? 0.491 0.421 0.533 0.026  -0.046 0.002  209 SER LLL HB3  
6377 N N    . LEU C 210 ? 0.466 0.393 0.481 0.031  -0.046 0.004  210 LEU LLL N    
6378 C CA   . LEU C 210 ? 0.473 0.395 0.482 0.034  -0.051 0.002  210 LEU LLL CA   
6379 C C    . LEU C 210 ? 0.476 0.394 0.476 0.043  -0.058 -0.001 210 LEU LLL C    
6380 O O    . LEU C 210 ? 0.477 0.395 0.473 0.046  -0.057 -0.002 210 LEU LLL O    
6381 C CB   . LEU C 210 ? 0.475 0.399 0.476 0.034  -0.047 0.004  210 LEU LLL CB   
6382 C CG   . LEU C 210 ? 0.475 0.404 0.471 0.038  -0.042 0.005  210 LEU LLL CG   
6383 C CD1  . LEU C 210 ? 0.487 0.412 0.474 0.046  -0.045 0.002  210 LEU LLL CD1  
6384 C CD2  . LEU C 210 ? 0.467 0.398 0.463 0.035  -0.038 0.007  210 LEU LLL CD2  
6385 H H    . LEU C 210 ? 0.468 0.396 0.481 0.034  -0.047 0.003  210 LEU LLL H    
6386 H HA   . LEU C 210 ? 0.475 0.394 0.489 0.031  -0.054 0.002  210 LEU LLL HA   
6387 H HB2  . LEU C 210 ? 0.479 0.399 0.477 0.035  -0.050 0.003  210 LEU LLL HB2  
6388 H HB3  . LEU C 210 ? 0.472 0.397 0.476 0.029  -0.043 0.006  210 LEU LLL HB3  
6389 H HG   . LEU C 210 ? 0.472 0.403 0.469 0.038  -0.039 0.005  210 LEU LLL HG   
6390 H HD11 . LEU C 210 ? 0.489 0.412 0.473 0.050  -0.045 0.001  210 LEU LLL HD11 
6391 H HD12 . LEU C 210 ? 0.485 0.412 0.471 0.048  -0.041 0.003  210 LEU LLL HD12 
6392 H HD13 . LEU C 210 ? 0.490 0.410 0.476 0.047  -0.050 0.001  210 LEU LLL HD13 
6393 H HD21 . LEU C 210 ? 0.471 0.400 0.466 0.036  -0.041 0.006  210 LEU LLL HD21 
6394 H HD22 . LEU C 210 ? 0.466 0.401 0.463 0.037  -0.034 0.007  210 LEU LLL HD22 
6395 H HD23 . LEU C 210 ? 0.466 0.397 0.464 0.031  -0.036 0.008  210 LEU LLL HD23 
6396 N N    . SER C 211 ? 0.484 0.396 0.480 0.046  -0.065 -0.004 211 SER LLL N    
6397 C CA   . SER C 211 ? 0.502 0.405 0.485 0.056  -0.072 -0.007 211 SER LLL CA   
6398 C C    . SER C 211 ? 0.504 0.405 0.476 0.060  -0.069 -0.007 211 SER LLL C    
6399 O O    . SER C 211 ? 0.504 0.409 0.482 0.055  -0.068 -0.006 211 SER LLL O    
6400 C CB   . SER C 211 ? 0.516 0.411 0.506 0.056  -0.084 -0.011 211 SER LLL CB   
6401 O OG   . SER C 211 ? 0.530 0.424 0.528 0.056  -0.088 -0.013 211 SER LLL OG   
6402 H H    . SER C 211 ? 0.484 0.395 0.483 0.043  -0.065 -0.003 211 SER LLL H    
6403 H HA   . SER C 211 ? 0.505 0.407 0.482 0.059  -0.070 -0.007 211 SER LLL HA   
6404 H HB2  . SER C 211 ? 0.513 0.410 0.512 0.051  -0.084 -0.010 211 SER LLL HB2  
6405 H HB3  . SER C 211 ? 0.528 0.416 0.507 0.063  -0.089 -0.014 211 SER LLL HB3  
6407 N N    . ARG C 212 ? 0.510 0.404 0.467 0.069  -0.069 -0.009 212 ARG LLL N    
6408 C CA   . ARG C 212 ? 0.510 0.402 0.458 0.074  -0.062 -0.008 212 ARG LLL CA   
6409 C C    . ARG C 212 ? 0.504 0.391 0.452 0.075  -0.070 -0.011 212 ARG LLL C    
6410 O O    . ARG C 212 ? 0.502 0.381 0.446 0.078  -0.081 -0.014 212 ARG LLL O    
6411 C CB   . ARG C 212 ? 0.528 0.409 0.457 0.084  -0.058 -0.009 212 ARG LLL CB   
6412 C CG   . ARG C 212 ? 0.535 0.414 0.458 0.090  -0.048 -0.008 212 ARG LLL CG   
6413 C CD   . ARG C 212 ? 0.551 0.418 0.455 0.100  -0.038 -0.007 212 ARG LLL CD   
6414 N NE   . ARG C 212 ? 0.572 0.423 0.456 0.107  -0.046 -0.009 212 ARG LLL NE   
6415 C CZ   . ARG C 212 ? 0.585 0.420 0.452 0.114  -0.057 -0.014 212 ARG LLL CZ   
6416 N NH1  . ARG C 212 ? 0.585 0.419 0.454 0.115  -0.061 -0.016 212 ARG LLL NH1  
6417 N NH2  . ARG C 212 ? 0.603 0.421 0.451 0.121  -0.066 -0.016 212 ARG LLL NH2  
6418 H H    . ARG C 212 ? 0.519 0.406 0.468 0.073  -0.072 -0.010 212 ARG LLL H    
6419 H HA   . ARG C 212 ? 0.500 0.400 0.455 0.070  -0.056 -0.006 212 ARG LLL HA   
6420 H HB2  . ARG C 212 ? 0.525 0.409 0.454 0.083  -0.053 -0.007 212 ARG LLL HB2  
6421 H HB3  . ARG C 212 ? 0.540 0.411 0.459 0.089  -0.065 -0.012 212 ARG LLL HB3  
6422 H HG2  . ARG C 212 ? 0.541 0.414 0.460 0.093  -0.053 -0.010 212 ARG LLL HG2  
6423 H HG3  . ARG C 212 ? 0.523 0.411 0.458 0.085  -0.043 -0.006 212 ARG LLL HG3  
6424 H HD2  . ARG C 212 ? 0.561 0.423 0.460 0.105  -0.033 -0.007 212 ARG LLL HD2  
6425 H HD3  . ARG C 212 ? 0.544 0.418 0.456 0.097  -0.030 -0.004 212 ARG LLL HD3  
6426 H HE   . ARG C 212 ? 0.570 0.421 0.451 0.106  -0.043 -0.008 212 ARG LLL HE   
6427 H HH11 . ARG C 212 ? 0.575 0.419 0.456 0.111  -0.056 -0.014 212 ARG LLL HH11 
6428 H HH12 . ARG C 212 ? 0.599 0.422 0.457 0.120  -0.069 -0.019 212 ARG LLL HH12 
6429 H HH21 . ARG C 212 ? 0.603 0.422 0.450 0.120  -0.064 -0.015 212 ARG LLL HH21 
6430 H HH22 . ARG C 212 ? 0.617 0.424 0.455 0.126  -0.075 -0.019 212 ARG LLL HH22 
6431 C C1   . NAG D .   ? 0.622 0.549 0.666 -0.050 0.085  0.058  1   NAG A   C1   
6432 C C2   . NAG D .   ? 0.658 0.567 0.700 -0.054 0.092  0.058  1   NAG A   C2   
6433 C C3   . NAG D .   ? 0.666 0.574 0.709 -0.054 0.095  0.066  1   NAG A   C3   
6434 C C4   . NAG D .   ? 0.674 0.585 0.714 -0.045 0.091  0.074  1   NAG A   C4   
6435 C C5   . NAG D .   ? 0.649 0.578 0.691 -0.042 0.082  0.072  1   NAG A   C5   
6436 C C6   . NAG D .   ? 0.642 0.573 0.684 -0.034 0.075  0.081  1   NAG A   C6   
6437 C C7   . NAG D .   ? 0.699 0.586 0.733 -0.065 0.091  0.043  1   NAG A   C7   
6438 C C8   . NAG D .   ? 0.704 0.586 0.737 -0.075 0.084  0.034  1   NAG A   C8   
6439 N N2   . NAG D .   ? 0.677 0.582 0.719 -0.063 0.090  0.049  1   NAG A   N2   
6440 O O3   . NAG D .   ? 0.680 0.570 0.722 -0.055 0.102  0.068  1   NAG A   O3   
6441 O O4   . NAG D .   ? 0.710 0.616 0.741 -0.046 0.093  0.081  1   NAG A   O4   
6442 O O5   . NAG D .   ? 0.626 0.556 0.673 -0.042 0.083  0.066  1   NAG A   O5   
6443 O O6   . NAG D .   ? 0.645 0.566 0.695 -0.028 0.076  0.087  1   NAG A   O6   
6444 O O7   . NAG D .   ? 0.710 0.582 0.737 -0.059 0.098  0.045  1   NAG A   O7   
6445 H H1   . NAG D .   ? 0.621 0.557 0.666 -0.054 0.082  0.056  1   NAG A   H1   
6446 H H2   . NAG D .   ? 0.666 0.565 0.707 -0.049 0.096  0.059  1   NAG A   H2   
6447 H H3   . NAG D .   ? 0.663 0.578 0.709 -0.059 0.094  0.064  1   NAG A   H3   
6448 H H4   . NAG D .   ? 0.682 0.586 0.725 -0.040 0.092  0.078  1   NAG A   H4   
6449 H H5   . NAG D .   ? 0.640 0.576 0.680 -0.047 0.081  0.070  1   NAG A   H5   
6450 H H61  . NAG D .   ? 0.649 0.577 0.681 -0.035 0.073  0.084  1   NAG A   H61  
6451 H H62  . NAG D .   ? 0.629 0.572 0.676 -0.033 0.070  0.079  1   NAG A   H62  
6452 H H81  . NAG D .   ? 0.693 0.588 0.728 -0.076 0.077  0.031  1   NAG A   H81  
6453 H H82  . NAG D .   ? 0.723 0.586 0.744 -0.076 0.084  0.029  1   NAG A   H82  
6454 H H83  . NAG D .   ? 0.706 0.590 0.751 -0.081 0.084  0.035  1   NAG A   H83  
6455 H HN2  . NAG D .   ? 0.668 0.583 0.716 -0.067 0.086  0.047  1   NAG A   HN2  
6457 H HO4  . NAG D .   ? 0.697 0.610 0.729 -0.050 0.094  0.078  1   NAG A   HO4  
6458 H HO6  . NAG D .   ? 0.646 0.565 0.701 -0.028 0.081  0.083  1   NAG A   HO6  
6459 C C1   . NAG D .   ? 0.817 0.708 0.842 -0.041 0.094  0.089  2   NAG A   C1   
6460 C C2   . NAG D .   ? 0.848 0.733 0.855 -0.039 0.093  0.096  2   NAG A   C2   
6461 C C3   . NAG D .   ? 0.886 0.750 0.880 -0.033 0.091  0.107  2   NAG A   C3   
6462 C C4   . NAG D .   ? 0.913 0.765 0.914 -0.035 0.101  0.107  2   NAG A   C4   
6463 C C5   . NAG D .   ? 0.881 0.741 0.901 -0.034 0.100  0.101  2   NAG A   C5   
6464 C C6   . NAG D .   ? 0.885 0.737 0.911 -0.041 0.111  0.096  2   NAG A   C6   
6465 C C7   . NAG D .   ? 0.813 0.722 0.816 -0.041 0.085  0.090  2   NAG A   C7   
6466 C C8   . NAG D .   ? 0.800 0.720 0.798 -0.037 0.075  0.089  2   NAG A   C8   
6467 N N2   . NAG D .   ? 0.826 0.725 0.831 -0.036 0.083  0.095  2   NAG A   N2   
6468 O O3   . NAG D .   ? 0.906 0.755 0.875 -0.032 0.093  0.112  2   NAG A   O3   
6469 O O4   . NAG D .   ? 0.981 0.811 0.969 -0.029 0.100  0.117  2   NAG A   O4   
6470 O O5   . NAG D .   ? 0.848 0.728 0.876 -0.034 0.094  0.095  2   NAG A   O5   
6471 O O6   . NAG D .   ? 0.901 0.743 0.934 -0.036 0.113  0.097  2   NAG A   O6   
6472 O O7   . NAG D .   ? 0.810 0.720 0.820 -0.048 0.095  0.086  2   NAG A   O7   
6473 H H1   . NAG D .   ? 0.829 0.717 0.857 -0.047 0.101  0.085  2   NAG A   H1   
6474 H H2   . NAG D .   ? 0.850 0.733 0.856 -0.045 0.101  0.094  2   NAG A   H2   
6475 H H3   . NAG D .   ? 0.882 0.750 0.881 -0.027 0.080  0.110  2   NAG A   H3   
6476 H H4   . NAG D .   ? 0.915 0.767 0.917 -0.042 0.110  0.103  2   NAG A   H4   
6477 H H5   . NAG D .   ? 0.889 0.742 0.912 -0.027 0.096  0.107  2   NAG A   H5   
6478 H H61  . NAG D .   ? 0.876 0.737 0.907 -0.046 0.111  0.087  2   NAG A   H61  
6479 H H62  . NAG D .   ? 0.902 0.743 0.921 -0.044 0.117  0.099  2   NAG A   H62  
6480 H H81  . NAG D .   ? 0.785 0.716 0.795 -0.036 0.069  0.086  2   NAG A   H81  
6481 H H82  . NAG D .   ? 0.798 0.723 0.794 -0.040 0.079  0.086  2   NAG A   H82  
6482 H H83  . NAG D .   ? 0.816 0.724 0.799 -0.033 0.069  0.096  2   NAG A   H83  
6483 H HN2  . NAG D .   ? 0.827 0.726 0.831 -0.031 0.074  0.099  2   NAG A   HN2  
6485 H HO4  . NAG D .   ? 0.976 0.798 0.968 -0.032 0.108  0.117  2   NAG A   HO4  
6487 C C1   . BMA D .   ? 1.077 0.886 1.053 -0.023 0.097  0.128  3   BMA A   C1   
6488 C C2   . BMA D .   ? 1.094 0.891 1.078 -0.015 0.091  0.135  3   BMA A   C2   
6489 C C3   . BMA D .   ? 1.126 0.895 1.093 -0.014 0.098  0.144  3   BMA A   C3   
6490 C C4   . BMA D .   ? 1.152 0.903 1.086 -0.016 0.103  0.148  3   BMA A   C4   
6491 C C5   . BMA D .   ? 1.133 0.900 1.070 -0.025 0.113  0.138  3   BMA A   C5   
6492 C C6   . BMA D .   ? 1.155 0.902 1.061 -0.027 0.123  0.143  3   BMA A   C6   
6493 O O2   . BMA D .   ? 1.082 0.883 1.068 -0.007 0.072  0.141  3   BMA A   O2   
6494 O O3   . BMA D .   ? 1.136 0.893 1.107 -0.004 0.085  0.154  3   BMA A   O3   
6495 O O4   . BMA D .   ? 1.175 0.901 1.098 -0.017 0.115  0.154  3   BMA A   O4   
6496 O O5   . BMA D .   ? 1.110 0.901 1.058 -0.024 0.101  0.133  3   BMA A   O5   
6497 O O6   . BMA D .   ? 1.129 0.891 1.031 -0.029 0.121  0.138  3   BMA A   O6   
6498 H H1   . BMA D .   ? 1.062 0.887 1.044 -0.021 0.088  0.125  3   BMA A   H1   
6499 H H2   . BMA D .   ? 1.077 0.883 1.081 -0.016 0.096  0.130  3   BMA A   H2   
6500 H H3   . BMA D .   ? 1.123 0.890 1.100 -0.018 0.109  0.139  3   BMA A   H3   
6501 H H4   . BMA D .   ? 1.163 0.906 1.081 -0.011 0.090  0.154  3   BMA A   H4   
6502 H H5   . BMA D .   ? 1.122 0.896 1.076 -0.031 0.123  0.133  3   BMA A   H5   
6503 H H61  . BMA D .   ? 1.181 0.906 1.063 -0.021 0.117  0.152  3   BMA A   H61  
6504 H H62  . BMA D .   ? 1.159 0.901 1.070 -0.033 0.138  0.142  3   BMA A   H62  
6509 C C1   . FUC D .   ? 0.617 0.540 0.673 -0.021 0.066  0.095  4   FUC A   C1   
6510 C C2   . FUC D .   ? 0.618 0.530 0.687 -0.015 0.069  0.101  4   FUC A   C2   
6511 C C3   . FUC D .   ? 0.606 0.524 0.696 -0.011 0.075  0.099  4   FUC A   C3   
6512 C C4   . FUC D .   ? 0.594 0.529 0.694 -0.010 0.067  0.098  4   FUC A   C4   
6513 C C5   . FUC D .   ? 0.583 0.527 0.665 -0.016 0.063  0.091  4   FUC A   C5   
6514 C C6   . FUC D .   ? 0.562 0.522 0.653 -0.015 0.054  0.091  4   FUC A   C6   
6515 O O2   . FUC D .   ? 0.632 0.528 0.692 -0.018 0.079  0.101  4   FUC A   O2   
6516 O O3   . FUC D .   ? 0.612 0.521 0.720 -0.004 0.076  0.107  4   FUC A   O3   
6517 O O4   . FUC D .   ? 0.599 0.538 0.715 -0.004 0.053  0.107  4   FUC A   O4   
6518 O O5   . FUC D .   ? 0.597 0.535 0.662 -0.018 0.057  0.095  4   FUC A   O5   
6519 H H1   . FUC D .   ? 0.624 0.540 0.665 -0.022 0.064  0.098  4   FUC A   H1   
6520 H H2   . FUC D .   ? 0.626 0.535 0.697 -0.010 0.059  0.109  4   FUC A   H2   
6521 H H3   . FUC D .   ? 0.608 0.521 0.691 -0.015 0.085  0.092  4   FUC A   H3   
6522 H H4   . FUC D .   ? 0.590 0.526 0.700 -0.008 0.076  0.095  4   FUC A   H4   
6523 H H5   . FUC D .   ? 0.582 0.524 0.656 -0.021 0.071  0.084  4   FUC A   H5   
6524 H H61  . FUC D .   ? 0.557 0.522 0.636 -0.019 0.053  0.085  4   FUC A   H61  
6525 H H62  . FUC D .   ? 0.567 0.527 0.661 -0.012 0.043  0.097  4   FUC A   H62  
6526 H H63  . FUC D .   ? 0.559 0.522 0.666 -0.012 0.059  0.090  4   FUC A   H63  
6530 C C1   . CIR E .   ? 0.471 0.508 0.518 -0.004 0.088  -0.043 701 CIR BBB C1   
6531 O O1   . CIR E .   ? 0.464 0.497 0.508 -0.007 0.088  -0.041 701 CIR BBB O1   
6532 C C2   . CIR E .   ? 0.464 0.493 0.513 -0.001 0.088  -0.044 701 CIR BBB C2   
6533 N N2   . CIR E .   ? 0.477 0.502 0.527 0.001  0.087  -0.043 701 CIR BBB N2   
6534 C C3   . CIR E .   ? 0.457 0.480 0.503 -0.002 0.089  -0.041 701 CIR BBB C3   
6535 C C4   . CIR E .   ? 0.448 0.471 0.496 -0.002 0.089  -0.042 701 CIR BBB C4   
6536 C C5   . CIR E .   ? 0.443 0.466 0.489 -0.004 0.089  -0.040 701 CIR BBB C5   
6537 N N6   . CIR E .   ? 0.437 0.455 0.478 -0.005 0.089  -0.038 701 CIR BBB N6   
6538 C C7   . CIR E .   ? 0.434 0.450 0.471 -0.006 0.089  -0.037 701 CIR BBB C7   
6539 O O7   . CIR E .   ? 0.440 0.450 0.471 -0.005 0.087  -0.036 701 CIR BBB O7   
6540 N N8   . CIR E .   ? 0.431 0.450 0.469 -0.008 0.089  -0.038 701 CIR BBB N8   
6541 H H2   . CIR E .   ? 0.467 0.498 0.517 0.001  0.087  -0.046 701 CIR BBB H2   
6542 H HN21 . CIR E .   ? 0.474 0.497 0.522 -0.000 0.088  -0.042 701 CIR BBB HN21 
6543 H HN22 . CIR E .   ? 0.475 0.498 0.526 0.003  0.086  -0.045 701 CIR BBB HN22 
6544 H H31  . CIR E .   ? 0.457 0.476 0.503 -0.001 0.088  -0.040 701 CIR BBB H31  
6545 H H32  . CIR E .   ? 0.457 0.481 0.501 -0.005 0.089  -0.040 701 CIR BBB H32  
6546 H H41  . CIR E .   ? 0.449 0.477 0.499 -0.001 0.088  -0.045 701 CIR BBB H41  
6547 H H42  . CIR E .   ? 0.450 0.469 0.499 -0.001 0.088  -0.041 701 CIR BBB H42  
6548 H H51  . CIR E .   ? 0.443 0.471 0.488 -0.006 0.089  -0.041 701 CIR BBB H51  
6549 H H52  . CIR E .   ? 0.443 0.465 0.489 -0.004 0.089  -0.040 701 CIR BBB H52  
6550 H HN6  . CIR E .   ? 0.438 0.454 0.479 -0.003 0.089  -0.037 701 CIR BBB HN6  
6551 H HN81 . CIR E .   ? 0.431 0.454 0.472 -0.008 0.090  -0.039 701 CIR BBB HN81 
6552 H HN82 . CIR E .   ? 0.436 0.452 0.470 -0.009 0.088  -0.037 701 CIR BBB HN82 
# 
loop_
_database_PDB_caveat.id 
_database_PDB_caveat.text 
1 'NAG A 2 HAS WRONG CHIRALITY AT ATOM C1' 
2 'BMA A 3 HAS WRONG CHIRALITY AT ATOM C1' 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   LEU 1   597 597 LEU LEU BBB . n 
A 1 2   PRO 2   598 598 PRO PRO BBB . n 
A 1 3   GLY 3   599 599 GLY GLY BBB . n 
A 1 4   GLN 4   600 600 GLN GLN BBB . n 
A 1 5   CYS 5   600 ?   ?   ?   BBB A n 
A 1 6   ILE 6   600 ?   ?   ?   BBB B n 
A 1 7   ARG 7   600 ?   ?   ?   BBB C n 
A 1 8   GLY 8   602 602 GLY GLY BBB . n 
A 1 9   GLU 9   603 603 GLU GLU BBB . n 
A 1 10  ARG 10  604 604 ARG ARG BBB . n 
A 1 11  GLY 11  605 605 GLY GLY BBB . n 
B 2 1   GLN 1   1   1   GLN GLN HHH . n 
B 2 2   VAL 2   2   2   VAL VAL HHH . n 
B 2 3   HIS 3   3   3   HIS HIS HHH . n 
B 2 4   LEU 4   4   4   LEU LEU HHH . n 
B 2 5   GLU 5   5   5   GLU GLU HHH . n 
B 2 6   GLN 6   6   6   GLN GLN HHH . n 
B 2 7   SER 7   7   7   SER SER HHH . n 
B 2 8   GLY 8   8   8   GLY GLY HHH . n 
B 2 9   SER 9   9   9   SER SER HHH . n 
B 2 10  GLU 10  10  10  GLU GLU HHH . n 
B 2 11  LEU 11  11  11  LEU LEU HHH . n 
B 2 12  LYS 12  12  12  LYS LYS HHH . n 
B 2 13  LYS 13  13  13  LYS LYS HHH . n 
B 2 14  PRO 14  14  14  PRO PRO HHH . n 
B 2 15  GLY 15  15  15  GLY GLY HHH . n 
B 2 16  ALA 16  16  16  ALA ALA HHH . n 
B 2 17  SER 17  17  17  SER SER HHH . n 
B 2 18  VAL 18  18  18  VAL VAL HHH . n 
B 2 19  THR 19  19  19  THR THR HHH . n 
B 2 20  ILE 20  20  20  ILE ILE HHH . n 
B 2 21  SER 21  21  21  SER SER HHH . n 
B 2 22  CYS 22  22  22  CYS CYS HHH . n 
B 2 23  LYS 23  23  23  LYS LYS HHH . n 
B 2 24  THR 24  24  24  THR THR HHH . n 
B 2 25  SER 25  25  25  SER SER HHH . n 
B 2 26  GLY 26  26  26  GLY GLY HHH . n 
B 2 27  TYR 27  27  27  TYR TYR HHH . n 
B 2 28  ASN 28  28  28  ASN ASN HHH . n 
B 2 29  PHE 29  29  29  PHE PHE HHH . n 
B 2 30  SER 30  30  30  SER SER HHH . n 
B 2 31  HIS 31  31  31  HIS HIS HHH . n 
B 2 32  PHE 32  32  32  PHE PHE HHH . n 
B 2 33  ALA 33  33  33  ALA ALA HHH . n 
B 2 34  ILE 34  34  34  ILE ILE HHH . n 
B 2 35  ASN 35  35  35  ASN ASN HHH . n 
B 2 36  TRP 36  36  36  TRP TRP HHH . n 
B 2 37  VAL 37  37  37  VAL VAL HHH . n 
B 2 38  ARG 38  38  38  ARG ARG HHH . n 
B 2 39  GLN 39  39  39  GLN GLN HHH . n 
B 2 40  ALA 40  40  40  ALA ALA HHH . n 
B 2 41  PRO 41  41  41  PRO PRO HHH . n 
B 2 42  GLY 42  42  42  GLY GLY HHH . n 
B 2 43  GLN 43  43  43  GLN GLN HHH . n 
B 2 44  GLY 44  44  44  GLY GLY HHH . n 
B 2 45  LEU 45  45  45  LEU LEU HHH . n 
B 2 46  GLN 46  46  46  GLN GLN HHH . n 
B 2 47  TRP 47  47  47  TRP TRP HHH . n 
B 2 48  MET 48  48  48  MET MET HHH . n 
B 2 49  GLY 49  49  49  GLY GLY HHH . n 
B 2 50  TRP 50  50  50  TRP TRP HHH . n 
B 2 51  ILE 51  51  51  ILE ILE HHH . n 
B 2 52  ASN 52  52  52  ASN ASN HHH . n 
B 2 53  THR 53  53  53  THR THR HHH . n 
B 2 54  LYS 54  54  54  LYS LYS HHH . n 
B 2 55  THR 55  55  55  THR THR HHH . n 
B 2 56  ALA 56  56  56  ALA ALA HHH . n 
B 2 57  ASN 57  57  57  ASN ASN HHH . n 
B 2 58  LEU 58  58  58  LEU LEU HHH . n 
B 2 59  THR 59  59  59  THR THR HHH . n 
B 2 60  TYR 60  60  60  TYR TYR HHH . n 
B 2 61  ALA 61  61  61  ALA ALA HHH . n 
B 2 62  GLN 62  62  62  GLN GLN HHH . n 
B 2 63  THR 63  63  63  THR THR HHH . n 
B 2 64  PHE 64  64  64  PHE PHE HHH . n 
B 2 65  THR 65  65  65  THR THR HHH . n 
B 2 66  GLY 66  66  66  GLY GLY HHH . n 
B 2 67  ARG 67  67  67  ARG ARG HHH . n 
B 2 68  PHE 68  68  68  PHE PHE HHH . n 
B 2 69  VAL 69  69  69  VAL VAL HHH . n 
B 2 70  PHE 70  70  70  PHE PHE HHH . n 
B 2 71  SER 71  71  71  SER SER HHH . n 
B 2 72  PHE 72  72  72  PHE PHE HHH . n 
B 2 73  ASP 73  73  73  ASP ASP HHH . n 
B 2 74  THR 74  74  74  THR THR HHH . n 
B 2 75  SER 75  75  75  SER SER HHH . n 
B 2 76  VAL 76  76  76  VAL VAL HHH . n 
B 2 77  SER 77  77  77  SER SER HHH . n 
B 2 78  THR 78  78  78  THR THR HHH . n 
B 2 79  ALA 79  79  79  ALA ALA HHH . n 
B 2 80  TYR 80  80  80  TYR TYR HHH . n 
B 2 81  LEU 81  81  81  LEU LEU HHH . n 
B 2 82  HIS 82  82  82  HIS HIS HHH . n 
B 2 83  ILE 83  83  83  ILE ILE HHH . n 
B 2 84  HIS 84  84  84  HIS HIS HHH . n 
B 2 85  GLY 85  85  85  GLY ALA HHH . n 
B 2 86  LEU 86  86  86  LEU LEU HHH . n 
B 2 87  LYS 87  87  87  LYS LYS HHH . n 
B 2 88  THR 88  88  88  THR THR HHH . n 
B 2 89  GLU 89  89  89  GLU GLU HHH . n 
B 2 90  ASP 90  90  90  ASP ASP HHH . n 
B 2 91  THR 91  91  91  THR THR HHH . n 
B 2 92  ALA 92  92  92  ALA ALA HHH . n 
B 2 93  MET 93  93  93  MET MET HHH . n 
B 2 94  TYR 94  94  94  TYR TYR HHH . n 
B 2 95  TYR 95  95  95  TYR TYR HHH . n 
B 2 96  CYS 96  96  96  CYS CYS HHH . n 
B 2 97  VAL 97  97  97  VAL VAL HHH . n 
B 2 98  ARG 98  98  98  ARG ARG HHH . n 
B 2 99  GLY 99  99  99  GLY GLY HHH . n 
B 2 100 GLY 100 100 100 GLY GLY HHH . n 
B 2 101 SER 101 101 101 SER SER HHH . n 
B 2 102 LEU 102 102 102 LEU LEU HHH . n 
B 2 103 GLY 103 103 103 GLY GLY HHH . n 
B 2 104 ILE 104 104 104 ILE ILE HHH . n 
B 2 105 PHE 105 105 105 PHE PHE HHH . n 
B 2 106 GLY 106 106 106 GLY GLY HHH . n 
B 2 107 GLY 107 107 107 GLY GLY HHH . n 
B 2 108 SER 108 108 108 SER SER HHH . n 
B 2 109 VAL 109 109 109 VAL VAL HHH . n 
B 2 110 GLY 110 110 110 GLY GLY HHH . n 
B 2 111 TYR 111 111 111 TYR TYR HHH . n 
B 2 112 TRP 112 112 112 TRP TRP HHH . n 
B 2 113 GLY 113 113 113 GLY GLY HHH . n 
B 2 114 GLN 114 114 114 GLN GLN HHH . n 
B 2 115 GLY 115 115 115 GLY GLY HHH . n 
B 2 116 ALA 116 116 116 ALA ALA HHH . n 
B 2 117 LEU 117 117 117 LEU LEU HHH . n 
B 2 118 VAL 118 118 118 VAL VAL HHH . n 
B 2 119 SER 119 119 119 SER SER HHH . n 
B 2 120 VAL 120 120 120 VAL ALA HHH . n 
B 2 121 SER 121 121 121 SER SER HHH . n 
B 2 122 SER 122 122 122 SER SER HHH . n 
B 2 123 ALA 123 123 123 ALA ALA HHH . n 
B 2 124 LYS 124 124 124 LYS LYS HHH . n 
B 2 125 THR 125 125 125 THR THR HHH . n 
B 2 126 THR 126 126 126 THR THR HHH . n 
B 2 127 PRO 127 127 127 PRO PRO HHH . n 
B 2 128 PRO 128 128 128 PRO PRO HHH . n 
B 2 129 SER 129 129 129 SER SER HHH . n 
B 2 130 VAL 130 130 130 VAL VAL HHH . n 
B 2 131 TYR 131 131 131 TYR TYR HHH . n 
B 2 132 PRO 132 132 132 PRO PRO HHH . n 
B 2 133 LEU 133 133 133 LEU LEU HHH . n 
B 2 134 ALA 134 134 134 ALA ALA HHH . n 
B 2 135 PRO 135 135 135 PRO PRO HHH . n 
B 2 136 GLY 136 136 136 GLY GLY HHH . n 
B 2 137 CYS 137 137 ?   ?   ?   HHH . n 
B 2 138 GLY 138 138 ?   ?   ?   HHH . n 
B 2 139 ASP 139 139 ?   ?   ?   HHH . n 
B 2 140 THR 140 140 ?   ?   ?   HHH . n 
B 2 141 THR 141 141 ?   ?   ?   HHH . n 
B 2 142 GLY 142 142 142 GLY GLY HHH . n 
B 2 143 SER 143 143 143 SER SER HHH . n 
B 2 144 SER 144 144 144 SER SER HHH . n 
B 2 145 VAL 145 145 145 VAL VAL HHH . n 
B 2 146 THR 146 146 146 THR THR HHH . n 
B 2 147 LEU 147 147 147 LEU LEU HHH . n 
B 2 148 GLY 148 148 148 GLY GLY HHH . n 
B 2 149 CYS 149 149 149 CYS CYS HHH . n 
B 2 150 LEU 150 150 150 LEU LEU HHH . n 
B 2 151 VAL 151 151 151 VAL VAL HHH . n 
B 2 152 LYS 152 152 152 LYS LYS HHH . n 
B 2 153 GLY 153 153 153 GLY GLY HHH . n 
B 2 154 TYR 154 154 154 TYR TYR HHH . n 
B 2 155 PHE 155 155 155 PHE PHE HHH . n 
B 2 156 PRO 156 156 156 PRO PRO HHH . n 
B 2 157 GLU 157 157 157 GLU GLU HHH . n 
B 2 158 SER 158 158 158 SER SER HHH . n 
B 2 159 VAL 159 159 159 VAL VAL HHH . n 
B 2 160 THR 160 160 160 THR THR HHH . n 
B 2 161 VAL 161 161 161 VAL VAL HHH . n 
B 2 162 THR 162 162 162 THR THR HHH . n 
B 2 163 TRP 163 163 163 TRP TRP HHH . n 
B 2 164 ASN 164 164 164 ASN ASN HHH . n 
B 2 165 SER 165 165 165 SER SER HHH . n 
B 2 166 GLY 166 166 ?   ?   ?   HHH . n 
B 2 167 SER 167 167 ?   ?   ?   HHH . n 
B 2 168 LEU 168 168 ?   ?   ?   HHH . n 
B 2 169 SER 169 169 ?   ?   ?   HHH . n 
B 2 170 SER 170 170 170 SER SER HHH . n 
B 2 171 SER 171 171 171 SER SER HHH . n 
B 2 172 VAL 172 172 172 VAL VAL HHH . n 
B 2 173 HIS 173 173 173 HIS HIS HHH . n 
B 2 174 THR 174 174 174 THR THR HHH . n 
B 2 175 PHE 175 175 175 PHE PHE HHH . n 
B 2 176 PRO 176 176 176 PRO PRO HHH . n 
B 2 177 ALA 177 177 177 ALA ALA HHH . n 
B 2 178 LEU 178 178 178 LEU LEU HHH . n 
B 2 179 LEU 179 179 179 LEU LEU HHH . n 
B 2 180 GLN 180 180 180 GLN GLN HHH . n 
B 2 181 SER 181 181 181 SER SER HHH . n 
B 2 182 GLY 182 182 182 GLY GLY HHH . n 
B 2 183 LEU 183 183 183 LEU LEU HHH . n 
B 2 184 TYR 184 184 184 TYR TYR HHH . n 
B 2 185 THR 185 185 185 THR THR HHH . n 
B 2 186 MET 186 186 186 MET MET HHH . n 
B 2 187 SER 187 187 187 SER SER HHH . n 
B 2 188 SER 188 188 188 SER SER HHH . n 
B 2 189 SER 189 189 189 SER SER HHH . n 
B 2 190 VAL 190 190 190 VAL VAL HHH . n 
B 2 191 THR 191 191 191 THR THR HHH . n 
B 2 192 VAL 192 192 192 VAL VAL HHH . n 
B 2 193 PRO 193 193 193 PRO PRO HHH . n 
B 2 194 SER 194 194 194 SER SER HHH . n 
B 2 195 SER 195 195 195 SER SER HHH . n 
B 2 196 THR 196 196 196 THR THR HHH . n 
B 2 197 TRP 197 197 197 TRP TRP HHH . n 
B 2 198 PRO 198 198 198 PRO PRO HHH . n 
B 2 199 SER 199 199 199 SER SER HHH . n 
B 2 200 GLN 200 200 200 GLN GLN HHH . n 
B 2 201 THR 201 201 201 THR THR HHH . n 
B 2 202 VAL 202 202 202 VAL VAL HHH . n 
B 2 203 THR 203 203 203 THR THR HHH . n 
B 2 204 CYS 204 204 204 CYS CYS HHH . n 
B 2 205 SER 205 205 205 SER SER HHH . n 
B 2 206 VAL 206 206 206 VAL VAL HHH . n 
B 2 207 ALA 207 207 207 ALA ALA HHH . n 
B 2 208 HIS 208 208 208 HIS HIS HHH . n 
B 2 209 PRO 209 209 209 PRO PRO HHH . n 
B 2 210 ALA 210 210 210 ALA ALA HHH . n 
B 2 211 SER 211 211 211 SER SER HHH . n 
B 2 212 SER 212 212 212 SER SER HHH . n 
B 2 213 THR 213 213 213 THR THR HHH . n 
B 2 214 THR 214 214 214 THR THR HHH . n 
B 2 215 VAL 215 215 215 VAL VAL HHH . n 
B 2 216 ASP 216 216 216 ASP ASP HHH . n 
B 2 217 LYS 217 217 217 LYS LYS HHH . n 
B 2 218 LYS 218 218 218 LYS LYS HHH . n 
B 2 219 ILE 219 219 219 ILE ILE HHH . n 
B 2 220 GLU 220 220 220 GLU GLU HHH . n 
B 2 221 PRO 221 221 221 PRO PRO HHH . n 
B 2 222 ARG 222 222 222 ARG ARG HHH . n 
C 3 1   ASN 1   1   1   ASN ASN LLL . n 
C 3 2   LEU 2   2   2   LEU LEU LLL . n 
C 3 3   THR 3   3   3   THR THR LLL . n 
C 3 4   LEU 4   4   4   LEU LEU LLL . n 
C 3 5   ILE 5   5   5   ILE ILE LLL . n 
C 3 6   GLN 6   6   6   GLN GLN LLL . n 
C 3 7   SER 7   7   7   SER SER LLL . n 
C 3 8   ARG 8   8   8   ARG ARG LLL . n 
C 3 9   SER 9   9   9   SER SER LLL . n 
C 3 10  VAL 10  10  10  VAL VAL LLL . n 
C 3 11  SER 11  11  11  SER SER LLL . n 
C 3 12  GLY 12  12  12  GLY GLY LLL . n 
C 3 13  SER 13  13  13  SER SER LLL . n 
C 3 14  PRO 14  14  14  PRO PRO LLL . n 
C 3 15  GLY 15  15  15  GLY GLY LLL . n 
C 3 16  GLN 16  16  16  GLN GLN LLL . n 
C 3 17  THR 17  17  17  THR THR LLL . n 
C 3 18  VAL 18  18  18  VAL VAL LLL . n 
C 3 19  SER 19  19  19  SER SER LLL . n 
C 3 20  ILE 20  20  20  ILE ILE LLL . n 
C 3 21  SER 21  21  21  SER SER LLL . n 
C 3 22  CYS 22  22  22  CYS CYS LLL . n 
C 3 23  THR 23  23  23  THR THR LLL . n 
C 3 24  ALA 24  24  24  ALA ALA LLL . n 
C 3 25  ASN 25  25  25  ASN ASN LLL . n 
C 3 26  GLY 26  26  26  GLY GLY LLL . n 
C 3 27  ALA 27  27  27  ALA ALA LLL . n 
C 3 28  HIS 28  28  28  HIS HIS LLL . n 
C 3 29  ILE 29  29  29  ILE ILE LLL . n 
C 3 30  GLY 30  30  30  GLY GLY LLL . n 
C 3 31  ASP 31  31  31  ASP ASP LLL . n 
C 3 32  SER 32  32  32  SER SER LLL . n 
C 3 33  TYR 33  33  33  TYR TYR LLL . n 
C 3 34  VAL 34  34  34  VAL VAL LLL . n 
C 3 35  GLN 35  35  35  GLN GLN LLL . n 
C 3 36  TRP 36  36  36  TRP TRP LLL . n 
C 3 37  PHE 37  37  37  PHE PHE LLL . n 
C 3 38  GLN 38  38  38  GLN GLN LLL . n 
C 3 39  GLN 39  39  39  GLN GLN LLL . n 
C 3 40  ARG 40  40  40  ARG ARG LLL . n 
C 3 41  PRO 41  41  41  PRO PRO LLL . n 
C 3 42  GLY 42  42  42  GLY GLY LLL . n 
C 3 43  SER 43  43  43  SER SER LLL . n 
C 3 44  ALA 44  44  44  ALA ALA LLL . n 
C 3 45  PRO 45  45  45  PRO PRO LLL . n 
C 3 46  ARG 46  46  46  ARG ARG LLL . n 
C 3 47  SER 47  47  47  SER SER LLL . n 
C 3 48  VAL 48  48  48  VAL VAL LLL . n 
C 3 49  ILE 49  49  49  ILE ILE LLL . n 
C 3 50  PHE 50  50  50  PHE PHE LLL . n 
C 3 51  GLU 51  51  51  GLU GLU LLL . n 
C 3 52  ASP 52  52  52  ASP ASP LLL . n 
C 3 53  ASP 53  53  53  ASP ASP LLL . n 
C 3 54  LYS 54  54  54  LYS LYS LLL . n 
C 3 55  ARG 55  55  55  ARG ARG LLL . n 
C 3 56  PRO 56  56  56  PRO PRO LLL . n 
C 3 57  SER 57  57  57  SER SER LLL . n 
C 3 58  GLY 58  58  58  GLY GLY LLL . n 
C 3 59  VAL 59  59  59  VAL VAL LLL . n 
C 3 60  PRO 60  60  60  PRO PRO LLL . n 
C 3 61  ASP 61  61  61  ASP ASP LLL . n 
C 3 62  ARG 62  62  62  ARG ARG LLL . n 
C 3 63  LEU 63  63  63  LEU LEU LLL . n 
C 3 64  SER 64  64  64  SER SER LLL . n 
C 3 65  GLY 65  65  65  GLY GLY LLL . n 
C 3 66  SER 66  66  66  SER SER LLL . n 
C 3 67  THR 67  67  67  THR THR LLL . n 
C 3 68  ASP 68  68  68  ASP ASP LLL . n 
C 3 69  PHE 69  69  69  PHE PHE LLL . n 
C 3 70  SER 70  70  70  SER SER LLL . n 
C 3 71  SER 71  71  71  SER SER LLL . n 
C 3 72  ASN 72  72  72  ASN ASN LLL . n 
C 3 73  SER 73  73  73  SER SER LLL . n 
C 3 74  ALA 74  74  74  ALA ALA LLL . n 
C 3 75  SER 75  75  75  SER SER LLL . n 
C 3 76  LEU 76  76  76  LEU LEU LLL . n 
C 3 77  THR 77  77  77  THR THR LLL . n 
C 3 78  ILE 78  78  78  ILE ILE LLL . n 
C 3 79  SER 79  79  79  SER SER LLL . n 
C 3 80  GLY 80  80  80  GLY GLY LLL . n 
C 3 81  LEU 81  81  81  LEU LEU LLL . n 
C 3 82  GLU 82  82  82  GLU GLU LLL . n 
C 3 83  SER 83  83  83  SER SER LLL . n 
C 3 84  GLU 84  84  84  GLU GLU LLL . n 
C 3 85  ASP 85  85  85  ASP ASP LLL . n 
C 3 86  GLU 86  86  86  GLU GLU LLL . n 
C 3 87  ALA 87  87  87  ALA ALA LLL . n 
C 3 88  ASP 88  88  88  ASP ASP LLL . n 
C 3 89  TYR 89  89  89  TYR TYR LLL . n 
C 3 90  TYR 90  90  90  TYR TYR LLL . n 
C 3 91  CYS 91  91  91  CYS CYS LLL . n 
C 3 92  GLN 92  92  92  GLN GLN LLL . n 
C 3 93  SER 93  93  93  SER SER LLL . n 
C 3 94  TYR 94  94  94  TYR TYR LLL . n 
C 3 95  TYR 95  95  95  TYR TYR LLL . n 
C 3 96  ARG 96  96  96  ARG ARG LLL . n 
C 3 97  GLY 97  97  97  GLY GLY LLL . n 
C 3 98  ASP 98  98  98  ASP ASP LLL . n 
C 3 99  TRP 99  99  99  TRP TRP LLL . n 
C 3 100 VAL 100 100 100 VAL VAL LLL . n 
C 3 101 LEU 101 101 101 LEU LEU LLL . n 
C 3 102 GLY 102 102 102 GLY GLY LLL . n 
C 3 103 GLY 103 103 103 GLY GLY LLL . n 
C 3 104 GLY 104 104 104 GLY GLY LLL . n 
C 3 105 THR 105 105 105 THR THR LLL . n 
C 3 106 LYS 106 106 106 LYS LYS LLL . n 
C 3 107 LEU 107 107 107 LEU LEU LLL . n 
C 3 108 THR 108 108 108 THR THR LLL . n 
C 3 109 VAL 109 109 109 VAL VAL LLL . n 
C 3 110 LEU 110 110 110 LEU LEU LLL . n 
C 3 111 GLY 111 111 111 GLY GLY LLL . n 
C 3 112 GLN 112 112 112 GLN GLN LLL . n 
C 3 113 PRO 113 113 113 PRO PRO LLL . n 
C 3 114 LYS 114 114 114 LYS LYS LLL . n 
C 3 115 SER 115 115 115 SER SER LLL . n 
C 3 116 SER 116 116 116 SER SER LLL . n 
C 3 117 PRO 117 117 117 PRO PRO LLL . n 
C 3 118 SER 118 118 118 SER SER LLL . n 
C 3 119 VAL 119 119 119 VAL VAL LLL . n 
C 3 120 THR 120 120 120 THR THR LLL . n 
C 3 121 LEU 121 121 121 LEU LEU LLL . n 
C 3 122 PHE 122 122 122 PHE PHE LLL . n 
C 3 123 PRO 123 123 123 PRO PRO LLL . n 
C 3 124 PRO 124 124 124 PRO PRO LLL . n 
C 3 125 SER 125 125 125 SER SER LLL . n 
C 3 126 SER 126 126 126 SER SER LLL . n 
C 3 127 GLU 127 127 127 GLU GLU LLL . n 
C 3 128 GLU 128 128 128 GLU GLU LLL . n 
C 3 129 LEU 129 129 129 LEU LEU LLL . n 
C 3 130 GLU 130 130 130 GLU GLU LLL . n 
C 3 131 THR 131 131 131 THR THR LLL . n 
C 3 132 ASN 132 132 132 ASN ASN LLL . n 
C 3 133 LYS 133 133 133 LYS LYS LLL . n 
C 3 134 ALA 134 134 134 ALA ALA LLL . n 
C 3 135 THR 135 135 135 THR THR LLL . n 
C 3 136 LEU 136 136 136 LEU LEU LLL . n 
C 3 137 VAL 137 137 137 VAL VAL LLL . n 
C 3 138 CYS 138 138 138 CYS CYS LLL . n 
C 3 139 THR 139 139 139 THR THR LLL . n 
C 3 140 ILE 140 140 140 ILE ILE LLL . n 
C 3 141 THR 141 141 141 THR THR LLL . n 
C 3 142 ASP 142 142 142 ASP ASP LLL . n 
C 3 143 PHE 143 143 143 PHE PHE LLL . n 
C 3 144 TYR 144 144 144 TYR TYR LLL . n 
C 3 145 PRO 145 145 145 PRO PRO LLL . n 
C 3 146 GLY 146 146 146 GLY GLY LLL . n 
C 3 147 VAL 147 147 147 VAL VAL LLL . n 
C 3 148 VAL 148 148 148 VAL VAL LLL . n 
C 3 149 THR 149 149 149 THR THR LLL . n 
C 3 150 VAL 150 150 150 VAL VAL LLL . n 
C 3 151 ASP 151 151 151 ASP ASP LLL . n 
C 3 152 TRP 152 152 152 TRP TRP LLL . n 
C 3 153 LYS 153 153 153 LYS LYS LLL . n 
C 3 154 VAL 154 154 154 VAL VAL LLL . n 
C 3 155 ASP 155 155 155 ASP ASP LLL . n 
C 3 156 GLY 156 156 156 GLY GLY LLL . n 
C 3 157 THR 157 157 157 THR THR LLL . n 
C 3 158 PRO 158 158 158 PRO PRO LLL . n 
C 3 159 VAL 159 159 159 VAL VAL LLL . n 
C 3 160 THR 160 160 160 THR THR LLL . n 
C 3 161 GLN 161 161 161 GLN GLN LLL . n 
C 3 162 GLY 162 162 162 GLY GLY LLL . n 
C 3 163 MET 163 163 163 MET MET LLL . n 
C 3 164 GLU 164 164 164 GLU GLU LLL . n 
C 3 165 THR 165 165 165 THR THR LLL . n 
C 3 166 THR 166 166 166 THR THR LLL . n 
C 3 167 GLN 167 167 167 GLN GLN LLL . n 
C 3 168 PRO 168 168 168 PRO PRO LLL . n 
C 3 169 SER 169 169 169 SER SER LLL . n 
C 3 170 LYS 170 170 170 LYS LYS LLL . n 
C 3 171 GLN 171 171 171 GLN GLN LLL . n 
C 3 172 SER 172 172 172 SER SER LLL . n 
C 3 173 ASN 173 173 173 ASN ASN LLL . n 
C 3 174 ASN 174 174 174 ASN ASN LLL . n 
C 3 175 LYS 175 175 175 LYS LYS LLL . n 
C 3 176 TYR 176 176 176 TYR TYR LLL . n 
C 3 177 MET 177 177 177 MET MET LLL . n 
C 3 178 ALA 178 178 178 ALA ALA LLL . n 
C 3 179 SER 179 179 179 SER SER LLL . n 
C 3 180 SER 180 180 180 SER SER LLL . n 
C 3 181 TYR 181 181 181 TYR TYR LLL . n 
C 3 182 LEU 182 182 182 LEU LEU LLL . n 
C 3 183 THR 183 183 183 THR THR LLL . n 
C 3 184 LEU 184 184 184 LEU LEU LLL . n 
C 3 185 THR 185 185 185 THR THR LLL . n 
C 3 186 ALA 186 186 186 ALA ALA LLL . n 
C 3 187 ARG 187 187 187 ARG ARG LLL . n 
C 3 188 ALA 188 188 188 ALA ALA LLL . n 
C 3 189 TRP 189 189 189 TRP TRP LLL . n 
C 3 190 GLU 190 190 190 GLU GLU LLL . n 
C 3 191 ARG 191 191 191 ARG ARG LLL . n 
C 3 192 HIS 192 192 192 HIS HIS LLL . n 
C 3 193 SER 193 193 193 SER SER LLL . n 
C 3 194 SER 194 194 194 SER SER LLL . n 
C 3 195 TYR 195 195 195 TYR TYR LLL . n 
C 3 196 SER 196 196 196 SER SER LLL . n 
C 3 197 CYS 197 197 197 CYS CYS LLL . n 
C 3 198 GLN 198 198 198 GLN GLN LLL . n 
C 3 199 VAL 199 199 199 VAL VAL LLL . n 
C 3 200 THR 200 200 200 THR THR LLL . n 
C 3 201 HIS 201 201 201 HIS HIS LLL . n 
C 3 202 GLU 202 202 202 GLU GLU LLL . n 
C 3 203 GLY 203 203 203 GLY GLY LLL . n 
C 3 204 HIS 204 204 204 HIS HIS LLL . n 
C 3 205 THR 205 205 205 THR THR LLL . n 
C 3 206 VAL 206 206 206 VAL VAL LLL . n 
C 3 207 GLU 207 207 207 GLU GLU LLL . n 
C 3 208 LYS 208 208 208 LYS LYS LLL . n 
C 3 209 SER 209 209 209 SER SER LLL . n 
C 3 210 LEU 210 210 210 LEU LEU LLL . n 
C 3 211 SER 211 211 211 SER SER LLL . n 
C 3 212 ARG 212 212 212 ARG ARG LLL . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
E 5 CIR 1  701 601 CIR CIR BBB . 
F 6 ZN  1  702 1   ZN  ZN  BBB . 
G 6 ZN  1  305 2   ZN  ZN  HHH . 
H 6 ZN  1  306 3   ZN  ZN  HHH . 
I 6 ZN  1  307 4   ZN  ZN  HHH . 
J 7 HOH 1  801 1   HOH HOH BBB . 
J 7 HOH 2  802 2   HOH HOH BBB . 
K 7 HOH 1  401 16  HOH HOH HHH . 
K 7 HOH 2  402 32  HOH HOH HHH . 
K 7 HOH 3  403 25  HOH HOH HHH . 
K 7 HOH 4  404 12  HOH HOH HHH . 
K 7 HOH 5  405 5   HOH HOH HHH . 
K 7 HOH 6  406 27  HOH HOH HHH . 
K 7 HOH 7  407 15  HOH HOH HHH . 
K 7 HOH 8  408 20  HOH HOH HHH . 
K 7 HOH 9  409 17  HOH HOH HHH . 
K 7 HOH 10 410 29  HOH HOH HHH . 
K 7 HOH 11 411 10  HOH HOH HHH . 
K 7 HOH 12 412 31  HOH HOH HHH . 
K 7 HOH 13 413 7   HOH HOH HHH . 
K 7 HOH 14 414 21  HOH HOH HHH . 
K 7 HOH 15 415 9   HOH HOH HHH . 
K 7 HOH 16 416 33  HOH HOH HHH . 
L 7 HOH 1  301 24  HOH HOH LLL . 
L 7 HOH 2  302 22  HOH HOH LLL . 
L 7 HOH 3  303 23  HOH HOH LLL . 
L 7 HOH 4  304 30  HOH HOH LLL . 
L 7 HOH 5  305 3   HOH HOH LLL . 
L 7 HOH 6  306 28  HOH HOH LLL . 
L 7 HOH 7  307 6   HOH HOH LLL . 
L 7 HOH 8  308 14  HOH HOH LLL . 
L 7 HOH 9  309 4   HOH HOH LLL . 
L 7 HOH 10 310 13  HOH HOH LLL . 
L 7 HOH 11 311 18  HOH HOH LLL . 
L 7 HOH 12 312 11  HOH HOH LLL . 
L 7 HOH 13 313 26  HOH HOH LLL . 
L 7 HOH 14 314 8   HOH HOH LLL . 
L 7 HOH 15 315 19  HOH HOH LLL . 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   trimeric 
_pdbx_struct_assembly.oligomeric_count     3 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G,H,I,J,K,L 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 5960  ? 
1 MORE         -115  ? 
1 'SSA (A^2)'  19850 ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  OE1 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OE2 ? A GLU 9   ? BBB GLU 603 ? 1_555 53.4  ? 
2  OE1 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD1 ? C ASP 31  ? LLL ASP 31  ? 1_555 90.1  ? 
3  OE2 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD1 ? C ASP 31  ? LLL ASP 31  ? 1_555 84.6  ? 
4  OE1 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 31  ? LLL ASP 31  ? 1_555 79.0  ? 
5  OE2 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 31  ? LLL ASP 31  ? 1_555 117.4 ? 
6  OD1 ? C ASP 31  ? LLL ASP 31  ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 31  ? LLL ASP 31  ? 1_555 54.5  ? 
7  OE1 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 155 ? LLL ASP 155 ? 1_555 80.3  ? 
8  OE2 ? A GLU 9   ? BBB GLU 603 ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 155 ? LLL ASP 155 ? 1_555 129.6 ? 
9  OD1 ? C ASP 31  ? LLL ASP 31  ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 155 ? LLL ASP 155 ? 1_555 75.8  ? 
10 OD2 ? C ASP 31  ? LLL ASP 31  ? 1_555 ZN ? F ZN . ? BBB ZN 702 ? 1_555 OD2 ? C ASP 155 ? LLL ASP 155 ? 1_555 21.6  ? 
11 NE2 ? B HIS 3   ? HHH HIS 3   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OE1 ? B GLU 5   ? HHH GLU 5   ? 1_555 112.0 ? 
12 NE2 ? B HIS 3   ? HHH HIS 3   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 O   ? K HOH .   ? HHH HOH 401 ? 1_555 113.9 ? 
13 OE1 ? B GLU 5   ? HHH GLU 5   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 O   ? K HOH .   ? HHH HOH 401 ? 1_555 109.5 ? 
14 NE2 ? B HIS 3   ? HHH HIS 3   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD1 ? C ASP 61  ? LLL ASP 61  ? 1_555 82.0  ? 
15 OE1 ? B GLU 5   ? HHH GLU 5   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD1 ? C ASP 61  ? LLL ASP 61  ? 1_555 165.2 ? 
16 O   ? K HOH .   ? HHH HOH 401 ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD1 ? C ASP 61  ? LLL ASP 61  ? 1_555 58.2  ? 
17 NE2 ? B HIS 3   ? HHH HIS 3   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD2 ? C ASP 61  ? LLL ASP 61  ? 1_555 79.0  ? 
18 OE1 ? B GLU 5   ? HHH GLU 5   ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD2 ? C ASP 61  ? LLL ASP 61  ? 1_555 166.9 ? 
19 O   ? K HOH .   ? HHH HOH 401 ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD2 ? C ASP 61  ? LLL ASP 61  ? 1_555 58.3  ? 
20 OD1 ? C ASP 61  ? LLL ASP 61  ? 1_555 ZN ? I ZN . ? HHH ZN 307 ? 1_555 OD2 ? C ASP 61  ? LLL ASP 61  ? 1_555 3.6   ? 
21 NE2 ? B HIS 82  ? HHH HIS 82  ? 1_555 ZN ? G ZN . ? HHH ZN 305 ? 1_555 ND1 ? B HIS 84  ? HHH HIS 84  ? 1_555 132.5 ? 
22 NE2 ? B HIS 82  ? HHH HIS 82  ? 1_555 ZN ? G ZN . ? HHH ZN 305 ? 1_555 O   ? K HOH .   ? HHH HOH 408 ? 1_555 97.0  ? 
23 ND1 ? B HIS 84  ? HHH HIS 84  ? 1_555 ZN ? G ZN . ? HHH ZN 305 ? 1_555 O   ? K HOH .   ? HHH HOH 408 ? 1_555 98.7  ? 
24 NE2 ? B HIS 82  ? HHH HIS 82  ? 1_555 ZN ? G ZN . ? HHH ZN 305 ? 1_555 OE2 ? C GLU 130 ? LLL GLU 130 ? 1_555 101.4 ? 
25 ND1 ? B HIS 84  ? HHH HIS 84  ? 1_555 ZN ? G ZN . ? HHH ZN 305 ? 1_555 OE2 ? C GLU 130 ? LLL GLU 130 ? 1_555 31.0  ? 
26 O   ? K HOH .   ? HHH HOH 408 ? 1_555 ZN ? G ZN . ? HHH ZN 305 ? 1_555 OE2 ? C GLU 130 ? LLL GLU 130 ? 1_555 105.6 ? 
27 NE2 ? B HIS 173 ? HHH HIS 173 ? 1_555 ZN ? H ZN . ? HHH ZN 306 ? 1_555 O   ? K HOH .   ? HHH HOH 415 ? 1_555 95.7  ? 
28 NE2 ? B HIS 173 ? HHH HIS 173 ? 1_555 ZN ? H ZN . ? HHH ZN 306 ? 1_555 OD1 ? C ASP 142 ? LLL ASP 142 ? 1_555 108.6 ? 
29 O   ? K HOH .   ? HHH HOH 415 ? 1_555 ZN ? H ZN . ? HHH ZN 306 ? 1_555 OD1 ? C ASP 142 ? LLL ASP 142 ? 1_555 114.2 ? 
30 NE2 ? B HIS 173 ? HHH HIS 173 ? 1_555 ZN ? H ZN . ? HHH ZN 306 ? 1_555 O   ? L HOH .   ? LLL HOH 303 ? 1_555 104.2 ? 
31 O   ? K HOH .   ? HHH HOH 415 ? 1_555 ZN ? H ZN . ? HHH ZN 306 ? 1_555 O   ? L HOH .   ? LLL HOH 303 ? 1_555 139.1 ? 
32 OD1 ? C ASP 142 ? LLL ASP 142 ? 1_555 ZN ? H ZN . ? HHH ZN 306 ? 1_555 O   ? L HOH .   ? LLL HOH 303 ? 1_555 92.9  ? 
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2021-05-12 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
loop_
_pdbx_refine_tls.id 
_pdbx_refine_tls.pdbx_refine_id 
_pdbx_refine_tls.details 
_pdbx_refine_tls.method 
_pdbx_refine_tls.origin_x 
_pdbx_refine_tls.origin_y 
_pdbx_refine_tls.origin_z 
_pdbx_refine_tls.T[1][1] 
_pdbx_refine_tls.T[1][1]_esd 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][2]_esd 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[1][3]_esd 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[2][2]_esd 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.T[2][3]_esd 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[3][3]_esd 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[1][1]_esd 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][2]_esd 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[1][3]_esd 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[2][2]_esd 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.L[2][3]_esd 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[3][3]_esd 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[1][1]_esd 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][2]_esd 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[1][3]_esd 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[2][1]_esd 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[2][2]_esd 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][3]_esd 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][1]_esd 
_pdbx_refine_tls.S[3][2] 
_pdbx_refine_tls.S[3][2]_esd 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[3][3]_esd 
1 'X-RAY DIFFRACTION' ? refined 26.0732 14.9513 23.9391 0.2018 ? 0.0112  ? 0.0845  ? 0.2570 ? -0.0553 ? 0.2540 ? 0.6819 ? -0.1361 
? 1.0985  ? 0.0430 ? -0.2322 ? 1.7948 ? 0.0507  ? 0.1869  ? -0.0849 ? -0.0024 ? 0.0156  ? -0.0066 ? 0.0835  ? 0.2751  ? -0.0663 ? 
2 'X-RAY DIFFRACTION' ? refined 5.8350  40.4590 15.7579 0.0272 ? -0.0068 ? -0.0274 ? 0.1162 ? 0.0208  ? 0.0692 ? 0.6200 ? -0.2441 
? -0.1323 ? 4.3543 ? -0.5282 ? 0.7875 ? -0.0258 ? -0.0073 ? 0.0424  ? 0.0341  ? -0.0094 ? 0.2153  ? -0.1051 ? -0.1294 ? 0.0352  ? 
3 'X-RAY DIFFRACTION' ? refined 21.6387 43.9806 12.7694 0.0590 ? 0.0021  ? 0.0327  ? 0.0407 ? 0.0273  ? 0.1009 ? 0.3634 ? -0.6874 
? 0.1150  ? 2.9820 ? 0.2337  ? 0.1730 ? -0.0461 ? -0.0206 ? -0.0247 ? -0.1862 ? 0.0238  ? 0.0238  ? -0.0754 ? -0.0074 ? 0.0224  ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1 'X-RAY DIFFRACTION' 1 ? ? BBB 597 ? ? BBB 605 ALL ? 
2 'X-RAY DIFFRACTION' 2 ? ? HHH 1   ? ? HHH 230 ALL ? 
3 'X-RAY DIFFRACTION' 3 ? ? LLL 1   ? ? LLL 212 ALL ? 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC  ? ? ? 5.8.0258 1 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC  ? ? ? 5.8.0258 2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .        3 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS     ? ? ? .        4 
? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot    ? ? ? .        5 
# 
_pdbx_entry_details.entry_id                 6YXM 
_pdbx_entry_details.has_ligand_of_interest   N 
_pdbx_entry_details.compound_details         ? 
_pdbx_entry_details.source_details           ? 
_pdbx_entry_details.nonpolymer_details       ? 
_pdbx_entry_details.sequence_details         ? 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1  1 HD1 HHH HIS 84  ? ? ZN   HHH ZN  305 ? ? 1.08 
2  1 HE2 HHH HIS 82  ? ? ZN   HHH ZN  305 ? ? 1.10 
3  1 HE2 HHH HIS 173 ? ? ZN   HHH ZN  306 ? ? 1.19 
4  1 C   BBB GLN 600 ? ? HN22 BBB CIR 701 ? ? 1.26 
5  1 O4  A   NAG 2   ? ? H1   A   BMA 3   ? ? 1.27 
6  1 H   BBB GLY 602 ? ? C1   BBB CIR 701 ? ? 1.39 
7  1 HE2 HHH HIS 3   ? ? ZN   HHH ZN  307 ? ? 1.44 
8  1 HO4 A   NAG 2   ? ? C1   A   BMA 3   ? ? 1.44 
9  1 O4  A   NAG 1   ? ? H1   A   NAG 2   ? ? 1.46 
10 1 C   BBB GLN 600 ? ? HN21 BBB CIR 701 ? ? 1.52 
11 1 O   BBB GLN 600 ? ? N2   BBB CIR 701 ? ? 2.15 
# 
_pdbx_validate_symm_contact.id                1 
_pdbx_validate_symm_contact.PDB_model_num     1 
_pdbx_validate_symm_contact.auth_atom_id_1    HD2 
_pdbx_validate_symm_contact.auth_asym_id_1    LLL 
_pdbx_validate_symm_contact.auth_comp_id_1    HIS 
_pdbx_validate_symm_contact.auth_seq_id_1     192 
_pdbx_validate_symm_contact.PDB_ins_code_1    ? 
_pdbx_validate_symm_contact.label_alt_id_1    ? 
_pdbx_validate_symm_contact.site_symmetry_1   1_555 
_pdbx_validate_symm_contact.auth_atom_id_2    ZN 
_pdbx_validate_symm_contact.auth_asym_id_2    BBB 
_pdbx_validate_symm_contact.auth_comp_id_2    ZN 
_pdbx_validate_symm_contact.auth_seq_id_2     702 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   3_655 
_pdbx_validate_symm_contact.dist              1.60 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1  1 ARG BBB 604 ? ? -163.47 -133.79 
2  1 SER HHH 7   ? ? -46.38  160.17  
3  1 TYR HHH 27  ? ? -175.92 147.30  
4  1 THR HHH 53  ? ? -65.91  0.40    
5  1 ALA HHH 56  ? ? 83.94   6.88    
6  1 SER HHH 108 ? ? -85.58  48.17   
7  1 PRO HHH 156 ? ? -83.77  -159.21 
8  1 CYS LLL 22  ? ? -156.64 86.97   
9  1 VAL LLL 48  ? ? -134.61 -42.47  
10 1 ASP LLL 52  ? ? 85.98   -51.58  
11 1 ASP LLL 53  ? ? -148.87 15.40   
# 
loop_
_pdbx_validate_chiral.id 
_pdbx_validate_chiral.PDB_model_num 
_pdbx_validate_chiral.auth_atom_id 
_pdbx_validate_chiral.label_alt_id 
_pdbx_validate_chiral.auth_asym_id 
_pdbx_validate_chiral.auth_comp_id 
_pdbx_validate_chiral.auth_seq_id 
_pdbx_validate_chiral.PDB_ins_code 
_pdbx_validate_chiral.details 
_pdbx_validate_chiral.omega 
1 1 C1 ? A NAG 2 ? 'WRONG HAND' . 
2 1 C1 ? A BMA 3 ? PLANAR       . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1 1 Y 1 HHH VAL 120 ? CG1 ? B VAL 120 CG1 
2 1 Y 1 HHH VAL 120 ? CG2 ? B VAL 120 CG2 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 BBB CYS 600 A A CYS 5   
2  1 Y 1 BBB ILE 600 B A ILE 6   
3  1 Y 1 BBB ARG 600 C A ARG 7   
4  1 Y 1 HHH CYS 137 ? B CYS 137 
5  1 Y 1 HHH GLY 138 ? B GLY 138 
6  1 Y 1 HHH ASP 139 ? B ASP 139 
7  1 Y 1 HHH THR 140 ? B THR 140 
8  1 Y 1 HHH THR 141 ? B THR 141 
9  1 Y 1 HHH GLY 166 ? B GLY 166 
10 1 Y 1 HHH SER 167 ? B SER 167 
11 1 Y 1 HHH LEU 168 ? B LEU 168 
12 1 Y 1 HHH SER 169 ? B SER 169 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Swedish Research Council'             Sweden ? 1 
'Knut and Alice Wallenberg Foundation' Sweden ? 2 
# 
loop_
_pdbx_branch_scheme.asym_id 
_pdbx_branch_scheme.entity_id 
_pdbx_branch_scheme.mon_id 
_pdbx_branch_scheme.num 
_pdbx_branch_scheme.pdb_asym_id 
_pdbx_branch_scheme.pdb_mon_id 
_pdbx_branch_scheme.pdb_seq_num 
_pdbx_branch_scheme.auth_asym_id 
_pdbx_branch_scheme.auth_mon_id 
_pdbx_branch_scheme.auth_seq_num 
_pdbx_branch_scheme.hetero 
D 4 NAG 1 A NAG 1 HaH NAG 230 n 
D 4 NAG 2 A NAG 2 HbH NAG 226 n 
D 4 BMA 3 A BMA 3 HcH BMA 227 n 
D 4 FUC 4 A FUC 4 HdH FUC 229 n 
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
BMA 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DManpb                         
BMA 'COMMON NAME'                         GMML     1.0 b-D-mannopyranose              
BMA 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-Manp                       
BMA 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 Man                            
FUC 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 LFucpa                         
FUC 'COMMON NAME'                         GMML     1.0 a-L-fucopyranose               
FUC 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 a-L-Fucp                       
FUC 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 Fuc                            
NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DGlcpNAcb                      
NAG 'COMMON NAME'                         GMML     1.0 N-acetyl-b-D-glucopyranosamine 
NAG 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-GlcpNAc                    
NAG 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 GlcNAc                         
# 
_pdbx_entity_branch.entity_id   4 
_pdbx_entity_branch.type        oligosaccharide 
# 
loop_
_pdbx_entity_branch_descriptor.ordinal 
_pdbx_entity_branch_descriptor.entity_id 
_pdbx_entity_branch_descriptor.descriptor 
_pdbx_entity_branch_descriptor.type 
_pdbx_entity_branch_descriptor.program 
_pdbx_entity_branch_descriptor.program_version 
1 4 'DManpb1-4DGlcpNAcb1-4[LFucpa1-6]DGlcpNAcb1-'                                                       
'Glycam Condensed Sequence' GMML       1.0   
2 4 'WURCS=2.0/3,4,3/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1221m-1a_1-5]/1-1-2-3/a4-b1_a6-d1_b4-c1' WURCS PDB2Glycan 1.1.0 
3 4 '[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][a-D-GlcpNAc]{[(4+1)][a-D-Manp]{}}[(6+1)][a-L-Fucp]{}}}'            LINUCS PDB-CARE   ?     
# 
loop_
_pdbx_entity_branch_link.link_id 
_pdbx_entity_branch_link.entity_id 
_pdbx_entity_branch_link.entity_branch_list_num_1 
_pdbx_entity_branch_link.comp_id_1 
_pdbx_entity_branch_link.atom_id_1 
_pdbx_entity_branch_link.leaving_atom_id_1 
_pdbx_entity_branch_link.entity_branch_list_num_2 
_pdbx_entity_branch_link.comp_id_2 
_pdbx_entity_branch_link.atom_id_2 
_pdbx_entity_branch_link.leaving_atom_id_2 
_pdbx_entity_branch_link.value_order 
_pdbx_entity_branch_link.details 
1 4 2 NAG C1 O1 1 NAG O4 HO4 sing ? 
2 4 3 BMA C1 O1 2 NAG O4 HO4 sing ? 
3 4 4 FUC C1 O1 1 NAG O6 HO6 sing ? 
# 
loop_
_pdbx_entity_branch_list.entity_id 
_pdbx_entity_branch_list.comp_id 
_pdbx_entity_branch_list.num 
_pdbx_entity_branch_list.hetero 
4 NAG 1 n 
4 NAG 2 n 
4 BMA 3 n 
4 FUC 4 n 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
5 CITRULLINE CIR 
6 'ZINC ION' ZN  
7 water      HOH 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
