data_7Z1E
# 
_entry.id   7Z1E 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.356 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   7Z1E         pdb_00007z1e 10.2210/pdb7z1e/pdb 
WWPDB D_1292120234 ?            ?                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        7Z1E 
_pdbx_database_status.recvd_initial_deposition_date   2022-02-24 
_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 
'Mikolajek, H.'  1 0000-0003-0776-9974 
'Naismith, J.H.' 2 0000-0001-6744-5061 
# 
_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                     'Structure of Nanobody H11-H4 Q98R H100E bound to RBD' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Mikolajek, H.'  1 0000-0003-0776-9974 
primary 'Naismith, J.H.' 2 0000-0001-6744-5061 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     7Z1E 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     78.243 
_cell.length_a_esd                 ? 
_cell.length_b                     78.243 
_cell.length_b_esd                 ? 
_cell.length_c                     126.812 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_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                         7Z1E 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                152 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 31 2 1' 
_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 'Spike protein S1'                       23716.580 1   ? ? ? ? 
2 polymer     man 'H11-H4 Q98R H100E'                      15065.783 1   ? ? ? ? 
3 non-polymer syn 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208   1   ? ? ? ? 
4 non-polymer syn GLYCEROL                                 92.094    3   ? ? ? ? 
5 non-polymer syn 'NITRATE ION'                            62.005    2   ? ? ? ? 
6 water       nat water                                    18.015    206 ? ? ? ? 
# 
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 
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNKHHHHHH
;
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTNKHHHHHH
;
EEE ? 
2 'polypeptide(L)' no no 
;QVQLVESGGGLMQAGGSLRLSCAVSGRTFSTAAMGWFRQAPGKEREFVAAIRWSGGSAYYADSVKGRFTISRDKAKNTVY
LQMNSLKYEDTAVYYCARTEYVSYLLSDYATWPYDYWGQGTQVTVSSKHHHHHH
;
;QVQLVESGGGLMQAGGSLRLSCAVSGRTFSTAAMGWFRQAPGKEREFVAAIRWSGGSAYYADSVKGRFTISRDKAKNTVY
LQMNSLKYEDTAVYYCARTEYVSYLLSDYATWPYDYWGQGTQVTVSSKHHHHHH
;
FFF ? 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   PRO n 
1 2   ASN n 
1 3   ILE n 
1 4   THR n 
1 5   ASN n 
1 6   LEU n 
1 7   CYS n 
1 8   PRO n 
1 9   PHE n 
1 10  GLY n 
1 11  GLU n 
1 12  VAL n 
1 13  PHE n 
1 14  ASN n 
1 15  ALA n 
1 16  THR n 
1 17  ARG n 
1 18  PHE n 
1 19  ALA n 
1 20  SER n 
1 21  VAL n 
1 22  TYR n 
1 23  ALA n 
1 24  TRP n 
1 25  ASN n 
1 26  ARG n 
1 27  LYS n 
1 28  ARG n 
1 29  ILE n 
1 30  SER n 
1 31  ASN n 
1 32  CYS n 
1 33  VAL n 
1 34  ALA n 
1 35  ASP n 
1 36  TYR n 
1 37  SER n 
1 38  VAL n 
1 39  LEU n 
1 40  TYR n 
1 41  ASN n 
1 42  SER n 
1 43  ALA n 
1 44  SER n 
1 45  PHE n 
1 46  SER n 
1 47  THR n 
1 48  PHE n 
1 49  LYS n 
1 50  CYS n 
1 51  TYR n 
1 52  GLY n 
1 53  VAL n 
1 54  SER n 
1 55  PRO n 
1 56  THR n 
1 57  LYS n 
1 58  LEU n 
1 59  ASN n 
1 60  ASP n 
1 61  LEU n 
1 62  CYS n 
1 63  PHE n 
1 64  THR n 
1 65  ASN n 
1 66  VAL n 
1 67  TYR n 
1 68  ALA n 
1 69  ASP n 
1 70  SER n 
1 71  PHE n 
1 72  VAL n 
1 73  ILE n 
1 74  ARG n 
1 75  GLY n 
1 76  ASP n 
1 77  GLU n 
1 78  VAL n 
1 79  ARG n 
1 80  GLN n 
1 81  ILE n 
1 82  ALA n 
1 83  PRO n 
1 84  GLY n 
1 85  GLN n 
1 86  THR n 
1 87  GLY n 
1 88  LYS n 
1 89  ILE n 
1 90  ALA n 
1 91  ASP n 
1 92  TYR n 
1 93  ASN n 
1 94  TYR n 
1 95  LYS n 
1 96  LEU n 
1 97  PRO n 
1 98  ASP n 
1 99  ASP n 
1 100 PHE n 
1 101 THR n 
1 102 GLY n 
1 103 CYS n 
1 104 VAL n 
1 105 ILE n 
1 106 ALA n 
1 107 TRP n 
1 108 ASN n 
1 109 SER n 
1 110 ASN n 
1 111 ASN n 
1 112 LEU n 
1 113 ASP n 
1 114 SER n 
1 115 LYS n 
1 116 VAL n 
1 117 GLY n 
1 118 GLY n 
1 119 ASN n 
1 120 TYR n 
1 121 ASN n 
1 122 TYR n 
1 123 LEU n 
1 124 TYR n 
1 125 ARG n 
1 126 LEU n 
1 127 PHE n 
1 128 ARG n 
1 129 LYS n 
1 130 SER n 
1 131 ASN n 
1 132 LEU n 
1 133 LYS n 
1 134 PRO n 
1 135 PHE n 
1 136 GLU n 
1 137 ARG n 
1 138 ASP n 
1 139 ILE n 
1 140 SER n 
1 141 THR n 
1 142 GLU n 
1 143 ILE n 
1 144 TYR n 
1 145 GLN n 
1 146 ALA n 
1 147 GLY n 
1 148 SER n 
1 149 THR n 
1 150 PRO n 
1 151 CYS n 
1 152 ASN n 
1 153 GLY n 
1 154 VAL n 
1 155 GLU n 
1 156 GLY n 
1 157 PHE n 
1 158 ASN n 
1 159 CYS n 
1 160 TYR n 
1 161 PHE n 
1 162 PRO n 
1 163 LEU n 
1 164 GLN n 
1 165 SER n 
1 166 TYR n 
1 167 GLY n 
1 168 PHE n 
1 169 GLN n 
1 170 PRO n 
1 171 THR n 
1 172 ASN n 
1 173 GLY n 
1 174 VAL n 
1 175 GLY n 
1 176 TYR n 
1 177 GLN n 
1 178 PRO n 
1 179 TYR n 
1 180 ARG n 
1 181 VAL n 
1 182 VAL n 
1 183 VAL n 
1 184 LEU n 
1 185 SER n 
1 186 PHE n 
1 187 GLU n 
1 188 LEU n 
1 189 LEU n 
1 190 HIS n 
1 191 ALA n 
1 192 PRO n 
1 193 ALA n 
1 194 THR n 
1 195 VAL n 
1 196 CYS n 
1 197 GLY n 
1 198 PRO n 
1 199 LYS n 
1 200 LYS n 
1 201 SER n 
1 202 THR n 
1 203 ASN n 
1 204 LYS n 
1 205 HIS n 
1 206 HIS n 
1 207 HIS n 
1 208 HIS n 
1 209 HIS n 
1 210 HIS n 
2 1   GLN n 
2 2   VAL n 
2 3   GLN n 
2 4   LEU n 
2 5   VAL n 
2 6   GLU n 
2 7   SER n 
2 8   GLY n 
2 9   GLY n 
2 10  GLY n 
2 11  LEU n 
2 12  MET n 
2 13  GLN n 
2 14  ALA n 
2 15  GLY n 
2 16  GLY n 
2 17  SER n 
2 18  LEU n 
2 19  ARG n 
2 20  LEU n 
2 21  SER n 
2 22  CYS n 
2 23  ALA n 
2 24  VAL n 
2 25  SER n 
2 26  GLY n 
2 27  ARG n 
2 28  THR n 
2 29  PHE n 
2 30  SER n 
2 31  THR n 
2 32  ALA n 
2 33  ALA n 
2 34  MET n 
2 35  GLY n 
2 36  TRP n 
2 37  PHE n 
2 38  ARG n 
2 39  GLN n 
2 40  ALA n 
2 41  PRO n 
2 42  GLY n 
2 43  LYS n 
2 44  GLU n 
2 45  ARG n 
2 46  GLU n 
2 47  PHE n 
2 48  VAL n 
2 49  ALA n 
2 50  ALA n 
2 51  ILE n 
2 52  ARG n 
2 53  TRP n 
2 54  SER n 
2 55  GLY n 
2 56  GLY n 
2 57  SER n 
2 58  ALA n 
2 59  TYR n 
2 60  TYR n 
2 61  ALA n 
2 62  ASP n 
2 63  SER n 
2 64  VAL n 
2 65  LYS n 
2 66  GLY n 
2 67  ARG n 
2 68  PHE n 
2 69  THR n 
2 70  ILE n 
2 71  SER n 
2 72  ARG n 
2 73  ASP n 
2 74  LYS n 
2 75  ALA n 
2 76  LYS n 
2 77  ASN n 
2 78  THR n 
2 79  VAL n 
2 80  TYR n 
2 81  LEU n 
2 82  GLN n 
2 83  MET n 
2 84  ASN n 
2 85  SER n 
2 86  LEU n 
2 87  LYS n 
2 88  TYR n 
2 89  GLU n 
2 90  ASP n 
2 91  THR n 
2 92  ALA n 
2 93  VAL n 
2 94  TYR n 
2 95  TYR n 
2 96  CYS n 
2 97  ALA n 
2 98  ARG n 
2 99  THR n 
2 100 GLU n 
2 101 TYR n 
2 102 VAL n 
2 103 SER n 
2 104 TYR n 
2 105 LEU n 
2 106 LEU n 
2 107 SER n 
2 108 ASP n 
2 109 TYR n 
2 110 ALA n 
2 111 THR n 
2 112 TRP n 
2 113 PRO n 
2 114 TYR n 
2 115 ASP n 
2 116 TYR n 
2 117 TRP n 
2 118 GLY n 
2 119 GLN n 
2 120 GLY n 
2 121 THR n 
2 122 GLN n 
2 123 VAL n 
2 124 THR n 
2 125 VAL n 
2 126 SER n 
2 127 SER n 
2 128 LYS n 
2 129 HIS n 
2 130 HIS n 
2 131 HIS n 
2 132 HIS n 
2 133 HIS n 
2 134 HIS 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' 1 210 ? ? 'S, 2' ? ? ? ? ? ? 'Severe acute respiratory syndrome coronavirus 2' 2697049 ? ? ? ? ? 
? ? ? 'Homo sapiens'     9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 134 ? ? ?      ? ? ? ? ? ? 'Lama glama'                                      9844    ? ? ? ? ? 
? ? ? 'Escherichia coli' 562  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
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 UNP SPIKE_SARS2 P0DTC2 ? 1 
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCGPKKSTN
;
330 
2 PDB 7Z1E        7Z1E   ? 2 ? 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 7Z1E EEE 1 ? 203 ? P0DTC2 330 ? 532 ? 330 532 
2 2 7Z1E FFF 1 ? 134 ? 7Z1E   1   ? 134 ? 1   134 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 7Z1E LYS EEE 204 ? UNP P0DTC2 ? ? 'expression tag' 533 1 
1 7Z1E HIS EEE 205 ? UNP P0DTC2 ? ? 'expression tag' 534 2 
1 7Z1E HIS EEE 206 ? UNP P0DTC2 ? ? 'expression tag' 535 3 
1 7Z1E HIS EEE 207 ? UNP P0DTC2 ? ? 'expression tag' 536 4 
1 7Z1E HIS EEE 208 ? UNP P0DTC2 ? ? 'expression tag' 537 5 
1 7Z1E HIS EEE 209 ? UNP P0DTC2 ? ? 'expression tag' 538 6 
1 7Z1E HIS EEE 210 ? UNP P0DTC2 ? ? 'expression tag' 539 7 
# 
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 
CYS 'L-peptide linking'          y CYSTEINE                                 ? 'C3 H7 N O2 S'   121.158 
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  
GOL non-polymer                  . GLYCEROL                                 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3'       
92.094  
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 
NO3 non-polymer                  . 'NITRATE ION'                            ? 'N O3 -1'        62.005  
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 
# 
_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                   7Z1E 
_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            2.89 
_exptl_crystal.density_method              ? 
_exptl_crystal.density_percent_sol         57.43 
_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    '0.2M Ammonium nitrate, 20 % Peg 3350' 
_exptl_crystal_grow.pdbx_pH_range   ? 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_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 EIGER2 XE 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2021-07-14 
_diffrn_detector.pdbx_frequency               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    M 
_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   0.9763 
_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        0.9763 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I03 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       7Z1E 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.59 
_reflns.d_resolution_low                               67.761 
_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                                     61104 
_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                           100.0 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                18.8 
_reflns.pdbx_Rmerge_I_obs                              0.046 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          24.9 
_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                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.59 
_reflns_shell.d_res_low                                     1.62 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           0.4 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             3027 
_reflns_shell.percent_possible_all                          100.0 
_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                                  4.156 
_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                               20.2 
_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                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.361 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            -0.473 
_refine.aniso_B[1][2]                            -0.237 
_refine.aniso_B[1][3]                            -0.000 
_refine.aniso_B[2][2]                            -0.473 
_refine.aniso_B[2][3]                            0.000 
_refine.aniso_B[3][3]                            1.535 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               38.799 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.976 
_refine.correlation_coeff_Fo_to_Fc_free          0.967 
_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                                 7Z1E 
_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                            1.590 
_refine.ls_d_res_low                             67.761 
_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                     61035 
_refine.ls_number_reflns_R_free                  3095 
_refine.ls_number_reflns_R_work                  57940 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.972 
_refine.ls_percent_reflns_R_free                 5.071 
_refine.ls_R_factor_all                          0.163 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2023 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1610 
_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                    'MASK BULK SOLVENT' 
_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               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      6ZBP 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.077 
_refine.pdbx_overall_ESU_R_Free                  0.072 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.700 
_refine.pdbx_solvent_shrinkage_radii             0.700 
_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                             4.816 
_refine.overall_SU_ML                            0.067 
_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.pdbx_number_atoms_protein        2520 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         40 
_refine_hist.number_atoms_solvent             206 
_refine_hist.number_atoms_total               2766 
_refine_hist.d_res_high                       1.590 
_refine_hist.d_res_low                        67.761 
# 
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' ? 0.005  0.012  2688 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.015  2400 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.306  1.656  3666 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 1.267  1.583  5521 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 6.994  5.000  338  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 29.597 21.597 144  ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 11.691 15.000 399  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 15.032 15.000 17   ? r_dihedral_angle_4_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.061  0.200  337  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.005  0.020  3115 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  701  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.186  0.200  416  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.178  0.200  2172 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.171  0.200  1266 ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.075  0.200  1249 ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.123  0.200  169  ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.266  0.200  28   ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.215  0.200  50   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.147  0.200  18   ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 2.307  3.866  1298 ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 2.293  3.864  1297 ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 3.050  5.801  1624 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 3.055  5.804  1625 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 2.621  4.231  1390 ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 2.527  4.225  1385 ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 3.287  6.211  2032 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 3.237  6.206  2027 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 4.128  44.471 2949 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 4.131  44.484 2950 ? r_lrange_other                 ? ? 
'X-RAY DIFFRACTION' ? 1.360  3.000  5088 ? r_rigid_bond_restr             ? ? 
# 
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' 1.590 1.631  4469 . 224 4228 99.6196  . 0.460 . 0.511 . 0.457 . . . . . 0.447 . 20 . 0.441 0.440 
'X-RAY DIFFRACTION' 1.631 1.676  4335 . 226 4109 100.0000 . 0.437 . 0.422 . 0.438 . . . . . 0.431 . 20 . 0.593 0.592 
'X-RAY DIFFRACTION' 1.676 1.725  4213 . 222 3991 100.0000 . 0.369 . 0.374 . 0.369 . . . . . 0.364 . 20 . 0.700 0.657 
'X-RAY DIFFRACTION' 1.725 1.778  4138 . 199 3939 100.0000 . 0.316 . 0.333 . 0.315 . . . . . 0.310 . 20 . 0.812 0.806 
'X-RAY DIFFRACTION' 1.778 1.836  3971 . 202 3769 100.0000 . 0.236 . 0.245 . 0.236 . . . . . 0.219 . 20 . 0.900 0.898 
'X-RAY DIFFRACTION' 1.836 1.900  3865 . 209 3656 100.0000 . 0.180 . 0.220 . 0.178 . . . . . 0.151 . 20 . 0.937 0.930 
'X-RAY DIFFRACTION' 1.900 1.972  3752 . 208 3544 100.0000 . 0.143 . 0.188 . 0.140 . . . . . 0.112 . 20 . 0.957 0.946 
'X-RAY DIFFRACTION' 1.972 2.052  3591 . 164 3427 100.0000 . 0.134 . 0.186 . 0.131 . . . . . 0.105 . 20 . 0.965 0.959 
'X-RAY DIFFRACTION' 2.052 2.144  3413 . 157 3256 100.0000 . 0.123 . 0.162 . 0.121 . . . . . 0.098 . 20 . 0.972 0.968 
'X-RAY DIFFRACTION' 2.144 2.248  3318 . 181 3137 100.0000 . 0.130 . 0.186 . 0.126 . . . . . 0.104 . 20 . 0.970 0.955 
'X-RAY DIFFRACTION' 2.248 2.369  3166 . 169 2997 100.0000 . 0.123 . 0.187 . 0.119 . . . . . 0.099 . 20 . 0.972 0.959 
'X-RAY DIFFRACTION' 2.369 2.513  2984 . 132 2852 100.0000 . 0.130 . 0.179 . 0.128 . . . . . 0.106 . 20 . 0.972 0.961 
'X-RAY DIFFRACTION' 2.513 2.686  2803 . 143 2660 100.0000 . 0.130 . 0.177 . 0.127 . . . . . 0.111 . 20 . 0.973 0.966 
'X-RAY DIFFRACTION' 2.686 2.901  2632 . 160 2472 100.0000 . 0.139 . 0.205 . 0.135 . . . . . 0.122 . 20 . 0.972 0.953 
'X-RAY DIFFRACTION' 2.901 3.177  2427 . 123 2304 100.0000 . 0.153 . 0.187 . 0.151 . . . . . 0.142 . 20 . 0.969 0.960 
'X-RAY DIFFRACTION' 3.177 3.552  2223 . 118 2105 100.0000 . 0.162 . 0.195 . 0.160 . . . . . 0.157 . 20 . 0.971 0.961 
'X-RAY DIFFRACTION' 3.552 4.099  1948 . 92  1856 100.0000 . 0.163 . 0.183 . 0.162 . . . . . 0.168 . 20 . 0.971 0.970 
'X-RAY DIFFRACTION' 4.099 5.016  1678 . 69  1609 100.0000 . 0.135 . 0.156 . 0.134 . . . . . 0.150 . 20 . 0.980 0.978 
'X-RAY DIFFRACTION' 5.016 7.074  1333 . 60  1273 100.0000 . 0.188 . 0.251 . 0.185 . . . . . 0.205 . 20 . 0.970 0.963 
'X-RAY DIFFRACTION' 7.074 67.761 793  . 37  756  100.0000 . 0.226 . 0.259 . 0.224 . . . . . 0.256 . 20 . 0.947 0.945 
# 
_struct.entry_id                                   7Z1E 
_struct.title                                      'Nanobody H11-H4 Q98R H100E bound to RBD' 
_struct.pdbx_structure_determination_methodology   ? 
_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        7Z1E 
_struct_keywords.text            'spike, nanobody, high affinity, antiviral protein' 
_struct_keywords.pdbx_keywords   'ANTIVIRAL PROTEIN' 
# 
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 4 ? 
F N N 4 ? 
G N N 5 ? 
H N N 5 ? 
I N N 6 ? 
J N N 6 ? 
# 
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 PRO A 8   ? ASN A 14  ? PRO EEE 337 ASN EEE 343 1 ? 7 
HELX_P HELX_P2  AA2 SER A 20  ? TRP A 24  ? SER EEE 349 TRP EEE 353 5 ? 5 
HELX_P HELX_P3  AA3 TYR A 36  ? ASN A 41  ? TYR EEE 365 ASN EEE 370 1 ? 6 
HELX_P HELX_P4  AA4 SER A 54  ? ASN A 59  ? SER EEE 383 ASN EEE 388 1 ? 6 
HELX_P HELX_P5  AA5 ASP A 76  ? ILE A 81  ? ASP EEE 405 ILE EEE 410 5 ? 6 
HELX_P HELX_P6  AA6 GLY A 87  ? ASN A 93  ? GLY EEE 416 ASN EEE 422 1 ? 7 
HELX_P HELX_P7  AA7 SER A 109 ? SER A 114 ? SER EEE 438 SER EEE 443 1 ? 6 
HELX_P HELX_P8  AA8 GLY A 173 ? TYR A 176 ? GLY EEE 502 TYR EEE 505 5 ? 4 
HELX_P HELX_P9  AA9 ASP B 62  ? LYS B 65  ? ASP FFF 62  LYS FFF 65  5 ? 4 
HELX_P HELX_P10 AB1 LYS B 87  ? THR B 91  ? LYS FFF 87  THR FFF 91  5 ? 5 
HELX_P HELX_P11 AB2 LEU B 105 ? THR B 111 ? LEU FFF 105 THR FFF 111 5 ? 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 ?   ? A CYS 7   SG  ? ? ? 1_555 A CYS 32  SG ? ? EEE CYS 336 EEE CYS 361 1_555 ? ? ? ? ? ? ? 2.053 ? ? 
disulf2 disulf ?   ? A CYS 50  SG  ? ? ? 1_555 A CYS 103 SG ? ? EEE CYS 379 EEE CYS 432 1_555 ? ? ? ? ? ? ? 2.060 ? ? 
disulf3 disulf ?   ? A CYS 62  SG  ? ? ? 1_555 A CYS 196 SG ? ? EEE CYS 391 EEE CYS 525 1_555 ? ? ? ? ? ? ? 2.068 ? ? 
disulf4 disulf ?   ? A CYS 151 SG  ? ? ? 1_555 A CYS 159 SG ? ? EEE CYS 480 EEE CYS 488 1_555 ? ? ? ? ? ? ? 2.055 ? ? 
disulf5 disulf ?   ? B CYS 22  SG  ? ? ? 1_555 B CYS 96  SG ? ? FFF CYS 22  FFF CYS 96  1_555 ? ? ? ? ? ? ? 2.046 ? ? 
covale1 covale one ? A ASN 14  ND2 ? ? ? 1_555 C NAG .   C1 ? ? EEE ASN 343 EEE NAG 601 1_555 ? ? ? ? ? ? ? 1.433 ? 
N-Glycosylation 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 3 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
AA5 ? 4 ? 
AA6 ? 6 ? 
AA7 ? 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 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA5 1 2 ? anti-parallel 
AA5 2 3 ? anti-parallel 
AA5 3 4 ? anti-parallel 
AA6 1 2 ? parallel      
AA6 2 3 ? anti-parallel 
AA6 3 4 ? anti-parallel 
AA6 4 5 ? anti-parallel 
AA6 5 6 ? anti-parallel 
AA7 1 2 ? parallel      
AA7 2 3 ? anti-parallel 
AA7 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 ASN A 25  ? ILE A 29  ? ASN EEE 354 ILE EEE 358 
AA1 2 ASN A 65  ? ARG A 74  ? ASN EEE 394 ARG EEE 403 
AA1 3 PRO A 178 ? GLU A 187 ? PRO EEE 507 GLU EEE 516 
AA1 4 CYS A 103 ? ASN A 108 ? CYS EEE 432 ASN EEE 437 
AA1 5 THR A 47  ? CYS A 50  ? THR EEE 376 CYS EEE 379 
AA2 1 CYS A 32  ? VAL A 33  ? CYS EEE 361 VAL EEE 362 
AA2 2 VAL A 195 ? CYS A 196 ? VAL EEE 524 CYS EEE 525 
AA2 3 CYS A 62  ? PHE A 63  ? CYS EEE 391 PHE EEE 392 
AA3 1 LEU A 123 ? ARG A 125 ? LEU EEE 452 ARG EEE 454 
AA3 2 LEU A 163 ? SER A 165 ? LEU EEE 492 SER EEE 494 
AA4 1 TYR A 144 ? GLN A 145 ? TYR EEE 473 GLN EEE 474 
AA4 2 CYS A 159 ? TYR A 160 ? CYS EEE 488 TYR EEE 489 
AA5 1 GLN B 3   ? GLY B 8   ? GLN FFF 3   GLY FFF 8   
AA5 2 LEU B 18  ? SER B 25  ? LEU FFF 18  SER FFF 25  
AA5 3 THR B 78  ? MET B 83  ? THR FFF 78  MET FFF 83  
AA5 4 PHE B 68  ? ASP B 73  ? PHE FFF 68  ASP FFF 73  
AA6 1 GLY B 10  ? GLN B 13  ? GLY FFF 10  GLN FFF 13  
AA6 2 THR B 121 ? SER B 126 ? THR FFF 121 SER FFF 126 
AA6 3 ALA B 92  ? THR B 99  ? ALA FFF 92  THR FFF 99  
AA6 4 ALA B 33  ? GLN B 39  ? ALA FFF 33  GLN FFF 39  
AA6 5 GLU B 46  ? ARG B 52  ? GLU FFF 46  ARG FFF 52  
AA6 6 ALA B 58  ? TYR B 60  ? ALA FFF 58  TYR FFF 60  
AA7 1 GLY B 10  ? GLN B 13  ? GLY FFF 10  GLN FFF 13  
AA7 2 THR B 121 ? SER B 126 ? THR FFF 121 SER FFF 126 
AA7 3 ALA B 92  ? THR B 99  ? ALA FFF 92  THR FFF 99  
AA7 4 TYR B 116 ? TRP B 117 ? TYR FFF 116 TRP FFF 117 
# 
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 ILE A 29  ? N ILE EEE 358 O VAL A 66  ? O VAL EEE 395 
AA1 2 3 N ILE A 73  ? N ILE EEE 402 O TYR A 179 ? O TYR EEE 508 
AA1 3 4 O VAL A 182 ? O VAL EEE 511 N ILE A 105 ? N ILE EEE 434 
AA1 4 5 O VAL A 104 ? O VAL EEE 433 N LYS A 49  ? N LYS EEE 378 
AA2 1 2 N CYS A 32  ? N CYS EEE 361 O CYS A 196 ? O CYS EEE 525 
AA2 2 3 O VAL A 195 ? O VAL EEE 524 N PHE A 63  ? N PHE EEE 392 
AA3 1 2 N TYR A 124 ? N TYR EEE 453 O GLN A 164 ? O GLN EEE 493 
AA4 1 2 N TYR A 144 ? N TYR EEE 473 O TYR A 160 ? O TYR EEE 489 
AA5 1 2 N VAL B 5   ? N VAL FFF 5   O ALA B 23  ? O ALA FFF 23  
AA5 2 3 N LEU B 18  ? N LEU FFF 18  O MET B 83  ? O MET FFF 83  
AA5 3 4 O GLN B 82  ? O GLN FFF 82  N THR B 69  ? N THR FFF 69  
AA6 1 2 N GLY B 10  ? N GLY FFF 10  O THR B 124 ? O THR FFF 124 
AA6 2 3 O THR B 121 ? O THR FFF 121 N TYR B 94  ? N TYR FFF 94  
AA6 3 4 O TYR B 95  ? O TYR FFF 95  N PHE B 37  ? N PHE FFF 37  
AA6 4 5 N ARG B 38  ? N ARG FFF 38  O GLU B 46  ? O GLU FFF 46  
AA6 5 6 N ALA B 50  ? N ALA FFF 50  O TYR B 59  ? O TYR FFF 59  
AA7 1 2 N GLY B 10  ? N GLY FFF 10  O THR B 124 ? O THR FFF 124 
AA7 2 3 O THR B 121 ? O THR FFF 121 N TYR B 94  ? N TYR FFF 94  
AA7 3 4 N ARG B 98  ? N ARG FFF 98  O TYR B 116 ? O TYR FFF 116 
# 
_atom_sites.entry_id                    7Z1E 
_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]   0.012781 
_atom_sites.fract_transf_matrix[1][2]   0.007379 
_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]   0.014758 
_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]   0.007886 
_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 1.049   
# 
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_site.calc_flag 
ATOM   1    N N   . ASN A 1 5   ? 47.574 -9.344  -13.221 1.000 68.805  0 334 ASN EEE N   1 ? 
ATOM   2    C CA  . ASN A 1 5   ? 46.541 -8.887  -14.201 1.000 66.236  0 334 ASN EEE CA  1 ? 
ATOM   3    C C   . ASN A 1 5   ? 45.372 -8.247  -13.432 1.000 57.059  0 334 ASN EEE C   1 ? 
ATOM   4    O O   . ASN A 1 5   ? 44.239 -8.766  -13.508 1.000 52.768  0 334 ASN EEE O   1 ? 
ATOM   5    C CB  . ASN A 1 5   ? 46.112 -10.042 -15.112 1.000 70.817  0 334 ASN EEE CB  1 ? 
ATOM   6    C CG  . ASN A 1 5   ? 45.309 -9.592  -16.315 1.000 75.891  0 334 ASN EEE CG  1 ? 
ATOM   7    O OD1 . ASN A 1 5   ? 45.108 -8.397  -16.528 1.000 80.747  0 334 ASN EEE OD1 1 ? 
ATOM   8    N ND2 . ASN A 1 5   ? 44.842 -10.544 -17.106 1.000 81.106  0 334 ASN EEE ND2 1 ? 
ATOM   9    N N   . LEU A 1 6   ? 45.644 -7.142  -12.732 1.000 52.436  0 335 LEU EEE N   1 ? 
ATOM   10   C CA  . LEU A 1 6   ? 44.733 -6.524  -11.728 1.000 51.805  0 335 LEU EEE CA  1 ? 
ATOM   11   C C   . LEU A 1 6   ? 43.564 -5.842  -12.442 1.000 47.153  0 335 LEU EEE C   1 ? 
ATOM   12   O O   . LEU A 1 6   ? 43.818 -5.087  -13.391 1.000 45.700  0 335 LEU EEE O   1 ? 
ATOM   13   C CB  . LEU A 1 6   ? 45.524 -5.507  -10.897 1.000 57.465  0 335 LEU EEE CB  1 ? 
ATOM   14   C CG  . LEU A 1 6   ? 44.825 -4.998  -9.638  1.000 64.197  0 335 LEU EEE CG  1 ? 
ATOM   15   C CD1 . LEU A 1 6   ? 44.906 -6.030  -8.518  1.000 68.841  0 335 LEU EEE CD1 1 ? 
ATOM   16   C CD2 . LEU A 1 6   ? 45.418 -3.670  -9.183  1.000 66.958  0 335 LEU EEE CD2 1 ? 
ATOM   17   N N   . CYS A 1 7   ? 42.329 -6.073  -11.988 1.000 42.490  0 336 CYS EEE N   1 ? 
ATOM   18   C CA  . CYS A 1 7   ? 41.136 -5.364  -12.514 1.000 42.069  0 336 CYS EEE CA  1 ? 
ATOM   19   C C   . CYS A 1 7   ? 41.334 -3.867  -12.303 1.000 41.726  0 336 CYS EEE C   1 ? 
ATOM   20   O O   . CYS A 1 7   ? 41.804 -3.442  -11.248 1.000 41.902  0 336 CYS EEE O   1 ? 
ATOM   21   C CB  . CYS A 1 7   ? 39.846 -5.845  -11.864 1.000 41.080  0 336 CYS EEE CB  1 ? 
ATOM   22   S SG  . CYS A 1 7   ? 39.446 -7.563  -12.275 1.000 40.156  0 336 CYS EEE SG  1 ? 
ATOM   23   N N   . PRO A 1 8   ? 41.010 -3.029  -13.312 1.000 44.096  0 337 PRO EEE N   1 ? 
ATOM   24   C CA  . PRO A 1 8   ? 41.277 -1.591  -13.242 1.000 45.087  0 337 PRO EEE CA  1 ? 
ATOM   25   C C   . PRO A 1 8   ? 40.214 -0.792  -12.471 1.000 41.449  0 337 PRO EEE C   1 ? 
ATOM   26   O O   . PRO A 1 8   ? 39.682 0.147   -13.013 1.000 41.853  0 337 PRO EEE O   1 ? 
ATOM   27   C CB  . PRO A 1 8   ? 41.273 -1.218  -14.733 1.000 46.786  0 337 PRO EEE CB  1 ? 
ATOM   28   C CG  . PRO A 1 8   ? 40.201 -2.112  -15.314 1.000 46.731  0 337 PRO EEE CG  1 ? 
ATOM   29   C CD  . PRO A 1 8   ? 40.389 -3.427  -14.587 1.000 46.637  0 337 PRO EEE CD  1 ? 
ATOM   30   N N   . PHE A 1 9   ? 39.931 -1.165  -11.222 1.000 38.861  0 338 PHE EEE N   1 ? 
ATOM   31   C CA  . PHE A 1 9   ? 38.957 -0.445  -10.361 1.000 39.959  0 338 PHE EEE CA  1 ? 
ATOM   32   C C   . PHE A 1 9   ? 39.474 0.970   -10.072 1.000 35.809  0 338 PHE EEE C   1 ? 
ATOM   33   O O   . PHE A 1 9   ? 38.645 1.877   -9.927  1.000 37.087  0 338 PHE EEE O   1 ? 
ATOM   34   C CB  . PHE A 1 9   ? 38.666 -1.227  -9.077  1.000 40.778  0 338 PHE EEE CB  1 ? 
ATOM   35   C CG  . PHE A 1 9   ? 37.798 -2.443  -9.271  1.000 43.169  0 338 PHE EEE CG  1 ? 
ATOM   36   C CD1 . PHE A 1 9   ? 36.502 -2.324  -9.748  1.000 44.801  0 338 PHE EEE CD1 1 ? 
ATOM   37   C CD2 . PHE A 1 9   ? 38.269 -3.706  -8.955  1.000 48.514  0 338 PHE EEE CD2 1 ? 
ATOM   38   C CE1 . PHE A 1 9   ? 35.701 -3.444  -9.916  1.000 46.679  0 338 PHE EEE CE1 1 ? 
ATOM   39   C CE2 . PHE A 1 9   ? 37.470 -4.826  -9.125  1.000 51.064  0 338 PHE EEE CE2 1 ? 
ATOM   40   C CZ  . PHE A 1 9   ? 36.188 -4.693  -9.606  1.000 49.101  0 338 PHE EEE CZ  1 ? 
ATOM   41   N N   . GLY A 1 10  ? 40.797 1.148   -10.002 1.000 37.704  0 339 GLY EEE N   1 ? 
ATOM   42   C CA  . GLY A 1 10  ? 41.445 2.458   -9.788  1.000 39.144  0 339 GLY EEE CA  1 ? 
ATOM   43   C C   . GLY A 1 10  ? 40.973 3.499   -10.794 1.000 38.335  0 339 GLY EEE C   1 ? 
ATOM   44   O O   . GLY A 1 10  ? 40.680 4.632   -10.372 1.000 38.672  0 339 GLY EEE O   1 ? 
ATOM   45   N N   . GLU A 1 11  ? 40.896 3.131   -12.078 1.000 39.390  0 340 GLU EEE N   1 ? 
ATOM   46   C CA  . GLU A 1 11  ? 40.433 4.018   -13.184 1.000 43.156  0 340 GLU EEE CA  1 ? 
ATOM   47   C C   . GLU A 1 11  ? 39.042 4.575   -12.863 1.000 38.781  0 340 GLU EEE C   1 ? 
ATOM   48   O O   . GLU A 1 11  ? 38.758 5.715   -13.254 1.000 39.665  0 340 GLU EEE O   1 ? 
ATOM   49   C CB  . GLU A 1 11  ? 40.343 3.260   -14.510 1.000 47.350  0 340 GLU EEE CB  1 ? 
ATOM   50   C CG  . GLU A 1 11  ? 41.684 2.930   -15.130 1.000 56.007  0 340 GLU EEE CG  1 ? 
ATOM   51   C CD  . GLU A 1 11  ? 41.589 2.185   -16.452 1.000 62.481  0 340 GLU EEE CD  1 ? 
ATOM   52   O OE1 . GLU A 1 11  ? 40.465 2.085   -17.003 1.000 63.316  0 340 GLU EEE OE1 1 ? 
ATOM   53   O OE2 . GLU A 1 11  ? 42.638 1.704   -16.926 1.000 71.343  0 340 GLU EEE OE2 1 ? 
ATOM   54   N N   . VAL A 1 12  ? 38.191 3.778   -12.214 1.000 36.231  0 341 VAL EEE N   1 ? 
ATOM   55   C CA  . VAL A 1 12  ? 36.793 4.174   -11.886 1.000 33.675  0 341 VAL EEE CA  1 ? 
ATOM   56   C C   . VAL A 1 12  ? 36.796 4.996   -10.588 1.000 32.636  0 341 VAL EEE C   1 ? 
ATOM   57   O O   . VAL A 1 12  ? 36.322 6.143   -10.609 1.000 32.752  0 341 VAL EEE O   1 ? 
ATOM   58   C CB  . VAL A 1 12  ? 35.874 2.942   -11.795 1.000 35.009  0 341 VAL EEE CB  1 ? 
ATOM   59   C CG1 . VAL A 1 12  ? 34.456 3.333   -11.412 1.000 34.376  0 341 VAL EEE CG1 1 ? 
ATOM   60   C CG2 . VAL A 1 12  ? 35.881 2.139   -13.095 1.000 35.710  0 341 VAL EEE CG2 1 ? 
ATOM   61   N N   . PHE A 1 13  ? 37.306 4.435   -9.491  1.000 32.477  0 342 PHE EEE N   1 ? 
ATOM   62   C CA  . PHE A 1 13  ? 37.177 5.047   -8.143  1.000 33.133  0 342 PHE EEE CA  1 ? 
ATOM   63   C C   . PHE A 1 13  ? 37.990 6.340   -8.046  1.000 33.900  0 342 PHE EEE C   1 ? 
ATOM   64   O O   . PHE A 1 13  ? 37.576 7.257   -7.303  1.000 34.767  0 342 PHE EEE O   1 ? 
ATOM   65   C CB  . PHE A 1 13  ? 37.579 4.050   -7.055  1.000 33.546  0 342 PHE EEE CB  1 ? 
ATOM   66   C CG  . PHE A 1 13  ? 36.507 3.031   -6.784  1.000 33.656  0 342 PHE EEE CG  1 ? 
ATOM   67   C CD1 . PHE A 1 13  ? 36.424 1.871   -7.536  1.000 33.360  0 342 PHE EEE CD1 1 ? 
ATOM   68   C CD2 . PHE A 1 13  ? 35.547 3.258   -5.810  1.000 34.485  0 342 PHE EEE CD2 1 ? 
ATOM   69   C CE1 . PHE A 1 13  ? 35.425 0.941   -7.295  1.000 34.501  0 342 PHE EEE CE1 1 ? 
ATOM   70   C CE2 . PHE A 1 13  ? 34.547 2.329   -5.571  1.000 32.296  0 342 PHE EEE CE2 1 ? 
ATOM   71   C CZ  . PHE A 1 13  ? 34.490 1.173   -6.314  1.000 33.221  0 342 PHE EEE CZ  1 ? 
ATOM   72   N N   . ASN A 1 14  ? 39.107 6.412   -8.770  1.000 33.617  0 343 ASN EEE N   1 ? 
ATOM   73   C CA  . ASN A 1 14  ? 40.081 7.524   -8.653  1.000 35.168  0 343 ASN EEE CA  1 ? 
ATOM   74   C C   . ASN A 1 14  ? 40.044 8.409   -9.905  1.000 34.475  0 343 ASN EEE C   1 ? 
ATOM   75   O O   . ASN A 1 14  ? 40.949 9.247   -10.045 1.000 35.934  0 343 ASN EEE O   1 ? 
ATOM   76   C CB  . ASN A 1 14  ? 41.477 6.978   -8.358  1.000 38.581  0 343 ASN EEE CB  1 ? 
ATOM   77   C CG  . ASN A 1 14  ? 41.634 6.538   -6.920  1.000 40.303  0 343 ASN EEE CG  1 ? 
ATOM   78   O OD1 . ASN A 1 14  ? 40.964 7.061   -6.033  1.000 41.116  0 343 ASN EEE OD1 1 ? 
ATOM   79   N ND2 . ASN A 1 14  ? 42.509 5.578   -6.683  1.000 43.302  0 343 ASN EEE ND2 1 ? 
ATOM   80   N N   . ALA A 1 15  ? 39.033 8.262   -10.768 1.000 34.629  0 344 ALA EEE N   1 ? 
ATOM   81   C CA  . ALA A 1 15  ? 38.845 9.156   -11.932 1.000 35.148  0 344 ALA EEE CA  1 ? 
ATOM   82   C C   . ALA A 1 15  ? 38.845 10.611  -11.453 1.000 35.768  0 344 ALA EEE C   1 ? 
ATOM   83   O O   . ALA A 1 15  ? 38.214 10.910  -10.424 1.000 36.208  0 344 ALA EEE O   1 ? 
ATOM   84   C CB  . ALA A 1 15  ? 37.577 8.833   -12.671 1.000 33.379  0 344 ALA EEE CB  1 ? 
ATOM   85   N N   . THR A 1 16  ? 39.518 11.494  -12.186 1.000 37.017  0 345 THR EEE N   1 ? 
ATOM   86   C CA  A THR A 1 16  ? 39.577 12.934  -11.824 0.500 38.106  0 345 THR EEE CA  1 ? 
ATOM   87   C CA  B THR A 1 16  ? 39.583 12.953  -11.907 0.500 38.406  0 345 THR EEE CA  1 ? 
ATOM   88   C C   . THR A 1 16  ? 38.174 13.541  -11.968 1.000 37.235  0 345 THR EEE C   1 ? 
ATOM   89   O O   . THR A 1 16  ? 37.780 14.278  -11.047 1.000 36.802  0 345 THR EEE O   1 ? 
ATOM   90   C CB  A THR A 1 16  ? 40.687 13.650  -12.603 0.500 40.615  0 345 THR EEE CB  1 ? 
ATOM   91   C CB  B THR A 1 16  ? 40.464 13.670  -12.940 0.500 38.722  0 345 THR EEE CB  1 ? 
ATOM   92   O OG1 A THR A 1 16  ? 40.486 13.406  -13.994 0.500 43.358  0 345 THR EEE OG1 1 ? 
ATOM   93   O OG1 B THR A 1 16  ? 41.749 13.047  -12.924 0.500 40.483  0 345 THR EEE OG1 1 ? 
ATOM   94   C CG2 A THR A 1 16  ? 42.067 13.185  -12.187 0.500 41.584  0 345 THR EEE CG2 1 ? 
ATOM   95   C CG2 B THR A 1 16  ? 40.580 15.159  -12.691 0.500 39.574  0 345 THR EEE CG2 1 ? 
ATOM   96   N N   . ARG A 1 17  ? 37.458 13.228  -13.047 1.000 36.820  0 346 ARG EEE N   1 ? 
ATOM   97   C CA  . ARG A 1 17  ? 36.081 13.732  -13.278 1.000 36.997  0 346 ARG EEE CA  1 ? 
ATOM   98   C C   . ARG A 1 17  ? 35.116 12.545  -13.305 1.000 31.792  0 346 ARG EEE C   1 ? 
ATOM   99   O O   . ARG A 1 17  ? 35.477 11.481  -13.845 1.000 34.787  0 346 ARG EEE O   1 ? 
ATOM   100  C CB  . ARG A 1 17  ? 36.005 14.551  -14.571 1.000 40.134  0 346 ARG EEE CB  1 ? 
ATOM   101  C CG  . ARG A 1 17  ? 34.620 15.113  -14.879 1.000 45.155  0 346 ARG EEE CG  1 ? 
ATOM   102  C CD  . ARG A 1 17  ? 34.053 16.085  -13.853 1.000 46.054  0 346 ARG EEE CD  1 ? 
ATOM   103  N NE  . ARG A 1 17  ? 32.661 16.423  -14.155 1.000 44.815  0 346 ARG EEE NE  1 ? 
ATOM   104  C CZ  . ARG A 1 17  ? 32.057 17.582  -13.870 1.000 43.960  0 346 ARG EEE CZ  1 ? 
ATOM   105  N NH1 . ARG A 1 17  ? 32.704 18.570  -13.263 1.000 44.302  0 346 ARG EEE NH1 1 ? 
ATOM   106  N NH2 . ARG A 1 17  ? 30.788 17.745  -14.199 1.000 40.851  0 346 ARG EEE NH2 1 ? 
ATOM   107  N N   . PHE A 1 18  ? 33.937 12.736  -12.718 1.000 30.644  0 347 PHE EEE N   1 ? 
ATOM   108  C CA  . PHE A 1 18  ? 32.815 11.772  -12.738 1.000 29.448  0 347 PHE EEE CA  1 ? 
ATOM   109  C C   . PHE A 1 18  ? 31.739 12.319  -13.670 1.000 28.380  0 347 PHE EEE C   1 ? 
ATOM   110  O O   . PHE A 1 18  ? 31.683 13.548  -13.917 1.000 30.134  0 347 PHE EEE O   1 ? 
ATOM   111  C CB  . PHE A 1 18  ? 32.267 11.542  -11.328 1.000 30.729  0 347 PHE EEE CB  1 ? 
ATOM   112  C CG  . PHE A 1 18  ? 32.891 10.385  -10.593 1.000 30.281  0 347 PHE EEE CG  1 ? 
ATOM   113  C CD1 . PHE A 1 18  ? 34.262 10.190  -10.598 1.000 31.617  0 347 PHE EEE CD1 1 ? 
ATOM   114  C CD2 . PHE A 1 18  ? 32.099 9.493   -9.885  1.000 30.343  0 347 PHE EEE CD2 1 ? 
ATOM   115  C CE1 . PHE A 1 18  ? 34.830 9.122   -9.918  1.000 32.772  0 347 PHE EEE CE1 1 ? 
ATOM   116  C CE2 . PHE A 1 18  ? 32.668 8.418   -9.219  1.000 32.107  0 347 PHE EEE CE2 1 ? 
ATOM   117  C CZ  . PHE A 1 18  ? 34.032 8.236   -9.236  1.000 31.657  0 347 PHE EEE CZ  1 ? 
ATOM   118  N N   . ALA A 1 19  ? 30.902 11.417  -14.168 1.000 29.187  0 348 ALA EEE N   1 ? 
ATOM   119  C CA  . ALA A 1 19  ? 29.726 11.751  -14.993 1.000 28.483  0 348 ALA EEE CA  1 ? 
ATOM   120  C C   . ALA A 1 19  ? 28.668 12.460  -14.141 1.000 27.102  0 348 ALA EEE C   1 ? 
ATOM   121  O O   . ALA A 1 19  ? 28.536 12.160  -12.933 1.000 30.404  0 348 ALA EEE O   1 ? 
ATOM   122  C CB  . ALA A 1 19  ? 29.160 10.505  -15.613 1.000 31.295  0 348 ALA EEE CB  1 ? 
ATOM   123  N N   . SER A 1 20  ? 27.886 13.325  -14.781 1.000 25.729  0 349 SER EEE N   1 ? 
ATOM   124  C CA  . SER A 1 20  ? 26.529 13.705  -14.322 1.000 26.435  0 349 SER EEE CA  1 ? 
ATOM   125  C C   . SER A 1 20  ? 25.674 12.436  -14.254 1.000 27.802  0 349 SER EEE C   1 ? 
ATOM   126  O O   . SER A 1 20  ? 25.822 11.536  -15.111 1.000 28.326  0 349 SER EEE O   1 ? 
ATOM   127  C CB  . SER A 1 20  ? 25.889 14.728  -15.223 1.000 28.238  0 349 SER EEE CB  1 ? 
ATOM   128  O OG  . SER A 1 20  ? 26.471 16.009  -15.053 1.000 28.025  0 349 SER EEE OG  1 ? 
ATOM   129  N N   . VAL A 1 21  ? 24.784 12.363  -13.276 1.000 27.924  0 350 VAL EEE N   1 ? 
ATOM   130  C CA  . VAL A 1 21  ? 23.961 11.148  -13.034 1.000 26.929  0 350 VAL EEE CA  1 ? 
ATOM   131  C C   . VAL A 1 21  ? 23.084 10.850  -14.265 1.000 25.975  0 350 VAL EEE C   1 ? 
ATOM   132  O O   . VAL A 1 21  ? 22.958 9.660   -14.592 1.000 26.829  0 350 VAL EEE O   1 ? 
ATOM   133  C CB  . VAL A 1 21  ? 23.160 11.265  -11.725 1.000 27.493  0 350 VAL EEE CB  1 ? 
ATOM   134  C CG1 . VAL A 1 21  ? 22.168 12.421  -11.741 1.000 27.434  0 350 VAL EEE CG1 1 ? 
ATOM   135  C CG2 . VAL A 1 21  ? 22.486 9.946   -11.387 1.000 26.673  0 350 VAL EEE CG2 1 ? 
ATOM   136  N N   . TYR A 1 22  ? 22.541 11.852  -14.971 1.000 26.315  0 351 TYR EEE N   1 ? 
ATOM   137  C CA  . TYR A 1 22  ? 21.667 11.580  -16.150 1.000 26.821  0 351 TYR EEE CA  1 ? 
ATOM   138  C C   . TYR A 1 22  ? 22.507 10.860  -17.214 1.000 26.036  0 351 TYR EEE C   1 ? 
ATOM   139  O O   . TYR A 1 22  ? 21.944 10.056  -17.979 1.000 26.771  0 351 TYR EEE O   1 ? 
ATOM   140  C CB  . TYR A 1 22  ? 21.007 12.851  -16.697 1.000 27.512  0 351 TYR EEE CB  1 ? 
ATOM   141  C CG  . TYR A 1 22  ? 21.885 13.660  -17.616 1.000 27.433  0 351 TYR EEE CG  1 ? 
ATOM   142  C CD1 . TYR A 1 22  ? 22.806 14.569  -17.121 1.000 28.455  0 351 TYR EEE CD1 1 ? 
ATOM   143  C CD2 . TYR A 1 22  ? 21.799 13.512  -18.991 1.000 27.702  0 351 TYR EEE CD2 1 ? 
ATOM   144  C CE1 . TYR A 1 22  ? 23.625 15.307  -17.964 1.000 29.712  0 351 TYR EEE CE1 1 ? 
ATOM   145  C CE2 . TYR A 1 22  ? 22.614 14.234  -19.849 1.000 28.537  0 351 TYR EEE CE2 1 ? 
ATOM   146  C CZ  . TYR A 1 22  ? 23.534 15.130  -19.336 1.000 29.495  0 351 TYR EEE CZ  1 ? 
ATOM   147  O OH  . TYR A 1 22  ? 24.335 15.830  -20.188 1.000 30.418  0 351 TYR EEE OH  1 ? 
ATOM   148  N N   . ALA A 1 23  ? 23.813 11.132  -17.246 1.000 25.884  0 352 ALA EEE N   1 ? 
ATOM   149  C CA  . ALA A 1 23  ? 24.775 10.649  -18.268 1.000 26.809  0 352 ALA EEE CA  1 ? 
ATOM   150  C C   . ALA A 1 23  ? 25.774 9.670   -17.636 1.000 26.882  0 352 ALA EEE C   1 ? 
ATOM   151  O O   . ALA A 1 23  ? 26.943 9.614   -18.073 1.000 26.284  0 352 ALA EEE O   1 ? 
ATOM   152  C CB  . ALA A 1 23  ? 25.467 11.836  -18.889 1.000 28.497  0 352 ALA EEE CB  1 ? 
ATOM   153  N N   . TRP A 1 24  ? 25.316 8.893   -16.653 1.000 27.659  0 353 TRP EEE N   1 ? 
ATOM   154  C CA  . TRP A 1 24  ? 26.168 7.975   -15.858 1.000 26.838  0 353 TRP EEE CA  1 ? 
ATOM   155  C C   . TRP A 1 24  ? 27.048 7.101   -16.761 1.000 27.268  0 353 TRP EEE C   1 ? 
ATOM   156  O O   . TRP A 1 24  ? 26.580 6.637   -17.811 1.000 27.967  0 353 TRP EEE O   1 ? 
ATOM   157  C CB  . TRP A 1 24  ? 25.313 7.134   -14.912 1.000 26.228  0 353 TRP EEE CB  1 ? 
ATOM   158  C CG  . TRP A 1 24  ? 24.211 6.329   -15.539 1.000 26.513  0 353 TRP EEE CG  1 ? 
ATOM   159  C CD1 . TRP A 1 24  ? 22.917 6.712   -15.745 1.000 26.436  0 353 TRP EEE CD1 1 ? 
ATOM   160  C CD2 . TRP A 1 24  ? 24.284 4.957   -15.954 1.000 27.275  0 353 TRP EEE CD2 1 ? 
ATOM   161  N NE1 . TRP A 1 24  ? 22.185 5.680   -16.268 1.000 27.484  0 353 TRP EEE NE1 1 ? 
ATOM   162  C CE2 . TRP A 1 24  ? 22.996 4.590   -16.407 1.000 26.761  0 353 TRP EEE CE2 1 ? 
ATOM   163  C CE3 . TRP A 1 24  ? 25.310 4.005   -15.991 1.000 27.557  0 353 TRP EEE CE3 1 ? 
ATOM   164  C CZ2 . TRP A 1 24  ? 22.710 3.311   -16.881 1.000 26.745  0 353 TRP EEE CZ2 1 ? 
ATOM   165  C CZ3 . TRP A 1 24  ? 25.017 2.740   -16.442 1.000 27.048  0 353 TRP EEE CZ3 1 ? 
ATOM   166  C CH2 . TRP A 1 24  ? 23.739 2.403   -16.892 1.000 28.816  0 353 TRP EEE CH2 1 ? 
ATOM   167  N N   . ASN A 1 25  ? 28.289 6.884   -16.335 1.000 27.995  0 354 ASN EEE N   1 ? 
ATOM   168  C CA  . ASN A 1 25  ? 29.295 6.065   -17.048 1.000 28.774  0 354 ASN EEE CA  1 ? 
ATOM   169  C C   . ASN A 1 25  ? 29.257 4.634   -16.534 1.000 29.664  0 354 ASN EEE C   1 ? 
ATOM   170  O O   . ASN A 1 25  ? 28.969 4.410   -15.341 1.000 29.818  0 354 ASN EEE O   1 ? 
ATOM   171  C CB  . ASN A 1 25  ? 30.706 6.618   -16.880 1.000 30.295  0 354 ASN EEE CB  1 ? 
ATOM   172  C CG  . ASN A 1 25  ? 30.949 7.858   -17.710 1.000 31.065  0 354 ASN EEE CG  1 ? 
ATOM   173  O OD1 . ASN A 1 25  ? 30.440 7.989   -18.830 1.000 33.059  0 354 ASN EEE OD1 1 ? 
ATOM   174  N ND2 . ASN A 1 25  ? 31.736 8.770   -17.166 1.000 33.104  0 354 ASN EEE ND2 1 ? 
ATOM   175  N N   . ARG A 1 26  ? 29.553 3.704   -17.430 1.000 29.958  0 355 ARG EEE N   1 ? 
ATOM   176  C CA  . ARG A 1 26  ? 29.737 2.280   -17.097 1.000 30.573  0 355 ARG EEE CA  1 ? 
ATOM   177  C C   . ARG A 1 26  ? 31.126 1.866   -17.566 1.000 31.749  0 355 ARG EEE C   1 ? 
ATOM   178  O O   . ARG A 1 26  ? 31.490 2.192   -18.725 1.000 32.240  0 355 ARG EEE O   1 ? 
ATOM   179  C CB  . ARG A 1 26  ? 28.661 1.416   -17.752 1.000 30.968  0 355 ARG EEE CB  1 ? 
ATOM   180  C CG  . ARG A 1 26  ? 28.947 -0.074  -17.656 1.000 30.753  0 355 ARG EEE CG  1 ? 
ATOM   181  C CD  . ARG A 1 26  ? 27.711 -0.869  -17.955 1.000 33.013  0 355 ARG EEE CD  1 ? 
ATOM   182  N NE  . ARG A 1 26  ? 26.750 -0.774  -16.872 1.000 30.261  0 355 ARG EEE NE  1 ? 
ATOM   183  C CZ  . ARG A 1 26  ? 25.565 -1.367  -16.872 1.000 36.062  0 355 ARG EEE CZ  1 ? 
ATOM   184  N NH1 . ARG A 1 26  ? 25.187 -2.087  -17.916 1.000 41.381  0 355 ARG EEE NH1 1 ? 
ATOM   185  N NH2 . ARG A 1 26  ? 24.764 -1.244  -15.827 1.000 38.923  0 355 ARG EEE NH2 1 ? 
ATOM   186  N N   . LYS A 1 27  ? 31.873 1.216   -16.679 1.000 32.251  0 356 LYS EEE N   1 ? 
ATOM   187  C CA  . LYS A 1 27  ? 33.109 0.479   -17.025 1.000 33.906  0 356 LYS EEE CA  1 ? 
ATOM   188  C C   . LYS A 1 27  ? 32.785 -1.009  -17.011 1.000 32.913  0 356 LYS EEE C   1 ? 
ATOM   189  O O   . LYS A 1 27  ? 32.273 -1.504  -15.988 1.000 31.439  0 356 LYS EEE O   1 ? 
ATOM   190  C CB  . LYS A 1 27  ? 34.245 0.771   -16.044 1.000 36.437  0 356 LYS EEE CB  1 ? 
ATOM   191  C CG  . LYS A 1 27  ? 35.589 0.194   -16.464 1.000 41.517  0 356 LYS EEE CG  1 ? 
ATOM   192  C CD  . LYS A 1 27  ? 36.189 0.933   -17.642 1.000 46.838  0 356 LYS EEE CD  1 ? 
ATOM   193  C CE  . LYS A 1 27  ? 37.087 0.078   -18.509 1.000 55.138  0 356 LYS EEE CE  1 ? 
ATOM   194  N NZ  . LYS A 1 27  ? 38.378 -0.192  -17.842 1.000 59.932  0 356 LYS EEE NZ  1 ? 
ATOM   195  N N   . ARG A 1 28  ? 33.086 -1.692  -18.109 1.000 31.992  0 357 ARG EEE N   1 ? 
ATOM   196  C CA  . ARG A 1 28  ? 33.026 -3.168  -18.173 1.000 33.640  0 357 ARG EEE CA  1 ? 
ATOM   197  C C   . ARG A 1 28  ? 34.375 -3.700  -17.696 1.000 32.748  0 357 ARG EEE C   1 ? 
ATOM   198  O O   . ARG A 1 28  ? 35.411 -3.313  -18.267 1.000 35.425  0 357 ARG EEE O   1 ? 
ATOM   199  C CB  . ARG A 1 28  ? 32.688 -3.638  -19.588 1.000 35.693  0 357 ARG EEE CB  1 ? 
ATOM   200  C CG  . ARG A 1 28  ? 32.618 -5.150  -19.733 1.000 39.073  0 357 ARG EEE CG  1 ? 
ATOM   201  C CD  . ARG A 1 28  ? 32.694 -5.551  -21.192 1.000 41.954  0 357 ARG EEE CD  1 ? 
ATOM   202  N NE  . ARG A 1 28  ? 33.005 -6.962  -21.292 1.000 42.761  0 357 ARG EEE NE  1 ? 
ATOM   203  C CZ  . ARG A 1 28  ? 33.725 -7.521  -22.239 1.000 42.566  0 357 ARG EEE CZ  1 ? 
ATOM   204  N NH1 . ARG A 1 28  ? 34.226 -6.796  -23.228 1.000 44.788  0 357 ARG EEE NH1 1 ? 
ATOM   205  N NH2 . ARG A 1 28  ? 33.923 -8.823  -22.197 1.000 45.277  0 357 ARG EEE NH2 1 ? 
ATOM   206  N N   . ILE A 1 29  ? 34.340 -4.543  -16.671 1.000 33.132  0 358 ILE EEE N   1 ? 
ATOM   207  C CA  . ILE A 1 29  ? 35.527 -5.214  -16.069 1.000 36.014  0 358 ILE EEE CA  1 ? 
ATOM   208  C C   . ILE A 1 29  ? 35.483 -6.677  -16.513 1.000 35.455  0 358 ILE EEE C   1 ? 
ATOM   209  O O   . ILE A 1 29  ? 34.450 -7.327  -16.283 1.000 37.814  0 358 ILE EEE O   1 ? 
ATOM   210  C CB  . ILE A 1 29  ? 35.495 -5.079  -14.532 1.000 36.758  0 358 ILE EEE CB  1 ? 
ATOM   211  C CG1 . ILE A 1 29  ? 35.409 -3.619  -14.075 1.000 40.798  0 358 ILE EEE CG1 1 ? 
ATOM   212  C CG2 . ILE A 1 29  ? 36.667 -5.816  -13.900 1.000 38.894  0 358 ILE EEE CG2 1 ? 
ATOM   213  C CD1 . ILE A 1 29  ? 36.688 -2.843  -14.209 1.000 43.804  0 358 ILE EEE CD1 1 ? 
ATOM   214  N N   . SER A 1 30  ? 36.539 -7.173  -17.151 1.000 37.986  0 359 SER EEE N   1 ? 
ATOM   215  C CA  . SER A 1 30  ? 36.613 -8.584  -17.605 1.000 39.697  0 359 SER EEE CA  1 ? 
ATOM   216  C C   . SER A 1 30  ? 38.067 -9.045  -17.630 1.000 40.744  0 359 SER EEE C   1 ? 
ATOM   217  O O   . SER A 1 30  ? 38.975 -8.195  -17.727 1.000 42.677  0 359 SER EEE O   1 ? 
ATOM   218  C CB  . SER A 1 30  ? 35.945 -8.780  -18.948 1.000 42.116  0 359 SER EEE CB  1 ? 
ATOM   219  O OG  . SER A 1 30  ? 36.655 -8.101  -19.967 1.000 45.309  0 359 SER EEE OG  1 ? 
ATOM   220  N N   . ASN A 1 31  ? 38.266 -10.353 -17.508 1.000 43.191  0 360 ASN EEE N   1 ? 
ATOM   221  C CA  . ASN A 1 31  ? 39.556 -11.002 -17.834 1.000 47.490  0 360 ASN EEE CA  1 ? 
ATOM   222  C C   . ASN A 1 31  ? 40.631 -10.414 -16.916 1.000 44.012  0 360 ASN EEE C   1 ? 
ATOM   223  O O   . ASN A 1 31  ? 41.636 -9.901  -17.427 1.000 45.324  0 360 ASN EEE O   1 ? 
ATOM   224  C CB  . ASN A 1 31  ? 39.873 -10.816 -19.322 1.000 52.747  0 360 ASN EEE CB  1 ? 
ATOM   225  C CG  . ASN A 1 31  ? 40.264 -12.106 -20.004 1.000 62.095  0 360 ASN EEE CG  1 ? 
ATOM   226  O OD1 . ASN A 1 31  ? 39.780 -12.399 -21.096 1.000 77.979  0 360 ASN EEE OD1 1 ? 
ATOM   227  N ND2 . ASN A 1 31  ? 41.117 -12.889 -19.362 1.000 64.877  0 360 ASN EEE ND2 1 ? 
ATOM   228  N N   . CYS A 1 32  ? 40.408 -10.448 -15.602 1.000 44.101  0 361 CYS EEE N   1 ? 
ATOM   229  C CA  . CYS A 1 32  ? 41.326 -9.819  -14.618 1.000 42.183  0 361 CYS EEE CA  1 ? 
ATOM   230  C C   . CYS A 1 32  ? 41.086 -10.369 -13.210 1.000 42.001  0 361 CYS EEE C   1 ? 
ATOM   231  O O   . CYS A 1 32  ? 40.032 -10.997 -12.965 1.000 41.239  0 361 CYS EEE O   1 ? 
ATOM   232  C CB  . CYS A 1 32  ? 41.193 -8.297  -14.642 1.000 42.792  0 361 CYS EEE CB  1 ? 
ATOM   233  S SG  . CYS A 1 32  ? 39.516 -7.686  -14.323 1.000 41.783  0 361 CYS EEE SG  1 ? 
ATOM   234  N N   . VAL A 1 33  ? 42.055 -10.133 -12.326 1.000 43.062  0 362 VAL EEE N   1 ? 
ATOM   235  C CA  . VAL A 1 33  ? 41.997 -10.513 -10.887 1.000 43.888  0 362 VAL EEE CA  1 ? 
ATOM   236  C C   . VAL A 1 33  ? 41.505 -9.295  -10.108 1.000 42.317  0 362 VAL EEE C   1 ? 
ATOM   237  O O   . VAL A 1 33  ? 42.176 -8.245  -10.183 1.000 43.851  0 362 VAL EEE O   1 ? 
ATOM   238  C CB  . VAL A 1 33  ? 43.365 -10.998 -10.378 1.000 47.368  0 362 VAL EEE CB  1 ? 
ATOM   239  C CG1 . VAL A 1 33  ? 43.338 -11.272 -8.883  1.000 49.196  0 362 VAL EEE CG1 1 ? 
ATOM   240  C CG2 . VAL A 1 33  ? 43.842 -12.222 -11.143 1.000 50.998  0 362 VAL EEE CG2 1 ? 
ATOM   241  N N   . ALA A 1 34  ? 40.375 -9.441  -9.410  1.000 44.759  0 363 ALA EEE N   1 ? 
ATOM   242  C CA  . ALA A 1 34  ? 39.702 -8.372  -8.636  1.000 45.663  0 363 ALA EEE CA  1 ? 
ATOM   243  C C   . ALA A 1 34  ? 40.131 -8.457  -7.173  1.000 48.479  0 363 ALA EEE C   1 ? 
ATOM   244  O O   . ALA A 1 34  ? 39.788 -9.460  -6.515  1.000 53.184  0 363 ALA EEE O   1 ? 
ATOM   245  C CB  . ALA A 1 34  ? 38.208 -8.501  -8.764  1.000 46.831  0 363 ALA EEE CB  1 ? 
ATOM   246  N N   . ASP A 1 35  ? 40.846 -7.436  -6.694  1.000 52.165  0 364 ASP EEE N   1 ? 
ATOM   247  C CA  . ASP A 1 35  ? 41.234 -7.290  -5.269  1.000 53.069  0 364 ASP EEE CA  1 ? 
ATOM   248  C C   . ASP A 1 35  ? 40.178 -6.428  -4.567  1.000 48.835  0 364 ASP EEE C   1 ? 
ATOM   249  O O   . ASP A 1 35  ? 40.385 -5.200  -4.438  1.000 49.756  0 364 ASP EEE O   1 ? 
ATOM   250  C CB  . ASP A 1 35  ? 42.648 -6.719  -5.145  1.000 59.332  0 364 ASP EEE CB  1 ? 
ATOM   251  C CG  . ASP A 1 35  ? 43.210 -6.785  -3.736  1.000 63.416  0 364 ASP EEE CG  1 ? 
ATOM   252  O OD1 . ASP A 1 35  ? 42.511 -7.319  -2.846  1.000 69.389  0 364 ASP EEE OD1 1 ? 
ATOM   253  O OD2 . ASP A 1 35  ? 44.344 -6.306  -3.543  1.000 66.861  0 364 ASP EEE OD2 1 ? 
ATOM   254  N N   . TYR A 1 36  ? 39.088 -7.056  -4.122  1.000 45.376  0 365 TYR EEE N   1 ? 
ATOM   255  C CA  . TYR A 1 36  ? 37.931 -6.365  -3.497  1.000 43.508  0 365 TYR EEE CA  1 ? 
ATOM   256  C C   . TYR A 1 36  ? 38.340 -5.814  -2.118  1.000 44.620  0 365 TYR EEE C   1 ? 
ATOM   257  O O   . TYR A 1 36  ? 37.678 -4.865  -1.649  1.000 44.791  0 365 TYR EEE O   1 ? 
ATOM   258  C CB  . TYR A 1 36  ? 36.717 -7.297  -3.444  1.000 44.164  0 365 TYR EEE CB  1 ? 
ATOM   259  C CG  . TYR A 1 36  ? 36.196 -7.743  -4.788  1.000 44.848  0 365 TYR EEE CG  1 ? 
ATOM   260  C CD1 . TYR A 1 36  ? 35.510 -6.871  -5.626  1.000 42.903  0 365 TYR EEE CD1 1 ? 
ATOM   261  C CD2 . TYR A 1 36  ? 36.392 -9.043  -5.229  1.000 45.626  0 365 TYR EEE CD2 1 ? 
ATOM   262  C CE1 . TYR A 1 36  ? 35.031 -7.282  -6.857  1.000 46.149  0 365 TYR EEE CE1 1 ? 
ATOM   263  C CE2 . TYR A 1 36  ? 35.927 -9.465  -6.464  1.000 46.874  0 365 TYR EEE CE2 1 ? 
ATOM   264  C CZ  . TYR A 1 36  ? 35.241 -8.583  -7.278  1.000 47.491  0 365 TYR EEE CZ  1 ? 
ATOM   265  O OH  . TYR A 1 36  ? 34.777 -9.001  -8.489  1.000 50.092  0 365 TYR EEE OH  1 ? 
ATOM   266  N N   . SER A 1 37  ? 39.404 -6.361  -1.505  1.000 45.259  0 366 SER EEE N   1 ? 
ATOM   267  C CA  . SER A 1 37  ? 39.912 -5.970  -0.160  1.000 43.376  0 366 SER EEE CA  1 ? 
ATOM   268  C C   . SER A 1 37  ? 40.249 -4.479  -0.132  1.000 41.746  0 366 SER EEE C   1 ? 
ATOM   269  O O   . SER A 1 37  ? 39.930 -3.825  0.876   1.000 44.494  0 366 SER EEE O   1 ? 
ATOM   270  C CB  . SER A 1 37  ? 41.097 -6.810  0.275   1.000 46.943  0 366 SER EEE CB  1 ? 
ATOM   271  O OG  . SER A 1 37  ? 42.285 -6.430  -0.405  1.000 48.804  0 366 SER EEE OG  1 ? 
ATOM   272  N N   . VAL A 1 38  ? 40.843 -3.973  -1.211  1.000 42.549  0 367 VAL EEE N   1 ? 
ATOM   273  C CA  . VAL A 1 38  ? 41.248 -2.547  -1.377  1.000 43.618  0 367 VAL EEE CA  1 ? 
ATOM   274  C C   . VAL A 1 38  ? 40.021 -1.651  -1.156  1.000 43.411  0 367 VAL EEE C   1 ? 
ATOM   275  O O   . VAL A 1 38  ? 40.198 -0.572  -0.559  1.000 45.826  0 367 VAL EEE O   1 ? 
ATOM   276  C CB  . VAL A 1 38  ? 41.893 -2.335  -2.763  1.000 50.706  0 367 VAL EEE CB  1 ? 
ATOM   277  C CG1 . VAL A 1 38  ? 42.132 -0.868  -3.086  1.000 55.816  0 367 VAL EEE CG1 1 ? 
ATOM   278  C CG2 . VAL A 1 38  ? 43.189 -3.124  -2.892  1.000 55.251  0 367 VAL EEE CG2 1 ? 
ATOM   279  N N   . LEU A 1 39  ? 38.832 -2.076  -1.617  1.000 40.138  0 368 LEU EEE N   1 ? 
ATOM   280  C CA  . LEU A 1 39  ? 37.551 -1.360  -1.393  1.000 38.424  0 368 LEU EEE CA  1 ? 
ATOM   281  C C   . LEU A 1 39  ? 37.057 -1.611  0.048   1.000 38.305  0 368 LEU EEE C   1 ? 
ATOM   282  O O   . LEU A 1 39  ? 36.948 -0.641  0.824   1.000 42.134  0 368 LEU EEE O   1 ? 
ATOM   283  C CB  . LEU A 1 39  ? 36.523 -1.806  -2.446  1.000 39.472  0 368 LEU EEE CB  1 ? 
ATOM   284  C CG  . LEU A 1 39  ? 36.969 -1.700  -3.910  1.000 38.413  0 368 LEU EEE CG  1 ? 
ATOM   285  C CD1 . LEU A 1 39  ? 35.884 -2.181  -4.862  1.000 38.508  0 368 LEU EEE CD1 1 ? 
ATOM   286  C CD2 . LEU A 1 39  ? 37.364 -0.274  -4.255  1.000 38.917  0 368 LEU EEE CD2 1 ? 
ATOM   287  N N   . TYR A 1 40  ? 36.785 -2.853  0.439   1.000 40.743  0 369 TYR EEE N   1 ? 
ATOM   288  C CA  . TYR A 1 40  ? 36.065 -3.124  1.715   1.000 42.782  0 369 TYR EEE CA  1 ? 
ATOM   289  C C   . TYR A 1 40  ? 36.934 -2.776  2.939   1.000 39.910  0 369 TYR EEE C   1 ? 
ATOM   290  O O   . TYR A 1 40  ? 36.344 -2.572  4.001   1.000 44.889  0 369 TYR EEE O   1 ? 
ATOM   291  C CB  . TYR A 1 40  ? 35.455 -4.527  1.747   1.000 48.215  0 369 TYR EEE CB  1 ? 
ATOM   292  C CG  . TYR A 1 40  ? 36.392 -5.707  1.731   1.000 57.979  0 369 TYR EEE CG  1 ? 
ATOM   293  C CD1 . TYR A 1 40  ? 37.079 -6.107  2.870   1.000 62.655  0 369 TYR EEE CD1 1 ? 
ATOM   294  C CD2 . TYR A 1 40  ? 36.507 -6.498  0.597   1.000 65.147  0 369 TYR EEE CD2 1 ? 
ATOM   295  C CE1 . TYR A 1 40  ? 37.907 -7.222  2.859   1.000 67.850  0 369 TYR EEE CE1 1 ? 
ATOM   296  C CE2 . TYR A 1 40  ? 37.321 -7.620  0.573   1.000 66.753  0 369 TYR EEE CE2 1 ? 
ATOM   297  C CZ  . TYR A 1 40  ? 38.026 -7.982  1.706   1.000 67.227  0 369 TYR EEE CZ  1 ? 
ATOM   298  O OH  . TYR A 1 40  ? 38.835 -9.080  1.667   1.000 70.454  0 369 TYR EEE OH  1 ? 
ATOM   299  N N   . ASN A 1 41  ? 38.259 -2.645  2.811   1.000 43.137  0 370 ASN EEE N   1 ? 
ATOM   300  C CA  . ASN A 1 41  ? 39.140 -2.227  3.940   1.000 42.390  0 370 ASN EEE CA  1 ? 
ATOM   301  C C   . ASN A 1 41  ? 39.331 -0.707  3.973   1.000 42.393  0 370 ASN EEE C   1 ? 
ATOM   302  O O   . ASN A 1 41  ? 39.970 -0.240  4.930   1.000 46.147  0 370 ASN EEE O   1 ? 
ATOM   303  C CB  . ASN A 1 41  ? 40.514 -2.898  3.895   1.000 45.509  0 370 ASN EEE CB  1 ? 
ATOM   304  C CG  . ASN A 1 41  ? 40.432 -4.379  4.176   1.000 48.957  0 370 ASN EEE CG  1 ? 
ATOM   305  O OD1 . ASN A 1 41  ? 39.433 -4.852  4.713   1.000 50.877  0 370 ASN EEE OD1 1 ? 
ATOM   306  N ND2 . ASN A 1 41  ? 41.473 -5.112  3.819   1.000 54.232  0 370 ASN EEE ND2 1 ? 
ATOM   307  N N   . SER A 1 42  ? 38.819 0.044   2.994   1.000 43.361  0 371 SER EEE N   1 ? 
ATOM   308  C CA  . SER A 1 42  ? 39.089 1.501   2.875   1.000 41.349  0 371 SER EEE CA  1 ? 
ATOM   309  C C   . SER A 1 42  ? 38.313 2.271   3.949   1.000 39.646  0 371 SER EEE C   1 ? 
ATOM   310  O O   . SER A 1 42  ? 37.183 1.848   4.281   1.000 37.154  0 371 SER EEE O   1 ? 
ATOM   311  C CB  . SER A 1 42  ? 38.774 2.036   1.497   1.000 44.970  0 371 SER EEE CB  1 ? 
ATOM   312  O OG  . SER A 1 42  ? 38.984 3.444   1.457   1.000 47.263  0 371 SER EEE OG  1 ? 
ATOM   313  N N   . ALA A 1 43  ? 38.918 3.357   4.455   1.000 38.842  0 372 ALA EEE N   1 ? 
ATOM   314  C CA  . ALA A 1 43  ? 38.289 4.397   5.302   1.000 40.060  0 372 ALA EEE CA  1 ? 
ATOM   315  C C   . ALA A 1 43  ? 37.743 5.544   4.434   1.000 39.199  0 372 ALA EEE C   1 ? 
ATOM   316  O O   . ALA A 1 43  ? 37.302 6.567   5.003   1.000 43.311  0 372 ALA EEE O   1 ? 
ATOM   317  C CB  . ALA A 1 43  ? 39.304 4.922   6.297   1.000 40.412  0 372 ALA EEE CB  1 ? 
ATOM   318  N N   . SER A 1 44  ? 37.787 5.421   3.106   1.000 39.541  0 373 SER EEE N   1 ? 
ATOM   319  C CA  . SER A 1 44  ? 37.463 6.546   2.196   1.000 41.221  0 373 SER EEE CA  1 ? 
ATOM   320  C C   . SER A 1 44  ? 35.948 6.662   1.992   1.000 39.870  0 373 SER EEE C   1 ? 
ATOM   321  O O   . SER A 1 44  ? 35.516 7.724   1.501   1.000 43.576  0 373 SER EEE O   1 ? 
ATOM   322  C CB  . SER A 1 44  ? 38.182 6.411   0.877   1.000 45.476  0 373 SER EEE CB  1 ? 
ATOM   323  O OG  . SER A 1 44  ? 39.586 6.394   1.076   1.000 48.300  0 373 SER EEE OG  1 ? 
ATOM   324  N N   . PHE A 1 45  ? 35.166 5.626   2.318   1.000 32.456  0 374 PHE EEE N   1 ? 
ATOM   325  C CA  . PHE A 1 45  ? 33.746 5.526   1.883   1.000 32.108  0 374 PHE EEE CA  1 ? 
ATOM   326  C C   . PHE A 1 45  ? 32.785 5.801   3.042   1.000 32.380  0 374 PHE EEE C   1 ? 
ATOM   327  O O   . PHE A 1 45  ? 33.045 5.346   4.163   1.000 34.977  0 374 PHE EEE O   1 ? 
ATOM   328  C CB  . PHE A 1 45  ? 33.471 4.154   1.270   1.000 32.513  0 374 PHE EEE CB  1 ? 
ATOM   329  C CG  . PHE A 1 45  ? 34.416 3.784   0.158   1.000 30.636  0 374 PHE EEE CG  1 ? 
ATOM   330  C CD1 . PHE A 1 45  ? 34.546 4.598   -0.954  1.000 31.298  0 374 PHE EEE CD1 1 ? 
ATOM   331  C CD2 . PHE A 1 45  ? 35.174 2.629   0.225   1.000 33.491  0 374 PHE EEE CD2 1 ? 
ATOM   332  C CE1 . PHE A 1 45  ? 35.407 4.252   -1.983  1.000 33.185  0 374 PHE EEE CE1 1 ? 
ATOM   333  C CE2 . PHE A 1 45  ? 36.053 2.298   -0.792  1.000 33.421  0 374 PHE EEE CE2 1 ? 
ATOM   334  C CZ  . PHE A 1 45  ? 36.160 3.106   -1.899  1.000 33.312  0 374 PHE EEE CZ  1 ? 
ATOM   335  N N   . SER A 1 46  ? 31.686 6.507   2.760   1.000 32.740  0 375 SER EEE N   1 ? 
ATOM   336  C CA  . SER A 1 46  ? 30.584 6.746   3.728   1.000 36.390  0 375 SER EEE CA  1 ? 
ATOM   337  C C   . SER A 1 46  ? 29.452 5.738   3.502   1.000 34.590  0 375 SER EEE C   1 ? 
ATOM   338  O O   . SER A 1 46  ? 28.733 5.459   4.458   1.000 38.227  0 375 SER EEE O   1 ? 
ATOM   339  C CB  . SER A 1 46  ? 30.084 8.163   3.680   1.000 39.826  0 375 SER EEE CB  1 ? 
ATOM   340  O OG  . SER A 1 46  ? 29.913 8.599   2.353   1.000 42.393  0 375 SER EEE OG  1 ? 
ATOM   341  N N   . THR A 1 47  ? 29.297 5.220   2.283   1.000 32.847  0 376 THR EEE N   1 ? 
ATOM   342  C CA  . THR A 1 47  ? 28.311 4.160   1.946   1.000 33.518  0 376 THR EEE CA  1 ? 
ATOM   343  C C   . THR A 1 47  ? 29.062 2.985   1.322   1.000 32.877  0 376 THR EEE C   1 ? 
ATOM   344  O O   . THR A 1 47  ? 29.916 3.213   0.464   1.000 33.995  0 376 THR EEE O   1 ? 
ATOM   345  C CB  . THR A 1 47  ? 27.219 4.656   0.992   1.000 32.874  0 376 THR EEE CB  1 ? 
ATOM   346  O OG1 . THR A 1 47  ? 26.534 5.744   1.606   1.000 34.665  0 376 THR EEE OG1 1 ? 
ATOM   347  C CG2 . THR A 1 47  ? 26.221 3.579   0.623   1.000 35.546  0 376 THR EEE CG2 1 ? 
ATOM   348  N N   . PHE A 1 48  ? 28.781 1.776   1.789   1.000 33.527  0 377 PHE EEE N   1 ? 
ATOM   349  C CA  . PHE A 1 48  ? 29.306 0.522   1.200   1.000 34.768  0 377 PHE EEE CA  1 ? 
ATOM   350  C C   . PHE A 1 48  ? 28.314 -0.583  1.558   1.000 36.398  0 377 PHE EEE C   1 ? 
ATOM   351  O O   . PHE A 1 48  ? 28.520 -1.287  2.567   1.000 37.712  0 377 PHE EEE O   1 ? 
ATOM   352  C CB  . PHE A 1 48  ? 30.742 0.276   1.663   1.000 36.696  0 377 PHE EEE CB  1 ? 
ATOM   353  C CG  . PHE A 1 48  ? 31.562 -0.602  0.753   1.000 36.957  0 377 PHE EEE CG  1 ? 
ATOM   354  C CD1 . PHE A 1 48  ? 31.045 -1.777  0.230   1.000 39.076  0 377 PHE EEE CD1 1 ? 
ATOM   355  C CD2 . PHE A 1 48  ? 32.859 -0.253  0.426   1.000 40.427  0 377 PHE EEE CD2 1 ? 
ATOM   356  C CE1 . PHE A 1 48  ? 31.811 -2.586  -0.596  1.000 38.863  0 377 PHE EEE CE1 1 ? 
ATOM   357  C CE2 . PHE A 1 48  ? 33.617 -1.055  -0.414  1.000 44.128  0 377 PHE EEE CE2 1 ? 
ATOM   358  C CZ  . PHE A 1 48  ? 33.094 -2.222  -0.918  1.000 39.866  0 377 PHE EEE CZ  1 ? 
ATOM   359  N N   . LYS A 1 49  ? 27.237 -0.661  0.772   1.000 37.041  0 378 LYS EEE N   1 ? 
ATOM   360  C CA  . LYS A 1 49  ? 26.136 -1.636  0.950   1.000 37.610  0 378 LYS EEE CA  1 ? 
ATOM   361  C C   . LYS A 1 49  ? 26.220 -2.673  -0.169  1.000 37.841  0 378 LYS EEE C   1 ? 
ATOM   362  O O   . LYS A 1 49  ? 26.203 -2.267  -1.342  1.000 39.031  0 378 LYS EEE O   1 ? 
ATOM   363  C CB  . LYS A 1 49  ? 24.766 -0.966  0.869   1.000 43.922  0 378 LYS EEE CB  1 ? 
ATOM   364  C CG  . LYS A 1 49  ? 24.407 0.009   1.976   1.000 48.122  0 378 LYS EEE CG  1 ? 
ATOM   365  C CD  . LYS A 1 49  ? 22.905 0.078   2.153   1.000 51.708  0 378 LYS EEE CD  1 ? 
ATOM   366  C CE  . LYS A 1 49  ? 22.454 1.257   2.979   1.000 53.629  0 378 LYS EEE CE  1 ? 
ATOM   367  N NZ  . LYS A 1 49  ? 20.982 1.261   3.140   1.000 47.198  0 378 LYS EEE NZ  1 ? 
ATOM   368  N N   . CYS A 1 50  ? 26.305 -3.957  0.178   1.000 37.846  0 379 CYS EEE N   1 ? 
ATOM   369  C CA  . CYS A 1 50  ? 26.221 -5.069  -0.803  1.000 36.596  0 379 CYS EEE CA  1 ? 
ATOM   370  C C   . CYS A 1 50  ? 24.973 -5.889  -0.490  1.000 37.942  0 379 CYS EEE C   1 ? 
ATOM   371  O O   . CYS A 1 50  ? 24.760 -6.219  0.687   1.000 39.755  0 379 CYS EEE O   1 ? 
ATOM   372  C CB  . CYS A 1 50  ? 27.484 -5.916  -0.806  1.000 39.471  0 379 CYS EEE CB  1 ? 
ATOM   373  S SG  . CYS A 1 50  ? 28.971 -4.945  -1.152  1.000 41.121  0 379 CYS EEE SG  1 ? 
ATOM   374  N N   . TYR A 1 51  ? 24.177 -6.170  -1.519  1.000 38.328  0 380 TYR EEE N   1 ? 
ATOM   375  C CA  . TYR A 1 51  ? 22.847 -6.819  -1.425  1.000 41.469  0 380 TYR EEE CA  1 ? 
ATOM   376  C C   . TYR A 1 51  ? 23.007 -8.296  -1.791  1.000 48.713  0 380 TYR EEE C   1 ? 
ATOM   377  O O   . TYR A 1 51  ? 23.328 -8.585  -2.940  1.000 62.276  0 380 TYR EEE O   1 ? 
ATOM   378  C CB  . TYR A 1 51  ? 21.858 -6.080  -2.327  1.000 39.281  0 380 TYR EEE CB  1 ? 
ATOM   379  C CG  . TYR A 1 51  ? 21.581 -4.659  -1.908  1.000 36.922  0 380 TYR EEE CG  1 ? 
ATOM   380  C CD1 . TYR A 1 51  ? 22.440 -3.623  -2.248  1.000 35.487  0 380 TYR EEE CD1 1 ? 
ATOM   381  C CD2 . TYR A 1 51  ? 20.455 -4.349  -1.163  1.000 38.319  0 380 TYR EEE CD2 1 ? 
ATOM   382  C CE1 . TYR A 1 51  ? 22.191 -2.319  -1.851  1.000 34.444  0 380 TYR EEE CE1 1 ? 
ATOM   383  C CE2 . TYR A 1 51  ? 20.197 -3.051  -0.752  1.000 38.353  0 380 TYR EEE CE2 1 ? 
ATOM   384  C CZ  . TYR A 1 51  ? 21.066 -2.031  -1.097  1.000 35.343  0 380 TYR EEE CZ  1 ? 
ATOM   385  O OH  . TYR A 1 51  ? 20.797 -0.751  -0.707  1.000 36.666  0 380 TYR EEE OH  1 ? 
ATOM   386  N N   . GLY A 1 52  ? 22.837 -9.196  -0.827  1.000 59.256  0 381 GLY EEE N   1 ? 
ATOM   387  C CA  . GLY A 1 52  ? 22.959 -10.653 -1.047  1.000 68.349  0 381 GLY EEE CA  1 ? 
ATOM   388  C C   . GLY A 1 52  ? 24.273 -11.018 -1.722  1.000 68.241  0 381 GLY EEE C   1 ? 
ATOM   389  O O   . GLY A 1 52  ? 24.237 -11.578 -2.825  1.000 68.278  0 381 GLY EEE O   1 ? 
ATOM   390  N N   . VAL A 1 53  ? 25.389 -10.694 -1.069  1.000 69.761  0 382 VAL EEE N   1 ? 
ATOM   391  C CA  . VAL A 1 53  ? 26.790 -10.986 -1.498  1.000 66.178  0 382 VAL EEE CA  1 ? 
ATOM   392  C C   . VAL A 1 53  ? 27.696 -10.150 -0.599  1.000 58.227  0 382 VAL EEE C   1 ? 
ATOM   393  O O   . VAL A 1 53  ? 27.349 -8.983  -0.345  1.000 53.772  0 382 VAL EEE O   1 ? 
ATOM   394  C CB  . VAL A 1 53  ? 27.065 -10.663 -2.979  1.000 69.569  0 382 VAL EEE CB  1 ? 
ATOM   395  C CG1 . VAL A 1 53  ? 27.109 -9.164  -3.244  1.000 69.381  0 382 VAL EEE CG1 1 ? 
ATOM   396  C CG2 . VAL A 1 53  ? 28.354 -11.318 -3.451  1.000 76.433  0 382 VAL EEE CG2 1 ? 
ATOM   397  N N   . SER A 1 54  ? 28.789 -10.720 -0.102  1.000 54.095  0 383 SER EEE N   1 ? 
ATOM   398  C CA  . SER A 1 54  ? 29.767 -9.962  0.711   1.000 50.517  0 383 SER EEE CA  1 ? 
ATOM   399  C C   . SER A 1 54  ? 31.079 -9.877  -0.051  1.000 51.597  0 383 SER EEE C   1 ? 
ATOM   400  O O   . SER A 1 54  ? 31.518 -10.870 -0.637  1.000 44.939  0 383 SER EEE O   1 ? 
ATOM   401  C CB  . SER A 1 54  ? 29.936 -10.528 2.094   1.000 56.132  0 383 SER EEE CB  1 ? 
ATOM   402  O OG  . SER A 1 54  ? 29.075 -9.847  2.997   1.000 56.338  0 383 SER EEE OG  1 ? 
ATOM   403  N N   . PRO A 1 55  ? 31.712 -8.680  -0.070  1.000 56.643  0 384 PRO EEE N   1 ? 
ATOM   404  C CA  . PRO A 1 55  ? 33.002 -8.493  -0.730  1.000 58.468  0 384 PRO EEE CA  1 ? 
ATOM   405  C C   . PRO A 1 55  ? 33.979 -9.618  -0.358  1.000 57.259  0 384 PRO EEE C   1 ? 
ATOM   406  O O   . PRO A 1 55  ? 34.863 -9.898  -1.135  1.000 63.814  0 384 PRO EEE O   1 ? 
ATOM   407  C CB  . PRO A 1 55  ? 33.458 -7.113  -0.229  1.000 60.185  0 384 PRO EEE CB  1 ? 
ATOM   408  C CG  . PRO A 1 55  ? 32.171 -6.376  0.043   1.000 61.262  0 384 PRO EEE CG  1 ? 
ATOM   409  C CD  . PRO A 1 55  ? 31.223 -7.440  0.556   1.000 60.521  0 384 PRO EEE CD  1 ? 
ATOM   410  N N   . THR A 1 56  ? 33.757 -10.260 0.792   1.000 62.830  0 385 THR EEE N   1 ? 
ATOM   411  C CA  . THR A 1 56  ? 34.592 -11.369 1.320   1.000 66.226  0 385 THR EEE CA  1 ? 
ATOM   412  C C   . THR A 1 56  ? 34.357 -12.628 0.466   1.000 65.654  0 385 THR EEE C   1 ? 
ATOM   413  O O   . THR A 1 56  ? 35.354 -13.258 0.083   1.000 73.201  0 385 THR EEE O   1 ? 
ATOM   414  C CB  . THR A 1 56  ? 34.369 -11.511 2.836   1.000 73.852  0 385 THR EEE CB  1 ? 
ATOM   415  O OG1 . THR A 1 56  ? 33.061 -12.015 3.116   1.000 81.622  0 385 THR EEE OG1 1 ? 
ATOM   416  C CG2 . THR A 1 56  ? 34.549 -10.194 3.562   1.000 74.706  0 385 THR EEE CG2 1 ? 
ATOM   417  N N   . LYS A 1 57  ? 33.105 -12.955 0.128   1.000 62.033  0 386 LYS EEE N   1 ? 
ATOM   418  C CA  . LYS A 1 57  ? 32.737 -14.159 -0.677  1.000 63.103  0 386 LYS EEE CA  1 ? 
ATOM   419  C C   . LYS A 1 57  ? 32.953 -13.900 -2.178  1.000 56.750  0 386 LYS EEE C   1 ? 
ATOM   420  O O   . LYS A 1 57  ? 33.048 -14.884 -2.937  1.000 61.840  0 386 LYS EEE O   1 ? 
ATOM   421  C CB  . LYS A 1 57  ? 31.287 -14.564 -0.394  1.000 69.940  0 386 LYS EEE CB  1 ? 
ATOM   422  C CG  . LYS A 1 57  ? 30.928 -14.594 1.087   1.000 79.051  0 386 LYS EEE CG  1 ? 
ATOM   423  C CD  . LYS A 1 57  ? 29.974 -15.694 1.493   1.000 86.572  0 386 LYS EEE CD  1 ? 
ATOM   424  C CE  . LYS A 1 57  ? 29.645 -15.643 2.970   1.000 90.385  0 386 LYS EEE CE  1 ? 
ATOM   425  N NZ  . LYS A 1 57  ? 28.712 -16.725 3.362   1.000 93.466  0 386 LYS EEE NZ  1 ? 
ATOM   426  N N   . LEU A 1 58  ? 33.010 -12.632 -2.597  1.000 49.624  0 387 LEU EEE N   1 ? 
ATOM   427  C CA  . LEU A 1 58  ? 33.387 -12.224 -3.978  1.000 46.219  0 387 LEU EEE CA  1 ? 
ATOM   428  C C   . LEU A 1 58  ? 34.815 -12.692 -4.285  1.000 49.883  0 387 LEU EEE C   1 ? 
ATOM   429  O O   . LEU A 1 58  ? 35.080 -13.014 -5.449  1.000 53.617  0 387 LEU EEE O   1 ? 
ATOM   430  C CB  . LEU A 1 58  ? 33.261 -10.706 -4.130  1.000 44.280  0 387 LEU EEE CB  1 ? 
ATOM   431  C CG  . LEU A 1 58  ? 31.832 -10.168 -4.191  1.000 44.907  0 387 LEU EEE CG  1 ? 
ATOM   432  C CD1 . LEU A 1 58  ? 31.815 -8.644  -4.181  1.000 46.234  0 387 LEU EEE CD1 1 ? 
ATOM   433  C CD2 . LEU A 1 58  ? 31.110 -10.689 -5.421  1.000 47.249  0 387 LEU EEE CD2 1 ? 
ATOM   434  N N   . ASN A 1 59  ? 35.682 -12.779 -3.272  1.000 52.342  0 388 ASN EEE N   1 ? 
ATOM   435  C CA  . ASN A 1 59  ? 37.120 -13.126 -3.441  1.000 58.309  0 388 ASN EEE CA  1 ? 
ATOM   436  C C   . ASN A 1 59  ? 37.302 -14.590 -3.872  1.000 58.031  0 388 ASN EEE C   1 ? 
ATOM   437  O O   . ASN A 1 59  ? 38.416 -14.899 -4.330  1.000 63.403  0 388 ASN EEE O   1 ? 
ATOM   438  C CB  . ASN A 1 59  ? 37.939 -12.800 -2.189  1.000 64.138  0 388 ASN EEE CB  1 ? 
ATOM   439  C CG  . ASN A 1 59  ? 38.288 -11.328 -2.097  1.000 71.267  0 388 ASN EEE CG  1 ? 
ATOM   440  O OD1 . ASN A 1 59  ? 38.589 -10.689 -3.107  1.000 74.104  0 388 ASN EEE OD1 1 ? 
ATOM   441  N ND2 . ASN A 1 59  ? 38.252 -10.777 -0.895  1.000 74.813  0 388 ASN EEE ND2 1 ? 
ATOM   442  N N   . ASP A 1 60  ? 36.283 -15.458 -3.763  1.000 54.251  0 389 ASP EEE N   1 ? 
ATOM   443  C CA  . ASP A 1 60  ? 36.378 -16.864 -4.255  1.000 59.393  0 389 ASP EEE CA  1 ? 
ATOM   444  C C   . ASP A 1 60  ? 35.265 -17.179 -5.272  1.000 55.378  0 389 ASP EEE C   1 ? 
ATOM   445  O O   . ASP A 1 60  ? 35.066 -18.364 -5.574  1.000 54.205  0 389 ASP EEE O   1 ? 
ATOM   446  C CB  . ASP A 1 60  ? 36.443 -17.864 -3.095  1.000 68.726  0 389 ASP EEE CB  1 ? 
ATOM   447  C CG  . ASP A 1 60  ? 35.368 -17.698 -2.037  1.000 73.093  0 389 ASP EEE CG  1 ? 
ATOM   448  O OD1 . ASP A 1 60  ? 34.179 -17.579 -2.422  1.000 78.616  0 389 ASP EEE OD1 1 ? 
ATOM   449  O OD2 . ASP A 1 60  ? 35.731 -17.699 -0.836  1.000 75.976  0 389 ASP EEE OD2 1 ? 
ATOM   450  N N   . LEU A 1 61  ? 34.600 -16.172 -5.842  1.000 54.382  0 390 LEU EEE N   1 ? 
ATOM   451  C CA  . LEU A 1 61  ? 33.670 -16.377 -6.987  1.000 52.870  0 390 LEU EEE CA  1 ? 
ATOM   452  C C   . LEU A 1 61  ? 34.296 -15.789 -8.256  1.000 48.851  0 390 LEU EEE C   1 ? 
ATOM   453  O O   . LEU A 1 61  ? 35.128 -14.870 -8.146  1.000 49.321  0 390 LEU EEE O   1 ? 
ATOM   454  C CB  . LEU A 1 61  ? 32.315 -15.731 -6.680  1.000 53.343  0 390 LEU EEE CB  1 ? 
ATOM   455  C CG  . LEU A 1 61  ? 31.541 -16.341 -5.512  1.000 57.780  0 390 LEU EEE CG  1 ? 
ATOM   456  C CD1 . LEU A 1 61  ? 30.349 -15.467 -5.147  1.000 59.986  0 390 LEU EEE CD1 1 ? 
ATOM   457  C CD2 . LEU A 1 61  ? 31.087 -17.764 -5.822  1.000 58.075  0 390 LEU EEE CD2 1 ? 
ATOM   458  N N   . CYS A 1 62  ? 33.926 -16.325 -9.418  1.000 46.054  0 391 CYS EEE N   1 ? 
ATOM   459  C CA  . CYS A 1 62  ? 34.301 -15.774 -10.744 1.000 44.394  0 391 CYS EEE CA  1 ? 
ATOM   460  C C   . CYS A 1 62  ? 33.029 -15.313 -11.456 1.000 41.881  0 391 CYS EEE C   1 ? 
ATOM   461  O O   . CYS A 1 62  ? 31.968 -15.957 -11.274 1.000 43.829  0 391 CYS EEE O   1 ? 
ATOM   462  C CB  . CYS A 1 62  ? 35.063 -16.787 -11.593 1.000 48.214  0 391 CYS EEE CB  1 ? 
ATOM   463  S SG  . CYS A 1 62  ? 36.655 -17.267 -10.873 1.000 52.942  0 391 CYS EEE SG  1 ? 
ATOM   464  N N   . PHE A 1 63  ? 33.138 -14.227 -12.218 1.000 36.984  0 392 PHE EEE N   1 ? 
ATOM   465  C CA  . PHE A 1 63  ? 32.035 -13.661 -13.029 1.000 35.822  0 392 PHE EEE CA  1 ? 
ATOM   466  C C   . PHE A 1 63  ? 32.523 -13.482 -14.463 1.000 34.437  0 392 PHE EEE C   1 ? 
ATOM   467  O O   . PHE A 1 63  ? 33.734 -13.341 -14.710 1.000 34.893  0 392 PHE EEE O   1 ? 
ATOM   468  C CB  . PHE A 1 63  ? 31.533 -12.360 -12.404 1.000 37.688  0 392 PHE EEE CB  1 ? 
ATOM   469  C CG  . PHE A 1 63  ? 30.947 -12.569 -11.035 1.000 38.881  0 392 PHE EEE CG  1 ? 
ATOM   470  C CD1 . PHE A 1 63  ? 29.654 -13.045 -10.887 1.000 40.690  0 392 PHE EEE CD1 1 ? 
ATOM   471  C CD2 . PHE A 1 63  ? 31.715 -12.360 -9.899  1.000 40.963  0 392 PHE EEE CD2 1 ? 
ATOM   472  C CE1 . PHE A 1 63  ? 29.124 -13.278 -9.626  1.000 42.660  0 392 PHE EEE CE1 1 ? 
ATOM   473  C CE2 . PHE A 1 63  ? 31.181 -12.584 -8.639  1.000 42.537  0 392 PHE EEE CE2 1 ? 
ATOM   474  C CZ  . PHE A 1 63  ? 29.887 -13.039 -8.506  1.000 42.698  0 392 PHE EEE CZ  1 ? 
ATOM   475  N N   . THR A 1 64  ? 31.579 -13.528 -15.392 1.000 34.000  0 393 THR EEE N   1 ? 
ATOM   476  C CA  A THR A 1 64  ? 31.851 -13.307 -16.836 0.500 35.836  0 393 THR EEE CA  1 ? 
ATOM   477  C CA  B THR A 1 64  ? 31.819 -13.297 -16.840 0.500 32.429  0 393 THR EEE CA  1 ? 
ATOM   478  C C   . THR A 1 64  ? 32.158 -11.821 -17.050 1.000 34.307  0 393 THR EEE C   1 ? 
ATOM   479  O O   . THR A 1 64  ? 33.101 -11.517 -17.810 1.000 35.890  0 393 THR EEE O   1 ? 
ATOM   480  C CB  A THR A 1 64  ? 30.676 -13.815 -17.673 0.500 40.863  0 393 THR EEE CB  1 ? 
ATOM   481  C CB  B THR A 1 64  ? 30.582 -13.670 -17.663 0.500 27.965  0 393 THR EEE CB  1 ? 
ATOM   482  O OG1 A THR A 1 64  ? 29.543 -13.016 -17.336 0.500 50.169  0 393 THR EEE OG1 1 ? 
ATOM   483  O OG1 B THR A 1 64  ? 30.132 -14.956 -17.233 0.500 26.848  0 393 THR EEE OG1 1 ? 
ATOM   484  C CG2 A THR A 1 64  ? 30.389 -15.276 -17.414 0.500 39.471  0 393 THR EEE CG2 1 ? 
ATOM   485  C CG2 B THR A 1 64  ? 30.856 -13.650 -19.151 0.500 26.623  0 393 THR EEE CG2 1 ? 
ATOM   486  N N   . ASN A 1 65  ? 31.392 -10.952 -16.392 1.000 34.266  0 394 ASN EEE N   1 ? 
ATOM   487  C CA  . ASN A 1 65  ? 31.600 -9.487  -16.434 1.000 34.313  0 394 ASN EEE CA  1 ? 
ATOM   488  C C   . ASN A 1 65  ? 31.276 -8.908  -15.064 1.000 32.993  0 394 ASN EEE C   1 ? 
ATOM   489  O O   . ASN A 1 65  ? 30.356 -9.422  -14.382 1.000 33.865  0 394 ASN EEE O   1 ? 
ATOM   490  C CB  . ASN A 1 65  ? 30.739 -8.792  -17.490 1.000 34.446  0 394 ASN EEE CB  1 ? 
ATOM   491  C CG  . ASN A 1 65  ? 31.050 -9.249  -18.898 1.000 36.618  0 394 ASN EEE CG  1 ? 
ATOM   492  O OD1 . ASN A 1 65  ? 32.140 -9.001  -19.412 1.000 39.318  0 394 ASN EEE OD1 1 ? 
ATOM   493  N ND2 . ASN A 1 65  ? 30.095 -9.919  -19.521 1.000 36.957  0 394 ASN EEE ND2 1 ? 
ATOM   494  N N   . VAL A 1 66  ? 32.003 -7.858  -14.712 1.000 31.885  0 395 VAL EEE N   1 ? 
ATOM   495  C CA  . VAL A 1 66  ? 31.630 -6.932  -13.613 1.000 30.739  0 395 VAL EEE CA  1 ? 
ATOM   496  C C   . VAL A 1 66  ? 31.457 -5.547  -14.231 1.000 30.323  0 395 VAL EEE C   1 ? 
ATOM   497  O O   . VAL A 1 66  ? 32.265 -5.174  -15.107 1.000 33.886  0 395 VAL EEE O   1 ? 
ATOM   498  C CB  . VAL A 1 66  ? 32.682 -6.959  -12.498 1.000 32.250  0 395 VAL EEE CB  1 ? 
ATOM   499  C CG1 . VAL A 1 66  ? 32.372 -5.927  -11.430 1.000 33.069  0 395 VAL EEE CG1 1 ? 
ATOM   500  C CG2 . VAL A 1 66  ? 32.792 -8.356  -11.907 1.000 34.284  0 395 VAL EEE CG2 1 ? 
ATOM   501  N N   . TYR A 1 67  ? 30.417 -4.834  -13.817 1.000 28.913  0 396 TYR EEE N   1 ? 
ATOM   502  C CA  . TYR A 1 67  ? 30.140 -3.457  -14.278 1.000 29.451  0 396 TYR EEE CA  1 ? 
ATOM   503  C C   . TYR A 1 67  ? 30.289 -2.508  -13.097 1.000 29.866  0 396 TYR EEE C   1 ? 
ATOM   504  O O   . TYR A 1 67  ? 29.770 -2.800  -11.992 1.000 32.487  0 396 TYR EEE O   1 ? 
ATOM   505  C CB  . TYR A 1 67  ? 28.765 -3.379  -14.937 1.000 29.957  0 396 TYR EEE CB  1 ? 
ATOM   506  C CG  . TYR A 1 67  ? 28.591 -4.360  -16.063 1.000 29.703  0 396 TYR EEE CG  1 ? 
ATOM   507  C CD1 . TYR A 1 67  ? 29.202 -4.155  -17.291 1.000 30.155  0 396 TYR EEE CD1 1 ? 
ATOM   508  C CD2 . TYR A 1 67  ? 27.836 -5.502  -15.892 1.000 30.113  0 396 TYR EEE CD2 1 ? 
ATOM   509  C CE1 . TYR A 1 67  ? 29.052 -5.065  -18.327 1.000 31.583  0 396 TYR EEE CE1 1 ? 
ATOM   510  C CE2 . TYR A 1 67  ? 27.677 -6.421  -16.914 1.000 32.304  0 396 TYR EEE CE2 1 ? 
ATOM   511  C CZ  . TYR A 1 67  ? 28.291 -6.205  -18.137 1.000 30.159  0 396 TYR EEE CZ  1 ? 
ATOM   512  O OH  . TYR A 1 67  ? 28.138 -7.116  -19.138 1.000 31.246  0 396 TYR EEE OH  1 ? 
ATOM   513  N N   . ALA A 1 68  ? 31.014 -1.417  -13.330 1.000 29.863  0 397 ALA EEE N   1 ? 
ATOM   514  C CA  . ALA A 1 68  ? 31.171 -0.301  -12.377 1.000 29.828  0 397 ALA EEE CA  1 ? 
ATOM   515  C C   . ALA A 1 68  ? 30.518 0.936   -12.994 1.000 28.136  0 397 ALA EEE C   1 ? 
ATOM   516  O O   . ALA A 1 68  ? 31.075 1.493   -13.976 1.000 30.960  0 397 ALA EEE O   1 ? 
ATOM   517  C CB  . ALA A 1 68  ? 32.626 -0.086  -12.050 1.000 31.114  0 397 ALA EEE CB  1 ? 
ATOM   518  N N   . ASP A 1 69  ? 29.355 1.310   -12.470 1.000 26.258  0 398 ASP EEE N   1 ? 
ATOM   519  C CA  . ASP A 1 69  ? 28.591 2.506   -12.908 1.000 27.718  0 398 ASP EEE CA  1 ? 
ATOM   520  C C   . ASP A 1 69  ? 28.953 3.645   -11.964 1.000 28.291  0 398 ASP EEE C   1 ? 
ATOM   521  O O   . ASP A 1 69  ? 28.954 3.414   -10.751 1.000 31.975  0 398 ASP EEE O   1 ? 
ATOM   522  C CB  . ASP A 1 69  ? 27.090 2.239   -12.913 1.000 29.274  0 398 ASP EEE CB  1 ? 
ATOM   523  C CG  . ASP A 1 69  ? 26.703 1.082   -13.813 1.000 31.131  0 398 ASP EEE CG  1 ? 
ATOM   524  O OD1 . ASP A 1 69  ? 27.473 0.806   -14.762 1.000 31.877  0 398 ASP EEE OD1 1 ? 
ATOM   525  O OD2 . ASP A 1 69  ? 25.633 0.470   -13.568 1.000 29.748  0 398 ASP EEE OD2 1 ? 
ATOM   526  N N   . SER A 1 70  ? 29.262 4.824   -12.490 1.000 26.583  0 399 SER EEE N   1 ? 
ATOM   527  C CA  . SER A 1 70  ? 29.757 5.933   -11.647 1.000 27.139  0 399 SER EEE CA  1 ? 
ATOM   528  C C   . SER A 1 70  ? 29.167 7.269   -12.082 1.000 27.587  0 399 SER EEE C   1 ? 
ATOM   529  O O   . SER A 1 70  ? 28.921 7.483   -13.305 1.000 27.666  0 399 SER EEE O   1 ? 
ATOM   530  C CB  . SER A 1 70  ? 31.258 5.933   -11.587 1.000 28.671  0 399 SER EEE CB  1 ? 
ATOM   531  O OG  . SER A 1 70  ? 31.844 6.288   -12.822 1.000 30.348  0 399 SER EEE OG  1 ? 
ATOM   532  N N   . PHE A 1 71  ? 28.918 8.127   -11.092 1.000 26.598  0 400 PHE EEE N   1 ? 
ATOM   533  C CA  . PHE A 1 71  ? 28.228 9.425   -11.278 1.000 26.502  0 400 PHE EEE CA  1 ? 
ATOM   534  C C   . PHE A 1 71  ? 28.232 10.207  -9.963  1.000 27.600  0 400 PHE EEE C   1 ? 
ATOM   535  O O   . PHE A 1 71  ? 28.625 9.656   -8.923  1.000 29.332  0 400 PHE EEE O   1 ? 
ATOM   536  C CB  . PHE A 1 71  ? 26.786 9.206   -11.737 1.000 27.364  0 400 PHE EEE CB  1 ? 
ATOM   537  C CG  . PHE A 1 71  ? 26.007 8.236   -10.888 1.000 27.382  0 400 PHE EEE CG  1 ? 
ATOM   538  C CD1 . PHE A 1 71  ? 25.383 8.660   -9.723  1.000 27.408  0 400 PHE EEE CD1 1 ? 
ATOM   539  C CD2 . PHE A 1 71  ? 25.923 6.896   -11.236 1.000 27.880  0 400 PHE EEE CD2 1 ? 
ATOM   540  C CE1 . PHE A 1 71  ? 24.676 7.765   -8.938  1.000 28.365  0 400 PHE EEE CE1 1 ? 
ATOM   541  C CE2 . PHE A 1 71  ? 25.218 6.001   -10.445 1.000 29.071  0 400 PHE EEE CE2 1 ? 
ATOM   542  C CZ  . PHE A 1 71  ? 24.585 6.440   -9.304  1.000 29.275  0 400 PHE EEE CZ  1 ? 
ATOM   543  N N   . VAL A 1 72  ? 27.780 11.451  -10.037 1.000 27.938  0 401 VAL EEE N   1 ? 
ATOM   544  C CA  . VAL A 1 72  ? 27.629 12.365  -8.876  1.000 27.331  0 401 VAL EEE CA  1 ? 
ATOM   545  C C   . VAL A 1 72  ? 26.150 12.687  -8.670  1.000 27.623  0 401 VAL EEE C   1 ? 
ATOM   546  O O   . VAL A 1 72  ? 25.433 12.934  -9.650  1.000 27.253  0 401 VAL EEE O   1 ? 
ATOM   547  C CB  . VAL A 1 72  ? 28.474 13.629  -9.083  1.000 28.867  0 401 VAL EEE CB  1 ? 
ATOM   548  C CG1 . VAL A 1 72  ? 28.071 14.757  -8.137  1.000 30.518  0 401 VAL EEE CG1 1 ? 
ATOM   549  C CG2 . VAL A 1 72  ? 29.949 13.293  -8.951  1.000 29.155  0 401 VAL EEE CG2 1 ? 
ATOM   550  N N   . ILE A 1 73  ? 25.725 12.659  -7.410  1.000 28.694  0 402 ILE EEE N   1 ? 
ATOM   551  C CA  . ILE A 1 73  ? 24.391 13.125  -6.941  1.000 28.311  0 402 ILE EEE CA  1 ? 
ATOM   552  C C   . ILE A 1 73  ? 24.627 13.912  -5.649  1.000 29.510  0 402 ILE EEE C   1 ? 
ATOM   553  O O   . ILE A 1 73  ? 25.784 13.983  -5.204  1.000 30.777  0 402 ILE EEE O   1 ? 
ATOM   554  C CB  . ILE A 1 73  ? 23.438 11.935  -6.744  1.000 28.697  0 402 ILE EEE CB  1 ? 
ATOM   555  C CG1 . ILE A 1 73  ? 24.034 10.879  -5.805  1.000 30.216  0 402 ILE EEE CG1 1 ? 
ATOM   556  C CG2 . ILE A 1 73  ? 23.046 11.341  -8.086  1.000 29.327  0 402 ILE EEE CG2 1 ? 
ATOM   557  C CD1 . ILE A 1 73  ? 23.119 9.724   -5.515  1.000 31.172  0 402 ILE EEE CD1 1 ? 
ATOM   558  N N   . ARG A 1 74  ? 23.581 14.471  -5.051  1.000 30.427  0 403 ARG EEE N   1 ? 
ATOM   559  C CA  . ARG A 1 74  ? 23.748 15.163  -3.753  1.000 32.704  0 403 ARG EEE CA  1 ? 
ATOM   560  C C   . ARG A 1 74  ? 23.554 14.147  -2.620  1.000 32.927  0 403 ARG EEE C   1 ? 
ATOM   561  O O   . ARG A 1 74  ? 22.995 13.060  -2.860  1.000 31.906  0 403 ARG EEE O   1 ? 
ATOM   562  C CB  . ARG A 1 74  ? 22.906 16.443  -3.709  1.000 34.753  0 403 ARG EEE CB  1 ? 
ATOM   563  C CG  . ARG A 1 74  ? 21.410 16.259  -3.565  1.000 37.817  0 403 ARG EEE CG  1 ? 
ATOM   564  C CD  . ARG A 1 74  ? 20.771 17.628  -3.676  1.000 42.234  0 403 ARG EEE CD  1 ? 
ATOM   565  N NE  . ARG A 1 74  ? 19.336 17.602  -3.446  1.000 50.167  0 403 ARG EEE NE  1 ? 
ATOM   566  C CZ  . ARG A 1 74  ? 18.746 17.798  -2.273  1.000 55.271  0 403 ARG EEE CZ  1 ? 
ATOM   567  N NH1 . ARG A 1 74  ? 19.464 18.020  -1.182  1.000 60.546  0 403 ARG EEE NH1 1 ? 
ATOM   568  N NH2 . ARG A 1 74  ? 17.428 17.750  -2.187  1.000 55.862  0 403 ARG EEE NH2 1 ? 
ATOM   569  N N   . GLY A 1 75  ? 24.094 14.467  -1.444  1.000 35.239  0 404 GLY EEE N   1 ? 
ATOM   570  C CA  . GLY A 1 75  ? 24.145 13.565  -0.276  1.000 35.592  0 404 GLY EEE CA  1 ? 
ATOM   571  C C   . GLY A 1 75  ? 22.805 12.919  0.028   1.000 34.977  0 404 GLY EEE C   1 ? 
ATOM   572  O O   . GLY A 1 75  ? 22.779 11.685  0.235   1.000 36.636  0 404 GLY EEE O   1 ? 
ATOM   573  N N   . ASP A 1 76  ? 21.720 13.701  0.056   1.000 36.873  0 405 ASP EEE N   1 ? 
ATOM   574  C CA  . ASP A 1 76  ? 20.398 13.187  0.509   1.000 39.231  0 405 ASP EEE CA  1 ? 
ATOM   575  C C   . ASP A 1 76  ? 19.751 12.329  -0.589  1.000 34.692  0 405 ASP EEE C   1 ? 
ATOM   576  O O   . ASP A 1 76  ? 18.660 11.792  -0.331  1.000 37.474  0 405 ASP EEE O   1 ? 
ATOM   577  C CB  . ASP A 1 76  ? 19.488 14.301  1.036   1.000 46.095  0 405 ASP EEE CB  1 ? 
ATOM   578  C CG  . ASP A 1 76  ? 19.102 15.375  0.040   1.000 53.101  0 405 ASP EEE CG  1 ? 
ATOM   579  O OD1 . ASP A 1 76  ? 18.680 16.456  0.506   1.000 58.576  0 405 ASP EEE OD1 1 ? 
ATOM   580  O OD2 . ASP A 1 76  ? 19.218 15.127  -1.190  1.000 58.574  0 405 ASP EEE OD2 1 ? 
ATOM   581  N N   . GLU A 1 77  ? 20.400 12.172  -1.750  1.000 34.254  0 406 GLU EEE N   1 ? 
ATOM   582  C CA  . GLU A 1 77  ? 19.902 11.312  -2.853  1.000 31.951  0 406 GLU EEE CA  1 ? 
ATOM   583  C C   . GLU A 1 77  ? 20.611 9.951   -2.872  1.000 32.001  0 406 GLU EEE C   1 ? 
ATOM   584  O O   . GLU A 1 77  ? 20.150 9.063   -3.615  1.000 30.621  0 406 GLU EEE O   1 ? 
ATOM   585  C CB  . GLU A 1 77  ? 20.087 12.013  -4.194  1.000 31.978  0 406 GLU EEE CB  1 ? 
ATOM   586  C CG  . GLU A 1 77  ? 19.136 13.173  -4.381  1.000 32.771  0 406 GLU EEE CG  1 ? 
ATOM   587  C CD  . GLU A 1 77  ? 19.444 14.058  -5.571  1.000 33.614  0 406 GLU EEE CD  1 ? 
ATOM   588  O OE1 . GLU A 1 77  ? 20.614 14.045  -6.037  1.000 32.656  0 406 GLU EEE OE1 1 ? 
ATOM   589  O OE2 . GLU A 1 77  ? 18.512 14.760  -6.023  1.000 34.057  0 406 GLU EEE OE2 1 ? 
ATOM   590  N N   . VAL A 1 78  ? 21.677 9.759   -2.095  1.000 31.909  0 407 VAL EEE N   1 ? 
ATOM   591  C CA  . VAL A 1 78  ? 22.415 8.463   -2.090  1.000 32.301  0 407 VAL EEE CA  1 ? 
ATOM   592  C C   . VAL A 1 78  ? 21.436 7.337   -1.712  1.000 33.231  0 407 VAL EEE C   1 ? 
ATOM   593  O O   . VAL A 1 78  ? 21.556 6.234   -2.290  1.000 31.456  0 407 VAL EEE O   1 ? 
ATOM   594  C CB  . VAL A 1 78  ? 23.665 8.502   -1.194  1.000 33.809  0 407 VAL EEE CB  1 ? 
ATOM   595  C CG1 . VAL A 1 78  ? 24.297 7.128   -1.065  1.000 35.376  0 407 VAL EEE CG1 1 ? 
ATOM   596  C CG2 . VAL A 1 78  ? 24.687 9.509   -1.716  1.000 35.026  0 407 VAL EEE CG2 1 ? 
ATOM   597  N N   . ARG A 1 79  ? 20.457 7.613   -0.843  1.000 33.614  0 408 ARG EEE N   1 ? 
ATOM   598  C CA  . ARG A 1 79  ? 19.450 6.603   -0.421  1.000 34.759  0 408 ARG EEE CA  1 ? 
ATOM   599  C C   . ARG A 1 79  ? 18.632 6.123   -1.633  1.000 33.359  0 408 ARG EEE C   1 ? 
ATOM   600  O O   . ARG A 1 79  ? 18.076 5.018   -1.548  1.000 33.697  0 408 ARG EEE O   1 ? 
ATOM   601  C CB  . ARG A 1 79  ? 18.551 7.153   0.694   1.000 38.044  0 408 ARG EEE CB  1 ? 
ATOM   602  C CG  . ARG A 1 79  ? 17.627 8.277   0.255   1.000 43.033  0 408 ARG EEE CG  1 ? 
ATOM   603  C CD  . ARG A 1 79  ? 16.653 8.682   1.340   1.000 51.793  0 408 ARG EEE CD  1 ? 
ATOM   604  N NE  . ARG A 1 79  ? 15.545 9.451   0.793   1.000 66.605  0 408 ARG EEE NE  1 ? 
ATOM   605  C CZ  . ARG A 1 79  ? 14.438 9.781   1.461   1.000 73.739  0 408 ARG EEE CZ  1 ? 
ATOM   606  N NH1 . ARG A 1 79  ? 14.272 9.404   2.719   1.000 77.366  0 408 ARG EEE NH1 1 ? 
ATOM   607  N NH2 . ARG A 1 79  ? 13.494 10.486  0.858   1.000 83.816  0 408 ARG EEE NH2 1 ? 
ATOM   608  N N   . GLN A 1 80  ? 18.553 6.903   -2.721  1.000 31.499  0 409 GLN EEE N   1 ? 
ATOM   609  C CA  . GLN A 1 80  ? 17.773 6.497   -3.923  1.000 31.880  0 409 GLN EEE CA  1 ? 
ATOM   610  C C   . GLN A 1 80  ? 18.538 5.456   -4.748  1.000 30.325  0 409 GLN EEE C   1 ? 
ATOM   611  O O   . GLN A 1 80  ? 17.886 4.785   -5.570  1.000 32.954  0 409 GLN EEE O   1 ? 
ATOM   612  C CB  . GLN A 1 80  ? 17.408 7.698   -4.789  1.000 32.132  0 409 GLN EEE CB  1 ? 
ATOM   613  C CG  . GLN A 1 80  ? 16.342 8.580   -4.161  1.000 33.227  0 409 GLN EEE CG  1 ? 
ATOM   614  C CD  . GLN A 1 80  ? 15.961 9.713   -5.081  1.000 34.004  0 409 GLN EEE CD  1 ? 
ATOM   615  O OE1 . GLN A 1 80  ? 15.676 9.508   -6.261  1.000 33.049  0 409 GLN EEE OE1 1 ? 
ATOM   616  N NE2 . GLN A 1 80  ? 15.951 10.923  -4.543  1.000 35.525  0 409 GLN EEE NE2 1 ? 
ATOM   617  N N   . ILE A 1 81  ? 19.850 5.312   -4.541  1.000 29.173  0 410 ILE EEE N   1 ? 
ATOM   618  C CA  . ILE A 1 81  ? 20.677 4.284   -5.240  1.000 29.724  0 410 ILE EEE CA  1 ? 
ATOM   619  C C   . ILE A 1 81  ? 20.588 2.989   -4.430  1.000 29.477  0 410 ILE EEE C   1 ? 
ATOM   620  O O   . ILE A 1 81  ? 21.585 2.564   -3.812  1.000 31.161  0 410 ILE EEE O   1 ? 
ATOM   621  C CB  . ILE A 1 81  ? 22.119 4.763   -5.479  1.000 30.119  0 410 ILE EEE CB  1 ? 
ATOM   622  C CG1 . ILE A 1 81  ? 22.158 6.201   -6.009  1.000 31.577  0 410 ILE EEE CG1 1 ? 
ATOM   623  C CG2 . ILE A 1 81  ? 22.848 3.803   -6.411  1.000 29.346  0 410 ILE EEE CG2 1 ? 
ATOM   624  C CD1 . ILE A 1 81  ? 21.343 6.424   -7.271  1.000 30.919  0 410 ILE EEE CD1 1 ? 
ATOM   625  N N   . ALA A 1 82  ? 19.406 2.383   -4.467  1.000 33.000  0 411 ALA EEE N   1 ? 
ATOM   626  C CA  . ALA A 1 82  ? 19.066 1.143   -3.743  1.000 32.780  0 411 ALA EEE CA  1 ? 
ATOM   627  C C   . ALA A 1 82  ? 17.865 0.514   -4.428  1.000 34.125  0 411 ALA EEE C   1 ? 
ATOM   628  O O   . ALA A 1 82  ? 17.062 1.213   -5.047  1.000 35.127  0 411 ALA EEE O   1 ? 
ATOM   629  C CB  . ALA A 1 82  ? 18.785 1.442   -2.290  1.000 34.804  0 411 ALA EEE CB  1 ? 
ATOM   630  N N   . PRO A 1 83  ? 17.714 -0.821  -4.343  1.000 35.970  0 412 PRO EEE N   1 ? 
ATOM   631  C CA  . PRO A 1 83  ? 16.531 -1.482  -4.883  1.000 36.186  0 412 PRO EEE CA  1 ? 
ATOM   632  C C   . PRO A 1 83  ? 15.254 -0.916  -4.243  1.000 37.403  0 412 PRO EEE C   1 ? 
ATOM   633  O O   . PRO A 1 83  ? 15.266 -0.637  -3.049  1.000 37.507  0 412 PRO EEE O   1 ? 
ATOM   634  C CB  . PRO A 1 83  ? 16.727 -2.971  -4.565  1.000 38.157  0 412 PRO EEE CB  1 ? 
ATOM   635  C CG  . PRO A 1 83  ? 17.889 -3.041  -3.604  1.000 39.379  0 412 PRO EEE CG  1 ? 
ATOM   636  C CD  . PRO A 1 83  ? 18.675 -1.759  -3.751  1.000 37.182  0 412 PRO EEE CD  1 ? 
ATOM   637  N N   . GLY A 1 84  ? 14.221 -0.714  -5.068  1.000 38.802  0 413 GLY EEE N   1 ? 
ATOM   638  C CA  . GLY A 1 84  ? 12.841 -0.409  -4.646  1.000 40.669  0 413 GLY EEE CA  1 ? 
ATOM   639  C C   . GLY A 1 84  ? 12.635 1.043   -4.253  1.000 39.532  0 413 GLY EEE C   1 ? 
ATOM   640  O O   . GLY A 1 84  ? 11.621 1.317   -3.603  1.000 42.966  0 413 GLY EEE O   1 ? 
ATOM   641  N N   . GLN A 1 85  ? 13.533 1.954   -4.639  1.000 38.771  0 414 GLN EEE N   1 ? 
ATOM   642  C CA  . GLN A 1 85  ? 13.440 3.387   -4.258  1.000 38.327  0 414 GLN EEE CA  1 ? 
ATOM   643  C C   . GLN A 1 85  ? 12.739 4.182   -5.362  1.000 38.426  0 414 GLN EEE C   1 ? 
ATOM   644  O O   . GLN A 1 85  ? 12.729 3.730   -6.538  1.000 40.310  0 414 GLN EEE O   1 ? 
ATOM   645  C CB  . GLN A 1 85  ? 14.824 3.965   -3.971  1.000 39.622  0 414 GLN EEE CB  1 ? 
ATOM   646  C CG  . GLN A 1 85  ? 15.550 3.256   -2.838  1.000 42.864  0 414 GLN EEE CG  1 ? 
ATOM   647  C CD  . GLN A 1 85  ? 14.718 3.220   -1.580  1.000 45.231  0 414 GLN EEE CD  1 ? 
ATOM   648  O OE1 . GLN A 1 85  ? 14.403 4.254   -0.996  1.000 48.798  0 414 GLN EEE OE1 1 ? 
ATOM   649  N NE2 . GLN A 1 85  ? 14.322 2.023   -1.169  1.000 49.571  0 414 GLN EEE NE2 1 ? 
ATOM   650  N N   . THR A 1 86  ? 12.167 5.324   -4.975  1.000 39.547  0 415 THR EEE N   1 ? 
ATOM   651  C CA  . THR A 1 86  ? 11.562 6.328   -5.882  1.000 41.209  0 415 THR EEE CA  1 ? 
ATOM   652  C C   . THR A 1 86  ? 12.132 7.706   -5.539  1.000 39.175  0 415 THR EEE C   1 ? 
ATOM   653  O O   . THR A 1 86  ? 12.823 7.833   -4.506  1.000 40.707  0 415 THR EEE O   1 ? 
ATOM   654  C CB  . THR A 1 86  ? 10.030 6.288   -5.828  1.000 43.995  0 415 THR EEE CB  1 ? 
ATOM   655  O OG1 . THR A 1 86  ? 9.610  6.721   -4.535  1.000 45.709  0 415 THR EEE OG1 1 ? 
ATOM   656  C CG2 . THR A 1 86  ? 9.472  4.914   -6.123  1.000 47.990  0 415 THR EEE CG2 1 ? 
ATOM   657  N N   . GLY A 1 87  ? 11.849 8.690   -6.392  1.000 39.003  0 416 GLY EEE N   1 ? 
ATOM   658  C CA  . GLY A 1 87  ? 12.435 10.038  -6.339  1.000 38.299  0 416 GLY EEE CA  1 ? 
ATOM   659  C C   . GLY A 1 87  ? 13.019 10.402  -7.688  1.000 36.152  0 416 GLY EEE C   1 ? 
ATOM   660  O O   . GLY A 1 87  ? 13.093 9.509   -8.562  1.000 33.176  0 416 GLY EEE O   1 ? 
ATOM   661  N N   . LYS A 1 88  ? 13.429 11.658  -7.850  1.000 35.964  0 417 LYS EEE N   1 ? 
ATOM   662  C CA  . LYS A 1 88  ? 13.936 12.201  -9.137  1.000 36.522  0 417 LYS EEE CA  1 ? 
ATOM   663  C C   . LYS A 1 88  ? 15.089 11.333  -9.662  1.000 32.225  0 417 LYS EEE C   1 ? 
ATOM   664  O O   . LYS A 1 88  ? 15.163 11.121  -10.881 1.000 30.905  0 417 LYS EEE O   1 ? 
ATOM   665  C CB  . LYS A 1 88  ? 14.362 13.661  -8.968  1.000 42.581  0 417 LYS EEE CB  1 ? 
ATOM   666  C CG  . LYS A 1 88  ? 13.541 14.654  -9.771  1.000 50.682  0 417 LYS EEE CG  1 ? 
ATOM   667  C CD  . LYS A 1 88  ? 12.118 14.771  -9.319  1.000 55.261  0 417 LYS EEE CD  1 ? 
ATOM   668  C CE  . LYS A 1 88  ? 11.281 15.607  -10.260 1.000 57.715  0 417 LYS EEE CE  1 ? 
ATOM   669  N NZ  . LYS A 1 88  ? 9.868  15.634  -9.834  1.000 61.173  0 417 LYS EEE NZ  1 ? 
ATOM   670  N N   . ILE A 1 89  ? 15.974 10.848  -8.796  1.000 30.187  0 418 ILE EEE N   1 ? 
ATOM   671  C CA  . ILE A 1 89  ? 17.181 10.117  -9.272  1.000 29.097  0 418 ILE EEE CA  1 ? 
ATOM   672  C C   . ILE A 1 89  ? 16.781 8.696   -9.685  1.000 29.312  0 418 ILE EEE C   1 ? 
ATOM   673  O O   . ILE A 1 89  ? 17.056 8.323   -10.840 1.000 29.773  0 418 ILE EEE O   1 ? 
ATOM   674  C CB  . ILE A 1 89  ? 18.319 10.156  -8.239  1.000 31.015  0 418 ILE EEE CB  1 ? 
ATOM   675  C CG1 . ILE A 1 89  ? 18.705 11.598  -7.894  1.000 31.595  0 418 ILE EEE CG1 1 ? 
ATOM   676  C CG2 . ILE A 1 89  ? 19.505 9.346   -8.738  1.000 30.900  0 418 ILE EEE CG2 1 ? 
ATOM   677  C CD1 . ILE A 1 89  ? 18.913 12.498  -9.086  1.000 32.737  0 418 ILE EEE CD1 1 ? 
ATOM   678  N N   . ALA A 1 90  ? 16.149 7.927   -8.804  1.000 30.425  0 419 ALA EEE N   1 ? 
ATOM   679  C CA  . ALA A 1 90  ? 15.716 6.543   -9.115  1.000 31.877  0 419 ALA EEE CA  1 ? 
ATOM   680  C C   . ALA A 1 90  ? 14.758 6.562   -10.316 1.000 31.096  0 419 ALA EEE C   1 ? 
ATOM   681  O O   . ALA A 1 90  ? 14.867 5.665   -11.170 1.000 32.987  0 419 ALA EEE O   1 ? 
ATOM   682  C CB  . ALA A 1 90  ? 15.089 5.882   -7.908  1.000 31.776  0 419 ALA EEE CB  1 ? 
ATOM   683  N N   . ASP A 1 91  ? 13.865 7.550   -10.389 1.000 30.504  0 420 ASP EEE N   1 ? 
ATOM   684  C CA  . ASP A 1 91  ? 12.771 7.579   -11.399 1.000 32.274  0 420 ASP EEE CA  1 ? 
ATOM   685  C C   . ASP A 1 91  ? 13.346 7.987   -12.760 1.000 32.521  0 420 ASP EEE C   1 ? 
ATOM   686  O O   . ASP A 1 91  ? 12.994 7.329   -13.764 1.000 33.817  0 420 ASP EEE O   1 ? 
ATOM   687  C CB  . ASP A 1 91  ? 11.628 8.518   -11.002 1.000 34.840  0 420 ASP EEE CB  1 ? 
ATOM   688  C CG  . ASP A 1 91  ? 10.807 8.078   -9.796  1.000 36.021  0 420 ASP EEE CG  1 ? 
ATOM   689  O OD1 . ASP A 1 91  ? 11.002 6.947   -9.319  1.000 38.624  0 420 ASP EEE OD1 1 ? 
ATOM   690  O OD2 . ASP A 1 91  ? 9.971  8.875   -9.348  1.000 39.027  0 420 ASP EEE OD2 1 ? 
ATOM   691  N N   . TYR A 1 92  ? 14.173 9.038   -12.818 1.000 30.272  0 421 TYR EEE N   1 ? 
ATOM   692  C CA  . TYR A 1 92  ? 14.504 9.708   -14.108 1.000 29.451  0 421 TYR EEE CA  1 ? 
ATOM   693  C C   . TYR A 1 92  ? 15.990 9.633   -14.471 1.000 29.881  0 421 TYR EEE C   1 ? 
ATOM   694  O O   . TYR A 1 92  ? 16.298 10.057  -15.604 1.000 31.398  0 421 TYR EEE O   1 ? 
ATOM   695  C CB  . TYR A 1 92  ? 14.056 11.169  -14.090 1.000 29.612  0 421 TYR EEE CB  1 ? 
ATOM   696  C CG  . TYR A 1 92  ? 12.570 11.417  -13.976 1.000 31.297  0 421 TYR EEE CG  1 ? 
ATOM   697  C CD1 . TYR A 1 92  ? 11.624 10.438  -14.241 1.000 32.834  0 421 TYR EEE CD1 1 ? 
ATOM   698  C CD2 . TYR A 1 92  ? 12.106 12.677  -13.644 1.000 32.655  0 421 TYR EEE CD2 1 ? 
ATOM   699  C CE1 . TYR A 1 92  ? 10.263 10.699  -14.155 1.000 35.484  0 421 TYR EEE CE1 1 ? 
ATOM   700  C CE2 . TYR A 1 92  ? 10.754 12.957  -13.556 1.000 34.237  0 421 TYR EEE CE2 1 ? 
ATOM   701  C CZ  . TYR A 1 92  ? 9.825  11.964  -13.806 1.000 35.188  0 421 TYR EEE CZ  1 ? 
ATOM   702  O OH  . TYR A 1 92  ? 8.493  12.257  -13.721 1.000 37.044  0 421 TYR EEE OH  1 ? 
ATOM   703  N N   . ASN A 1 93  ? 16.879 9.144   -13.599 1.000 27.713  0 422 ASN EEE N   1 ? 
ATOM   704  C CA  . ASN A 1 93  ? 18.346 9.285   -13.815 1.000 28.167  0 422 ASN EEE CA  1 ? 
ATOM   705  C C   . ASN A 1 93  ? 19.077 7.941   -13.757 1.000 28.347  0 422 ASN EEE C   1 ? 
ATOM   706  O O   . ASN A 1 93  ? 19.783 7.629   -14.718 1.000 27.858  0 422 ASN EEE O   1 ? 
ATOM   707  C CB  . ASN A 1 93  ? 18.957 10.290  -12.843 1.000 28.242  0 422 ASN EEE CB  1 ? 
ATOM   708  C CG  . ASN A 1 93  ? 18.525 11.701  -13.167 1.000 27.981  0 422 ASN EEE CG  1 ? 
ATOM   709  O OD1 . ASN A 1 93  ? 19.221 12.412  -13.886 1.000 28.869  0 422 ASN EEE OD1 1 ? 
ATOM   710  N ND2 . ASN A 1 93  ? 17.357 12.095  -12.689 1.000 27.862  0 422 ASN EEE ND2 1 ? 
ATOM   711  N N   . TYR A 1 94  ? 18.973 7.198   -12.655 1.000 27.501  0 423 TYR EEE N   1 ? 
ATOM   712  C CA  . TYR A 1 94  ? 19.698 5.914   -12.487 1.000 27.605  0 423 TYR EEE CA  1 ? 
ATOM   713  C C   . TYR A 1 94  ? 18.862 4.990   -11.603 1.000 29.500  0 423 TYR EEE C   1 ? 
ATOM   714  O O   . TYR A 1 94  ? 18.570 5.354   -10.443 1.000 30.731  0 423 TYR EEE O   1 ? 
ATOM   715  C CB  . TYR A 1 94  ? 21.110 6.128   -11.936 1.000 28.229  0 423 TYR EEE CB  1 ? 
ATOM   716  C CG  . TYR A 1 94  ? 21.905 4.851   -11.845 1.000 27.516  0 423 TYR EEE CG  1 ? 
ATOM   717  C CD1 . TYR A 1 94  ? 21.840 4.038   -10.727 1.000 28.186  0 423 TYR EEE CD1 1 ? 
ATOM   718  C CD2 . TYR A 1 94  ? 22.673 4.414   -12.912 1.000 26.820  0 423 TYR EEE CD2 1 ? 
ATOM   719  C CE1 . TYR A 1 94  ? 22.549 2.851   -10.654 1.000 28.129  0 423 TYR EEE CE1 1 ? 
ATOM   720  C CE2 . TYR A 1 94  ? 23.382 3.229   -12.859 1.000 27.599  0 423 TYR EEE CE2 1 ? 
ATOM   721  C CZ  . TYR A 1 94  ? 23.323 2.441   -11.722 1.000 27.164  0 423 TYR EEE CZ  1 ? 
ATOM   722  O OH  . TYR A 1 94  ? 24.023 1.270   -11.664 1.000 30.048  0 423 TYR EEE OH  1 ? 
ATOM   723  N N   . LYS A 1 95  ? 18.502 3.831   -12.151 1.000 29.098  0 424 LYS EEE N   1 ? 
ATOM   724  C CA  . LYS A 1 95  ? 17.506 2.913   -11.554 1.000 29.874  0 424 LYS EEE CA  1 ? 
ATOM   725  C C   . LYS A 1 95  ? 18.142 1.546   -11.319 1.000 30.640  0 424 LYS EEE C   1 ? 
ATOM   726  O O   . LYS A 1 95  ? 18.609 0.921   -12.293 1.000 29.768  0 424 LYS EEE O   1 ? 
ATOM   727  C CB  . LYS A 1 95  ? 16.276 2.782   -12.453 1.000 29.654  0 424 LYS EEE CB  1 ? 
ATOM   728  C CG  . LYS A 1 95  ? 15.190 1.873   -11.900 1.000 31.689  0 424 LYS EEE CG  1 ? 
ATOM   729  C CD  . LYS A 1 95  ? 14.735 2.256   -10.512 1.000 31.967  0 424 LYS EEE CD  1 ? 
ATOM   730  C CE  . LYS A 1 95  ? 13.557 1.438   -10.039 1.000 35.451  0 424 LYS EEE CE  1 ? 
ATOM   731  N NZ  . LYS A 1 95  ? 13.084 1.915   -8.719  1.000 37.755  0 424 LYS EEE NZ  1 ? 
ATOM   732  N N   . LEU A 1 96  ? 18.149 1.090   -10.067 1.000 30.968  0 425 LEU EEE N   1 ? 
ATOM   733  C CA  . LEU A 1 96  ? 18.536 -0.305  -9.745  1.000 31.924  0 425 LEU EEE CA  1 ? 
ATOM   734  C C   . LEU A 1 96  ? 17.308 -1.197  -9.861  1.000 30.808  0 425 LEU EEE C   1 ? 
ATOM   735  O O   . LEU A 1 96  ? 16.189 -0.767  -9.583  1.000 34.969  0 425 LEU EEE O   1 ? 
ATOM   736  C CB  . LEU A 1 96  ? 19.142 -0.374  -8.342  1.000 33.555  0 425 LEU EEE CB  1 ? 
ATOM   737  C CG  . LEU A 1 96  ? 20.533 0.234   -8.204  1.000 33.603  0 425 LEU EEE CG  1 ? 
ATOM   738  C CD1 . LEU A 1 96  ? 21.035 0.061   -6.789  1.000 34.653  0 425 LEU EEE CD1 1 ? 
ATOM   739  C CD2 . LEU A 1 96  ? 21.517 -0.379  -9.192  1.000 35.276  0 425 LEU EEE CD2 1 ? 
ATOM   740  N N   . PRO A 1 97  ? 17.493 -2.475  -10.249 1.000 33.657  0 426 PRO EEE N   1 ? 
ATOM   741  C CA  . PRO A 1 97  ? 16.393 -3.435  -10.281 1.000 35.922  0 426 PRO EEE CA  1 ? 
ATOM   742  C C   . PRO A 1 97  ? 15.995 -3.841  -8.853  1.000 37.152  0 426 PRO EEE C   1 ? 
ATOM   743  O O   . PRO A 1 97  ? 16.821 -3.753  -7.968  1.000 36.794  0 426 PRO EEE O   1 ? 
ATOM   744  C CB  . PRO A 1 97  ? 16.985 -4.616  -11.058 1.000 37.315  0 426 PRO EEE CB  1 ? 
ATOM   745  C CG  . PRO A 1 97  ? 18.458 -4.558  -10.736 1.000 38.350  0 426 PRO EEE CG  1 ? 
ATOM   746  C CD  . PRO A 1 97  ? 18.777 -3.077  -10.639 1.000 36.059  0 426 PRO EEE CD  1 ? 
ATOM   747  N N   . ASP A 1 98  ? 14.748 -4.277  -8.677  1.000 40.059  0 427 ASP EEE N   1 ? 
ATOM   748  C CA  . ASP A 1 98  ? 14.177 -4.702  -7.372  1.000 43.799  0 427 ASP EEE CA  1 ? 
ATOM   749  C C   . ASP A 1 98  ? 15.014 -5.858  -6.804  1.000 43.886  0 427 ASP EEE C   1 ? 
ATOM   750  O O   . ASP A 1 98  ? 15.102 -5.965  -5.573  1.000 48.028  0 427 ASP EEE O   1 ? 
ATOM   751  C CB  . ASP A 1 98  ? 12.707 -5.098  -7.524  1.000 47.550  0 427 ASP EEE CB  1 ? 
ATOM   752  C CG  . ASP A 1 98  ? 11.759 -3.957  -7.869  1.000 49.711  0 427 ASP EEE CG  1 ? 
ATOM   753  O OD1 . ASP A 1 98  ? 12.197 -2.791  -7.868  1.000 51.502  0 427 ASP EEE OD1 1 ? 
ATOM   754  O OD2 . ASP A 1 98  ? 10.578 -4.250  -8.136  1.000 56.365  0 427 ASP EEE OD2 1 ? 
ATOM   755  N N   . ASP A 1 99  ? 15.613 -6.683  -7.670  1.000 44.973  0 428 ASP EEE N   1 ? 
ATOM   756  C CA  . ASP A 1 99  ? 16.342 -7.922  -7.285  1.000 49.091  0 428 ASP EEE CA  1 ? 
ATOM   757  C C   . ASP A 1 99  ? 17.862 -7.697  -7.346  1.000 45.518  0 428 ASP EEE C   1 ? 
ATOM   758  O O   . ASP A 1 99  ? 18.595 -8.689  -7.493  1.000 44.856  0 428 ASP EEE O   1 ? 
ATOM   759  C CB  . ASP A 1 99  ? 15.907 -9.093  -8.174  1.000 52.598  0 428 ASP EEE CB  1 ? 
ATOM   760  C CG  . ASP A 1 99  ? 16.314 -8.957  -9.633  1.000 54.942  0 428 ASP EEE CG  1 ? 
ATOM   761  O OD1 . ASP A 1 99  ? 16.800 -7.872  -10.018 1.000 57.031  0 428 ASP EEE OD1 1 ? 
ATOM   762  O OD2 . ASP A 1 99  ? 16.136 -9.937  -10.377 1.000 62.887  0 428 ASP EEE OD2 1 ? 
ATOM   763  N N   . PHE A 1 100 ? 18.331 -6.453  -7.228  1.000 40.226  0 429 PHE EEE N   1 ? 
ATOM   764  C CA  . PHE A 1 100 ? 19.775 -6.098  -7.302  1.000 37.948  0 429 PHE EEE CA  1 ? 
ATOM   765  C C   . PHE A 1 100 ? 20.566 -6.904  -6.261  1.000 37.724  0 429 PHE EEE C   1 ? 
ATOM   766  O O   . PHE A 1 100 ? 20.120 -6.929  -5.097  1.000 39.688  0 429 PHE EEE O   1 ? 
ATOM   767  C CB  . PHE A 1 100 ? 19.950 -4.599  -7.064  1.000 36.288  0 429 PHE EEE CB  1 ? 
ATOM   768  C CG  . PHE A 1 100 ? 21.376 -4.128  -7.114  1.000 34.402  0 429 PHE EEE CG  1 ? 
ATOM   769  C CD1 . PHE A 1 100 ? 22.073 -4.132  -8.312  1.000 35.303  0 429 PHE EEE CD1 1 ? 
ATOM   770  C CD2 . PHE A 1 100 ? 22.020 -3.684  -5.970  1.000 34.467  0 429 PHE EEE CD2 1 ? 
ATOM   771  C CE1 . PHE A 1 100 ? 23.387 -3.696  -8.366  1.000 32.925  0 429 PHE EEE CE1 1 ? 
ATOM   772  C CE2 . PHE A 1 100 ? 23.330 -3.244  -6.029  1.000 33.165  0 429 PHE EEE CE2 1 ? 
ATOM   773  C CZ  . PHE A 1 100 ? 24.009 -3.242  -7.227  1.000 33.606  0 429 PHE EEE CZ  1 ? 
ATOM   774  N N   . THR A 1 101 ? 21.702 -7.508  -6.644  1.000 37.844  0 430 THR EEE N   1 ? 
ATOM   775  C CA  . THR A 1 101 ? 22.569 -8.304  -5.729  1.000 42.026  0 430 THR EEE CA  1 ? 
ATOM   776  C C   . THR A 1 101 ? 24.027 -7.809  -5.714  1.000 43.551  0 430 THR EEE C   1 ? 
ATOM   777  O O   . THR A 1 101 ? 24.903 -8.579  -5.248  1.000 51.131  0 430 THR EEE O   1 ? 
ATOM   778  C CB  . THR A 1 101 ? 22.512 -9.799  -6.062  1.000 45.768  0 430 THR EEE CB  1 ? 
ATOM   779  O OG1 . THR A 1 101 ? 22.983 -9.985  -7.394  1.000 50.022  0 430 THR EEE OG1 1 ? 
ATOM   780  C CG2 . THR A 1 101 ? 21.119 -10.366 -5.918  1.000 49.173  0 430 THR EEE CG2 1 ? 
ATOM   781  N N   . GLY A 1 102 ? 24.291 -6.574  -6.140  1.000 37.598  0 431 GLY EEE N   1 ? 
ATOM   782  C CA  . GLY A 1 102 ? 25.650 -6.000  -6.174  1.000 31.433  0 431 GLY EEE CA  1 ? 
ATOM   783  C C   . GLY A 1 102 ? 25.922 -5.063  -5.007  1.000 33.106  0 431 GLY EEE C   1 ? 
ATOM   784  O O   . GLY A 1 102 ? 25.277 -5.204  -3.943  1.000 33.955  0 431 GLY EEE O   1 ? 
ATOM   785  N N   . CYS A 1 103 ? 26.858 -4.133  -5.189  1.000 30.008  0 432 CYS EEE N   1 ? 
ATOM   786  C CA  . CYS A 1 103 ? 27.285 -3.173  -4.141  1.000 31.181  0 432 CYS EEE CA  1 ? 
ATOM   787  C C   . CYS A 1 103 ? 27.061 -1.738  -4.601  1.000 31.733  0 432 CYS EEE C   1 ? 
ATOM   788  O O   . CYS A 1 103 ? 27.303 -1.439  -5.798  1.000 32.155  0 432 CYS EEE O   1 ? 
ATOM   789  C CB  . CYS A 1 103 ? 28.751 -3.344  -3.782  1.000 35.452  0 432 CYS EEE CB  1 ? 
ATOM   790  S SG  . CYS A 1 103 ? 29.154 -5.009  -3.203  1.000 38.374  0 432 CYS EEE SG  1 ? 
ATOM   791  N N   . VAL A 1 104 ? 26.670 -0.887  -3.656  1.000 30.093  0 433 VAL EEE N   1 ? 
ATOM   792  C CA  . VAL A 1 104 ? 26.594 0.587   -3.823  1.000 29.768  0 433 VAL EEE CA  1 ? 
ATOM   793  C C   . VAL A 1 104 ? 27.621 1.207   -2.879  1.000 30.430  0 433 VAL EEE C   1 ? 
ATOM   794  O O   . VAL A 1 104 ? 27.548 0.959   -1.659  1.000 30.998  0 433 VAL EEE O   1 ? 
ATOM   795  C CB  . VAL A 1 104 ? 25.178 1.129   -3.579  1.000 29.821  0 433 VAL EEE CB  1 ? 
ATOM   796  C CG1 . VAL A 1 104 ? 25.140 2.645   -3.740  1.000 30.183  0 433 VAL EEE CG1 1 ? 
ATOM   797  C CG2 . VAL A 1 104 ? 24.174 0.463   -4.507  1.000 30.355  0 433 VAL EEE CG2 1 ? 
ATOM   798  N N   . ILE A 1 105 ? 28.544 1.979   -3.445  1.000 29.238  0 434 ILE EEE N   1 ? 
ATOM   799  C CA  . ILE A 1 105 ? 29.670 2.624   -2.717  1.000 31.044  0 434 ILE EEE CA  1 ? 
ATOM   800  C C   . ILE A 1 105 ? 29.586 4.125   -2.994  1.000 30.799  0 434 ILE EEE C   1 ? 
ATOM   801  O O   . ILE A 1 105 ? 29.382 4.501   -4.158  1.000 31.666  0 434 ILE EEE O   1 ? 
ATOM   802  C CB  . ILE A 1 105 ? 31.013 2.027   -3.172  1.000 33.048  0 434 ILE EEE CB  1 ? 
ATOM   803  C CG1 . ILE A 1 105 ? 31.037 0.504   -3.008  1.000 34.691  0 434 ILE EEE CG1 1 ? 
ATOM   804  C CG2 . ILE A 1 105 ? 32.169 2.702   -2.448  1.000 32.936  0 434 ILE EEE CG2 1 ? 
ATOM   805  C CD1 . ILE A 1 105 ? 32.073 -0.201  -3.851  1.000 37.000  0 434 ILE EEE CD1 1 ? 
ATOM   806  N N   . ALA A 1 106 ? 29.707 4.954   -1.962  1.000 30.035  0 435 ALA EEE N   1 ? 
ATOM   807  C CA  . ALA A 1 106 ? 29.634 6.419   -2.119  1.000 30.444  0 435 ALA EEE CA  1 ? 
ATOM   808  C C   . ALA A 1 106 ? 30.574 7.096   -1.127  1.000 31.025  0 435 ALA EEE C   1 ? 
ATOM   809  O O   . ALA A 1 106 ? 30.898 6.514   -0.061  1.000 33.181  0 435 ALA EEE O   1 ? 
ATOM   810  C CB  . ALA A 1 106 ? 28.216 6.907   -1.960  1.000 32.094  0 435 ALA EEE CB  1 ? 
ATOM   811  N N   . TRP A 1 107 ? 31.012 8.289   -1.497  1.000 32.105  0 436 TRP EEE N   1 ? 
ATOM   812  C CA  . TRP A 1 107 ? 31.857 9.149   -0.643  1.000 31.543  0 436 TRP EEE CA  1 ? 
ATOM   813  C C   . TRP A 1 107 ? 31.581 10.606  -0.976  1.000 32.065  0 436 TRP EEE C   1 ? 
ATOM   814  O O   . TRP A 1 107 ? 31.252 10.917  -2.151  1.000 32.370  0 436 TRP EEE O   1 ? 
ATOM   815  C CB  . TRP A 1 107 ? 33.339 8.788   -0.772  1.000 34.103  0 436 TRP EEE CB  1 ? 
ATOM   816  C CG  . TRP A 1 107 ? 33.959 9.036   -2.110  1.000 33.700  0 436 TRP EEE CG  1 ? 
ATOM   817  C CD1 . TRP A 1 107 ? 34.697 10.121  -2.481  1.000 35.820  0 436 TRP EEE CD1 1 ? 
ATOM   818  C CD2 . TRP A 1 107 ? 33.947 8.149   -3.243  1.000 33.531  0 436 TRP EEE CD2 1 ? 
ATOM   819  N NE1 . TRP A 1 107 ? 35.131 9.977   -3.771  1.000 35.912  0 436 TRP EEE NE1 1 ? 
ATOM   820  C CE2 . TRP A 1 107 ? 34.690 8.778   -4.263  1.000 34.264  0 436 TRP EEE CE2 1 ? 
ATOM   821  C CE3 . TRP A 1 107 ? 33.381 6.896   -3.497  1.000 33.340  0 436 TRP EEE CE3 1 ? 
ATOM   822  C CZ2 . TRP A 1 107 ? 34.880 8.192   -5.511  1.000 33.167  0 436 TRP EEE CZ2 1 ? 
ATOM   823  C CZ3 . TRP A 1 107 ? 33.566 6.315   -4.732  1.000 32.390  0 436 TRP EEE CZ3 1 ? 
ATOM   824  C CH2 . TRP A 1 107 ? 34.305 6.959   -5.724  1.000 33.905  0 436 TRP EEE CH2 1 ? 
ATOM   825  N N   . ASN A 1 108 ? 31.732 11.453  0.038   1.000 34.385  0 437 ASN EEE N   1 ? 
ATOM   826  C CA  . ASN A 1 108 ? 31.573 12.917  -0.076  1.000 34.090  0 437 ASN EEE CA  1 ? 
ATOM   827  C C   . ASN A 1 108 ? 32.693 13.435  -0.984  1.000 33.511  0 437 ASN EEE C   1 ? 
ATOM   828  O O   . ASN A 1 108 ? 33.863 13.114  -0.709  1.000 35.331  0 437 ASN EEE O   1 ? 
ATOM   829  C CB  . ASN A 1 108 ? 31.559 13.547  1.316   1.000 35.937  0 437 ASN EEE CB  1 ? 
ATOM   830  C CG  . ASN A 1 108 ? 31.314 15.034  1.260   1.000 36.191  0 437 ASN EEE CG  1 ? 
ATOM   831  O OD1 . ASN A 1 108 ? 32.105 15.761  0.670   1.000 39.597  0 437 ASN EEE OD1 1 ? 
ATOM   832  N ND2 . ASN A 1 108 ? 30.221 15.487  1.849   1.000 38.749  0 437 ASN EEE ND2 1 ? 
ATOM   833  N N   . SER A 1 109 ? 32.356 14.179  -2.042  1.000 32.067  0 438 SER EEE N   1 ? 
ATOM   834  C CA  . SER A 1 109 ? 33.356 14.738  -2.994  1.000 33.318  0 438 SER EEE CA  1 ? 
ATOM   835  C C   . SER A 1 109 ? 33.342 16.271  -2.966  1.000 35.187  0 438 SER EEE C   1 ? 
ATOM   836  O O   . SER A 1 109 ? 33.782 16.887  -3.954  1.000 35.102  0 438 SER EEE O   1 ? 
ATOM   837  C CB  . SER A 1 109 ? 33.133 14.199  -4.391  1.000 33.183  0 438 SER EEE CB  1 ? 
ATOM   838  O OG  . SER A 1 109 ? 31.848 14.555  -4.872  1.000 32.794  0 438 SER EEE OG  1 ? 
ATOM   839  N N   . ASN A 1 110 ? 32.924 16.873  -1.852  1.000 35.595  0 439 ASN EEE N   1 ? 
ATOM   840  C CA  . ASN A 1 110 ? 32.818 18.350  -1.701  1.000 39.024  0 439 ASN EEE CA  1 ? 
ATOM   841  C C   . ASN A 1 110 ? 34.146 19.014  -2.097  1.000 39.533  0 439 ASN EEE C   1 ? 
ATOM   842  O O   . ASN A 1 110 ? 34.110 20.110  -2.688  1.000 40.588  0 439 ASN EEE O   1 ? 
ATOM   843  C CB  . ASN A 1 110 ? 32.406 18.731  -0.278  1.000 40.699  0 439 ASN EEE CB  1 ? 
ATOM   844  C CG  . ASN A 1 110 ? 31.802 20.114  -0.184  1.000 39.549  0 439 ASN EEE CG  1 ? 
ATOM   845  O OD1 . ASN A 1 110 ? 30.995 20.503  -1.022  1.000 40.596  0 439 ASN EEE OD1 1 ? 
ATOM   846  N ND2 . ASN A 1 110 ? 32.164 20.851  0.851   1.000 43.407  0 439 ASN EEE ND2 1 ? 
ATOM   847  N N   . ASN A 1 111 ? 35.270 18.367  -1.782  1.000 39.748  0 440 ASN EEE N   1 ? 
ATOM   848  C CA  . ASN A 1 111 ? 36.647 18.884  -2.016  1.000 44.437  0 440 ASN EEE CA  1 ? 
ATOM   849  C C   . ASN A 1 111 ? 36.923 19.020  -3.518  1.000 44.440  0 440 ASN EEE C   1 ? 
ATOM   850  O O   . ASN A 1 111 ? 37.706 19.903  -3.874  1.000 43.688  0 440 ASN EEE O   1 ? 
ATOM   851  C CB  . ASN A 1 111 ? 37.713 17.996  -1.366  1.000 52.301  0 440 ASN EEE CB  1 ? 
ATOM   852  C CG  . ASN A 1 111 ? 37.568 16.526  -1.713  1.000 60.909  0 440 ASN EEE CG  1 ? 
ATOM   853  O OD1 . ASN A 1 111 ? 36.488 15.944  -1.574  1.000 65.234  0 440 ASN EEE OD1 1 ? 
ATOM   854  N ND2 . ASN A 1 111 ? 38.656 15.909  -2.149  1.000 68.701  0 440 ASN EEE ND2 1 ? 
ATOM   855  N N   . LEU A 1 112 ? 36.325 18.167  -4.354  1.000 43.054  0 441 LEU EEE N   1 ? 
ATOM   856  C CA  . LEU A 1 112 ? 36.626 18.080  -5.811  1.000 42.184  0 441 LEU EEE CA  1 ? 
ATOM   857  C C   . LEU A 1 112 ? 35.500 18.705  -6.641  1.000 39.373  0 441 LEU EEE C   1 ? 
ATOM   858  O O   . LEU A 1 112 ? 35.819 19.270  -7.696  1.000 42.464  0 441 LEU EEE O   1 ? 
ATOM   859  C CB  . LEU A 1 112 ? 36.816 16.612  -6.211  1.000 46.658  0 441 LEU EEE CB  1 ? 
ATOM   860  C CG  . LEU A 1 112 ? 37.991 15.877  -5.565  1.000 50.079  0 441 LEU EEE CG  1 ? 
ATOM   861  C CD1 . LEU A 1 112 ? 38.102 14.465  -6.116  1.000 53.631  0 441 LEU EEE CD1 1 ? 
ATOM   862  C CD2 . LEU A 1 112 ? 39.298 16.625  -5.772  1.000 52.556  0 441 LEU EEE CD2 1 ? 
ATOM   863  N N   . ASP A 1 113 ? 34.243 18.584  -6.206  1.000 35.961  0 442 ASP EEE N   1 ? 
ATOM   864  C CA  . ASP A 1 113 ? 33.054 18.786  -7.080  1.000 36.096  0 442 ASP EEE CA  1 ? 
ATOM   865  C C   . ASP A 1 113 ? 32.279 20.058  -6.713  1.000 36.004  0 442 ASP EEE C   1 ? 
ATOM   866  O O   . ASP A 1 113 ? 31.317 20.376  -7.437  1.000 36.389  0 442 ASP EEE O   1 ? 
ATOM   867  C CB  . ASP A 1 113 ? 32.185 17.530  -7.064  1.000 33.966  0 442 ASP EEE CB  1 ? 
ATOM   868  C CG  . ASP A 1 113 ? 32.852 16.363  -7.767  1.000 33.976  0 442 ASP EEE CG  1 ? 
ATOM   869  O OD1 . ASP A 1 113 ? 33.596 16.619  -8.750  1.000 32.646  0 442 ASP EEE OD1 1 ? 
ATOM   870  O OD2 . ASP A 1 113 ? 32.633 15.210  -7.330  1.000 32.039  0 442 ASP EEE OD2 1 ? 
ATOM   871  N N   . SER A 1 114 ? 32.662 20.751  -5.639  1.000 37.378  0 443 SER EEE N   1 ? 
ATOM   872  C CA  A SER A 1 114 ? 32.101 22.074  -5.258  0.500 37.986  0 443 SER EEE CA  1 ? 
ATOM   873  C CA  B SER A 1 114 ? 32.102 22.075  -5.261  0.500 38.060  0 443 SER EEE CA  1 ? 
ATOM   874  C C   . SER A 1 114 ? 33.133 23.156  -5.589  1.000 38.644  0 443 SER EEE C   1 ? 
ATOM   875  O O   . SER A 1 114 ? 34.320 22.821  -5.698  1.000 42.551  0 443 SER EEE O   1 ? 
ATOM   876  C CB  A SER A 1 114 ? 31.720 22.116  -3.794  0.500 38.778  0 443 SER EEE CB  1 ? 
ATOM   877  C CB  B SER A 1 114 ? 31.738 22.122  -3.801  0.500 37.473  0 443 SER EEE CB  1 ? 
ATOM   878  O OG  A SER A 1 114 ? 30.874 21.026  -3.453  0.500 38.210  0 443 SER EEE OG  1 ? 
ATOM   879  O OG  B SER A 1 114 ? 32.897 22.332  -3.011  0.500 37.797  0 443 SER EEE OG  1 ? 
ATOM   880  N N   . LYS A 1 115 ? 32.690 24.397  -5.734  1.000 42.049  0 444 LYS EEE N   1 ? 
ATOM   881  C CA  . LYS A 1 115 ? 33.620 25.546  -5.861  1.000 44.788  0 444 LYS EEE CA  1 ? 
ATOM   882  C C   . LYS A 1 115 ? 32.908 26.788  -5.324  1.000 44.062  0 444 LYS EEE C   1 ? 
ATOM   883  O O   . LYS A 1 115 ? 31.657 26.816  -5.331  1.000 43.833  0 444 LYS EEE O   1 ? 
ATOM   884  C CB  . LYS A 1 115 ? 34.119 25.680  -7.303  1.000 51.401  0 444 LYS EEE CB  1 ? 
ATOM   885  C CG  . LYS A 1 115 ? 33.119 26.244  -8.298  1.000 56.570  0 444 LYS EEE CG  1 ? 
ATOM   886  C CD  . LYS A 1 115 ? 33.760 26.685  -9.604  1.000 61.180  0 444 LYS EEE CD  1 ? 
ATOM   887  C CE  . LYS A 1 115 ? 32.754 27.203  -10.609 1.000 62.816  0 444 LYS EEE CE  1 ? 
ATOM   888  N NZ  . LYS A 1 115 ? 33.369 27.409  -11.942 1.000 63.557  0 444 LYS EEE NZ  1 ? 
ATOM   889  N N   . VAL A 1 116 ? 33.678 27.749  -4.822  1.000 46.934  0 445 VAL EEE N   1 ? 
ATOM   890  C CA  . VAL A 1 116 ? 33.130 29.039  -4.317  1.000 48.516  0 445 VAL EEE CA  1 ? 
ATOM   891  C C   . VAL A 1 116 ? 32.368 29.682  -5.480  1.000 48.477  0 445 VAL EEE C   1 ? 
ATOM   892  O O   . VAL A 1 116 ? 32.892 29.658  -6.601  1.000 48.212  0 445 VAL EEE O   1 ? 
ATOM   893  C CB  . VAL A 1 116 ? 34.251 29.932  -3.754  1.000 51.357  0 445 VAL EEE CB  1 ? 
ATOM   894  C CG1 . VAL A 1 116 ? 33.770 31.343  -3.450  1.000 52.551  0 445 VAL EEE CG1 1 ? 
ATOM   895  C CG2 . VAL A 1 116 ? 34.881 29.298  -2.523  1.000 55.422  0 445 VAL EEE CG2 1 ? 
ATOM   896  N N   . GLY A 1 117 ? 31.145 30.157  -5.225  1.000 50.448  0 446 GLY EEE N   1 ? 
ATOM   897  C CA  . GLY A 1 117 ? 30.257 30.753  -6.241  1.000 51.341  0 446 GLY EEE CA  1 ? 
ATOM   898  C C   . GLY A 1 117 ? 29.374 29.707  -6.905  1.000 47.534  0 446 GLY EEE C   1 ? 
ATOM   899  O O   . GLY A 1 117 ? 28.421 30.105  -7.595  1.000 49.960  0 446 GLY EEE O   1 ? 
ATOM   900  N N   . GLY A 1 118 ? 29.673 28.418  -6.707  1.000 43.629  0 447 GLY EEE N   1 ? 
ATOM   901  C CA  . GLY A 1 118 ? 28.839 27.289  -7.163  1.000 41.263  0 447 GLY EEE CA  1 ? 
ATOM   902  C C   . GLY A 1 118 ? 29.440 26.573  -8.360  1.000 38.263  0 447 GLY EEE C   1 ? 
ATOM   903  O O   . GLY A 1 118 ? 29.815 27.255  -9.338  1.000 41.034  0 447 GLY EEE O   1 ? 
ATOM   904  N N   . ASN A 1 119 ? 29.565 25.248  -8.276  1.000 35.722  0 448 ASN EEE N   1 ? 
ATOM   905  C CA  . ASN A 1 119 ? 29.802 24.371  -9.451  1.000 33.416  0 448 ASN EEE CA  1 ? 
ATOM   906  C C   . ASN A 1 119 ? 28.436 23.911  -9.959  1.000 32.305  0 448 ASN EEE C   1 ? 
ATOM   907  O O   . ASN A 1 119 ? 27.694 23.280  -9.184  1.000 32.336  0 448 ASN EEE O   1 ? 
ATOM   908  C CB  . ASN A 1 119 ? 30.702 23.169  -9.157  1.000 34.353  0 448 ASN EEE CB  1 ? 
ATOM   909  C CG  . ASN A 1 119 ? 30.946 22.329  -10.395 1.000 36.301  0 448 ASN EEE CG  1 ? 
ATOM   910  O OD1 . ASN A 1 119 ? 30.875 22.832  -11.512 1.000 35.804  0 448 ASN EEE OD1 1 ? 
ATOM   911  N ND2 . ASN A 1 119 ? 31.241 21.055  -10.214 1.000 37.504  0 448 ASN EEE ND2 1 ? 
ATOM   912  N N   . TYR A 1 120 ? 28.137 24.226  -11.219 1.000 30.781  0 449 TYR EEE N   1 ? 
ATOM   913  C CA  . TYR A 1 120 ? 26.840 23.952  -11.883 1.000 31.491  0 449 TYR EEE CA  1 ? 
ATOM   914  C C   . TYR A 1 120 ? 26.997 22.886  -12.971 1.000 29.952  0 449 TYR EEE C   1 ? 
ATOM   915  O O   . TYR A 1 120 ? 25.966 22.557  -13.584 1.000 30.729  0 449 TYR EEE O   1 ? 
ATOM   916  C CB  . TYR A 1 120 ? 26.286 25.248  -12.471 1.000 31.372  0 449 TYR EEE CB  1 ? 
ATOM   917  C CG  . TYR A 1 120 ? 26.118 26.349  -11.460 1.000 34.959  0 449 TYR EEE CG  1 ? 
ATOM   918  C CD1 . TYR A 1 120 ? 25.332 26.165  -10.332 1.000 35.341  0 449 TYR EEE CD1 1 ? 
ATOM   919  C CD2 . TYR A 1 120 ? 26.731 27.579  -11.637 1.000 37.008  0 449 TYR EEE CD2 1 ? 
ATOM   920  C CE1 . TYR A 1 120 ? 25.179 27.170  -9.391  1.000 41.026  0 449 TYR EEE CE1 1 ? 
ATOM   921  C CE2 . TYR A 1 120 ? 26.581 28.595  -10.709 1.000 43.581  0 449 TYR EEE CE2 1 ? 
ATOM   922  C CZ  . TYR A 1 120 ? 25.798 28.389  -9.587  1.000 41.154  0 449 TYR EEE CZ  1 ? 
ATOM   923  O OH  . TYR A 1 120 ? 25.650 29.392  -8.679  1.000 48.082  0 449 TYR EEE OH  1 ? 
ATOM   924  N N   . ASN A 1 121 ? 28.214 22.359  -13.163 1.000 30.239  0 450 ASN EEE N   1 ? 
ATOM   925  C CA  . ASN A 1 121 ? 28.601 21.417  -14.253 1.000 33.489  0 450 ASN EEE CA  1 ? 
ATOM   926  C C   . ASN A 1 121 ? 27.969 20.029  -14.092 1.000 28.334  0 450 ASN EEE C   1 ? 
ATOM   927  O O   . ASN A 1 121 ? 28.020 19.252  -15.053 1.000 29.283  0 450 ASN EEE O   1 ? 
ATOM   928  C CB  . ASN A 1 121 ? 30.119 21.200  -14.292 1.000 38.167  0 450 ASN EEE CB  1 ? 
ATOM   929  C CG  . ASN A 1 121 ? 30.878 22.400  -14.800 1.000 42.675  0 450 ASN EEE CG  1 ? 
ATOM   930  O OD1 . ASN A 1 121 ? 32.085 22.476  -14.637 1.000 45.393  0 450 ASN EEE OD1 1 ? 
ATOM   931  N ND2 . ASN A 1 121 ? 30.181 23.328  -15.436 1.000 52.248  0 450 ASN EEE ND2 1 ? 
ATOM   932  N N   . TYR A 1 122 ? 27.485 19.671  -12.905 1.000 28.879  0 451 TYR EEE N   1 ? 
ATOM   933  C CA  . TYR A 1 122 ? 26.797 18.381  -12.661 1.000 28.159  0 451 TYR EEE CA  1 ? 
ATOM   934  C C   . TYR A 1 122 ? 25.294 18.613  -12.780 1.000 27.796  0 451 TYR EEE C   1 ? 
ATOM   935  O O   . TYR A 1 122 ? 24.747 19.493  -12.088 1.000 27.713  0 451 TYR EEE O   1 ? 
ATOM   936  C CB  . TYR A 1 122 ? 27.160 17.785  -11.299 1.000 28.484  0 451 TYR EEE CB  1 ? 
ATOM   937  C CG  . TYR A 1 122 ? 28.545 17.199  -11.224 1.000 28.812  0 451 TYR EEE CG  1 ? 
ATOM   938  C CD1 . TYR A 1 122 ? 28.843 15.986  -11.828 1.000 29.147  0 451 TYR EEE CD1 1 ? 
ATOM   939  C CD2 . TYR A 1 122 ? 29.560 17.848  -10.541 1.000 28.970  0 451 TYR EEE CD2 1 ? 
ATOM   940  C CE1 . TYR A 1 122 ? 30.113 15.441  -11.765 1.000 30.483  0 451 TYR EEE CE1 1 ? 
ATOM   941  C CE2 . TYR A 1 122 ? 30.834 17.314  -10.465 1.000 29.924  0 451 TYR EEE CE2 1 ? 
ATOM   942  C CZ  . TYR A 1 122 ? 31.111 16.096  -11.062 1.000 31.536  0 451 TYR EEE CZ  1 ? 
ATOM   943  O OH  . TYR A 1 122 ? 32.366 15.560  -10.976 1.000 32.200  0 451 TYR EEE OH  1 ? 
ATOM   944  N N   . LEU A 1 123 ? 24.655 17.841  -13.652 1.000 28.486  0 452 LEU EEE N   1 ? 
ATOM   945  C CA  . LEU A 1 123 ? 23.216 17.974  -13.973 1.000 27.249  0 452 LEU EEE CA  1 ? 
ATOM   946  C C   . LEU A 1 123 ? 22.469 16.710  -13.549 1.000 26.900  0 452 LEU EEE C   1 ? 
ATOM   947  O O   . LEU A 1 123 ? 23.089 15.621  -13.417 1.000 26.755  0 452 LEU EEE O   1 ? 
ATOM   948  C CB  . LEU A 1 123 ? 23.042 18.179  -15.481 1.000 26.848  0 452 LEU EEE CB  1 ? 
ATOM   949  C CG  . LEU A 1 123 ? 23.991 19.157  -16.167 1.000 26.942  0 452 LEU EEE CG  1 ? 
ATOM   950  C CD1 . LEU A 1 123 ? 23.588 19.301  -17.630 1.000 27.414  0 452 LEU EEE CD1 1 ? 
ATOM   951  C CD2 . LEU A 1 123 ? 23.999 20.518  -15.482 1.000 29.190  0 452 LEU EEE CD2 1 ? 
ATOM   952  N N   . TYR A 1 124 ? 21.156 16.841  -13.429 1.000 27.099  0 453 TYR EEE N   1 ? 
ATOM   953  C CA  . TYR A 1 124 ? 20.224 15.699  -13.337 1.000 27.425  0 453 TYR EEE CA  1 ? 
ATOM   954  C C   . TYR A 1 124 ? 19.019 15.982  -14.227 1.000 27.092  0 453 TYR EEE C   1 ? 
ATOM   955  O O   . TYR A 1 124 ? 18.732 17.162  -14.542 1.000 27.235  0 453 TYR EEE O   1 ? 
ATOM   956  C CB  . TYR A 1 124 ? 19.816 15.457  -11.886 1.000 28.202  0 453 TYR EEE CB  1 ? 
ATOM   957  C CG  . TYR A 1 124 ? 19.024 16.577  -11.264 1.000 30.223  0 453 TYR EEE CG  1 ? 
ATOM   958  C CD1 . TYR A 1 124 ? 19.657 17.668  -10.686 1.000 31.589  0 453 TYR EEE CD1 1 ? 
ATOM   959  C CD2 . TYR A 1 124 ? 17.640 16.538  -11.237 1.000 30.971  0 453 TYR EEE CD2 1 ? 
ATOM   960  C CE1 . TYR A 1 124 ? 18.933 18.695  -10.102 1.000 32.638  0 453 TYR EEE CE1 1 ? 
ATOM   961  C CE2 . TYR A 1 124 ? 16.902 17.558  -10.662 1.000 33.378  0 453 TYR EEE CE2 1 ? 
ATOM   962  C CZ  . TYR A 1 124 ? 17.551 18.636  -10.089 1.000 33.741  0 453 TYR EEE CZ  1 ? 
ATOM   963  O OH  . TYR A 1 124 ? 16.819 19.633  -9.525  1.000 37.945  0 453 TYR EEE OH  1 ? 
ATOM   964  N N   . ARG A 1 125 ? 18.342 14.912  -14.626 1.000 26.318  0 454 ARG EEE N   1 ? 
ATOM   965  C CA  . ARG A 1 125 ? 17.070 15.003  -15.374 1.000 26.611  0 454 ARG EEE CA  1 ? 
ATOM   966  C C   . ARG A 1 125 ? 15.942 15.271  -14.373 1.000 28.919  0 454 ARG EEE C   1 ? 
ATOM   967  O O   . ARG A 1 125 ? 15.758 14.463  -13.434 1.000 29.585  0 454 ARG EEE O   1 ? 
ATOM   968  C CB  . ARG A 1 125 ? 16.836 13.741  -16.203 1.000 28.834  0 454 ARG EEE CB  1 ? 
ATOM   969  C CG  . ARG A 1 125 ? 15.621 13.834  -17.113 1.000 28.426  0 454 ARG EEE CG  1 ? 
ATOM   970  C CD  . ARG A 1 125 ? 15.469 12.636  -18.036 1.000 28.518  0 454 ARG EEE CD  1 ? 
ATOM   971  N NE  . ARG A 1 125 ? 16.672 12.500  -18.834 1.000 28.359  0 454 ARG EEE NE  1 ? 
ATOM   972  C CZ  . ARG A 1 125 ? 16.965 13.222  -19.905 1.000 27.718  0 454 ARG EEE CZ  1 ? 
ATOM   973  N NH1 . ARG A 1 125 ? 16.100 14.096  -20.392 1.000 28.689  0 454 ARG EEE NH1 1 ? 
ATOM   974  N NH2 . ARG A 1 125 ? 18.133 13.054  -20.494 1.000 29.211  0 454 ARG EEE NH2 1 ? 
ATOM   975  N N   . LEU A 1 126 ? 15.225 16.374  -14.575 1.000 27.612  0 455 LEU EEE N   1 ? 
ATOM   976  C CA  . LEU A 1 126 ? 14.141 16.845  -13.675 1.000 29.663  0 455 LEU EEE CA  1 ? 
ATOM   977  C C   . LEU A 1 126 ? 12.780 16.358  -14.190 1.000 29.682  0 455 LEU EEE C   1 ? 
ATOM   978  O O   . LEU A 1 126 ? 11.860 16.188  -13.357 1.000 30.294  0 455 LEU EEE O   1 ? 
ATOM   979  C CB  . LEU A 1 126 ? 14.219 18.371  -13.607 1.000 32.671  0 455 LEU EEE CB  1 ? 
ATOM   980  C CG  . LEU A 1 126 ? 13.152 19.074  -12.775 1.000 35.831  0 455 LEU EEE CG  1 ? 
ATOM   981  C CD1 . LEU A 1 126 ? 13.157 18.586  -11.333 1.000 38.801  0 455 LEU EEE CD1 1 ? 
ATOM   982  C CD2 . LEU A 1 126 ? 13.357 20.579  -12.832 1.000 36.161  0 455 LEU EEE CD2 1 ? 
ATOM   983  N N   . PHE A 1 127 ? 12.643 16.160  -15.507 1.000 30.807  0 456 PHE EEE N   1 ? 
ATOM   984  C CA  . PHE A 1 127 ? 11.364 15.772  -16.158 1.000 30.892  0 456 PHE EEE CA  1 ? 
ATOM   985  C C   . PHE A 1 127 ? 11.576 14.595  -17.106 1.000 32.058  0 456 PHE EEE C   1 ? 
ATOM   986  O O   . PHE A 1 127 ? 12.622 14.538  -17.790 1.000 32.116  0 456 PHE EEE O   1 ? 
ATOM   987  C CB  . PHE A 1 127 ? 10.773 16.925  -16.965 1.000 32.435  0 456 PHE EEE CB  1 ? 
ATOM   988  C CG  . PHE A 1 127 ? 10.485 18.175  -16.178 1.000 34.939  0 456 PHE EEE CG  1 ? 
ATOM   989  C CD1 . PHE A 1 127 ? 9.410  18.228  -15.304 1.000 38.388  0 456 PHE EEE CD1 1 ? 
ATOM   990  C CD2 . PHE A 1 127 ? 11.273 19.308  -16.335 1.000 34.615  0 456 PHE EEE CD2 1 ? 
ATOM   991  C CE1 . PHE A 1 127 ? 9.140  19.387  -14.594 1.000 40.378  0 456 PHE EEE CE1 1 ? 
ATOM   992  C CE2 . PHE A 1 127 ? 10.996 20.466  -15.628 1.000 34.844  0 456 PHE EEE CE2 1 ? 
ATOM   993  C CZ  . PHE A 1 127 ? 9.929  20.504  -14.759 1.000 38.370  0 456 PHE EEE CZ  1 ? 
ATOM   994  N N   . ARG A 1 128 ? 10.588 13.700  -17.157 1.000 32.146  0 457 ARG EEE N   1 ? 
ATOM   995  C CA  . ARG A 1 128 ? 10.575 12.547  -18.084 1.000 33.018  0 457 ARG EEE CA  1 ? 
ATOM   996  C C   . ARG A 1 128 ? 9.143  12.025  -18.208 1.000 34.577  0 457 ARG EEE C   1 ? 
ATOM   997  O O   . ARG A 1 128 ? 8.382  12.131  -17.226 1.000 35.509  0 457 ARG EEE O   1 ? 
ATOM   998  C CB  . ARG A 1 128 ? 11.540 11.466  -17.595 1.000 32.904  0 457 ARG EEE CB  1 ? 
ATOM   999  C CG  . ARG A 1 128 ? 11.990 10.514  -18.692 1.000 33.462  0 457 ARG EEE CG  1 ? 
ATOM   1000 C CD  . ARG A 1 128 ? 13.040 9.530   -18.221 1.000 32.846  0 457 ARG EEE CD  1 ? 
ATOM   1001 N NE  . ARG A 1 128 ? 13.534 8.747   -19.343 1.000 33.277  0 457 ARG EEE NE  1 ? 
ATOM   1002 C CZ  . ARG A 1 128 ? 13.064 7.566   -19.744 1.000 34.964  0 457 ARG EEE CZ  1 ? 
ATOM   1003 N NH1 . ARG A 1 128 ? 12.080 6.958   -19.098 1.000 37.316  0 457 ARG EEE NH1 1 ? 
ATOM   1004 N NH2 . ARG A 1 128 ? 13.610 6.982   -20.797 1.000 34.773  0 457 ARG EEE NH2 1 ? 
ATOM   1005 N N   . LYS A 1 129 ? 8.802  11.469  -19.373 1.000 36.061  0 458 LYS EEE N   1 ? 
ATOM   1006 C CA  . LYS A 1 129 ? 7.426  11.001  -19.689 1.000 37.989  0 458 LYS EEE CA  1 ? 
ATOM   1007 C C   . LYS A 1 129 ? 7.104  9.743   -18.881 1.000 36.815  0 458 LYS EEE C   1 ? 
ATOM   1008 O O   . LYS A 1 129 ? 5.910  9.471   -18.660 1.000 40.629  0 458 LYS EEE O   1 ? 
ATOM   1009 C CB  . LYS A 1 129 ? 7.266  10.758  -21.192 1.000 42.485  0 458 LYS EEE CB  1 ? 
ATOM   1010 C CG  . LYS A 1 129 ? 7.135  12.026  -22.026 1.000 46.336  0 458 LYS EEE CG  1 ? 
ATOM   1011 C CD  . LYS A 1 129 ? 6.554  11.797  -23.407 1.000 53.700  0 458 LYS EEE CD  1 ? 
ATOM   1012 C CE  . LYS A 1 129 ? 7.602  11.519  -24.462 1.000 59.082  0 458 LYS EEE CE  1 ? 
ATOM   1013 N NZ  . LYS A 1 129 ? 6.991  11.389  -25.806 1.000 63.281  0 458 LYS EEE NZ  1 ? 
ATOM   1014 N N   . SER A 1 130 ? 8.126  9.000   -18.462 1.000 36.496  0 459 SER EEE N   1 ? 
ATOM   1015 C CA  . SER A 1 130 ? 7.967  7.723   -17.729 1.000 38.106  0 459 SER EEE CA  1 ? 
ATOM   1016 C C   . SER A 1 130 ? 9.236  7.440   -16.928 1.000 35.742  0 459 SER EEE C   1 ? 
ATOM   1017 O O   . SER A 1 130 ? 10.274 8.099   -17.184 1.000 33.935  0 459 SER EEE O   1 ? 
ATOM   1018 C CB  . SER A 1 130 ? 7.634  6.598   -18.677 1.000 39.902  0 459 SER EEE CB  1 ? 
ATOM   1019 O OG  . SER A 1 130 ? 8.785  6.214   -19.407 1.000 39.950  0 459 SER EEE OG  1 ? 
ATOM   1020 N N   . ASN A 1 131 ? 9.147  6.509   -15.982 1.000 37.341  0 460 ASN EEE N   1 ? 
ATOM   1021 C CA  . ASN A 1 131 ? 10.298 6.104   -15.138 1.000 36.090  0 460 ASN EEE CA  1 ? 
ATOM   1022 C C   . ASN A 1 131 ? 11.249 5.248   -15.972 1.000 32.548  0 460 ASN EEE C   1 ? 
ATOM   1023 O O   . ASN A 1 131 ? 10.781 4.484   -16.834 1.000 34.514  0 460 ASN EEE O   1 ? 
ATOM   1024 C CB  . ASN A 1 131 ? 9.852  5.358   -13.881 1.000 36.876  0 460 ASN EEE CB  1 ? 
ATOM   1025 C CG  . ASN A 1 131 ? 9.101  6.244   -12.916 1.000 37.689  0 460 ASN EEE CG  1 ? 
ATOM   1026 O OD1 . ASN A 1 131 ? 9.114  7.467   -13.044 1.000 38.010  0 460 ASN EEE OD1 1 ? 
ATOM   1027 N ND2 . ASN A 1 131 ? 8.455  5.632   -11.939 1.000 42.750  0 460 ASN EEE ND2 1 ? 
ATOM   1028 N N   . LEU A 1 132 ? 12.542 5.374   -15.708 1.000 33.535  0 461 LEU EEE N   1 ? 
ATOM   1029 C CA  . LEU A 1 132 ? 13.588 4.497   -16.285 1.000 33.089  0 461 LEU EEE CA  1 ? 
ATOM   1030 C C   . LEU A 1 132 ? 13.321 3.049   -15.883 1.000 32.911  0 461 LEU EEE C   1 ? 
ATOM   1031 O O   . LEU A 1 132 ? 12.908 2.793   -14.728 1.000 33.950  0 461 LEU EEE O   1 ? 
ATOM   1032 C CB  . LEU A 1 132 ? 14.962 4.911   -15.761 1.000 32.265  0 461 LEU EEE CB  1 ? 
ATOM   1033 C CG  . LEU A 1 132 ? 15.519 6.238   -16.266 1.000 32.676  0 461 LEU EEE CG  1 ? 
ATOM   1034 C CD1 . LEU A 1 132 ? 16.866 6.498   -15.623 1.000 31.268  0 461 LEU EEE CD1 1 ? 
ATOM   1035 C CD2 . LEU A 1 132 ? 15.660 6.249   -17.780 1.000 34.010  0 461 LEU EEE CD2 1 ? 
ATOM   1036 N N   . LYS A 1 133 ? 13.608 2.139   -16.803 1.000 33.923  0 462 LYS EEE N   1 ? 
ATOM   1037 C CA  . LYS A 1 133 ? 13.799 0.708   -16.495 1.000 33.916  0 462 LYS EEE CA  1 ? 
ATOM   1038 C C   . LYS A 1 133 ? 15.139 0.571   -15.786 1.000 33.044  0 462 LYS EEE C   1 ? 
ATOM   1039 O O   . LYS A 1 133 ? 15.995 1.454   -15.895 1.000 29.870  0 462 LYS EEE O   1 ? 
ATOM   1040 C CB  . LYS A 1 133 ? 13.742 -0.125  -17.775 1.000 37.319  0 462 LYS EEE CB  1 ? 
ATOM   1041 C CG  . LYS A 1 133 ? 12.367 -0.185  -18.423 1.000 42.523  0 462 LYS EEE CG  1 ? 
ATOM   1042 C CD  . LYS A 1 133 ? 12.224 -1.307  -19.424 1.000 52.762  0 462 LYS EEE CD  1 ? 
ATOM   1043 C CE  . LYS A 1 133 ? 10.900 -2.028  -19.288 1.000 60.526  0 462 LYS EEE CE  1 ? 
ATOM   1044 N NZ  . LYS A 1 133 ? 10.708 -3.031  -20.358 1.000 64.489  0 462 LYS EEE NZ  1 ? 
ATOM   1045 N N   . PRO A 1 134 ? 15.368 -0.532  -15.043 1.000 33.680  0 463 PRO EEE N   1 ? 
ATOM   1046 C CA  . PRO A 1 134 ? 16.659 -0.742  -14.389 1.000 32.766  0 463 PRO EEE CA  1 ? 
ATOM   1047 C C   . PRO A 1 134 ? 17.806 -0.660  -15.405 1.000 31.604  0 463 PRO EEE C   1 ? 
ATOM   1048 O O   . PRO A 1 134 ? 17.717 -1.292  -16.456 1.000 31.365  0 463 PRO EEE O   1 ? 
ATOM   1049 C CB  . PRO A 1 134 ? 16.541 -2.141  -13.778 1.000 34.438  0 463 PRO EEE CB  1 ? 
ATOM   1050 C CG  . PRO A 1 134 ? 15.048 -2.316  -13.579 1.000 36.207  0 463 PRO EEE CG  1 ? 
ATOM   1051 C CD  . PRO A 1 134 ? 14.418 -1.624  -14.772 1.000 36.016  0 463 PRO EEE CD  1 ? 
ATOM   1052 N N   . PHE A 1 135 ? 18.828 0.127   -15.064 1.000 30.190  0 464 PHE EEE N   1 ? 
ATOM   1053 C CA  . PHE A 1 135 ? 20.083 0.327   -15.830 1.000 30.948  0 464 PHE EEE CA  1 ? 
ATOM   1054 C C   . PHE A 1 135 ? 19.819 1.022   -17.169 1.000 30.302  0 464 PHE EEE C   1 ? 
ATOM   1055 O O   . PHE A 1 135 ? 20.738 1.035   -17.993 1.000 31.314  0 464 PHE EEE O   1 ? 
ATOM   1056 C CB  . PHE A 1 135 ? 20.798 -1.007  -16.034 1.000 30.801  0 464 PHE EEE CB  1 ? 
ATOM   1057 C CG  . PHE A 1 135 ? 21.229 -1.666  -14.751 1.000 32.063  0 464 PHE EEE CG  1 ? 
ATOM   1058 C CD1 . PHE A 1 135 ? 22.100 -1.018  -13.888 1.000 32.078  0 464 PHE EEE CD1 1 ? 
ATOM   1059 C CD2 . PHE A 1 135 ? 20.798 -2.944  -14.424 1.000 33.665  0 464 PHE EEE CD2 1 ? 
ATOM   1060 C CE1 . PHE A 1 135 ? 22.521 -1.633  -12.723 1.000 32.030  0 464 PHE EEE CE1 1 ? 
ATOM   1061 C CE2 . PHE A 1 135 ? 21.227 -3.559  -13.255 1.000 32.252  0 464 PHE EEE CE2 1 ? 
ATOM   1062 C CZ  . PHE A 1 135 ? 22.084 -2.898  -12.409 1.000 33.069  0 464 PHE EEE CZ  1 ? 
ATOM   1063 N N   . GLU A 1 136 ? 18.646 1.627   -17.358 1.000 29.332  0 465 GLU EEE N   1 ? 
ATOM   1064 C CA  . GLU A 1 136 ? 18.365 2.472   -18.551 1.000 30.089  0 465 GLU EEE CA  1 ? 
ATOM   1065 C C   . GLU A 1 136 ? 19.121 3.801   -18.409 1.000 29.502  0 465 GLU EEE C   1 ? 
ATOM   1066 O O   . GLU A 1 136 ? 19.353 4.272   -17.269 1.000 28.711  0 465 GLU EEE O   1 ? 
ATOM   1067 C CB  . GLU A 1 136 ? 16.863 2.678   -18.729 1.000 30.976  0 465 GLU EEE CB  1 ? 
ATOM   1068 C CG  . GLU A 1 136 ? 16.495 3.306   -20.060 1.000 33.392  0 465 GLU EEE CG  1 ? 
ATOM   1069 C CD  . GLU A 1 136 ? 15.002 3.460   -20.288 1.000 36.275  0 465 GLU EEE CD  1 ? 
ATOM   1070 O OE1 . GLU A 1 136 ? 14.216 3.084   -19.397 1.000 38.837  0 465 GLU EEE OE1 1 ? 
ATOM   1071 O OE2 . GLU A 1 136 ? 14.629 3.974   -21.349 1.000 41.566  0 465 GLU EEE OE2 1 ? 
ATOM   1072 N N   . ARG A 1 137 ? 19.536 4.373   -19.537 1.000 29.186  0 466 ARG EEE N   1 ? 
ATOM   1073 C CA  . ARG A 1 137 ? 20.268 5.654   -19.581 1.000 28.546  0 466 ARG EEE CA  1 ? 
ATOM   1074 C C   . ARG A 1 137 ? 19.576 6.555   -20.599 1.000 29.059  0 466 ARG EEE C   1 ? 
ATOM   1075 O O   . ARG A 1 137 ? 19.297 6.076   -21.708 1.000 31.209  0 466 ARG EEE O   1 ? 
ATOM   1076 C CB  . ARG A 1 137 ? 21.731 5.413   -19.945 1.000 29.368  0 466 ARG EEE CB  1 ? 
ATOM   1077 C CG  . ARG A 1 137 ? 22.606 6.650   -19.840 1.000 27.820  0 466 ARG EEE CG  1 ? 
ATOM   1078 C CD  . ARG A 1 137 ? 24.050 6.209   -19.873 1.000 28.121  0 466 ARG EEE CD  1 ? 
ATOM   1079 N NE  . ARG A 1 137 ? 25.026 7.280   -19.964 1.000 27.735  0 466 ARG EEE NE  1 ? 
ATOM   1080 C CZ  . ARG A 1 137 ? 25.374 7.908   -21.089 1.000 29.778  0 466 ARG EEE CZ  1 ? 
ATOM   1081 N NH1 . ARG A 1 137 ? 24.792 7.618   -22.246 1.000 29.984  0 466 ARG EEE NH1 1 ? 
ATOM   1082 N NH2 . ARG A 1 137 ? 26.309 8.835   -21.043 1.000 29.084  0 466 ARG EEE NH2 1 ? 
ATOM   1083 N N   . ASP A 1 138 ? 19.261 7.782   -20.200 1.000 27.562  0 467 ASP EEE N   1 ? 
ATOM   1084 C CA  . ASP A 1 138 ? 18.584 8.779   -21.061 1.000 28.577  0 467 ASP EEE CA  1 ? 
ATOM   1085 C C   . ASP A 1 138 ? 19.448 10.041  -21.084 1.000 28.265  0 467 ASP EEE C   1 ? 
ATOM   1086 O O   . ASP A 1 138 ? 19.565 10.703  -20.037 1.000 27.640  0 467 ASP EEE O   1 ? 
ATOM   1087 C CB  . ASP A 1 138 ? 17.152 9.026   -20.580 1.000 29.332  0 467 ASP EEE CB  1 ? 
ATOM   1088 C CG  . ASP A 1 138 ? 16.335 9.908   -21.508 1.000 31.748  0 467 ASP EEE CG  1 ? 
ATOM   1089 O OD1 . ASP A 1 138 ? 16.917 10.447  -22.483 1.000 33.480  0 467 ASP EEE OD1 1 ? 
ATOM   1090 O OD2 . ASP A 1 138 ? 15.129 10.052  -21.245 1.000 33.124  0 467 ASP EEE OD2 1 ? 
ATOM   1091 N N   . ILE A 1 139 ? 20.012 10.380  -22.242 1.000 28.310  0 468 ILE EEE N   1 ? 
ATOM   1092 C CA  . ILE A 1 139 ? 20.828 11.617  -22.395 1.000 28.162  0 468 ILE EEE CA  1 ? 
ATOM   1093 C C   . ILE A 1 139 ? 20.133 12.588  -23.358 1.000 28.682  0 468 ILE EEE C   1 ? 
ATOM   1094 O O   . ILE A 1 139 ? 20.764 13.574  -23.746 1.000 29.545  0 468 ILE EEE O   1 ? 
ATOM   1095 C CB  . ILE A 1 139 ? 22.282 11.273  -22.774 1.000 30.092  0 468 ILE EEE CB  1 ? 
ATOM   1096 C CG1 . ILE A 1 139 ? 22.414 10.394  -24.022 1.000 32.539  0 468 ILE EEE CG1 1 ? 
ATOM   1097 C CG2 . ILE A 1 139 ? 22.972 10.634  -21.576 1.000 29.918  0 468 ILE EEE CG2 1 ? 
ATOM   1098 C CD1 . ILE A 1 139 ? 22.010 11.069  -25.310 1.000 35.241  0 468 ILE EEE CD1 1 ? 
ATOM   1099 N N   . SER A 1 140 ? 18.853 12.362  -23.659 1.000 28.816  0 469 SER EEE N   1 ? 
ATOM   1100 C CA  A SER A 1 140 ? 18.085 13.245  -24.574 0.500 28.784  0 469 SER EEE CA  1 ? 
ATOM   1101 C CA  B SER A 1 140 ? 18.006 13.223  -24.530 0.500 30.071  0 469 SER EEE CA  1 ? 
ATOM   1102 C C   . SER A 1 140 ? 17.881 14.630  -23.935 1.000 28.919  0 469 SER EEE C   1 ? 
ATOM   1103 O O   . SER A 1 140 ? 17.861 14.743  -22.681 1.000 28.780  0 469 SER EEE O   1 ? 
ATOM   1104 C CB  A SER A 1 140 ? 16.791 12.606  -25.001 0.500 29.299  0 469 SER EEE CB  1 ? 
ATOM   1105 C CB  B SER A 1 140 ? 16.636 12.611  -24.712 0.500 32.176  0 469 SER EEE CB  1 ? 
ATOM   1106 O OG  A SER A 1 140 ? 15.962 12.320  -23.892 0.500 26.052  0 469 SER EEE OG  1 ? 
ATOM   1107 O OG  B SER A 1 140 ? 15.754 13.517  -25.369 0.500 35.810  0 469 SER EEE OG  1 ? 
ATOM   1108 N N   . THR A 1 141 ? 17.763 15.647  -24.787 1.000 28.882  0 470 THR EEE N   1 ? 
ATOM   1109 C CA  . THR A 1 141 ? 17.512 17.056  -24.391 1.000 29.850  0 470 THR EEE CA  1 ? 
ATOM   1110 C C   . THR A 1 141 ? 16.272 17.584  -25.121 1.000 29.824  0 470 THR EEE C   1 ? 
ATOM   1111 O O   . THR A 1 141 ? 16.192 18.804  -25.341 1.000 33.646  0 470 THR EEE O   1 ? 
ATOM   1112 C CB  . THR A 1 141 ? 18.758 17.913  -24.623 1.000 32.574  0 470 THR EEE CB  1 ? 
ATOM   1113 O OG1 . THR A 1 141 ? 19.188 17.717  -25.970 1.000 32.638  0 470 THR EEE OG1 1 ? 
ATOM   1114 C CG2 . THR A 1 141 ? 19.867 17.569  -23.652 1.000 33.695  0 470 THR EEE CG2 1 ? 
ATOM   1115 N N   . GLU A 1 142 ? 15.337 16.690  -25.448 1.000 31.605  0 471 GLU EEE N   1 ? 
ATOM   1116 C CA  . GLU A 1 142 ? 14.003 17.018  -26.012 1.000 33.999  0 471 GLU EEE CA  1 ? 
ATOM   1117 C C   . GLU A 1 142 ? 13.305 17.982  -25.047 1.000 33.429  0 471 GLU EEE C   1 ? 
ATOM   1118 O O   . GLU A 1 142 ? 13.315 17.723  -23.828 1.000 31.874  0 471 GLU EEE O   1 ? 
ATOM   1119 C CB  . GLU A 1 142 ? 13.215 15.723  -26.220 1.000 40.807  0 471 GLU EEE CB  1 ? 
ATOM   1120 C CG  . GLU A 1 142 ? 11.763 15.912  -26.618 1.000 48.674  0 471 GLU EEE CG  1 ? 
ATOM   1121 C CD  . GLU A 1 142 ? 10.988 14.622  -26.863 1.000 56.602  0 471 GLU EEE CD  1 ? 
ATOM   1122 O OE1 . GLU A 1 142 ? 10.920 13.760  -25.944 1.000 58.242  0 471 GLU EEE OE1 1 ? 
ATOM   1123 O OE2 . GLU A 1 142 ? 10.448 14.481  -27.967 1.000 60.310  0 471 GLU EEE OE2 1 ? 
ATOM   1124 N N   . ILE A 1 143 ? 12.747 19.075  -25.563 1.000 33.001  0 472 ILE EEE N   1 ? 
ATOM   1125 C CA  . ILE A 1 143 ? 11.925 19.999  -24.737 1.000 33.367  0 472 ILE EEE CA  1 ? 
ATOM   1126 C C   . ILE A 1 143 ? 10.720 19.205  -24.217 1.000 33.830  0 472 ILE EEE C   1 ? 
ATOM   1127 O O   . ILE A 1 143 ? 10.069 18.494  -25.008 1.000 35.947  0 472 ILE EEE O   1 ? 
ATOM   1128 C CB  . ILE A 1 143 ? 11.556 21.268  -25.519 1.000 32.844  0 472 ILE EEE CB  1 ? 
ATOM   1129 C CG1 . ILE A 1 143 ? 12.814 22.002  -25.994 1.000 33.047  0 472 ILE EEE CG1 1 ? 
ATOM   1130 C CG2 . ILE A 1 143 ? 10.654 22.170  -24.696 1.000 34.606  0 472 ILE EEE CG2 1 ? 
ATOM   1131 C CD1 . ILE A 1 143 ? 13.872 22.185  -24.916 1.000 32.982  0 472 ILE EEE CD1 1 ? 
ATOM   1132 N N   . TYR A 1 144 ? 10.493 19.284  -22.908 1.000 33.542  0 473 TYR EEE N   1 ? 
ATOM   1133 C CA  . TYR A 1 144 ? 9.523  18.450  -22.161 1.000 34.014  0 473 TYR EEE CA  1 ? 
ATOM   1134 C C   . TYR A 1 144 ? 8.160  19.141  -22.144 1.000 35.881  0 473 TYR EEE C   1 ? 
ATOM   1135 O O   . TYR A 1 144 ? 8.070  20.296  -21.686 1.000 36.211  0 473 TYR EEE O   1 ? 
ATOM   1136 C CB  . TYR A 1 144 ? 10.017 18.197  -20.736 1.000 34.361  0 473 TYR EEE CB  1 ? 
ATOM   1137 C CG  . TYR A 1 144 ? 9.039  17.416  -19.897 1.000 35.316  0 473 TYR EEE CG  1 ? 
ATOM   1138 C CD1 . TYR A 1 144 ? 8.942  16.041  -20.010 1.000 35.631  0 473 TYR EEE CD1 1 ? 
ATOM   1139 C CD2 . TYR A 1 144 ? 8.197  18.057  -19.003 1.000 38.351  0 473 TYR EEE CD2 1 ? 
ATOM   1140 C CE1 . TYR A 1 144 ? 8.045  15.315  -19.245 1.000 37.267  0 473 TYR EEE CE1 1 ? 
ATOM   1141 C CE2 . TYR A 1 144 ? 7.294  17.349  -18.229 1.000 37.493  0 473 TYR EEE CE2 1 ? 
ATOM   1142 C CZ  . TYR A 1 144 ? 7.217  15.974  -18.353 1.000 38.680  0 473 TYR EEE CZ  1 ? 
ATOM   1143 O OH  . TYR A 1 144 ? 6.331  15.280  -17.590 1.000 43.184  0 473 TYR EEE OH  1 ? 
ATOM   1144 N N   . GLN A 1 145 ? 7.133  18.430  -22.613 1.000 39.771  0 474 GLN EEE N   1 ? 
ATOM   1145 C CA  . GLN A 1 145 ? 5.729  18.909  -22.664 1.000 42.401  0 474 GLN EEE CA  1 ? 
ATOM   1146 C C   . GLN A 1 145 ? 5.041  18.637  -21.319 1.000 43.325  0 474 GLN EEE C   1 ? 
ATOM   1147 O O   . GLN A 1 145 ? 4.585  17.494  -21.095 1.000 45.112  0 474 GLN EEE O   1 ? 
ATOM   1148 C CB  . GLN A 1 145 ? 5.007  18.230  -23.828 1.000 46.642  0 474 GLN EEE CB  1 ? 
ATOM   1149 C CG  . GLN A 1 145 ? 3.678  18.880  -24.156 1.000 49.797  0 474 GLN EEE CG  1 ? 
ATOM   1150 C CD  . GLN A 1 145 ? 2.867  18.045  -25.113 1.000 50.646  0 474 GLN EEE CD  1 ? 
ATOM   1151 O OE1 . GLN A 1 145 ? 3.381  17.532  -26.103 1.000 52.617  0 474 GLN EEE OE1 1 ? 
ATOM   1152 N NE2 . GLN A 1 145 ? 1.586  17.905  -24.822 1.000 57.750  0 474 GLN EEE NE2 1 ? 
ATOM   1153 N N   . ALA A 1 146 ? 4.958  19.656  -20.460 1.000 42.524  0 475 ALA EEE N   1 ? 
ATOM   1154 C CA  . ALA A 1 146 ? 4.315  19.572  -19.126 1.000 47.108  0 475 ALA EEE CA  1 ? 
ATOM   1155 C C   . ALA A 1 146 ? 2.796  19.756  -19.253 1.000 49.783  0 475 ALA EEE C   1 ? 
ATOM   1156 O O   . ALA A 1 146 ? 2.088  19.334  -18.327 1.000 51.278  0 475 ALA EEE O   1 ? 
ATOM   1157 C CB  . ALA A 1 146 ? 4.926  20.583  -18.186 1.000 47.379  0 475 ALA EEE CB  1 ? 
ATOM   1158 N N   . GLY A 1 147 ? 2.317  20.346  -20.355 1.000 52.633  0 476 GLY EEE N   1 ? 
ATOM   1159 C CA  . GLY A 1 147 ? 0.885  20.625  -20.589 1.000 54.952  0 476 GLY EEE CA  1 ? 
ATOM   1160 C C   . GLY A 1 147 ? 0.344  19.855  -21.781 1.000 55.987  0 476 GLY EEE C   1 ? 
ATOM   1161 O O   . GLY A 1 147 ? 0.959  18.852  -22.159 1.000 57.415  0 476 GLY EEE O   1 ? 
ATOM   1162 N N   . SER A 1 148 ? -0.772 20.318  -22.352 1.000 59.873  0 477 SER EEE N   1 ? 
ATOM   1163 C CA  . SER A 1 148 ? -1.483 19.703  -23.504 1.000 61.198  0 477 SER EEE CA  1 ? 
ATOM   1164 C C   . SER A 1 148 ? -0.975 20.262  -24.841 1.000 61.463  0 477 SER EEE C   1 ? 
ATOM   1165 O O   . SER A 1 148 ? -1.211 19.600  -25.867 1.000 70.587  0 477 SER EEE O   1 ? 
ATOM   1166 C CB  . SER A 1 148 ? -2.967 19.902  -23.363 1.000 65.292  0 477 SER EEE CB  1 ? 
ATOM   1167 O OG  . SER A 1 148 ? -3.246 21.228  -22.935 1.000 66.046  0 477 SER EEE OG  1 ? 
ATOM   1168 N N   . THR A 1 149 ? -0.324 21.430  -24.840 1.000 60.333  0 478 THR EEE N   1 ? 
ATOM   1169 C CA  . THR A 1 149 ? 0.195  22.110  -26.061 1.000 61.031  0 478 THR EEE CA  1 ? 
ATOM   1170 C C   . THR A 1 149 ? 1.548  21.514  -26.437 1.000 56.026  0 478 THR EEE C   1 ? 
ATOM   1171 O O   . THR A 1 149 ? 2.463  21.502  -25.616 1.000 57.401  0 478 THR EEE O   1 ? 
ATOM   1172 C CB  . THR A 1 149 ? 0.324  23.628  -25.863 1.000 62.571  0 478 THR EEE CB  1 ? 
ATOM   1173 O OG1 . THR A 1 149 ? -0.920 24.132  -25.378 1.000 62.986  0 478 THR EEE OG1 1 ? 
ATOM   1174 C CG2 . THR A 1 149 ? 0.700  24.365  -27.130 1.000 64.400  0 478 THR EEE CG2 1 ? 
ATOM   1175 N N   . PRO A 1 150 ? 1.733  21.007  -27.679 1.000 56.782  0 479 PRO EEE N   1 ? 
ATOM   1176 C CA  . PRO A 1 150 ? 3.046  20.538  -28.125 1.000 55.200  0 479 PRO EEE CA  1 ? 
ATOM   1177 C C   . PRO A 1 150 ? 4.089  21.665  -28.130 1.000 52.750  0 479 PRO EEE C   1 ? 
ATOM   1178 O O   . PRO A 1 150 ? 3.739  22.804  -28.398 1.000 51.054  0 479 PRO EEE O   1 ? 
ATOM   1179 C CB  . PRO A 1 150 ? 2.796  20.021  -29.551 1.000 56.908  0 479 PRO EEE CB  1 ? 
ATOM   1180 C CG  . PRO A 1 150 ? 1.308  19.745  -29.592 1.000 59.198  0 479 PRO EEE CG  1 ? 
ATOM   1181 C CD  . PRO A 1 150 ? 0.695  20.806  -28.702 1.000 58.978  0 479 PRO EEE CD  1 ? 
ATOM   1182 N N   . CYS A 1 151 ? 5.345  21.318  -27.844 1.000 51.362  0 480 CYS EEE N   1 ? 
ATOM   1183 C CA  . CYS A 1 151 ? 6.473  22.271  -27.696 1.000 48.047  0 480 CYS EEE CA  1 ? 
ATOM   1184 C C   . CYS A 1 151 ? 7.190  22.465  -29.039 1.000 49.354  0 480 CYS EEE C   1 ? 
ATOM   1185 O O   . CYS A 1 151 ? 7.689  23.584  -29.276 1.000 42.695  0 480 CYS EEE O   1 ? 
ATOM   1186 C CB  . CYS A 1 151 ? 7.437  21.784  -26.620 1.000 46.640  0 480 CYS EEE CB  1 ? 
ATOM   1187 S SG  . CYS A 1 151 ? 6.637  21.561  -25.007 1.000 48.016  0 480 CYS EEE SG  1 ? 
ATOM   1188 N N   . ASN A 1 152 ? 7.250  21.419  -29.872 1.000 52.918  0 481 ASN EEE N   1 ? 
ATOM   1189 C CA  . ASN A 1 152 ? 7.950  21.419  -31.186 1.000 53.677  0 481 ASN EEE CA  1 ? 
ATOM   1190 C C   . ASN A 1 152 ? 9.390  21.915  -30.998 1.000 47.101  0 481 ASN EEE C   1 ? 
ATOM   1191 O O   . ASN A 1 152 ? 9.852  22.721  -31.829 1.000 44.528  0 481 ASN EEE O   1 ? 
ATOM   1192 C CB  . ASN A 1 152 ? 7.208  22.265  -32.224 1.000 58.583  0 481 ASN EEE CB  1 ? 
ATOM   1193 C CG  . ASN A 1 152 ? 5.824  21.733  -32.530 1.000 63.300  0 481 ASN EEE CG  1 ? 
ATOM   1194 O OD1 . ASN A 1 152 ? 5.676  20.604  -32.995 1.000 70.203  0 481 ASN EEE OD1 1 ? 
ATOM   1195 N ND2 . ASN A 1 152 ? 4.804  22.536  -32.276 1.000 66.715  0 481 ASN EEE ND2 1 ? 
ATOM   1196 N N   . GLY A 1 153 ? 10.062 21.467  -29.931 1.000 43.920  0 482 GLY EEE N   1 ? 
ATOM   1197 C CA  . GLY A 1 153 ? 11.476 21.784  -29.650 1.000 44.462  0 482 GLY EEE CA  1 ? 
ATOM   1198 C C   . GLY A 1 153 ? 11.704 23.228  -29.216 1.000 42.682  0 482 GLY EEE C   1 ? 
ATOM   1199 O O   . GLY A 1 153 ? 12.876 23.655  -29.211 1.000 41.225  0 482 GLY EEE O   1 ? 
ATOM   1200 N N   . VAL A 1 154 ? 10.647 23.952  -28.826 1.000 38.713  0 483 VAL EEE N   1 ? 
ATOM   1201 C CA  . VAL A 1 154 ? 10.716 25.391  -28.439 1.000 38.153  0 483 VAL EEE CA  1 ? 
ATOM   1202 C C   . VAL A 1 154 ? 10.276 25.531  -26.977 1.000 36.553  0 483 VAL EEE C   1 ? 
ATOM   1203 O O   . VAL A 1 154 ? 9.160  25.086  -26.622 1.000 36.392  0 483 VAL EEE O   1 ? 
ATOM   1204 C CB  . VAL A 1 154 ? 9.878  26.281  -29.374 1.000 42.463  0 483 VAL EEE CB  1 ? 
ATOM   1205 C CG1 . VAL A 1 154 ? 9.955  27.750  -28.979 1.000 45.102  0 483 VAL EEE CG1 1 ? 
ATOM   1206 C CG2 . VAL A 1 154 ? 10.295 26.102  -30.824 1.000 45.478  0 483 VAL EEE CG2 1 ? 
ATOM   1207 N N   . GLU A 1 155 ? 11.135 26.131  -26.155 1.000 34.513  0 484 GLU EEE N   1 ? 
ATOM   1208 C CA  . GLU A 1 155 ? 10.845 26.343  -24.720 1.000 33.607  0 484 GLU EEE CA  1 ? 
ATOM   1209 C C   . GLU A 1 155 ? 9.844  27.488  -24.571 1.000 34.861  0 484 GLU EEE C   1 ? 
ATOM   1210 O O   . GLU A 1 155 ? 9.829  28.414  -25.407 1.000 38.657  0 484 GLU EEE O   1 ? 
ATOM   1211 C CB  . GLU A 1 155 ? 12.125 26.615  -23.935 1.000 31.851  0 484 GLU EEE CB  1 ? 
ATOM   1212 C CG  . GLU A 1 155 ? 13.091 25.452  -23.958 1.000 30.852  0 484 GLU EEE CG  1 ? 
ATOM   1213 C CD  . GLU A 1 155 ? 14.364 25.723  -23.182 1.000 31.117  0 484 GLU EEE CD  1 ? 
ATOM   1214 O OE1 . GLU A 1 155 ? 14.251 26.048  -21.979 1.000 31.547  0 484 GLU EEE OE1 1 ? 
ATOM   1215 O OE2 . GLU A 1 155 ? 15.462 25.644  -23.783 1.000 30.703  0 484 GLU EEE OE2 1 ? 
ATOM   1216 N N   . GLY A 1 156 ? 9.042  27.415  -23.519 1.000 35.649  0 485 GLY EEE N   1 ? 
ATOM   1217 C CA  . GLY A 1 156 ? 8.073  28.458  -23.154 1.000 37.245  0 485 GLY EEE CA  1 ? 
ATOM   1218 C C   . GLY A 1 156 ? 7.149  27.937  -22.080 1.000 37.427  0 485 GLY EEE C   1 ? 
ATOM   1219 O O   . GLY A 1 156 ? 7.586  27.072  -21.288 1.000 38.490  0 485 GLY EEE O   1 ? 
ATOM   1220 N N   . PHE A 1 157 ? 5.915  28.421  -22.060 1.000 39.648  0 486 PHE EEE N   1 ? 
ATOM   1221 C CA  A PHE A 1 157 ? 4.900  28.004  -21.060 0.500 42.643  0 486 PHE EEE CA  1 ? 
ATOM   1222 C CA  B PHE A 1 157 ? 4.885  28.001  -21.075 0.500 42.629  0 486 PHE EEE CA  1 ? 
ATOM   1223 C C   . PHE A 1 157 ? 4.699  26.485  -21.176 1.000 42.015  0 486 PHE EEE C   1 ? 
ATOM   1224 O O   . PHE A 1 157 ? 4.442  26.008  -22.288 1.000 42.182  0 486 PHE EEE O   1 ? 
ATOM   1225 C CB  A PHE A 1 157 ? 3.633  28.844  -21.244 0.500 45.609  0 486 PHE EEE CB  1 ? 
ATOM   1226 C CB  B PHE A 1 157 ? 3.560  28.727  -21.320 0.500 45.820  0 486 PHE EEE CB  1 ? 
ATOM   1227 C CG  A PHE A 1 157 ? 3.854  30.324  -21.042 0.500 47.319  0 486 PHE EEE CG  1 ? 
ATOM   1228 C CG  B PHE A 1 157 ? 2.553  28.568  -20.208 0.500 49.299  0 486 PHE EEE CG  1 ? 
ATOM   1229 C CD1 A PHE A 1 157 ? 4.517  30.792  -19.917 0.500 49.036  0 486 PHE EEE CD1 1 ? 
ATOM   1230 C CD1 B PHE A 1 157 ? 2.775  29.143  -18.967 0.500 51.695  0 486 PHE EEE CD1 1 ? 
ATOM   1231 C CD2 A PHE A 1 157 ? 3.412  31.249  -21.974 0.500 49.852  0 486 PHE EEE CD2 1 ? 
ATOM   1232 C CD2 B PHE A 1 157 ? 1.385  27.849  -20.401 0.500 51.756  0 486 PHE EEE CD2 1 ? 
ATOM   1233 C CE1 A PHE A 1 157 ? 4.724  32.149  -19.728 0.500 49.284  0 486 PHE EEE CE1 1 ? 
ATOM   1234 C CE1 B PHE A 1 157 ? 1.848  29.006  -17.945 0.500 53.527  0 486 PHE EEE CE1 1 ? 
ATOM   1235 C CE2 A PHE A 1 157 ? 3.615  32.606  -21.779 0.500 49.919  0 486 PHE EEE CE2 1 ? 
ATOM   1236 C CE2 B PHE A 1 157 ? 0.459  27.716  -19.378 0.500 53.956  0 486 PHE EEE CE2 1 ? 
ATOM   1237 C CZ  A PHE A 1 157 ? 4.272  33.053  -20.658 0.500 49.377  0 486 PHE EEE CZ  1 ? 
ATOM   1238 C CZ  B PHE A 1 157 ? 0.694  28.291  -18.152 0.500 52.877  0 486 PHE EEE CZ  1 ? 
ATOM   1239 N N   . ASN A 1 158 ? 4.878  25.768  -20.058 1.000 42.293  0 487 ASN EEE N   1 ? 
ATOM   1240 C CA  . ASN A 1 158 ? 4.680  24.294  -19.936 1.000 43.957  0 487 ASN EEE CA  1 ? 
ATOM   1241 C C   . ASN A 1 158 ? 5.590  23.518  -20.900 1.000 40.244  0 487 ASN EEE C   1 ? 
ATOM   1242 O O   . ASN A 1 158 ? 5.285  22.339  -21.184 1.000 44.750  0 487 ASN EEE O   1 ? 
ATOM   1243 C CB  . ASN A 1 158 ? 3.220  23.916  -20.185 1.000 48.475  0 487 ASN EEE CB  1 ? 
ATOM   1244 C CG  . ASN A 1 158 ? 2.272  24.623  -19.246 1.000 54.884  0 487 ASN EEE CG  1 ? 
ATOM   1245 O OD1 . ASN A 1 158 ? 1.301  25.227  -19.687 1.000 66.216  0 487 ASN EEE OD1 1 ? 
ATOM   1246 N ND2 . ASN A 1 158 ? 2.549  24.564  -17.955 1.000 55.145  0 487 ASN EEE ND2 1 ? 
ATOM   1247 N N   . CYS A 1 159 ? 6.674  24.138  -21.364 1.000 36.882  0 488 CYS EEE N   1 ? 
ATOM   1248 C CA  . CYS A 1 159 ? 7.631  23.563  -22.339 1.000 35.557  0 488 CYS EEE CA  1 ? 
ATOM   1249 C C   . CYS A 1 159 ? 9.054  23.824  -21.830 1.000 34.134  0 488 CYS EEE C   1 ? 
ATOM   1250 O O   . CYS A 1 159 ? 9.581  24.928  -22.040 1.000 33.432  0 488 CYS EEE O   1 ? 
ATOM   1251 C CB  . CYS A 1 159 ? 7.387  24.144  -23.726 1.000 38.803  0 488 CYS EEE CB  1 ? 
ATOM   1252 S SG  . CYS A 1 159 ? 5.929  23.433  -24.539 1.000 42.855  0 488 CYS EEE SG  1 ? 
ATOM   1253 N N   . TYR A 1 160 ? 9.641  22.827  -21.172 1.000 32.690  0 489 TYR EEE N   1 ? 
ATOM   1254 C CA  . TYR A 1 160 ? 10.841 22.994  -20.321 1.000 32.660  0 489 TYR EEE CA  1 ? 
ATOM   1255 C C   . TYR A 1 160 ? 12.034 22.236  -20.889 1.000 29.755  0 489 TYR EEE C   1 ? 
ATOM   1256 O O   . TYR A 1 160 ? 11.887 21.184  -21.531 1.000 32.520  0 489 TYR EEE O   1 ? 
ATOM   1257 C CB  . TYR A 1 160 ? 10.551 22.501  -18.904 1.000 33.815  0 489 TYR EEE CB  1 ? 
ATOM   1258 C CG  . TYR A 1 160 ? 9.377  23.179  -18.250 1.000 34.587  0 489 TYR EEE CG  1 ? 
ATOM   1259 C CD1 . TYR A 1 160 ? 9.254  24.559  -18.273 1.000 36.488  0 489 TYR EEE CD1 1 ? 
ATOM   1260 C CD2 . TYR A 1 160 ? 8.388  22.448  -17.612 1.000 37.477  0 489 TYR EEE CD2 1 ? 
ATOM   1261 C CE1 . TYR A 1 160 ? 8.179  25.197  -17.680 1.000 40.387  0 489 TYR EEE CE1 1 ? 
ATOM   1262 C CE2 . TYR A 1 160 ? 7.314  23.074  -16.997 1.000 42.408  0 489 TYR EEE CE2 1 ? 
ATOM   1263 C CZ  . TYR A 1 160 ? 7.207  24.452  -17.038 1.000 42.892  0 489 TYR EEE CZ  1 ? 
ATOM   1264 O OH  . TYR A 1 160 ? 6.151  25.084  -16.449 1.000 46.885  0 489 TYR EEE OH  1 ? 
ATOM   1265 N N   . PHE A 1 161 ? 13.220 22.742  -20.590 1.000 29.303  0 490 PHE EEE N   1 ? 
ATOM   1266 C CA  . PHE A 1 161 ? 14.464 21.969  -20.769 1.000 28.886  0 490 PHE EEE CA  1 ? 
ATOM   1267 C C   . PHE A 1 161 ? 14.463 20.872  -19.708 1.000 29.269  0 490 PHE EEE C   1 ? 
ATOM   1268 O O   . PHE A 1 161 ? 14.124 21.149  -18.564 1.000 29.496  0 490 PHE EEE O   1 ? 
ATOM   1269 C CB  . PHE A 1 161 ? 15.679 22.885  -20.690 1.000 28.774  0 490 PHE EEE CB  1 ? 
ATOM   1270 C CG  . PHE A 1 161 ? 16.919 22.240  -21.236 1.000 27.777  0 490 PHE EEE CG  1 ? 
ATOM   1271 C CD1 . PHE A 1 161 ? 17.061 22.043  -22.600 1.000 27.012  0 490 PHE EEE CD1 1 ? 
ATOM   1272 C CD2 . PHE A 1 161 ? 17.929 21.812  -20.394 1.000 28.433  0 490 PHE EEE CD2 1 ? 
ATOM   1273 C CE1 . PHE A 1 161 ? 18.205 21.450  -23.109 1.000 28.694  0 490 PHE EEE CE1 1 ? 
ATOM   1274 C CE2 . PHE A 1 161 ? 19.069 21.215  -20.908 1.000 29.475  0 490 PHE EEE CE2 1 ? 
ATOM   1275 C CZ  . PHE A 1 161 ? 19.206 21.037  -22.266 1.000 28.353  0 490 PHE EEE CZ  1 ? 
ATOM   1276 N N   . PRO A 1 162 ? 14.748 19.596  -20.056 1.000 27.867  0 491 PRO EEE N   1 ? 
ATOM   1277 C CA  . PRO A 1 162 ? 14.555 18.497  -19.105 1.000 28.435  0 491 PRO EEE CA  1 ? 
ATOM   1278 C C   . PRO A 1 162 ? 15.668 18.319  -18.056 1.000 28.340  0 491 PRO EEE C   1 ? 
ATOM   1279 O O   . PRO A 1 162 ? 15.466 17.547  -17.132 1.000 29.735  0 491 PRO EEE O   1 ? 
ATOM   1280 C CB  . PRO A 1 162 ? 14.468 17.270  -20.019 1.000 26.859  0 491 PRO EEE CB  1 ? 
ATOM   1281 C CG  . PRO A 1 162 ? 15.333 17.638  -21.206 1.000 28.216  0 491 PRO EEE CG  1 ? 
ATOM   1282 C CD  . PRO A 1 162 ? 15.097 19.121  -21.408 1.000 27.483  0 491 PRO EEE CD  1 ? 
ATOM   1283 N N   . LEU A 1 163 ? 16.800 19.005  -18.225 1.000 26.997  0 492 LEU EEE N   1 ? 
ATOM   1284 C CA  . LEU A 1 163 ? 17.966 18.894  -17.308 1.000 27.240  0 492 LEU EEE CA  1 ? 
ATOM   1285 C C   . LEU A 1 163 ? 18.040 20.138  -16.429 1.000 27.181  0 492 LEU EEE C   1 ? 
ATOM   1286 O O   . LEU A 1 163 ? 17.489 21.194  -16.805 1.000 28.243  0 492 LEU EEE O   1 ? 
ATOM   1287 C CB  . LEU A 1 163 ? 19.268 18.715  -18.094 1.000 27.344  0 492 LEU EEE CB  1 ? 
ATOM   1288 C CG  . LEU A 1 163 ? 19.294 17.564  -19.095 1.000 26.300  0 492 LEU EEE CG  1 ? 
ATOM   1289 C CD1 . LEU A 1 163 ? 20.670 17.445  -19.736 1.000 27.701  0 492 LEU EEE CD1 1 ? 
ATOM   1290 C CD2 . LEU A 1 163 ? 18.903 16.253  -18.432 1.000 26.880  0 492 LEU EEE CD2 1 ? 
ATOM   1291 N N   . GLN A 1 164 ? 18.732 19.992  -15.301 1.000 26.978  0 493 GLN EEE N   1 ? 
ATOM   1292 C CA  . GLN A 1 164 ? 18.845 21.030  -14.252 1.000 28.909  0 493 GLN EEE CA  1 ? 
ATOM   1293 C C   . GLN A 1 164 ? 20.199 20.845  -13.562 1.000 26.903  0 493 GLN EEE C   1 ? 
ATOM   1294 O O   . GLN A 1 164 ? 20.562 19.692  -13.260 1.000 28.389  0 493 GLN EEE O   1 ? 
ATOM   1295 C CB  . GLN A 1 164 ? 17.672 20.915  -13.272 1.000 28.154  0 493 GLN EEE CB  1 ? 
ATOM   1296 C CG  . GLN A 1 164 ? 17.826 21.755  -12.008 1.000 29.736  0 493 GLN EEE CG  1 ? 
ATOM   1297 C CD  . GLN A 1 164 ? 17.732 23.243  -12.243 1.000 31.482  0 493 GLN EEE CD  1 ? 
ATOM   1298 O OE1 . GLN A 1 164 ? 16.821 23.731  -12.913 1.000 32.948  0 493 GLN EEE OE1 1 ? 
ATOM   1299 N NE2 . GLN A 1 164 ? 18.655 23.986  -11.652 1.000 32.709  0 493 GLN EEE NE2 1 ? 
ATOM   1300 N N   . SER A 1 165 ? 20.914 21.945  -13.342 1.000 28.327  0 494 SER EEE N   1 ? 
ATOM   1301 C CA  . SER A 1 165 ? 22.183 21.970  -12.578 1.000 29.291  0 494 SER EEE CA  1 ? 
ATOM   1302 C C   . SER A 1 165 ? 21.894 21.682  -11.107 1.000 29.163  0 494 SER EEE C   1 ? 
ATOM   1303 O O   . SER A 1 165 ? 20.967 22.305  -10.536 1.000 28.740  0 494 SER EEE O   1 ? 
ATOM   1304 C CB  . SER A 1 165 ? 22.889 23.294  -12.704 1.000 29.385  0 494 SER EEE CB  1 ? 
ATOM   1305 O OG  . SER A 1 165 ? 23.481 23.451  -13.980 1.000 28.108  0 494 SER EEE OG  1 ? 
ATOM   1306 N N   . TYR A 1 166 ? 22.706 20.820  -10.502 1.000 28.473  0 495 TYR EEE N   1 ? 
ATOM   1307 C CA  . TYR A 1 166 ? 23.021 20.912  -9.056  1.000 29.792  0 495 TYR EEE CA  1 ? 
ATOM   1308 C C   . TYR A 1 166 ? 23.793 22.212  -8.829  1.000 33.088  0 495 TYR EEE C   1 ? 
ATOM   1309 O O   . TYR A 1 166 ? 24.572 22.609  -9.720  1.000 33.008  0 495 TYR EEE O   1 ? 
ATOM   1310 C CB  . TYR A 1 166 ? 23.880 19.738  -8.602  1.000 30.756  0 495 TYR EEE CB  1 ? 
ATOM   1311 C CG  . TYR A 1 166 ? 23.193 18.401  -8.565  1.000 30.963  0 495 TYR EEE CG  1 ? 
ATOM   1312 C CD1 . TYR A 1 166 ? 22.265 18.098  -7.581  1.000 31.490  0 495 TYR EEE CD1 1 ? 
ATOM   1313 C CD2 . TYR A 1 166 ? 23.518 17.413  -9.478  1.000 31.525  0 495 TYR EEE CD2 1 ? 
ATOM   1314 C CE1 . TYR A 1 166 ? 21.659 16.854  -7.523  1.000 31.953  0 495 TYR EEE CE1 1 ? 
ATOM   1315 C CE2 . TYR A 1 166 ? 22.926 16.162  -9.430  1.000 30.301  0 495 TYR EEE CE2 1 ? 
ATOM   1316 C CZ  . TYR A 1 166 ? 21.989 15.882  -8.452  1.000 30.569  0 495 TYR EEE CZ  1 ? 
ATOM   1317 O OH  . TYR A 1 166 ? 21.415 14.647  -8.398  1.000 31.027  0 495 TYR EEE OH  1 ? 
ATOM   1318 N N   . GLY A 1 167 ? 23.587 22.849  -7.675  1.000 35.885  0 496 GLY EEE N   1 ? 
ATOM   1319 C CA  . GLY A 1 167 ? 24.401 23.991  -7.220  1.000 36.428  0 496 GLY EEE CA  1 ? 
ATOM   1320 C C   . GLY A 1 167 ? 25.290 23.563  -6.073  1.000 36.055  0 496 GLY EEE C   1 ? 
ATOM   1321 O O   . GLY A 1 167 ? 24.807 23.578  -4.946  1.000 39.464  0 496 GLY EEE O   1 ? 
ATOM   1322 N N   . PHE A 1 168 ? 26.518 23.126  -6.362  1.000 33.064  0 497 PHE EEE N   1 ? 
ATOM   1323 C CA  . PHE A 1 168 ? 27.479 22.634  -5.344  1.000 35.780  0 497 PHE EEE CA  1 ? 
ATOM   1324 C C   . PHE A 1 168 ? 28.411 23.781  -4.941  1.000 37.930  0 497 PHE EEE C   1 ? 
ATOM   1325 O O   . PHE A 1 168 ? 29.362 24.099  -5.665  1.000 36.512  0 497 PHE EEE O   1 ? 
ATOM   1326 C CB  . PHE A 1 168 ? 28.231 21.403  -5.847  1.000 34.165  0 497 PHE EEE CB  1 ? 
ATOM   1327 C CG  . PHE A 1 168 ? 27.377 20.179  -6.083  1.000 33.169  0 497 PHE EEE CG  1 ? 
ATOM   1328 C CD1 . PHE A 1 168 ? 26.505 19.714  -5.107  1.000 33.754  0 497 PHE EEE CD1 1 ? 
ATOM   1329 C CD2 . PHE A 1 168 ? 27.491 19.450  -7.259  1.000 32.886  0 497 PHE EEE CD2 1 ? 
ATOM   1330 C CE1 . PHE A 1 168 ? 25.751 18.568  -5.312  1.000 33.346  0 497 PHE EEE CE1 1 ? 
ATOM   1331 C CE2 . PHE A 1 168 ? 26.729 18.308  -7.468  1.000 31.959  0 497 PHE EEE CE2 1 ? 
ATOM   1332 C CZ  . PHE A 1 168 ? 25.863 17.865  -6.495  1.000 33.419  0 497 PHE EEE CZ  1 ? 
ATOM   1333 N N   . GLN A 1 169 ? 28.121 24.384  -3.792  1.000 42.989  0 498 GLN EEE N   1 ? 
ATOM   1334 C CA  . GLN A 1 169 ? 28.999 25.345  -3.078  1.000 45.637  0 498 GLN EEE CA  1 ? 
ATOM   1335 C C   . GLN A 1 169 ? 29.577 24.626  -1.867  1.000 43.396  0 498 GLN EEE C   1 ? 
ATOM   1336 O O   . GLN A 1 169 ? 28.873 23.838  -1.237  1.000 41.432  0 498 GLN EEE O   1 ? 
ATOM   1337 C CB  . GLN A 1 169 ? 28.203 26.572  -2.641  1.000 50.198  0 498 GLN EEE CB  1 ? 
ATOM   1338 C CG  . GLN A 1 169 ? 27.230 27.074  -3.692  1.000 55.646  0 498 GLN EEE CG  1 ? 
ATOM   1339 C CD  . GLN A 1 169 ? 26.952 28.548  -3.541  1.000 62.984  0 498 GLN EEE CD  1 ? 
ATOM   1340 O OE1 . GLN A 1 169 ? 27.112 29.121  -2.466  1.000 66.033  0 498 GLN EEE OE1 1 ? 
ATOM   1341 N NE2 . GLN A 1 169 ? 26.546 29.178  -4.630  1.000 73.852  0 498 GLN EEE NE2 1 ? 
ATOM   1342 N N   . PRO A 1 170 ? 30.856 24.868  -1.496  1.000 44.448  0 499 PRO EEE N   1 ? 
ATOM   1343 C CA  . PRO A 1 170 ? 31.485 24.109  -0.415  1.000 47.030  0 499 PRO EEE CA  1 ? 
ATOM   1344 C C   . PRO A 1 170 ? 30.811 24.319  0.951   1.000 47.816  0 499 PRO EEE C   1 ? 
ATOM   1345 O O   . PRO A 1 170 ? 30.994 23.477  1.815   1.000 47.007  0 499 PRO EEE O   1 ? 
ATOM   1346 C CB  . PRO A 1 170 ? 32.944 24.596  -0.404  1.000 48.688  0 499 PRO EEE CB  1 ? 
ATOM   1347 C CG  . PRO A 1 170 ? 32.922 25.927  -1.122  1.000 48.107  0 499 PRO EEE CG  1 ? 
ATOM   1348 C CD  . PRO A 1 170 ? 31.759 25.863  -2.090  1.000 45.807  0 499 PRO EEE CD  1 ? 
ATOM   1349 N N   . THR A 1 171 ? 30.049 25.407  1.111   1.000 47.784  0 500 THR EEE N   1 ? 
ATOM   1350 C CA  . THR A 1 171 ? 29.374 25.785  2.381   1.000 49.730  0 500 THR EEE CA  1 ? 
ATOM   1351 C C   . THR A 1 171 ? 27.984 25.148  2.463   1.000 44.925  0 500 THR EEE C   1 ? 
ATOM   1352 O O   . THR A 1 171 ? 27.350 25.299  3.507   1.000 47.347  0 500 THR EEE O   1 ? 
ATOM   1353 C CB  . THR A 1 171 ? 29.292 27.309  2.527   1.000 52.847  0 500 THR EEE CB  1 ? 
ATOM   1354 O OG1 . THR A 1 171 ? 28.752 27.830  1.311   1.000 56.807  0 500 THR EEE OG1 1 ? 
ATOM   1355 C CG2 . THR A 1 171 ? 30.638 27.937  2.816   1.000 55.018  0 500 THR EEE CG2 1 ? 
ATOM   1356 N N   . ASN A 1 172 ? 27.520 24.473  1.405   1.000 43.476  0 501 ASN EEE N   1 ? 
ATOM   1357 C CA  . ASN A 1 172 ? 26.241 23.714  1.422   1.000 44.519  0 501 ASN EEE CA  1 ? 
ATOM   1358 C C   . ASN A 1 172 ? 26.200 22.795  2.645   1.000 44.165  0 501 ASN EEE C   1 ? 
ATOM   1359 O O   . ASN A 1 172 ? 27.270 22.276  3.031   1.000 42.914  0 501 ASN EEE O   1 ? 
ATOM   1360 C CB  . ASN A 1 172 ? 26.066 22.844  0.179   1.000 43.790  0 501 ASN EEE CB  1 ? 
ATOM   1361 C CG  . ASN A 1 172 ? 25.664 23.622  -1.055  1.000 43.132  0 501 ASN EEE CG  1 ? 
ATOM   1362 O OD1 . ASN A 1 172 ? 25.505 24.839  -1.007  1.000 44.803  0 501 ASN EEE OD1 1 ? 
ATOM   1363 N ND2 . ASN A 1 172 ? 25.482 22.916  -2.156  1.000 42.282  0 501 ASN EEE ND2 1 ? 
ATOM   1364 N N   . GLY A 1 173 ? 25.006 22.585  3.210   1.000 45.692  0 502 GLY EEE N   1 ? 
ATOM   1365 C CA  . GLY A 1 173 ? 24.727 21.462  4.123   1.000 47.295  0 502 GLY EEE CA  1 ? 
ATOM   1366 C C   . GLY A 1 173 ? 25.096 20.138  3.466   1.000 45.541  0 502 GLY EEE C   1 ? 
ATOM   1367 O O   . GLY A 1 173 ? 25.022 20.050  2.221   1.000 43.228  0 502 GLY EEE O   1 ? 
ATOM   1368 N N   . VAL A 1 174 ? 25.474 19.137  4.264   1.000 45.655  0 503 VAL EEE N   1 ? 
ATOM   1369 C CA  . VAL A 1 174 ? 26.041 17.843  3.779   1.000 45.511  0 503 VAL EEE CA  1 ? 
ATOM   1370 C C   . VAL A 1 174 ? 25.019 17.139  2.866   1.000 42.627  0 503 VAL EEE C   1 ? 
ATOM   1371 O O   . VAL A 1 174 ? 25.447 16.508  1.870   1.000 41.090  0 503 VAL EEE O   1 ? 
ATOM   1372 C CB  . VAL A 1 174 ? 26.505 16.970  4.961   1.000 50.322  0 503 VAL EEE CB  1 ? 
ATOM   1373 C CG1 . VAL A 1 174 ? 25.340 16.404  5.762   1.000 53.977  0 503 VAL EEE CG1 1 ? 
ATOM   1374 C CG2 . VAL A 1 174 ? 27.435 15.863  4.503   1.000 54.092  0 503 VAL EEE CG2 1 ? 
ATOM   1375 N N   . GLY A 1 175 ? 23.720 17.297  3.144   1.000 39.998  0 504 GLY EEE N   1 ? 
ATOM   1376 C CA  . GLY A 1 175 ? 22.617 16.782  2.303   1.000 40.905  0 504 GLY EEE CA  1 ? 
ATOM   1377 C C   . GLY A 1 175 ? 22.637 17.360  0.892   1.000 39.821  0 504 GLY EEE C   1 ? 
ATOM   1378 O O   . GLY A 1 175 ? 22.087 16.704  -0.028  1.000 38.542  0 504 GLY EEE O   1 ? 
ATOM   1379 N N   . TYR A 1 176 ? 23.235 18.543  0.712   1.000 38.565  0 505 TYR EEE N   1 ? 
ATOM   1380 C CA  . TYR A 1 176 ? 23.294 19.278  -0.579  1.000 38.961  0 505 TYR EEE CA  1 ? 
ATOM   1381 C C   . TYR A 1 176 ? 24.733 19.309  -1.109  1.000 35.299  0 505 TYR EEE C   1 ? 
ATOM   1382 O O   . TYR A 1 176 ? 24.977 20.025  -2.091  1.000 38.352  0 505 TYR EEE O   1 ? 
ATOM   1383 C CB  . TYR A 1 176 ? 22.712 20.687  -0.421  1.000 41.691  0 505 TYR EEE CB  1 ? 
ATOM   1384 C CG  . TYR A 1 176 ? 21.227 20.731  -0.159  1.000 49.956  0 505 TYR EEE CG  1 ? 
ATOM   1385 C CD1 . TYR A 1 176 ? 20.720 20.573  1.123   1.000 55.259  0 505 TYR EEE CD1 1 ? 
ATOM   1386 C CD2 . TYR A 1 176 ? 20.322 20.925  -1.192  1.000 55.315  0 505 TYR EEE CD2 1 ? 
ATOM   1387 C CE1 . TYR A 1 176 ? 19.357 20.610  1.372   1.000 60.407  0 505 TYR EEE CE1 1 ? 
ATOM   1388 C CE2 . TYR A 1 176 ? 18.956 20.967  -0.958  1.000 60.759  0 505 TYR EEE CE2 1 ? 
ATOM   1389 C CZ  . TYR A 1 176 ? 18.472 20.808  0.328   1.000 61.727  0 505 TYR EEE CZ  1 ? 
ATOM   1390 O OH  . TYR A 1 176 ? 17.128 20.846  0.561   1.000 73.682  0 505 TYR EEE OH  1 ? 
ATOM   1391 N N   . GLN A 1 177 ? 25.654 18.553  -0.505  1.000 34.354  0 506 GLN EEE N   1 ? 
ATOM   1392 C CA  . GLN A 1 177 ? 27.050 18.418  -1.008  1.000 34.734  0 506 GLN EEE CA  1 ? 
ATOM   1393 C C   . GLN A 1 177 ? 27.101 17.294  -2.039  1.000 32.157  0 506 GLN EEE C   1 ? 
ATOM   1394 O O   . GLN A 1 177 ? 26.238 16.415  -2.048  1.000 32.132  0 506 GLN EEE O   1 ? 
ATOM   1395 C CB  . GLN A 1 177 ? 28.039 18.171  0.132   1.000 36.238  0 506 GLN EEE CB  1 ? 
ATOM   1396 C CG  . GLN A 1 177 ? 28.343 19.429  0.933   1.000 37.918  0 506 GLN EEE CG  1 ? 
ATOM   1397 C CD  . GLN A 1 177 ? 29.281 19.182  2.090   1.000 39.825  0 506 GLN EEE CD  1 ? 
ATOM   1398 O OE1 . GLN A 1 177 ? 29.985 18.178  2.141   1.000 39.033  0 506 GLN EEE OE1 1 ? 
ATOM   1399 N NE2 . GLN A 1 177 ? 29.300 20.110  3.033   1.000 43.720  0 506 GLN EEE NE2 1 ? 
ATOM   1400 N N   . PRO A 1 178 ? 28.092 17.322  -2.959  1.000 31.828  0 507 PRO EEE N   1 ? 
ATOM   1401 C CA  . PRO A 1 178 ? 28.235 16.280  -3.970  1.000 31.287  0 507 PRO EEE CA  1 ? 
ATOM   1402 C C   . PRO A 1 178 ? 28.805 14.996  -3.363  1.000 32.329  0 507 PRO EEE C   1 ? 
ATOM   1403 O O   . PRO A 1 178 ? 29.699 15.073  -2.526  1.000 30.979  0 507 PRO EEE O   1 ? 
ATOM   1404 C CB  . PRO A 1 178 ? 29.220 16.882  -4.982  1.000 31.839  0 507 PRO EEE CB  1 ? 
ATOM   1405 C CG  . PRO A 1 178 ? 30.059 17.823  -4.146  1.000 32.167  0 507 PRO EEE CG  1 ? 
ATOM   1406 C CD  . PRO A 1 178 ? 29.096 18.382  -3.117  1.000 31.869  0 507 PRO EEE CD  1 ? 
ATOM   1407 N N   . TYR A 1 179 ? 28.247 13.869  -3.793  1.000 31.654  0 508 TYR EEE N   1 ? 
ATOM   1408 C CA  . TYR A 1 179 ? 28.728 12.503  -3.498  1.000 31.905  0 508 TYR EEE CA  1 ? 
ATOM   1409 C C   . TYR A 1 179 ? 29.038 11.803  -4.814  1.000 30.432  0 508 TYR EEE C   1 ? 
ATOM   1410 O O   . TYR A 1 179 ? 28.206 11.837  -5.737  1.000 31.527  0 508 TYR EEE O   1 ? 
ATOM   1411 C CB  . TYR A 1 179 ? 27.705 11.726  -2.668  1.000 32.852  0 508 TYR EEE CB  1 ? 
ATOM   1412 C CG  . TYR A 1 179 ? 27.785 12.110  -1.219  1.000 31.832  0 508 TYR EEE CG  1 ? 
ATOM   1413 C CD1 . TYR A 1 179 ? 27.430 13.388  -0.830  1.000 31.921  0 508 TYR EEE CD1 1 ? 
ATOM   1414 C CD2 . TYR A 1 179 ? 28.275 11.241  -0.257  1.000 32.562  0 508 TYR EEE CD2 1 ? 
ATOM   1415 C CE1 . TYR A 1 179 ? 27.530 13.798  0.482   1.000 33.431  0 508 TYR EEE CE1 1 ? 
ATOM   1416 C CE2 . TYR A 1 179 ? 28.383 11.638  1.072   1.000 32.645  0 508 TYR EEE CE2 1 ? 
ATOM   1417 C CZ  . TYR A 1 179 ? 28.005 12.918  1.435   1.000 34.570  0 508 TYR EEE CZ  1 ? 
ATOM   1418 O OH  . TYR A 1 179 ? 28.112 13.367  2.715   1.000 38.024  0 508 TYR EEE OH  1 ? 
ATOM   1419 N N   . ARG A 1 180 ? 30.222 11.207  -4.867  1.000 30.754  0 509 ARG EEE N   1 ? 
ATOM   1420 C CA  . ARG A 1 180 ? 30.634 10.262  -5.925  1.000 30.200  0 509 ARG EEE CA  1 ? 
ATOM   1421 C C   . ARG A 1 180 ? 30.121 8.874   -5.552  1.000 30.075  0 509 ARG EEE C   1 ? 
ATOM   1422 O O   . ARG A 1 180 ? 30.298 8.441   -4.395  1.000 30.778  0 509 ARG EEE O   1 ? 
ATOM   1423 C CB  . ARG A 1 180 ? 32.142 10.334  -6.124  1.000 29.531  0 509 ARG EEE CB  1 ? 
ATOM   1424 C CG  . ARG A 1 180 ? 32.535 11.581  -6.899  1.000 30.434  0 509 ARG EEE CG  1 ? 
ATOM   1425 C CD  . ARG A 1 180 ? 34.011 11.711  -7.148  1.000 31.971  0 509 ARG EEE CD  1 ? 
ATOM   1426 N NE  . ARG A 1 180 ? 34.263 12.964  -7.840  1.000 32.494  0 509 ARG EEE NE  1 ? 
ATOM   1427 C CZ  . ARG A 1 180 ? 35.319 13.216  -8.609  1.000 34.465  0 509 ARG EEE CZ  1 ? 
ATOM   1428 N NH1 . ARG A 1 180 ? 36.246 12.293  -8.810  1.000 34.066  0 509 ARG EEE NH1 1 ? 
ATOM   1429 N NH2 . ARG A 1 180 ? 35.432 14.398  -9.188  1.000 36.238  0 509 ARG EEE NH2 1 ? 
ATOM   1430 N N   . VAL A 1 181 ? 29.493 8.219   -6.519  1.000 28.425  0 510 VAL EEE N   1 ? 
ATOM   1431 C CA  . VAL A 1 181 ? 28.851 6.894   -6.348  1.000 28.620  0 510 VAL EEE CA  1 ? 
ATOM   1432 C C   . VAL A 1 181 ? 29.454 5.933   -7.369  1.000 29.397  0 510 VAL EEE C   1 ? 
ATOM   1433 O O   . VAL A 1 181 ? 29.613 6.326   -8.545  1.000 28.255  0 510 VAL EEE O   1 ? 
ATOM   1434 C CB  . VAL A 1 181 ? 27.330 7.003   -6.515  1.000 28.616  0 510 VAL EEE CB  1 ? 
ATOM   1435 C CG1 . VAL A 1 181 ? 26.648 5.661   -6.294  1.000 30.342  0 510 VAL EEE CG1 1 ? 
ATOM   1436 C CG2 . VAL A 1 181 ? 26.755 8.078   -5.608  1.000 30.388  0 510 VAL EEE CG2 1 ? 
ATOM   1437 N N   . VAL A 1 182 ? 29.765 4.722   -6.921  1.000 28.312  0 511 VAL EEE N   1 ? 
ATOM   1438 C CA  . VAL A 1 182 ? 30.134 3.585   -7.802  1.000 28.598  0 511 VAL EEE CA  1 ? 
ATOM   1439 C C   . VAL A 1 182 ? 29.194 2.430   -7.464  1.000 30.073  0 511 VAL EEE C   1 ? 
ATOM   1440 O O   . VAL A 1 182 ? 29.104 2.058   -6.282  1.000 29.928  0 511 VAL EEE O   1 ? 
ATOM   1441 C CB  . VAL A 1 182 ? 31.611 3.189   -7.669  1.000 29.538  0 511 VAL EEE CB  1 ? 
ATOM   1442 C CG1 . VAL A 1 182 ? 31.926 1.971   -8.533  1.000 31.725  0 511 VAL EEE CG1 1 ? 
ATOM   1443 C CG2 . VAL A 1 182 ? 32.530 4.354   -8.005  1.000 29.000  0 511 VAL EEE CG2 1 ? 
ATOM   1444 N N   . VAL A 1 183 ? 28.508 1.910   -8.480  1.000 28.648  0 512 VAL EEE N   1 ? 
ATOM   1445 C CA  . VAL A 1 183 ? 27.606 0.735   -8.349  1.000 28.745  0 512 VAL EEE CA  1 ? 
ATOM   1446 C C   . VAL A 1 183 ? 28.294 -0.440  -9.033  1.000 28.549  0 512 VAL EEE C   1 ? 
ATOM   1447 O O   . VAL A 1 183 ? 28.558 -0.335  -10.233 1.000 31.620  0 512 VAL EEE O   1 ? 
ATOM   1448 C CB  . VAL A 1 183 ? 26.217 0.986   -8.953  1.000 29.026  0 512 VAL EEE CB  1 ? 
ATOM   1449 C CG1 . VAL A 1 183 ? 25.343 -0.254  -8.828  1.000 29.825  0 512 VAL EEE CG1 1 ? 
ATOM   1450 C CG2 . VAL A 1 183 ? 25.540 2.193   -8.325  1.000 30.198  0 512 VAL EEE CG2 1 ? 
ATOM   1451 N N   . LEU A 1 184 ? 28.554 -1.512  -8.289  1.000 28.643  0 513 LEU EEE N   1 ? 
ATOM   1452 C CA  . LEU A 1 184 ? 29.154 -2.754  -8.832  1.000 29.547  0 513 LEU EEE CA  1 ? 
ATOM   1453 C C   . LEU A 1 184 ? 28.042 -3.780  -9.054  1.000 30.258  0 513 LEU EEE C   1 ? 
ATOM   1454 O O   . LEU A 1 184 ? 27.277 -4.056  -8.102  1.000 30.636  0 513 LEU EEE O   1 ? 
ATOM   1455 C CB  . LEU A 1 184 ? 30.217 -3.296  -7.874  1.000 31.476  0 513 LEU EEE CB  1 ? 
ATOM   1456 C CG  . LEU A 1 184 ? 31.391 -2.366  -7.576  1.000 31.704  0 513 LEU EEE CG  1 ? 
ATOM   1457 C CD1 . LEU A 1 184 ? 32.374 -3.052  -6.645  1.000 32.383  0 513 LEU EEE CD1 1 ? 
ATOM   1458 C CD2 . LEU A 1 184 ? 32.091 -1.910  -8.852  1.000 33.244  0 513 LEU EEE CD2 1 ? 
ATOM   1459 N N   . SER A 1 185 ? 27.960 -4.303  -10.279 1.000 29.657  0 514 SER EEE N   1 ? 
ATOM   1460 C CA  A SER A 1 185 ? 27.058 -5.401  -10.721 0.500 30.863  0 514 SER EEE CA  1 ? 
ATOM   1461 C CA  B SER A 1 185 ? 27.074 -5.452  -10.587 0.500 29.477  0 514 SER EEE CA  1 ? 
ATOM   1462 C C   . SER A 1 185 ? 27.920 -6.593  -11.147 1.000 29.999  0 514 SER EEE C   1 ? 
ATOM   1463 O O   . SER A 1 185 ? 28.963 -6.338  -11.771 1.000 31.131  0 514 SER EEE O   1 ? 
ATOM   1464 C CB  A SER A 1 185 ? 26.178 -4.962  -11.875 0.500 31.410  0 514 SER EEE CB  1 ? 
ATOM   1465 C CB  B SER A 1 185 ? 25.901 -5.090  -11.472 0.500 28.571  0 514 SER EEE CB  1 ? 
ATOM   1466 O OG  A SER A 1 185 ? 25.241 -3.975  -11.478 0.500 33.026  0 514 SER EEE OG  1 ? 
ATOM   1467 O OG  B SER A 1 185 ? 26.325 -4.493  -12.680 0.500 27.777  0 514 SER EEE OG  1 ? 
ATOM   1468 N N   . PHE A 1 186 ? 27.477 -7.805  -10.847 1.000 31.732  0 515 PHE EEE N   1 ? 
ATOM   1469 C CA  . PHE A 1 186 ? 28.225 -9.067  -11.042 1.000 32.429  0 515 PHE EEE CA  1 ? 
ATOM   1470 C C   . PHE A 1 186 ? 27.381 -9.968  -11.934 1.000 33.889  0 515 PHE EEE C   1 ? 
ATOM   1471 O O   . PHE A 1 186 ? 26.227 -10.283 -11.587 1.000 36.335  0 515 PHE EEE O   1 ? 
ATOM   1472 C CB  . PHE A 1 186 ? 28.543 -9.677  -9.676  1.000 33.390  0 515 PHE EEE CB  1 ? 
ATOM   1473 C CG  . PHE A 1 186 ? 29.323 -8.748  -8.783  1.000 33.151  0 515 PHE EEE CG  1 ? 
ATOM   1474 C CD1 . PHE A 1 186 ? 28.673 -7.858  -7.941  1.000 33.762  0 515 PHE EEE CD1 1 ? 
ATOM   1475 C CD2 . PHE A 1 186 ? 30.710 -8.743  -8.811  1.000 35.461  0 515 PHE EEE CD2 1 ? 
ATOM   1476 C CE1 . PHE A 1 186 ? 29.400 -6.998  -7.132  1.000 34.795  0 515 PHE EEE CE1 1 ? 
ATOM   1477 C CE2 . PHE A 1 186 ? 31.432 -7.876  -8.006  1.000 35.935  0 515 PHE EEE CE2 1 ? 
ATOM   1478 C CZ  . PHE A 1 186 ? 30.776 -7.003  -7.172  1.000 35.156  0 515 PHE EEE CZ  1 ? 
ATOM   1479 N N   . GLU A 1 187 ? 27.940 -10.337 -13.078 1.000 31.055  0 516 GLU EEE N   1 ? 
ATOM   1480 C CA  . GLU A 1 187 ? 27.178 -11.013 -14.147 1.000 32.557  0 516 GLU EEE CA  1 ? 
ATOM   1481 C C   . GLU A 1 187 ? 27.818 -12.364 -14.446 1.000 31.983  0 516 GLU EEE C   1 ? 
ATOM   1482 O O   . GLU A 1 187 ? 29.024 -12.400 -14.763 1.000 35.111  0 516 GLU EEE O   1 ? 
ATOM   1483 C CB  . GLU A 1 187 ? 27.159 -10.099 -15.361 1.000 34.053  0 516 GLU EEE CB  1 ? 
ATOM   1484 C CG  . GLU A 1 187 ? 26.505 -10.705 -16.569 1.000 35.585  0 516 GLU EEE CG  1 ? 
ATOM   1485 C CD  . GLU A 1 187 ? 26.387 -9.658  -17.651 1.000 33.517  0 516 GLU EEE CD  1 ? 
ATOM   1486 O OE1 . GLU A 1 187 ? 25.428 -8.870  -17.582 1.000 31.889  0 516 GLU EEE OE1 1 ? 
ATOM   1487 O OE2 . GLU A 1 187 ? 27.303 -9.592  -18.500 1.000 34.337  0 516 GLU EEE OE2 1 ? 
ATOM   1488 N N   . LEU A 1 188 ? 27.015 -13.419 -14.348 1.000 34.215  0 517 LEU EEE N   1 ? 
ATOM   1489 C CA  . LEU A 1 188 ? 27.400 -14.797 -14.727 1.000 37.011  0 517 LEU EEE CA  1 ? 
ATOM   1490 C C   . LEU A 1 188 ? 26.568 -15.199 -15.944 1.000 36.303  0 517 LEU EEE C   1 ? 
ATOM   1491 O O   . LEU A 1 188 ? 25.327 -15.215 -15.855 1.000 40.360  0 517 LEU EEE O   1 ? 
ATOM   1492 C CB  . LEU A 1 188 ? 27.171 -15.738 -13.541 1.000 43.493  0 517 LEU EEE CB  1 ? 
ATOM   1493 C CG  . LEU A 1 188 ? 27.714 -17.157 -13.721 1.000 48.902  0 517 LEU EEE CG  1 ? 
ATOM   1494 C CD1 . LEU A 1 188 ? 29.217 -17.146 -13.969 1.000 53.125  0 517 LEU EEE CD1 1 ? 
ATOM   1495 C CD2 . LEU A 1 188 ? 27.382 -18.028 -12.515 1.000 53.383  0 517 LEU EEE CD2 1 ? 
ATOM   1496 N N   . LEU A 1 189 ? 27.246 -15.453 -17.054 1.000 33.401  0 518 LEU EEE N   1 ? 
ATOM   1497 C CA  . LEU A 1 189 ? 26.636 -15.884 -18.334 1.000 35.110  0 518 LEU EEE CA  1 ? 
ATOM   1498 C C   . LEU A 1 189 ? 27.068 -17.318 -18.615 1.000 35.372  0 518 LEU EEE C   1 ? 
ATOM   1499 O O   . LEU A 1 189 ? 27.903 -17.857 -17.872 1.000 38.748  0 518 LEU EEE O   1 ? 
ATOM   1500 C CB  . LEU A 1 189 ? 27.116 -14.967 -19.464 1.000 34.100  0 518 LEU EEE CB  1 ? 
ATOM   1501 C CG  . LEU A 1 189 ? 26.893 -13.471 -19.269 1.000 35.224  0 518 LEU EEE CG  1 ? 
ATOM   1502 C CD1 . LEU A 1 189 ? 27.459 -12.688 -20.447 1.000 36.811  0 518 LEU EEE CD1 1 ? 
ATOM   1503 C CD2 . LEU A 1 189 ? 25.418 -13.162 -19.088 1.000 36.450  0 518 LEU EEE CD2 1 ? 
ATOM   1504 N N   . HIS A 1 190 ? 26.532 -17.887 -19.689 1.000 35.354  0 519 HIS EEE N   1 ? 
ATOM   1505 C CA  A HIS A 1 190 ? 26.960 -19.215 -20.205 0.500 35.010  0 519 HIS EEE CA  1 ? 
ATOM   1506 C CA  B HIS A 1 190 ? 26.949 -19.189 -20.274 0.500 37.424  0 519 HIS EEE CA  1 ? 
ATOM   1507 C C   . HIS A 1 190 ? 28.466 -19.179 -20.520 1.000 36.387  0 519 HIS EEE C   1 ? 
ATOM   1508 O O   . HIS A 1 190 ? 29.118 -20.233 -20.358 1.000 40.222  0 519 HIS EEE O   1 ? 
ATOM   1509 C CB  A HIS A 1 190 ? 26.110 -19.613 -21.417 0.500 32.615  0 519 HIS EEE CB  1 ? 
ATOM   1510 C CB  B HIS A 1 190 ? 26.137 -19.409 -21.559 0.500 39.273  0 519 HIS EEE CB  1 ? 
ATOM   1511 C CG  A HIS A 1 190 ? 26.498 -18.868 -22.647 0.500 31.470  0 519 HIS EEE CG  1 ? 
ATOM   1512 C CG  B HIS A 1 190 ? 26.103 -20.811 -22.057 0.500 40.265  0 519 HIS EEE CG  1 ? 
ATOM   1513 N ND1 A HIS A 1 190 ? 26.273 -17.514 -22.781 0.500 29.076  0 519 HIS EEE ND1 1 ? 
ATOM   1514 N ND1 B HIS A 1 190 ? 25.423 -21.821 -21.396 0.500 41.657  0 519 HIS EEE ND1 1 ? 
ATOM   1515 C CD2 A HIS A 1 190 ? 27.135 -19.269 -23.769 0.500 31.450  0 519 HIS EEE CD2 1 ? 
ATOM   1516 C CD2 B HIS A 1 190 ? 26.615 -21.367 -23.175 0.500 38.235  0 519 HIS EEE CD2 1 ? 
ATOM   1517 C CE1 A HIS A 1 190 ? 26.737 -17.108 -23.947 0.500 30.951  0 519 HIS EEE CE1 1 ? 
ATOM   1518 C CE1 B HIS A 1 190 ? 25.528 -22.938 -22.080 0.500 33.734  0 519 HIS EEE CE1 1 ? 
ATOM   1519 N NE2 A HIS A 1 190 ? 27.273 -18.169 -24.573 0.500 30.545  0 519 HIS EEE NE2 1 ? 
ATOM   1520 N NE2 B HIS A 1 190 ? 26.266 -22.691 -23.164 0.500 39.392  0 519 HIS EEE NE2 1 ? 
ATOM   1521 N N   . ALA A 1 191 ? 28.990 -18.016 -20.915 1.000 36.364  0 520 ALA EEE N   1 ? 
ATOM   1522 C CA  . ALA A 1 191 ? 30.391 -17.790 -21.342 1.000 35.992  0 520 ALA EEE CA  1 ? 
ATOM   1523 C C   . ALA A 1 191 ? 31.334 -17.783 -20.141 1.000 38.970  0 520 ALA EEE C   1 ? 
ATOM   1524 O O   . ALA A 1 191 ? 30.895 -17.594 -19.004 1.000 42.934  0 520 ALA EEE O   1 ? 
ATOM   1525 C CB  . ALA A 1 191 ? 30.473 -16.492 -22.101 1.000 38.153  0 520 ALA EEE CB  1 ? 
ATOM   1526 N N   . PRO A 1 192 ? 32.655 -17.973 -20.366 1.000 39.843  0 521 PRO EEE N   1 ? 
ATOM   1527 C CA  . PRO A 1 192 ? 33.620 -18.142 -19.275 1.000 41.396  0 521 PRO EEE CA  1 ? 
ATOM   1528 C C   . PRO A 1 192 ? 33.598 -17.031 -18.213 1.000 42.295  0 521 PRO EEE C   1 ? 
ATOM   1529 O O   . PRO A 1 192 ? 33.492 -15.867 -18.570 1.000 38.775  0 521 PRO EEE O   1 ? 
ATOM   1530 C CB  . PRO A 1 192 ? 34.975 -18.149 -19.997 1.000 44.585  0 521 PRO EEE CB  1 ? 
ATOM   1531 C CG  . PRO A 1 192 ? 34.654 -18.672 -21.373 1.000 44.827  0 521 PRO EEE CG  1 ? 
ATOM   1532 C CD  . PRO A 1 192 ? 33.292 -18.086 -21.689 1.000 39.999  0 521 PRO EEE CD  1 ? 
ATOM   1533 N N   . ALA A 1 193 ? 33.680 -17.428 -16.938 1.000 42.549  0 522 ALA EEE N   1 ? 
ATOM   1534 C CA  . ALA A 1 193 ? 33.772 -16.526 -15.766 1.000 43.544  0 522 ALA EEE CA  1 ? 
ATOM   1535 C C   . ALA A 1 193 ? 35.246 -16.183 -15.534 1.000 46.278  0 522 ALA EEE C   1 ? 
ATOM   1536 O O   . ALA A 1 193 ? 35.965 -17.028 -14.971 1.000 51.948  0 522 ALA EEE O   1 ? 
ATOM   1537 C CB  . ALA A 1 193 ? 33.151 -17.176 -14.552 1.000 47.866  0 522 ALA EEE CB  1 ? 
ATOM   1538 N N   . THR A 1 194 ? 35.666 -14.992 -15.965 1.000 45.031  0 523 THR EEE N   1 ? 
ATOM   1539 C CA  . THR A 1 194 ? 37.091 -14.587 -16.100 1.000 48.715  0 523 THR EEE CA  1 ? 
ATOM   1540 C C   . THR A 1 194 ? 37.438 -13.432 -15.142 1.000 44.965  0 523 THR EEE C   1 ? 
ATOM   1541 O O   . THR A 1 194 ? 38.618 -13.029 -15.117 1.000 47.772  0 523 THR EEE O   1 ? 
ATOM   1542 C CB  . THR A 1 194 ? 37.390 -14.255 -17.567 1.000 56.071  0 523 THR EEE CB  1 ? 
ATOM   1543 O OG1 . THR A 1 194 ? 38.788 -13.990 -17.676 1.000 71.200  0 523 THR EEE OG1 1 ? 
ATOM   1544 C CG2 . THR A 1 194 ? 36.592 -13.084 -18.098 1.000 56.335  0 523 THR EEE CG2 1 ? 
ATOM   1545 N N   . VAL A 1 195 ? 36.474 -12.898 -14.387 1.000 39.317  0 524 VAL EEE N   1 ? 
ATOM   1546 C CA  . VAL A 1 195 ? 36.768 -11.920 -13.298 1.000 40.973  0 524 VAL EEE CA  1 ? 
ATOM   1547 C C   . VAL A 1 195 ? 36.709 -12.679 -11.972 1.000 43.156  0 524 VAL EEE C   1 ? 
ATOM   1548 O O   . VAL A 1 195 ? 35.589 -12.963 -11.501 1.000 42.050  0 524 VAL EEE O   1 ? 
ATOM   1549 C CB  . VAL A 1 195 ? 35.823 -10.707 -13.297 1.000 41.296  0 524 VAL EEE CB  1 ? 
ATOM   1550 C CG1 . VAL A 1 195 ? 36.200 -9.725  -12.199 1.000 42.797  0 524 VAL EEE CG1 1 ? 
ATOM   1551 C CG2 . VAL A 1 195 ? 35.797 -10.018 -14.652 1.000 42.243  0 524 VAL EEE CG2 1 ? 
ATOM   1552 N N   . CYS A 1 196 ? 37.878 -12.987 -11.407 1.000 45.434  0 525 CYS EEE N   1 ? 
ATOM   1553 C CA  . CYS A 1 196 ? 38.047 -13.833 -10.198 1.000 45.268  0 525 CYS EEE CA  1 ? 
ATOM   1554 C C   . CYS A 1 196 ? 38.771 -13.038 -9.106  1.000 44.825  0 525 CYS EEE C   1 ? 
ATOM   1555 O O   . CYS A 1 196 ? 39.520 -12.104 -9.433  1.000 46.402  0 525 CYS EEE O   1 ? 
ATOM   1556 C CB  . CYS A 1 196 ? 38.815 -15.104 -10.542 1.000 49.997  0 525 CYS EEE CB  1 ? 
ATOM   1557 S SG  . CYS A 1 196 ? 38.033 -16.079 -11.857 1.000 53.671  0 525 CYS EEE SG  1 ? 
ATOM   1558 N N   . GLY A 1 197 ? 38.551 -13.402 -7.844  1.000 48.316  0 526 GLY EEE N   1 ? 
ATOM   1559 C CA  . GLY A 1 197 ? 39.346 -12.887 -6.717  1.000 54.341  0 526 GLY EEE CA  1 ? 
ATOM   1560 C C   . GLY A 1 197 ? 40.757 -13.473 -6.737  1.000 56.824  0 526 GLY EEE C   1 ? 
ATOM   1561 O O   . GLY A 1 197 ? 41.055 -14.332 -7.566  1.000 56.663  0 526 GLY EEE O   1 ? 
ATOM   1562 N N   . PRO A 1 198 ? 41.667 -13.007 -5.851  1.000 62.063  0 527 PRO EEE N   1 ? 
ATOM   1563 C CA  . PRO A 1 198 ? 42.973 -13.642 -5.655  1.000 67.951  0 527 PRO EEE CA  1 ? 
ATOM   1564 C C   . PRO A 1 198 ? 42.887 -14.940 -4.837  1.000 67.663  0 527 PRO EEE C   1 ? 
ATOM   1565 O O   . PRO A 1 198 ? 42.545 -15.992 -5.368  1.000 75.126  0 527 PRO EEE O   1 ? 
ATOM   1566 C CB  . PRO A 1 198 ? 43.797 -12.619 -4.853  1.000 70.010  0 527 PRO EEE CB  1 ? 
ATOM   1567 C CG  . PRO A 1 198 ? 42.924 -11.374 -4.759  1.000 71.337  0 527 PRO EEE CG  1 ? 
ATOM   1568 C CD  . PRO A 1 198 ? 41.498 -11.832 -4.987  1.000 67.220  0 527 PRO EEE CD  1 ? 
ATOM   1569 N N   . VAL B 2 2   ? 39.205 31.856  -19.416 1.000 57.444  0 2   VAL FFF N   1 ? 
ATOM   1570 C CA  . VAL B 2 2   ? 37.994 32.016  -20.276 1.000 56.770  0 2   VAL FFF CA  1 ? 
ATOM   1571 C C   . VAL B 2 2   ? 37.795 33.503  -20.583 1.000 52.937  0 2   VAL FFF C   1 ? 
ATOM   1572 O O   . VAL B 2 2   ? 37.714 34.291  -19.631 1.000 54.358  0 2   VAL FFF O   1 ? 
ATOM   1573 C CB  . VAL B 2 2   ? 36.730 31.441  -19.612 1.000 61.607  0 2   VAL FFF CB  1 ? 
ATOM   1574 C CG1 . VAL B 2 2   ? 35.476 31.756  -20.425 1.000 60.695  0 2   VAL FFF CG1 1 ? 
ATOM   1575 C CG2 . VAL B 2 2   ? 36.855 29.947  -19.371 1.000 65.415  0 2   VAL FFF CG2 1 ? 
ATOM   1576 N N   . GLN B 2 3   ? 37.685 33.866  -21.860 1.000 50.207  0 3   GLN FFF N   1 ? 
ATOM   1577 C CA  . GLN B 2 3   ? 37.458 35.274  -22.272 1.000 50.813  0 3   GLN FFF CA  1 ? 
ATOM   1578 C C   . GLN B 2 3   ? 36.255 35.344  -23.207 1.000 44.465  0 3   GLN FFF C   1 ? 
ATOM   1579 O O   . GLN B 2 3   ? 36.094 34.445  -24.064 1.000 45.152  0 3   GLN FFF O   1 ? 
ATOM   1580 C CB  . GLN B 2 3   ? 38.710 35.859  -22.926 1.000 57.886  0 3   GLN FFF CB  1 ? 
ATOM   1581 C CG  . GLN B 2 3   ? 39.834 36.098  -21.932 1.000 65.738  0 3   GLN FFF CG  1 ? 
ATOM   1582 C CD  . GLN B 2 3   ? 39.388 36.946  -20.762 1.000 71.842  0 3   GLN FFF CD  1 ? 
ATOM   1583 O OE1 . GLN B 2 3   ? 38.831 38.029  -20.930 1.000 78.013  0 3   GLN FFF OE1 1 ? 
ATOM   1584 N NE2 . GLN B 2 3   ? 39.612 36.450  -19.554 1.000 78.649  0 3   GLN FFF NE2 1 ? 
ATOM   1585 N N   . LEU B 2 4   ? 35.426 36.364  -23.002 1.000 40.617  0 4   LEU FFF N   1 ? 
ATOM   1586 C CA  . LEU B 2 4   ? 34.332 36.747  -23.925 1.000 39.580  0 4   LEU FFF CA  1 ? 
ATOM   1587 C C   . LEU B 2 4   ? 34.810 37.977  -24.694 1.000 41.229  0 4   LEU FFF C   1 ? 
ATOM   1588 O O   . LEU B 2 4   ? 35.100 39.005  -24.034 1.000 41.425  0 4   LEU FFF O   1 ? 
ATOM   1589 C CB  . LEU B 2 4   ? 33.063 37.053  -23.126 1.000 41.685  0 4   LEU FFF CB  1 ? 
ATOM   1590 C CG  . LEU B 2 4   ? 32.571 35.969  -22.166 1.000 45.313  0 4   LEU FFF CG  1 ? 
ATOM   1591 C CD1 . LEU B 2 4   ? 31.132 36.247  -21.760 1.000 45.217  0 4   LEU FFF CD1 1 ? 
ATOM   1592 C CD2 . LEU B 2 4   ? 32.693 34.579  -22.761 1.000 46.406  0 4   LEU FFF CD2 1 ? 
ATOM   1593 N N   . VAL B 2 5   ? 34.936 37.859  -26.017 1.000 43.461  0 5   VAL FFF N   1 ? 
ATOM   1594 C CA  . VAL B 2 5   ? 35.470 38.931  -26.909 1.000 45.068  0 5   VAL FFF CA  1 ? 
ATOM   1595 C C   . VAL B 2 5   ? 34.318 39.410  -27.791 1.000 43.027  0 5   VAL FFF C   1 ? 
ATOM   1596 O O   . VAL B 2 5   ? 33.878 38.640  -28.653 1.000 40.571  0 5   VAL FFF O   1 ? 
ATOM   1597 C CB  . VAL B 2 5   ? 36.662 38.447  -27.759 1.000 49.443  0 5   VAL FFF CB  1 ? 
ATOM   1598 C CG1 . VAL B 2 5   ? 37.234 39.577  -28.599 1.000 52.457  0 5   VAL FFF CG1 1 ? 
ATOM   1599 C CG2 . VAL B 2 5   ? 37.755 37.809  -26.912 1.000 53.127  0 5   VAL FFF CG2 1 ? 
ATOM   1600 N N   . GLU B 2 6   ? 33.842 40.631  -27.560 1.000 46.596  0 6   GLU FFF N   1 ? 
ATOM   1601 C CA  . GLU B 2 6   ? 32.737 41.231  -28.340 1.000 46.946  0 6   GLU FFF CA  1 ? 
ATOM   1602 C C   . GLU B 2 6   ? 33.327 41.969  -29.541 1.000 45.423  0 6   GLU FFF C   1 ? 
ATOM   1603 O O   . GLU B 2 6   ? 34.487 42.418  -29.461 1.000 45.272  0 6   GLU FFF O   1 ? 
ATOM   1604 C CB  . GLU B 2 6   ? 31.927 42.184  -27.469 1.000 48.670  0 6   GLU FFF CB  1 ? 
ATOM   1605 C CG  . GLU B 2 6   ? 31.370 41.527  -26.218 1.000 50.271  0 6   GLU FFF CG  1 ? 
ATOM   1606 C CD  . GLU B 2 6   ? 31.173 42.505  -25.081 1.000 54.358  0 6   GLU FFF CD  1 ? 
ATOM   1607 O OE1 . GLU B 2 6   ? 31.430 43.700  -25.311 1.000 60.165  0 6   GLU FFF OE1 1 ? 
ATOM   1608 O OE2 . GLU B 2 6   ? 30.768 42.080  -23.983 1.000 41.160  0 6   GLU FFF OE2 1 ? 
ATOM   1609 N N   . SER B 2 7   ? 32.546 42.080  -30.611 1.000 43.761  0 7   SER FFF N   1 ? 
ATOM   1610 C CA  . SER B 2 7   ? 32.865 42.910  -31.797 1.000 43.564  0 7   SER FFF CA  1 ? 
ATOM   1611 C C   . SER B 2 7   ? 31.559 43.319  -32.485 1.000 41.915  0 7   SER FFF C   1 ? 
ATOM   1612 O O   . SER B 2 7   ? 30.476 42.843  -32.062 1.000 38.590  0 7   SER FFF O   1 ? 
ATOM   1613 C CB  . SER B 2 7   ? 33.789 42.173  -32.722 1.000 44.940  0 7   SER FFF CB  1 ? 
ATOM   1614 O OG  . SER B 2 7   ? 33.245 40.908  -33.057 1.000 42.168  0 7   SER FFF OG  1 ? 
ATOM   1615 N N   . GLY B 2 8   ? 31.661 44.183  -33.491 1.000 40.158  0 8   GLY FFF N   1 ? 
ATOM   1616 C CA  . GLY B 2 8   ? 30.505 44.738  -34.216 1.000 42.568  0 8   GLY FFF CA  1 ? 
ATOM   1617 C C   . GLY B 2 8   ? 29.947 45.940  -33.482 1.000 44.427  0 8   GLY FFF C   1 ? 
ATOM   1618 O O   . GLY B 2 8   ? 30.639 46.462  -32.582 1.000 46.797  0 8   GLY FFF O   1 ? 
ATOM   1619 N N   . GLY B 2 9   ? 28.739 46.367  -33.848 1.000 48.183  0 9   GLY FFF N   1 ? 
ATOM   1620 C CA  . GLY B 2 9   ? 28.086 47.550  -33.259 1.000 49.144  0 9   GLY FFF CA  1 ? 
ATOM   1621 C C   . GLY B 2 9   ? 28.705 48.834  -33.783 1.000 47.840  0 9   GLY FFF C   1 ? 
ATOM   1622 O O   . GLY B 2 9   ? 29.099 48.858  -34.957 1.000 51.056  0 9   GLY FFF O   1 ? 
ATOM   1623 N N   . GLY B 2 10  ? 28.801 49.859  -32.937 1.000 46.641  0 10  GLY FFF N   1 ? 
ATOM   1624 C CA  . GLY B 2 10  ? 29.249 51.208  -33.325 1.000 48.491  0 10  GLY FFF CA  1 ? 
ATOM   1625 C C   . GLY B 2 10  ? 28.075 52.077  -33.744 1.000 47.156  0 10  GLY FFF C   1 ? 
ATOM   1626 O O   . GLY B 2 10  ? 26.976 51.915  -33.177 1.000 41.539  0 10  GLY FFF O   1 ? 
ATOM   1627 N N   . LEU B 2 11  ? 28.295 52.960  -34.716 1.000 46.549  0 11  LEU FFF N   1 ? 
ATOM   1628 C CA  . LEU B 2 11  ? 27.335 54.018  -35.120 1.000 48.687  0 11  LEU FFF CA  1 ? 
ATOM   1629 C C   . LEU B 2 11  ? 26.404 53.483  -36.210 1.000 47.109  0 11  LEU FFF C   1 ? 
ATOM   1630 O O   . LEU B 2 11  ? 26.899 52.835  -37.141 1.000 47.535  0 11  LEU FFF O   1 ? 
ATOM   1631 C CB  . LEU B 2 11  ? 28.135 55.221  -35.627 1.000 51.907  0 11  LEU FFF CB  1 ? 
ATOM   1632 C CG  . LEU B 2 11  ? 27.325 56.481  -35.919 1.000 57.286  0 11  LEU FFF CG  1 ? 
ATOM   1633 C CD1 . LEU B 2 11  ? 26.710 57.048  -34.646 1.000 56.631  0 11  LEU FFF CD1 1 ? 
ATOM   1634 C CD2 . LEU B 2 11  ? 28.195 57.521  -36.604 1.000 60.796  0 11  LEU FFF CD2 1 ? 
ATOM   1635 N N   . MET B 2 12  ? 25.106 53.771  -36.105 1.000 43.037  0 12  MET FFF N   1 ? 
ATOM   1636 C CA  . MET B 2 12  ? 24.110 53.488  -37.170 1.000 47.207  0 12  MET FFF CA  1 ? 
ATOM   1637 C C   . MET B 2 12  ? 22.934 54.454  -37.019 1.000 47.059  0 12  MET FFF C   1 ? 
ATOM   1638 O O   . MET B 2 12  ? 22.550 54.739  -35.878 1.000 49.830  0 12  MET FFF O   1 ? 
ATOM   1639 C CB  . MET B 2 12  ? 23.615 52.041  -37.084 1.000 50.123  0 12  MET FFF CB  1 ? 
ATOM   1640 C CG  . MET B 2 12  ? 22.576 51.670  -38.132 1.000 53.936  0 12  MET FFF CG  1 ? 
ATOM   1641 S SD  . MET B 2 12  ? 23.116 51.998  -39.832 1.000 60.560  0 12  MET FFF SD  1 ? 
ATOM   1642 C CE  . MET B 2 12  ? 24.324 50.691  -40.052 1.000 56.079  0 12  MET FFF CE  1 ? 
ATOM   1643 N N   . GLN B 2 13  ? 22.381 54.933  -38.133 1.000 44.630  0 13  GLN FFF N   1 ? 
ATOM   1644 C CA  . GLN B 2 13  ? 21.201 55.832  -38.121 1.000 50.740  0 13  GLN FFF CA  1 ? 
ATOM   1645 C C   . GLN B 2 13  ? 19.963 54.997  -37.760 1.000 48.657  0 13  GLN FFF C   1 ? 
ATOM   1646 O O   . GLN B 2 13  ? 19.928 53.787  -38.085 1.000 45.049  0 13  GLN FFF O   1 ? 
ATOM   1647 C CB  . GLN B 2 13  ? 21.102 56.618  -39.432 1.000 56.339  0 13  GLN FFF CB  1 ? 
ATOM   1648 C CG  . GLN B 2 13  ? 20.457 55.874  -40.590 1.000 63.804  0 13  GLN FFF CG  1 ? 
ATOM   1649 C CD  . GLN B 2 13  ? 20.236 56.796  -41.766 1.000 70.348  0 13  GLN FFF CD  1 ? 
ATOM   1650 O OE1 . GLN B 2 13  ? 20.468 58.001  -41.690 1.000 75.792  0 13  GLN FFF OE1 1 ? 
ATOM   1651 N NE2 . GLN B 2 13  ? 19.783 56.230  -42.873 1.000 78.836  0 13  GLN FFF NE2 1 ? 
ATOM   1652 N N   . ALA B 2 14  ? 19.017 55.620  -37.053 1.000 47.885  0 14  ALA FFF N   1 ? 
ATOM   1653 C CA  . ALA B 2 14  ? 17.730 55.029  -36.618 1.000 49.746  0 14  ALA FFF CA  1 ? 
ATOM   1654 C C   . ALA B 2 14  ? 17.061 54.318  -37.800 1.000 49.099  0 14  ALA FFF C   1 ? 
ATOM   1655 O O   . ALA B 2 14  ? 17.115 54.855  -38.930 1.000 45.286  0 14  ALA FFF O   1 ? 
ATOM   1656 C CB  . ALA B 2 14  ? 16.833 56.105  -36.051 1.000 53.329  0 14  ALA FFF CB  1 ? 
ATOM   1657 N N   . GLY B 2 15  ? 16.458 53.155  -37.539 1.000 47.718  0 15  GLY FFF N   1 ? 
ATOM   1658 C CA  . GLY B 2 15  ? 15.756 52.331  -38.541 1.000 48.391  0 15  GLY FFF CA  1 ? 
ATOM   1659 C C   . GLY B 2 15  ? 16.667 51.284  -39.161 1.000 46.936  0 15  GLY FFF C   1 ? 
ATOM   1660 O O   . GLY B 2 15  ? 16.137 50.315  -39.738 1.000 47.915  0 15  GLY FFF O   1 ? 
ATOM   1661 N N   . GLY B 2 16  ? 17.987 51.465  -39.045 1.000 45.080  0 16  GLY FFF N   1 ? 
ATOM   1662 C CA  . GLY B 2 16  ? 19.003 50.548  -39.595 1.000 43.588  0 16  GLY FFF CA  1 ? 
ATOM   1663 C C   . GLY B 2 16  ? 19.186 49.307  -38.735 1.000 43.440  0 16  GLY FFF C   1 ? 
ATOM   1664 O O   . GLY B 2 16  ? 18.454 49.143  -37.733 1.000 41.936  0 16  GLY FFF O   1 ? 
ATOM   1665 N N   . SER B 2 17  ? 20.131 48.451  -39.124 1.000 40.360  0 17  SER FFF N   1 ? 
ATOM   1666 C CA  . SER B 2 17  ? 20.397 47.139  -38.489 1.000 42.364  0 17  SER FFF CA  1 ? 
ATOM   1667 C C   . SER B 2 17  ? 21.904 47.005  -38.223 1.000 41.773  0 17  SER FFF C   1 ? 
ATOM   1668 O O   . SER B 2 17  ? 22.692 47.432  -39.073 1.000 43.637  0 17  SER FFF O   1 ? 
ATOM   1669 C CB  . SER B 2 17  ? 19.840 46.022  -39.345 1.000 45.043  0 17  SER FFF CB  1 ? 
ATOM   1670 O OG  . SER B 2 17  ? 19.541 44.886  -38.548 1.000 54.395  0 17  SER FFF OG  1 ? 
ATOM   1671 N N   . LEU B 2 18  ? 22.284 46.511  -37.040 1.000 39.371  0 18  LEU FFF N   1 ? 
ATOM   1672 C CA  . LEU B 2 18  ? 23.687 46.186  -36.668 1.000 38.360  0 18  LEU FFF CA  1 ? 
ATOM   1673 C C   . LEU B 2 18  ? 23.699 44.752  -36.137 1.000 36.973  0 18  LEU FFF C   1 ? 
ATOM   1674 O O   . LEU B 2 18  ? 22.670 44.301  -35.599 1.000 36.918  0 18  LEU FFF O   1 ? 
ATOM   1675 C CB  . LEU B 2 18  ? 24.210 47.127  -35.574 1.000 42.878  0 18  LEU FFF CB  1 ? 
ATOM   1676 C CG  . LEU B 2 18  ? 24.545 48.566  -35.966 1.000 44.703  0 18  LEU FFF CG  1 ? 
ATOM   1677 C CD1 . LEU B 2 18  ? 24.793 49.400  -34.718 1.000 48.535  0 18  LEU FFF CD1 1 ? 
ATOM   1678 C CD2 . LEU B 2 18  ? 25.754 48.635  -36.886 1.000 48.685  0 18  LEU FFF CD2 1 ? 
ATOM   1679 N N   . ARG B 2 19  ? 24.830 44.071  -36.257 1.000 35.763  0 19  ARG FFF N   1 ? 
ATOM   1680 C CA  . ARG B 2 19  ? 25.018 42.747  -35.619 1.000 34.710  0 19  ARG FFF CA  1 ? 
ATOM   1681 C C   . ARG B 2 19  ? 26.194 42.815  -34.651 1.000 36.147  0 19  ARG FFF C   1 ? 
ATOM   1682 O O   . ARG B 2 19  ? 27.283 43.242  -35.069 1.000 38.054  0 19  ARG FFF O   1 ? 
ATOM   1683 C CB  . ARG B 2 19  ? 25.246 41.682  -36.682 1.000 34.777  0 19  ARG FFF CB  1 ? 
ATOM   1684 C CG  . ARG B 2 19  ? 25.274 40.266  -36.138 1.000 35.674  0 19  ARG FFF CG  1 ? 
ATOM   1685 C CD  . ARG B 2 19  ? 25.661 39.425  -37.324 1.000 37.842  0 19  ARG FFF CD  1 ? 
ATOM   1686 N NE  . ARG B 2 19  ? 25.476 38.013  -37.154 1.000 42.441  0 19  ARG FFF NE  1 ? 
ATOM   1687 C CZ  . ARG B 2 19  ? 24.341 37.355  -37.355 1.000 37.587  0 19  ARG FFF CZ  1 ? 
ATOM   1688 N NH1 . ARG B 2 19  ? 23.228 37.989  -37.669 1.000 39.075  0 19  ARG FFF NH1 1 ? 
ATOM   1689 N NH2 . ARG B 2 19  ? 24.328 36.047  -37.199 1.000 38.370  0 19  ARG FFF NH2 1 ? 
ATOM   1690 N N   . LEU B 2 20  ? 25.963 42.393  -33.404 1.000 32.953  0 20  LEU FFF N   1 ? 
ATOM   1691 C CA  . LEU B 2 20  ? 27.035 42.197  -32.402 1.000 34.228  0 20  LEU FFF CA  1 ? 
ATOM   1692 C C   . LEU B 2 20  ? 27.418 40.719  -32.392 1.000 31.610  0 20  LEU FFF C   1 ? 
ATOM   1693 O O   . LEU B 2 20  ? 26.530 39.874  -32.602 1.000 31.607  0 20  LEU FFF O   1 ? 
ATOM   1694 C CB  . LEU B 2 20  ? 26.554 42.628  -31.017 1.000 35.626  0 20  LEU FFF CB  1 ? 
ATOM   1695 C CG  . LEU B 2 20  ? 25.931 44.021  -30.916 1.000 39.202  0 20  LEU FFF CG  1 ? 
ATOM   1696 C CD1 . LEU B 2 20  ? 25.578 44.328  -29.477 1.000 39.565  0 20  LEU FFF CD1 1 ? 
ATOM   1697 C CD2 . LEU B 2 20  ? 26.850 45.095  -31.465 1.000 43.579  0 20  LEU FFF CD2 1 ? 
ATOM   1698 N N   . SER B 2 21  ? 28.702 40.453  -32.157 1.000 32.844  0 21  SER FFF N   1 ? 
ATOM   1699 C CA  . SER B 2 21  ? 29.297 39.109  -31.995 1.000 33.941  0 21  SER FFF CA  1 ? 
ATOM   1700 C C   . SER B 2 21  ? 29.940 39.031  -30.617 1.000 33.527  0 21  SER FFF C   1 ? 
ATOM   1701 O O   . SER B 2 21  ? 30.463 40.047  -30.119 1.000 33.907  0 21  SER FFF O   1 ? 
ATOM   1702 C CB  . SER B 2 21  ? 30.315 38.823  -33.074 1.000 35.824  0 21  SER FFF CB  1 ? 
ATOM   1703 O OG  . SER B 2 21  ? 29.719 38.906  -34.349 1.000 38.415  0 21  SER FFF OG  1 ? 
ATOM   1704 N N   . CYS B 2 22  ? 29.926 37.848  -30.032 1.000 32.911  0 22  CYS FFF N   1 ? 
ATOM   1705 C CA  . CYS B 2 22  ? 30.652 37.584  -28.776 1.000 34.738  0 22  CYS FFF CA  1 ? 
ATOM   1706 C C   . CYS B 2 22  ? 31.261 36.189  -28.850 1.000 34.082  0 22  CYS FFF C   1 ? 
ATOM   1707 O O   . CYS B 2 22  ? 30.489 35.213  -28.804 1.000 36.217  0 22  CYS FFF O   1 ? 
ATOM   1708 C CB  . CYS B 2 22  ? 29.729 37.743  -27.581 1.000 35.126  0 22  CYS FFF CB  1 ? 
ATOM   1709 S SG  . CYS B 2 22  ? 30.552 37.215  -26.069 1.000 39.128  0 22  CYS FFF SG  1 ? 
ATOM   1710 N N   . ALA B 2 23  ? 32.586 36.122  -29.002 1.000 35.806  0 23  ALA FFF N   1 ? 
ATOM   1711 C CA  . ALA B 2 23  ? 33.353 34.866  -29.161 1.000 38.576  0 23  ALA FFF CA  1 ? 
ATOM   1712 C C   . ALA B 2 23  ? 33.868 34.437  -27.788 1.000 38.028  0 23  ALA FFF C   1 ? 
ATOM   1713 O O   . ALA B 2 23  ? 34.426 35.291  -27.071 1.000 40.579  0 23  ALA FFF O   1 ? 
ATOM   1714 C CB  . ALA B 2 23  ? 34.482 35.051  -30.147 1.000 41.693  0 23  ALA FFF CB  1 ? 
ATOM   1715 N N   . VAL B 2 24  ? 33.661 33.168  -27.442 1.000 38.505  0 24  VAL FFF N   1 ? 
ATOM   1716 C CA  . VAL B 2 24  ? 34.162 32.551  -26.182 1.000 40.303  0 24  VAL FFF CA  1 ? 
ATOM   1717 C C   . VAL B 2 24  ? 35.486 31.858  -26.512 1.000 43.105  0 24  VAL FFF C   1 ? 
ATOM   1718 O O   . VAL B 2 24  ? 35.490 31.010  -27.415 1.000 41.197  0 24  VAL FFF O   1 ? 
ATOM   1719 C CB  . VAL B 2 24  ? 33.139 31.564  -25.596 1.000 42.668  0 24  VAL FFF CB  1 ? 
ATOM   1720 C CG1 . VAL B 2 24  ? 33.603 31.012  -24.261 1.000 43.633  0 24  VAL FFF CG1 1 ? 
ATOM   1721 C CG2 . VAL B 2 24  ? 31.757 32.185  -25.481 1.000 44.042  0 24  VAL FFF CG2 1 ? 
ATOM   1722 N N   . SER B 2 25  ? 36.566 32.224  -25.823 1.000 45.953  0 25  SER FFF N   1 ? 
ATOM   1723 C CA  . SER B 2 25  ? 37.909 31.611  -25.994 1.000 52.213  0 25  SER FFF CA  1 ? 
ATOM   1724 C C   . SER B 2 25  ? 38.352 30.997  -24.666 1.000 55.506  0 25  SER FFF C   1 ? 
ATOM   1725 O O   . SER B 2 25  ? 37.779 31.359  -23.612 1.000 56.524  0 25  SER FFF O   1 ? 
ATOM   1726 C CB  . SER B 2 25  ? 38.919 32.601  -26.525 1.000 55.409  0 25  SER FFF CB  1 ? 
ATOM   1727 O OG  . SER B 2 25  ? 38.959 33.775  -25.730 1.000 61.228  0 25  SER FFF OG  1 ? 
ATOM   1728 N N   . GLY B 2 26  ? 39.315 30.079  -24.732 1.000 56.827  0 26  GLY FFF N   1 ? 
ATOM   1729 C CA  . GLY B 2 26  ? 39.846 29.356  -23.564 1.000 56.883  0 26  GLY FFF CA  1 ? 
ATOM   1730 C C   . GLY B 2 26  ? 39.031 28.112  -23.267 1.000 60.825  0 26  GLY FFF C   1 ? 
ATOM   1731 O O   . GLY B 2 26  ? 37.873 28.026  -23.739 1.000 58.153  0 26  GLY FFF O   1 ? 
ATOM   1732 N N   . ARG B 2 27  ? 39.620 27.183  -22.510 1.000 65.682  0 27  ARG FFF N   1 ? 
ATOM   1733 C CA  . ARG B 2 27  ? 39.015 25.870  -22.161 1.000 68.466  0 27  ARG FFF CA  1 ? 
ATOM   1734 C C   . ARG B 2 27  ? 37.759 26.096  -21.316 1.000 61.492  0 27  ARG FFF C   1 ? 
ATOM   1735 O O   . ARG B 2 27  ? 37.852 26.759  -20.267 1.000 62.638  0 27  ARG FFF O   1 ? 
ATOM   1736 C CB  . ARG B 2 27  ? 39.994 24.984  -21.385 1.000 78.863  0 27  ARG FFF CB  1 ? 
ATOM   1737 C CG  . ARG B 2 27  ? 41.246 24.592  -22.156 1.000 87.697  0 27  ARG FFF CG  1 ? 
ATOM   1738 C CD  . ARG B 2 27  ? 41.906 23.382  -21.521 1.000 94.742  0 27  ARG FFF CD  1 ? 
ATOM   1739 N NE  . ARG B 2 27  ? 43.321 23.265  -21.849 1.000 100.796 0 27  ARG FFF NE  1 ? 
ATOM   1740 C CZ  . ARG B 2 27  ? 44.125 22.296  -21.414 1.000 104.080 0 27  ARG FFF CZ  1 ? 
ATOM   1741 N NH1 . ARG B 2 27  ? 43.659 21.340  -20.627 1.000 107.128 0 27  ARG FFF NH1 1 ? 
ATOM   1742 N NH2 . ARG B 2 27  ? 45.399 22.288  -21.771 1.000 104.199 0 27  ARG FFF NH2 1 ? 
ATOM   1743 N N   . THR B 2 28  ? 36.635 25.561  -21.784 1.000 55.536  0 28  THR FFF N   1 ? 
ATOM   1744 C CA  A THR B 2 28  ? 35.332 25.526  -21.071 0.500 55.008  0 28  THR FFF CA  1 ? 
ATOM   1745 C CA  B THR B 2 28  ? 35.356 25.522  -21.028 0.500 51.533  0 28  THR FFF CA  1 ? 
ATOM   1746 C C   . THR B 2 28  ? 34.949 24.056  -20.862 1.000 51.000  0 28  THR FFF C   1 ? 
ATOM   1747 O O   . THR B 2 28  ? 35.226 23.257  -21.782 1.000 53.991  0 28  THR FFF O   1 ? 
ATOM   1748 C CB  A THR B 2 28  ? 34.257 26.285  -21.862 0.500 59.234  0 28  THR FFF CB  1 ? 
ATOM   1749 C CB  B THR B 2 28  ? 34.262 26.344  -21.720 0.500 49.283  0 28  THR FFF CB  1 ? 
ATOM   1750 O OG1 A THR B 2 28  ? 32.976 25.882  -21.379 0.500 61.668  0 28  THR FFF OG1 1 ? 
ATOM   1751 O OG1 B THR B 2 28  ? 33.930 25.682  -22.940 0.500 45.867  0 28  THR FFF OG1 1 ? 
ATOM   1752 C CG2 A THR B 2 28  ? 34.321 26.039  -23.356 0.500 62.001  0 28  THR FFF CG2 1 ? 
ATOM   1753 C CG2 B THR B 2 28  ? 34.677 27.775  -21.988 0.500 47.759  0 28  THR FFF CG2 1 ? 
ATOM   1754 N N   . PHE B 2 29  ? 34.352 23.720  -19.718 1.000 47.410  0 29  PHE FFF N   1 ? 
ATOM   1755 C CA  . PHE B 2 29  ? 33.833 22.351  -19.469 1.000 44.331  0 29  PHE FFF CA  1 ? 
ATOM   1756 C C   . PHE B 2 29  ? 32.490 22.219  -20.191 1.000 40.905  0 29  PHE FFF C   1 ? 
ATOM   1757 O O   . PHE B 2 29  ? 32.228 21.169  -20.806 1.000 41.677  0 29  PHE FFF O   1 ? 
ATOM   1758 C CB  . PHE B 2 29  ? 33.684 22.047  -17.977 1.000 44.998  0 29  PHE FFF CB  1 ? 
ATOM   1759 C CG  . PHE B 2 29  ? 33.217 20.640  -17.710 1.000 43.433  0 29  PHE FFF CG  1 ? 
ATOM   1760 C CD1 . PHE B 2 29  ? 31.864 20.349  -17.604 1.000 42.741  0 29  PHE FFF CD1 1 ? 
ATOM   1761 C CD2 . PHE B 2 29  ? 34.129 19.598  -17.595 1.000 45.683  0 29  PHE FFF CD2 1 ? 
ATOM   1762 C CE1 . PHE B 2 29  ? 31.436 19.049  -17.376 1.000 46.469  0 29  PHE FFF CE1 1 ? 
ATOM   1763 C CE2 . PHE B 2 29  ? 33.699 18.298  -17.368 1.000 46.292  0 29  PHE FFF CE2 1 ? 
ATOM   1764 C CZ  . PHE B 2 29  ? 32.353 18.026  -17.256 1.000 46.858  0 29  PHE FFF CZ  1 ? 
ATOM   1765 N N   . SER B 2 30  ? 31.677 23.277  -20.112 1.000 41.956  0 30  SER FFF N   1 ? 
ATOM   1766 C CA  . SER B 2 30  ? 30.287 23.322  -20.620 1.000 39.362  0 30  SER FFF CA  1 ? 
ATOM   1767 C C   . SER B 2 30  ? 29.806 24.770  -20.694 1.000 38.795  0 30  SER FFF C   1 ? 
ATOM   1768 O O   . SER B 2 30  ? 30.370 25.620  -20.001 1.000 45.674  0 30  SER FFF O   1 ? 
ATOM   1769 C CB  . SER B 2 30  ? 29.383 22.499  -19.736 1.000 41.966  0 30  SER FFF CB  1 ? 
ATOM   1770 O OG  . SER B 2 30  ? 29.243 23.089  -18.441 1.000 45.192  0 30  SER FFF OG  1 ? 
ATOM   1771 N N   . THR B 2 31  ? 28.835 25.037  -21.556 1.000 35.954  0 31  THR FFF N   1 ? 
ATOM   1772 C CA  . THR B 2 31  ? 28.106 26.332  -21.649 1.000 35.500  0 31  THR FFF CA  1 ? 
ATOM   1773 C C   . THR B 2 31  ? 26.615 26.008  -21.545 1.000 32.347  0 31  THR FFF C   1 ? 
ATOM   1774 O O   . THR B 2 31  ? 26.137 25.169  -22.319 1.000 35.531  0 31  THR FFF O   1 ? 
ATOM   1775 C CB  . THR B 2 31  ? 28.428 27.091  -22.945 1.000 36.589  0 31  THR FFF CB  1 ? 
ATOM   1776 O OG1 . THR B 2 31  ? 29.810 27.439  -22.966 1.000 39.609  0 31  THR FFF OG1 1 ? 
ATOM   1777 C CG2 . THR B 2 31  ? 27.627 28.365  -23.113 1.000 36.537  0 31  THR FFF CG2 1 ? 
ATOM   1778 N N   . ALA B 2 32  ? 25.915 26.615  -20.597 1.000 30.240  0 32  ALA FFF N   1 ? 
ATOM   1779 C CA  . ALA B 2 32  ? 24.456 26.432  -20.430 1.000 30.861  0 32  ALA FFF CA  1 ? 
ATOM   1780 C C   . ALA B 2 32  ? 23.728 27.448  -21.307 1.000 28.694  0 32  ALA FFF C   1 ? 
ATOM   1781 O O   . ALA B 2 32  ? 22.790 27.076  -22.006 1.000 29.050  0 32  ALA FFF O   1 ? 
ATOM   1782 C CB  . ALA B 2 32  ? 24.071 26.574  -18.985 1.000 31.683  0 32  ALA FFF CB  1 ? 
ATOM   1783 N N   . ALA B 2 33  ? 24.132 28.707  -21.236 1.000 28.745  0 33  ALA FFF N   1 ? 
ATOM   1784 C CA  . ALA B 2 33  ? 23.423 29.811  -21.910 1.000 28.307  0 33  ALA FFF CA  1 ? 
ATOM   1785 C C   . ALA B 2 33  ? 24.367 30.985  -22.097 1.000 28.915  0 33  ALA FFF C   1 ? 
ATOM   1786 O O   . ALA B 2 33  ? 25.354 31.104  -21.355 1.000 29.520  0 33  ALA FFF O   1 ? 
ATOM   1787 C CB  . ALA B 2 33  ? 22.200 30.223  -21.122 1.000 28.839  0 33  ALA FFF CB  1 ? 
ATOM   1788 N N   . MET B 2 34  ? 24.064 31.800  -23.098 1.000 28.757  0 34  MET FFF N   1 ? 
ATOM   1789 C CA  A MET B 2 34  ? 24.714 33.109  -23.368 0.500 31.075  0 34  MET FFF CA  1 ? 
ATOM   1790 C CA  B MET B 2 34  ? 24.718 33.121  -23.232 0.500 27.569  0 34  MET FFF CA  1 ? 
ATOM   1791 C C   . MET B 2 34  ? 23.632 34.189  -23.331 1.000 29.290  0 34  MET FFF C   1 ? 
ATOM   1792 O O   . MET B 2 34  ? 22.477 33.860  -23.632 1.000 31.170  0 34  MET FFF O   1 ? 
ATOM   1793 C CB  A MET B 2 34  ? 25.367 33.148  -24.753 0.500 34.000  0 34  MET FFF CB  1 ? 
ATOM   1794 C CB  B MET B 2 34  ? 25.671 33.167  -24.430 0.500 26.389  0 34  MET FFF CB  1 ? 
ATOM   1795 C CG  A MET B 2 34  ? 26.493 32.159  -24.944 0.500 37.497  0 34  MET FFF CG  1 ? 
ATOM   1796 C CG  B MET B 2 34  ? 26.828 32.192  -24.282 0.500 24.975  0 34  MET FFF CG  1 ? 
ATOM   1797 S SD  A MET B 2 34  ? 27.904 32.499  -23.886 0.500 42.764  0 34  MET FFF SD  1 ? 
ATOM   1798 S SD  B MET B 2 34  ? 28.153 32.414  -25.492 0.500 25.278  0 34  MET FFF SD  1 ? 
ATOM   1799 C CE  A MET B 2 34  ? 28.407 34.107  -24.499 0.500 42.036  0 34  MET FFF CE  1 ? 
ATOM   1800 C CE  B MET B 2 34  ? 28.921 33.905  -24.862 0.500 25.893  0 34  MET FFF CE  1 ? 
ATOM   1801 N N   . GLY B 2 35  ? 24.011 35.416  -23.030 1.000 30.724  0 35  GLY FFF N   1 ? 
ATOM   1802 C CA  . GLY B 2 35  ? 23.055 36.520  -22.965 1.000 31.889  0 35  GLY FFF CA  1 ? 
ATOM   1803 C C   . GLY B 2 35  ? 23.706 37.808  -23.388 1.000 32.325  0 35  GLY FFF C   1 ? 
ATOM   1804 O O   . GLY B 2 35  ? 24.956 37.890  -23.401 1.000 32.181  0 35  GLY FFF O   1 ? 
ATOM   1805 N N   . TRP B 2 36  ? 22.859 38.759  -23.749 1.000 30.540  0 36  TRP FFF N   1 ? 
ATOM   1806 C CA  . TRP B 2 36  ? 23.231 40.157  -24.019 1.000 30.672  0 36  TRP FFF CA  1 ? 
ATOM   1807 C C   . TRP B 2 36  ? 22.543 41.023  -22.978 1.000 31.203  0 36  TRP FFF C   1 ? 
ATOM   1808 O O   . TRP B 2 36  ? 21.344 40.777  -22.703 1.000 32.721  0 36  TRP FFF O   1 ? 
ATOM   1809 C CB  . TRP B 2 36  ? 22.835 40.551  -25.443 1.000 31.444  0 36  TRP FFF CB  1 ? 
ATOM   1810 C CG  . TRP B 2 36  ? 23.705 39.915  -26.483 1.000 32.136  0 36  TRP FFF CG  1 ? 
ATOM   1811 C CD1 . TRP B 2 36  ? 23.430 38.807  -27.229 1.000 30.801  0 36  TRP FFF CD1 1 ? 
ATOM   1812 C CD2 . TRP B 2 36  ? 25.022 40.340  -26.860 1.000 32.069  0 36  TRP FFF CD2 1 ? 
ATOM   1813 N NE1 . TRP B 2 36  ? 24.484 38.520  -28.054 1.000 31.135  0 36  TRP FFF NE1 1 ? 
ATOM   1814 C CE2 . TRP B 2 36  ? 25.468 39.454  -27.864 1.000 32.153  0 36  TRP FFF CE2 1 ? 
ATOM   1815 C CE3 . TRP B 2 36  ? 25.854 41.394  -26.467 1.000 33.515  0 36  TRP FFF CE3 1 ? 
ATOM   1816 C CZ2 . TRP B 2 36  ? 26.714 39.593  -28.475 1.000 31.772  0 36  TRP FFF CZ2 1 ? 
ATOM   1817 C CZ3 . TRP B 2 36  ? 27.085 41.528  -27.071 1.000 35.413  0 36  TRP FFF CZ3 1 ? 
ATOM   1818 C CH2 . TRP B 2 36  ? 27.510 40.630  -28.053 1.000 34.270  0 36  TRP FFF CH2 1 ? 
ATOM   1819 N N   . PHE B 2 37  ? 23.296 41.975  -22.433 1.000 32.876  0 37  PHE FFF N   1 ? 
ATOM   1820 C CA  . PHE B 2 37  ? 22.814 43.031  -21.515 1.000 35.094  0 37  PHE FFF CA  1 ? 
ATOM   1821 C C   . PHE B 2 37  ? 23.234 44.375  -22.104 1.000 35.465  0 37  PHE FFF C   1 ? 
ATOM   1822 O O   . PHE B 2 37  ? 24.105 44.401  -22.987 1.000 35.871  0 37  PHE FFF O   1 ? 
ATOM   1823 C CB  . PHE B 2 37  ? 23.397 42.817  -20.116 1.000 36.188  0 37  PHE FFF CB  1 ? 
ATOM   1824 C CG  . PHE B 2 37  ? 22.882 41.594  -19.400 1.000 40.011  0 37  PHE FFF CG  1 ? 
ATOM   1825 C CD1 . PHE B 2 37  ? 23.349 40.329  -19.717 1.000 39.301  0 37  PHE FFF CD1 1 ? 
ATOM   1826 C CD2 . PHE B 2 37  ? 21.937 41.713  -18.393 1.000 43.847  0 37  PHE FFF CD2 1 ? 
ATOM   1827 C CE1 . PHE B 2 37  ? 22.867 39.210  -19.054 1.000 41.369  0 37  PHE FFF CE1 1 ? 
ATOM   1828 C CE2 . PHE B 2 37  ? 21.462 40.594  -17.724 1.000 43.824  0 37  PHE FFF CE2 1 ? 
ATOM   1829 C CZ  . PHE B 2 37  ? 21.923 39.345  -18.061 1.000 42.998  0 37  PHE FFF CZ  1 ? 
ATOM   1830 N N   . ARG B 2 38  ? 22.649 45.468  -21.633 1.000 36.225  0 38  ARG FFF N   1 ? 
ATOM   1831 C CA  . ARG B 2 38  ? 23.076 46.815  -22.080 1.000 36.359  0 38  ARG FFF CA  1 ? 
ATOM   1832 C C   . ARG B 2 38  ? 22.984 47.788  -20.908 1.000 38.198  0 38  ARG FFF C   1 ? 
ATOM   1833 O O   . ARG B 2 38  ? 22.148 47.572  -20.010 1.000 40.767  0 38  ARG FFF O   1 ? 
ATOM   1834 C CB  . ARG B 2 38  ? 22.257 47.261  -23.294 1.000 37.153  0 38  ARG FFF CB  1 ? 
ATOM   1835 C CG  . ARG B 2 38  ? 20.785 47.514  -23.005 1.000 39.008  0 38  ARG FFF CG  1 ? 
ATOM   1836 C CD  . ARG B 2 38  ? 20.047 47.861  -24.281 1.000 40.601  0 38  ARG FFF CD  1 ? 
ATOM   1837 N NE  . ARG B 2 38  ? 18.638 48.134  -24.043 1.000 41.143  0 38  ARG FFF NE  1 ? 
ATOM   1838 C CZ  . ARG B 2 38  ? 17.742 48.368  -24.996 1.000 41.981  0 38  ARG FFF CZ  1 ? 
ATOM   1839 N NH1 . ARG B 2 38  ? 18.106 48.362  -26.268 1.000 41.128  0 38  ARG FFF NH1 1 ? 
ATOM   1840 N NH2 . ARG B 2 38  ? 16.483 48.607  -24.675 1.000 44.262  0 38  ARG FFF NH2 1 ? 
ATOM   1841 N N   . GLN B 2 39  ? 23.842 48.806  -20.933 1.000 39.737  0 39  GLN FFF N   1 ? 
ATOM   1842 C CA  . GLN B 2 39  ? 23.868 49.903  -19.938 1.000 42.099  0 39  GLN FFF CA  1 ? 
ATOM   1843 C C   . GLN B 2 39  ? 23.951 51.226  -20.696 1.000 43.444  0 39  GLN FFF C   1 ? 
ATOM   1844 O O   . GLN B 2 39  ? 24.978 51.456  -21.343 1.000 42.333  0 39  GLN FFF O   1 ? 
ATOM   1845 C CB  . GLN B 2 39  ? 25.052 49.728  -18.986 1.000 45.287  0 39  GLN FFF CB  1 ? 
ATOM   1846 C CG  . GLN B 2 39  ? 25.093 50.774  -17.883 1.000 50.423  0 39  GLN FFF CG  1 ? 
ATOM   1847 C CD  . GLN B 2 39  ? 25.752 50.258  -16.629 1.000 53.068  0 39  GLN FFF CD  1 ? 
ATOM   1848 O OE1 . GLN B 2 39  ? 26.647 49.418  -16.672 1.000 60.986  0 39  GLN FFF OE1 1 ? 
ATOM   1849 N NE2 . GLN B 2 39  ? 25.298 50.752  -15.490 1.000 57.561  0 39  GLN FFF NE2 1 ? 
ATOM   1850 N N   . ALA B 2 40  ? 22.887 52.027  -20.649 1.000 49.015  0 40  ALA FFF N   1 ? 
ATOM   1851 C CA  . ALA B 2 40  ? 22.856 53.413  -21.166 1.000 54.135  0 40  ALA FFF CA  1 ? 
ATOM   1852 C C   . ALA B 2 40  ? 23.450 54.322  -20.094 1.000 60.884  0 40  ALA FFF C   1 ? 
ATOM   1853 O O   . ALA B 2 40  ? 23.340 54.016  -18.907 1.000 57.235  0 40  ALA FFF O   1 ? 
ATOM   1854 C CB  . ALA B 2 40  ? 21.443 53.798  -21.530 1.000 57.650  0 40  ALA FFF CB  1 ? 
ATOM   1855 N N   . PRO B 2 41  ? 24.102 55.451  -20.463 1.000 70.700  0 41  PRO FFF N   1 ? 
ATOM   1856 C CA  . PRO B 2 41  ? 24.806 56.282  -19.486 1.000 74.898  0 41  PRO FFF CA  1 ? 
ATOM   1857 C C   . PRO B 2 41  ? 23.868 56.725  -18.353 1.000 74.723  0 41  PRO FFF C   1 ? 
ATOM   1858 O O   . PRO B 2 41  ? 22.787 57.214  -18.641 1.000 72.723  0 41  PRO FFF O   1 ? 
ATOM   1859 C CB  . PRO B 2 41  ? 25.324 57.484  -20.297 1.000 78.654  0 41  PRO FFF CB  1 ? 
ATOM   1860 C CG  . PRO B 2 41  ? 24.511 57.467  -21.581 1.000 77.490  0 41  PRO FFF CG  1 ? 
ATOM   1861 C CD  . PRO B 2 41  ? 24.171 56.011  -21.822 1.000 73.725  0 41  PRO FFF CD  1 ? 
ATOM   1862 N N   . GLY B 2 42  ? 24.285 56.488  -17.105 1.000 76.110  0 42  GLY FFF N   1 ? 
ATOM   1863 C CA  . GLY B 2 42  ? 23.552 56.885  -15.888 1.000 77.706  0 42  GLY FFF CA  1 ? 
ATOM   1864 C C   . GLY B 2 42  ? 22.325 56.024  -15.622 1.000 75.417  0 42  GLY FFF C   1 ? 
ATOM   1865 O O   . GLY B 2 42  ? 21.573 56.366  -14.691 1.000 73.499  0 42  GLY FFF O   1 ? 
ATOM   1866 N N   . LYS B 2 43  ? 22.117 54.948  -16.391 1.000 70.743  0 43  LYS FFF N   1 ? 
ATOM   1867 C CA  . LYS B 2 43  ? 21.014 53.973  -16.175 1.000 68.009  0 43  LYS FFF CA  1 ? 
ATOM   1868 C C   . LYS B 2 43  ? 21.627 52.652  -15.698 1.000 61.689  0 43  LYS FFF C   1 ? 
ATOM   1869 O O   . LYS B 2 43  ? 22.849 52.458  -15.883 1.000 61.288  0 43  LYS FFF O   1 ? 
ATOM   1870 C CB  . LYS B 2 43  ? 20.169 53.814  -17.444 1.000 72.751  0 43  LYS FFF CB  1 ? 
ATOM   1871 C CG  . LYS B 2 43  ? 19.409 55.068  -17.855 1.000 76.822  0 43  LYS FFF CG  1 ? 
ATOM   1872 C CD  . LYS B 2 43  ? 18.204 54.810  -18.736 1.000 81.694  0 43  LYS FFF CD  1 ? 
ATOM   1873 C CE  . LYS B 2 43  ? 17.388 56.062  -18.984 1.000 81.363  0 43  LYS FFF CE  1 ? 
ATOM   1874 N NZ  . LYS B 2 43  ? 16.285 55.820  -19.944 1.000 79.185  0 43  LYS FFF NZ  1 ? 
ATOM   1875 N N   . GLU B 2 44  ? 20.820 51.803  -15.057 1.000 60.003  0 44  GLU FFF N   1 ? 
ATOM   1876 C CA  . GLU B 2 44  ? 21.267 50.475  -14.565 1.000 62.054  0 44  GLU FFF CA  1 ? 
ATOM   1877 C C   . GLU B 2 44  ? 21.393 49.539  -15.766 1.000 53.952  0 44  GLU FFF C   1 ? 
ATOM   1878 O O   . GLU B 2 44  ? 20.643 49.735  -16.751 1.000 50.372  0 44  GLU FFF O   1 ? 
ATOM   1879 C CB  . GLU B 2 44  ? 20.302 49.935  -13.509 1.000 67.801  0 44  GLU FFF CB  1 ? 
ATOM   1880 C CG  . GLU B 2 44  ? 20.328 50.747  -12.221 1.000 73.915  0 44  GLU FFF CG  1 ? 
ATOM   1881 C CD  . GLU B 2 44  ? 19.331 50.307  -11.166 1.000 84.498  0 44  GLU FFF CD  1 ? 
ATOM   1882 O OE1 . GLU B 2 44  ? 18.668 49.270  -11.376 1.000 87.467  0 44  GLU FFF OE1 1 ? 
ATOM   1883 O OE2 . GLU B 2 44  ? 19.223 51.004  -10.133 1.000 96.938  0 44  GLU FFF OE2 1 ? 
ATOM   1884 N N   . ARG B 2 45  ? 22.337 48.597  -15.702 1.000 50.654  0 45  ARG FFF N   1 ? 
ATOM   1885 C CA  . ARG B 2 45  ? 22.530 47.554  -16.742 1.000 49.596  0 45  ARG FFF CA  1 ? 
ATOM   1886 C C   . ARG B 2 45  ? 21.240 46.735  -16.789 1.000 50.510  0 45  ARG FFF C   1 ? 
ATOM   1887 O O   . ARG B 2 45  ? 20.686 46.455  -15.702 1.000 52.863  0 45  ARG FFF O   1 ? 
ATOM   1888 C CB  . ARG B 2 45  ? 23.754 46.691  -16.419 1.000 54.924  0 45  ARG FFF CB  1 ? 
ATOM   1889 C CG  . ARG B 2 45  ? 24.031 45.578  -17.421 1.000 57.293  0 45  ARG FFF CG  1 ? 
ATOM   1890 C CD  . ARG B 2 45  ? 25.123 44.646  -16.932 1.000 64.867  0 45  ARG FFF CD  1 ? 
ATOM   1891 N NE  . ARG B 2 45  ? 24.715 43.950  -15.716 1.000 69.925  0 45  ARG FFF NE  1 ? 
ATOM   1892 C CZ  . ARG B 2 45  ? 25.522 43.243  -14.928 1.000 78.732  0 45  ARG FFF CZ  1 ? 
ATOM   1893 N NH1 . ARG B 2 45  ? 26.808 43.114  -15.221 1.000 82.002  0 45  ARG FFF NH1 1 ? 
ATOM   1894 N NH2 . ARG B 2 45  ? 25.033 42.664  -13.843 1.000 80.648  0 45  ARG FFF NH2 1 ? 
ATOM   1895 N N   . GLU B 2 46  ? 20.762 46.390  -17.988 1.000 44.257  0 46  GLU FFF N   1 ? 
ATOM   1896 C CA  . GLU B 2 46  ? 19.454 45.708  -18.141 1.000 45.833  0 46  GLU FFF CA  1 ? 
ATOM   1897 C C   . GLU B 2 46  ? 19.590 44.536  -19.111 1.000 41.609  0 46  GLU FFF C   1 ? 
ATOM   1898 O O   . GLU B 2 46  ? 20.427 44.593  -20.035 1.000 39.848  0 46  GLU FFF O   1 ? 
ATOM   1899 C CB  . GLU B 2 46  ? 18.376 46.718  -18.533 1.000 52.912  0 46  GLU FFF CB  1 ? 
ATOM   1900 C CG  . GLU B 2 46  ? 18.267 46.981  -20.016 1.000 54.282  0 46  GLU FFF CG  1 ? 
ATOM   1901 C CD  . GLU B 2 46  ? 17.405 48.171  -20.393 1.000 57.596  0 46  GLU FFF CD  1 ? 
ATOM   1902 O OE1 . GLU B 2 46  ? 17.221 48.404  -21.607 1.000 55.043  0 46  GLU FFF OE1 1 ? 
ATOM   1903 O OE2 . GLU B 2 46  ? 16.922 48.860  -19.479 1.000 59.801  0 46  GLU FFF OE2 1 ? 
ATOM   1904 N N   . PHE B 2 47  ? 18.794 43.501  -18.869 1.000 37.918  0 47  PHE FFF N   1 ? 
ATOM   1905 C CA  . PHE B 2 47  ? 18.722 42.288  -19.712 1.000 35.855  0 47  PHE FFF CA  1 ? 
ATOM   1906 C C   . PHE B 2 47  ? 18.176 42.652  -21.098 1.000 36.122  0 47  PHE FFF C   1 ? 
ATOM   1907 O O   . PHE B 2 47  ? 17.241 43.475  -21.186 1.000 35.677  0 47  PHE FFF O   1 ? 
ATOM   1908 C CB  . PHE B 2 47  ? 17.849 41.240  -19.031 1.000 36.635  0 47  PHE FFF CB  1 ? 
ATOM   1909 C CG  . PHE B 2 47  ? 17.582 40.039  -19.890 1.000 33.902  0 47  PHE FFF CG  1 ? 
ATOM   1910 C CD1 . PHE B 2 47  ? 18.583 39.111  -20.123 1.000 33.650  0 47  PHE FFF CD1 1 ? 
ATOM   1911 C CD2 . PHE B 2 47  ? 16.344 39.854  -20.484 1.000 33.522  0 47  PHE FFF CD2 1 ? 
ATOM   1912 C CE1 . PHE B 2 47  ? 18.336 37.991  -20.898 1.000 33.237  0 47  PHE FFF CE1 1 ? 
ATOM   1913 C CE2 . PHE B 2 47  ? 16.103 38.737  -21.267 1.000 34.956  0 47  PHE FFF CE2 1 ? 
ATOM   1914 C CZ  . PHE B 2 47  ? 17.099 37.810  -21.471 1.000 33.864  0 47  PHE FFF CZ  1 ? 
ATOM   1915 N N   . VAL B 2 48  ? 18.754 42.052  -22.144 1.000 34.492  0 48  VAL FFF N   1 ? 
ATOM   1916 C CA  . VAL B 2 48  ? 18.303 42.220  -23.559 1.000 33.970  0 48  VAL FFF CA  1 ? 
ATOM   1917 C C   . VAL B 2 48  ? 17.801 40.869  -24.077 1.000 32.050  0 48  VAL FFF C   1 ? 
ATOM   1918 O O   . VAL B 2 48  ? 16.633 40.790  -24.517 1.000 33.312  0 48  VAL FFF O   1 ? 
ATOM   1919 C CB  . VAL B 2 48  ? 19.420 42.803  -24.446 1.000 36.110  0 48  VAL FFF CB  1 ? 
ATOM   1920 C CG1 . VAL B 2 48  ? 19.024 42.816  -25.917 1.000 36.455  0 48  VAL FFF CG1 1 ? 
ATOM   1921 C CG2 . VAL B 2 48  ? 19.819 44.198  -23.985 1.000 37.462  0 48  VAL FFF CG2 1 ? 
ATOM   1922 N N   . ALA B 2 49  ? 18.641 39.837  -24.058 1.000 30.676  0 49  ALA FFF N   1 ? 
ATOM   1923 C CA  . ALA B 2 49  ? 18.272 38.524  -24.629 1.000 30.097  0 49  ALA FFF CA  1 ? 
ATOM   1924 C C   . ALA B 2 49  ? 19.183 37.428  -24.098 1.000 30.019  0 49  ALA FFF C   1 ? 
ATOM   1925 O O   . ALA B 2 49  ? 20.346 37.727  -23.754 1.000 29.998  0 49  ALA FFF O   1 ? 
ATOM   1926 C CB  . ALA B 2 49  ? 18.339 38.573  -26.137 1.000 30.761  0 49  ALA FFF CB  1 ? 
ATOM   1927 N N   . ALA B 2 50  ? 18.655 36.204  -24.070 1.000 28.523  0 50  ALA FFF N   1 ? 
ATOM   1928 C CA  . ALA B 2 50  ? 19.400 34.991  -23.691 1.000 29.975  0 50  ALA FFF CA  1 ? 
ATOM   1929 C C   . ALA B 2 50  ? 19.078 33.874  -24.671 1.000 27.581  0 50  ALA FFF C   1 ? 
ATOM   1930 O O   . ALA B 2 50  ? 17.981 33.874  -25.277 1.000 28.520  0 50  ALA FFF O   1 ? 
ATOM   1931 C CB  . ALA B 2 50  ? 19.077 34.568  -22.286 1.000 32.061  0 50  ALA FFF CB  1 ? 
ATOM   1932 N N   . ILE B 2 51  ? 20.019 32.955  -24.807 1.000 28.613  0 51  ILE FFF N   1 ? 
ATOM   1933 C CA  . ILE B 2 51  ? 19.854 31.763  -25.673 1.000 27.844  0 51  ILE FFF CA  1 ? 
ATOM   1934 C C   . ILE B 2 51  ? 20.436 30.558  -24.941 1.000 25.977  0 51  ILE FFF C   1 ? 
ATOM   1935 O O   . ILE B 2 51  ? 21.567 30.663  -24.406 1.000 27.569  0 51  ILE FFF O   1 ? 
ATOM   1936 C CB  . ILE B 2 51  ? 20.484 32.003  -27.060 1.000 28.904  0 51  ILE FFF CB  1 ? 
ATOM   1937 C CG1 . ILE B 2 51  ? 20.122 30.877  -28.031 1.000 29.283  0 51  ILE FFF CG1 1 ? 
ATOM   1938 C CG2 . ILE B 2 51  ? 21.995 32.230  -26.968 1.000 29.221  0 51  ILE FFF CG2 1 ? 
ATOM   1939 C CD1 . ILE B 2 51  ? 20.395 31.216  -29.497 1.000 28.423  0 51  ILE FFF CD1 1 ? 
ATOM   1940 N N   . ARG B 2 52  ? 19.688 29.458  -24.913 1.000 26.589  0 52  ARG FFF N   1 ? 
ATOM   1941 C CA  . ARG B 2 52  ? 20.210 28.184  -24.372 1.000 26.758  0 52  ARG FFF CA  1 ? 
ATOM   1942 C C   . ARG B 2 52  ? 21.161 27.577  -25.404 1.000 27.569  0 52  ARG FFF C   1 ? 
ATOM   1943 O O   . ARG B 2 52  ? 20.791 27.476  -26.588 1.000 29.392  0 52  ARG FFF O   1 ? 
ATOM   1944 C CB  . ARG B 2 52  ? 19.117 27.180  -24.027 1.000 28.972  0 52  ARG FFF CB  1 ? 
ATOM   1945 C CG  . ARG B 2 52  ? 19.663 26.050  -23.166 1.000 28.766  0 52  ARG FFF CG  1 ? 
ATOM   1946 C CD  . ARG B 2 52  ? 18.626 25.025  -22.816 1.000 27.974  0 52  ARG FFF CD  1 ? 
ATOM   1947 N NE  . ARG B 2 52  ? 17.516 25.587  -22.067 1.000 28.347  0 52  ARG FFF NE  1 ? 
ATOM   1948 C CZ  . ARG B 2 52  ? 17.491 25.776  -20.751 1.000 29.083  0 52  ARG FFF CZ  1 ? 
ATOM   1949 N NH1 . ARG B 2 52  ? 18.542 25.471  -20.005 1.000 29.098  0 52  ARG FFF NH1 1 ? 
ATOM   1950 N NH2 . ARG B 2 52  ? 16.400 26.270  -20.186 1.000 27.770  0 52  ARG FFF NH2 1 ? 
ATOM   1951 N N   . TRP B 2 53  ? 22.352 27.193  -24.965 1.000 27.506  0 53  TRP FFF N   1 ? 
ATOM   1952 C CA  . TRP B 2 53  ? 23.384 26.628  -25.864 1.000 29.900  0 53  TRP FFF CA  1 ? 
ATOM   1953 C C   . TRP B 2 53  ? 22.838 25.363  -26.534 1.000 30.623  0 53  TRP FFF C   1 ? 
ATOM   1954 O O   . TRP B 2 53  ? 22.912 25.255  -27.779 1.000 32.291  0 53  TRP FFF O   1 ? 
ATOM   1955 C CB  . TRP B 2 53  ? 24.676 26.367  -25.092 1.000 31.388  0 53  TRP FFF CB  1 ? 
ATOM   1956 C CG  . TRP B 2 53  ? 25.883 26.535  -25.956 1.000 31.043  0 53  TRP FFF CG  1 ? 
ATOM   1957 C CD1 . TRP B 2 53  ? 26.796 25.583  -26.297 1.000 33.009  0 53  TRP FFF CD1 1 ? 
ATOM   1958 C CD2 . TRP B 2 53  ? 26.303 27.749  -26.596 1.000 32.477  0 53  TRP FFF CD2 1 ? 
ATOM   1959 N NE1 . TRP B 2 53  ? 27.758 26.122  -27.104 1.000 34.965  0 53  TRP FFF NE1 1 ? 
ATOM   1960 C CE2 . TRP B 2 53  ? 27.488 27.449  -27.296 1.000 32.469  0 53  TRP FFF CE2 1 ? 
ATOM   1961 C CE3 . TRP B 2 53  ? 25.801 29.054  -26.631 1.000 32.259  0 53  TRP FFF CE3 1 ? 
ATOM   1962 C CZ2 . TRP B 2 53  ? 28.168 28.409  -28.039 1.000 35.856  0 53  TRP FFF CZ2 1 ? 
ATOM   1963 C CZ3 . TRP B 2 53  ? 26.483 30.003  -27.358 1.000 33.023  0 53  TRP FFF CZ3 1 ? 
ATOM   1964 C CH2 . TRP B 2 53  ? 27.651 29.682  -28.043 1.000 33.509  0 53  TRP FFF CH2 1 ? 
ATOM   1965 N N   . SER B 2 54  ? 22.294 24.452  -25.736 1.000 29.711  0 54  SER FFF N   1 ? 
ATOM   1966 C CA  . SER B 2 54  ? 21.584 23.234  -26.192 1.000 30.930  0 54  SER FFF CA  1 ? 
ATOM   1967 C C   . SER B 2 54  ? 20.192 23.629  -26.707 1.000 31.003  0 54  SER FFF C   1 ? 
ATOM   1968 O O   . SER B 2 54  ? 19.388 24.177  -25.923 1.000 32.005  0 54  SER FFF O   1 ? 
ATOM   1969 C CB  . SER B 2 54  ? 21.513 22.225  -25.067 1.000 33.219  0 54  SER FFF CB  1 ? 
ATOM   1970 O OG  . SER B 2 54  ? 20.858 21.053  -25.494 1.000 38.334  0 54  SER FFF OG  1 ? 
ATOM   1971 N N   . GLY B 2 55  ? 19.916 23.397  -27.990 1.000 32.481  0 55  GLY FFF N   1 ? 
ATOM   1972 C CA  . GLY B 2 55  ? 18.569 23.572  -28.566 1.000 33.442  0 55  GLY FFF CA  1 ? 
ATOM   1973 C C   . GLY B 2 55  ? 18.326 24.972  -29.110 1.000 32.025  0 55  GLY FFF C   1 ? 
ATOM   1974 O O   . GLY B 2 55  ? 17.529 25.092  -30.037 1.000 32.664  0 55  GLY FFF O   1 ? 
ATOM   1975 N N   . GLY B 2 56  ? 18.928 26.010  -28.529 1.000 30.666  0 56  GLY FFF N   1 ? 
ATOM   1976 C CA  . GLY B 2 56  ? 18.908 27.377  -29.089 1.000 30.077  0 56  GLY FFF CA  1 ? 
ATOM   1977 C C   . GLY B 2 56  ? 17.623 28.153  -28.821 1.000 29.517  0 56  GLY FFF C   1 ? 
ATOM   1978 O O   . GLY B 2 56  ? 17.437 29.207  -29.485 1.000 28.785  0 56  GLY FFF O   1 ? 
ATOM   1979 N N   . SER B 2 57  ? 16.764 27.721  -27.885 1.000 29.521  0 57  SER FFF N   1 ? 
ATOM   1980 C CA  . SER B 2 57  ? 15.576 28.525  -27.480 1.000 31.130  0 57  SER FFF CA  1 ? 
ATOM   1981 C C   . SER B 2 57  ? 16.057 29.874  -26.928 1.000 29.364  0 57  SER FFF C   1 ? 
ATOM   1982 O O   . SER B 2 57  ? 17.105 29.914  -26.230 1.000 29.814  0 57  SER FFF O   1 ? 
ATOM   1983 C CB  . SER B 2 57  ? 14.671 27.825  -26.498 1.000 32.772  0 57  SER FFF CB  1 ? 
ATOM   1984 O OG  . SER B 2 57  ? 13.887 26.828  -27.139 1.000 34.358  0 57  SER FFF OG  1 ? 
ATOM   1985 N N   . ALA B 2 58  ? 15.331 30.942  -27.258 1.000 30.435  0 58  ALA FFF N   1 ? 
ATOM   1986 C CA  . ALA B 2 58  ? 15.714 32.338  -26.970 1.000 30.843  0 58  ALA FFF CA  1 ? 
ATOM   1987 C C   . ALA B 2 58  ? 14.662 32.982  -26.071 1.000 30.200  0 58  ALA FFF C   1 ? 
ATOM   1988 O O   . ALA B 2 58  ? 13.457 32.639  -26.182 1.000 31.228  0 58  ALA FFF O   1 ? 
ATOM   1989 C CB  . ALA B 2 58  ? 15.876 33.116  -28.249 1.000 32.300  0 58  ALA FFF CB  1 ? 
ATOM   1990 N N   . TYR B 2 59  ? 15.118 33.905  -25.228 1.000 30.706  0 59  TYR FFF N   1 ? 
ATOM   1991 C CA  . TYR B 2 59  ? 14.270 34.699  -24.308 1.000 31.528  0 59  TYR FFF CA  1 ? 
ATOM   1992 C C   . TYR B 2 59  ? 14.665 36.171  -24.444 1.000 31.650  0 59  TYR FFF C   1 ? 
ATOM   1993 O O   . TYR B 2 59  ? 15.863 36.472  -24.413 1.000 32.208  0 59  TYR FFF O   1 ? 
ATOM   1994 C CB  . TYR B 2 59  ? 14.429 34.187  -22.878 1.000 31.937  0 59  TYR FFF CB  1 ? 
ATOM   1995 C CG  . TYR B 2 59  ? 13.351 34.680  -21.955 1.000 32.874  0 59  TYR FFF CG  1 ? 
ATOM   1996 C CD1 . TYR B 2 59  ? 12.126 34.039  -21.896 1.000 34.669  0 59  TYR FFF CD1 1 ? 
ATOM   1997 C CD2 . TYR B 2 59  ? 13.539 35.802  -21.163 1.000 35.241  0 59  TYR FFF CD2 1 ? 
ATOM   1998 C CE1 . TYR B 2 59  ? 11.112 34.493  -21.070 1.000 37.598  0 59  TYR FFF CE1 1 ? 
ATOM   1999 C CE2 . TYR B 2 59  ? 12.537 36.263  -20.323 1.000 38.406  0 59  TYR FFF CE2 1 ? 
ATOM   2000 C CZ  . TYR B 2 59  ? 11.318 35.609  -20.279 1.000 38.325  0 59  TYR FFF CZ  1 ? 
ATOM   2001 O OH  . TYR B 2 59  ? 10.323 36.052  -19.452 1.000 41.327  0 59  TYR FFF OH  1 ? 
ATOM   2002 N N   . TYR B 2 60  ? 13.674 37.053  -24.586 1.000 32.800  0 60  TYR FFF N   1 ? 
ATOM   2003 C CA  . TYR B 2 60  ? 13.859 38.480  -24.939 1.000 33.958  0 60  TYR FFF CA  1 ? 
ATOM   2004 C C   . TYR B 2 60  ? 13.217 39.390  -23.893 1.000 35.574  0 60  TYR FFF C   1 ? 
ATOM   2005 O O   . TYR B 2 60  ? 12.101 39.093  -23.401 1.000 36.496  0 60  TYR FFF O   1 ? 
ATOM   2006 C CB  . TYR B 2 60  ? 13.242 38.768  -26.308 1.000 34.244  0 60  TYR FFF CB  1 ? 
ATOM   2007 C CG  . TYR B 2 60  ? 13.918 38.054  -27.449 1.000 33.222  0 60  TYR FFF CG  1 ? 
ATOM   2008 C CD1 . TYR B 2 60  ? 15.060 38.579  -28.034 1.000 32.524  0 60  TYR FFF CD1 1 ? 
ATOM   2009 C CD2 . TYR B 2 60  ? 13.423 36.859  -27.947 1.000 34.168  0 60  TYR FFF CD2 1 ? 
ATOM   2010 C CE1 . TYR B 2 60  ? 15.696 37.937  -29.086 1.000 32.104  0 60  TYR FFF CE1 1 ? 
ATOM   2011 C CE2 . TYR B 2 60  ? 14.051 36.201  -28.992 1.000 34.942  0 60  TYR FFF CE2 1 ? 
ATOM   2012 C CZ  . TYR B 2 60  ? 15.190 36.743  -29.566 1.000 34.015  0 60  TYR FFF CZ  1 ? 
ATOM   2013 O OH  . TYR B 2 60  ? 15.823 36.100  -30.593 1.000 33.144  0 60  TYR FFF OH  1 ? 
ATOM   2014 N N   . ALA B 2 61  ? 13.888 40.503  -23.601 1.000 37.040  0 61  ALA FFF N   1 ? 
ATOM   2015 C CA  . ALA B 2 61  ? 13.281 41.661  -22.907 1.000 39.838  0 61  ALA FFF CA  1 ? 
ATOM   2016 C C   . ALA B 2 61  ? 12.141 42.180  -23.790 1.000 39.363  0 61  ALA FFF C   1 ? 
ATOM   2017 O O   . ALA B 2 61  ? 12.286 42.141  -25.027 1.000 38.168  0 61  ALA FFF O   1 ? 
ATOM   2018 C CB  . ALA B 2 61  ? 14.308 42.733  -22.636 1.000 40.123  0 61  ALA FFF CB  1 ? 
ATOM   2019 N N   . ASP B 2 62  ? 11.052 42.635  -23.174 1.000 42.837  0 62  ASP FFF N   1 ? 
ATOM   2020 C CA  . ASP B 2 62  ? 9.863  43.186  -23.880 1.000 47.023  0 62  ASP FFF CA  1 ? 
ATOM   2021 C C   . ASP B 2 62  ? 10.292 44.319  -24.824 1.000 45.528  0 62  ASP FFF C   1 ? 
ATOM   2022 O O   . ASP B 2 62  ? 9.719  44.403  -25.927 1.000 48.531  0 62  ASP FFF O   1 ? 
ATOM   2023 C CB  . ASP B 2 62  ? 8.800  43.656  -22.885 1.000 51.494  0 62  ASP FFF CB  1 ? 
ATOM   2024 C CG  . ASP B 2 62  ? 8.077  42.527  -22.169 1.000 56.107  0 62  ASP FFF CG  1 ? 
ATOM   2025 O OD1 . ASP B 2 62  ? 8.276  41.354  -22.548 1.000 60.848  0 62  ASP FFF OD1 1 ? 
ATOM   2026 O OD2 . ASP B 2 62  ? 7.315  42.830  -21.239 1.000 62.488  0 62  ASP FFF OD2 1 ? 
ATOM   2027 N N   . SER B 2 63  ? 11.280 45.132  -24.430 1.000 45.415  0 63  SER FFF N   1 ? 
ATOM   2028 C CA  . SER B 2 63  ? 11.728 46.343  -25.174 1.000 47.083  0 63  SER FFF CA  1 ? 
ATOM   2029 C C   . SER B 2 63  ? 12.328 45.994  -26.547 1.000 44.920  0 63  SER FFF C   1 ? 
ATOM   2030 O O   . SER B 2 63  ? 12.424 46.916  -27.380 1.000 48.517  0 63  SER FFF O   1 ? 
ATOM   2031 C CB  . SER B 2 63  ? 12.713 47.145  -24.364 1.000 50.712  0 63  SER FFF CB  1 ? 
ATOM   2032 O OG  . SER B 2 63  ? 13.848 46.361  -24.029 1.000 54.337  0 63  SER FFF OG  1 ? 
ATOM   2033 N N   . VAL B 2 64  ? 12.750 44.747  -26.791 1.000 42.305  0 64  VAL FFF N   1 ? 
ATOM   2034 C CA  . VAL B 2 64  ? 13.459 44.396  -28.061 1.000 40.516  0 64  VAL FFF CA  1 ? 
ATOM   2035 C C   . VAL B 2 64  ? 12.712 43.310  -28.849 1.000 42.096  0 64  VAL FFF C   1 ? 
ATOM   2036 O O   . VAL B 2 64  ? 13.190 42.977  -29.949 1.000 42.401  0 64  VAL FFF O   1 ? 
ATOM   2037 C CB  . VAL B 2 64  ? 14.923 43.997  -27.807 1.000 38.966  0 64  VAL FFF CB  1 ? 
ATOM   2038 C CG1 . VAL B 2 64  ? 15.691 45.102  -27.100 1.000 39.651  0 64  VAL FFF CG1 1 ? 
ATOM   2039 C CG2 . VAL B 2 64  ? 15.052 42.682  -27.054 1.000 38.824  0 64  VAL FFF CG2 1 ? 
ATOM   2040 N N   . LYS B 2 65  ? 11.595 42.781  -28.343 1.000 45.103  0 65  LYS FFF N   1 ? 
ATOM   2041 C CA  . LYS B 2 65  ? 10.804 41.733  -29.050 1.000 51.609  0 65  LYS FFF CA  1 ? 
ATOM   2042 C C   . LYS B 2 65  ? 10.375 42.251  -30.428 1.000 52.379  0 65  LYS FFF C   1 ? 
ATOM   2043 O O   . LYS B 2 65  ? 9.914  43.401  -30.505 1.000 54.897  0 65  LYS FFF O   1 ? 
ATOM   2044 C CB  . LYS B 2 65  ? 9.570  41.327  -28.241 1.000 55.371  0 65  LYS FFF CB  1 ? 
ATOM   2045 C CG  . LYS B 2 65  ? 9.836  40.320  -27.135 1.000 57.420  0 65  LYS FFF CG  1 ? 
ATOM   2046 C CD  . LYS B 2 65  ? 8.586  39.898  -26.398 1.000 61.021  0 65  LYS FFF CD  1 ? 
ATOM   2047 C CE  . LYS B 2 65  ? 8.850  38.783  -25.413 1.000 62.444  0 65  LYS FFF CE  1 ? 
ATOM   2048 N NZ  . LYS B 2 65  ? 7.640  38.472  -24.621 1.000 65.908  0 65  LYS FFF NZ  1 ? 
ATOM   2049 N N   . GLY B 2 66  ? 10.540 41.427  -31.467 1.000 51.232  0 66  GLY FFF N   1 ? 
ATOM   2050 C CA  . GLY B 2 66  ? 10.185 41.754  -32.861 1.000 51.216  0 66  GLY FFF CA  1 ? 
ATOM   2051 C C   . GLY B 2 66  ? 11.245 42.593  -33.555 1.000 49.605  0 66  GLY FFF C   1 ? 
ATOM   2052 O O   . GLY B 2 66  ? 11.094 42.841  -34.769 1.000 54.877  0 66  GLY FFF O   1 ? 
ATOM   2053 N N   . ARG B 2 67  ? 12.283 43.030  -32.835 1.000 45.045  0 67  ARG FFF N   1 ? 
ATOM   2054 C CA  . ARG B 2 67  ? 13.345 43.909  -33.393 1.000 44.015  0 67  ARG FFF CA  1 ? 
ATOM   2055 C C   . ARG B 2 67  ? 14.700 43.200  -33.330 1.000 40.060  0 67  ARG FFF C   1 ? 
ATOM   2056 O O   . ARG B 2 67  ? 15.452 43.283  -34.310 1.000 43.184  0 67  ARG FFF O   1 ? 
ATOM   2057 C CB  . ARG B 2 67  ? 13.375 45.249  -32.655 1.000 44.033  0 67  ARG FFF CB  1 ? 
ATOM   2058 C CG  . ARG B 2 67  ? 12.109 46.073  -32.826 1.000 45.731  0 67  ARG FFF CG  1 ? 
ATOM   2059 C CD  . ARG B 2 67  ? 12.302 47.514  -32.389 1.000 45.869  0 67  ARG FFF CD  1 ? 
ATOM   2060 N NE  . ARG B 2 67  ? 12.802 47.616  -31.025 1.000 42.123  0 67  ARG FFF NE  1 ? 
ATOM   2061 C CZ  . ARG B 2 67  ? 14.001 48.074  -30.665 1.000 43.580  0 67  ARG FFF CZ  1 ? 
ATOM   2062 N NH1 . ARG B 2 67  ? 14.867 48.501  -31.572 1.000 42.905  0 67  ARG FFF NH1 1 ? 
ATOM   2063 N NH2 . ARG B 2 67  ? 14.332 48.106  -29.383 1.000 42.019  0 67  ARG FFF NH2 1 ? 
ATOM   2064 N N   . PHE B 2 68  ? 15.024 42.557  -32.210 1.000 38.064  0 68  PHE FFF N   1 ? 
ATOM   2065 C CA  . PHE B 2 68  ? 16.348 41.925  -32.005 1.000 34.878  0 68  PHE FFF CA  1 ? 
ATOM   2066 C C   . PHE B 2 68  ? 16.187 40.413  -32.124 1.000 35.127  0 68  PHE FFF C   1 ? 
ATOM   2067 O O   . PHE B 2 68  ? 15.139 39.872  -31.724 1.000 36.602  0 68  PHE FFF O   1 ? 
ATOM   2068 C CB  . PHE B 2 68  ? 16.949 42.297  -30.647 1.000 35.970  0 68  PHE FFF CB  1 ? 
ATOM   2069 C CG  . PHE B 2 68  ? 17.424 43.719  -30.485 1.000 36.274  0 68  PHE FFF CG  1 ? 
ATOM   2070 C CD1 . PHE B 2 68  ? 17.075 44.718  -31.387 1.000 35.418  0 68  PHE FFF CD1 1 ? 
ATOM   2071 C CD2 . PHE B 2 68  ? 18.178 44.070  -29.373 1.000 36.043  0 68  PHE FFF CD2 1 ? 
ATOM   2072 C CE1 . PHE B 2 68  ? 17.508 46.021  -31.203 1.000 35.411  0 68  PHE FFF CE1 1 ? 
ATOM   2073 C CE2 . PHE B 2 68  ? 18.601 45.377  -29.189 1.000 36.819  0 68  PHE FFF CE2 1 ? 
ATOM   2074 C CZ  . PHE B 2 68  ? 18.263 46.349  -30.103 1.000 36.980  0 68  PHE FFF CZ  1 ? 
ATOM   2075 N N   . THR B 2 69  ? 17.210 39.754  -32.659 1.000 33.777  0 69  THR FFF N   1 ? 
ATOM   2076 C CA  . THR B 2 69  ? 17.303 38.277  -32.707 1.000 32.924  0 69  THR FFF CA  1 ? 
ATOM   2077 C C   . THR B 2 69  ? 18.641 37.851  -32.118 1.000 31.473  0 69  THR FFF C   1 ? 
ATOM   2078 O O   . THR B 2 69  ? 19.683 38.353  -32.577 1.000 31.818  0 69  THR FFF O   1 ? 
ATOM   2079 C CB  . THR B 2 69  ? 17.166 37.726  -34.129 1.000 36.617  0 69  THR FFF CB  1 ? 
ATOM   2080 O OG1 . THR B 2 69  ? 15.934 38.218  -34.654 1.000 38.671  0 69  THR FFF OG1 1 ? 
ATOM   2081 C CG2 . THR B 2 69  ? 17.190 36.212  -34.157 1.000 37.051  0 69  THR FFF CG2 1 ? 
ATOM   2082 N N   . ILE B 2 70  ? 18.599 36.955  -31.136 1.000 29.856  0 70  ILE FFF N   1 ? 
ATOM   2083 C CA  . ILE B 2 70  ? 19.817 36.304  -30.600 1.000 30.318  0 70  ILE FFF CA  1 ? 
ATOM   2084 C C   . ILE B 2 70  ? 19.941 34.949  -31.296 1.000 30.472  0 70  ILE FFF C   1 ? 
ATOM   2085 O O   . ILE B 2 70  ? 18.914 34.298  -31.525 1.000 33.033  0 70  ILE FFF O   1 ? 
ATOM   2086 C CB  . ILE B 2 70  ? 19.780 36.208  -29.060 1.000 29.795  0 70  ILE FFF CB  1 ? 
ATOM   2087 C CG1 . ILE B 2 70  ? 21.137 35.777  -28.499 1.000 30.881  0 70  ILE FFF CG1 1 ? 
ATOM   2088 C CG2 . ILE B 2 70  ? 18.643 35.316  -28.573 1.000 31.048  0 70  ILE FFF CG2 1 ? 
ATOM   2089 C CD1 . ILE B 2 70  ? 21.225 35.854  -26.986 1.000 30.107  0 70  ILE FFF CD1 1 ? 
ATOM   2090 N N   . SER B 2 71  ? 21.165 34.570  -31.636 1.000 31.658  0 71  SER FFF N   1 ? 
ATOM   2091 C CA  . SER B 2 71  ? 21.495 33.289  -32.295 1.000 31.063  0 71  SER FFF CA  1 ? 
ATOM   2092 C C   . SER B 2 71  ? 22.883 32.860  -31.826 1.000 30.834  0 71  SER FFF C   1 ? 
ATOM   2093 O O   . SER B 2 71  ? 23.627 33.697  -31.274 1.000 29.927  0 71  SER FFF O   1 ? 
ATOM   2094 C CB  . SER B 2 71  ? 21.422 33.429  -33.799 1.000 31.647  0 71  SER FFF CB  1 ? 
ATOM   2095 O OG  . SER B 2 71  ? 22.420 34.320  -34.257 1.000 31.022  0 71  SER FFF OG  1 ? 
ATOM   2096 N N   . ARG B 2 72  ? 23.236 31.604  -32.032 1.000 29.705  0 72  ARG FFF N   1 ? 
ATOM   2097 C CA  . ARG B 2 72  ? 24.576 31.131  -31.624 1.000 30.279  0 72  ARG FFF CA  1 ? 
ATOM   2098 C C   . ARG B 2 72  ? 25.063 30.082  -32.611 1.000 29.778  0 72  ARG FFF C   1 ? 
ATOM   2099 O O   . ARG B 2 72  ? 24.234 29.330  -33.166 1.000 29.603  0 72  ARG FFF O   1 ? 
ATOM   2100 C CB  . ARG B 2 72  ? 24.563 30.617  -30.183 1.000 29.545  0 72  ARG FFF CB  1 ? 
ATOM   2101 C CG  . ARG B 2 72  ? 23.618 29.450  -29.942 1.000 30.953  0 72  ARG FFF CG  1 ? 
ATOM   2102 C CD  . ARG B 2 72  ? 24.327 28.122  -30.072 1.000 30.939  0 72  ARG FFF CD  1 ? 
ATOM   2103 N NE  . ARG B 2 72  ? 23.413 27.013  -29.856 1.000 32.854  0 72  ARG FFF NE  1 ? 
ATOM   2104 C CZ  . ARG B 2 72  ? 22.547 26.551  -30.753 1.000 33.280  0 72  ARG FFF CZ  1 ? 
ATOM   2105 N NH1 . ARG B 2 72  ? 22.467 27.096  -31.961 1.000 34.768  0 72  ARG FFF NH1 1 ? 
ATOM   2106 N NH2 . ARG B 2 72  ? 21.777 25.524  -30.442 1.000 32.445  0 72  ARG FFF NH2 1 ? 
ATOM   2107 N N   . ASP B 2 73  ? 26.378 30.080  -32.800 1.000 32.514  0 73  ASP FFF N   1 ? 
ATOM   2108 C CA  . ASP B 2 73  ? 27.123 29.080  -33.593 1.000 33.983  0 73  ASP FFF CA  1 ? 
ATOM   2109 C C   . ASP B 2 73  ? 27.972 28.269  -32.609 1.000 33.572  0 73  ASP FFF C   1 ? 
ATOM   2110 O O   . ASP B 2 73  ? 28.983 28.810  -32.105 1.000 34.761  0 73  ASP FFF O   1 ? 
ATOM   2111 C CB  . ASP B 2 73  ? 27.930 29.795  -34.677 1.000 36.591  0 73  ASP FFF CB  1 ? 
ATOM   2112 C CG  . ASP B 2 73  ? 28.632 28.845  -35.615 1.000 40.262  0 73  ASP FFF CG  1 ? 
ATOM   2113 O OD1 . ASP B 2 73  ? 28.932 27.716  -35.192 1.000 43.236  0 73  ASP FFF OD1 1 ? 
ATOM   2114 O OD2 . ASP B 2 73  ? 28.863 29.248  -36.758 1.000 48.273  0 73  ASP FFF OD2 1 ? 
ATOM   2115 N N   . LYS B 2 74  ? 27.553 27.041  -32.306 1.000 34.621  0 74  LYS FFF N   1 ? 
ATOM   2116 C CA  . LYS B 2 74  ? 28.239 26.184  -31.299 1.000 37.674  0 74  LYS FFF CA  1 ? 
ATOM   2117 C C   . LYS B 2 74  ? 29.673 25.907  -31.764 1.000 39.445  0 74  LYS FFF C   1 ? 
ATOM   2118 O O   . LYS B 2 74  ? 30.587 26.054  -30.940 1.000 40.475  0 74  LYS FFF O   1 ? 
ATOM   2119 C CB  . LYS B 2 74  ? 27.464 24.885  -31.058 1.000 41.318  0 74  LYS FFF CB  1 ? 
ATOM   2120 C CG  . LYS B 2 74  ? 26.065 25.065  -30.486 1.000 44.793  0 74  LYS FFF CG  1 ? 
ATOM   2121 C CD  . LYS B 2 74  ? 25.232 23.796  -30.499 1.000 50.220  0 74  LYS FFF CD  1 ? 
ATOM   2122 C CE  . LYS B 2 74  ? 25.465 22.910  -29.300 1.000 49.839  0 74  LYS FFF CE  1 ? 
ATOM   2123 N NZ  . LYS B 2 74  ? 24.706 21.642  -29.422 1.000 49.617  0 74  LYS FFF NZ  1 ? 
ATOM   2124 N N   . ALA B 2 75  ? 29.876 25.546  -33.035 1.000 42.302  0 75  ALA FFF N   1 ? 
ATOM   2125 C CA  . ALA B 2 75  ? 31.206 25.195  -33.592 1.000 43.605  0 75  ALA FFF CA  1 ? 
ATOM   2126 C C   . ALA B 2 75  ? 32.173 26.381  -33.448 1.000 41.433  0 75  ALA FFF C   1 ? 
ATOM   2127 O O   . ALA B 2 75  ? 33.360 26.134  -33.232 1.000 42.417  0 75  ALA FFF O   1 ? 
ATOM   2128 C CB  . ALA B 2 75  ? 31.086 24.745  -35.030 1.000 45.703  0 75  ALA FFF CB  1 ? 
ATOM   2129 N N   . LYS B 2 76  ? 31.687 27.622  -33.549 1.000 40.929  0 76  LYS FFF N   1 ? 
ATOM   2130 C CA  . LYS B 2 76  ? 32.522 28.849  -33.424 1.000 40.582  0 76  LYS FFF CA  1 ? 
ATOM   2131 C C   . LYS B 2 76  ? 32.493 29.387  -31.988 1.000 37.192  0 76  LYS FFF C   1 ? 
ATOM   2132 O O   . LYS B 2 76  ? 33.162 30.405  -31.734 1.000 39.482  0 76  LYS FFF O   1 ? 
ATOM   2133 C CB  . LYS B 2 76  ? 32.022 29.940  -34.374 1.000 45.485  0 76  LYS FFF CB  1 ? 
ATOM   2134 C CG  . LYS B 2 76  ? 32.347 29.732  -35.845 1.000 49.494  0 76  LYS FFF CG  1 ? 
ATOM   2135 C CD  . LYS B 2 76  ? 32.014 30.947  -36.677 1.000 52.595  0 76  LYS FFF CD  1 ? 
ATOM   2136 C CE  . LYS B 2 76  ? 32.287 30.750  -38.149 1.000 56.044  0 76  LYS FFF CE  1 ? 
ATOM   2137 N NZ  . LYS B 2 76  ? 33.742 30.738  -38.429 1.000 59.989  0 76  LYS FFF NZ  1 ? 
ATOM   2138 N N   . ASN B 2 77  ? 31.742 28.745  -31.088 1.000 36.653  0 77  ASN FFF N   1 ? 
ATOM   2139 C CA  . ASN B 2 77  ? 31.567 29.197  -29.684 1.000 36.341  0 77  ASN FFF CA  1 ? 
ATOM   2140 C C   . ASN B 2 77  ? 31.292 30.703  -29.685 1.000 35.139  0 77  ASN FFF C   1 ? 
ATOM   2141 O O   . ASN B 2 77  ? 31.941 31.439  -28.920 1.000 36.172  0 77  ASN FFF O   1 ? 
ATOM   2142 C CB  . ASN B 2 77  ? 32.768 28.796  -28.827 1.000 42.306  0 77  ASN FFF CB  1 ? 
ATOM   2143 C CG  . ASN B 2 77  ? 32.737 27.322  -28.486 1.000 48.317  0 77  ASN FFF CG  1 ? 
ATOM   2144 O OD1 . ASN B 2 77  ? 31.861 26.872  -27.748 1.000 57.476  0 77  ASN FFF OD1 1 ? 
ATOM   2145 N ND2 . ASN B 2 77  ? 33.668 26.561  -29.036 1.000 54.842  0 77  ASN FFF ND2 1 ? 
ATOM   2146 N N   . THR B 2 78  ? 30.364 31.143  -30.534 1.000 32.078  0 78  THR FFF N   1 ? 
ATOM   2147 C CA  . THR B 2 78  ? 30.017 32.572  -30.708 1.000 32.979  0 78  THR FFF CA  1 ? 
ATOM   2148 C C   . THR B 2 78  ? 28.504 32.769  -30.593 1.000 31.390  0 78  THR FFF C   1 ? 
ATOM   2149 O O   . THR B 2 78  ? 27.734 31.943  -31.113 1.000 30.650  0 78  THR FFF O   1 ? 
ATOM   2150 C CB  . THR B 2 78  ? 30.589 33.107  -32.023 1.000 35.493  0 78  THR FFF CB  1 ? 
ATOM   2151 O OG1 . THR B 2 78  ? 32.000 32.890  -31.944 1.000 37.692  0 78  THR FFF OG1 1 ? 
ATOM   2152 C CG2 . THR B 2 78  ? 30.283 34.571  -32.247 1.000 36.349  0 78  THR FFF CG2 1 ? 
ATOM   2153 N N   . VAL B 2 79  ? 28.113 33.837  -29.904 1.000 30.908  0 79  VAL FFF N   1 ? 
ATOM   2154 C CA  . VAL B 2 79  ? 26.703 34.297  -29.809 1.000 30.245  0 79  VAL FFF CA  1 ? 
ATOM   2155 C C   . VAL B 2 79  ? 26.624 35.633  -30.553 1.000 29.129  0 79  VAL FFF C   1 ? 
ATOM   2156 O O   . VAL B 2 79  ? 27.607 36.401  -30.546 1.000 31.310  0 79  VAL FFF O   1 ? 
ATOM   2157 C CB  . VAL B 2 79  ? 26.214 34.372  -28.345 1.000 30.428  0 79  VAL FFF CB  1 ? 
ATOM   2158 C CG1 . VAL B 2 79  ? 26.987 35.388  -27.533 1.000 31.495  0 79  VAL FFF CG1 1 ? 
ATOM   2159 C CG2 . VAL B 2 79  ? 24.718 34.638  -28.252 1.000 29.375  0 79  VAL FFF CG2 1 ? 
ATOM   2160 N N   . TYR B 2 80  ? 25.486 35.875  -31.191 1.000 29.715  0 80  TYR FFF N   1 ? 
ATOM   2161 C CA  . TYR B 2 80  ? 25.220 37.067  -32.024 1.000 29.675  0 80  TYR FFF CA  1 ? 
ATOM   2162 C C   . TYR B 2 80  ? 23.958 37.767  -31.531 1.000 30.418  0 80  TYR FFF C   1 ? 
ATOM   2163 O O   . TYR B 2 80  ? 23.025 37.097  -31.065 1.000 30.831  0 80  TYR FFF O   1 ? 
ATOM   2164 C CB  . TYR B 2 80  ? 25.030 36.651  -33.480 1.000 30.611  0 80  TYR FFF CB  1 ? 
ATOM   2165 C CG  . TYR B 2 80  ? 26.208 35.921  -34.066 1.000 32.799  0 80  TYR FFF CG  1 ? 
ATOM   2166 C CD1 . TYR B 2 80  ? 27.372 36.595  -34.408 1.000 35.500  0 80  TYR FFF CD1 1 ? 
ATOM   2167 C CD2 . TYR B 2 80  ? 26.174 34.551  -34.256 1.000 36.757  0 80  TYR FFF CD2 1 ? 
ATOM   2168 C CE1 . TYR B 2 80  ? 28.461 35.928  -34.953 1.000 36.423  0 80  TYR FFF CE1 1 ? 
ATOM   2169 C CE2 . TYR B 2 80  ? 27.254 33.871  -34.798 1.000 39.318  0 80  TYR FFF CE2 1 ? 
ATOM   2170 C CZ  . TYR B 2 80  ? 28.402 34.560  -35.146 1.000 38.779  0 80  TYR FFF CZ  1 ? 
ATOM   2171 O OH  . TYR B 2 80  ? 29.461 33.875  -35.672 1.000 40.348  0 80  TYR FFF OH  1 ? 
ATOM   2172 N N   . LEU B 2 81  ? 23.924 39.085  -31.683 1.000 30.872  0 81  LEU FFF N   1 ? 
ATOM   2173 C CA  . LEU B 2 81  ? 22.688 39.875  -31.515 1.000 30.561  0 81  LEU FFF CA  1 ? 
ATOM   2174 C C   . LEU B 2 81  ? 22.467 40.674  -32.800 1.000 30.542  0 81  LEU FFF C   1 ? 
ATOM   2175 O O   . LEU B 2 81  ? 23.281 41.561  -33.100 1.000 30.085  0 81  LEU FFF O   1 ? 
ATOM   2176 C CB  . LEU B 2 81  ? 22.817 40.775  -30.287 1.000 32.955  0 81  LEU FFF CB  1 ? 
ATOM   2177 C CG  . LEU B 2 81  ? 21.522 41.452  -29.855 1.000 31.949  0 81  LEU FFF CG  1 ? 
ATOM   2178 C CD1 . LEU B 2 81  ? 20.537 40.433  -29.305 1.000 32.086  0 81  LEU FFF CD1 1 ? 
ATOM   2179 C CD2 . LEU B 2 81  ? 21.813 42.544  -28.846 1.000 34.218  0 81  LEU FFF CD2 1 ? 
ATOM   2180 N N   . GLN B 2 82  ? 21.437 40.300  -33.553 1.000 31.718  0 82  GLN FFF N   1 ? 
ATOM   2181 C CA  . GLN B 2 82  ? 20.985 41.043  -34.751 1.000 32.889  0 82  GLN FFF CA  1 ? 
ATOM   2182 C C   . GLN B 2 82  ? 20.040 42.141  -34.265 1.000 34.877  0 82  GLN FFF C   1 ? 
ATOM   2183 O O   . GLN B 2 82  ? 18.936 41.812  -33.776 1.000 36.587  0 82  GLN FFF O   1 ? 
ATOM   2184 C CB  . GLN B 2 82  ? 20.314 40.106  -35.754 1.000 32.405  0 82  GLN FFF CB  1 ? 
ATOM   2185 C CG  . GLN B 2 82  ? 20.017 40.778  -37.086 1.000 33.546  0 82  GLN FFF CG  1 ? 
ATOM   2186 C CD  . GLN B 2 82  ? 21.281 41.207  -37.796 1.000 34.079  0 82  GLN FFF CD  1 ? 
ATOM   2187 O OE1 . GLN B 2 82  ? 22.272 40.484  -37.828 1.000 39.126  0 82  GLN FFF OE1 1 ? 
ATOM   2188 N NE2 . GLN B 2 82  ? 21.253 42.392  -38.380 1.000 36.972  0 82  GLN FFF NE2 1 ? 
ATOM   2189 N N   . MET B 2 83  ? 20.483 43.392  -34.355 1.000 34.643  0 83  MET FFF N   1 ? 
ATOM   2190 C CA  . MET B 2 83  ? 19.744 44.563  -33.827 1.000 35.249  0 83  MET FFF CA  1 ? 
ATOM   2191 C C   . MET B 2 83  ? 19.080 45.290  -34.998 1.000 37.015  0 83  MET FFF C   1 ? 
ATOM   2192 O O   . MET B 2 83  ? 19.747 46.120  -35.629 1.000 42.006  0 83  MET FFF O   1 ? 
ATOM   2193 C CB  . MET B 2 83  ? 20.700 45.498  -33.083 1.000 35.689  0 83  MET FFF CB  1 ? 
ATOM   2194 C CG  . MET B 2 83  ? 21.539 44.777  -32.045 1.000 35.417  0 83  MET FFF CG  1 ? 
ATOM   2195 S SD  . MET B 2 83  ? 22.769 45.840  -31.264 1.000 39.882  0 83  MET FFF SD  1 ? 
ATOM   2196 C CE  . MET B 2 83  ? 21.694 47.048  -30.498 1.000 38.645  0 83  MET FFF CE  1 ? 
ATOM   2197 N N   . ASN B 2 84  ? 17.821 44.960  -35.288 1.000 38.909  0 84  ASN FFF N   1 ? 
ATOM   2198 C CA  . ASN B 2 84  ? 17.038 45.573  -36.394 1.000 42.087  0 84  ASN FFF CA  1 ? 
ATOM   2199 C C   . ASN B 2 84  ? 16.188 46.719  -35.841 1.000 43.239  0 84  ASN FFF C   1 ? 
ATOM   2200 O O   . ASN B 2 84  ? 15.992 46.783  -34.606 1.000 45.897  0 84  ASN FFF O   1 ? 
ATOM   2201 C CB  . ASN B 2 84  ? 16.135 44.561  -37.100 1.000 44.897  0 84  ASN FFF CB  1 ? 
ATOM   2202 C CG  . ASN B 2 84  ? 16.881 43.324  -37.542 1.000 47.115  0 84  ASN FFF CG  1 ? 
ATOM   2203 O OD1 . ASN B 2 84  ? 17.850 43.418  -38.295 1.000 46.690  0 84  ASN FFF OD1 1 ? 
ATOM   2204 N ND2 . ASN B 2 84  ? 16.440 42.165  -37.083 1.000 48.766  0 84  ASN FFF ND2 1 ? 
ATOM   2205 N N   . SER B 2 85  ? 15.695 47.578  -36.734 1.000 44.354  0 85  SER FFF N   1 ? 
ATOM   2206 C CA  . SER B 2 85  ? 14.783 48.705  -36.415 1.000 45.709  0 85  SER FFF CA  1 ? 
ATOM   2207 C C   . SER B 2 85  ? 15.345 49.486  -35.224 1.000 42.608  0 85  SER FFF C   1 ? 
ATOM   2208 O O   . SER B 2 85  ? 14.599 49.716  -34.262 1.000 45.662  0 85  SER FFF O   1 ? 
ATOM   2209 C CB  . SER B 2 85  ? 13.392 48.199  -36.151 1.000 47.726  0 85  SER FFF CB  1 ? 
ATOM   2210 O OG  . SER B 2 85  ? 12.889 47.521  -37.291 1.000 52.163  0 85  SER FFF OG  1 ? 
ATOM   2211 N N   . LEU B 2 86  ? 16.621 49.871  -35.300 1.000 42.556  0 86  LEU FFF N   1 ? 
ATOM   2212 C CA  . LEU B 2 86  ? 17.339 50.587  -34.213 1.000 43.109  0 86  LEU FFF CA  1 ? 
ATOM   2213 C C   . LEU B 2 86  ? 16.596 51.882  -33.872 1.000 45.542  0 86  LEU FFF C   1 ? 
ATOM   2214 O O   . LEU B 2 86  ? 16.153 52.584  -34.811 1.000 44.140  0 86  LEU FFF O   1 ? 
ATOM   2215 C CB  . LEU B 2 86  ? 18.782 50.863  -34.643 1.000 41.800  0 86  LEU FFF CB  1 ? 
ATOM   2216 C CG  . LEU B 2 86  ? 19.696 49.641  -34.654 1.000 43.413  0 86  LEU FFF CG  1 ? 
ATOM   2217 C CD1 . LEU B 2 86  ? 20.996 49.950  -35.372 1.000 44.129  0 86  LEU FFF CD1 1 ? 
ATOM   2218 C CD2 . LEU B 2 86  ? 19.970 49.153  -33.239 1.000 44.489  0 86  LEU FFF CD2 1 ? 
ATOM   2219 N N   . LYS B 2 87  ? 16.453 52.153  -32.571 1.000 48.465  0 87  LYS FFF N   1 ? 
ATOM   2220 C CA  . LYS B 2 87  ? 15.837 53.381  -31.998 1.000 50.464  0 87  LYS FFF CA  1 ? 
ATOM   2221 C C   . LYS B 2 87  ? 16.880 54.077  -31.120 1.000 46.898  0 87  LYS FFF C   1 ? 
ATOM   2222 O O   . LYS B 2 87  ? 17.809 53.389  -30.662 1.000 43.739  0 87  LYS FFF O   1 ? 
ATOM   2223 C CB  . LYS B 2 87  ? 14.593 53.019  -31.179 1.000 55.754  0 87  LYS FFF CB  1 ? 
ATOM   2224 C CG  . LYS B 2 87  ? 13.625 52.064  -31.866 1.000 60.259  0 87  LYS FFF CG  1 ? 
ATOM   2225 C CD  . LYS B 2 87  ? 12.292 51.910  -31.166 1.000 66.382  0 87  LYS FFF CD  1 ? 
ATOM   2226 C CE  . LYS B 2 87  ? 12.426 51.508  -29.714 1.000 69.384  0 87  LYS FFF CE  1 ? 
ATOM   2227 N NZ  . LYS B 2 87  ? 11.107 51.204  -29.114 1.000 75.587  0 87  LYS FFF NZ  1 ? 
ATOM   2228 N N   . TYR B 2 88  ? 16.719 55.380  -30.870 1.000 49.402  0 88  TYR FFF N   1 ? 
ATOM   2229 C CA  . TYR B 2 88  ? 17.639 56.182  -30.019 1.000 53.380  0 88  TYR FFF CA  1 ? 
ATOM   2230 C C   . TYR B 2 88  ? 17.791 55.485  -28.657 1.000 51.283  0 88  TYR FFF C   1 ? 
ATOM   2231 O O   . TYR B 2 88  ? 18.909 55.469  -28.105 1.000 52.268  0 88  TYR FFF O   1 ? 
ATOM   2232 C CB  . TYR B 2 88  ? 17.154 57.629  -29.880 1.000 58.323  0 88  TYR FFF CB  1 ? 
ATOM   2233 C CG  . TYR B 2 88  ? 18.037 58.475  -28.996 1.000 72.422  0 88  TYR FFF CG  1 ? 
ATOM   2234 C CD1 . TYR B 2 88  ? 19.286 58.897  -29.427 1.000 80.368  0 88  TYR FFF CD1 1 ? 
ATOM   2235 C CD2 . TYR B 2 88  ? 17.645 58.824  -27.711 1.000 79.938  0 88  TYR FFF CD2 1 ? 
ATOM   2236 C CE1 . TYR B 2 88  ? 20.113 59.658  -28.615 1.000 85.132  0 88  TYR FFF CE1 1 ? 
ATOM   2237 C CE2 . TYR B 2 88  ? 18.460 59.584  -26.887 1.000 83.771  0 88  TYR FFF CE2 1 ? 
ATOM   2238 C CZ  . TYR B 2 88  ? 19.699 60.003  -27.340 1.000 85.207  0 88  TYR FFF CZ  1 ? 
ATOM   2239 O OH  . TYR B 2 88  ? 20.506 60.756  -26.536 1.000 87.309  0 88  TYR FFF OH  1 ? 
ATOM   2240 N N   . GLU B 2 89  ? 16.702 54.881  -28.166 1.000 50.018  0 89  GLU FFF N   1 ? 
ATOM   2241 C CA  . GLU B 2 89  ? 16.615 54.173  -26.860 1.000 53.026  0 89  GLU FFF CA  1 ? 
ATOM   2242 C C   . GLU B 2 89  ? 17.559 52.960  -26.820 1.000 44.653  0 89  GLU FFF C   1 ? 
ATOM   2243 O O   . GLU B 2 89  ? 17.816 52.470  -25.706 1.000 44.830  0 89  GLU FFF O   1 ? 
ATOM   2244 C CB  . GLU B 2 89  ? 15.173 53.722  -26.593 1.000 59.210  0 89  GLU FFF CB  1 ? 
ATOM   2245 C CG  . GLU B 2 89  ? 14.219 54.860  -26.270 1.000 64.894  0 89  GLU FFF CG  1 ? 
ATOM   2246 C CD  . GLU B 2 89  ? 13.688 55.663  -27.450 1.000 65.131  0 89  GLU FFF CD  1 ? 
ATOM   2247 O OE1 . GLU B 2 89  ? 13.906 55.254  -28.609 1.000 60.625  0 89  GLU FFF OE1 1 ? 
ATOM   2248 O OE2 . GLU B 2 89  ? 13.051 56.701  -27.201 1.000 76.472  0 89  GLU FFF OE2 1 ? 
ATOM   2249 N N   . ASP B 2 90  ? 18.032 52.469  -27.974 1.000 42.639  0 90  ASP FFF N   1 ? 
ATOM   2250 C CA  . ASP B 2 90  ? 18.955 51.306  -28.064 1.000 42.123  0 90  ASP FFF CA  1 ? 
ATOM   2251 C C   . ASP B 2 90  ? 20.412 51.738  -27.852 1.000 40.448  0 90  ASP FFF C   1 ? 
ATOM   2252 O O   . ASP B 2 90  ? 21.264 50.842  -27.738 1.000 41.499  0 90  ASP FFF O   1 ? 
ATOM   2253 C CB  . ASP B 2 90  ? 18.817 50.581  -29.404 1.000 41.252  0 90  ASP FFF CB  1 ? 
ATOM   2254 C CG  . ASP B 2 90  ? 17.443 49.977  -29.623 1.000 42.646  0 90  ASP FFF CG  1 ? 
ATOM   2255 O OD1 . ASP B 2 90  ? 16.833 49.511  -28.627 1.000 40.866  0 90  ASP FFF OD1 1 ? 
ATOM   2256 O OD2 . ASP B 2 90  ? 16.993 49.980  -30.789 1.000 43.106  0 90  ASP FFF OD2 1 ? 
ATOM   2257 N N   . THR B 2 91  ? 20.703 53.041  -27.815 1.000 40.843  0 91  THR FFF N   1 ? 
ATOM   2258 C CA  . THR B 2 91  ? 22.073 53.561  -27.576 1.000 41.573  0 91  THR FFF CA  1 ? 
ATOM   2259 C C   . THR B 2 91  ? 22.516 53.107  -26.184 1.000 43.347  0 91  THR FFF C   1 ? 
ATOM   2260 O O   . THR B 2 91  ? 21.817 53.438  -25.201 1.000 46.462  0 91  THR FFF O   1 ? 
ATOM   2261 C CB  . THR B 2 91  ? 22.149 55.083  -27.744 1.000 43.759  0 91  THR FFF CB  1 ? 
ATOM   2262 O OG1 . THR B 2 91  ? 21.818 55.370  -29.103 1.000 42.775  0 91  THR FFF OG1 1 ? 
ATOM   2263 C CG2 . THR B 2 91  ? 23.515 55.650  -27.420 1.000 43.360  0 91  THR FFF CG2 1 ? 
ATOM   2264 N N   . ALA B 2 92  ? 23.615 52.357  -26.108 1.000 41.633  0 92  ALA FFF N   1 ? 
ATOM   2265 C CA  . ALA B 2 92  ? 24.149 51.805  -24.842 1.000 41.135  0 92  ALA FFF CA  1 ? 
ATOM   2266 C C   . ALA B 2 92  ? 25.462 51.077  -25.106 1.000 40.169  0 92  ALA FFF C   1 ? 
ATOM   2267 O O   . ALA B 2 92  ? 25.761 50.791  -26.283 1.000 38.924  0 92  ALA FFF O   1 ? 
ATOM   2268 C CB  . ALA B 2 92  ? 23.142 50.866  -24.224 1.000 41.177  0 92  ALA FFF CB  1 ? 
ATOM   2269 N N   . VAL B 2 93  ? 26.192 50.764  -24.038 1.000 40.599  0 93  VAL FFF N   1 ? 
ATOM   2270 C CA  . VAL B 2 93  ? 27.260 49.726  -24.052 1.000 41.794  0 93  VAL FFF CA  1 ? 
ATOM   2271 C C   . VAL B 2 93  ? 26.553 48.375  -23.919 1.000 38.620  0 93  VAL FFF C   1 ? 
ATOM   2272 O O   . VAL B 2 93  ? 25.766 48.204  -22.964 1.000 37.691  0 93  VAL FFF O   1 ? 
ATOM   2273 C CB  . VAL B 2 93  ? 28.317 49.934  -22.950 1.000 45.681  0 93  VAL FFF CB  1 ? 
ATOM   2274 C CG1 . VAL B 2 93  ? 29.425 48.888  -23.034 1.000 46.933  0 93  VAL FFF CG1 1 ? 
ATOM   2275 C CG2 . VAL B 2 93  ? 28.909 51.338  -22.996 1.000 49.916  0 93  VAL FFF CG2 1 ? 
ATOM   2276 N N   . TYR B 2 94  ? 26.800 47.474  -24.867 1.000 36.433  0 94  TYR FFF N   1 ? 
ATOM   2277 C CA  . TYR B 2 94  ? 26.229 46.103  -24.897 1.000 37.407  0 94  TYR FFF CA  1 ? 
ATOM   2278 C C   . TYR B 2 94  ? 27.281 45.128  -24.367 1.000 36.860  0 94  TYR FFF C   1 ? 
ATOM   2279 O O   . TYR B 2 94  ? 28.433 45.185  -24.808 1.000 39.747  0 94  TYR FFF O   1 ? 
ATOM   2280 C CB  . TYR B 2 94  ? 25.739 45.756  -26.305 1.000 35.693  0 94  TYR FFF CB  1 ? 
ATOM   2281 C CG  . TYR B 2 94  ? 24.442 46.435  -26.654 1.000 35.289  0 94  TYR FFF CG  1 ? 
ATOM   2282 C CD1 . TYR B 2 94  ? 24.396 47.798  -26.897 1.000 35.735  0 94  TYR FFF CD1 1 ? 
ATOM   2283 C CD2 . TYR B 2 94  ? 23.250 45.731  -26.683 1.000 33.468  0 94  TYR FFF CD2 1 ? 
ATOM   2284 C CE1 . TYR B 2 94  ? 23.203 48.439  -27.188 1.000 34.997  0 94  TYR FFF CE1 1 ? 
ATOM   2285 C CE2 . TYR B 2 94  ? 22.050 46.356  -26.976 1.000 35.417  0 94  TYR FFF CE2 1 ? 
ATOM   2286 C CZ  . TYR B 2 94  ? 22.025 47.717  -27.224 1.000 34.948  0 94  TYR FFF CZ  1 ? 
ATOM   2287 O OH  . TYR B 2 94  ? 20.842 48.339  -27.504 1.000 36.432  0 94  TYR FFF OH  1 ? 
ATOM   2288 N N   . TYR B 2 95  ? 26.888 44.275  -23.423 1.000 35.511  0 95  TYR FFF N   1 ? 
ATOM   2289 C CA  . TYR B 2 95  ? 27.769 43.259  -22.793 1.000 36.591  0 95  TYR FFF CA  1 ? 
ATOM   2290 C C   . TYR B 2 95  ? 27.216 41.869  -23.092 1.000 34.679  0 95  TYR FFF C   1 ? 
ATOM   2291 O O   . TYR B 2 95  ? 26.019 41.649  -22.893 1.000 34.539  0 95  TYR FFF O   1 ? 
ATOM   2292 C CB  . TYR B 2 95  ? 27.831 43.443  -21.276 1.000 36.523  0 95  TYR FFF CB  1 ? 
ATOM   2293 C CG  . TYR B 2 95  ? 28.364 44.774  -20.818 1.000 38.999  0 95  TYR FFF CG  1 ? 
ATOM   2294 C CD1 . TYR B 2 95  ? 27.520 45.854  -20.614 1.000 41.676  0 95  TYR FFF CD1 1 ? 
ATOM   2295 C CD2 . TYR B 2 95  ? 29.714 44.948  -20.567 1.000 42.487  0 95  TYR FFF CD2 1 ? 
ATOM   2296 C CE1 . TYR B 2 95  ? 28.007 47.078  -20.182 1.000 44.030  0 95  TYR FFF CE1 1 ? 
ATOM   2297 C CE2 . TYR B 2 95  ? 30.217 46.165  -20.138 1.000 44.782  0 95  TYR FFF CE2 1 ? 
ATOM   2298 C CZ  . TYR B 2 95  ? 29.360 47.233  -19.944 1.000 45.080  0 95  TYR FFF CZ  1 ? 
ATOM   2299 O OH  . TYR B 2 95  ? 29.859 48.429  -19.524 1.000 50.527  0 95  TYR FFF OH  1 ? 
ATOM   2300 N N   . CYS B 2 96  ? 28.054 40.943  -23.547 1.000 35.534  0 96  CYS FFF N   1 ? 
ATOM   2301 C CA  . CYS B 2 96  ? 27.646 39.522  -23.564 1.000 38.017  0 96  CYS FFF CA  1 ? 
ATOM   2302 C C   . CYS B 2 96  ? 28.062 38.891  -22.235 1.000 34.718  0 96  CYS FFF C   1 ? 
ATOM   2303 O O   . CYS B 2 96  ? 28.981 39.405  -21.533 1.000 34.621  0 96  CYS FFF O   1 ? 
ATOM   2304 C CB  . CYS B 2 96  ? 28.183 38.738  -24.748 1.000 45.512  0 96  CYS FFF CB  1 ? 
ATOM   2305 S SG  . CYS B 2 96  ? 29.974 38.603  -24.681 1.000 55.387  0 96  CYS FFF SG  1 ? 
ATOM   2306 N N   . ALA B 2 97  ? 27.358 37.830  -21.886 1.000 34.894  0 97  ALA FFF N   1 ? 
ATOM   2307 C CA  . ALA B 2 97  ? 27.520 37.104  -20.619 1.000 34.444  0 97  ALA FFF CA  1 ? 
ATOM   2308 C C   . ALA B 2 97  ? 27.371 35.617  -20.915 1.000 33.507  0 97  ALA FFF C   1 ? 
ATOM   2309 O O   . ALA B 2 97  ? 26.691 35.252  -21.898 1.000 31.313  0 97  ALA FFF O   1 ? 
ATOM   2310 C CB  . ALA B 2 97  ? 26.504 37.582  -19.621 1.000 36.609  0 97  ALA FFF CB  1 ? 
ATOM   2311 N N   . ARG B 2 98  ? 28.010 34.810  -20.083 1.000 34.021  0 98  ARG FFF N   1 ? 
ATOM   2312 C CA  . ARG B 2 98  ? 28.035 33.343  -20.203 1.000 33.038  0 98  ARG FFF CA  1 ? 
ATOM   2313 C C   . ARG B 2 98  ? 27.778 32.752  -18.822 1.000 31.409  0 98  ARG FFF C   1 ? 
ATOM   2314 O O   . ARG B 2 98  ? 28.226 33.356  -17.833 1.000 33.524  0 98  ARG FFF O   1 ? 
ATOM   2315 C CB  . ARG B 2 98  ? 29.394 32.927  -20.758 1.000 39.057  0 98  ARG FFF CB  1 ? 
ATOM   2316 C CG  . ARG B 2 98  ? 29.494 31.444  -21.046 1.000 40.253  0 98  ARG FFF CG  1 ? 
ATOM   2317 C CD  . ARG B 2 98  ? 30.866 31.087  -21.549 1.000 44.229  0 98  ARG FFF CD  1 ? 
ATOM   2318 N NE  . ARG B 2 98  ? 31.010 29.660  -21.367 1.000 46.647  0 98  ARG FFF NE  1 ? 
ATOM   2319 C CZ  . ARG B 2 98  ? 31.503 29.080  -20.285 1.000 45.201  0 98  ARG FFF CZ  1 ? 
ATOM   2320 N NH1 . ARG B 2 98  ? 31.956 29.802  -19.273 1.000 52.787  0 98  ARG FFF NH1 1 ? 
ATOM   2321 N NH2 . ARG B 2 98  ? 31.560 27.768  -20.234 1.000 51.467  0 98  ARG FFF NH2 1 ? 
ATOM   2322 N N   . THR B 2 99  ? 27.076 31.624  -18.769 1.000 33.111  0 99  THR FFF N   1 ? 
ATOM   2323 C CA  . THR B 2 99  ? 26.900 30.836  -17.528 1.000 33.910  0 99  THR FFF CA  1 ? 
ATOM   2324 C C   . THR B 2 99  ? 26.949 29.346  -17.857 1.000 33.669  0 99  THR FFF C   1 ? 
ATOM   2325 O O   . THR B 2 99  ? 26.591 28.967  -18.980 1.000 32.739  0 99  THR FFF O   1 ? 
ATOM   2326 C CB  . THR B 2 99  ? 25.600 31.198  -16.798 1.000 35.085  0 99  THR FFF CB  1 ? 
ATOM   2327 O OG1 . THR B 2 99  ? 25.598 30.448  -15.578 1.000 36.202  0 99  THR FFF OG1 1 ? 
ATOM   2328 C CG2 . THR B 2 99  ? 24.355 30.894  -17.603 1.000 34.058  0 99  THR FFF CG2 1 ? 
ATOM   2329 N N   . GLU B 2 100 ? 27.387 28.553  -16.882 1.000 33.790  0 100 GLU FFF N   1 ? 
ATOM   2330 C CA  A GLU B 2 100 ? 27.347 27.071  -16.954 0.500 35.619  0 100 GLU FFF CA  1 ? 
ATOM   2331 C CA  B GLU B 2 100 ? 27.366 27.068  -16.915 0.500 35.254  0 100 GLU FFF CA  1 ? 
ATOM   2332 C C   . GLU B 2 100 ? 26.123 26.571  -16.171 1.000 32.883  0 100 GLU FFF C   1 ? 
ATOM   2333 O O   . GLU B 2 100 ? 25.905 25.352  -16.150 1.000 32.871  0 100 GLU FFF O   1 ? 
ATOM   2334 C CB  A GLU B 2 100 ? 28.684 26.517  -16.461 0.500 39.512  0 100 GLU FFF CB  1 ? 
ATOM   2335 C CB  B GLU B 2 100 ? 28.620 26.491  -16.254 0.500 39.240  0 100 GLU FFF CB  1 ? 
ATOM   2336 C CG  A GLU B 2 100 ? 29.859 27.064  -17.257 0.500 42.445  0 100 GLU FFF CG  1 ? 
ATOM   2337 C CG  B GLU B 2 100 ? 29.847 26.515  -17.143 0.500 41.624  0 100 GLU FFF CG  1 ? 
ATOM   2338 C CD  A GLU B 2 100 ? 31.242 26.831  -16.673 0.500 44.122  0 100 GLU FFF CD  1 ? 
ATOM   2339 C CD  B GLU B 2 100 ? 31.026 25.737  -16.586 0.500 43.210  0 100 GLU FFF CD  1 ? 
ATOM   2340 O OE1 A GLU B 2 100 ? 31.368 25.984  -15.757 0.500 41.176  0 100 GLU FFF OE1 1 ? 
ATOM   2341 O OE1 B GLU B 2 100 ? 31.721 26.267  -15.694 0.500 47.430  0 100 GLU FFF OE1 1 ? 
ATOM   2342 O OE2 A GLU B 2 100 ? 32.193 27.506  -17.140 0.500 46.027  0 100 GLU FFF OE2 1 ? 
ATOM   2343 O OE2 B GLU B 2 100 ? 31.219 24.579  -17.012 0.500 42.396  0 100 GLU FFF OE2 1 ? 
ATOM   2344 N N   . TYR B 2 101 ? 25.351 27.487  -15.577 1.000 30.454  0 101 TYR FFF N   1 ? 
ATOM   2345 C CA  . TYR B 2 101 ? 24.139 27.129  -14.798 1.000 30.621  0 101 TYR FFF CA  1 ? 
ATOM   2346 C C   . TYR B 2 101 ? 23.011 26.738  -15.759 1.000 29.813  0 101 TYR FFF C   1 ? 
ATOM   2347 O O   . TYR B 2 101 ? 22.538 27.593  -16.529 1.000 30.142  0 101 TYR FFF O   1 ? 
ATOM   2348 C CB  . TYR B 2 101 ? 23.687 28.257  -13.871 1.000 31.834  0 101 TYR FFF CB  1 ? 
ATOM   2349 C CG  . TYR B 2 101 ? 22.398 27.933  -13.169 1.000 32.386  0 101 TYR FFF CG  1 ? 
ATOM   2350 C CD1 . TYR B 2 101 ? 22.326 26.873  -12.280 1.000 33.948  0 101 TYR FFF CD1 1 ? 
ATOM   2351 C CD2 . TYR B 2 101 ? 21.239 28.643  -13.424 1.000 33.942  0 101 TYR FFF CD2 1 ? 
ATOM   2352 C CE1 . TYR B 2 101 ? 21.140 26.542  -11.651 1.000 35.605  0 101 TYR FFF CE1 1 ? 
ATOM   2353 C CE2 . TYR B 2 101 ? 20.048 28.329  -12.793 1.000 34.827  0 101 TYR FFF CE2 1 ? 
ATOM   2354 C CZ  . TYR B 2 101 ? 19.996 27.273  -11.905 1.000 34.938  0 101 TYR FFF CZ  1 ? 
ATOM   2355 O OH  . TYR B 2 101 ? 18.827 26.949  -11.272 1.000 39.084  0 101 TYR FFF OH  1 ? 
ATOM   2356 N N   . VAL B 2 102 ? 22.579 25.478  -15.679 1.000 27.493  0 102 VAL FFF N   1 ? 
ATOM   2357 C CA  . VAL B 2 102 ? 21.433 24.926  -16.451 1.000 28.380  0 102 VAL FFF CA  1 ? 
ATOM   2358 C C   . VAL B 2 102 ? 20.175 25.043  -15.591 1.000 29.023  0 102 VAL FFF C   1 ? 
ATOM   2359 O O   . VAL B 2 102 ? 20.065 24.294  -14.614 1.000 29.480  0 102 VAL FFF O   1 ? 
ATOM   2360 C CB  . VAL B 2 102 ? 21.689 23.464  -16.857 1.000 27.912  0 102 VAL FFF CB  1 ? 
ATOM   2361 C CG1 . VAL B 2 102 ? 20.496 22.873  -17.590 1.000 28.255  0 102 VAL FFF CG1 1 ? 
ATOM   2362 C CG2 . VAL B 2 102 ? 22.962 23.320  -17.673 1.000 27.784  0 102 VAL FFF CG2 1 ? 
ATOM   2363 N N   . SER B 2 103 ? 19.260 25.938  -15.950 1.000 29.127  0 103 SER FFF N   1 ? 
ATOM   2364 C CA  . SER B 2 103 ? 17.891 25.968  -15.387 1.000 30.561  0 103 SER FFF CA  1 ? 
ATOM   2365 C C   . SER B 2 103 ? 16.947 25.272  -16.360 1.000 29.085  0 103 SER FFF C   1 ? 
ATOM   2366 O O   . SER B 2 103 ? 17.093 25.481  -17.576 1.000 31.677  0 103 SER FFF O   1 ? 
ATOM   2367 C CB  . SER B 2 103 ? 17.419 27.360  -15.095 1.000 31.513  0 103 SER FFF CB  1 ? 
ATOM   2368 O OG  . SER B 2 103 ? 16.073 27.326  -14.644 1.000 32.355  0 103 SER FFF OG  1 ? 
ATOM   2369 N N   . TYR B 2 104 ? 16.003 24.490  -15.844 1.000 29.619  0 104 TYR FFF N   1 ? 
ATOM   2370 C CA  . TYR B 2 104 ? 14.914 23.884  -16.653 1.000 31.148  0 104 TYR FFF CA  1 ? 
ATOM   2371 C C   . TYR B 2 104 ? 14.077 25.003  -17.291 1.000 29.805  0 104 TYR FFF C   1 ? 
ATOM   2372 O O   . TYR B 2 104 ? 13.407 24.753  -18.307 1.000 29.808  0 104 TYR FFF O   1 ? 
ATOM   2373 C CB  . TYR B 2 104 ? 14.056 22.956  -15.791 1.000 29.857  0 104 TYR FFF CB  1 ? 
ATOM   2374 C CG  . TYR B 2 104 ? 13.037 23.654  -14.930 1.000 32.946  0 104 TYR FFF CG  1 ? 
ATOM   2375 C CD1 . TYR B 2 104 ? 11.758 23.913  -15.398 1.000 32.115  0 104 TYR FFF CD1 1 ? 
ATOM   2376 C CD2 . TYR B 2 104 ? 13.349 24.050  -13.639 1.000 34.022  0 104 TYR FFF CD2 1 ? 
ATOM   2377 C CE1 . TYR B 2 104 ? 10.818 24.552  -14.607 1.000 34.444  0 104 TYR FFF CE1 1 ? 
ATOM   2378 C CE2 . TYR B 2 104 ? 12.419 24.690  -12.838 1.000 33.299  0 104 TYR FFF CE2 1 ? 
ATOM   2379 C CZ  . TYR B 2 104 ? 11.152 24.947  -13.325 1.000 35.501  0 104 TYR FFF CZ  1 ? 
ATOM   2380 O OH  . TYR B 2 104 ? 10.227 25.571  -12.538 1.000 40.658  0 104 TYR FFF OH  1 ? 
ATOM   2381 N N   . LEU B 2 105 ? 14.116 26.200  -16.699 1.000 32.166  0 105 LEU FFF N   1 ? 
ATOM   2382 C CA  . LEU B 2 105 ? 13.189 27.325  -16.982 1.000 31.875  0 105 LEU FFF CA  1 ? 
ATOM   2383 C C   . LEU B 2 105 ? 13.950 28.450  -17.686 1.000 31.772  0 105 LEU FFF C   1 ? 
ATOM   2384 O O   . LEU B 2 105 ? 14.740 29.158  -17.033 1.000 32.782  0 105 LEU FFF O   1 ? 
ATOM   2385 C CB  . LEU B 2 105 ? 12.575 27.804  -15.663 1.000 33.060  0 105 LEU FFF CB  1 ? 
ATOM   2386 C CG  . LEU B 2 105 ? 11.442 28.819  -15.805 1.000 36.172  0 105 LEU FFF CG  1 ? 
ATOM   2387 C CD1 . LEU B 2 105 ? 10.260 28.215  -16.547 1.000 38.991  0 105 LEU FFF CD1 1 ? 
ATOM   2388 C CD2 . LEU B 2 105 ? 11.008 29.336  -14.437 1.000 39.526  0 105 LEU FFF CD2 1 ? 
ATOM   2389 N N   . LEU B 2 106 ? 13.718 28.614  -18.985 1.000 31.383  0 106 LEU FFF N   1 ? 
ATOM   2390 C CA  . LEU B 2 106 ? 14.502 29.561  -19.823 1.000 31.437  0 106 LEU FFF CA  1 ? 
ATOM   2391 C C   . LEU B 2 106 ? 14.399 30.990  -19.274 1.000 30.543  0 106 LEU FFF C   1 ? 
ATOM   2392 O O   . LEU B 2 106 ? 15.409 31.700  -19.322 1.000 30.557  0 106 LEU FFF O   1 ? 
ATOM   2393 C CB  . LEU B 2 106 ? 14.011 29.491  -21.269 1.000 29.990  0 106 LEU FFF CB  1 ? 
ATOM   2394 C CG  . LEU B 2 106 ? 14.922 30.163  -22.294 1.000 32.526  0 106 LEU FFF CG  1 ? 
ATOM   2395 C CD1 . LEU B 2 106 ? 16.203 29.366  -22.498 1.000 31.580  0 106 LEU FFF CD1 1 ? 
ATOM   2396 C CD2 . LEU B 2 106 ? 14.186 30.350  -23.614 1.000 34.736  0 106 LEU FFF CD2 1 ? 
ATOM   2397 N N   . SER B 2 107 ? 13.229 31.406  -18.778 1.000 31.875  0 107 SER FFF N   1 ? 
ATOM   2398 C CA  . SER B 2 107 ? 12.991 32.797  -18.315 1.000 32.828  0 107 SER FFF CA  1 ? 
ATOM   2399 C C   . SER B 2 107 ? 13.958 33.137  -17.170 1.000 32.957  0 107 SER FFF C   1 ? 
ATOM   2400 O O   . SER B 2 107 ? 14.206 34.331  -16.949 1.000 32.574  0 107 SER FFF O   1 ? 
ATOM   2401 C CB  . SER B 2 107 ? 11.557 33.006  -17.918 1.000 33.546  0 107 SER FFF CB  1 ? 
ATOM   2402 O OG  . SER B 2 107 ? 11.204 32.160  -16.836 1.000 35.268  0 107 SER FFF OG  1 ? 
ATOM   2403 N N   . ASP B 2 108 ? 14.503 32.133  -16.472 1.000 31.445  0 108 ASP FFF N   1 ? 
ATOM   2404 C CA  . ASP B 2 108 ? 15.498 32.358  -15.385 1.000 33.990  0 108 ASP FFF CA  1 ? 
ATOM   2405 C C   . ASP B 2 108 ? 16.725 33.110  -15.925 1.000 34.350  0 108 ASP FFF C   1 ? 
ATOM   2406 O O   . ASP B 2 108 ? 17.368 33.817  -15.139 1.000 35.334  0 108 ASP FFF O   1 ? 
ATOM   2407 C CB  . ASP B 2 108 ? 15.930 31.052  -14.708 1.000 35.318  0 108 ASP FFF CB  1 ? 
ATOM   2408 C CG  . ASP B 2 108 ? 14.933 30.469  -13.717 1.000 36.174  0 108 ASP FFF CG  1 ? 
ATOM   2409 O OD1 . ASP B 2 108 ? 13.945 31.161  -13.369 1.000 36.116  0 108 ASP FFF OD1 1 ? 
ATOM   2410 O OD2 . ASP B 2 108 ? 15.155 29.324  -13.289 1.000 36.533  0 108 ASP FFF OD2 1 ? 
ATOM   2411 N N   . TYR B 2 109 ? 17.061 32.980  -17.216 1.000 33.073  0 109 TYR FFF N   1 ? 
ATOM   2412 C CA  . TYR B 2 109 ? 18.273 33.622  -17.788 1.000 31.484  0 109 TYR FFF CA  1 ? 
ATOM   2413 C C   . TYR B 2 109 ? 18.102 35.151  -17.869 1.000 33.138  0 109 TYR FFF C   1 ? 
ATOM   2414 O O   . TYR B 2 109 ? 19.113 35.840  -18.064 1.000 34.270  0 109 TYR FFF O   1 ? 
ATOM   2415 C CB  . TYR B 2 109 ? 18.654 32.934  -19.098 1.000 30.950  0 109 TYR FFF CB  1 ? 
ATOM   2416 C CG  . TYR B 2 109 ? 19.138 31.527  -18.856 1.000 30.210  0 109 TYR FFF CG  1 ? 
ATOM   2417 C CD1 . TYR B 2 109 ? 20.254 31.287  -18.069 1.000 30.149  0 109 TYR FFF CD1 1 ? 
ATOM   2418 C CD2 . TYR B 2 109 ? 18.439 30.432  -19.333 1.000 30.917  0 109 TYR FFF CD2 1 ? 
ATOM   2419 C CE1 . TYR B 2 109 ? 20.690 30.001  -17.799 1.000 29.409  0 109 TYR FFF CE1 1 ? 
ATOM   2420 C CE2 . TYR B 2 109 ? 18.858 29.139  -19.069 1.000 30.313  0 109 TYR FFF CE2 1 ? 
ATOM   2421 C CZ  . TYR B 2 109 ? 19.989 28.921  -18.300 1.000 29.015  0 109 TYR FFF CZ  1 ? 
ATOM   2422 O OH  . TYR B 2 109 ? 20.400 27.646  -18.049 1.000 29.023  0 109 TYR FFF OH  1 ? 
ATOM   2423 N N   . ALA B 2 110 ? 16.895 35.684  -17.671 1.000 34.141  0 110 ALA FFF N   1 ? 
ATOM   2424 C CA  . ALA B 2 110 ? 16.653 37.147  -17.637 1.000 35.107  0 110 ALA FFF CA  1 ? 
ATOM   2425 C C   . ALA B 2 110 ? 17.191 37.748  -16.330 1.000 37.591  0 110 ALA FFF C   1 ? 
ATOM   2426 O O   . ALA B 2 110 ? 17.601 38.932  -16.344 1.000 40.881  0 110 ALA FFF O   1 ? 
ATOM   2427 C CB  . ALA B 2 110 ? 15.188 37.448  -17.828 1.000 37.330  0 110 ALA FFF CB  1 ? 
ATOM   2428 N N   . THR B 2 111 ? 17.194 36.978  -15.240 1.000 36.522  0 111 THR FFF N   1 ? 
ATOM   2429 C CA  . THR B 2 111 ? 17.488 37.495  -13.871 1.000 40.783  0 111 THR FFF CA  1 ? 
ATOM   2430 C C   . THR B 2 111 ? 18.658 36.754  -13.208 1.000 40.068  0 111 THR FFF C   1 ? 
ATOM   2431 O O   . THR B 2 111 ? 19.094 37.209  -12.132 1.000 41.147  0 111 THR FFF O   1 ? 
ATOM   2432 C CB  . THR B 2 111 ? 16.243 37.410  -12.984 1.000 43.305  0 111 THR FFF CB  1 ? 
ATOM   2433 O OG1 . THR B 2 111 ? 15.860 36.036  -12.942 1.000 44.216  0 111 THR FFF OG1 1 ? 
ATOM   2434 C CG2 . THR B 2 111 ? 15.102 38.271  -13.483 1.000 46.433  0 111 THR FFF CG2 1 ? 
ATOM   2435 N N   . TRP B 2 112 ? 19.141 35.659  -13.795 1.000 40.204  0 112 TRP FFF N   1 ? 
ATOM   2436 C CA  . TRP B 2 112 ? 20.289 34.883  -13.260 1.000 44.983  0 112 TRP FFF CA  1 ? 
ATOM   2437 C C   . TRP B 2 112 ? 21.535 35.761  -13.252 1.000 45.228  0 112 TRP FFF C   1 ? 
ATOM   2438 O O   . TRP B 2 112 ? 21.811 36.450  -14.233 1.000 46.024  0 112 TRP FFF O   1 ? 
ATOM   2439 C CB  . TRP B 2 112 ? 20.540 33.611  -14.073 1.000 49.290  0 112 TRP FFF CB  1 ? 
ATOM   2440 C CG  . TRP B 2 112 ? 21.611 32.762  -13.462 1.000 53.859  0 112 TRP FFF CG  1 ? 
ATOM   2441 C CD1 . TRP B 2 112 ? 22.901 32.626  -13.881 1.000 58.079  0 112 TRP FFF CD1 1 ? 
ATOM   2442 C CD2 . TRP B 2 112 ? 21.487 31.963  -12.274 1.000 53.819  0 112 TRP FFF CD2 1 ? 
ATOM   2443 N NE1 . TRP B 2 112 ? 23.585 31.779  -13.050 1.000 59.031  0 112 TRP FFF NE1 1 ? 
ATOM   2444 C CE2 . TRP B 2 112 ? 22.744 31.358  -12.053 1.000 56.215  0 112 TRP FFF CE2 1 ? 
ATOM   2445 C CE3 . TRP B 2 112 ? 20.439 31.695  -11.385 1.000 56.936  0 112 TRP FFF CE3 1 ? 
ATOM   2446 C CZ2 . TRP B 2 112 ? 22.974 30.500  -10.978 1.000 56.289  0 112 TRP FFF CZ2 1 ? 
ATOM   2447 C CZ3 . TRP B 2 112 ? 20.669 30.850  -10.321 1.000 61.001  0 112 TRP FFF CZ3 1 ? 
ATOM   2448 C CH2 . TRP B 2 112 ? 21.921 30.263  -10.123 1.000 60.133  0 112 TRP FFF CH2 1 ? 
ATOM   2449 N N   . PRO B 2 113 ? 22.330 35.767  -12.157 1.000 46.233  0 113 PRO FFF N   1 ? 
ATOM   2450 C CA  . PRO B 2 113 ? 23.632 36.430  -12.176 1.000 50.852  0 113 PRO FFF CA  1 ? 
ATOM   2451 C C   . PRO B 2 113 ? 24.622 35.565  -12.968 1.000 51.483  0 113 PRO FFF C   1 ? 
ATOM   2452 O O   . PRO B 2 113 ? 24.899 34.447  -12.579 1.000 58.916  0 113 PRO FFF O   1 ? 
ATOM   2453 C CB  . PRO B 2 113 ? 24.005 36.568  -10.694 1.000 50.713  0 113 PRO FFF CB  1 ? 
ATOM   2454 C CG  . PRO B 2 113 ? 23.263 35.432  -10.012 1.000 50.019  0 113 PRO FFF CG  1 ? 
ATOM   2455 C CD  . PRO B 2 113 ? 22.018 35.180  -10.843 1.000 48.473  0 113 PRO FFF CD  1 ? 
ATOM   2456 N N   . TYR B 2 114 ? 25.116 36.094  -14.080 1.000 49.025  0 114 TYR FFF N   1 ? 
ATOM   2457 C CA  . TYR B 2 114 ? 26.042 35.373  -14.985 1.000 48.416  0 114 TYR FFF CA  1 ? 
ATOM   2458 C C   . TYR B 2 114 ? 27.458 35.416  -14.409 1.000 53.053  0 114 TYR FFF C   1 ? 
ATOM   2459 O O   . TYR B 2 114 ? 27.797 36.385  -13.676 1.000 53.276  0 114 TYR FFF O   1 ? 
ATOM   2460 C CB  . TYR B 2 114 ? 26.000 35.967  -16.390 1.000 44.598  0 114 TYR FFF CB  1 ? 
ATOM   2461 C CG  . TYR B 2 114 ? 24.774 35.604  -17.181 1.000 42.174  0 114 TYR FFF CG  1 ? 
ATOM   2462 C CD1 . TYR B 2 114 ? 23.539 36.143  -16.866 1.000 42.471  0 114 TYR FFF CD1 1 ? 
ATOM   2463 C CD2 . TYR B 2 114 ? 24.859 34.760  -18.277 1.000 43.730  0 114 TYR FFF CD2 1 ? 
ATOM   2464 C CE1 . TYR B 2 114 ? 22.408 35.830  -17.599 1.000 41.795  0 114 TYR FFF CE1 1 ? 
ATOM   2465 C CE2 . TYR B 2 114 ? 23.740 34.446  -19.029 1.000 44.176  0 114 TYR FFF CE2 1 ? 
ATOM   2466 C CZ  . TYR B 2 114 ? 22.510 34.978  -18.684 1.000 42.139  0 114 TYR FFF CZ  1 ? 
ATOM   2467 O OH  . TYR B 2 114 ? 21.410 34.682  -19.428 1.000 43.297  0 114 TYR FFF OH  1 ? 
ATOM   2468 N N   . ASP B 2 115 ? 28.253 34.403  -14.770 1.000 50.719  0 115 ASP FFF N   1 ? 
ATOM   2469 C CA  . ASP B 2 115 ? 29.590 34.105  -14.188 1.000 56.284  0 115 ASP FFF CA  1 ? 
ATOM   2470 C C   . ASP B 2 115 ? 30.664 34.894  -14.959 1.000 49.385  0 115 ASP FFF C   1 ? 
ATOM   2471 O O   . ASP B 2 115 ? 31.623 35.353  -14.333 1.000 48.984  0 115 ASP FFF O   1 ? 
ATOM   2472 C CB  . ASP B 2 115 ? 29.871 32.593  -14.204 1.000 63.096  0 115 ASP FFF CB  1 ? 
ATOM   2473 C CG  . ASP B 2 115 ? 28.696 31.692  -13.820 1.000 67.529  0 115 ASP FFF CG  1 ? 
ATOM   2474 O OD1 . ASP B 2 115 ? 28.072 31.974  -12.756 1.000 73.991  0 115 ASP FFF OD1 1 ? 
ATOM   2475 O OD2 . ASP B 2 115 ? 28.414 30.695  -14.595 1.000 64.805  0 115 ASP FFF OD2 1 ? 
ATOM   2476 N N   . TYR B 2 116 ? 30.521 35.039  -16.280 1.000 45.236  0 116 TYR FFF N   1 ? 
ATOM   2477 C CA  . TYR B 2 116 ? 31.557 35.630  -17.170 1.000 43.285  0 116 TYR FFF CA  1 ? 
ATOM   2478 C C   . TYR B 2 116 ? 30.943 36.771  -17.987 1.000 40.143  0 116 TYR FFF C   1 ? 
ATOM   2479 O O   . TYR B 2 116 ? 29.787 36.630  -18.443 1.000 38.403  0 116 TYR FFF O   1 ? 
ATOM   2480 C CB  . TYR B 2 116 ? 32.162 34.550  -18.068 1.000 47.867  0 116 TYR FFF CB  1 ? 
ATOM   2481 C CG  . TYR B 2 116 ? 32.638 33.327  -17.326 1.000 54.372  0 116 TYR FFF CG  1 ? 
ATOM   2482 C CD1 . TYR B 2 116 ? 33.937 33.237  -16.852 1.000 59.931  0 116 TYR FFF CD1 1 ? 
ATOM   2483 C CD2 . TYR B 2 116 ? 31.781 32.266  -17.074 1.000 58.891  0 116 TYR FFF CD2 1 ? 
ATOM   2484 C CE1 . TYR B 2 116 ? 34.377 32.122  -16.154 1.000 64.424  0 116 TYR FFF CE1 1 ? 
ATOM   2485 C CE2 . TYR B 2 116 ? 32.205 31.144  -16.380 1.000 63.196  0 116 TYR FFF CE2 1 ? 
ATOM   2486 C CZ  . TYR B 2 116 ? 33.509 31.069  -15.921 1.000 66.853  0 116 TYR FFF CZ  1 ? 
ATOM   2487 O OH  . TYR B 2 116 ? 33.925 29.963  -15.236 1.000 73.315  0 116 TYR FFF OH  1 ? 
ATOM   2488 N N   . TRP B 2 117 ? 31.708 37.853  -18.169 1.000 39.573  0 117 TRP FFF N   1 ? 
ATOM   2489 C CA  . TRP B 2 117 ? 31.269 39.104  -18.846 1.000 41.755  0 117 TRP FFF CA  1 ? 
ATOM   2490 C C   . TRP B 2 117 ? 32.310 39.549  -19.874 1.000 40.372  0 117 TRP FFF C   1 ? 
ATOM   2491 O O   . TRP B 2 117 ? 33.515 39.440  -19.582 1.000 42.615  0 117 TRP FFF O   1 ? 
ATOM   2492 C CB  . TRP B 2 117 ? 31.017 40.203  -17.810 1.000 44.240  0 117 TRP FFF CB  1 ? 
ATOM   2493 C CG  . TRP B 2 117 ? 29.832 39.909  -16.947 1.000 44.808  0 117 TRP FFF CG  1 ? 
ATOM   2494 C CD1 . TRP B 2 117 ? 29.823 39.222  -15.768 1.000 48.136  0 117 TRP FFF CD1 1 ? 
ATOM   2495 C CD2 . TRP B 2 117 ? 28.464 40.248  -17.228 1.000 43.590  0 117 TRP FFF CD2 1 ? 
ATOM   2496 N NE1 . TRP B 2 117 ? 28.546 39.127  -15.285 1.000 47.938  0 117 TRP FFF NE1 1 ? 
ATOM   2497 C CE2 . TRP B 2 117 ? 27.690 39.743  -16.161 1.000 43.677  0 117 TRP FFF CE2 1 ? 
ATOM   2498 C CE3 . TRP B 2 117 ? 27.818 40.924  -18.273 1.000 42.074  0 117 TRP FFF CE3 1 ? 
ATOM   2499 C CZ2 . TRP B 2 117 ? 26.308 39.913  -16.102 1.000 45.019  0 117 TRP FFF CZ2 1 ? 
ATOM   2500 C CZ3 . TRP B 2 117 ? 26.450 41.084  -18.218 1.000 41.904  0 117 TRP FFF CZ3 1 ? 
ATOM   2501 C CH2 . TRP B 2 117 ? 25.708 40.586  -17.143 1.000 44.555  0 117 TRP FFF CH2 1 ? 
ATOM   2502 N N   . GLY B 2 118 ? 31.851 40.062  -21.017 1.000 38.712  0 118 GLY FFF N   1 ? 
ATOM   2503 C CA  . GLY B 2 118 ? 32.713 40.733  -22.009 1.000 41.145  0 118 GLY FFF CA  1 ? 
ATOM   2504 C C   . GLY B 2 118 ? 33.039 42.155  -21.581 1.000 42.951  0 118 GLY FFF C   1 ? 
ATOM   2505 O O   . GLY B 2 118 ? 32.479 42.613  -20.566 1.000 40.884  0 118 GLY FFF O   1 ? 
ATOM   2506 N N   . GLN B 2 119 ? 33.904 42.835  -22.340 1.000 45.265  0 119 GLN FFF N   1 ? 
ATOM   2507 C CA  . GLN B 2 119 ? 34.429 44.191  -22.021 1.000 49.186  0 119 GLN FFF CA  1 ? 
ATOM   2508 C C   . GLN B 2 119 ? 33.359 45.255  -22.302 1.000 46.680  0 119 GLN FFF C   1 ? 
ATOM   2509 O O   . GLN B 2 119 ? 33.456 46.355  -21.725 1.000 48.760  0 119 GLN FFF O   1 ? 
ATOM   2510 C CB  . GLN B 2 119 ? 35.702 44.462  -22.828 1.000 52.128  0 119 GLN FFF CB  1 ? 
ATOM   2511 C CG  . GLN B 2 119 ? 36.813 43.451  -22.574 1.000 60.623  0 119 GLN FFF CG  1 ? 
ATOM   2512 C CD  . GLN B 2 119 ? 37.151 43.319  -21.108 1.000 69.428  0 119 GLN FFF CD  1 ? 
ATOM   2513 O OE1 . GLN B 2 119 ? 37.148 42.227  -20.542 1.000 83.087  0 119 GLN FFF OE1 1 ? 
ATOM   2514 N NE2 . GLN B 2 119 ? 37.442 44.444  -20.478 1.000 70.938  0 119 GLN FFF NE2 1 ? 
ATOM   2515 N N   . GLY B 2 120 ? 32.385 44.950  -23.164 1.000 43.126  0 120 GLY FFF N   1 ? 
ATOM   2516 C CA  . GLY B 2 120 ? 31.313 45.884  -23.559 1.000 44.065  0 120 GLY FFF CA  1 ? 
ATOM   2517 C C   . GLY B 2 120 ? 31.609 46.537  -24.901 1.000 44.126  0 120 GLY FFF C   1 ? 
ATOM   2518 O O   . GLY B 2 120 ? 32.784 46.837  -25.160 1.000 48.746  0 120 GLY FFF O   1 ? 
ATOM   2519 N N   . THR B 2 121 ? 30.581 46.731  -25.731 1.000 43.701  0 121 THR FFF N   1 ? 
ATOM   2520 C CA  . THR B 2 121 ? 30.688 47.324  -27.091 1.000 42.384  0 121 THR FFF CA  1 ? 
ATOM   2521 C C   . THR B 2 121 ? 29.651 48.436  -27.233 1.000 39.565  0 121 THR FFF C   1 ? 
ATOM   2522 O O   . THR B 2 121 ? 28.462 48.171  -26.987 1.000 38.478  0 121 THR FFF O   1 ? 
ATOM   2523 C CB  . THR B 2 121 ? 30.510 46.262  -28.178 1.000 46.350  0 121 THR FFF CB  1 ? 
ATOM   2524 O OG1 . THR B 2 121 ? 31.402 45.200  -27.845 1.000 50.801  0 121 THR FFF OG1 1 ? 
ATOM   2525 C CG2 . THR B 2 121 ? 30.806 46.778  -29.569 1.000 44.262  0 121 THR FFF CG2 1 ? 
ATOM   2526 N N   . GLN B 2 122 ? 30.101 49.629  -27.619 1.000 40.531  0 122 GLN FFF N   1 ? 
ATOM   2527 C CA  . GLN B 2 122 ? 29.230 50.816  -27.786 1.000 41.616  0 122 GLN FFF CA  1 ? 
ATOM   2528 C C   . GLN B 2 122 ? 28.348 50.619  -29.023 1.000 39.880  0 122 GLN FFF C   1 ? 
ATOM   2529 O O   . GLN B 2 122 ? 28.878 50.252  -30.092 1.000 42.107  0 122 GLN FFF O   1 ? 
ATOM   2530 C CB  . GLN B 2 122 ? 30.066 52.089  -27.927 1.000 44.880  0 122 GLN FFF CB  1 ? 
ATOM   2531 C CG  . GLN B 2 122 ? 29.226 53.353  -28.045 1.000 46.433  0 122 GLN FFF CG  1 ? 
ATOM   2532 C CD  . GLN B 2 122 ? 28.464 53.647  -26.778 1.000 44.393  0 122 GLN FFF CD  1 ? 
ATOM   2533 O OE1 . GLN B 2 122 ? 29.037 53.691  -25.696 1.000 47.406  0 122 GLN FFF OE1 1 ? 
ATOM   2534 N NE2 . GLN B 2 122 ? 27.162 53.849  -26.897 1.000 43.939  0 122 GLN FFF NE2 1 ? 
ATOM   2535 N N   . VAL B 2 123 ? 27.046 50.853  -28.872 1.000 36.552  0 123 VAL FFF N   1 ? 
ATOM   2536 C CA  . VAL B 2 123 ? 26.099 51.033  -30.007 1.000 37.591  0 123 VAL FFF CA  1 ? 
ATOM   2537 C C   . VAL B 2 123 ? 25.522 52.441  -29.867 1.000 40.314  0 123 VAL FFF C   1 ? 
ATOM   2538 O O   . VAL B 2 123 ? 25.030 52.776  -28.776 1.000 42.150  0 123 VAL FFF O   1 ? 
ATOM   2539 C CB  . VAL B 2 123 ? 25.006 49.952  -30.029 1.000 36.708  0 123 VAL FFF CB  1 ? 
ATOM   2540 C CG1 . VAL B 2 123 ? 23.948 50.221  -31.090 1.000 38.438  0 123 VAL FFF CG1 1 ? 
ATOM   2541 C CG2 . VAL B 2 123 ? 25.602 48.567  -30.194 1.000 37.428  0 123 VAL FFF CG2 1 ? 
ATOM   2542 N N   . THR B 2 124 ? 25.627 53.246  -30.919 1.000 42.922  0 124 THR FFF N   1 ? 
ATOM   2543 C CA  . THR B 2 124 ? 25.112 54.638  -30.948 1.000 43.895  0 124 THR FFF CA  1 ? 
ATOM   2544 C C   . THR B 2 124 ? 24.149 54.759  -32.127 1.000 43.521  0 124 THR FFF C   1 ? 
ATOM   2545 O O   . THR B 2 124 ? 24.581 54.523  -33.273 1.000 46.432  0 124 THR FFF O   1 ? 
ATOM   2546 C CB  . THR B 2 124 ? 26.263 55.651  -30.974 1.000 45.654  0 124 THR FFF CB  1 ? 
ATOM   2547 O OG1 . THR B 2 124 ? 27.155 55.312  -29.910 1.000 46.457  0 124 THR FFF OG1 1 ? 
ATOM   2548 C CG2 . THR B 2 124 ? 25.793 57.083  -30.827 1.000 47.983  0 124 THR FFF CG2 1 ? 
ATOM   2549 N N   . VAL B 2 125 ? 22.889 55.079  -31.840 1.000 41.314  0 125 VAL FFF N   1 ? 
ATOM   2550 C CA  . VAL B 2 125 ? 21.830 55.270  -32.868 1.000 43.076  0 125 VAL FFF CA  1 ? 
ATOM   2551 C C   . VAL B 2 125 ? 21.627 56.775  -33.078 1.000 45.961  0 125 VAL FFF C   1 ? 
ATOM   2552 O O   . VAL B 2 125 ? 21.274 57.457  -32.107 1.000 48.949  0 125 VAL FFF O   1 ? 
ATOM   2553 C CB  . VAL B 2 125 ? 20.528 54.553  -32.469 1.000 42.418  0 125 VAL FFF CB  1 ? 
ATOM   2554 C CG1 . VAL B 2 125 ? 19.485 54.662  -33.571 1.000 43.534  0 125 VAL FFF CG1 1 ? 
ATOM   2555 C CG2 . VAL B 2 125 ? 20.777 53.094  -32.123 1.000 42.323  0 125 VAL FFF CG2 1 ? 
ATOM   2556 N N   . SER B 2 126 ? 21.854 57.262  -34.303 1.000 50.749  0 126 SER FFF N   1 ? 
ATOM   2557 C CA  . SER B 2 126 ? 21.716 58.692  -34.702 1.000 56.327  0 126 SER FFF CA  1 ? 
ATOM   2558 C C   . SER B 2 126 ? 20.374 58.919  -35.414 1.000 58.657  0 126 SER FFF C   1 ? 
ATOM   2559 O O   . SER B 2 126 ? 19.705 57.930  -35.738 1.000 58.727  0 126 SER FFF O   1 ? 
ATOM   2560 C CB  . SER B 2 126 ? 22.882 59.129  -35.556 1.000 59.043  0 126 SER FFF CB  1 ? 
ATOM   2561 O OG  . SER B 2 126 ? 23.182 58.155  -36.545 1.000 59.201  0 126 SER FFF OG  1 ? 
ATOM   2562 N N   . SER B 2 127 ? 20.002 60.185  -35.640 1.000 66.730  0 127 SER FFF N   1 ? 
ATOM   2563 C CA  . SER B 2 127 ? 18.697 60.615  -36.219 1.000 72.131  0 127 SER FFF CA  1 ? 
ATOM   2564 C C   . SER B 2 127 ? 18.425 59.910  -37.557 1.000 71.343  0 127 SER FFF C   1 ? 
ATOM   2565 O O   . SER B 2 127 ? 19.191 60.003  -38.523 1.000 74.146  0 127 SER FFF O   1 ? 
ATOM   2566 C CB  . SER B 2 127 ? 18.655 62.109  -36.374 1.000 75.787  0 127 SER FFF CB  1 ? 
ATOM   2567 O OG  . SER B 2 127 ? 18.648 62.736  -35.102 1.000 85.633  0 127 SER FFF OG  1 ? 
HETATM 2568 C C1  . NAG C 3 .   ? 42.759 5.172   -5.332  1.000 47.959  0 601 NAG EEE C1  1 ? 
HETATM 2569 C C2  . NAG C 3 .   ? 42.904 3.679   -5.064  1.000 49.056  0 601 NAG EEE C2  1 ? 
HETATM 2570 C C3  . NAG C 3 .   ? 43.305 3.495   -3.597  1.000 53.557  0 601 NAG EEE C3  1 ? 
HETATM 2571 C C4  . NAG C 3 .   ? 44.627 4.209   -3.359  1.000 56.247  0 601 NAG EEE C4  1 ? 
HETATM 2572 C C5  . NAG C 3 .   ? 44.505 5.676   -3.733  1.000 55.232  0 601 NAG EEE C5  1 ? 
HETATM 2573 C C6  . NAG C 3 .   ? 45.867 6.360   -3.688  1.000 58.463  0 601 NAG EEE C6  1 ? 
HETATM 2574 C C7  . NAG C 3 .   ? 41.596 1.871   -6.035  1.000 42.542  0 601 NAG EEE C7  1 ? 
HETATM 2575 C C8  . NAG C 3 .   ? 40.246 1.215   -6.047  1.000 43.597  0 601 NAG EEE C8  1 ? 
HETATM 2576 N N2  . NAG C 3 .   ? 41.662 2.995   -5.325  1.000 43.555  0 601 NAG EEE N2  1 ? 
HETATM 2577 O O3  . NAG C 3 .   ? 43.441 2.112   -3.254  1.000 55.867  0 601 NAG EEE O3  1 ? 
HETATM 2578 O O4  . NAG C 3 .   ? 45.032 4.126   -1.991  1.000 58.192  0 601 NAG EEE O4  1 ? 
HETATM 2579 O O5  . NAG C 3 .   ? 44.002 5.817   -5.055  1.000 51.248  0 601 NAG EEE O5  1 ? 
HETATM 2580 O O6  . NAG C 3 .   ? 45.656 7.761   -3.866  1.000 63.927  0 601 NAG EEE O6  1 ? 
HETATM 2581 O O7  . NAG C 3 .   ? 42.562 1.382   -6.610  1.000 43.030  0 601 NAG EEE O7  1 ? 
HETATM 2582 C C1  . GOL D 4 .   ? 26.871 3.747   -19.833 1.000 53.203  0 602 GOL EEE C1  1 ? 
HETATM 2583 O O1  . GOL D 4 .   ? 28.206 4.128   -20.194 1.000 47.954  0 602 GOL EEE O1  1 ? 
HETATM 2584 C C2  . GOL D 4 .   ? 26.080 3.196   -21.010 1.000 54.161  0 602 GOL EEE C2  1 ? 
HETATM 2585 O O2  . GOL D 4 .   ? 26.780 2.128   -21.654 1.000 57.781  0 602 GOL EEE O2  1 ? 
HETATM 2586 C C3  . GOL D 4 .   ? 24.696 2.714   -20.618 1.000 52.858  0 602 GOL EEE C3  1 ? 
HETATM 2587 O O3  . GOL D 4 .   ? 23.782 2.780   -21.716 1.000 51.412  0 602 GOL EEE O3  1 ? 
HETATM 2588 C C1  . GOL E 4 .   ? 24.171 -4.493  -15.369 1.000 40.124  0 603 GOL EEE C1  1 ? 
HETATM 2589 O O1  . GOL E 4 .   ? 24.392 -5.709  -14.661 1.000 44.735  0 603 GOL EEE O1  1 ? 
HETATM 2590 C C2  . GOL E 4 .   ? 23.321 -4.696  -16.608 1.000 40.074  0 603 GOL EEE C2  1 ? 
HETATM 2591 O O2  . GOL E 4 .   ? 22.914 -3.417  -17.088 1.000 39.668  0 603 GOL EEE O2  1 ? 
HETATM 2592 C C3  . GOL E 4 .   ? 24.029 -5.466  -17.711 1.000 40.911  0 603 GOL EEE C3  1 ? 
HETATM 2593 O O3  . GOL E 4 .   ? 23.379 -5.357  -18.984 1.000 36.622  0 603 GOL EEE O3  1 ? 
HETATM 2594 C C1  . GOL F 4 .   ? 38.512 6.590   -4.330  1.000 54.981  0 604 GOL EEE C1  1 ? 
HETATM 2595 O O1  . GOL F 4 .   ? 37.218 6.141   -3.957  1.000 60.201  0 604 GOL EEE O1  1 ? 
HETATM 2596 C C2  . GOL F 4 .   ? 39.078 7.553   -3.313  1.000 57.193  0 604 GOL EEE C2  1 ? 
HETATM 2597 O O2  . GOL F 4 .   ? 39.948 8.466   -3.974  1.000 64.043  0 604 GOL EEE O2  1 ? 
HETATM 2598 C C3  . GOL F 4 .   ? 38.020 8.331   -2.561  1.000 59.828  0 604 GOL EEE C3  1 ? 
HETATM 2599 O O3  . GOL F 4 .   ? 38.608 9.230   -1.626  1.000 57.248  0 604 GOL EEE O3  1 ? 
HETATM 2600 N N   . NO3 G 5 .   ? 29.353 -15.217 -25.461 1.000 52.135  0 605 NO3 EEE N   1 ? 
HETATM 2601 O O1  . NO3 G 5 .   ? 28.618 -14.377 -24.875 1.000 37.460  0 605 NO3 EEE O1  1 ? 
HETATM 2602 O O2  . NO3 G 5 .   ? 28.863 -16.181 -26.087 1.000 39.105  0 605 NO3 EEE O2  1 ? 
HETATM 2603 O O3  . NO3 G 5 .   ? 30.583 -15.076 -25.447 1.000 50.122  0 605 NO3 EEE O3  1 ? 
HETATM 2604 N N   . NO3 H 5 .   ? 33.018 -12.332 -24.225 1.000 72.244  0 606 NO3 EEE N   1 ? 
HETATM 2605 O O1  . NO3 H 5 .   ? 32.449 -11.288 -23.918 1.000 61.195  0 606 NO3 EEE O1  1 ? 
HETATM 2606 O O2  . NO3 H 5 .   ? 32.736 -13.381 -23.644 1.000 75.856  0 606 NO3 EEE O2  1 ? 
HETATM 2607 O O3  . NO3 H 5 .   ? 33.868 -12.329 -25.111 1.000 74.618  0 606 NO3 EEE O3  1 ? 
HETATM 2608 O O   . HOH I 6 .   ? 14.856 14.622  -23.316 1.000 43.079  0 701 HOH EEE O   1 ? 
HETATM 2609 O O   . HOH I 6 .   ? 34.091 -14.581 -20.632 1.000 47.637  0 702 HOH EEE O   1 ? 
HETATM 2610 O O   . HOH I 6 .   ? 16.407 -1.070  -0.862  1.000 45.357  0 703 HOH EEE O   1 ? 
HETATM 2611 O O   . HOH I 6 .   ? 18.253 16.626  -7.675  1.000 41.090  0 704 HOH EEE O   1 ? 
HETATM 2612 O O   . HOH I 6 .   ? 5.601  27.329  -17.546 1.000 47.918  0 705 HOH EEE O   1 ? 
HETATM 2613 O O   . HOH I 6 .   ? 27.869 4.707   6.753   1.000 36.181  0 706 HOH EEE O   1 ? 
HETATM 2614 O O   . HOH I 6 .   ? 6.689  10.524  -14.356 1.000 55.305  0 707 HOH EEE O   1 ? 
HETATM 2615 O O   . HOH I 6 .   ? 41.479 -0.939  6.916   1.000 44.632  0 708 HOH EEE O   1 ? 
HETATM 2616 O O   . HOH I 6 .   ? 12.559 4.683   -22.752 1.000 65.968  0 709 HOH EEE O   1 ? 
HETATM 2617 O O   . HOH I 6 .   ? 23.973 -8.133  -15.506 1.000 38.765  0 710 HOH EEE O   1 ? 
HETATM 2618 O O   . HOH I 6 .   ? 16.587 20.931  -26.799 1.000 41.820  0 711 HOH EEE O   1 ? 
HETATM 2619 O O   . HOH I 6 .   ? 40.513 -8.807  -2.035  1.000 51.845  0 712 HOH EEE O   1 ? 
HETATM 2620 O O   . HOH I 6 .   ? 37.504 9.845   -7.714  1.000 40.629  0 713 HOH EEE O   1 ? 
HETATM 2621 O O   . HOH I 6 .   ? 13.317 11.796  -21.991 1.000 33.801  0 714 HOH EEE O   1 ? 
HETATM 2622 O O   . HOH I 6 .   ? 36.958 13.497  -2.398  1.000 59.822  0 715 HOH EEE O   1 ? 
HETATM 2623 O O   . HOH I 6 .   ? 28.512 21.426  -2.208  1.000 48.487  0 716 HOH EEE O   1 ? 
HETATM 2624 O O   . HOH I 6 .   ? 28.948 -6.595  -21.582 1.000 54.360  0 717 HOH EEE O   1 ? 
HETATM 2625 O O   . HOH I 6 .   ? 35.368 11.940  1.099   1.000 44.856  0 718 HOH EEE O   1 ? 
HETATM 2626 O O   . HOH I 6 .   ? 14.188 -1.063  -7.845  1.000 37.440  0 719 HOH EEE O   1 ? 
HETATM 2627 O O   . HOH I 6 .   ? 27.320 8.263   1.547   1.000 39.174  0 720 HOH EEE O   1 ? 
HETATM 2628 O O   . HOH I 6 .   ? 34.285 21.773  -13.341 1.000 50.276  0 721 HOH EEE O   1 ? 
HETATM 2629 O O   . HOH I 6 .   ? 11.132 1.121   -13.693 1.000 49.047  0 722 HOH EEE O   1 ? 
HETATM 2630 O O   . HOH I 6 .   ? 20.587 -4.085  -18.168 1.000 43.351  0 723 HOH EEE O   1 ? 
HETATM 2631 O O   . HOH I 6 .   ? 19.916 8.443   -17.416 1.000 26.799  0 724 HOH EEE O   1 ? 
HETATM 2632 O O   . HOH I 6 .   ? 30.210 -12.771 -23.095 1.000 46.676  0 725 HOH EEE O   1 ? 
HETATM 2633 O O   . HOH I 6 .   ? 30.090 29.744  -2.817  1.000 66.593  0 726 HOH EEE O   1 ? 
HETATM 2634 O O   . HOH I 6 .   ? 12.298 26.340  -20.189 1.000 33.667  0 727 HOH EEE O   1 ? 
HETATM 2635 O O   . HOH I 6 .   ? 40.401 7.370   -14.548 1.000 47.639  0 728 HOH EEE O   1 ? 
HETATM 2636 O O   . HOH I 6 .   ? 15.243 23.668  -27.981 1.000 54.936  0 729 HOH EEE O   1 ? 
HETATM 2637 O O   . HOH I 6 .   ? 7.904  17.204  -25.899 1.000 54.910  0 730 HOH EEE O   1 ? 
HETATM 2638 O O   . HOH I 6 .   ? 33.743 -14.605 3.010   1.000 77.845  0 731 HOH EEE O   1 ? 
HETATM 2639 O O   . HOH I 6 .   ? 33.769 3.607   -18.759 1.000 37.865  0 732 HOH EEE O   1 ? 
HETATM 2640 O O   . HOH I 6 .   ? 8.529  3.030   -16.955 1.000 61.526  0 733 HOH EEE O   1 ? 
HETATM 2641 O O   . HOH I 6 .   ? 41.508 -0.252  1.762   1.000 69.793  0 734 HOH EEE O   1 ? 
HETATM 2642 O O   . HOH I 6 .   ? 9.931  27.653  -20.114 1.000 35.522  0 735 HOH EEE O   1 ? 
HETATM 2643 O O   . HOH I 6 .   ? 15.683 2.005   -7.212  1.000 42.580  0 736 HOH EEE O   1 ? 
HETATM 2644 O O   . HOH I 6 .   ? 24.782 5.078   3.536   1.000 44.412  0 737 HOH EEE O   1 ? 
HETATM 2645 O O   . HOH I 6 .   ? 18.006 3.436   0.629   1.000 38.649  0 738 HOH EEE O   1 ? 
HETATM 2646 O O   . HOH I 6 .   ? 5.258  14.972  -21.755 1.000 45.883  0 739 HOH EEE O   1 ? 
HETATM 2647 O O   . HOH I 6 .   ? 29.470 1.984   -21.637 1.000 37.797  0 740 HOH EEE O   1 ? 
HETATM 2648 O O   . HOH I 6 .   ? 4.551  16.657  -16.108 1.000 53.441  0 741 HOH EEE O   1 ? 
HETATM 2649 O O   . HOH I 6 .   ? 13.203 14.121  -20.393 1.000 30.723  0 742 HOH EEE O   1 ? 
HETATM 2650 O O   . HOH I 6 .   ? 11.710 4.060   -19.641 1.000 36.604  0 743 HOH EEE O   1 ? 
HETATM 2651 O O   . HOH I 6 .   ? 29.269 11.753  4.551   1.000 51.655  0 744 HOH EEE O   1 ? 
HETATM 2652 O O   . HOH I 6 .   ? 22.337 1.332   -1.519  1.000 35.741  0 745 HOH EEE O   1 ? 
HETATM 2653 O O   . HOH I 6 .   ? 12.154 15.761  -22.362 1.000 34.297  0 746 HOH EEE O   1 ? 
HETATM 2654 O O   . HOH I 6 .   ? 26.650 -1.742  -12.107 1.000 31.442  0 747 HOH EEE O   1 ? 
HETATM 2655 O O   . HOH I 6 .   ? 18.235 10.768  -17.375 1.000 28.619  0 748 HOH EEE O   1 ? 
HETATM 2656 O O   . HOH I 6 .   ? 6.773  26.381  -26.773 1.000 52.399  0 749 HOH EEE O   1 ? 
HETATM 2657 O O   . HOH I 6 .   ? 12.810 4.211   -12.409 1.000 34.575  0 750 HOH EEE O   1 ? 
HETATM 2658 O O   . HOH I 6 .   ? 26.802 21.029  -10.424 1.000 31.693  0 751 HOH EEE O   1 ? 
HETATM 2659 O O   . HOH I 6 .   ? 32.047 4.014   -14.344 1.000 32.113  0 752 HOH EEE O   1 ? 
HETATM 2660 O O   . HOH I 6 .   ? 35.492 23.109  -2.665  1.000 66.408  0 753 HOH EEE O   1 ? 
HETATM 2661 O O   . HOH I 6 .   ? 34.639 8.919   -14.302 1.000 33.230  0 754 HOH EEE O   1 ? 
HETATM 2662 O O   . HOH I 6 .   ? 16.318 11.504  -1.716  1.000 41.041  0 755 HOH EEE O   1 ? 
HETATM 2663 O O   . HOH I 6 .   ? 8.709  13.350  -10.798 1.000 56.888  0 756 HOH EEE O   1 ? 
HETATM 2664 O O   . HOH I 6 .   ? 34.656 18.249  -10.677 1.000 44.706  0 757 HOH EEE O   1 ? 
HETATM 2665 O O   . HOH I 6 .   ? 3.019  21.841  -22.957 1.000 52.051  0 758 HOH EEE O   1 ? 
HETATM 2666 O O   . HOH I 6 .   ? 1.338  16.314  -21.205 1.000 74.650  0 759 HOH EEE O   1 ? 
HETATM 2667 O O   . HOH I 6 .   ? 19.104 -0.455  1.431   1.000 49.143  0 760 HOH EEE O   1 ? 
HETATM 2668 O O   . HOH I 6 .   ? 31.876 8.681   -14.166 1.000 30.409  0 761 HOH EEE O   1 ? 
HETATM 2669 O O   . HOH I 6 .   ? 16.591 25.191  -26.250 1.000 33.391  0 762 HOH EEE O   1 ? 
HETATM 2670 O O   . HOH I 6 .   ? 21.816 1.225   -20.582 1.000 42.137  0 763 HOH EEE O   1 ? 
HETATM 2671 O O   . HOH I 6 .   ? 41.629 3.682   4.066   1.000 53.989  0 764 HOH EEE O   1 ? 
HETATM 2672 O O   . HOH I 6 .   ? 44.054 4.510   -8.708  1.000 53.062  0 765 HOH EEE O   1 ? 
HETATM 2673 O O   . HOH I 6 .   ? 34.570 6.789   -12.650 1.000 31.952  0 766 HOH EEE O   1 ? 
HETATM 2674 O O   . HOH I 6 .   ? 19.851 3.299   -14.726 1.000 30.710  0 767 HOH EEE O   1 ? 
HETATM 2675 O O   . HOH I 6 .   ? 11.795 29.985  -26.579 1.000 44.268  0 768 HOH EEE O   1 ? 
HETATM 2676 O O   . HOH I 6 .   ? 25.209 14.804  -11.690 1.000 28.337  0 769 HOH EEE O   1 ? 
HETATM 2677 O O   . HOH I 6 .   ? 15.612 25.823  -11.545 1.000 45.288  0 770 HOH EEE O   1 ? 
HETATM 2678 O O   . HOH I 6 .   ? 29.117 10.365  -19.629 1.000 38.478  0 771 HOH EEE O   1 ? 
HETATM 2679 O O   . HOH I 6 .   ? 13.407 13.200  -5.536  1.000 62.112  0 772 HOH EEE O   1 ? 
HETATM 2680 O O   . HOH I 6 .   ? 11.740 4.287   -9.782  1.000 39.245  0 773 HOH EEE O   1 ? 
HETATM 2681 O O   . HOH I 6 .   ? 10.931 0.458   -7.666  1.000 53.211  0 774 HOH EEE O   1 ? 
HETATM 2682 O O   . HOH I 6 .   ? 18.117 3.672   -8.243  1.000 33.341  0 775 HOH EEE O   1 ? 
HETATM 2683 O O   . HOH I 6 .   ? 6.090  18.857  -29.920 1.000 58.835  0 776 HOH EEE O   1 ? 
HETATM 2684 O O   . HOH I 6 .   ? 5.856  18.595  -27.286 1.000 52.150  0 777 HOH EEE O   1 ? 
HETATM 2685 O O   . HOH I 6 .   ? 33.501 -11.283 -20.600 1.000 52.903  0 778 HOH EEE O   1 ? 
HETATM 2686 O O   . HOH I 6 .   ? 6.620  5.413   -15.339 1.000 45.748  0 779 HOH EEE O   1 ? 
HETATM 2687 O O   . HOH I 6 .   ? 10.318 11.679  -9.493  1.000 50.532  0 780 HOH EEE O   1 ? 
HETATM 2688 O O   . HOH I 6 .   ? 9.411  7.960   -21.549 1.000 56.092  0 781 HOH EEE O   1 ? 
HETATM 2689 O O   . HOH I 6 .   ? 13.020 19.210  -28.381 1.000 40.721  0 782 HOH EEE O   1 ? 
HETATM 2690 O O   . HOH I 6 .   ? 21.000 9.664   1.152   1.000 35.599  0 783 HOH EEE O   1 ? 
HETATM 2691 O O   . HOH I 6 .   ? 25.047 -7.910  -9.336  1.000 48.128  0 784 HOH EEE O   1 ? 
HETATM 2692 O O   . HOH I 6 .   ? 4.895  13.632  -19.449 1.000 53.659  0 785 HOH EEE O   1 ? 
HETATM 2693 O O   . HOH I 6 .   ? 13.043 12.122  -24.922 1.000 48.927  0 786 HOH EEE O   1 ? 
HETATM 2694 O O   . HOH I 6 .   ? 8.216  14.603  -15.351 1.000 34.843  0 787 HOH EEE O   1 ? 
HETATM 2695 O O   . HOH I 6 .   ? 17.857 14.957  -27.577 1.000 37.851  0 788 HOH EEE O   1 ? 
HETATM 2696 O O   . HOH I 6 .   ? 32.378 10.350  2.616   1.000 51.951  0 789 HOH EEE O   1 ? 
HETATM 2697 O O   . HOH I 6 .   ? 14.145 -7.019  -10.747 1.000 65.876  0 790 HOH EEE O   1 ? 
HETATM 2698 O O   . HOH I 6 .   ? 25.816 19.783  7.054   1.000 51.635  0 791 HOH EEE O   1 ? 
HETATM 2699 O O   . HOH I 6 .   ? 36.764 12.197  -4.629  1.000 66.825  0 792 HOH EEE O   1 ? 
HETATM 2700 O O   . HOH I 6 .   ? 39.354 3.807   -3.791  1.000 47.187  0 793 HOH EEE O   1 ? 
HETATM 2701 O O   . HOH I 6 .   ? 0.686  23.237  -22.826 1.000 69.520  0 794 HOH EEE O   1 ? 
HETATM 2702 O O   . HOH I 6 .   ? 13.102 -4.183  -11.056 1.000 52.106  0 795 HOH EEE O   1 ? 
HETATM 2703 O O   . HOH I 6 .   ? 29.934 25.826  -12.831 1.000 42.082  0 796 HOH EEE O   1 ? 
HETATM 2704 O O   . HOH I 6 .   ? 19.175 8.988   -24.640 1.000 36.451  0 797 HOH EEE O   1 ? 
HETATM 2705 O O   . HOH I 6 .   ? 17.700 -0.988  -19.339 1.000 39.086  0 798 HOH EEE O   1 ? 
HETATM 2706 O O   . HOH I 6 .   ? 5.320  30.167  -24.298 1.000 59.774  0 799 HOH EEE O   1 ? 
HETATM 2707 O O   . HOH I 6 .   ? 22.030 18.917  4.858   1.000 61.334  0 800 HOH EEE O   1 ? 
HETATM 2708 O O   . HOH I 6 .   ? 9.970  14.279  -23.245 1.000 37.069  0 801 HOH EEE O   1 ? 
HETATM 2709 O O   . HOH I 6 .   ? 27.884 -13.294 0.917   1.000 73.312  0 802 HOH EEE O   1 ? 
HETATM 2710 O O   . HOH I 6 .   ? 22.818 20.546  -3.982  1.000 54.569  0 803 HOH EEE O   1 ? 
HETATM 2711 O O   . HOH I 6 .   ? 38.427 11.783  -15.391 1.000 43.032  0 804 HOH EEE O   1 ? 
HETATM 2712 O O   . HOH I 6 .   ? 11.890 5.643   -2.076  1.000 49.881  0 805 HOH EEE O   1 ? 
HETATM 2713 O O   . HOH I 6 .   ? 30.072 -19.556 -16.875 1.000 47.600  0 806 HOH EEE O   1 ? 
HETATM 2714 O O   . HOH I 6 .   ? 21.902 2.724   5.527   1.000 52.484  0 807 HOH EEE O   1 ? 
HETATM 2715 O O   . HOH I 6 .   ? 22.694 23.784  1.830   1.000 61.150  0 808 HOH EEE O   1 ? 
HETATM 2716 O O   . HOH I 6 .   ? 34.957 -11.955 -8.560  1.000 56.295  0 809 HOH EEE O   1 ? 
HETATM 2717 O O   . HOH I 6 .   ? 10.572 11.926  -21.694 1.000 38.245  0 810 HOH EEE O   1 ? 
HETATM 2718 O O   . HOH I 6 .   ? 38.737 -5.173  -17.275 1.000 47.288  0 811 HOH EEE O   1 ? 
HETATM 2719 O O   . HOH I 6 .   ? 48.467 -6.236  -13.123 1.000 76.494  0 812 HOH EEE O   1 ? 
HETATM 2720 O O   . HOH I 6 .   ? 21.599 21.491  -5.896  1.000 48.020  0 813 HOH EEE O   1 ? 
HETATM 2721 O O   . HOH I 6 .   ? 14.601 7.537   -1.324  1.000 77.149  0 814 HOH EEE O   1 ? 
HETATM 2722 O O   . HOH I 6 .   ? 18.461 21.843  -8.312  1.000 60.547  0 815 HOH EEE O   1 ? 
HETATM 2723 O O   . HOH I 6 .   ? 42.852 -1.068  -9.725  1.000 50.536  0 816 HOH EEE O   1 ? 
HETATM 2724 O O   . HOH I 6 .   ? 7.522  15.556  -23.417 1.000 37.994  0 817 HOH EEE O   1 ? 
HETATM 2725 O O   . HOH I 6 .   ? 23.630 -17.021 -19.812 1.000 35.378  0 818 HOH EEE O   1 ? 
HETATM 2726 O O   . HOH I 6 .   ? 22.014 -7.472  -9.673  1.000 55.773  0 819 HOH EEE O   1 ? 
HETATM 2727 O O   . HOH I 6 .   ? 22.145 3.784   -0.578  1.000 46.052  0 820 HOH EEE O   1 ? 
HETATM 2728 O O   . HOH I 6 .   ? 43.120 1.094   -12.527 1.000 55.211  0 821 HOH EEE O   1 ? 
HETATM 2729 O O   . HOH I 6 .   ? 40.682 10.085  -14.637 1.000 49.874  0 822 HOH EEE O   1 ? 
HETATM 2730 O O   . HOH I 6 .   ? 41.348 -5.042  -8.628  1.000 52.370  0 823 HOH EEE O   1 ? 
HETATM 2731 O O   . HOH I 6 .   ? 36.828 17.151  -11.765 1.000 51.815  0 824 HOH EEE O   1 ? 
HETATM 2732 O O   . HOH I 6 .   ? 24.010 -12.813 -13.645 1.000 48.717  0 825 HOH EEE O   1 ? 
HETATM 2733 O O   . HOH I 6 .   ? 15.715 13.066  -28.488 1.000 65.886  0 826 HOH EEE O   1 ? 
HETATM 2734 O O   . HOH I 6 .   ? 17.040 11.788  2.389   1.000 73.728  0 827 HOH EEE O   1 ? 
HETATM 2735 O O   . HOH I 6 .   ? 45.412 -16.906 -4.347  1.000 77.996  0 828 HOH EEE O   1 ? 
HETATM 2736 O O   . HOH I 6 .   ? 22.764 -15.313 -17.743 1.000 45.106  0 829 HOH EEE O   1 ? 
HETATM 2737 O O   . HOH I 6 .   ? 15.639 7.466   -23.265 1.000 67.304  0 830 HOH EEE O   1 ? 
HETATM 2738 O O   . HOH I 6 .   ? 36.576 5.545   -15.654 1.000 56.259  0 831 HOH EEE O   1 ? 
HETATM 2739 O O   . HOH I 6 .   ? 31.183 0.000   -21.135 0.500 43.761  0 832 HOH EEE O   1 ? 
HETATM 2740 O O   . HOH I 6 .   ? 35.929 -7.787  -25.849 1.000 52.575  0 833 HOH EEE O   1 ? 
HETATM 2741 O O   . HOH I 6 .   ? 25.137 10.311  2.130   1.000 53.583  0 834 HOH EEE O   1 ? 
HETATM 2742 O O   . HOH I 6 .   ? 36.857 19.712  0.898   1.000 69.574  0 835 HOH EEE O   1 ? 
HETATM 2743 O O   . HOH I 6 .   ? 16.918 0.944   0.816   1.000 50.563  0 836 HOH EEE O   1 ? 
HETATM 2744 O O   . HOH I 6 .   ? 9.119  2.239   -12.241 1.000 53.673  0 837 HOH EEE O   1 ? 
HETATM 2745 O O   . HOH I 6 .   ? 23.390 -10.082 -13.592 1.000 48.168  0 838 HOH EEE O   1 ? 
HETATM 2746 O O   . HOH I 6 .   ? 34.302 0.000   -21.135 0.500 45.500  0 839 HOH EEE O   1 ? 
HETATM 2747 O O   . HOH I 6 .   ? 23.921 13.300  3.529   1.000 60.451  0 840 HOH EEE O   1 ? 
HETATM 2748 O O   . HOH I 6 .   ? 15.759 0.000   -21.135 0.500 38.778  0 841 HOH EEE O   1 ? 
HETATM 2749 O O   . HOH I 6 .   ? 22.389 7.845   2.493   1.000 54.306  0 842 HOH EEE O   1 ? 
HETATM 2750 O O   . HOH I 6 .   ? 45.732 -17.702 -6.791  1.000 76.101  0 843 HOH EEE O   1 ? 
HETATM 2751 O O   . HOH I 6 .   ? 18.857 10.514  -27.110 1.000 54.325  0 844 HOH EEE O   1 ? 
HETATM 2752 O O   . HOH I 6 .   ? 34.085 4.563   -16.082 1.000 42.998  0 845 HOH EEE O   1 ? 
HETATM 2753 O O   . HOH I 6 .   ? 19.654 -2.652  -20.297 1.000 33.965  0 846 HOH EEE O   1 ? 
HETATM 2754 O O   . HOH I 6 .   ? 35.924 2.981   -20.143 1.000 55.035  0 847 HOH EEE O   1 ? 
HETATM 2755 O O   . HOH J 6 .   ? 27.135 23.483  -17.271 1.000 60.257  0 201 HOH FFF O   1 ? 
HETATM 2756 O O   . HOH J 6 .   ? 31.590 25.083  -23.527 1.000 54.067  0 202 HOH FFF O   1 ? 
HETATM 2757 O O   . HOH J 6 .   ? 14.774 34.037  -31.615 1.000 41.922  0 203 HOH FFF O   1 ? 
HETATM 2758 O O   . HOH J 6 .   ? 28.826 32.044  -37.351 1.000 41.695  0 204 HOH FFF O   1 ? 
HETATM 2759 O O   . HOH J 6 .   ? 10.261 39.279  -21.615 1.000 57.197  0 205 HOH FFF O   1 ? 
HETATM 2760 O O   . HOH J 6 .   ? 15.513 44.109  -19.364 1.000 54.243  0 206 HOH FFF O   1 ? 
HETATM 2761 O O   . HOH J 6 .   ? 17.707 32.331  -32.737 1.000 41.551  0 207 HOH FFF O   1 ? 
HETATM 2762 O O   . HOH J 6 .   ? 18.966 20.237  -27.114 1.000 42.915  0 208 HOH FFF O   1 ? 
HETATM 2763 O O   . HOH J 6 .   ? 20.153 55.433  -24.753 1.000 57.084  0 209 HOH FFF O   1 ? 
HETATM 2764 O O   . HOH J 6 .   ? 33.530 34.121  -33.710 1.000 43.801  0 210 HOH FFF O   1 ? 
HETATM 2765 O O   . HOH J 6 .   ? 17.108 28.979  -11.398 1.000 44.185  0 211 HOH FFF O   1 ? 
HETATM 2766 O O   . HOH J 6 .   ? 27.280 57.244  -28.074 1.000 61.041  0 212 HOH FFF O   1 ? 
HETATM 2767 O O   . HOH J 6 .   ? 18.261 29.787  -31.956 1.000 36.737  0 213 HOH FFF O   1 ? 
HETATM 2768 O O   . HOH J 6 .   ? 11.212 27.295  -10.750 1.000 59.905  0 214 HOH FFF O   1 ? 
HETATM 2769 O O   . HOH J 6 .   ? 33.878 38.895  -31.335 1.000 43.086  0 215 HOH FFF O   1 ? 
HETATM 2770 O O   . HOH J 6 .   ? 21.350 36.792  -34.396 1.000 36.924  0 216 HOH FFF O   1 ? 
HETATM 2771 O O   . HOH J 6 .   ? 9.117  36.866  -23.024 1.000 56.048  0 217 HOH FFF O   1 ? 
HETATM 2772 O O   . HOH J 6 .   ? 31.626 21.166  -23.457 1.000 45.630  0 218 HOH FFF O   1 ? 
HETATM 2773 O O   . HOH J 6 .   ? 12.084 32.913  -14.348 1.000 38.972  0 219 HOH FFF O   1 ? 
HETATM 2774 O O   . HOH J 6 .   ? 31.866 37.684  -35.537 1.000 49.213  0 220 HOH FFF O   1 ? 
HETATM 2775 O O   . HOH J 6 .   ? 16.667 64.467  -34.300 1.000 75.357  0 221 HOH FFF O   1 ? 
HETATM 2776 O O   . HOH J 6 .   ? 14.859 49.721  -26.603 1.000 60.465  0 222 HOH FFF O   1 ? 
HETATM 2777 O O   . HOH J 6 .   ? 13.564 28.036  -11.433 1.000 54.129  0 223 HOH FFF O   1 ? 
HETATM 2778 O O   . HOH J 6 .   ? 20.703 50.834  -19.431 1.000 48.154  0 224 HOH FFF O   1 ? 
HETATM 2779 O O   . HOH J 6 .   ? 10.594 46.672  -29.631 1.000 64.658  0 225 HOH FFF O   1 ? 
HETATM 2780 O O   . HOH J 6 .   ? 14.816 49.599  -22.340 1.000 71.280  0 226 HOH FFF O   1 ? 
HETATM 2781 O O   . HOH J 6 .   ? 17.081 43.680  -16.662 1.000 46.179  0 227 HOH FFF O   1 ? 
HETATM 2782 O O   . HOH J 6 .   ? 21.959 22.204  -29.640 1.000 42.199  0 228 HOH FFF O   1 ? 
HETATM 2783 O O   . HOH J 6 .   ? 8.606  31.404  -17.725 1.000 61.854  0 229 HOH FFF O   1 ? 
HETATM 2784 O O   . HOH J 6 .   ? 23.141 24.140  -23.034 1.000 39.041  0 230 HOH FFF O   1 ? 
HETATM 2785 O O   . HOH J 6 .   ? 12.498 38.992  -31.095 1.000 50.829  0 231 HOH FFF O   1 ? 
HETATM 2786 O O   . HOH J 6 .   ? 11.016 42.666  -20.314 1.000 54.090  0 232 HOH FFF O   1 ? 
HETATM 2787 O O   . HOH J 6 .   ? 32.899 49.994  -28.103 1.000 54.316  0 233 HOH FFF O   1 ? 
HETATM 2788 O O   . HOH J 6 .   ? 24.024 27.626  -35.470 1.000 49.995  0 234 HOH FFF O   1 ? 
HETATM 2789 O O   . HOH J 6 .   ? 21.019 30.055  -33.042 1.000 31.565  0 235 HOH FFF O   1 ? 
HETATM 2790 O O   . HOH J 6 .   ? 13.050 30.408  -28.968 1.000 39.867  0 236 HOH FFF O   1 ? 
HETATM 2791 O O   . HOH J 6 .   ? 27.764 24.762  -34.880 1.000 54.180  0 237 HOH FFF O   1 ? 
HETATM 2792 O O   . HOH J 6 .   ? 34.111 37.973  -16.508 1.000 55.552  0 238 HOH FFF O   1 ? 
HETATM 2793 O O   . HOH J 6 .   ? 10.945 36.078  -24.986 1.000 40.683  0 239 HOH FFF O   1 ? 
HETATM 2794 O O   . HOH J 6 .   ? 28.704 44.691  -16.808 1.000 69.346  0 240 HOH FFF O   1 ? 
HETATM 2795 O O   . HOH J 6 .   ? 21.245 24.543  -20.726 1.000 34.315  0 241 HOH FFF O   1 ? 
HETATM 2796 O O   . HOH J 6 .   ? 11.758 45.300  -21.525 1.000 58.773  0 242 HOH FFF O   1 ? 
HETATM 2797 O O   . HOH J 6 .   ? 25.885 54.806  -24.416 1.000 51.214  0 243 HOH FFF O   1 ? 
HETATM 2798 O O   . HOH J 6 .   ? 29.451 54.261  -31.449 1.000 63.812  0 244 HOH FFF O   1 ? 
HETATM 2799 O O   . HOH J 6 .   ? 25.369 25.767  -33.858 1.000 40.138  0 245 HOH FFF O   1 ? 
HETATM 2800 O O   . HOH J 6 .   ? 29.075 26.242  -37.766 1.000 70.351  0 246 HOH FFF O   1 ? 
HETATM 2801 O O   . HOH J 6 .   ? 20.183 25.690  -33.263 1.000 68.463  0 247 HOH FFF O   1 ? 
HETATM 2802 O O   . HOH J 6 .   ? 11.800 50.775  -34.311 1.000 62.841  0 248 HOH FFF O   1 ? 
HETATM 2803 O O   . HOH J 6 .   ? 28.000 22.535  -23.057 1.000 45.253  0 249 HOH FFF O   1 ? 
HETATM 2804 O O   . HOH J 6 .   ? 10.623 30.214  -19.830 1.000 39.125  0 250 HOH FFF O   1 ? 
HETATM 2805 O O   . HOH J 6 .   ? 27.581 44.017  -38.130 1.000 46.016  0 251 HOH FFF O   1 ? 
HETATM 2806 O O   . HOH J 6 .   ? 20.469 36.585  -36.844 1.000 54.782  0 252 HOH FFF O   1 ? 
HETATM 2807 O O   . HOH J 6 .   ? 24.343 54.607  -40.666 1.000 66.260  0 253 HOH FFF O   1 ? 
HETATM 2808 O O   . HOH J 6 .   ? 42.299 32.127  -18.370 1.000 69.199  0 254 HOH FFF O   1 ? 
HETATM 2809 O O   . HOH J 6 .   ? 22.610 19.727  -22.500 1.000 39.650  0 255 HOH FFF O   1 ? 
HETATM 2810 O O   . HOH J 6 .   ? 23.720 23.666  -33.298 1.000 63.795  0 256 HOH FFF O   1 ? 
HETATM 2811 O O   . HOH J 6 .   ? 15.409 64.445  -36.489 1.000 84.423  0 257 HOH FFF O   1 ? 
HETATM 2812 O O   . HOH J 6 .   ? 12.354 32.870  -29.944 1.000 60.475  0 258 HOH FFF O   1 ? 
HETATM 2813 O O   . HOH J 6 .   ? 22.654 22.058  -21.072 1.000 44.763  0 259 HOH FFF 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   . ASN A 5   ? 0.770 0.956 0.888 0.261  -0.047 -0.129 334 ASN EEE N   
2    C CA  . ASN A 5   ? 0.761 0.926 0.829 0.188  -0.031 -0.100 334 ASN EEE CA  
3    C C   . ASN A 5   ? 0.677 0.804 0.687 0.104  -0.066 -0.064 334 ASN EEE C   
4    O O   . ASN A 5   ? 0.662 0.710 0.633 0.142  -0.077 -0.062 334 ASN EEE O   
5    C CB  . ASN A 5   ? 0.884 0.910 0.897 0.218  0.023  -0.144 334 ASN EEE CB  
6    C CG  . ASN A 5   ? 1.048 0.958 0.877 0.239  0.039  -0.108 334 ASN EEE CG  
7    O OD1 . ASN A 5   ? 1.167 0.939 0.962 0.229  0.091  -0.095 334 ASN EEE OD1 
8    N ND2 . ASN A 5   ? 1.105 0.931 1.045 0.261  0.040  -0.161 334 ASN EEE ND2 
9    N N   . LEU A 6   ? 0.602 0.756 0.634 0.041  -0.047 0.001  335 LEU EEE N   
10   C CA  . LEU A 6   ? 0.600 0.751 0.617 0.046  -0.071 0.011  335 LEU EEE CA  
11   C C   . LEU A 6   ? 0.595 0.689 0.508 0.014  -0.037 0.035  335 LEU EEE C   
12   O O   . LEU A 6   ? 0.516 0.742 0.479 0.076  -0.004 0.061  335 LEU EEE O   
13   C CB  . LEU A 6   ? 0.752 0.799 0.633 -0.010 -0.131 0.024  335 LEU EEE CB  
14   C CG  . LEU A 6   ? 0.867 0.885 0.687 -0.016 -0.082 0.029  335 LEU EEE CG  
15   C CD1 . LEU A 6   ? 0.966 0.909 0.741 -0.030 -0.117 0.065  335 LEU EEE CD1 
16   C CD2 . LEU A 6   ? 0.885 0.891 0.769 -0.045 -0.096 0.055  335 LEU EEE CD2 
17   N N   . CYS A 7   ? 0.544 0.605 0.466 0.021  -0.106 0.000  336 CYS EEE N   
18   C CA  . CYS A 7   ? 0.537 0.573 0.488 0.020  -0.080 0.025  336 CYS EEE CA  
19   C C   . CYS A 7   ? 0.550 0.569 0.466 0.022  -0.059 0.003  336 CYS EEE C   
20   O O   . CYS A 7   ? 0.529 0.550 0.513 -0.011 -0.097 -0.000 336 CYS EEE O   
21   C CB  . CYS A 7   ? 0.530 0.567 0.463 0.030  -0.066 0.003  336 CYS EEE CB  
22   S SG  . CYS A 7   ? 0.540 0.556 0.431 0.062  -0.058 -0.008 336 CYS EEE SG  
23   N N   . PRO A 8   ? 0.607 0.551 0.517 0.010  -0.029 0.053  337 PRO EEE N   
24   C CA  . PRO A 8   ? 0.618 0.565 0.530 -0.006 0.010  0.064  337 PRO EEE CA  
25   C C   . PRO A 8   ? 0.580 0.525 0.470 -0.019 0.017  0.083  337 PRO EEE C   
26   O O   . PRO A 8   ? 0.561 0.537 0.492 -0.002 0.005  0.061  337 PRO EEE O   
27   C CB  . PRO A 8   ? 0.645 0.606 0.527 -0.031 0.013  0.075  337 PRO EEE CB  
28   C CG  . PRO A 8   ? 0.654 0.614 0.508 -0.016 -0.010 0.102  337 PRO EEE CG  
29   C CD  . PRO A 8   ? 0.647 0.587 0.538 0.009  -0.036 0.068  337 PRO EEE CD  
30   N N   . PHE A 9   ? 0.525 0.493 0.459 0.007  -0.009 0.067  338 PHE EEE N   
31   C CA  . PHE A 9   ? 0.504 0.520 0.494 -0.010 0.039  0.085  338 PHE EEE CA  
32   C C   . PHE A 9   ? 0.447 0.505 0.409 0.007  0.040  0.096  338 PHE EEE C   
33   O O   . PHE A 9   ? 0.475 0.468 0.466 0.011  0.005  0.074  338 PHE EEE O   
34   C CB  . PHE A 9   ? 0.514 0.518 0.517 0.001  0.061  0.092  338 PHE EEE CB  
35   C CG  . PHE A 9   ? 0.532 0.509 0.599 -0.015 0.101  0.076  338 PHE EEE CG  
36   C CD1 . PHE A 9   ? 0.594 0.500 0.608 -0.032 0.047  0.066  338 PHE EEE CD1 
37   C CD2 . PHE A 9   ? 0.547 0.525 0.771 -0.003 0.076  0.052  338 PHE EEE CD2 
38   C CE1 . PHE A 9   ? 0.609 0.526 0.639 -0.044 0.066  0.067  338 PHE EEE CE1 
39   C CE2 . PHE A 9   ? 0.591 0.531 0.819 -0.028 0.073  0.038  338 PHE EEE CE2 
40   C CZ  . PHE A 9   ? 0.607 0.510 0.749 -0.041 0.064  0.047  338 PHE EEE CZ  
41   N N   . GLY A 10  ? 0.451 0.533 0.449 0.007  0.020  0.101  339 GLY EEE N   
42   C CA  . GLY A 10  ? 0.474 0.531 0.482 0.008  0.033  0.087  339 GLY EEE CA  
43   C C   . GLY A 10  ? 0.448 0.516 0.492 0.022  0.006  0.059  339 GLY EEE C   
44   O O   . GLY A 10  ? 0.453 0.521 0.496 -0.001 -0.013 0.019  339 GLY EEE O   
45   N N   . GLU A 11  ? 0.480 0.561 0.456 0.006  0.029  0.081  340 GLU EEE N   
46   C CA  . GLU A 11  ? 0.556 0.586 0.498 0.019  0.034  0.102  340 GLU EEE CA  
47   C C   . GLU A 11  ? 0.538 0.515 0.421 -0.006 0.046  0.086  340 GLU EEE C   
48   O O   . GLU A 11  ? 0.503 0.494 0.510 0.009  0.090  0.082  340 GLU EEE O   
49   C CB  . GLU A 11  ? 0.688 0.646 0.465 0.026  0.109  0.078  340 GLU EEE CB  
50   C CG  . GLU A 11  ? 0.744 0.773 0.611 -0.014 0.157  0.072  340 GLU EEE CG  
51   C CD  . GLU A 11  ? 0.880 0.837 0.657 -0.007 0.238  -0.001 340 GLU EEE CD  
52   O OE1 . GLU A 11  ? 0.915 0.840 0.650 -0.110 0.208  0.033  340 GLU EEE OE1 
53   O OE2 . GLU A 11  ? 0.865 0.927 0.919 -0.004 0.338  0.100  340 GLU EEE OE2 
54   N N   . VAL A 12  ? 0.461 0.525 0.391 -0.017 -0.022 0.081  341 VAL EEE N   
55   C CA  . VAL A 12  ? 0.435 0.494 0.351 -0.030 -0.051 0.045  341 VAL EEE CA  
56   C C   . VAL A 12  ? 0.425 0.458 0.357 -0.028 -0.074 0.057  341 VAL EEE C   
57   O O   . VAL A 12  ? 0.422 0.442 0.381 -0.048 -0.035 0.045  341 VAL EEE O   
58   C CB  . VAL A 12  ? 0.488 0.486 0.356 -0.039 -0.050 0.034  341 VAL EEE CB  
59   C CG1 . VAL A 12  ? 0.464 0.505 0.337 -0.085 -0.048 0.047  341 VAL EEE CG1 
60   C CG2 . VAL A 12  ? 0.492 0.457 0.408 -0.043 -0.026 0.007  341 VAL EEE CG2 
61   N N   . PHE A 13  ? 0.446 0.440 0.349 -0.034 -0.048 0.062  342 PHE EEE N   
62   C CA  . PHE A 13  ? 0.479 0.458 0.321 -0.049 -0.067 0.080  342 PHE EEE CA  
63   C C   . PHE A 13  ? 0.452 0.465 0.371 -0.053 -0.049 0.091  342 PHE EEE C   
64   O O   . PHE A 13  ? 0.452 0.451 0.418 -0.066 -0.032 0.072  342 PHE EEE O   
65   C CB  . PHE A 13  ? 0.485 0.450 0.339 -0.018 -0.079 0.078  342 PHE EEE CB  
66   C CG  . PHE A 13  ? 0.483 0.465 0.331 -0.029 -0.068 0.071  342 PHE EEE CG  
67   C CD1 . PHE A 13  ? 0.472 0.481 0.315 -0.017 -0.066 0.054  342 PHE EEE CD1 
68   C CD2 . PHE A 13  ? 0.494 0.504 0.313 -0.034 -0.080 0.049  342 PHE EEE CD2 
69   C CE1 . PHE A 13  ? 0.488 0.482 0.342 -0.025 -0.063 0.056  342 PHE EEE CE1 
70   C CE2 . PHE A 13  ? 0.492 0.461 0.274 -0.033 -0.102 0.071  342 PHE EEE CE2 
71   C CZ  . PHE A 13  ? 0.478 0.455 0.330 -0.028 -0.073 0.070  342 PHE EEE CZ  
72   N N   . ASN A 14  ? 0.448 0.512 0.317 -0.067 -0.080 0.069  343 ASN EEE N   
73   C CA  . ASN A 14  ? 0.454 0.506 0.376 -0.068 -0.046 0.066  343 ASN EEE CA  
74   C C   . ASN A 14  ? 0.424 0.507 0.379 -0.082 -0.061 0.070  343 ASN EEE C   
75   O O   . ASN A 14  ? 0.436 0.499 0.430 -0.105 -0.069 0.031  343 ASN EEE O   
76   C CB  . ASN A 14  ? 0.483 0.547 0.435 -0.037 -0.079 0.069  343 ASN EEE CB  
77   C CG  . ASN A 14  ? 0.500 0.600 0.432 -0.044 -0.148 0.040  343 ASN EEE CG  
78   O OD1 . ASN A 14  ? 0.534 0.569 0.459 -0.042 -0.132 0.048  343 ASN EEE OD1 
79   N ND2 . ASN A 14  ? 0.549 0.569 0.528 -0.044 -0.166 0.052  343 ASN EEE ND2 
80   N N   . ALA A 15  ? 0.422 0.520 0.373 -0.069 -0.046 0.050  344 ALA EEE N   
81   C CA  . ALA A 15  ? 0.449 0.525 0.361 -0.061 -0.026 0.055  344 ALA EEE CA  
82   C C   . ALA A 15  ? 0.461 0.506 0.392 -0.094 -0.047 0.081  344 ALA EEE C   
83   O O   . ALA A 15  ? 0.478 0.514 0.384 -0.080 -0.047 0.097  344 ALA EEE O   
84   C CB  . ALA A 15  ? 0.421 0.490 0.357 -0.028 -0.031 0.060  344 ALA EEE CB  
85   N N   . THR A 16  ? 0.410 0.551 0.446 -0.112 -0.031 0.078  345 THR EEE N   
86   C CA  A THR A 16  ? 0.458 0.536 0.453 -0.107 -0.032 0.088  345 THR EEE CA  
87   C CA  B THR A 16  ? 0.446 0.544 0.470 -0.103 -0.050 0.067  345 THR EEE CA  
88   C C   . THR A 16  ? 0.460 0.508 0.446 -0.096 -0.040 0.056  345 THR EEE C   
89   O O   . THR A 16  ? 0.468 0.523 0.407 -0.101 -0.070 0.054  345 THR EEE O   
90   C CB  A THR A 16  ? 0.499 0.574 0.469 -0.120 -0.004 0.104  345 THR EEE CB  
91   C CB  B THR A 16  ? 0.416 0.557 0.498 -0.101 -0.040 0.064  345 THR EEE CB  
92   O OG1 A THR A 16  ? 0.601 0.598 0.448 -0.126 0.004  0.139  345 THR EEE OG1 
93   O OG1 B THR A 16  ? 0.393 0.602 0.544 -0.100 -0.076 0.094  345 THR EEE OG1 
94   C CG2 A THR A 16  ? 0.513 0.568 0.500 -0.094 0.005  0.116  345 THR EEE CG2 
95   C CG2 B THR A 16  ? 0.417 0.555 0.531 -0.097 -0.050 0.051  345 THR EEE CG2 
96   N N   . ARG A 17  ? 0.484 0.496 0.418 -0.058 -0.050 0.093  346 ARG EEE N   
97   C CA  . ARG A 17  ? 0.466 0.497 0.442 -0.081 -0.026 0.074  346 ARG EEE CA  
98   C C   . ARG A 17  ? 0.461 0.437 0.310 -0.055 -0.001 0.080  346 ARG EEE C   
99   O O   . ARG A 17  ? 0.450 0.445 0.427 -0.045 0.021  0.055  346 ARG EEE O   
100  C CB  . ARG A 17  ? 0.511 0.535 0.478 -0.059 -0.024 0.114  346 ARG EEE CB  
101  C CG  . ARG A 17  ? 0.523 0.600 0.592 -0.007 0.039  0.037  346 ARG EEE CG  
102  C CD  . ARG A 17  ? 0.530 0.571 0.649 -0.013 0.064  0.023  346 ARG EEE CD  
103  N NE  . ARG A 17  ? 0.543 0.580 0.580 -0.010 0.096  0.046  346 ARG EEE NE  
104  C CZ  . ARG A 17  ? 0.510 0.604 0.556 0.026  0.087  0.123  346 ARG EEE CZ  
105  N NH1 . ARG A 17  ? 0.478 0.610 0.595 0.017  0.050  0.171  346 ARG EEE NH1 
106  N NH2 . ARG A 17  ? 0.528 0.523 0.501 -0.026 0.037  0.111  346 ARG EEE NH2 
107  N N   . PHE A 18  ? 0.441 0.396 0.327 -0.040 -0.052 0.045  347 PHE EEE N   
108  C CA  . PHE A 18  ? 0.395 0.430 0.294 -0.032 -0.017 0.051  347 PHE EEE CA  
109  C C   . PHE A 18  ? 0.414 0.407 0.257 -0.034 -0.017 0.058  347 PHE EEE C   
110  O O   . PHE A 18  ? 0.435 0.416 0.293 -0.020 -0.047 0.021  347 PHE EEE O   
111  C CB  . PHE A 18  ? 0.448 0.439 0.280 -0.021 -0.013 0.032  347 PHE EEE CB  
112  C CG  . PHE A 18  ? 0.435 0.441 0.275 -0.036 -0.028 0.050  347 PHE EEE CG  
113  C CD1 . PHE A 18  ? 0.434 0.485 0.283 -0.049 -0.023 0.082  347 PHE EEE CD1 
114  C CD2 . PHE A 18  ? 0.424 0.450 0.278 -0.059 -0.064 0.044  347 PHE EEE CD2 
115  C CE1 . PHE A 18  ? 0.456 0.480 0.309 -0.053 -0.043 0.057  347 PHE EEE CE1 
116  C CE2 . PHE A 18  ? 0.460 0.459 0.301 -0.050 -0.046 0.064  347 PHE EEE CE2 
117  C CZ  . PHE A 18  ? 0.460 0.490 0.253 -0.050 -0.049 0.054  347 PHE EEE CZ  
118  N N   . ALA A 19  ? 0.410 0.393 0.307 -0.006 -0.017 0.042  348 ALA EEE N   
119  C CA  . ALA A 19  ? 0.391 0.372 0.319 -0.000 -0.012 0.032  348 ALA EEE CA  
120  C C   . ALA A 19  ? 0.413 0.347 0.270 -0.002 -0.029 0.001  348 ALA EEE C   
121  O O   . ALA A 19  ? 0.455 0.418 0.282 -0.020 -0.004 0.022  348 ALA EEE O   
122  C CB  . ALA A 19  ? 0.424 0.410 0.355 -0.021 -0.014 0.002  348 ALA EEE CB  
123  N N   . SER A 20  ? 0.393 0.355 0.229 0.003  -0.011 0.006  349 SER EEE N   
124  C CA  . SER A 20  ? 0.387 0.380 0.237 -0.018 0.018  -0.017 349 SER EEE CA  
125  C C   . SER A 20  ? 0.378 0.396 0.282 -0.015 0.021  0.003  349 SER EEE C   
126  O O   . SER A 20  ? 0.397 0.402 0.277 -0.010 0.032  0.019  349 SER EEE O   
127  C CB  . SER A 20  ? 0.419 0.388 0.266 -0.024 0.002  0.007  349 SER EEE CB  
128  O OG  . SER A 20  ? 0.406 0.402 0.257 -0.035 -0.020 -0.007 349 SER EEE OG  
129  N N   . VAL A 21  ? 0.404 0.413 0.243 -0.041 0.007  -0.014 350 VAL EEE N   
130  C CA  . VAL A 21  ? 0.404 0.406 0.213 -0.045 -0.011 -0.002 350 VAL EEE CA  
131  C C   . VAL A 21  ? 0.395 0.383 0.209 -0.030 -0.014 0.008  350 VAL EEE C   
132  O O   . VAL A 21  ? 0.411 0.387 0.222 -0.014 -0.016 0.009  350 VAL EEE O   
133  C CB  . VAL A 21  ? 0.390 0.408 0.247 -0.026 0.014  -0.020 350 VAL EEE CB  
134  C CG1 . VAL A 21  ? 0.416 0.395 0.232 -0.034 0.000  -0.003 350 VAL EEE CG1 
135  C CG2 . VAL A 21  ? 0.365 0.420 0.228 -0.037 0.006  -0.022 350 VAL EEE CG2 
136  N N   . TYR A 22  ? 0.388 0.386 0.226 -0.019 -0.007 -0.015 351 TYR EEE N   
137  C CA  . TYR A 22  ? 0.388 0.391 0.239 -0.032 -0.016 -0.011 351 TYR EEE CA  
138  C C   . TYR A 22  ? 0.385 0.362 0.243 -0.026 -0.017 -0.006 351 TYR EEE C   
139  O O   . TYR A 22  ? 0.409 0.380 0.228 -0.018 -0.012 -0.018 351 TYR EEE O   
140  C CB  . TYR A 22  ? 0.390 0.402 0.253 -0.026 -0.021 -0.016 351 TYR EEE CB  
141  C CG  . TYR A 22  ? 0.380 0.405 0.258 -0.024 -0.018 -0.006 351 TYR EEE CG  
142  C CD1 . TYR A 22  ? 0.418 0.398 0.266 -0.022 -0.024 -0.018 351 TYR EEE CD1 
143  C CD2 . TYR A 22  ? 0.398 0.394 0.261 -0.013 0.005  -0.019 351 TYR EEE CD2 
144  C CE1 . TYR A 22  ? 0.420 0.422 0.287 -0.016 -0.013 -0.005 351 TYR EEE CE1 
145  C CE2 . TYR A 22  ? 0.407 0.410 0.268 -0.019 0.031  -0.029 351 TYR EEE CE2 
146  C CZ  . TYR A 22  ? 0.424 0.416 0.281 -0.020 -0.011 -0.003 351 TYR EEE CZ  
147  O OH  . TYR A 22  ? 0.446 0.435 0.275 -0.007 0.009  -0.016 351 TYR EEE OH  
148  N N   . ALA A 23  ? 0.393 0.372 0.218 -0.004 -0.021 -0.005 352 ALA EEE N   
149  C CA  . ALA A 23  ? 0.394 0.380 0.245 -0.009 -0.011 -0.009 352 ALA EEE CA  
150  C C   . ALA A 23  ? 0.378 0.367 0.276 -0.026 -0.013 0.007  352 ALA EEE C   
151  O O   . ALA A 23  ? 0.406 0.392 0.201 0.006  0.004  0.053  352 ALA EEE O   
152  C CB  . ALA A 23  ? 0.431 0.392 0.260 -0.025 -0.006 -0.008 352 ALA EEE CB  
153  N N   . TRP A 24  ? 0.394 0.383 0.274 -0.009 -0.019 0.019  353 TRP EEE N   
154  C CA  . TRP A 24  ? 0.414 0.350 0.256 -0.025 -0.015 0.012  353 TRP EEE CA  
155  C C   . TRP A 24  ? 0.424 0.367 0.245 -0.024 -0.023 0.006  353 TRP EEE C   
156  O O   . TRP A 24  ? 0.474 0.361 0.227 -0.015 -0.011 -0.021 353 TRP EEE O   
157  C CB  . TRP A 24  ? 0.415 0.353 0.229 -0.031 -0.016 0.009  353 TRP EEE CB  
158  C CG  . TRP A 24  ? 0.411 0.352 0.244 -0.025 -0.025 0.012  353 TRP EEE CG  
159  C CD1 . TRP A 24  ? 0.423 0.359 0.222 -0.027 -0.040 0.004  353 TRP EEE CD1 
160  C CD2 . TRP A 24  ? 0.434 0.365 0.238 -0.019 -0.042 0.003  353 TRP EEE CD2 
161  N NE1 . TRP A 24  ? 0.419 0.367 0.259 -0.028 -0.041 0.012  353 TRP EEE NE1 
162  C CE2 . TRP A 24  ? 0.432 0.370 0.214 -0.021 -0.030 0.004  353 TRP EEE CE2 
163  C CE3 . TRP A 24  ? 0.469 0.370 0.208 0.004  -0.039 -0.019 353 TRP EEE CE3 
164  C CZ2 . TRP A 24  ? 0.410 0.392 0.215 -0.013 -0.031 -0.029 353 TRP EEE CZ2 
165  C CZ3 . TRP A 24  ? 0.447 0.384 0.197 0.007  -0.030 -0.039 353 TRP EEE CZ3 
166  C CH2 . TRP A 24  ? 0.444 0.375 0.275 -0.000 -0.037 -0.026 353 TRP EEE CH2 
167  N N   . ASN A 25  ? 0.434 0.408 0.221 0.005  -0.017 0.008  354 ASN EEE N   
168  C CA  . ASN A 25  ? 0.456 0.409 0.228 0.020  0.011  0.027  354 ASN EEE CA  
169  C C   . ASN A 25  ? 0.449 0.393 0.285 0.017  0.008  -0.019 354 ASN EEE C   
170  O O   . ASN A 25  ? 0.456 0.394 0.283 0.006  -0.013 -0.002 354 ASN EEE O   
171  C CB  . ASN A 25  ? 0.461 0.385 0.305 0.032  0.009  0.014  354 ASN EEE CB  
172  C CG  . ASN A 25  ? 0.465 0.393 0.322 0.031  0.009  0.034  354 ASN EEE CG  
173  O OD1 . ASN A 25  ? 0.547 0.414 0.295 0.017  0.014  0.021  354 ASN EEE OD1 
174  N ND2 . ASN A 25  ? 0.460 0.427 0.371 -0.017 0.005  0.069  354 ASN EEE ND2 
175  N N   . ARG A 26  ? 0.515 0.438 0.185 0.014  0.010  -0.005 355 ARG EEE N   
176  C CA  . ARG A 26  ? 0.486 0.447 0.229 0.010  -0.001 0.045  355 ARG EEE CA  
177  C C   . ARG A 26  ? 0.508 0.455 0.243 0.007  0.022  0.034  355 ARG EEE C   
178  O O   . ARG A 26  ? 0.535 0.451 0.239 0.051  0.034  0.060  355 ARG EEE O   
179  C CB  . ARG A 26  ? 0.460 0.456 0.260 0.040  -0.013 0.018  355 ARG EEE CB  
180  C CG  . ARG A 26  ? 0.455 0.448 0.266 0.041  -0.033 0.006  355 ARG EEE CG  
181  C CD  . ARG A 26  ? 0.460 0.463 0.331 0.028  -0.003 -0.023 355 ARG EEE CD  
182  N NE  . ARG A 26  ? 0.466 0.447 0.237 -0.005 -0.048 -0.024 355 ARG EEE NE  
183  C CZ  . ARG A 26  ? 0.464 0.500 0.406 -0.006 -0.048 -0.092 355 ARG EEE CZ  
184  N NH1 . ARG A 26  ? 0.557 0.591 0.424 -0.036 -0.030 -0.145 355 ARG EEE NH1 
185  N NH2 . ARG A 26  ? 0.519 0.542 0.417 -0.012 -0.019 -0.089 355 ARG EEE NH2 
186  N N   . LYS A 27  ? 0.491 0.472 0.262 -0.003 0.003  0.046  356 LYS EEE N   
187  C CA  . LYS A 27  ? 0.492 0.475 0.321 0.008  0.005  0.039  356 LYS EEE CA  
188  C C   . LYS A 27  ? 0.449 0.473 0.328 0.010  0.011  0.016  356 LYS EEE C   
189  O O   . LYS A 27  ? 0.449 0.453 0.293 0.024  -0.016 0.019  356 LYS EEE O   
190  C CB  . LYS A 27  ? 0.469 0.502 0.414 -0.007 -0.012 0.031  356 LYS EEE CB  
191  C CG  . LYS A 27  ? 0.519 0.539 0.519 0.039  0.012  0.001  356 LYS EEE CG  
192  C CD  . LYS A 27  ? 0.588 0.597 0.594 0.018  0.053  0.031  356 LYS EEE CD  
193  C CE  . LYS A 27  ? 0.660 0.666 0.769 0.100  0.023  -0.026 356 LYS EEE CE  
194  N NZ  . LYS A 27  ? 0.659 0.698 0.920 0.099  -0.013 -0.027 356 LYS EEE NZ  
195  N N   . ARG A 28  ? 0.440 0.468 0.307 0.003  -0.013 0.022  357 ARG EEE N   
196  C CA  . ARG A 28  ? 0.476 0.468 0.334 0.021  -0.011 0.001  357 ARG EEE CA  
197  C C   . ARG A 28  ? 0.463 0.430 0.352 0.000  -0.004 0.031  357 ARG EEE C   
198  O O   . ARG A 28  ? 0.436 0.463 0.446 0.014  0.018  0.057  357 ARG EEE O   
199  C CB  . ARG A 28  ? 0.533 0.504 0.319 0.008  -0.039 0.004  357 ARG EEE CB  
200  C CG  . ARG A 28  ? 0.589 0.511 0.385 0.043  -0.004 0.017  357 ARG EEE CG  
201  C CD  . ARG A 28  ? 0.667 0.542 0.385 0.008  -0.063 0.030  357 ARG EEE CD  
202  N NE  . ARG A 28  ? 0.668 0.591 0.366 -0.012 -0.016 -0.035 357 ARG EEE NE  
203  C CZ  . ARG A 28  ? 0.620 0.562 0.436 -0.014 -0.006 -0.041 357 ARG EEE CZ  
204  N NH1 . ARG A 28  ? 0.671 0.542 0.488 -0.077 0.025  -0.050 357 ARG EEE NH1 
205  N NH2 . ARG A 28  ? 0.699 0.553 0.468 -0.042 -0.046 0.019  357 ARG EEE NH2 
206  N N   . ILE A 29  ? 0.485 0.447 0.327 0.019  -0.019 0.034  358 ILE EEE N   
207  C CA  . ILE A 29  ? 0.483 0.495 0.390 0.048  -0.022 0.032  358 ILE EEE CA  
208  C C   . ILE A 29  ? 0.508 0.497 0.342 0.057  -0.028 0.037  358 ILE EEE C   
209  O O   . ILE A 29  ? 0.539 0.495 0.402 0.039  -0.021 0.047  358 ILE EEE O   
210  C CB  . ILE A 29  ? 0.504 0.513 0.379 0.065  0.005  0.048  358 ILE EEE CB  
211  C CG1 . ILE A 29  ? 0.554 0.511 0.485 0.058  -0.006 0.073  358 ILE EEE CG1 
212  C CG2 . ILE A 29  ? 0.529 0.532 0.417 0.064  -0.021 0.057  358 ILE EEE CG2 
213  C CD1 . ILE A 29  ? 0.578 0.551 0.535 0.047  0.008  0.101  358 ILE EEE CD1 
214  N N   . SER A 30  ? 0.519 0.537 0.388 0.066  -0.019 0.035  359 SER EEE N   
215  C CA  . SER A 30  ? 0.539 0.571 0.398 0.087  -0.040 0.003  359 SER EEE CA  
216  C C   . SER A 30  ? 0.550 0.586 0.412 0.106  -0.077 -0.005 359 SER EEE C   
217  O O   . SER A 30  ? 0.559 0.578 0.485 0.106  -0.038 0.032  359 SER EEE O   
218  C CB  . SER A 30  ? 0.540 0.660 0.401 0.076  -0.047 0.030  359 SER EEE CB  
219  O OG  . SER A 30  ? 0.581 0.700 0.441 0.073  0.035  0.004  359 SER EEE OG  
220  N N   . ASN A 31  ? 0.593 0.588 0.460 0.112  -0.058 -0.052 360 ASN EEE N   
221  C CA  . ASN A 31  ? 0.631 0.617 0.557 0.168  -0.081 -0.066 360 ASN EEE CA  
222  C C   . ASN A 31  ? 0.585 0.596 0.491 0.147  -0.038 -0.062 360 ASN EEE C   
223  O O   . ASN A 31  ? 0.569 0.651 0.502 0.137  -0.068 -0.010 360 ASN EEE O   
224  C CB  . ASN A 31  ? 0.698 0.742 0.564 0.183  -0.033 -0.073 360 ASN EEE CB  
225  C CG  . ASN A 31  ? 0.864 0.737 0.759 0.223  -0.101 -0.094 360 ASN EEE CG  
226  O OD1 . ASN A 31  ? 1.018 1.091 0.854 0.080  -0.187 -0.080 360 ASN EEE OD1 
227  N ND2 . ASN A 31  ? 0.751 0.822 0.892 0.276  -0.169 -0.170 360 ASN EEE ND2 
228  N N   . CYS A 32  ? 0.566 0.611 0.499 0.107  -0.062 -0.034 361 CYS EEE N   
229  C CA  . CYS A 32  ? 0.579 0.580 0.444 0.113  -0.060 -0.015 361 CYS EEE CA  
230  C C   . CYS A 32  ? 0.578 0.556 0.463 0.105  -0.105 0.000  361 CYS EEE C   
231  O O   . CYS A 32  ? 0.615 0.545 0.407 0.081  -0.135 0.028  361 CYS EEE O   
232  C CB  . CYS A 32  ? 0.591 0.592 0.443 0.093  -0.046 -0.007 361 CYS EEE CB  
233  S SG  . CYS A 32  ? 0.599 0.572 0.417 0.099  -0.066 -0.013 361 CYS EEE SG  
234  N N   . VAL A 33  ? 0.570 0.575 0.490 0.107  -0.132 0.030  362 VAL EEE N   
235  C CA  . VAL A 33  ? 0.627 0.554 0.486 0.084  -0.140 0.044  362 VAL EEE CA  
236  C C   . VAL A 33  ? 0.620 0.530 0.458 0.073  -0.151 0.053  362 VAL EEE C   
237  O O   . VAL A 33  ? 0.678 0.536 0.452 0.037  -0.107 0.007  362 VAL EEE O   
238  C CB  . VAL A 33  ? 0.624 0.620 0.556 0.097  -0.145 0.045  362 VAL EEE CB  
239  C CG1 . VAL A 33  ? 0.680 0.637 0.552 0.087  -0.129 0.077  362 VAL EEE CG1 
240  C CG2 . VAL A 33  ? 0.691 0.626 0.621 0.117  -0.104 0.049  362 VAL EEE CG2 
241  N N   . ALA A 34  ? 0.669 0.568 0.464 0.057  -0.129 0.047  363 ALA EEE N   
242  C CA  . ALA A 34  ? 0.727 0.617 0.391 0.045  -0.106 0.029  363 ALA EEE CA  
243  C C   . ALA A 34  ? 0.776 0.654 0.412 0.028  -0.137 0.006  363 ALA EEE C   
244  O O   . ALA A 34  ? 0.895 0.732 0.394 0.017  -0.123 0.094  363 ALA EEE O   
245  C CB  . ALA A 34  ? 0.717 0.640 0.422 0.052  -0.117 0.027  363 ALA EEE CB  
246  N N   . ASP A 35  ? 0.758 0.730 0.494 0.033  -0.174 -0.060 364 ASP EEE N   
247  C CA  . ASP A 35  ? 0.767 0.778 0.472 0.085  -0.153 -0.094 364 ASP EEE CA  
248  C C   . ASP A 35  ? 0.660 0.715 0.481 0.101  -0.199 -0.002 364 ASP EEE C   
249  O O   . ASP A 35  ? 0.678 0.739 0.474 0.068  -0.177 -0.047 364 ASP EEE O   
250  C CB  . ASP A 35  ? 0.804 0.902 0.548 0.030  -0.140 -0.094 364 ASP EEE CB  
251  C CG  . ASP A 35  ? 0.864 0.968 0.577 0.021  -0.198 -0.074 364 ASP EEE CG  
252  O OD1 . ASP A 35  ? 0.915 1.107 0.615 0.026  -0.134 -0.080 364 ASP EEE OD1 
253  O OD2 . ASP A 35  ? 0.884 1.006 0.650 -0.040 -0.206 -0.011 364 ASP EEE OD2 
254  N N   . TYR A 36  ? 0.727 0.635 0.362 0.099  -0.154 0.004  365 TYR EEE N   
255  C CA  . TYR A 36  ? 0.732 0.586 0.334 0.048  -0.130 0.028  365 TYR EEE CA  
256  C C   . TYR A 36  ? 0.745 0.581 0.369 0.044  -0.186 0.025  365 TYR EEE C   
257  O O   . TYR A 36  ? 0.756 0.595 0.351 0.104  -0.208 0.086  365 TYR EEE O   
258  C CB  . TYR A 36  ? 0.791 0.560 0.327 -0.004 -0.102 0.014  365 TYR EEE CB  
259  C CG  . TYR A 36  ? 0.760 0.558 0.386 -0.022 -0.124 -0.003 365 TYR EEE CG  
260  C CD1 . TYR A 36  ? 0.695 0.561 0.374 -0.018 -0.099 -0.030 365 TYR EEE CD1 
261  C CD2 . TYR A 36  ? 0.770 0.582 0.382 -0.011 -0.143 -0.037 365 TYR EEE CD2 
262  C CE1 . TYR A 36  ? 0.715 0.584 0.454 0.002  -0.197 -0.012 365 TYR EEE CE1 
263  C CE2 . TYR A 36  ? 0.717 0.614 0.450 -0.034 -0.187 -0.058 365 TYR EEE CE2 
264  C CZ  . TYR A 36  ? 0.745 0.607 0.452 0.001  -0.169 -0.054 365 TYR EEE CZ  
265  O OH  . TYR A 36  ? 0.633 0.749 0.522 0.018  -0.179 -0.138 365 TYR EEE OH  
266  N N   . SER A 37  ? 0.713 0.589 0.418 0.039  -0.167 0.039  366 SER EEE N   
267  C CA  . SER A 37  ? 0.635 0.609 0.404 0.028  -0.180 0.057  366 SER EEE CA  
268  C C   . SER A 37  ? 0.597 0.657 0.332 0.017  -0.112 0.015  366 SER EEE C   
269  O O   . SER A 37  ? 0.649 0.749 0.292 0.081  -0.065 0.017  366 SER EEE O   
270  C CB  . SER A 37  ? 0.642 0.655 0.487 0.064  -0.135 0.005  366 SER EEE CB  
271  O OG  . SER A 37  ? 0.641 0.658 0.555 -0.020 -0.155 -0.006 366 SER EEE OG  
272  N N   . VAL A 38  ? 0.538 0.689 0.390 -0.041 -0.040 -0.002 367 VAL EEE N   
273  C CA  . VAL A 38  ? 0.562 0.675 0.420 -0.025 -0.114 0.035  367 VAL EEE CA  
274  C C   . VAL A 38  ? 0.502 0.722 0.425 -0.095 -0.054 0.011  367 VAL EEE C   
275  O O   . VAL A 38  ? 0.570 0.639 0.532 -0.074 -0.069 0.102  367 VAL EEE O   
276  C CB  . VAL A 38  ? 0.628 0.730 0.568 -0.021 0.023  0.034  367 VAL EEE CB  
277  C CG1 . VAL A 38  ? 0.730 0.730 0.661 -0.001 -0.022 0.053  367 VAL EEE CG1 
278  C CG2 . VAL A 38  ? 0.645 0.796 0.658 0.014  0.029  0.008  367 VAL EEE CG2 
279  N N   . LEU A 39  ? 0.498 0.659 0.368 -0.062 -0.096 0.040  368 LEU EEE N   
280  C CA  . LEU A 39  ? 0.537 0.603 0.320 -0.037 -0.098 0.036  368 LEU EEE CA  
281  C C   . LEU A 39  ? 0.512 0.585 0.358 -0.082 -0.094 0.082  368 LEU EEE C   
282  O O   . LEU A 39  ? 0.596 0.598 0.408 -0.067 0.024  0.065  368 LEU EEE O   
283  C CB  . LEU A 39  ? 0.526 0.594 0.379 -0.075 -0.090 0.042  368 LEU EEE CB  
284  C CG  . LEU A 39  ? 0.494 0.597 0.368 -0.070 -0.085 0.061  368 LEU EEE CG  
285  C CD1 . LEU A 39  ? 0.539 0.537 0.387 -0.070 -0.090 0.080  368 LEU EEE CD1 
286  C CD2 . LEU A 39  ? 0.518 0.631 0.329 -0.046 -0.094 0.133  368 LEU EEE CD2 
287  N N   . TYR A 40  ? 0.561 0.597 0.389 -0.111 -0.109 0.059  369 TYR EEE N   
288  C CA  . TYR A 40  ? 0.598 0.648 0.380 -0.105 -0.073 0.029  369 TYR EEE CA  
289  C C   . TYR A 40  ? 0.585 0.567 0.365 -0.095 -0.072 0.099  369 TYR EEE C   
290  O O   . TYR A 40  ? 0.580 0.747 0.378 -0.162 -0.069 0.019  369 TYR EEE O   
291  C CB  . TYR A 40  ? 0.766 0.627 0.439 -0.084 -0.020 0.106  369 TYR EEE CB  
292  C CG  . TYR A 40  ? 0.851 0.696 0.656 -0.046 -0.055 0.041  369 TYR EEE CG  
293  C CD1 . TYR A 40  ? 1.017 0.723 0.641 -0.070 -0.108 0.015  369 TYR EEE CD1 
294  C CD2 . TYR A 40  ? 1.022 0.770 0.683 -0.052 -0.068 -0.004 369 TYR EEE CD2 
295  C CE1 . TYR A 40  ? 1.090 0.752 0.735 -0.021 -0.142 0.077  369 TYR EEE CE1 
296  C CE2 . TYR A 40  ? 1.078 0.712 0.746 -0.054 -0.145 -0.021 369 TYR EEE CE2 
297  C CZ  . TYR A 40  ? 1.090 0.667 0.797 0.005  -0.128 0.059  369 TYR EEE CZ  
298  O OH  . TYR A 40  ? 1.056 0.810 0.810 0.096  -0.192 0.103  369 TYR EEE OH  
299  N N   . ASN A 41  ? 0.580 0.623 0.436 -0.096 -0.130 0.032  370 ASN EEE N   
300  C CA  . ASN A 41  ? 0.587 0.605 0.418 -0.081 -0.101 0.005  370 ASN EEE CA  
301  C C   . ASN A 41  ? 0.609 0.594 0.407 -0.092 -0.097 0.020  370 ASN EEE C   
302  O O   . ASN A 41  ? 0.668 0.675 0.410 -0.070 -0.144 0.036  370 ASN EEE O   
303  C CB  . ASN A 41  ? 0.599 0.621 0.509 -0.062 -0.167 0.011  370 ASN EEE CB  
304  C CG  . ASN A 41  ? 0.695 0.640 0.525 -0.030 -0.175 0.050  370 ASN EEE CG  
305  O OD1 . ASN A 41  ? 0.742 0.615 0.576 -0.021 -0.146 0.054  370 ASN EEE OD1 
306  N ND2 . ASN A 41  ? 0.738 0.729 0.594 0.002  -0.149 0.051  370 ASN EEE ND2 
307  N N   . SER A 42  ? 0.627 0.606 0.415 -0.083 -0.060 0.048  371 SER EEE N   
308  C CA  . SER A 42  ? 0.644 0.582 0.345 -0.037 -0.102 0.031  371 SER EEE CA  
309  C C   . SER A 42  ? 0.556 0.593 0.358 -0.105 -0.081 0.007  371 SER EEE C   
310  O O   . SER A 42  ? 0.551 0.568 0.293 -0.109 -0.045 -0.038 371 SER EEE O   
311  C CB  . SER A 42  ? 0.701 0.612 0.396 -0.042 -0.145 0.090  371 SER EEE CB  
312  O OG  . SER A 42  ? 0.743 0.603 0.450 -0.083 -0.238 0.126  371 SER EEE OG  
313  N N   . ALA A 43  ? 0.563 0.555 0.358 -0.079 -0.101 0.016  372 ALA EEE N   
314  C CA  . ALA A 43  ? 0.581 0.602 0.339 -0.072 -0.115 -0.018 372 ALA EEE CA  
315  C C   . ALA A 43  ? 0.554 0.599 0.336 -0.079 -0.077 -0.001 372 ALA EEE C   
316  O O   . ALA A 43  ? 0.604 0.670 0.372 0.017  -0.048 -0.001 372 ALA EEE O   
317  C CB  . ALA A 43  ? 0.632 0.599 0.305 -0.089 -0.134 0.002  372 ALA EEE CB  
318  N N   . SER A 44  ? 0.530 0.633 0.339 -0.090 -0.113 0.004  373 SER EEE N   
319  C CA  . SER A 44  ? 0.555 0.624 0.387 -0.082 -0.093 0.017  373 SER EEE CA  
320  C C   . SER A 44  ? 0.523 0.515 0.477 -0.099 -0.028 0.028  373 SER EEE C   
321  O O   . SER A 44  ? 0.547 0.511 0.598 -0.100 -0.053 0.060  373 SER EEE O   
322  C CB  . SER A 44  ? 0.555 0.725 0.448 -0.105 -0.038 0.019  373 SER EEE CB  
323  O OG  . SER A 44  ? 0.575 0.887 0.374 -0.120 -0.102 0.030  373 SER EEE OG  
324  N N   . PHE A 45  ? 0.504 0.474 0.255 -0.032 -0.014 0.085  374 PHE EEE N   
325  C CA  . PHE A 45  ? 0.490 0.450 0.280 -0.064 -0.036 0.048  374 PHE EEE CA  
326  C C   . PHE A 45  ? 0.477 0.449 0.304 -0.063 -0.042 0.049  374 PHE EEE C   
327  O O   . PHE A 45  ? 0.475 0.567 0.288 -0.088 -0.055 0.065  374 PHE EEE O   
328  C CB  . PHE A 45  ? 0.461 0.449 0.326 -0.064 -0.037 0.067  374 PHE EEE CB  
329  C CG  . PHE A 45  ? 0.463 0.449 0.251 -0.056 -0.076 0.052  374 PHE EEE CG  
330  C CD1 . PHE A 45  ? 0.459 0.454 0.275 -0.063 -0.044 0.064  374 PHE EEE CD1 
331  C CD2 . PHE A 45  ? 0.498 0.463 0.312 -0.043 -0.055 0.071  374 PHE EEE CD2 
332  C CE1 . PHE A 45  ? 0.446 0.496 0.319 -0.036 -0.042 0.046  374 PHE EEE CE1 
333  C CE2 . PHE A 45  ? 0.496 0.463 0.310 -0.035 -0.060 0.050  374 PHE EEE CE2 
334  C CZ  . PHE A 45  ? 0.472 0.470 0.324 -0.047 -0.039 0.059  374 PHE EEE CZ  
335  N N   . SER A 46  ? 0.494 0.435 0.315 -0.054 -0.064 0.008  375 SER EEE N   
336  C CA  . SER A 46  ? 0.521 0.486 0.376 -0.086 -0.027 -0.005 375 SER EEE CA  
337  C C   . SER A 46  ? 0.523 0.464 0.327 -0.085 -0.031 -0.003 375 SER EEE C   
338  O O   . SER A 46  ? 0.565 0.579 0.308 -0.149 -0.035 -0.019 375 SER EEE O   
339  C CB  . SER A 46  ? 0.544 0.483 0.486 -0.088 -0.027 -0.006 375 SER EEE CB  
340  O OG  . SER A 46  ? 0.556 0.517 0.538 -0.059 0.020  0.079  375 SER EEE OG  
341  N N   . THR A 47  ? 0.538 0.427 0.284 -0.090 -0.055 0.057  376 THR EEE N   
342  C CA  . THR A 47  ? 0.519 0.448 0.306 -0.093 -0.062 0.070  376 THR EEE CA  
343  C C   . THR A 47  ? 0.531 0.423 0.295 -0.108 -0.096 0.063  376 THR EEE C   
344  O O   . THR A 47  ? 0.548 0.462 0.282 -0.101 -0.087 0.052  376 THR EEE O   
345  C CB  . THR A 47  ? 0.495 0.468 0.286 -0.082 -0.035 0.078  376 THR EEE CB  
346  O OG1 . THR A 47  ? 0.517 0.500 0.301 -0.075 -0.055 0.048  376 THR EEE OG1 
347  C CG2 . THR A 47  ? 0.533 0.473 0.345 -0.090 -0.034 0.082  376 THR EEE CG2 
348  N N   . PHE A 48  ? 0.552 0.452 0.269 -0.116 -0.100 0.089  377 PHE EEE N   
349  C CA  . PHE A 48  ? 0.592 0.449 0.280 -0.109 -0.121 0.089  377 PHE EEE CA  
350  C C   . PHE A 48  ? 0.590 0.457 0.336 -0.110 -0.108 0.097  377 PHE EEE C   
351  O O   . PHE A 48  ? 0.631 0.502 0.300 -0.119 -0.085 0.100  377 PHE EEE O   
352  C CB  . PHE A 48  ? 0.597 0.460 0.337 -0.099 -0.123 0.102  377 PHE EEE CB  
353  C CG  . PHE A 48  ? 0.589 0.469 0.346 -0.104 -0.087 0.106  377 PHE EEE CG  
354  C CD1 . PHE A 48  ? 0.639 0.457 0.389 -0.090 -0.087 0.084  377 PHE EEE CD1 
355  C CD2 . PHE A 48  ? 0.555 0.492 0.488 -0.100 -0.111 0.028  377 PHE EEE CD2 
356  C CE1 . PHE A 48  ? 0.612 0.488 0.377 -0.109 -0.087 0.069  377 PHE EEE CE1 
357  C CE2 . PHE A 48  ? 0.576 0.519 0.582 -0.080 -0.111 -0.005 377 PHE EEE CE2 
358  C CZ  . PHE A 48  ? 0.538 0.505 0.472 -0.053 -0.143 0.019  377 PHE EEE CZ  
359  N N   . LYS A 49  ? 0.642 0.490 0.275 -0.151 -0.114 0.052  378 LYS EEE N   
360  C CA  . LYS A 49  ? 0.647 0.509 0.272 -0.161 -0.123 0.055  378 LYS EEE CA  
361  C C   . LYS A 49  ? 0.680 0.484 0.274 -0.147 -0.108 0.061  378 LYS EEE C   
362  O O   . LYS A 49  ? 0.689 0.503 0.292 -0.178 -0.108 0.094  378 LYS EEE O   
363  C CB  . LYS A 49  ? 0.716 0.631 0.322 -0.085 -0.153 0.078  378 LYS EEE CB  
364  C CG  . LYS A 49  ? 0.720 0.711 0.397 -0.055 -0.092 0.086  378 LYS EEE CG  
365  C CD  . LYS A 49  ? 0.713 0.792 0.459 -0.019 -0.124 0.112  378 LYS EEE CD  
366  C CE  . LYS A 49  ? 0.684 0.830 0.524 -0.020 -0.091 0.092  378 LYS EEE CE  
367  N NZ  . LYS A 49  ? 0.657 0.802 0.335 -0.097 -0.123 0.197  378 LYS EEE NZ  
368  N N   . CYS A 50  ? 0.684 0.483 0.271 -0.152 -0.129 0.058  379 CYS EEE N   
369  C CA  . CYS A 50  ? 0.672 0.443 0.275 -0.175 -0.119 0.073  379 CYS EEE CA  
370  C C   . CYS A 50  ? 0.659 0.511 0.272 -0.171 -0.092 0.054  379 CYS EEE C   
371  O O   . CYS A 50  ? 0.755 0.496 0.259 -0.196 -0.098 0.048  379 CYS EEE O   
372  C CB  . CYS A 50  ? 0.666 0.522 0.311 -0.160 -0.120 0.055  379 CYS EEE CB  
373  S SG  . CYS A 50  ? 0.677 0.540 0.345 -0.162 -0.130 0.096  379 CYS EEE SG  
374  N N   . TYR A 51  ? 0.666 0.507 0.283 -0.167 -0.107 0.059  380 TYR EEE N   
375  C CA  . TYR A 51  ? 0.652 0.575 0.349 -0.169 -0.078 0.016  380 TYR EEE CA  
376  C C   . TYR A 51  ? 0.785 0.601 0.464 -0.147 -0.101 -0.022 380 TYR EEE C   
377  O O   . TYR A 51  ? 0.926 0.833 0.607 -0.161 -0.011 -0.185 380 TYR EEE O   
378  C CB  . TYR A 51  ? 0.634 0.535 0.324 -0.150 -0.045 0.019  380 TYR EEE CB  
379  C CG  . TYR A 51  ? 0.577 0.548 0.278 -0.159 -0.049 0.004  380 TYR EEE CG  
380  C CD1 . TYR A 51  ? 0.570 0.499 0.279 -0.139 -0.079 0.003  380 TYR EEE CD1 
381  C CD2 . TYR A 51  ? 0.561 0.571 0.324 -0.093 -0.038 0.049  380 TYR EEE CD2 
382  C CE1 . TYR A 51  ? 0.512 0.470 0.326 -0.129 -0.084 0.055  380 TYR EEE CE1 
383  C CE2 . TYR A 51  ? 0.566 0.544 0.348 -0.144 -0.048 0.063  380 TYR EEE CE2 
384  C CZ  . TYR A 51  ? 0.545 0.495 0.302 -0.126 -0.073 0.037  380 TYR EEE CZ  
385  O OH  . TYR A 51  ? 0.562 0.485 0.346 -0.088 -0.039 0.062  380 TYR EEE OH  
386  N N   . GLY A 52  ? 0.909 0.614 0.729 -0.186 0.003  0.072  381 GLY EEE N   
387  C CA  . GLY A 52  ? 1.010 0.695 0.892 -0.149 -0.049 -0.079 381 GLY EEE CA  
388  C C   . GLY A 52  ? 0.975 0.842 0.776 -0.188 -0.099 -0.104 381 GLY EEE C   
389  O O   . GLY A 52  ? 1.152 0.962 0.480 -0.205 -0.162 0.159  381 GLY EEE O   
390  N N   . VAL A 53  ? 0.950 0.793 0.908 -0.130 -0.165 -0.102 382 VAL EEE N   
391  C CA  . VAL A 53  ? 0.967 0.776 0.772 -0.154 -0.146 -0.075 382 VAL EEE CA  
392  C C   . VAL A 53  ? 0.902 0.661 0.649 -0.176 -0.131 0.064  382 VAL EEE C   
393  O O   . VAL A 53  ? 0.861 0.629 0.554 -0.245 -0.103 0.094  382 VAL EEE O   
394  C CB  . VAL A 53  ? 1.029 0.892 0.722 -0.108 -0.209 -0.150 382 VAL EEE CB  
395  C CG1 . VAL A 53  ? 1.064 0.928 0.645 -0.092 -0.282 -0.128 382 VAL EEE CG1 
396  C CG2 . VAL A 53  ? 1.049 1.002 0.853 -0.099 -0.178 -0.186 382 VAL EEE CG2 
397  N N   . SER A 54  ? 0.813 0.591 0.651 -0.211 -0.051 0.009  383 SER EEE N   
398  C CA  . SER A 54  ? 0.819 0.673 0.428 -0.178 -0.091 0.087  383 SER EEE CA  
399  C C   . SER A 54  ? 0.839 0.698 0.423 -0.138 -0.058 0.078  383 SER EEE C   
400  O O   . SER A 54  ? 0.756 0.548 0.403 -0.162 -0.132 0.151  383 SER EEE O   
401  C CB  . SER A 54  ? 0.938 0.789 0.406 -0.199 -0.069 0.099  383 SER EEE CB  
402  O OG  . SER A 54  ? 0.965 0.768 0.408 -0.260 -0.140 -0.025 383 SER EEE OG  
403  N N   . PRO A 55  ? 0.869 0.710 0.574 -0.153 -0.041 -0.019 384 PRO EEE N   
404  C CA  . PRO A 55  ? 0.816 0.797 0.608 -0.150 -0.084 -0.003 384 PRO EEE CA  
405  C C   . PRO A 55  ? 0.761 0.922 0.492 -0.140 -0.156 0.074  384 PRO EEE C   
406  O O   . PRO A 55  ? 0.743 1.138 0.543 -0.051 -0.187 0.078  384 PRO EEE O   
407  C CB  . PRO A 55  ? 0.819 0.744 0.724 -0.107 -0.074 0.009  384 PRO EEE CB  
408  C CG  . PRO A 55  ? 0.870 0.687 0.770 -0.082 -0.009 0.079  384 PRO EEE CG  
409  C CD  . PRO A 55  ? 0.904 0.695 0.701 -0.096 0.002  0.035  384 PRO EEE CD  
410  N N   . THR A 56  ? 0.861 1.003 0.523 -0.098 -0.154 0.153  385 THR EEE N   
411  C CA  . THR A 56  ? 0.827 1.114 0.575 -0.016 -0.112 0.186  385 THR EEE CA  
412  C C   . THR A 56  ? 0.852 1.049 0.593 0.079  -0.141 0.214  385 THR EEE C   
413  O O   . THR A 56  ? 0.893 1.191 0.697 0.140  -0.100 0.253  385 THR EEE O   
414  C CB  . THR A 56  ? 0.965 1.288 0.553 -0.061 -0.184 0.117  385 THR EEE CB  
415  O OG1 . THR A 56  ? 0.947 1.407 0.747 -0.044 -0.161 0.192  385 THR EEE OG1 
416  C CG2 . THR A 56  ? 1.027 1.263 0.549 -0.057 -0.114 0.117  385 THR EEE CG2 
417  N N   . LYS A 57  ? 0.866 0.876 0.615 0.051  -0.049 0.249  386 LYS EEE N   
418  C CA  . LYS A 57  ? 1.004 0.737 0.656 0.028  0.035  0.283  386 LYS EEE CA  
419  C C   . LYS A 57  ? 0.932 0.604 0.621 0.054  -0.001 0.170  386 LYS EEE C   
420  O O   . LYS A 57  ? 0.972 0.569 0.808 0.064  -0.054 0.139  386 LYS EEE O   
421  C CB  . LYS A 57  ? 1.040 0.840 0.777 0.028  0.095  0.316  386 LYS EEE CB  
422  C CG  . LYS A 57  ? 1.124 1.045 0.835 -0.025 0.185  0.301  386 LYS EEE CG  
423  C CD  . LYS A 57  ? 1.234 1.093 0.962 -0.061 0.152  0.392  386 LYS EEE CD  
424  C CE  . LYS A 57  ? 1.266 1.229 0.939 -0.060 0.158  0.432  386 LYS EEE CE  
425  N NZ  . LYS A 57  ? 1.286 1.254 1.010 -0.068 0.147  0.451  386 LYS EEE NZ  
426  N N   . LEU A 58  ? 0.857 0.568 0.460 0.029  -0.023 0.098  387 LEU EEE N   
427  C CA  . LEU A 58  ? 0.860 0.497 0.400 0.041  -0.075 0.051  387 LEU EEE CA  
428  C C   . LEU A 58  ? 0.878 0.544 0.473 0.027  -0.036 0.107  387 LEU EEE C   
429  O O   . LEU A 58  ? 0.968 0.587 0.483 0.094  0.021  0.145  387 LEU EEE O   
430  C CB  . LEU A 58  ? 0.847 0.491 0.344 0.011  -0.058 0.059  387 LEU EEE CB  
431  C CG  . LEU A 58  ? 0.853 0.512 0.341 0.019  -0.070 0.042  387 LEU EEE CG  
432  C CD1 . LEU A 58  ? 0.862 0.518 0.376 0.045  -0.067 0.053  387 LEU EEE CD1 
433  C CD2 . LEU A 58  ? 0.903 0.586 0.307 0.053  -0.081 0.031  387 LEU EEE CD2 
434  N N   . ASN A 59  ? 0.897 0.592 0.500 -0.002 -0.054 0.052  388 ASN EEE N   
435  C CA  . ASN A 59  ? 0.941 0.674 0.600 0.059  -0.043 0.018  388 ASN EEE CA  
436  C C   . ASN A 59  ? 0.923 0.649 0.633 0.106  -0.083 0.065  388 ASN EEE C   
437  O O   . ASN A 59  ? 0.916 0.706 0.786 0.148  -0.057 0.081  388 ASN EEE O   
438  C CB  . ASN A 59  ? 0.944 0.780 0.713 0.051  -0.103 -0.007 388 ASN EEE CB  
439  C CG  . ASN A 59  ? 1.085 0.804 0.819 0.004  -0.076 0.019  388 ASN EEE CG  
440  O OD1 . ASN A 59  ? 1.100 0.884 0.831 0.132  -0.106 0.124  388 ASN EEE OD1 
441  N ND2 . ASN A 59  ? 1.133 0.849 0.861 -0.025 -0.122 -0.033 388 ASN EEE ND2 
442  N N   . ASP A 60  ? 0.957 0.674 0.430 0.073  -0.135 0.077  389 ASP EEE N   
443  C CA  . ASP A 60  ? 1.037 0.684 0.535 0.059  -0.164 0.039  389 ASP EEE CA  
444  C C   . ASP A 60  ? 1.008 0.514 0.582 0.059  -0.174 0.076  389 ASP EEE C   
445  O O   . ASP A 60  ? 0.980 0.520 0.559 0.051  -0.234 0.052  389 ASP EEE O   
446  C CB  . ASP A 60  ? 1.196 0.785 0.630 0.040  -0.126 0.103  389 ASP EEE CB  
447  C CG  . ASP A 60  ? 1.272 0.904 0.601 0.084  -0.136 0.086  389 ASP EEE CG  
448  O OD1 . ASP A 60  ? 1.304 0.891 0.791 -0.014 -0.227 0.006  389 ASP EEE OD1 
449  O OD2 . ASP A 60  ? 1.271 0.914 0.702 0.259  -0.366 0.190  389 ASP EEE OD2 
450  N N   . LEU A 61  ? 0.949 0.644 0.473 0.089  -0.218 0.082  390 LEU EEE N   
451  C CA  . LEU A 61  ? 0.898 0.601 0.510 0.039  -0.181 0.078  390 LEU EEE CA  
452  C C   . LEU A 61  ? 0.846 0.528 0.483 0.051  -0.161 0.028  390 LEU EEE C   
453  O O   . LEU A 61  ? 0.838 0.531 0.505 0.051  -0.227 0.064  390 LEU EEE O   
454  C CB  . LEU A 61  ? 0.878 0.618 0.531 0.007  -0.151 0.072  390 LEU EEE CB  
455  C CG  . LEU A 61  ? 0.961 0.624 0.611 -0.034 -0.102 0.063  390 LEU EEE CG  
456  C CD1 . LEU A 61  ? 0.956 0.638 0.685 -0.021 -0.082 0.090  390 LEU EEE CD1 
457  C CD2 . LEU A 61  ? 0.950 0.621 0.636 -0.048 -0.132 0.078  390 LEU EEE CD2 
458  N N   . CYS A 62  ? 0.815 0.453 0.482 0.059  -0.166 0.062  391 CYS EEE N   
459  C CA  . CYS A 62  ? 0.731 0.485 0.471 0.095  -0.174 0.058  391 CYS EEE CA  
460  C C   . CYS A 62  ? 0.651 0.491 0.449 0.040  -0.122 0.083  391 CYS EEE C   
461  O O   . CYS A 62  ? 0.710 0.485 0.470 -0.017 -0.135 0.102  391 CYS EEE O   
462  C CB  . CYS A 62  ? 0.756 0.549 0.527 0.116  -0.156 0.033  391 CYS EEE CB  
463  S SG  . CYS A 62  ? 0.791 0.585 0.635 0.091  -0.219 0.047  391 CYS EEE SG  
464  N N   . PHE A 63  ? 0.585 0.436 0.384 0.053  -0.117 0.036  392 PHE EEE N   
465  C CA  . PHE A 63  ? 0.571 0.433 0.358 0.035  -0.105 0.039  392 PHE EEE CA  
466  C C   . PHE A 63  ? 0.535 0.418 0.356 0.013  -0.096 0.037  392 PHE EEE C   
467  O O   . PHE A 63  ? 0.523 0.408 0.396 0.024  -0.083 0.038  392 PHE EEE O   
468  C CB  . PHE A 63  ? 0.612 0.434 0.386 0.056  -0.115 0.044  392 PHE EEE CB  
469  C CG  . PHE A 63  ? 0.675 0.419 0.384 0.042  -0.097 0.049  392 PHE EEE CG  
470  C CD1 . PHE A 63  ? 0.694 0.464 0.388 0.020  -0.118 0.054  392 PHE EEE CD1 
471  C CD2 . PHE A 63  ? 0.747 0.428 0.382 0.027  -0.106 0.046  392 PHE EEE CD2 
472  C CE1 . PHE A 63  ? 0.747 0.475 0.399 0.010  -0.099 0.035  392 PHE EEE CE1 
473  C CE2 . PHE A 63  ? 0.781 0.444 0.391 0.020  -0.088 0.035  392 PHE EEE CE2 
474  C CZ  . PHE A 63  ? 0.763 0.467 0.392 0.047  -0.108 0.062  392 PHE EEE CZ  
475  N N   . THR A 64  ? 0.526 0.414 0.352 0.018  -0.079 0.040  393 THR EEE N   
476  C CA  A THR A 64  ? 0.555 0.460 0.347 0.021  -0.057 0.008  393 THR EEE CA  
477  C CA  B THR A 64  ? 0.497 0.417 0.317 0.047  -0.066 -0.011 393 THR EEE CA  
478  C C   . THR A 64  ? 0.517 0.442 0.344 0.046  -0.039 0.003  393 THR EEE C   
479  O O   . THR A 64  ? 0.546 0.419 0.398 0.002  -0.019 0.044  393 THR EEE O   
480  C CB  A THR A 64  ? 0.573 0.524 0.456 0.003  -0.086 -0.008 393 THR EEE CB  
481  C CB  B THR A 64  ? 0.460 0.328 0.275 0.069  -0.034 -0.005 393 THR EEE CB  
482  O OG1 A THR A 64  ? 0.625 0.684 0.597 0.039  -0.039 -0.036 393 THR EEE OG1 
483  O OG1 B THR A 64  ? 0.465 0.305 0.250 0.075  -0.050 0.001  393 THR EEE OG1 
484  C CG2 A THR A 64  ? 0.575 0.517 0.408 0.014  -0.083 0.007  393 THR EEE CG2 
485  C CG2 B THR A 64  ? 0.466 0.297 0.249 0.064  -0.060 -0.006 393 THR EEE CG2 
486  N N   . ASN A 65  ? 0.559 0.423 0.320 0.055  -0.024 0.022  394 ASN EEE N   
487  C CA  . ASN A 65  ? 0.544 0.420 0.339 0.049  -0.032 -0.007 394 ASN EEE CA  
488  C C   . ASN A 65  ? 0.514 0.401 0.339 0.037  -0.050 -0.004 394 ASN EEE C   
489  O O   . ASN A 65  ? 0.529 0.422 0.336 0.033  -0.057 0.017  394 ASN EEE O   
490  C CB  . ASN A 65  ? 0.568 0.415 0.326 0.035  -0.038 -0.004 394 ASN EEE CB  
491  C CG  . ASN A 65  ? 0.589 0.453 0.350 0.045  0.016  -0.002 394 ASN EEE CG  
492  O OD1 . ASN A 65  ? 0.642 0.488 0.363 0.027  0.072  0.057  394 ASN EEE OD1 
493  N ND2 . ASN A 65  ? 0.603 0.455 0.347 0.052  -0.005 -0.014 394 ASN EEE ND2 
494  N N   . VAL A 66  ? 0.476 0.409 0.326 0.028  -0.039 0.013  395 VAL EEE N   
495  C CA  . VAL A 66  ? 0.472 0.383 0.313 0.018  -0.048 0.017  395 VAL EEE CA  
496  C C   . VAL A 66  ? 0.453 0.379 0.320 0.017  -0.048 0.009  395 VAL EEE C   
497  O O   . VAL A 66  ? 0.475 0.443 0.369 -0.006 -0.026 0.029  395 VAL EEE O   
498  C CB  . VAL A 66  ? 0.513 0.400 0.312 0.051  -0.067 0.031  395 VAL EEE CB  
499  C CG1 . VAL A 66  ? 0.534 0.437 0.285 0.046  -0.088 0.017  395 VAL EEE CG1 
500  C CG2 . VAL A 66  ? 0.553 0.410 0.340 0.047  -0.076 0.045  395 VAL EEE CG2 
501  N N   . TYR A 67  ? 0.448 0.383 0.267 0.016  -0.052 0.023  396 TYR EEE N   
502  C CA  . TYR A 67  ? 0.456 0.360 0.303 0.007  -0.001 0.016  396 TYR EEE CA  
503  C C   . TYR A 67  ? 0.445 0.380 0.309 -0.011 -0.037 0.017  396 TYR EEE C   
504  O O   . TYR A 67  ? 0.536 0.410 0.289 -0.031 -0.022 -0.001 396 TYR EEE O   
505  C CB  . TYR A 67  ? 0.465 0.372 0.302 0.011  -0.007 -0.002 396 TYR EEE CB  
506  C CG  . TYR A 67  ? 0.465 0.375 0.289 0.003  -0.001 -0.003 396 TYR EEE CG  
507  C CD1 . TYR A 67  ? 0.472 0.395 0.279 0.009  -0.000 0.006  396 TYR EEE CD1 
508  C CD2 . TYR A 67  ? 0.444 0.394 0.306 -0.011 0.000  0.009  396 TYR EEE CD2 
509  C CE1 . TYR A 67  ? 0.486 0.418 0.296 -0.005 -0.008 -0.001 396 TYR EEE CE1 
510  C CE2 . TYR A 67  ? 0.500 0.450 0.278 -0.011 0.012  -0.002 396 TYR EEE CE2 
511  C CZ  . TYR A 67  ? 0.462 0.420 0.264 -0.003 -0.010 -0.004 396 TYR EEE CZ  
512  O OH  . TYR A 67  ? 0.497 0.415 0.275 0.018  -0.039 -0.009 396 TYR EEE OH  
513  N N   . ALA A 68  ? 0.453 0.385 0.297 -0.012 -0.033 0.039  397 ALA EEE N   
514  C CA  . ALA A 68  ? 0.451 0.378 0.305 0.008  -0.017 0.031  397 ALA EEE CA  
515  C C   . ALA A 68  ? 0.394 0.396 0.280 -0.006 -0.029 0.044  397 ALA EEE C   
516  O O   . ALA A 68  ? 0.477 0.407 0.292 -0.025 -0.009 0.063  397 ALA EEE O   
517  C CB  . ALA A 68  ? 0.453 0.409 0.320 0.004  -0.041 0.045  397 ALA EEE CB  
518  N N   . ASP A 69  ? 0.410 0.363 0.225 -0.023 -0.001 0.041  398 ASP EEE N   
519  C CA  . ASP A 69  ? 0.442 0.358 0.253 -0.013 -0.011 0.029  398 ASP EEE CA  
520  C C   . ASP A 69  ? 0.442 0.377 0.256 -0.039 -0.010 0.036  398 ASP EEE C   
521  O O   . ASP A 69  ? 0.544 0.428 0.243 -0.045 -0.037 0.031  398 ASP EEE O   
522  C CB  . ASP A 69  ? 0.453 0.388 0.271 -0.032 -0.027 0.047  398 ASP EEE CB  
523  C CG  . ASP A 69  ? 0.476 0.393 0.314 -0.015 -0.021 0.010  398 ASP EEE CG  
524  O OD1 . ASP A 69  ? 0.464 0.435 0.313 0.002  -0.045 0.021  398 ASP EEE OD1 
525  O OD2 . ASP A 69  ? 0.481 0.390 0.259 -0.026 -0.042 0.022  398 ASP EEE OD2 
526  N N   . SER A 70  ? 0.393 0.385 0.232 -0.045 -0.013 0.041  399 SER EEE N   
527  C CA  . SER A 70  ? 0.411 0.377 0.243 -0.032 -0.014 0.028  399 SER EEE CA  
528  C C   . SER A 70  ? 0.415 0.378 0.255 -0.010 -0.016 -0.003 399 SER EEE C   
529  O O   . SER A 70  ? 0.406 0.393 0.252 -0.007 -0.030 -0.003 399 SER EEE O   
530  C CB  . SER A 70  ? 0.407 0.390 0.292 -0.042 -0.009 0.029  399 SER EEE CB  
531  O OG  . SER A 70  ? 0.438 0.425 0.291 -0.036 0.011  0.062  399 SER EEE OG  
532  N N   . PHE A 71  ? 0.418 0.388 0.204 -0.023 -0.026 0.003  400 PHE EEE N   
533  C CA  . PHE A 71  ? 0.408 0.389 0.210 -0.022 -0.026 0.011  400 PHE EEE CA  
534  C C   . PHE A 71  ? 0.409 0.384 0.256 -0.028 -0.046 -0.013 400 PHE EEE C   
535  O O   . PHE A 71  ? 0.431 0.409 0.274 -0.022 -0.045 0.029  400 PHE EEE O   
536  C CB  . PHE A 71  ? 0.406 0.385 0.248 -0.037 -0.014 0.004  400 PHE EEE CB  
537  C CG  . PHE A 71  ? 0.400 0.390 0.250 -0.021 -0.008 0.025  400 PHE EEE CG  
538  C CD1 . PHE A 71  ? 0.385 0.388 0.269 -0.018 -0.017 0.003  400 PHE EEE CD1 
539  C CD2 . PHE A 71  ? 0.409 0.389 0.261 -0.041 -0.019 0.038  400 PHE EEE CD2 
540  C CE1 . PHE A 71  ? 0.426 0.391 0.261 -0.006 -0.008 0.023  400 PHE EEE CE1 
541  C CE2 . PHE A 71  ? 0.417 0.384 0.303 -0.048 -0.020 0.040  400 PHE EEE CE2 
542  C CZ  . PHE A 71  ? 0.438 0.384 0.291 -0.035 -0.021 0.039  400 PHE EEE CZ  
543  N N   . VAL A 72  ? 0.422 0.377 0.263 -0.028 -0.029 -0.006 401 VAL EEE N   
544  C CA  . VAL A 72  ? 0.420 0.376 0.243 -0.059 -0.043 -0.002 401 VAL EEE CA  
545  C C   . VAL A 72  ? 0.423 0.389 0.238 -0.056 -0.028 -0.014 401 VAL EEE C   
546  O O   . VAL A 72  ? 0.410 0.391 0.235 -0.027 -0.014 -0.009 401 VAL EEE O   
547  C CB  . VAL A 72  ? 0.438 0.399 0.260 -0.070 -0.014 0.025  401 VAL EEE CB  
548  C CG1 . VAL A 72  ? 0.452 0.451 0.256 -0.062 -0.036 -0.009 401 VAL EEE CG1 
549  C CG2 . VAL A 72  ? 0.435 0.432 0.241 -0.067 -0.017 0.032  401 VAL EEE CG2 
550  N N   . ILE A 73  ? 0.425 0.423 0.242 -0.048 -0.020 0.041  402 ILE EEE N   
551  C CA  . ILE A 73  ? 0.431 0.408 0.237 -0.040 -0.026 -0.001 402 ILE EEE CA  
552  C C   . ILE A 73  ? 0.460 0.404 0.257 -0.056 -0.019 -0.015 402 ILE EEE C   
553  O O   . ILE A 73  ? 0.459 0.447 0.263 -0.046 -0.013 -0.026 402 ILE EEE O   
554  C CB  . ILE A 73  ? 0.431 0.407 0.252 -0.047 -0.007 -0.007 402 ILE EEE CB  
555  C CG1 . ILE A 73  ? 0.456 0.431 0.261 -0.063 -0.003 0.010  402 ILE EEE CG1 
556  C CG2 . ILE A 73  ? 0.433 0.424 0.258 -0.052 0.001  -0.017 402 ILE EEE CG2 
557  C CD1 . ILE A 73  ? 0.463 0.445 0.277 -0.072 0.038  -0.007 402 ILE EEE CD1 
558  N N   . ARG A 74  ? 0.483 0.410 0.262 -0.046 -0.022 -0.019 403 ARG EEE N   
559  C CA  . ARG A 74  ? 0.544 0.452 0.247 -0.073 -0.027 -0.018 403 ARG EEE CA  
560  C C   . ARG A 74  ? 0.531 0.451 0.269 -0.096 -0.029 -0.010 403 ARG EEE C   
561  O O   . ARG A 74  ? 0.527 0.454 0.232 -0.098 0.026  0.013  403 ARG EEE O   
562  C CB  . ARG A 74  ? 0.560 0.520 0.240 -0.031 -0.020 -0.061 403 ARG EEE CB  
563  C CG  . ARG A 74  ? 0.573 0.562 0.302 -0.048 -0.063 -0.042 403 ARG EEE CG  
564  C CD  . ARG A 74  ? 0.619 0.536 0.450 -0.050 -0.083 -0.039 403 ARG EEE CD  
565  N NE  . ARG A 74  ? 0.648 0.705 0.553 -0.068 -0.067 -0.017 403 ARG EEE NE  
566  C CZ  . ARG A 74  ? 0.702 0.804 0.594 -0.082 -0.056 -0.040 403 ARG EEE CZ  
567  N NH1 . ARG A 74  ? 0.796 0.860 0.644 -0.094 -0.109 -0.054 403 ARG EEE NH1 
568  N NH2 . ARG A 74  ? 0.685 0.853 0.584 -0.037 -0.078 0.011  403 ARG EEE NH2 
569  N N   . GLY A 75  ? 0.616 0.472 0.251 -0.120 -0.033 -0.004 404 GLY EEE N   
570  C CA  . GLY A 75  ? 0.631 0.489 0.232 -0.103 -0.021 -0.010 404 GLY EEE CA  
571  C C   . GLY A 75  ? 0.605 0.507 0.216 -0.083 -0.021 -0.041 404 GLY EEE C   
572  O O   . GLY A 75  ? 0.600 0.525 0.267 -0.115 -0.013 0.005  404 GLY EEE O   
573  N N   . ASP A 76  ? 0.615 0.548 0.238 -0.084 -0.014 -0.018 405 ASP EEE N   
574  C CA  . ASP A 76  ? 0.648 0.559 0.283 -0.089 0.055  -0.020 405 ASP EEE CA  
575  C C   . ASP A 76  ? 0.557 0.492 0.269 -0.055 0.057  0.007  405 ASP EEE C   
576  O O   . ASP A 76  ? 0.598 0.537 0.288 -0.078 0.088  -0.023 405 ASP EEE O   
577  C CB  . ASP A 76  ? 0.715 0.565 0.471 -0.046 0.071  -0.009 405 ASP EEE CB  
578  C CG  . ASP A 76  ? 0.831 0.590 0.596 -0.026 0.067  0.010  405 ASP EEE CG  
579  O OD1 . ASP A 76  ? 0.911 0.622 0.692 -0.047 0.115  -0.092 405 ASP EEE OD1 
580  O OD2 . ASP A 76  ? 0.939 0.623 0.664 -0.034 0.135  -0.037 405 ASP EEE OD2 
581  N N   . GLU A 77  ? 0.551 0.482 0.269 -0.069 0.050  0.002  406 GLU EEE N   
582  C CA  . GLU A 77  ? 0.495 0.471 0.248 -0.075 0.041  0.025  406 GLU EEE CA  
583  C C   . GLU A 77  ? 0.472 0.486 0.258 -0.073 0.016  0.033  406 GLU EEE C   
584  O O   . GLU A 77  ? 0.468 0.437 0.259 -0.060 0.016  0.035  406 GLU EEE O   
585  C CB  . GLU A 77  ? 0.481 0.487 0.247 -0.059 0.033  0.035  406 GLU EEE CB  
586  C CG  . GLU A 77  ? 0.509 0.475 0.261 -0.039 0.045  -0.012 406 GLU EEE CG  
587  C CD  . GLU A 77  ? 0.523 0.459 0.296 -0.029 0.025  0.013  406 GLU EEE CD  
588  O OE1 . GLU A 77  ? 0.514 0.463 0.264 -0.022 -0.003 -0.014 406 GLU EEE OE1 
589  O OE2 . GLU A 77  ? 0.482 0.524 0.288 -0.001 0.063  0.013  406 GLU EEE OE2 
590  N N   . VAL A 78  ? 0.475 0.505 0.232 -0.080 0.021  -0.006 407 VAL EEE N   
591  C CA  . VAL A 78  ? 0.466 0.513 0.248 -0.063 0.009  -0.013 407 VAL EEE CA  
592  C C   . VAL A 78  ? 0.459 0.519 0.285 -0.047 0.014  0.006  407 VAL EEE C   
593  O O   . VAL A 78  ? 0.470 0.469 0.256 -0.050 -0.014 0.042  407 VAL EEE O   
594  C CB  . VAL A 78  ? 0.452 0.522 0.310 -0.071 -0.005 0.002  407 VAL EEE CB  
595  C CG1 . VAL A 78  ? 0.481 0.535 0.328 -0.066 -0.026 0.025  407 VAL EEE CG1 
596  C CG2 . VAL A 78  ? 0.478 0.503 0.350 -0.056 0.002  0.024  407 VAL EEE CG2 
597  N N   . ARG A 79  ? 0.481 0.554 0.242 -0.073 0.022  -0.005 408 ARG EEE N   
598  C CA  . ARG A 79  ? 0.503 0.551 0.266 -0.066 0.021  0.005  408 ARG EEE CA  
599  C C   . ARG A 79  ? 0.525 0.476 0.266 -0.068 0.005  0.031  408 ARG EEE C   
600  O O   . ARG A 79  ? 0.505 0.497 0.279 -0.092 0.018  0.035  408 ARG EEE O   
601  C CB  . ARG A 79  ? 0.559 0.591 0.296 -0.063 0.056  -0.037 408 ARG EEE CB  
602  C CG  . ARG A 79  ? 0.624 0.652 0.359 -0.039 0.056  0.017  408 ARG EEE CG  
603  C CD  . ARG A 79  ? 0.696 0.800 0.471 0.021  0.121  0.019  408 ARG EEE CD  
604  N NE  . ARG A 79  ? 0.820 0.976 0.735 0.090  0.100  0.105  408 ARG EEE NE  
605  C CZ  . ARG A 79  ? 0.895 1.196 0.711 0.082  0.151  0.128  408 ARG EEE CZ  
606  N NH1 . ARG A 79  ? 0.977 1.276 0.687 0.063  0.180  0.127  408 ARG EEE NH1 
607  N NH2 . ARG A 79  ? 0.990 1.249 0.945 0.084  0.009  0.167  408 ARG EEE NH2 
608  N N   . GLN A 80  ? 0.454 0.458 0.284 -0.053 0.010  0.036  409 GLN EEE N   
609  C CA  . GLN A 80  ? 0.473 0.430 0.309 -0.052 0.001  0.033  409 GLN EEE CA  
610  C C   . GLN A 80  ? 0.417 0.420 0.315 -0.068 0.021  0.050  409 GLN EEE C   
611  O O   . GLN A 80  ? 0.463 0.455 0.334 -0.073 0.037  -0.003 409 GLN EEE O   
612  C CB  . GLN A 80  ? 0.459 0.431 0.332 -0.026 -0.000 0.034  409 GLN EEE CB  
613  C CG  . GLN A 80  ? 0.460 0.465 0.337 -0.017 0.008  0.018  409 GLN EEE CG  
614  C CD  . GLN A 80  ? 0.482 0.460 0.350 -0.023 0.032  0.032  409 GLN EEE CD  
615  O OE1 . GLN A 80  ? 0.430 0.465 0.360 -0.033 0.032  -0.016 409 GLN EEE OE1 
616  N NE2 . GLN A 80  ? 0.525 0.474 0.351 -0.017 0.025  0.024  409 GLN EEE NE2 
617  N N   . ILE A 81  ? 0.427 0.406 0.275 -0.053 -0.002 0.014  410 ILE EEE N   
618  C CA  . ILE A 81  ? 0.440 0.404 0.285 -0.038 -0.020 0.010  410 ILE EEE CA  
619  C C   . ILE A 81  ? 0.427 0.411 0.282 -0.050 0.006  0.002  410 ILE EEE C   
620  O O   . ILE A 81  ? 0.433 0.428 0.324 -0.047 0.005  0.037  410 ILE EEE O   
621  C CB  . ILE A 81  ? 0.420 0.418 0.306 -0.012 -0.034 0.024  410 ILE EEE CB  
622  C CG1 . ILE A 81  ? 0.441 0.423 0.336 0.005  -0.028 0.035  410 ILE EEE CG1 
623  C CG2 . ILE A 81  ? 0.428 0.409 0.279 -0.017 -0.045 0.022  410 ILE EEE CG2 
624  C CD1 . ILE A 81  ? 0.443 0.421 0.311 0.001  -0.005 0.051  410 ILE EEE CD1 
625  N N   . ALA A 82  ? 0.449 0.440 0.365 -0.070 0.022  0.024  411 ALA EEE N   
626  C CA  . ALA A 82  ? 0.438 0.446 0.361 -0.103 0.000  0.017  411 ALA EEE CA  
627  C C   . ALA A 82  ? 0.454 0.487 0.356 -0.093 -0.035 0.016  411 ALA EEE C   
628  O O   . ALA A 82  ? 0.477 0.490 0.368 -0.099 -0.049 0.041  411 ALA EEE O   
629  C CB  . ALA A 82  ? 0.484 0.483 0.355 -0.115 0.017  0.021  411 ALA EEE CB  
630  N N   . PRO A 83  ? 0.487 0.493 0.386 -0.098 -0.052 0.014  412 PRO EEE N   
631  C CA  . PRO A 83  ? 0.505 0.504 0.366 -0.124 -0.038 0.010  412 PRO EEE CA  
632  C C   . PRO A 83  ? 0.531 0.510 0.380 -0.118 -0.017 0.010  412 PRO EEE C   
633  O O   . PRO A 83  ? 0.543 0.527 0.355 -0.092 -0.011 0.031  412 PRO EEE O   
634  C CB  . PRO A 83  ? 0.549 0.503 0.398 -0.113 -0.051 0.010  412 PRO EEE CB  
635  C CG  . PRO A 83  ? 0.548 0.509 0.439 -0.098 -0.059 0.035  412 PRO EEE CG  
636  C CD  . PRO A 83  ? 0.494 0.518 0.401 -0.098 -0.059 0.033  412 PRO EEE CD  
637  N N   . GLY A 84  ? 0.512 0.512 0.450 -0.115 -0.015 0.044  413 GLY EEE N   
638  C CA  . GLY A 84  ? 0.537 0.549 0.460 -0.119 0.025  0.023  413 GLY EEE CA  
639  C C   . GLY A 84  ? 0.508 0.546 0.449 -0.106 0.051  0.046  413 GLY EEE C   
640  O O   . GLY A 84  ? 0.558 0.565 0.510 -0.133 0.114  0.027  413 GLY EEE O   
641  N N   . GLN A 85  ? 0.516 0.513 0.445 -0.093 0.038  0.043  414 GLN EEE N   
642  C CA  . GLN A 85  ? 0.498 0.523 0.435 -0.069 0.034  0.023  414 GLN EEE CA  
643  C C   . GLN A 85  ? 0.487 0.524 0.449 -0.067 0.058  0.034  414 GLN EEE C   
644  O O   . GLN A 85  ? 0.551 0.579 0.402 -0.066 0.027  0.081  414 GLN EEE O   
645  C CB  . GLN A 85  ? 0.518 0.522 0.466 -0.086 0.043  0.034  414 GLN EEE CB  
646  C CG  . GLN A 85  ? 0.552 0.557 0.519 -0.078 -0.005 0.054  414 GLN EEE CG  
647  C CD  . GLN A 85  ? 0.616 0.596 0.506 -0.072 0.002  0.059  414 GLN EEE CD  
648  O OE1 . GLN A 85  ? 0.722 0.638 0.494 -0.094 -0.006 -0.011 414 GLN EEE OE1 
649  N NE2 . GLN A 85  ? 0.678 0.658 0.547 -0.066 0.025  0.149  414 GLN EEE NE2 
650  N N   . THR A 86  ? 0.482 0.579 0.441 -0.042 0.062  0.010  415 THR EEE N   
651  C CA  . THR A 86  ? 0.509 0.577 0.480 -0.042 0.058  0.029  415 THR EEE CA  
652  C C   . THR A 86  ? 0.461 0.577 0.450 -0.029 0.028  0.032  415 THR EEE C   
653  O O   . THR A 86  ? 0.521 0.596 0.430 -0.022 0.026  -0.008 415 THR EEE O   
654  C CB  . THR A 86  ? 0.509 0.631 0.531 -0.080 0.076  -0.001 415 THR EEE CB  
655  O OG1 . THR A 86  ? 0.477 0.754 0.506 -0.076 0.125  0.061  415 THR EEE OG1 
656  C CG2 . THR A 86  ? 0.585 0.630 0.608 -0.082 0.050  0.014  415 THR EEE CG2 
657  N N   . GLY A 87  ? 0.487 0.544 0.451 -0.057 0.064  0.048  416 GLY EEE N   
658  C CA  . GLY A 87  ? 0.499 0.525 0.432 -0.044 0.091  0.039  416 GLY EEE CA  
659  C C   . GLY A 87  ? 0.479 0.495 0.399 -0.027 0.074  0.001  416 GLY EEE C   
660  O O   . GLY A 87  ? 0.435 0.492 0.334 -0.023 0.051  0.020  416 GLY EEE O   
661  N N   . LYS A 88  ? 0.499 0.489 0.379 -0.027 0.066  0.002  417 LYS EEE N   
662  C CA  . LYS A 88  ? 0.457 0.521 0.409 -0.035 0.071  0.025  417 LYS EEE CA  
663  C C   . LYS A 88  ? 0.461 0.437 0.327 -0.031 0.011  0.020  417 LYS EEE C   
664  O O   . LYS A 88  ? 0.435 0.429 0.311 -0.012 0.007  0.017  417 LYS EEE O   
665  C CB  . LYS A 88  ? 0.569 0.534 0.514 -0.068 0.059  0.048  417 LYS EEE CB  
666  C CG  . LYS A 88  ? 0.647 0.607 0.672 -0.054 0.070  0.122  417 LYS EEE CG  
667  C CD  . LYS A 88  ? 0.659 0.703 0.737 -0.108 0.120  0.117  417 LYS EEE CD  
668  C CE  . LYS A 88  ? 0.657 0.763 0.773 -0.103 0.114  0.126  417 LYS EEE CE  
669  N NZ  . LYS A 88  ? 0.612 0.838 0.874 -0.005 0.044  0.090  417 LYS EEE NZ  
670  N N   . ILE A 89  ? 0.400 0.439 0.307 -0.048 0.021  0.001  418 ILE EEE N   
671  C CA  . ILE A 89  ? 0.393 0.435 0.278 -0.044 0.021  0.018  418 ILE EEE CA  
672  C C   . ILE A 89  ? 0.373 0.424 0.316 -0.052 0.029  0.028  418 ILE EEE C   
673  O O   . ILE A 89  ? 0.403 0.423 0.305 -0.057 0.032  0.015  418 ILE EEE O   
674  C CB  . ILE A 89  ? 0.405 0.466 0.307 -0.048 0.002  0.005  418 ILE EEE CB  
675  C CG1 . ILE A 89  ? 0.431 0.460 0.310 -0.019 -0.015 0.005  418 ILE EEE CG1 
676  C CG2 . ILE A 89  ? 0.455 0.440 0.279 -0.027 0.006  -0.012 418 ILE EEE CG2 
677  C CD1 . ILE A 89  ? 0.444 0.450 0.349 -0.052 0.008  0.009  418 ILE EEE CD1 
678  N N   . ALA A 90  ? 0.410 0.447 0.298 -0.060 0.024  0.042  419 ALA EEE N   
679  C CA  . ALA A 90  ? 0.429 0.448 0.334 -0.054 0.035  0.018  419 ALA EEE CA  
680  C C   . ALA A 90  ? 0.406 0.432 0.343 -0.039 0.039  0.044  419 ALA EEE C   
681  O O   . ALA A 90  ? 0.465 0.441 0.347 -0.020 -0.003 0.031  419 ALA EEE O   
682  C CB  . ALA A 90  ? 0.441 0.455 0.312 -0.066 0.023  0.019  419 ALA EEE CB  
683  N N   . ASP A 91  ? 0.362 0.432 0.365 -0.051 0.030  0.034  420 ASP EEE N   
684  C CA  . ASP A 91  ? 0.411 0.454 0.361 -0.049 0.010  0.029  420 ASP EEE CA  
685  C C   . ASP A 91  ? 0.407 0.442 0.386 -0.055 0.018  0.039  420 ASP EEE C   
686  O O   . ASP A 91  ? 0.436 0.433 0.416 -0.012 0.005  0.006  420 ASP EEE O   
687  C CB  . ASP A 91  ? 0.413 0.511 0.399 -0.041 0.029  0.025  420 ASP EEE CB  
688  C CG  . ASP A 91  ? 0.420 0.512 0.436 -0.013 0.070  0.026  420 ASP EEE CG  
689  O OD1 . ASP A 91  ? 0.449 0.525 0.493 -0.046 0.065  0.063  420 ASP EEE OD1 
690  O OD2 . ASP A 91  ? 0.426 0.577 0.480 -0.009 0.142  0.021  420 ASP EEE OD2 
691  N N   . TYR A 92  ? 0.394 0.418 0.339 -0.040 -0.006 0.036  421 TYR EEE N   
692  C CA  . TYR A 92  ? 0.391 0.412 0.316 -0.049 -0.017 0.025  421 TYR EEE CA  
693  C C   . TYR A 92  ? 0.397 0.412 0.327 -0.002 -0.015 0.023  421 TYR EEE C   
694  O O   . TYR A 92  ? 0.420 0.451 0.322 -0.019 -0.024 0.025  421 TYR EEE O   
695  C CB  . TYR A 92  ? 0.396 0.423 0.305 -0.024 -0.008 0.034  421 TYR EEE CB  
696  C CG  . TYR A 92  ? 0.391 0.444 0.354 -0.026 -0.002 0.038  421 TYR EEE CG  
697  C CD1 . TYR A 92  ? 0.393 0.464 0.390 -0.024 0.001  0.013  421 TYR EEE CD1 
698  C CD2 . TYR A 92  ? 0.424 0.451 0.366 -0.031 0.032  0.025  421 TYR EEE CD2 
699  C CE1 . TYR A 92  ? 0.406 0.483 0.460 -0.012 0.045  0.027  421 TYR EEE CE1 
700  C CE2 . TYR A 92  ? 0.422 0.470 0.409 -0.014 0.034  0.022  421 TYR EEE CE2 
701  C CZ  . TYR A 92  ? 0.402 0.479 0.456 -0.019 0.060  0.012  421 TYR EEE CZ  
702  O OH  . TYR A 92  ? 0.408 0.527 0.473 -0.002 0.078  0.043  421 TYR EEE OH  
703  N N   . ASN A 93  ? 0.409 0.370 0.274 -0.033 -0.028 0.006  422 ASN EEE N   
704  C CA  . ASN A 93  ? 0.415 0.380 0.275 -0.054 -0.006 0.017  422 ASN EEE CA  
705  C C   . ASN A 93  ? 0.415 0.396 0.266 -0.044 -0.012 0.012  422 ASN EEE C   
706  O O   . ASN A 93  ? 0.382 0.419 0.258 -0.037 -0.025 -0.007 422 ASN EEE O   
707  C CB  . ASN A 93  ? 0.406 0.381 0.286 -0.050 0.024  -0.007 422 ASN EEE CB  
708  C CG  . ASN A 93  ? 0.400 0.380 0.283 -0.054 -0.006 0.010  422 ASN EEE CG  
709  O OD1 . ASN A 93  ? 0.403 0.415 0.278 -0.049 0.012  0.003  422 ASN EEE OD1 
710  N ND2 . ASN A 93  ? 0.414 0.369 0.276 -0.047 -0.003 0.037  422 ASN EEE ND2 
711  N N   . TYR A 94  ? 0.418 0.386 0.241 -0.051 -0.018 -0.004 423 TYR EEE N   
712  C CA  . TYR A 94  ? 0.411 0.401 0.237 -0.048 -0.003 0.019  423 TYR EEE CA  
713  C C   . TYR A 94  ? 0.416 0.401 0.304 -0.060 0.001  0.032  423 TYR EEE C   
714  O O   . TYR A 94  ? 0.431 0.441 0.296 -0.051 -0.018 0.024  423 TYR EEE O   
715  C CB  . TYR A 94  ? 0.403 0.407 0.262 -0.045 0.006  0.004  423 TYR EEE CB  
716  C CG  . TYR A 94  ? 0.379 0.418 0.249 -0.044 0.005  0.019  423 TYR EEE CG  
717  C CD1 . TYR A 94  ? 0.408 0.408 0.255 -0.034 -0.034 0.024  423 TYR EEE CD1 
718  C CD2 . TYR A 94  ? 0.408 0.416 0.195 -0.020 -0.012 0.039  423 TYR EEE CD2 
719  C CE1 . TYR A 94  ? 0.420 0.405 0.244 -0.033 -0.024 0.036  423 TYR EEE CE1 
720  C CE2 . TYR A 94  ? 0.429 0.409 0.210 -0.025 -0.040 0.039  423 TYR EEE CE2 
721  C CZ  . TYR A 94  ? 0.425 0.394 0.213 -0.043 -0.039 0.033  423 TYR EEE CZ  
722  O OH  . TYR A 94  ? 0.482 0.405 0.255 -0.023 -0.046 0.047  423 TYR EEE OH  
723  N N   . LYS A 95  ? 0.420 0.397 0.288 -0.050 -0.023 0.043  424 LYS EEE N   
724  C CA  . LYS A 95  ? 0.396 0.411 0.328 -0.060 -0.014 0.027  424 LYS EEE CA  
725  C C   . LYS A 95  ? 0.411 0.423 0.330 -0.043 -0.003 0.029  424 LYS EEE C   
726  O O   . LYS A 95  ? 0.450 0.411 0.270 -0.059 -0.027 0.020  424 LYS EEE O   
727  C CB  . LYS A 95  ? 0.412 0.405 0.310 -0.051 -0.017 0.039  424 LYS EEE CB  
728  C CG  . LYS A 95  ? 0.433 0.422 0.349 -0.047 0.000  0.054  424 LYS EEE CG  
729  C CD  . LYS A 95  ? 0.419 0.446 0.350 -0.044 0.013  0.044  424 LYS EEE CD  
730  C CE  . LYS A 95  ? 0.456 0.471 0.420 -0.056 0.054  0.049  424 LYS EEE CE  
731  N NZ  . LYS A 95  ? 0.485 0.523 0.426 -0.043 0.080  0.048  424 LYS EEE NZ  
732  N N   . LEU A 96  ? 0.426 0.444 0.307 -0.070 -0.007 0.005  425 LEU EEE N   
733  C CA  . LEU A 96  ? 0.453 0.444 0.315 -0.073 -0.038 0.039  425 LEU EEE CA  
734  C C   . LEU A 96  ? 0.445 0.440 0.286 -0.065 -0.079 0.048  425 LEU EEE C   
735  O O   . LEU A 96  ? 0.469 0.450 0.410 -0.045 -0.051 0.057  425 LEU EEE O   
736  C CB  . LEU A 96  ? 0.472 0.467 0.336 -0.070 -0.059 0.039  425 LEU EEE CB  
737  C CG  . LEU A 96  ? 0.468 0.443 0.365 -0.069 -0.069 -0.000 425 LEU EEE CG  
738  C CD1 . LEU A 96  ? 0.474 0.481 0.362 -0.062 -0.079 -0.014 425 LEU EEE CD1 
739  C CD2 . LEU A 96  ? 0.492 0.449 0.399 -0.088 -0.032 0.017  425 LEU EEE CD2 
740  N N   . PRO A 97  ? 0.501 0.450 0.328 -0.073 -0.054 0.036  426 PRO EEE N   
741  C CA  . PRO A 97  ? 0.534 0.468 0.363 -0.105 -0.063 0.046  426 PRO EEE CA  
742  C C   . PRO A 97  ? 0.519 0.507 0.385 -0.101 -0.050 0.074  426 PRO EEE C   
743  O O   . PRO A 97  ? 0.505 0.457 0.436 -0.104 -0.068 0.055  426 PRO EEE O   
744  C CB  . PRO A 97  ? 0.545 0.466 0.406 -0.084 -0.043 0.060  426 PRO EEE CB  
745  C CG  . PRO A 97  ? 0.546 0.453 0.458 -0.089 -0.060 0.042  426 PRO EEE CG  
746  C CD  . PRO A 97  ? 0.512 0.460 0.398 -0.073 -0.064 0.048  426 PRO EEE CD  
747  N N   . ASP A 98  ? 0.510 0.552 0.460 -0.101 -0.102 0.089  427 ASP EEE N   
748  C CA  . ASP A 98  ? 0.576 0.559 0.529 -0.162 -0.045 0.116  427 ASP EEE CA  
749  C C   . ASP A 98  ? 0.587 0.546 0.535 -0.183 -0.061 0.122  427 ASP EEE C   
750  O O   . ASP A 98  ? 0.649 0.619 0.556 -0.183 -0.159 0.155  427 ASP EEE O   
751  C CB  . ASP A 98  ? 0.590 0.661 0.556 -0.177 -0.045 0.085  427 ASP EEE CB  
752  C CG  . ASP A 98  ? 0.591 0.673 0.625 -0.175 -0.028 0.095  427 ASP EEE CG  
753  O OD1 . ASP A 98  ? 0.593 0.684 0.680 -0.174 0.040  0.054  427 ASP EEE OD1 
754  O OD2 . ASP A 98  ? 0.607 0.756 0.779 -0.213 -0.031 0.060  427 ASP EEE OD2 
755  N N   . ASP A 99  ? 0.617 0.512 0.579 -0.159 -0.089 0.122  428 ASP EEE N   
756  C CA  . ASP A 99  ? 0.676 0.530 0.659 -0.125 -0.108 0.074  428 ASP EEE CA  
757  C C   . ASP A 99  ? 0.663 0.486 0.580 -0.147 -0.130 0.054  428 ASP EEE C   
758  O O   . ASP A 99  ? 0.663 0.461 0.580 -0.166 -0.139 0.033  428 ASP EEE O   
759  C CB  . ASP A 99  ? 0.777 0.515 0.706 -0.138 -0.161 0.067  428 ASP EEE CB  
760  C CG  . ASP A 99  ? 0.826 0.522 0.739 -0.121 -0.133 0.031  428 ASP EEE CG  
761  O OD1 . ASP A 99  ? 0.906 0.499 0.762 -0.118 -0.213 0.056  428 ASP EEE OD1 
762  O OD2 . ASP A 99  ? 0.966 0.514 0.909 -0.175 -0.166 -0.009 428 ASP EEE OD2 
763  N N   . PHE A 100 ? 0.591 0.477 0.460 -0.100 -0.123 0.046  429 PHE EEE N   
764  C CA  . PHE A 100 ? 0.581 0.451 0.409 -0.112 -0.118 0.016  429 PHE EEE CA  
765  C C   . PHE A 100 ? 0.564 0.458 0.412 -0.095 -0.083 0.025  429 PHE EEE C   
766  O O   . PHE A 100 ? 0.604 0.484 0.420 -0.123 -0.051 0.059  429 PHE EEE O   
767  C CB  . PHE A 100 ? 0.541 0.453 0.386 -0.089 -0.082 0.047  429 PHE EEE CB  
768  C CG  . PHE A 100 ? 0.499 0.454 0.354 -0.062 -0.089 0.033  429 PHE EEE CG  
769  C CD1 . PHE A 100 ? 0.510 0.457 0.374 -0.055 -0.085 0.045  429 PHE EEE CD1 
770  C CD2 . PHE A 100 ? 0.487 0.450 0.372 -0.050 -0.089 0.033  429 PHE EEE CD2 
771  C CE1 . PHE A 100 ? 0.488 0.455 0.308 -0.042 -0.090 0.075  429 PHE EEE CE1 
772  C CE2 . PHE A 100 ? 0.469 0.442 0.349 -0.043 -0.094 0.012  429 PHE EEE CE2 
773  C CZ  . PHE A 100 ? 0.500 0.440 0.337 -0.066 -0.095 0.042  429 PHE EEE CZ  
774  N N   . THR A 101 ? 0.561 0.449 0.428 -0.095 -0.081 -0.005 430 THR EEE N   
775  C CA  . THR A 101 ? 0.602 0.513 0.482 -0.071 -0.101 0.026  430 THR EEE CA  
776  C C   . THR A 101 ? 0.626 0.464 0.565 -0.078 -0.026 0.055  430 THR EEE C   
777  O O   . THR A 101 ? 0.670 0.665 0.607 -0.021 -0.099 0.053  430 THR EEE O   
778  C CB  . THR A 101 ? 0.685 0.532 0.522 -0.063 -0.110 -0.008 430 THR EEE CB  
779  O OG1 . THR A 101 ? 0.801 0.609 0.490 0.007  -0.139 -0.011 430 THR EEE OG1 
780  C CG2 . THR A 101 ? 0.700 0.532 0.636 -0.091 -0.155 -0.007 430 THR EEE CG2 
781  N N   . GLY A 102 ? 0.523 0.469 0.437 -0.062 -0.022 0.083  431 GLY EEE N   
782  C CA  . GLY A 102 ? 0.493 0.462 0.239 -0.056 -0.041 0.034  431 GLY EEE CA  
783  C C   . GLY A 102 ? 0.499 0.440 0.318 -0.095 -0.003 0.013  431 GLY EEE C   
784  O O   . GLY A 102 ? 0.569 0.456 0.265 -0.110 -0.030 0.029  431 GLY EEE O   
785  N N   . CYS A 103 ? 0.482 0.399 0.259 -0.070 -0.049 0.063  432 CYS EEE N   
786  C CA  . CYS A 103 ? 0.487 0.410 0.288 -0.092 -0.029 0.044  432 CYS EEE CA  
787  C C   . CYS A 103 ? 0.469 0.435 0.302 -0.039 -0.006 0.043  432 CYS EEE C   
788  O O   . CYS A 103 ? 0.510 0.423 0.288 -0.046 -0.032 0.045  432 CYS EEE O   
789  C CB  . CYS A 103 ? 0.516 0.479 0.352 -0.072 -0.079 0.061  432 CYS EEE CB  
790  S SG  . CYS A 103 ? 0.615 0.484 0.359 -0.062 -0.094 0.073  432 CYS EEE SG  
791  N N   . VAL A 104 ? 0.471 0.424 0.249 -0.068 -0.017 0.041  433 VAL EEE N   
792  C CA  . VAL A 104 ? 0.477 0.429 0.225 -0.079 -0.027 0.045  433 VAL EEE CA  
793  C C   . VAL A 104 ? 0.478 0.435 0.244 -0.082 -0.040 0.058  433 VAL EEE C   
794  O O   . VAL A 104 ? 0.514 0.447 0.217 -0.106 -0.091 0.029  433 VAL EEE O   
795  C CB  . VAL A 104 ? 0.453 0.434 0.246 -0.078 -0.034 0.021  433 VAL EEE CB  
796  C CG1 . VAL A 104 ? 0.457 0.442 0.248 -0.079 -0.061 0.022  433 VAL EEE CG1 
797  C CG2 . VAL A 104 ? 0.446 0.441 0.266 -0.089 -0.014 0.000  433 VAL EEE CG2 
798  N N   . ILE A 105 ? 0.465 0.435 0.211 -0.081 -0.059 0.058  434 ILE EEE N   
799  C CA  . ILE A 105 ? 0.471 0.416 0.293 -0.093 -0.066 0.044  434 ILE EEE CA  
800  C C   . ILE A 105 ? 0.506 0.399 0.265 -0.048 -0.067 -0.019 434 ILE EEE C   
801  O O   . ILE A 105 ? 0.503 0.412 0.288 -0.063 -0.047 0.047  434 ILE EEE O   
802  C CB  . ILE A 105 ? 0.472 0.465 0.319 -0.077 -0.053 0.045  434 ILE EEE CB  
803  C CG1 . ILE A 105 ? 0.500 0.482 0.336 -0.094 -0.070 0.053  434 ILE EEE CG1 
804  C CG2 . ILE A 105 ? 0.516 0.475 0.261 -0.082 -0.062 0.037  434 ILE EEE CG2 
805  C CD1 . ILE A 105 ? 0.505 0.515 0.387 -0.063 -0.054 0.067  434 ILE EEE CD1 
806  N N   . ALA A 106 ? 0.520 0.400 0.221 -0.078 -0.072 0.001  435 ALA EEE N   
807  C CA  . ALA A 106 ? 0.496 0.398 0.263 -0.082 -0.088 0.009  435 ALA EEE CA  
808  C C   . ALA A 106 ? 0.500 0.399 0.279 -0.086 -0.106 0.033  435 ALA EEE C   
809  O O   . ALA A 106 ? 0.523 0.414 0.324 -0.072 -0.112 0.076  435 ALA EEE O   
810  C CB  . ALA A 106 ? 0.502 0.433 0.285 -0.076 -0.081 0.013  435 ALA EEE CB  
811  N N   . TRP A 107 ? 0.508 0.440 0.272 -0.107 -0.086 0.069  436 TRP EEE N   
812  C CA  . TRP A 107 ? 0.526 0.441 0.232 -0.112 -0.060 0.054  436 TRP EEE CA  
813  C C   . TRP A 107 ? 0.544 0.454 0.220 -0.097 -0.062 0.025  436 TRP EEE C   
814  O O   . TRP A 107 ? 0.555 0.460 0.215 -0.138 -0.080 0.029  436 TRP EEE O   
815  C CB  . TRP A 107 ? 0.540 0.458 0.298 -0.084 -0.048 0.080  436 TRP EEE CB  
816  C CG  . TRP A 107 ? 0.522 0.452 0.307 -0.085 -0.042 0.064  436 TRP EEE CG  
817  C CD1 . TRP A 107 ? 0.525 0.452 0.384 -0.083 -0.057 0.066  436 TRP EEE CD1 
818  C CD2 . TRP A 107 ? 0.498 0.453 0.323 -0.064 -0.064 0.063  436 TRP EEE CD2 
819  N NE1 . TRP A 107 ? 0.514 0.457 0.393 -0.088 -0.047 0.082  436 TRP EEE NE1 
820  C CE2 . TRP A 107 ? 0.513 0.471 0.317 -0.059 -0.066 0.060  436 TRP EEE CE2 
821  C CE3 . TRP A 107 ? 0.511 0.453 0.303 -0.047 -0.070 0.050  436 TRP EEE CE3 
822  C CZ2 . TRP A 107 ? 0.488 0.458 0.314 -0.034 -0.046 0.054  436 TRP EEE CZ2 
823  C CZ3 . TRP A 107 ? 0.485 0.437 0.308 -0.048 -0.054 0.050  436 TRP EEE CZ3 
824  C CH2 . TRP A 107 ? 0.517 0.448 0.323 -0.040 -0.040 0.073  436 TRP EEE CH2 
825  N N   . ASN A 108 ? 0.593 0.459 0.254 -0.112 -0.074 -0.012 437 ASN EEE N   
826  C CA  . ASN A 108 ? 0.554 0.463 0.279 -0.078 -0.067 0.003  437 ASN EEE CA  
827  C C   . ASN A 108 ? 0.523 0.469 0.281 -0.075 -0.073 0.015  437 ASN EEE C   
828  O O   . ASN A 108 ? 0.536 0.490 0.317 -0.078 -0.102 0.065  437 ASN EEE O   
829  C CB  . ASN A 108 ? 0.610 0.485 0.270 -0.083 -0.082 0.001  437 ASN EEE CB  
830  C CG  . ASN A 108 ? 0.612 0.477 0.286 -0.080 -0.081 -0.013 437 ASN EEE CG  
831  O OD1 . ASN A 108 ? 0.642 0.538 0.325 -0.130 -0.130 0.026  437 ASN EEE OD1 
832  N ND2 . ASN A 108 ? 0.640 0.508 0.324 -0.080 -0.016 0.038  437 ASN EEE ND2 
833  N N   . SER A 109 ? 0.508 0.451 0.260 -0.093 -0.068 -0.006 438 SER EEE N   
834  C CA  . SER A 109 ? 0.491 0.475 0.300 -0.095 -0.060 0.014  438 SER EEE CA  
835  C C   . SER A 109 ? 0.511 0.482 0.344 -0.094 -0.059 0.004  438 SER EEE C   
836  O O   . SER A 109 ? 0.533 0.451 0.349 -0.100 -0.099 0.045  438 SER EEE O   
837  C CB  . SER A 109 ? 0.486 0.466 0.309 -0.080 -0.060 -0.002 438 SER EEE CB  
838  O OG  . SER A 109 ? 0.475 0.444 0.327 -0.095 -0.050 0.014  438 SER EEE OG  
839  N N   . ASN A 110 ? 0.544 0.473 0.335 -0.074 -0.063 0.020  439 ASN EEE N   
840  C CA  . ASN A 110 ? 0.601 0.488 0.394 -0.089 -0.082 -0.006 439 ASN EEE CA  
841  C C   . ASN A 110 ? 0.598 0.472 0.432 -0.093 -0.102 -0.001 439 ASN EEE C   
842  O O   . ASN A 110 ? 0.614 0.483 0.446 -0.147 -0.118 0.027  439 ASN EEE O   
843  C CB  . ASN A 110 ? 0.646 0.517 0.383 -0.079 -0.097 -0.020 439 ASN EEE CB  
844  C CG  . ASN A 110 ? 0.650 0.484 0.369 -0.098 -0.106 -0.014 439 ASN EEE CG  
845  O OD1 . ASN A 110 ? 0.640 0.501 0.401 -0.068 -0.097 0.005  439 ASN EEE OD1 
846  N ND2 . ASN A 110 ? 0.742 0.488 0.419 -0.125 -0.135 -0.035 439 ASN EEE ND2 
847  N N   . ASN A 111 ? 0.609 0.484 0.417 -0.099 -0.123 0.049  440 ASN EEE N   
848  C CA  . ASN A 111 ? 0.644 0.582 0.463 -0.117 -0.071 0.027  440 ASN EEE CA  
849  C C   . ASN A 111 ? 0.657 0.556 0.475 -0.178 -0.058 0.067  440 ASN EEE C   
850  O O   . ASN A 111 ? 0.645 0.562 0.453 -0.226 -0.129 0.025  440 ASN EEE O   
851  C CB  . ASN A 111 ? 0.667 0.699 0.621 -0.093 -0.139 0.061  440 ASN EEE CB  
852  C CG  . ASN A 111 ? 0.780 0.736 0.798 -0.039 -0.129 0.013  440 ASN EEE CG  
853  O OD1 . ASN A 111 ? 0.730 0.707 1.042 -0.088 -0.370 -0.064 440 ASN EEE OD1 
854  N ND2 . ASN A 111 ? 0.832 0.912 0.867 0.023  -0.093 0.045  440 ASN EEE ND2 
855  N N   . LEU A 112 ? 0.602 0.549 0.485 -0.146 -0.070 0.055  441 LEU EEE N   
856  C CA  . LEU A 112 ? 0.564 0.559 0.479 -0.124 -0.066 0.072  441 LEU EEE CA  
857  C C   . LEU A 112 ? 0.556 0.526 0.414 -0.124 -0.034 0.076  441 LEU EEE C   
858  O O   . LEU A 112 ? 0.551 0.568 0.494 -0.171 -0.043 0.165  441 LEU EEE O   
859  C CB  . LEU A 112 ? 0.616 0.589 0.567 -0.092 -0.055 0.050  441 LEU EEE CB  
860  C CG  . LEU A 112 ? 0.633 0.627 0.643 -0.068 -0.068 0.031  441 LEU EEE CG  
861  C CD1 . LEU A 112 ? 0.706 0.675 0.658 -0.077 -0.082 -0.021 441 LEU EEE CD1 
862  C CD2 . LEU A 112 ? 0.605 0.708 0.684 -0.070 -0.066 -0.025 441 LEU EEE CD2 
863  N N   . ASP A 113 ? 0.543 0.484 0.339 -0.100 -0.055 0.048  442 ASP EEE N   
864  C CA  . ASP A 113 ? 0.517 0.481 0.374 -0.088 -0.045 0.025  442 ASP EEE CA  
865  C C   . ASP A 113 ? 0.562 0.452 0.354 -0.098 -0.063 0.014  442 ASP EEE C   
866  O O   . ASP A 113 ? 0.587 0.420 0.376 -0.073 -0.073 0.008  442 ASP EEE O   
867  C CB  . ASP A 113 ? 0.490 0.448 0.352 -0.071 -0.037 0.058  442 ASP EEE CB  
868  C CG  . ASP A 113 ? 0.466 0.452 0.373 -0.065 -0.035 0.064  442 ASP EEE CG  
869  O OD1 . ASP A 113 ? 0.436 0.456 0.349 -0.073 -0.037 0.001  442 ASP EEE OD1 
870  O OD2 . ASP A 113 ? 0.476 0.445 0.296 -0.084 -0.019 0.043  442 ASP EEE OD2 
871  N N   . SER A 114 ? 0.602 0.476 0.343 -0.086 -0.089 0.010  443 SER EEE N   
872  C CA  A SER A 114 ? 0.646 0.469 0.328 -0.088 -0.079 0.020  443 SER EEE CA  
873  C CA  B SER A 114 ? 0.633 0.467 0.345 -0.087 -0.081 0.015  443 SER EEE CA  
874  C C   . SER A 114 ? 0.625 0.473 0.370 -0.086 -0.079 0.009  443 SER EEE C   
875  O O   . SER A 114 ? 0.621 0.499 0.497 -0.101 -0.054 0.003  443 SER EEE O   
876  C CB  A SER A 114 ? 0.665 0.491 0.317 -0.092 -0.090 0.016  443 SER EEE CB  
877  C CB  B SER A 114 ? 0.619 0.467 0.338 -0.094 -0.093 0.004  443 SER EEE CB  
878  O OG  A SER A 114 ? 0.676 0.479 0.296 -0.104 -0.124 -0.004 443 SER EEE OG  
879  O OG  B SER A 114 ? 0.624 0.440 0.373 -0.086 -0.109 -0.036 443 SER EEE OG  
880  N N   . LYS A 115 ? 0.700 0.465 0.432 -0.095 -0.082 0.014  444 LYS EEE N   
881  C CA  . LYS A 115 ? 0.765 0.490 0.446 -0.136 -0.097 0.016  444 LYS EEE CA  
882  C C   . LYS A 115 ? 0.745 0.493 0.436 -0.139 -0.169 -0.017 444 LYS EEE C   
883  O O   . LYS A 115 ? 0.734 0.462 0.470 -0.120 -0.185 -0.028 444 LYS EEE O   
884  C CB  . LYS A 115 ? 0.888 0.574 0.491 -0.137 -0.055 0.045  444 LYS EEE CB  
885  C CG  . LYS A 115 ? 0.957 0.703 0.490 -0.092 -0.084 0.067  444 LYS EEE CG  
886  C CD  . LYS A 115 ? 0.991 0.771 0.562 -0.098 -0.020 0.083  444 LYS EEE CD  
887  C CE  . LYS A 115 ? 1.085 0.777 0.525 -0.079 -0.026 0.126  444 LYS EEE CE  
888  N NZ  . LYS A 115 ? 1.140 0.754 0.521 -0.075 -0.042 0.131  444 LYS EEE NZ  
889  N N   . VAL A 116 ? 0.715 0.522 0.546 -0.135 -0.192 -0.055 445 VAL EEE N   
890  C CA  . VAL A 116 ? 0.791 0.522 0.530 -0.111 -0.196 -0.054 445 VAL EEE CA  
891  C C   . VAL A 116 ? 0.813 0.509 0.520 -0.093 -0.159 -0.044 445 VAL EEE C   
892  O O   . VAL A 116 ? 0.858 0.470 0.505 -0.107 -0.136 -0.025 445 VAL EEE O   
893  C CB  . VAL A 116 ? 0.798 0.576 0.578 -0.123 -0.200 -0.080 445 VAL EEE CB  
894  C CG1 . VAL A 116 ? 0.789 0.601 0.607 -0.084 -0.157 -0.090 445 VAL EEE CG1 
895  C CG2 . VAL A 116 ? 0.855 0.655 0.595 -0.098 -0.219 -0.074 445 VAL EEE CG2 
896  N N   . GLY A 117 ? 0.836 0.526 0.555 -0.057 -0.198 -0.057 446 GLY EEE N   
897  C CA  . GLY A 117 ? 0.848 0.553 0.550 -0.067 -0.218 -0.070 446 GLY EEE CA  
898  C C   . GLY A 117 ? 0.847 0.460 0.500 -0.050 -0.164 -0.062 446 GLY EEE C   
899  O O   . GLY A 117 ? 0.866 0.461 0.571 -0.035 -0.180 -0.044 446 GLY EEE O   
900  N N   . GLY A 118 ? 0.774 0.456 0.428 -0.064 -0.105 -0.057 447 GLY EEE N   
901  C CA  . GLY A 118 ? 0.690 0.480 0.398 -0.071 -0.079 -0.033 447 GLY EEE CA  
902  C C   . GLY A 118 ? 0.647 0.455 0.352 -0.083 -0.076 0.012  447 GLY EEE C   
903  O O   . GLY A 118 ? 0.738 0.413 0.408 -0.111 -0.067 0.027  447 GLY EEE O   
904  N N   . ASN A 119 ? 0.590 0.448 0.319 -0.076 -0.049 -0.023 448 ASN EEE N   
905  C CA  . ASN A 119 ? 0.540 0.433 0.297 -0.083 -0.050 0.007  448 ASN EEE CA  
906  C C   . ASN A 119 ? 0.521 0.421 0.286 -0.058 -0.048 0.007  448 ASN EEE C   
907  O O   . ASN A 119 ? 0.527 0.419 0.282 -0.061 -0.053 0.004  448 ASN EEE O   
908  C CB  . ASN A 119 ? 0.514 0.459 0.332 -0.075 -0.039 0.008  448 ASN EEE CB  
909  C CG  . ASN A 119 ? 0.570 0.478 0.330 -0.057 -0.052 0.007  448 ASN EEE CG  
910  O OD1 . ASN A 119 ? 0.545 0.473 0.343 -0.076 -0.056 0.026  448 ASN EEE OD1 
911  N ND2 . ASN A 119 ? 0.614 0.471 0.339 -0.066 -0.052 -0.000 448 ASN EEE ND2 
912  N N   . TYR A 120 ? 0.501 0.389 0.279 -0.060 -0.019 0.038  449 TYR EEE N   
913  C CA  . TYR A 120 ? 0.488 0.388 0.321 -0.049 -0.016 0.010  449 TYR EEE CA  
914  C C   . TYR A 120 ? 0.463 0.368 0.308 -0.038 0.004  0.028  449 TYR EEE C   
915  O O   . TYR A 120 ? 0.481 0.408 0.278 -0.033 -0.022 0.033  449 TYR EEE O   
916  C CB  . TYR A 120 ? 0.524 0.372 0.296 -0.046 -0.019 -0.012 449 TYR EEE CB  
917  C CG  . TYR A 120 ? 0.546 0.411 0.372 -0.037 -0.046 -0.063 449 TYR EEE CG  
918  C CD1 . TYR A 120 ? 0.588 0.423 0.332 0.006  -0.049 -0.056 449 TYR EEE CD1 
919  C CD2 . TYR A 120 ? 0.562 0.412 0.432 -0.036 -0.038 -0.067 449 TYR EEE CD2 
920  C CE1 . TYR A 120 ? 0.680 0.456 0.423 0.011  -0.083 -0.111 449 TYR EEE CE1 
921  C CE2 . TYR A 120 ? 0.668 0.497 0.492 -0.012 -0.036 -0.126 449 TYR EEE CE2 
922  C CZ  . TYR A 120 ? 0.631 0.507 0.426 -0.017 -0.092 -0.113 449 TYR EEE CZ  
923  O OH  . TYR A 120 ? 0.746 0.503 0.578 0.043  -0.084 -0.172 449 TYR EEE OH  
924  N N   . ASN A 121 ? 0.451 0.372 0.326 -0.033 0.021  0.035  450 ASN EEE N   
925  C CA  . ASN A 121 ? 0.484 0.372 0.416 -0.012 0.010  -0.013 450 ASN EEE CA  
926  C C   . ASN A 121 ? 0.385 0.413 0.279 -0.042 0.032  -0.020 450 ASN EEE C   
927  O O   . ASN A 121 ? 0.471 0.378 0.264 -0.019 0.019  0.010  450 ASN EEE O   
928  C CB  . ASN A 121 ? 0.474 0.442 0.535 -0.075 0.103  -0.132 450 ASN EEE CB  
929  C CG  . ASN A 121 ? 0.545 0.531 0.546 -0.058 0.057  -0.015 450 ASN EEE CG  
930  O OD1 . ASN A 121 ? 0.566 0.659 0.500 -0.112 -0.077 0.009  450 ASN EEE OD1 
931  N ND2 . ASN A 121 ? 0.708 0.625 0.652 0.037  -0.009 -0.030 450 ASN EEE ND2 
932  N N   . TYR A 122 ? 0.460 0.402 0.235 -0.034 -0.011 0.001  451 TYR EEE N   
933  C CA  . TYR A 122 ? 0.440 0.400 0.230 -0.016 -0.016 0.001  451 TYR EEE CA  
934  C C   . TYR A 122 ? 0.435 0.377 0.244 -0.013 -0.027 0.004  451 TYR EEE C   
935  O O   . TYR A 122 ? 0.435 0.392 0.226 -0.030 -0.018 -0.012 451 TYR EEE O   
936  C CB  . TYR A 122 ? 0.448 0.395 0.240 -0.020 -0.007 0.028  451 TYR EEE CB  
937  C CG  . TYR A 122 ? 0.433 0.400 0.262 -0.033 -0.040 0.037  451 TYR EEE CG  
938  C CD1 . TYR A 122 ? 0.421 0.401 0.286 -0.041 -0.048 0.028  451 TYR EEE CD1 
939  C CD2 . TYR A 122 ? 0.437 0.385 0.279 -0.051 -0.009 0.027  451 TYR EEE CD2 
940  C CE1 . TYR A 122 ? 0.429 0.403 0.326 -0.037 -0.038 0.029  451 TYR EEE CE1 
941  C CE2 . TYR A 122 ? 0.420 0.435 0.282 -0.055 -0.050 0.033  451 TYR EEE CE2 
942  C CZ  . TYR A 122 ? 0.417 0.449 0.332 -0.053 -0.018 0.008  451 TYR EEE CZ  
943  O OH  . TYR A 122 ? 0.434 0.460 0.330 -0.036 -0.015 0.065  451 TYR EEE OH  
944  N N   . LEU A 123 ? 0.435 0.402 0.245 -0.030 -0.018 -0.004 452 LEU EEE N   
945  C CA  . LEU A 123 ? 0.421 0.384 0.230 -0.003 0.000  0.002  452 LEU EEE CA  
946  C C   . LEU A 123 ? 0.413 0.397 0.212 -0.004 0.012  0.015  452 LEU EEE C   
947  O O   . LEU A 123 ? 0.392 0.377 0.248 -0.030 -0.013 -0.009 452 LEU EEE O   
948  C CB  . LEU A 123 ? 0.426 0.367 0.227 -0.018 -0.013 0.002  452 LEU EEE CB  
949  C CG  . LEU A 123 ? 0.421 0.379 0.224 -0.024 0.001  -0.006 452 LEU EEE CG  
950  C CD1 . LEU A 123 ? 0.445 0.365 0.231 -0.021 -0.006 0.003  452 LEU EEE CD1 
951  C CD2 . LEU A 123 ? 0.436 0.373 0.300 -0.038 -0.009 -0.006 452 LEU EEE CD2 
952  N N   . TYR A 124 ? 0.420 0.389 0.221 -0.024 0.011  -0.001 453 TYR EEE N   
953  C CA  . TYR A 124 ? 0.393 0.384 0.265 -0.019 0.021  0.013  453 TYR EEE CA  
954  C C   . TYR A 124 ? 0.396 0.373 0.260 -0.032 0.013  -0.015 453 TYR EEE C   
955  O O   . TYR A 124 ? 0.397 0.397 0.241 -0.034 -0.012 0.005  453 TYR EEE O   
956  C CB  . TYR A 124 ? 0.435 0.377 0.260 -0.039 0.024  0.015  453 TYR EEE CB  
957  C CG  . TYR A 124 ? 0.464 0.404 0.281 -0.014 0.047  0.017  453 TYR EEE CG  
958  C CD1 . TYR A 124 ? 0.498 0.401 0.301 -0.019 0.051  0.023  453 TYR EEE CD1 
959  C CD2 . TYR A 124 ? 0.475 0.438 0.264 -0.007 0.040  0.018  453 TYR EEE CD2 
960  C CE1 . TYR A 124 ? 0.513 0.426 0.302 0.006  0.036  0.011  453 TYR EEE CE1 
961  C CE2 . TYR A 124 ? 0.464 0.452 0.352 0.025  0.050  0.044  453 TYR EEE CE2 
962  C CZ  . TYR A 124 ? 0.515 0.437 0.329 0.036  0.067  0.032  453 TYR EEE CZ  
963  O OH  . TYR A 124 ? 0.613 0.492 0.337 0.096  0.125  0.063  453 TYR EEE OH  
964  N N   . ARG A 125 ? 0.375 0.364 0.262 -0.037 0.043  -0.020 454 ARG EEE N   
965  C CA  . ARG A 125 ? 0.380 0.381 0.251 -0.018 0.030  0.009  454 ARG EEE CA  
966  C C   . ARG A 125 ? 0.391 0.409 0.298 0.005  0.037  -0.023 454 ARG EEE C   
967  O O   . ARG A 125 ? 0.405 0.441 0.279 -0.023 0.024  -0.022 454 ARG EEE O   
968  C CB  . ARG A 125 ? 0.397 0.384 0.315 -0.027 0.018  -0.012 454 ARG EEE CB  
969  C CG  . ARG A 125 ? 0.378 0.395 0.307 -0.003 0.021  0.001  454 ARG EEE CG  
970  C CD  . ARG A 125 ? 0.360 0.385 0.338 -0.003 -0.001 -0.015 454 ARG EEE CD  
971  N NE  . ARG A 125 ? 0.360 0.398 0.319 -0.008 -0.003 -0.015 454 ARG EEE NE  
972  C CZ  . ARG A 125 ? 0.393 0.361 0.299 0.023  -0.013 -0.019 454 ARG EEE CZ  
973  N NH1 . ARG A 125 ? 0.413 0.383 0.295 0.022  0.020  0.024  454 ARG EEE NH1 
974  N NH2 . ARG A 125 ? 0.407 0.375 0.327 0.033  -0.011 0.020  454 ARG EEE NH2 
975  N N   . LEU A 126 ? 0.379 0.390 0.280 -0.006 0.038  0.011  455 LEU EEE N   
976  C CA  . LEU A 126 ? 0.374 0.445 0.309 0.003  0.061  0.030  455 LEU EEE CA  
977  C C   . LEU A 126 ? 0.349 0.450 0.329 -0.002 0.087  0.013  455 LEU EEE C   
978  O O   . LEU A 126 ? 0.351 0.448 0.352 -0.013 0.102  -0.008 455 LEU EEE O   
979  C CB  . LEU A 126 ? 0.412 0.456 0.373 -0.013 0.079  0.000  455 LEU EEE CB  
980  C CG  . LEU A 126 ? 0.453 0.494 0.415 0.020  0.097  0.001  455 LEU EEE CG  
981  C CD1 . LEU A 126 ? 0.522 0.538 0.415 0.007  0.074  0.006  455 LEU EEE CD1 
982  C CD2 . LEU A 126 ? 0.494 0.492 0.389 0.002  0.129  -0.031 455 LEU EEE CD2 
983  N N   . PHE A 127 ? 0.392 0.438 0.340 -0.008 0.054  0.023  456 PHE EEE N   
984  C CA  . PHE A 127 ? 0.386 0.432 0.356 -0.007 0.058  0.019  456 PHE EEE CA  
985  C C   . PHE A 127 ? 0.403 0.435 0.380 -0.016 0.033  0.015  456 PHE EEE C   
986  O O   . PHE A 127 ? 0.384 0.458 0.378 -0.007 0.018  0.008  456 PHE EEE O   
987  C CB  . PHE A 127 ? 0.427 0.425 0.381 0.001  0.054  0.021  456 PHE EEE CB  
988  C CG  . PHE A 127 ? 0.485 0.461 0.381 0.031  0.087  0.009  456 PHE EEE CG  
989  C CD1 . PHE A 127 ? 0.502 0.516 0.441 0.029  0.115  0.017  456 PHE EEE CD1 
990  C CD2 . PHE A 127 ? 0.473 0.481 0.362 0.027  0.102  0.004  456 PHE EEE CD2 
991  C CE1 . PHE A 127 ? 0.499 0.528 0.507 0.027  0.129  -0.005 456 PHE EEE CE1 
992  C CE2 . PHE A 127 ? 0.486 0.441 0.397 0.013  0.081  0.015  456 PHE EEE CE2 
993  C CZ  . PHE A 127 ? 0.466 0.532 0.460 0.022  0.096  0.012  456 PHE EEE CZ  
994  N N   . ARG A 128 ? 0.375 0.458 0.388 -0.009 0.036  0.020  457 ARG EEE N   
995  C CA  . ARG A 128 ? 0.398 0.433 0.423 -0.034 -0.013 0.018  457 ARG EEE CA  
996  C C   . ARG A 128 ? 0.384 0.474 0.455 -0.017 0.004  0.031  457 ARG EEE C   
997  O O   . ARG A 128 ? 0.362 0.527 0.460 -0.032 0.020  0.004  457 ARG EEE O   
998  C CB  . ARG A 128 ? 0.384 0.431 0.435 -0.018 0.005  0.008  457 ARG EEE CB  
999  C CG  . ARG A 128 ? 0.402 0.441 0.429 -0.012 -0.026 -0.000 457 ARG EEE CG  
1000 C CD  . ARG A 128 ? 0.422 0.430 0.395 0.001  -0.013 0.016  457 ARG EEE CD  
1001 N NE  . ARG A 128 ? 0.440 0.434 0.390 -0.007 -0.021 0.010  457 ARG EEE NE  
1002 C CZ  . ARG A 128 ? 0.452 0.457 0.419 -0.010 -0.024 -0.016 457 ARG EEE CZ  
1003 N NH1 . ARG A 128 ? 0.439 0.487 0.492 -0.070 -0.053 -0.034 457 ARG EEE NH1 
1004 N NH2 . ARG A 128 ? 0.447 0.446 0.428 -0.010 -0.022 -0.031 457 ARG EEE NH2 
1005 N N   . LYS A 129 ? 0.432 0.470 0.467 -0.004 -0.084 0.052  458 LYS EEE N   
1006 C CA  . LYS A 129 ? 0.435 0.457 0.551 -0.030 -0.066 0.045  458 LYS EEE CA  
1007 C C   . LYS A 129 ? 0.378 0.517 0.503 -0.031 -0.029 0.053  458 LYS EEE C   
1008 O O   . LYS A 129 ? 0.366 0.526 0.651 -0.029 -0.020 0.101  458 LYS EEE O   
1009 C CB  . LYS A 129 ? 0.505 0.551 0.557 -0.050 -0.121 0.029  458 LYS EEE CB  
1010 C CG  . LYS A 129 ? 0.573 0.570 0.618 -0.037 -0.155 0.055  458 LYS EEE CG  
1011 C CD  . LYS A 129 ? 0.697 0.722 0.621 -0.037 -0.130 -0.008 458 LYS EEE CD  
1012 C CE  . LYS A 129 ? 0.773 0.813 0.659 -0.020 -0.113 -0.078 458 LYS EEE CE  
1013 N NZ  . LYS A 129 ? 0.818 0.900 0.686 -0.002 -0.167 -0.035 458 LYS EEE NZ  
1014 N N   . SER A 130 ? 0.394 0.479 0.513 -0.038 -0.031 0.038  459 SER EEE N   
1015 C CA  . SER A 130 ? 0.451 0.482 0.514 -0.033 -0.078 0.037  459 SER EEE CA  
1016 C C   . SER A 130 ? 0.440 0.445 0.473 -0.046 -0.068 0.035  459 SER EEE C   
1017 O O   . SER A 130 ? 0.403 0.442 0.444 -0.028 -0.056 0.010  459 SER EEE O   
1018 C CB  . SER A 130 ? 0.527 0.478 0.512 0.004  -0.064 0.015  459 SER EEE CB  
1019 O OG  . SER A 130 ? 0.510 0.491 0.518 0.013  -0.108 -0.012 459 SER EEE OG  
1020 N N   . ASN A 131 ? 0.473 0.497 0.449 -0.065 -0.054 0.051  460 ASN EEE N   
1021 C CA  . ASN A 131 ? 0.465 0.464 0.442 -0.040 -0.041 0.039  460 ASN EEE CA  
1022 C C   . ASN A 131 ? 0.417 0.429 0.390 -0.056 -0.080 0.026  460 ASN EEE C   
1023 O O   . ASN A 131 ? 0.428 0.451 0.432 -0.046 -0.097 -0.017 460 ASN EEE O   
1024 C CB  . ASN A 131 ? 0.483 0.493 0.425 -0.064 -0.035 0.023  460 ASN EEE CB  
1025 C CG  . ASN A 131 ? 0.449 0.540 0.442 -0.053 -0.019 0.038  460 ASN EEE CG  
1026 O OD1 . ASN A 131 ? 0.446 0.536 0.462 -0.010 -0.023 0.009  460 ASN EEE OD1 
1027 N ND2 . ASN A 131 ? 0.539 0.599 0.486 -0.089 0.055  0.037  460 ASN EEE ND2 
1028 N N   . LEU A 132 ? 0.408 0.458 0.408 -0.057 -0.044 0.012  461 LEU EEE N   
1029 C CA  . LEU A 132 ? 0.426 0.413 0.418 -0.044 -0.050 0.003  461 LEU EEE CA  
1030 C C   . LEU A 132 ? 0.423 0.429 0.398 -0.052 -0.033 -0.002 461 LEU EEE C   
1031 O O   . LEU A 132 ? 0.456 0.406 0.429 -0.041 0.022  0.019  461 LEU EEE O   
1032 C CB  . LEU A 132 ? 0.406 0.410 0.410 -0.038 -0.035 -0.014 461 LEU EEE CB  
1033 C CG  . LEU A 132 ? 0.427 0.413 0.401 -0.043 -0.030 -0.003 461 LEU EEE CG  
1034 C CD1 . LEU A 132 ? 0.406 0.434 0.349 -0.018 -0.014 -0.010 461 LEU EEE CD1 
1035 C CD2 . LEU A 132 ? 0.441 0.437 0.415 -0.041 -0.021 -0.007 461 LEU EEE CD2 
1036 N N   . LYS A 133 ? 0.457 0.416 0.417 -0.049 -0.050 -0.018 462 LYS EEE N   
1037 C CA  . LYS A 133 ? 0.458 0.436 0.395 -0.034 -0.075 0.018  462 LYS EEE CA  
1038 C C   . LYS A 133 ? 0.444 0.445 0.367 -0.055 -0.069 -0.014 462 LYS EEE C   
1039 O O   . LYS A 133 ? 0.434 0.414 0.288 -0.033 -0.068 0.000  462 LYS EEE O   
1040 C CB  . LYS A 133 ? 0.524 0.464 0.430 -0.066 -0.093 -0.029 462 LYS EEE CB  
1041 C CG  . LYS A 133 ? 0.550 0.527 0.539 -0.068 -0.126 -0.012 462 LYS EEE CG  
1042 C CD  . LYS A 133 ? 0.733 0.655 0.617 -0.080 -0.074 -0.109 462 LYS EEE CD  
1043 C CE  . LYS A 133 ? 0.842 0.715 0.743 -0.170 -0.020 -0.099 462 LYS EEE CE  
1044 N NZ  . LYS A 133 ? 0.998 0.709 0.743 -0.132 0.091  -0.125 462 LYS EEE NZ  
1045 N N   . PRO A 134 ? 0.442 0.461 0.377 -0.056 -0.077 0.017  463 PRO EEE N   
1046 C CA  . PRO A 134 ? 0.420 0.420 0.404 -0.047 -0.047 0.014  463 PRO EEE CA  
1047 C C   . PRO A 134 ? 0.448 0.382 0.371 -0.036 -0.035 -0.023 463 PRO EEE C   
1048 O O   . PRO A 134 ? 0.435 0.386 0.371 -0.040 -0.026 -0.028 463 PRO EEE O   
1049 C CB  . PRO A 134 ? 0.485 0.431 0.393 -0.044 -0.059 0.032  463 PRO EEE CB  
1050 C CG  . PRO A 134 ? 0.475 0.464 0.437 -0.029 -0.069 0.062  463 PRO EEE CG  
1051 C CD  . PRO A 134 ? 0.464 0.502 0.402 -0.055 -0.067 0.058  463 PRO EEE CD  
1052 N N   . PHE A 135 ? 0.435 0.381 0.331 -0.033 -0.044 0.016  464 PHE EEE N   
1053 C CA  . PHE A 135 ? 0.433 0.404 0.339 -0.033 -0.047 -0.002 464 PHE EEE CA  
1054 C C   . PHE A 135 ? 0.434 0.395 0.322 -0.016 -0.033 -0.022 464 PHE EEE C   
1055 O O   . PHE A 135 ? 0.459 0.400 0.331 -0.017 -0.010 -0.000 464 PHE EEE O   
1056 C CB  . PHE A 135 ? 0.442 0.408 0.320 -0.035 -0.065 0.008  464 PHE EEE CB  
1057 C CG  . PHE A 135 ? 0.498 0.430 0.290 -0.039 -0.072 -0.001 464 PHE EEE CG  
1058 C CD1 . PHE A 135 ? 0.476 0.414 0.329 -0.035 -0.052 -0.022 464 PHE EEE CD1 
1059 C CD2 . PHE A 135 ? 0.525 0.454 0.300 -0.039 -0.054 0.004  464 PHE EEE CD2 
1060 C CE1 . PHE A 135 ? 0.458 0.457 0.302 -0.044 -0.058 -0.031 464 PHE EEE CE1 
1061 C CE2 . PHE A 135 ? 0.533 0.433 0.260 -0.050 -0.040 -0.019 464 PHE EEE CE2 
1062 C CZ  . PHE A 135 ? 0.497 0.447 0.312 -0.044 -0.064 -0.012 464 PHE EEE CZ  
1063 N N   . GLU A 136 ? 0.428 0.389 0.298 -0.031 -0.047 0.009  465 GLU EEE N   
1064 C CA  . GLU A 136 ? 0.450 0.402 0.292 -0.016 -0.017 0.010  465 GLU EEE CA  
1065 C C   . GLU A 136 ? 0.452 0.409 0.260 -0.017 -0.023 -0.006 465 GLU EEE C   
1066 O O   . GLU A 136 ? 0.422 0.402 0.267 -0.041 -0.014 -0.027 465 GLU EEE O   
1067 C CB  . GLU A 136 ? 0.450 0.406 0.321 -0.014 -0.042 0.005  465 GLU EEE CB  
1068 C CG  . GLU A 136 ? 0.487 0.437 0.345 0.006  -0.055 0.015  465 GLU EEE CG  
1069 C CD  . GLU A 136 ? 0.496 0.498 0.385 -0.004 -0.063 -0.001 465 GLU EEE CD  
1070 O OE1 . GLU A 136 ? 0.505 0.501 0.469 -0.098 -0.080 0.057  465 GLU EEE OE1 
1071 O OE2 . GLU A 136 ? 0.597 0.561 0.421 0.001  -0.076 0.056  465 GLU EEE OE2 
1072 N N   . ARG A 137 ? 0.453 0.396 0.260 -0.023 -0.028 -0.016 466 ARG EEE N   
1073 C CA  . ARG A 137 ? 0.459 0.377 0.248 -0.007 -0.038 -0.019 466 ARG EEE CA  
1074 C C   . ARG A 137 ? 0.474 0.387 0.243 -0.006 -0.053 -0.022 466 ARG EEE C   
1075 O O   . ARG A 137 ? 0.544 0.409 0.232 -0.020 -0.066 -0.016 466 ARG EEE O   
1076 C CB  . ARG A 137 ? 0.462 0.392 0.262 0.011  -0.047 0.005  466 ARG EEE CB  
1077 C CG  . ARG A 137 ? 0.451 0.385 0.221 0.012  -0.022 -0.004 466 ARG EEE CG  
1078 C CD  . ARG A 137 ? 0.443 0.388 0.238 0.010  -0.018 0.005  466 ARG EEE CD  
1079 N NE  . ARG A 137 ? 0.448 0.385 0.221 -0.001 -0.017 0.006  466 ARG EEE NE  
1080 C CZ  . ARG A 137 ? 0.472 0.399 0.260 -0.029 -0.018 0.033  466 ARG EEE CZ  
1081 N NH1 . ARG A 137 ? 0.482 0.427 0.230 -0.035 0.011  0.013  466 ARG EEE NH1 
1082 N NH2 . ARG A 137 ? 0.465 0.399 0.241 -0.025 -0.008 -0.006 466 ARG EEE NH2 
1083 N N   . ASP A 138 ? 0.419 0.373 0.254 -0.007 -0.024 -0.003 467 ASP EEE N   
1084 C CA  . ASP A 138 ? 0.427 0.378 0.280 0.012  -0.019 -0.014 467 ASP EEE CA  
1085 C C   . ASP A 138 ? 0.401 0.393 0.280 -0.003 0.005  -0.026 467 ASP EEE C   
1086 O O   . ASP A 138 ? 0.440 0.363 0.247 -0.016 -0.007 0.000  467 ASP EEE O   
1087 C CB  . ASP A 138 ? 0.426 0.421 0.268 0.005  -0.010 -0.001 467 ASP EEE CB  
1088 C CG  . ASP A 138 ? 0.439 0.469 0.298 0.009  -0.043 0.012  467 ASP EEE CG  
1089 O OD1 . ASP A 138 ? 0.426 0.538 0.308 0.000  -0.038 0.024  467 ASP EEE OD1 
1090 O OD2 . ASP A 138 ? 0.456 0.500 0.302 -0.006 -0.035 0.028  467 ASP EEE OD2 
1091 N N   . ILE A 139 ? 0.412 0.386 0.278 0.002  -0.007 -0.000 468 ILE EEE N   
1092 C CA  . ILE A 139 ? 0.418 0.407 0.246 -0.021 -0.025 0.007  468 ILE EEE CA  
1093 C C   . ILE A 139 ? 0.402 0.410 0.278 -0.010 -0.002 0.022  468 ILE EEE C   
1094 O O   . ILE A 139 ? 0.476 0.393 0.253 -0.001 -0.010 0.056  468 ILE EEE O   
1095 C CB  . ILE A 139 ? 0.450 0.422 0.272 -0.006 0.001  0.012  468 ILE EEE CB  
1096 C CG1 . ILE A 139 ? 0.487 0.462 0.287 -0.006 0.011  -0.006 468 ILE EEE CG1 
1097 C CG2 . ILE A 139 ? 0.460 0.412 0.265 -0.028 -0.002 0.019  468 ILE EEE CG2 
1098 C CD1 . ILE A 139 ? 0.544 0.533 0.263 -0.005 0.034  0.005  468 ILE EEE CD1 
1099 N N   . SER A 140 ? 0.418 0.393 0.283 -0.008 -0.024 0.015  469 SER EEE N   
1100 C CA  A SER A 140 ? 0.402 0.413 0.278 -0.002 -0.032 0.009  469 SER EEE CA  
1101 C CA  B SER A 140 ? 0.442 0.418 0.282 0.010  -0.036 0.011  469 SER EEE CA  
1102 C C   . SER A 140 ? 0.417 0.401 0.280 -0.012 -0.043 0.019  469 SER EEE C   
1103 O O   . SER A 140 ? 0.404 0.416 0.273 -0.003 -0.033 0.017  469 SER EEE O   
1104 C CB  A SER A 140 ? 0.399 0.406 0.308 -0.010 -0.029 0.013  469 SER EEE CB  
1105 C CB  B SER A 140 ? 0.465 0.442 0.315 -0.010 -0.055 0.015  469 SER EEE CB  
1106 O OG  A SER A 140 ? 0.330 0.393 0.267 -0.046 -0.077 0.014  469 SER EEE OG  
1107 O OG  B SER A 140 ? 0.493 0.472 0.396 -0.004 -0.073 0.049  469 SER EEE OG  
1108 N N   . THR A 141 ? 0.438 0.417 0.243 0.003  -0.011 0.018  470 THR EEE N   
1109 C CA  . THR A 141 ? 0.432 0.422 0.280 0.012  -0.040 -0.009 470 THR EEE CA  
1110 C C   . THR A 141 ? 0.435 0.431 0.267 0.009  -0.046 -0.008 470 THR EEE C   
1111 O O   . THR A 141 ? 0.468 0.444 0.367 0.013  -0.032 -0.012 470 THR EEE O   
1112 C CB  . THR A 141 ? 0.431 0.450 0.357 0.003  -0.017 -0.020 470 THR EEE CB  
1113 O OG1 . THR A 141 ? 0.441 0.425 0.373 0.026  -0.003 -0.025 470 THR EEE OG1 
1114 C CG2 . THR A 141 ? 0.485 0.437 0.359 0.004  -0.045 -0.016 470 THR EEE CG2 
1115 N N   . GLU A 142 ? 0.464 0.397 0.340 0.013  -0.067 0.001  471 GLU EEE N   
1116 C CA  . GLU A 142 ? 0.472 0.449 0.371 0.052  -0.071 -0.037 471 GLU EEE CA  
1117 C C   . GLU A 142 ? 0.468 0.442 0.361 0.025  -0.079 -0.025 471 GLU EEE C   
1118 O O   . GLU A 142 ? 0.408 0.453 0.350 0.006  -0.029 -0.005 471 GLU EEE O   
1119 C CB  . GLU A 142 ? 0.565 0.482 0.503 0.011  -0.128 -0.026 471 GLU EEE CB  
1120 C CG  . GLU A 142 ? 0.614 0.588 0.647 0.048  -0.127 -0.064 471 GLU EEE CG  
1121 C CD  . GLU A 142 ? 0.804 0.678 0.669 -0.058 -0.212 -0.082 471 GLU EEE CD  
1122 O OE1 . GLU A 142 ? 0.878 0.721 0.614 0.029  -0.169 -0.083 471 GLU EEE OE1 
1123 O OE2 . GLU A 142 ? 0.980 0.726 0.586 -0.089 -0.182 -0.056 471 GLU EEE OE2 
1124 N N   . ILE A 143 ? 0.442 0.448 0.364 0.037  -0.049 -0.022 472 ILE EEE N   
1125 C CA  . ILE A 143 ? 0.454 0.439 0.375 0.010  -0.061 -0.039 472 ILE EEE CA  
1126 C C   . ILE A 143 ? 0.449 0.436 0.400 0.010  -0.052 -0.027 472 ILE EEE C   
1127 O O   . ILE A 143 ? 0.489 0.491 0.386 -0.031 -0.077 -0.001 472 ILE EEE O   
1128 C CB  . ILE A 143 ? 0.454 0.449 0.345 0.022  -0.059 -0.026 472 ILE EEE CB  
1129 C CG1 . ILE A 143 ? 0.450 0.451 0.354 0.021  -0.059 -0.016 472 ILE EEE CG1 
1130 C CG2 . ILE A 143 ? 0.484 0.482 0.349 0.019  -0.043 -0.043 472 ILE EEE CG2 
1131 C CD1 . ILE A 143 ? 0.453 0.487 0.314 -0.007 -0.028 0.014  472 ILE EEE CD1 
1132 N N   . TYR A 144 ? 0.436 0.436 0.403 -0.005 -0.044 -0.018 473 TYR EEE N   
1133 C CA  . TYR A 144 ? 0.425 0.431 0.436 -0.007 -0.047 0.015  473 TYR EEE CA  
1134 C C   . TYR A 144 ? 0.433 0.442 0.489 0.003  -0.054 0.032  473 TYR EEE C   
1135 O O   . TYR A 144 ? 0.407 0.462 0.507 0.013  -0.053 0.026  473 TYR EEE O   
1136 C CB  . TYR A 144 ? 0.408 0.451 0.447 0.007  -0.044 0.023  473 TYR EEE CB  
1137 C CG  . TYR A 144 ? 0.412 0.468 0.462 0.015  -0.021 0.021  473 TYR EEE CG  
1138 C CD1 . TYR A 144 ? 0.428 0.477 0.449 0.003  -0.040 -0.007 473 TYR EEE CD1 
1139 C CD2 . TYR A 144 ? 0.429 0.504 0.524 0.026  0.004  0.005  473 TYR EEE CD2 
1140 C CE1 . TYR A 144 ? 0.402 0.486 0.528 -0.023 -0.043 -0.010 473 TYR EEE CE1 
1141 C CE2 . TYR A 144 ? 0.432 0.494 0.498 0.028  -0.013 0.007  473 TYR EEE CE2 
1142 C CZ  . TYR A 144 ? 0.433 0.507 0.530 -0.014 -0.023 0.017  473 TYR EEE CZ  
1143 O OH  . TYR A 144 ? 0.474 0.580 0.587 -0.045 0.004  0.058  473 TYR EEE OH  
1144 N N   . GLN A 145 ? 0.431 0.466 0.614 0.007  -0.071 0.024  474 GLN EEE N   
1145 C CA  . GLN A 145 ? 0.432 0.504 0.675 -0.008 -0.121 0.037  474 GLN EEE CA  
1146 C C   . GLN A 145 ? 0.412 0.498 0.737 -0.017 -0.067 0.035  474 GLN EEE C   
1147 O O   . GLN A 145 ? 0.452 0.490 0.772 -0.009 -0.048 0.087  474 GLN EEE O   
1148 C CB  . GLN A 145 ? 0.480 0.551 0.741 0.004  -0.174 -0.001 474 GLN EEE CB  
1149 C CG  . GLN A 145 ? 0.510 0.557 0.825 0.033  -0.193 0.018  474 GLN EEE CG  
1150 C CD  . GLN A 145 ? 0.485 0.544 0.895 0.026  -0.204 0.004  474 GLN EEE CD  
1151 O OE1 . GLN A 145 ? 0.611 0.547 0.841 0.016  -0.261 -0.038 474 GLN EEE OE1 
1152 N NE2 . GLN A 145 ? 0.460 0.711 1.023 -0.054 -0.252 -0.002 474 GLN EEE NE2 
1153 N N   . ALA A 146 ? 0.377 0.524 0.714 0.008  -0.016 0.040  475 ALA EEE N   
1154 C CA  . ALA A 146 ? 0.429 0.574 0.786 -0.004 0.031  0.054  475 ALA EEE CA  
1155 C C   . ALA A 146 ? 0.431 0.623 0.837 -0.000 0.020  0.084  475 ALA EEE C   
1156 O O   . ALA A 146 ? 0.430 0.622 0.897 -0.048 0.063  0.063  475 ALA EEE O   
1157 C CB  . ALA A 146 ? 0.458 0.594 0.748 -0.003 0.087  0.023  475 ALA EEE CB  
1158 N N   . GLY A 147 ? 0.427 0.621 0.952 -0.003 -0.058 0.138  476 GLY EEE N   
1159 C CA  . GLY A 147 ? 0.429 0.655 1.003 0.018  -0.047 0.123  476 GLY EEE CA  
1160 C C   . GLY A 147 ? 0.446 0.617 1.064 -0.006 -0.067 0.105  476 GLY EEE C   
1161 O O   . GLY A 147 ? 0.444 0.620 1.118 0.021  -0.144 0.120  476 GLY EEE O   
1162 N N   . SER A 148 ? 0.465 0.640 1.170 0.018  -0.088 0.086  477 SER EEE N   
1163 C CA  . SER A 148 ? 0.450 0.640 1.236 0.072  -0.102 0.043  477 SER EEE CA  
1164 C C   . SER A 148 ? 0.540 0.629 1.167 0.038  -0.138 -0.013 477 SER EEE C   
1165 O O   . SER A 148 ? 0.719 0.736 1.227 -0.001 -0.183 -0.091 477 SER EEE O   
1166 C CB  . SER A 148 ? 0.450 0.660 1.370 0.075  -0.059 0.048  477 SER EEE CB  
1167 O OG  . SER A 148 ? 0.450 0.649 1.411 0.069  0.046  0.101  477 SER EEE OG  
1168 N N   . THR A 149 ? 0.552 0.625 1.115 0.039  -0.174 -0.001 478 THR EEE N   
1169 C CA  . THR A 149 ? 0.551 0.670 1.098 0.029  -0.174 0.005  478 THR EEE CA  
1170 C C   . THR A 149 ? 0.541 0.603 0.985 0.043  -0.250 -0.022 478 THR EEE C   
1171 O O   . THR A 149 ? 0.470 0.619 1.092 -0.003 -0.268 0.019  478 THR EEE O   
1172 C CB  . THR A 149 ? 0.578 0.650 1.149 0.084  -0.101 0.033  478 THR EEE CB  
1173 O OG1 . THR A 149 ? 0.565 0.613 1.215 0.045  -0.035 0.074  478 THR EEE OG1 
1174 C CG2 . THR A 149 ? 0.619 0.666 1.162 0.086  -0.132 0.072  478 THR EEE CG2 
1175 N N   . PRO A 150 ? 0.537 0.675 0.946 0.018  -0.261 -0.021 479 PRO EEE N   
1176 C CA  . PRO A 150 ? 0.555 0.668 0.874 -0.009 -0.224 0.012  479 PRO EEE CA  
1177 C C   . PRO A 150 ? 0.542 0.628 0.834 0.026  -0.270 -0.010 479 PRO EEE C   
1178 O O   . PRO A 150 ? 0.558 0.652 0.730 0.007  -0.253 0.087  479 PRO EEE O   
1179 C CB  . PRO A 150 ? 0.614 0.648 0.901 0.006  -0.236 -0.038 479 PRO EEE CB  
1180 C CG  . PRO A 150 ? 0.622 0.729 0.898 0.009  -0.243 -0.046 479 PRO EEE CG  
1181 C CD  . PRO A 150 ? 0.620 0.728 0.893 0.016  -0.262 -0.041 479 PRO EEE CD  
1182 N N   . CYS A 151 ? 0.515 0.665 0.771 0.013  -0.216 -0.004 480 CYS EEE N   
1183 C CA  . CYS A 151 ? 0.558 0.635 0.632 -0.005 -0.187 -0.035 480 CYS EEE CA  
1184 C C   . CYS A 151 ? 0.662 0.639 0.574 0.004  -0.202 -0.008 480 CYS EEE C   
1185 O O   . CYS A 151 ? 0.619 0.567 0.436 0.080  -0.147 -0.028 480 CYS EEE O   
1186 C CB  . CYS A 151 ? 0.553 0.620 0.599 -0.007 -0.161 -0.008 480 CYS EEE CB  
1187 S SG  . CYS A 151 ? 0.607 0.578 0.639 -0.020 -0.126 -0.009 480 CYS EEE SG  
1188 N N   . ASN A 152 ? 0.695 0.684 0.632 -0.020 -0.158 -0.045 481 ASN EEE N   
1189 C CA  . ASN A 152 ? 0.708 0.750 0.581 -0.041 -0.178 -0.030 481 ASN EEE CA  
1190 C C   . ASN A 152 ? 0.686 0.656 0.448 -0.017 -0.122 0.019  481 ASN EEE C   
1191 O O   . ASN A 152 ? 0.630 0.659 0.403 -0.021 -0.092 0.008  481 ASN EEE O   
1192 C CB  . ASN A 152 ? 0.757 0.800 0.669 -0.025 -0.223 -0.007 481 ASN EEE CB  
1193 C CG  . ASN A 152 ? 0.756 0.895 0.754 -0.008 -0.232 0.010  481 ASN EEE CG  
1194 O OD1 . ASN A 152 ? 0.943 0.976 0.748 -0.086 -0.339 -0.069 481 ASN EEE OD1 
1195 N ND2 . ASN A 152 ? 0.746 0.997 0.793 0.039  -0.230 0.046  481 ASN EEE ND2 
1196 N N   . GLY A 153 ? 0.663 0.611 0.394 -0.022 -0.114 -0.015 482 GLY EEE N   
1197 C CA  . GLY A 153 ? 0.630 0.623 0.436 -0.014 -0.055 0.000  482 GLY EEE CA  
1198 C C   . GLY A 153 ? 0.578 0.586 0.457 -0.004 -0.008 0.034  482 GLY EEE C   
1199 O O   . GLY A 153 ? 0.571 0.601 0.394 0.007  0.015  0.049  482 GLY EEE O   
1200 N N   . VAL A 154 ? 0.554 0.525 0.392 -0.017 -0.066 0.005  483 VAL EEE N   
1201 C CA  . VAL A 154 ? 0.574 0.510 0.366 -0.004 -0.072 0.023  483 VAL EEE CA  
1202 C C   . VAL A 154 ? 0.500 0.480 0.409 -0.027 -0.036 0.018  483 VAL EEE C   
1203 O O   . VAL A 154 ? 0.474 0.532 0.377 -0.011 -0.047 0.066  483 VAL EEE O   
1204 C CB  . VAL A 154 ? 0.645 0.556 0.412 0.033  -0.098 0.030  483 VAL EEE CB  
1205 C CG1 . VAL A 154 ? 0.709 0.556 0.448 0.037  -0.078 0.032  483 VAL EEE CG1 
1206 C CG2 . VAL A 154 ? 0.698 0.602 0.428 0.033  -0.058 0.044  483 VAL EEE CG2 
1207 N N   . GLU A 155 ? 0.477 0.462 0.373 0.006  -0.039 0.012  484 GLU EEE N   
1208 C CA  . GLU A 155 ? 0.451 0.444 0.382 0.031  -0.005 0.024  484 GLU EEE CA  
1209 C C   . GLU A 155 ? 0.449 0.484 0.392 0.049  -0.012 0.024  484 GLU EEE C   
1210 O O   . GLU A 155 ? 0.486 0.539 0.444 0.083  0.028  0.073  484 GLU EEE O   
1211 C CB  . GLU A 155 ? 0.417 0.427 0.366 0.029  0.019  0.027  484 GLU EEE CB  
1212 C CG  . GLU A 155 ? 0.402 0.432 0.338 0.028  0.010  0.013  484 GLU EEE CG  
1213 C CD  . GLU A 155 ? 0.421 0.439 0.323 0.026  -0.002 -0.014 484 GLU EEE CD  
1214 O OE1 . GLU A 155 ? 0.454 0.415 0.329 0.058  0.024  -0.014 484 GLU EEE OE1 
1215 O OE2 . GLU A 155 ? 0.447 0.457 0.262 0.003  0.009  -0.027 484 GLU EEE OE2 
1216 N N   . GLY A 156 ? 0.401 0.498 0.456 0.060  0.015  0.030  485 GLY EEE N   
1217 C CA  . GLY A 156 ? 0.420 0.494 0.501 0.078  0.004  0.050  485 GLY EEE CA  
1218 C C   . GLY A 156 ? 0.405 0.505 0.512 0.065  0.007  0.055  485 GLY EEE C   
1219 O O   . GLY A 156 ? 0.455 0.474 0.534 0.069  0.017  0.073  485 GLY EEE O   
1220 N N   . PHE A 157 ? 0.406 0.542 0.558 0.066  0.003  0.032  486 PHE EEE N   
1221 C CA  A PHE A 157 ? 0.483 0.568 0.569 0.053  0.043  0.037  486 PHE EEE CA  
1222 C CA  B PHE A 157 ? 0.463 0.575 0.581 0.071  0.059  0.029  486 PHE EEE CA  
1223 C C   . PHE A 157 ? 0.430 0.566 0.600 0.083  0.044  0.003  486 PHE EEE C   
1224 O O   . PHE A 157 ? 0.475 0.562 0.566 0.044  0.023  0.079  486 PHE EEE O   
1225 C CB  A PHE A 157 ? 0.544 0.581 0.608 0.087  0.031  0.014  486 PHE EEE CB  
1226 C CB  B PHE A 157 ? 0.486 0.637 0.618 0.111  0.091  0.006  486 PHE EEE CB  
1227 C CG  A PHE A 157 ? 0.629 0.588 0.581 0.030  0.042  0.037  486 PHE EEE CG  
1228 C CG  B PHE A 157 ? 0.541 0.695 0.637 0.104  0.137  0.014  486 PHE EEE CG  
1229 C CD1 A PHE A 157 ? 0.714 0.586 0.563 0.040  0.040  0.007  486 PHE EEE CD1 
1230 C CD1 B PHE A 157 ? 0.585 0.766 0.613 0.084  0.170  0.014  486 PHE EEE CD1 
1231 C CD2 A PHE A 157 ? 0.700 0.589 0.605 0.042  0.020  0.037  486 PHE EEE CD2 
1232 C CD2 B PHE A 157 ? 0.564 0.743 0.660 0.094  0.139  -0.020 486 PHE EEE CD2 
1233 C CE1 A PHE A 157 ? 0.757 0.580 0.535 0.028  0.028  0.020  486 PHE EEE CE1 
1234 C CE1 B PHE A 157 ? 0.605 0.816 0.613 0.077  0.193  -0.016 486 PHE EEE CE1 
1235 C CE2 A PHE A 157 ? 0.723 0.587 0.586 0.054  0.018  0.012  486 PHE EEE CE2 
1236 C CE2 B PHE A 157 ? 0.595 0.799 0.656 0.097  0.152  -0.003 486 PHE EEE CE2 
1237 C CZ  A PHE A 157 ? 0.751 0.570 0.554 0.061  0.034  0.006  486 PHE EEE CZ  
1238 C CZ  B PHE A 157 ? 0.576 0.808 0.625 0.110  0.194  -0.016 486 PHE EEE CZ  
1239 N N   . ASN A 158 ? 0.429 0.547 0.631 0.048  0.066  0.017  487 ASN EEE N   
1240 C CA  . ASN A 158 ? 0.440 0.560 0.671 0.030  0.038  0.044  487 ASN EEE CA  
1241 C C   . ASN A 158 ? 0.405 0.508 0.616 0.011  -0.015 0.037  487 ASN EEE C   
1242 O O   . ASN A 158 ? 0.432 0.509 0.759 0.022  0.005  0.033  487 ASN EEE O   
1243 C CB  . ASN A 158 ? 0.448 0.660 0.734 0.017  0.008  0.026  487 ASN EEE CB  
1244 C CG  . ASN A 158 ? 0.532 0.812 0.741 0.030  0.047  0.011  487 ASN EEE CG  
1245 O OD1 . ASN A 158 ? 0.557 1.060 0.899 0.110  0.049  0.040  487 ASN EEE OD1 
1246 N ND2 . ASN A 158 ? 0.602 0.782 0.711 0.046  0.051  0.023  487 ASN EEE ND2 
1247 N N   . CYS A 159 ? 0.392 0.451 0.559 0.041  0.011  0.006  488 CYS EEE N   
1248 C CA  . CYS A 159 ? 0.406 0.457 0.488 0.048  -0.023 0.009  488 CYS EEE CA  
1249 C C   . CYS A 159 ? 0.415 0.444 0.438 0.044  -0.019 -0.003 488 CYS EEE C   
1250 O O   . CYS A 159 ? 0.395 0.470 0.405 0.039  0.013  0.014  488 CYS EEE O   
1251 C CB  . CYS A 159 ? 0.459 0.507 0.508 0.052  -0.058 0.026  488 CYS EEE CB  
1252 S SG  . CYS A 159 ? 0.516 0.560 0.553 0.016  -0.095 0.004  488 CYS EEE SG  
1253 N N   . TYR A 160 ? 0.428 0.445 0.369 0.032  0.005  0.001  489 TYR EEE N   
1254 C CA  . TYR A 160 ? 0.413 0.440 0.388 0.016  0.013  -0.002 489 TYR EEE CA  
1255 C C   . TYR A 160 ? 0.392 0.423 0.315 -0.013 0.014  0.016  489 TYR EEE C   
1256 O O   . TYR A 160 ? 0.393 0.423 0.420 -0.011 -0.024 0.001  489 TYR EEE O   
1257 C CB  . TYR A 160 ? 0.426 0.447 0.412 0.011  0.030  0.017  489 TYR EEE CB  
1258 C CG  . TYR A 160 ? 0.435 0.477 0.402 0.020  0.037  -0.012 489 TYR EEE CG  
1259 C CD1 . TYR A 160 ? 0.476 0.484 0.427 0.054  0.056  0.008  489 TYR EEE CD1 
1260 C CD2 . TYR A 160 ? 0.459 0.499 0.467 -0.012 0.031  -0.022 489 TYR EEE CD2 
1261 C CE1 . TYR A 160 ? 0.463 0.526 0.545 0.064  0.076  0.021  489 TYR EEE CE1 
1262 C CE2 . TYR A 160 ? 0.458 0.543 0.609 0.013  0.060  -0.003 489 TYR EEE CE2 
1263 C CZ  . TYR A 160 ? 0.487 0.544 0.599 0.025  0.088  -0.005 489 TYR EEE CZ  
1264 O OH  . TYR A 160 ? 0.503 0.599 0.679 0.035  0.148  0.021  489 TYR EEE OH  
1265 N N   . PHE A 161 ? 0.389 0.394 0.331 -0.002 0.007  0.001  490 PHE EEE N   
1266 C CA  . PHE A 161 ? 0.399 0.377 0.322 0.005  0.003  -0.001 490 PHE EEE CA  
1267 C C   . PHE A 161 ? 0.421 0.389 0.302 -0.020 -0.010 -0.006 490 PHE EEE C   
1268 O O   . PHE A 161 ? 0.405 0.404 0.312 0.028  0.030  0.012  490 PHE EEE O   
1269 C CB  . PHE A 161 ? 0.393 0.396 0.304 -0.001 0.004  -0.013 490 PHE EEE CB  
1270 C CG  . PHE A 161 ? 0.384 0.385 0.286 0.011  0.003  -0.012 490 PHE EEE CG  
1271 C CD1 . PHE A 161 ? 0.387 0.370 0.269 0.001  -0.031 -0.002 490 PHE EEE CD1 
1272 C CD2 . PHE A 161 ? 0.405 0.413 0.263 0.015  0.004  0.001  490 PHE EEE CD2 
1273 C CE1 . PHE A 161 ? 0.385 0.409 0.296 0.007  -0.030 -0.003 490 PHE EEE CE1 
1274 C CE2 . PHE A 161 ? 0.392 0.426 0.302 0.023  -0.011 0.002  490 PHE EEE CE2 
1275 C CZ  . PHE A 161 ? 0.370 0.410 0.296 0.015  -0.017 0.008  490 PHE EEE CZ  
1276 N N   . PRO A 162 ? 0.395 0.395 0.269 0.001  0.013  -0.019 491 PRO EEE N   
1277 C CA  . PRO A 162 ? 0.381 0.395 0.305 0.005  -0.002 -0.001 491 PRO EEE CA  
1278 C C   . PRO A 162 ? 0.379 0.397 0.301 -0.001 0.003  0.016  491 PRO EEE C   
1279 O O   . PRO A 162 ? 0.418 0.416 0.296 -0.030 0.018  0.020  491 PRO EEE O   
1280 C CB  . PRO A 162 ? 0.356 0.373 0.291 -0.006 0.002  0.012  491 PRO EEE CB  
1281 C CG  . PRO A 162 ? 0.372 0.394 0.307 -0.003 0.024  -0.010 491 PRO EEE CG  
1282 C CD  . PRO A 162 ? 0.387 0.395 0.262 0.018  0.012  -0.006 491 PRO EEE CD  
1283 N N   . LEU A 163 ? 0.373 0.367 0.286 -0.002 0.001  0.004  492 LEU EEE N   
1284 C CA  . LEU A 163 ? 0.386 0.379 0.270 -0.015 0.002  -0.006 492 LEU EEE CA  
1285 C C   . LEU A 163 ? 0.380 0.393 0.260 0.001  -0.005 -0.010 492 LEU EEE C   
1286 O O   . LEU A 163 ? 0.443 0.387 0.242 -0.000 -0.005 -0.022 492 LEU EEE O   
1287 C CB  . LEU A 163 ? 0.365 0.358 0.317 -0.004 -0.002 -0.016 492 LEU EEE CB  
1288 C CG  . LEU A 163 ? 0.362 0.353 0.284 -0.021 -0.026 -0.010 492 LEU EEE CG  
1289 C CD1 . LEU A 163 ? 0.373 0.395 0.284 -0.029 -0.011 -0.011 492 LEU EEE CD1 
1290 C CD2 . LEU A 163 ? 0.418 0.352 0.252 -0.019 -0.007 -0.034 492 LEU EEE CD2 
1291 N N   . GLN A 164 ? 0.422 0.375 0.228 0.000  -0.000 0.013  493 GLN EEE N   
1292 C CA  . GLN A 164 ? 0.425 0.400 0.274 -0.013 0.023  -0.025 493 GLN EEE CA  
1293 C C   . GLN A 164 ? 0.420 0.360 0.242 0.001  0.034  -0.030 493 GLN EEE C   
1294 O O   . GLN A 164 ? 0.428 0.359 0.292 -0.004 0.036  -0.016 493 GLN EEE O   
1295 C CB  . GLN A 164 ? 0.398 0.388 0.283 -0.021 0.018  0.004  493 GLN EEE CB  
1296 C CG  . GLN A 164 ? 0.460 0.401 0.269 -0.022 0.010  0.012  493 GLN EEE CG  
1297 C CD  . GLN A 164 ? 0.488 0.415 0.292 -0.042 0.061  0.026  493 GLN EEE CD  
1298 O OE1 . GLN A 164 ? 0.523 0.443 0.286 -0.012 0.051  -0.004 493 GLN EEE OE1 
1299 N NE2 . GLN A 164 ? 0.529 0.417 0.297 -0.031 0.029  0.011  493 GLN EEE NE2 
1300 N N   . SER A 165 ? 0.439 0.374 0.263 -0.029 0.024  0.006  494 SER EEE N   
1301 C CA  . SER A 165 ? 0.447 0.400 0.267 -0.019 0.031  -0.021 494 SER EEE CA  
1302 C C   . SER A 165 ? 0.427 0.411 0.270 -0.003 0.038  -0.001 494 SER EEE C   
1303 O O   . SER A 165 ? 0.438 0.445 0.210 -0.007 0.034  -0.009 494 SER EEE O   
1304 C CB  . SER A 165 ? 0.466 0.388 0.263 -0.036 0.046  -0.025 494 SER EEE CB  
1305 O OG  . SER A 165 ? 0.444 0.397 0.227 -0.027 0.015  -0.022 494 SER EEE OG  
1306 N N   . TYR A 166 ? 0.476 0.398 0.208 -0.027 0.009  -0.019 495 TYR EEE N   
1307 C CA  . TYR A 166 ? 0.484 0.439 0.209 -0.048 0.005  -0.013 495 TYR EEE CA  
1308 C C   . TYR A 166 ? 0.518 0.449 0.291 -0.057 0.000  -0.029 495 TYR EEE C   
1309 O O   . TYR A 166 ? 0.545 0.435 0.274 -0.062 0.006  -0.018 495 TYR EEE O   
1310 C CB  . TYR A 166 ? 0.503 0.432 0.234 -0.038 -0.002 -0.034 495 TYR EEE CB  
1311 C CG  . TYR A 166 ? 0.496 0.426 0.255 -0.049 0.004  -0.024 495 TYR EEE CG  
1312 C CD1 . TYR A 166 ? 0.496 0.416 0.284 -0.054 0.022  -0.051 495 TYR EEE CD1 
1313 C CD2 . TYR A 166 ? 0.494 0.430 0.274 -0.036 0.016  -0.016 495 TYR EEE CD2 
1314 C CE1 . TYR A 166 ? 0.509 0.414 0.291 -0.048 0.029  -0.029 495 TYR EEE CE1 
1315 C CE2 . TYR A 166 ? 0.473 0.421 0.257 -0.038 -0.006 -0.041 495 TYR EEE CE2 
1316 C CZ  . TYR A 166 ? 0.468 0.426 0.267 -0.023 0.009  -0.030 495 TYR EEE CZ  
1317 O OH  . TYR A 166 ? 0.471 0.450 0.258 -0.030 0.027  -0.019 495 TYR EEE OH  
1318 N N   . GLY A 167 ? 0.587 0.458 0.318 -0.037 0.002  -0.051 496 GLY EEE N   
1319 C CA  . GLY A 167 ? 0.582 0.483 0.320 -0.050 -0.034 -0.004 496 GLY EEE CA  
1320 C C   . GLY A 167 ? 0.554 0.508 0.309 -0.039 -0.025 -0.024 496 GLY EEE C   
1321 O O   . GLY A 167 ? 0.646 0.536 0.317 -0.008 0.009  -0.077 496 GLY EEE O   
1322 N N   . PHE A 168 ? 0.538 0.434 0.284 -0.066 -0.037 -0.012 497 PHE EEE N   
1323 C CA  . PHE A 168 ? 0.586 0.483 0.291 -0.069 -0.059 -0.011 497 PHE EEE CA  
1324 C C   . PHE A 168 ? 0.630 0.451 0.360 -0.092 -0.017 -0.001 497 PHE EEE C   
1325 O O   . PHE A 168 ? 0.644 0.483 0.260 -0.091 -0.045 -0.006 497 PHE EEE O   
1326 C CB  . PHE A 168 ? 0.561 0.458 0.279 -0.084 -0.035 0.018  497 PHE EEE CB  
1327 C CG  . PHE A 168 ? 0.542 0.444 0.274 -0.072 -0.048 0.001  497 PHE EEE CG  
1328 C CD1 . PHE A 168 ? 0.525 0.500 0.258 -0.079 -0.050 -0.021 497 PHE EEE CD1 
1329 C CD2 . PHE A 168 ? 0.537 0.465 0.248 -0.055 -0.036 0.018  497 PHE EEE CD2 
1330 C CE1 . PHE A 168 ? 0.517 0.501 0.249 -0.070 -0.030 -0.004 497 PHE EEE CE1 
1331 C CE2 . PHE A 168 ? 0.497 0.454 0.264 -0.027 -0.017 -0.029 497 PHE EEE CE2 
1332 C CZ  . PHE A 168 ? 0.509 0.469 0.291 -0.045 -0.016 -0.022 497 PHE EEE CZ  
1333 N N   . GLN A 169 ? 0.727 0.512 0.395 -0.100 -0.019 -0.046 498 GLN EEE N   
1334 C CA  . GLN A 169 ? 0.776 0.543 0.415 -0.105 -0.084 -0.043 498 GLN EEE CA  
1335 C C   . GLN A 169 ? 0.748 0.506 0.395 -0.126 -0.072 -0.050 498 GLN EEE C   
1336 O O   . GLN A 169 ? 0.723 0.543 0.308 -0.134 -0.066 -0.059 498 GLN EEE O   
1337 C CB  . GLN A 169 ? 0.881 0.590 0.437 -0.055 -0.107 -0.092 498 GLN EEE CB  
1338 C CG  . GLN A 169 ? 0.951 0.684 0.479 -0.022 -0.139 -0.080 498 GLN EEE CG  
1339 C CD  . GLN A 169 ? 1.058 0.726 0.609 0.070  -0.117 -0.081 498 GLN EEE CD  
1340 O OE1 . GLN A 169 ? 1.121 0.796 0.592 0.113  -0.108 -0.077 498 GLN EEE OE1 
1341 N NE2 . GLN A 169 ? 1.165 0.909 0.733 0.110  -0.125 0.020  498 GLN EEE NE2 
1342 N N   . PRO A 170 ? 0.758 0.518 0.413 -0.118 -0.098 -0.038 499 PRO EEE N   
1343 C CA  . PRO A 170 ? 0.781 0.563 0.443 -0.121 -0.136 -0.043 499 PRO EEE CA  
1344 C C   . PRO A 170 ? 0.826 0.543 0.447 -0.097 -0.106 -0.015 499 PRO EEE C   
1345 O O   . PRO A 170 ? 0.829 0.584 0.373 -0.119 -0.126 -0.023 499 PRO EEE O   
1346 C CB  . PRO A 170 ? 0.786 0.559 0.504 -0.144 -0.133 -0.041 499 PRO EEE CB  
1347 C CG  . PRO A 170 ? 0.780 0.567 0.480 -0.141 -0.136 -0.032 499 PRO EEE CG  
1348 C CD  . PRO A 170 ? 0.774 0.526 0.440 -0.167 -0.115 -0.101 499 PRO EEE CD  
1349 N N   . THR A 171 ? 0.841 0.528 0.446 -0.118 -0.091 -0.056 500 THR EEE N   
1350 C CA  . THR A 171 ? 0.865 0.540 0.485 -0.108 -0.074 -0.096 500 THR EEE CA  
1351 C C   . THR A 171 ? 0.861 0.481 0.365 -0.086 -0.037 -0.124 500 THR EEE C   
1352 O O   . THR A 171 ? 0.906 0.562 0.331 -0.042 -0.032 -0.133 500 THR EEE O   
1353 C CB  . THR A 171 ? 0.933 0.551 0.524 -0.095 -0.084 -0.121 500 THR EEE CB  
1354 O OG1 . THR A 171 ? 0.929 0.512 0.718 -0.066 -0.180 -0.024 500 THR EEE OG1 
1355 C CG2 . THR A 171 ? 0.953 0.630 0.508 -0.121 -0.069 -0.143 500 THR EEE CG2 
1356 N N   . ASN A 172 ? 0.822 0.489 0.341 -0.099 -0.078 -0.070 501 ASN EEE N   
1357 C CA  . ASN A 172 ? 0.831 0.483 0.377 -0.093 -0.058 -0.070 501 ASN EEE CA  
1358 C C   . ASN A 172 ? 0.780 0.523 0.375 -0.095 -0.069 -0.059 501 ASN EEE C   
1359 O O   . ASN A 172 ? 0.788 0.561 0.282 -0.073 -0.081 -0.029 501 ASN EEE O   
1360 C CB  . ASN A 172 ? 0.831 0.491 0.341 -0.108 -0.096 -0.035 501 ASN EEE CB  
1361 C CG  . ASN A 172 ? 0.849 0.447 0.342 -0.071 -0.070 -0.026 501 ASN EEE CG  
1362 O OD1 . ASN A 172 ? 0.803 0.452 0.447 -0.060 -0.063 -0.038 501 ASN EEE OD1 
1363 N ND2 . ASN A 172 ? 0.761 0.523 0.323 -0.048 -0.064 -0.043 501 ASN EEE ND2 
1364 N N   . GLY A 173 ? 0.802 0.510 0.424 -0.089 -0.018 -0.115 502 GLY EEE N   
1365 C CA  . GLY A 173 ? 0.849 0.562 0.386 -0.084 -0.019 -0.095 502 GLY EEE CA  
1366 C C   . GLY A 173 ? 0.836 0.576 0.319 -0.059 -0.004 -0.072 502 GLY EEE C   
1367 O O   . GLY A 173 ? 0.810 0.527 0.305 -0.054 0.012  -0.082 502 GLY EEE O   
1368 N N   . VAL A 174 ? 0.804 0.620 0.311 -0.062 0.015  -0.038 503 VAL EEE N   
1369 C CA  . VAL A 174 ? 0.773 0.625 0.332 -0.067 0.031  -0.001 503 VAL EEE CA  
1370 C C   . VAL A 174 ? 0.717 0.588 0.314 -0.047 0.048  -0.019 503 VAL EEE C   
1371 O O   . VAL A 174 ? 0.714 0.558 0.289 -0.051 0.010  -0.027 503 VAL EEE O   
1372 C CB  . VAL A 174 ? 0.841 0.712 0.360 -0.030 0.046  0.053  503 VAL EEE CB  
1373 C CG1 . VAL A 174 ? 0.869 0.768 0.414 -0.040 0.063  0.092  503 VAL EEE CG1 
1374 C CG2 . VAL A 174 ? 0.866 0.742 0.447 -0.013 0.076  0.058  503 VAL EEE CG2 
1375 N N   . GLY A 175 ? 0.696 0.590 0.234 -0.086 0.019  -0.071 504 GLY EEE N   
1376 C CA  . GLY A 175 ? 0.685 0.579 0.290 -0.094 -0.001 -0.035 504 GLY EEE CA  
1377 C C   . GLY A 175 ? 0.686 0.526 0.300 -0.073 -0.021 -0.041 504 GLY EEE C   
1378 O O   . GLY A 175 ? 0.658 0.532 0.274 -0.099 0.047  -0.050 504 GLY EEE O   
1379 N N   . TYR A 176 ? 0.659 0.502 0.303 -0.057 -0.009 -0.050 505 TYR EEE N   
1380 C CA  . TYR A 176 ? 0.647 0.517 0.316 -0.063 0.006  -0.038 505 TYR EEE CA  
1381 C C   . TYR A 176 ? 0.626 0.431 0.284 -0.053 -0.013 -0.001 505 TYR EEE C   
1382 O O   . TYR A 176 ? 0.664 0.525 0.268 -0.043 0.002  0.046  505 TYR EEE O   
1383 C CB  . TYR A 176 ? 0.668 0.520 0.396 -0.064 0.028  -0.045 505 TYR EEE CB  
1384 C CG  . TYR A 176 ? 0.689 0.671 0.538 -0.012 0.041  -0.062 505 TYR EEE CG  
1385 C CD1 . TYR A 176 ? 0.673 0.795 0.632 -0.032 0.132  -0.064 505 TYR EEE CD1 
1386 C CD2 . TYR A 176 ? 0.684 0.775 0.643 0.006  0.020  -0.114 505 TYR EEE CD2 
1387 C CE1 . TYR A 176 ? 0.659 0.872 0.764 -0.005 0.127  -0.072 505 TYR EEE CE1 
1388 C CE2 . TYR A 176 ? 0.702 0.877 0.729 -0.056 0.059  -0.096 505 TYR EEE CE2 
1389 C CZ  . TYR A 176 ? 0.688 0.914 0.744 -0.016 0.130  -0.124 505 TYR EEE CZ  
1390 O OH  . TYR A 176 ? 0.681 0.991 1.128 -0.030 0.072  -0.101 505 TYR EEE OH  
1391 N N   . GLN A 177 ? 0.611 0.453 0.241 -0.053 -0.023 -0.019 506 GLN EEE N   
1392 C CA  . GLN A 177 ? 0.599 0.456 0.265 -0.060 -0.041 -0.047 506 GLN EEE CA  
1393 C C   . GLN A 177 ? 0.536 0.428 0.258 -0.046 -0.033 -0.025 506 GLN EEE C   
1394 O O   . GLN A 177 ? 0.543 0.417 0.260 -0.041 -0.025 -0.006 506 GLN EEE O   
1395 C CB  . GLN A 177 ? 0.617 0.485 0.274 -0.066 -0.047 -0.031 506 GLN EEE CB  
1396 C CG  . GLN A 177 ? 0.663 0.459 0.319 -0.092 -0.058 -0.017 506 GLN EEE CG  
1397 C CD  . GLN A 177 ? 0.704 0.501 0.309 -0.079 -0.077 -0.025 506 GLN EEE CD  
1398 O OE1 . GLN A 177 ? 0.671 0.502 0.311 -0.093 -0.136 -0.069 506 GLN EEE OE1 
1399 N NE2 . GLN A 177 ? 0.774 0.555 0.333 -0.088 -0.141 -0.055 506 GLN EEE NE2 
1400 N N   . PRO A 178 ? 0.487 0.439 0.284 -0.076 -0.032 -0.030 507 PRO EEE N   
1401 C CA  . PRO A 178 ? 0.470 0.415 0.303 -0.070 -0.027 -0.016 507 PRO EEE CA  
1402 C C   . PRO A 178 ? 0.476 0.439 0.313 -0.089 -0.051 0.005  507 PRO EEE C   
1403 O O   . PRO A 178 ? 0.455 0.436 0.285 -0.067 -0.038 0.001  507 PRO EEE O   
1404 C CB  . PRO A 178 ? 0.479 0.417 0.313 -0.083 -0.026 -0.002 507 PRO EEE CB  
1405 C CG  . PRO A 178 ? 0.499 0.428 0.296 -0.082 -0.035 -0.004 507 PRO EEE CG  
1406 C CD  . PRO A 178 ? 0.494 0.440 0.276 -0.081 -0.060 -0.015 507 PRO EEE CD  
1407 N N   . TYR A 179 ? 0.522 0.437 0.243 -0.090 -0.034 -0.005 508 TYR EEE N   
1408 C CA  . TYR A 179 ? 0.513 0.440 0.259 -0.077 -0.040 -0.006 508 TYR EEE CA  
1409 C C   . TYR A 179 ? 0.482 0.416 0.258 -0.066 -0.013 0.020  508 TYR EEE C   
1410 O O   . TYR A 179 ? 0.536 0.407 0.255 -0.082 -0.031 0.025  508 TYR EEE O   
1411 C CB  . TYR A 179 ? 0.560 0.434 0.254 -0.086 -0.024 0.013  508 TYR EEE CB  
1412 C CG  . TYR A 179 ? 0.534 0.425 0.250 -0.101 -0.059 0.012  508 TYR EEE CG  
1413 C CD1 . TYR A 179 ? 0.562 0.422 0.229 -0.100 -0.031 0.028  508 TYR EEE CD1 
1414 C CD2 . TYR A 179 ? 0.592 0.442 0.203 -0.085 -0.035 0.010  508 TYR EEE CD2 
1415 C CE1 . TYR A 179 ? 0.588 0.437 0.246 -0.081 -0.046 -0.015 508 TYR EEE CE1 
1416 C CE2 . TYR A 179 ? 0.590 0.444 0.206 -0.093 -0.059 -0.000 508 TYR EEE CE2 
1417 C CZ  . TYR A 179 ? 0.636 0.458 0.220 -0.063 -0.006 0.005  508 TYR EEE CZ  
1418 O OH  . TYR A 179 ? 0.726 0.511 0.208 -0.086 -0.036 0.023  508 TYR EEE OH  
1419 N N   . ARG A 180 ? 0.463 0.427 0.279 -0.075 -0.066 0.013  509 ARG EEE N   
1420 C CA  . ARG A 180 ? 0.472 0.407 0.269 -0.061 -0.056 0.037  509 ARG EEE CA  
1421 C C   . ARG A 180 ? 0.448 0.419 0.276 -0.074 -0.059 0.035  509 ARG EEE C   
1422 O O   . ARG A 180 ? 0.497 0.412 0.260 -0.059 -0.049 0.023  509 ARG EEE O   
1423 C CB  . ARG A 180 ? 0.461 0.404 0.256 -0.066 -0.042 0.034  509 ARG EEE CB  
1424 C CG  . ARG A 180 ? 0.458 0.404 0.295 -0.060 -0.051 0.046  509 ARG EEE CG  
1425 C CD  . ARG A 180 ? 0.458 0.431 0.325 -0.064 -0.058 0.041  509 ARG EEE CD  
1426 N NE  . ARG A 180 ? 0.475 0.422 0.337 -0.075 -0.062 0.040  509 ARG EEE NE  
1427 C CZ  . ARG A 180 ? 0.468 0.440 0.401 -0.073 -0.041 0.042  509 ARG EEE CZ  
1428 N NH1 . ARG A 180 ? 0.453 0.418 0.424 -0.072 -0.008 0.080  509 ARG EEE NH1 
1429 N NH2 . ARG A 180 ? 0.498 0.472 0.407 -0.057 -0.028 0.081  509 ARG EEE NH2 
1430 N N   . VAL A 181 ? 0.439 0.417 0.224 -0.059 -0.040 0.034  510 VAL EEE N   
1431 C CA  . VAL A 181 ? 0.449 0.410 0.229 -0.050 -0.032 0.040  510 VAL EEE CA  
1432 C C   . VAL A 181 ? 0.426 0.398 0.293 -0.020 -0.041 0.043  510 VAL EEE C   
1433 O O   . VAL A 181 ? 0.394 0.400 0.279 -0.027 -0.049 0.034  510 VAL EEE O   
1434 C CB  . VAL A 181 ? 0.442 0.413 0.232 -0.033 -0.020 0.042  510 VAL EEE CB  
1435 C CG1 . VAL A 181 ? 0.466 0.421 0.266 -0.051 -0.014 0.033  510 VAL EEE CG1 
1436 C CG2 . VAL A 181 ? 0.463 0.439 0.253 -0.032 -0.011 0.024  510 VAL EEE CG2 
1437 N N   . VAL A 182 ? 0.436 0.405 0.234 -0.013 -0.058 0.056  511 VAL EEE N   
1438 C CA  . VAL A 182 ? 0.450 0.384 0.252 -0.027 -0.053 0.042  511 VAL EEE CA  
1439 C C   . VAL A 182 ? 0.444 0.412 0.287 -0.039 -0.072 0.031  511 VAL EEE C   
1440 O O   . VAL A 182 ? 0.454 0.401 0.282 -0.026 -0.051 0.011  511 VAL EEE O   
1441 C CB  . VAL A 182 ? 0.456 0.411 0.255 -0.018 -0.002 0.041  511 VAL EEE CB  
1442 C CG1 . VAL A 182 ? 0.477 0.457 0.271 0.001  0.006  0.030  511 VAL EEE CG1 
1443 C CG2 . VAL A 182 ? 0.443 0.426 0.233 -0.007 0.016  0.048  511 VAL EEE CG2 
1444 N N   . VAL A 183 ? 0.450 0.404 0.235 -0.032 -0.068 0.040  512 VAL EEE N   
1445 C CA  . VAL A 183 ? 0.465 0.390 0.237 -0.033 -0.057 0.052  512 VAL EEE CA  
1446 C C   . VAL A 183 ? 0.445 0.395 0.245 -0.044 -0.062 0.041  512 VAL EEE C   
1447 O O   . VAL A 183 ? 0.533 0.426 0.242 -0.020 -0.033 0.024  512 VAL EEE O   
1448 C CB  . VAL A 183 ? 0.439 0.410 0.254 -0.034 -0.034 0.049  512 VAL EEE CB  
1449 C CG1 . VAL A 183 ? 0.444 0.425 0.264 -0.039 -0.041 0.046  512 VAL EEE CG1 
1450 C CG2 . VAL A 183 ? 0.476 0.417 0.255 -0.034 -0.047 0.043  512 VAL EEE CG2 
1451 N N   . LEU A 184 ? 0.471 0.384 0.234 -0.040 -0.050 0.044  513 LEU EEE N   
1452 C CA  . LEU A 184 ? 0.462 0.405 0.256 -0.032 -0.058 0.012  513 LEU EEE CA  
1453 C C   . LEU A 184 ? 0.460 0.423 0.267 -0.044 -0.033 -0.001 513 LEU EEE C   
1454 O O   . LEU A 184 ? 0.464 0.426 0.274 -0.058 -0.052 0.037  513 LEU EEE O   
1455 C CB  . LEU A 184 ? 0.469 0.445 0.282 -0.034 -0.070 0.035  513 LEU EEE CB  
1456 C CG  . LEU A 184 ? 0.455 0.442 0.308 -0.026 -0.086 0.020  513 LEU EEE CG  
1457 C CD1 . LEU A 184 ? 0.477 0.430 0.323 -0.009 -0.082 0.025  513 LEU EEE CD1 
1458 C CD2 . LEU A 184 ? 0.447 0.456 0.359 -0.021 -0.061 0.037  513 LEU EEE CD2 
1459 N N   . SER A 185 ? 0.502 0.405 0.219 -0.045 -0.029 0.040  514 SER EEE N   
1460 C CA  A SER A 185 ? 0.497 0.402 0.274 -0.046 -0.030 0.048  514 SER EEE CA  
1461 C CA  B SER A 185 ? 0.483 0.402 0.236 -0.042 -0.029 0.058  514 SER EEE CA  
1462 C C   . SER A 185 ? 0.476 0.414 0.249 -0.044 -0.041 0.034  514 SER EEE C   
1463 O O   . SER A 185 ? 0.489 0.415 0.279 -0.043 -0.036 0.030  514 SER EEE O   
1464 C CB  A SER A 185 ? 0.494 0.410 0.290 -0.045 -0.039 0.047  514 SER EEE CB  
1465 C CB  B SER A 185 ? 0.462 0.393 0.231 -0.039 -0.013 0.061  514 SER EEE CB  
1466 O OG  A SER A 185 ? 0.499 0.381 0.375 -0.051 -0.026 0.067  514 SER EEE OG  
1467 O OG  B SER A 185 ? 0.455 0.370 0.231 -0.056 -0.028 0.068  514 SER EEE OG  
1468 N N   . PHE A 186 ? 0.535 0.406 0.265 -0.023 -0.053 0.056  515 PHE EEE N   
1469 C CA  . PHE A 186 ? 0.534 0.425 0.274 -0.013 -0.037 0.041  515 PHE EEE CA  
1470 C C   . PHE A 186 ? 0.526 0.456 0.305 -0.022 -0.020 0.006  515 PHE EEE C   
1471 O O   . PHE A 186 ? 0.572 0.496 0.313 -0.097 0.010  -0.017 515 PHE EEE O   
1472 C CB  . PHE A 186 ? 0.564 0.429 0.276 -0.013 -0.056 0.044  515 PHE EEE CB  
1473 C CG  . PHE A 186 ? 0.560 0.386 0.313 -0.023 -0.045 0.057  515 PHE EEE CG  
1474 C CD1 . PHE A 186 ? 0.568 0.419 0.296 -0.025 -0.043 0.037  515 PHE EEE CD1 
1475 C CD2 . PHE A 186 ? 0.567 0.455 0.325 -0.020 -0.026 0.054  515 PHE EEE CD2 
1476 C CE1 . PHE A 186 ? 0.541 0.413 0.368 -0.023 -0.039 0.022  515 PHE EEE CE1 
1477 C CE2 . PHE A 186 ? 0.568 0.465 0.333 -0.013 -0.046 0.050  515 PHE EEE CE2 
1478 C CZ  . PHE A 186 ? 0.532 0.459 0.345 0.009  -0.071 0.045  515 PHE EEE CZ  
1479 N N   . GLU A 187 ? 0.520 0.400 0.260 -0.010 -0.039 0.055  516 GLU EEE N   
1480 C CA  . GLU A 187 ? 0.542 0.417 0.279 0.013  -0.062 0.041  516 GLU EEE CA  
1481 C C   . GLU A 187 ? 0.536 0.422 0.256 0.020  -0.068 0.042  516 GLU EEE C   
1482 O O   . GLU A 187 ? 0.522 0.443 0.369 0.057  -0.056 0.030  516 GLU EEE O   
1483 C CB  . GLU A 187 ? 0.575 0.411 0.308 0.009  -0.091 0.056  516 GLU EEE CB  
1484 C CG  . GLU A 187 ? 0.602 0.437 0.313 0.010  -0.076 0.033  516 GLU EEE CG  
1485 C CD  . GLU A 187 ? 0.542 0.440 0.291 0.015  -0.077 0.038  516 GLU EEE CD  
1486 O OE1 . GLU A 187 ? 0.492 0.426 0.294 -0.014 -0.056 0.017  516 GLU EEE OE1 
1487 O OE2 . GLU A 187 ? 0.524 0.459 0.321 0.015  -0.065 0.027  516 GLU EEE OE2 
1488 N N   . LEU A 188 ? 0.557 0.450 0.293 0.001  -0.047 0.058  517 LEU EEE N   
1489 C CA  . LEU A 188 ? 0.619 0.444 0.344 -0.018 -0.059 0.037  517 LEU EEE CA  
1490 C C   . LEU A 188 ? 0.544 0.488 0.347 -0.012 -0.012 -0.027 517 LEU EEE C   
1491 O O   . LEU A 188 ? 0.541 0.627 0.365 -0.109 0.051  -0.108 517 LEU EEE O   
1492 C CB  . LEU A 188 ? 0.732 0.506 0.415 -0.050 -0.013 0.099  517 LEU EEE CB  
1493 C CG  . LEU A 188 ? 0.769 0.577 0.511 0.007  -0.003 0.119  517 LEU EEE CG  
1494 C CD1 . LEU A 188 ? 0.751 0.632 0.636 -0.043 -0.000 0.119  517 LEU EEE CD1 
1495 C CD2 . LEU A 188 ? 0.855 0.589 0.584 0.002  -0.026 0.200  517 LEU EEE CD2 
1496 N N   . LEU A 189 ? 0.521 0.414 0.334 -0.009 -0.016 -0.005 518 LEU EEE N   
1497 C CA  . LEU A 189 ? 0.535 0.428 0.371 -0.031 -0.040 -0.031 518 LEU EEE CA  
1498 C C   . LEU A 189 ? 0.538 0.439 0.367 -0.012 -0.051 -0.034 518 LEU EEE C   
1499 O O   . LEU A 189 ? 0.581 0.479 0.412 -0.003 -0.109 -0.055 518 LEU EEE O   
1500 C CB  . LEU A 189 ? 0.543 0.414 0.339 -0.021 -0.057 -0.017 518 LEU EEE CB  
1501 C CG  . LEU A 189 ? 0.555 0.422 0.362 -0.041 -0.048 -0.042 518 LEU EEE CG  
1502 C CD1 . LEU A 189 ? 0.604 0.428 0.367 -0.016 -0.063 -0.013 518 LEU EEE CD1 
1503 C CD2 . LEU A 189 ? 0.571 0.442 0.372 -0.008 -0.048 -0.051 518 LEU EEE CD2 
1504 N N   . HIS A 190 ? 0.484 0.461 0.398 -0.014 -0.076 -0.032 519 HIS EEE N   
1505 C CA  A HIS A 190 ? 0.504 0.476 0.350 0.004  -0.041 -0.022 519 HIS EEE CA  
1506 C CA  B HIS A 190 ? 0.521 0.463 0.438 -0.004 -0.051 -0.025 519 HIS EEE CA  
1507 C C   . HIS A 190 ? 0.520 0.453 0.410 -0.023 -0.046 -0.024 519 HIS EEE C   
1508 O O   . HIS A 190 ? 0.552 0.511 0.465 0.016  -0.026 0.013  519 HIS EEE O   
1509 C CB  A HIS A 190 ? 0.453 0.477 0.309 0.031  -0.022 -0.004 519 HIS EEE CB  
1510 C CB  B HIS A 190 ? 0.531 0.476 0.485 0.003  -0.096 -0.015 519 HIS EEE CB  
1511 C CG  A HIS A 190 ? 0.406 0.528 0.262 0.052  -0.014 -0.005 519 HIS EEE CG  
1512 C CG  B HIS A 190 ? 0.551 0.452 0.527 -0.036 -0.104 0.020  519 HIS EEE CG  
1513 N ND1 A HIS A 190 ? 0.352 0.526 0.226 0.064  -0.002 -0.029 519 HIS EEE ND1 
1514 N ND1 B HIS A 190 ? 0.594 0.442 0.547 -0.007 -0.072 0.051  519 HIS EEE ND1 
1515 C CD2 A HIS A 190 ? 0.388 0.539 0.268 0.067  -0.019 -0.015 519 HIS EEE CD2 
1516 C CD2 B HIS A 190 ? 0.510 0.443 0.500 -0.016 -0.122 0.046  519 HIS EEE CD2 
1517 C CE1 A HIS A 190 ? 0.380 0.559 0.238 0.080  -0.002 0.003  519 HIS EEE CE1 
1518 C CE1 B HIS A 190 ? 0.562 0.315 0.405 -0.061 -0.147 0.126  519 HIS EEE CE1 
1519 N NE2 A HIS A 190 ? 0.373 0.552 0.235 0.062  -0.005 -0.008 519 HIS EEE NE2 
1520 N NE2 B HIS A 190 ? 0.555 0.419 0.523 -0.012 -0.099 0.067  519 HIS EEE NE2 
1521 N N   . ALA A 191 ? 0.533 0.466 0.383 -0.027 -0.004 0.011  520 ALA EEE N   
1522 C CA  . ALA A 191 ? 0.489 0.481 0.397 0.025  -0.062 -0.033 520 ALA EEE CA  
1523 C C   . ALA A 191 ? 0.537 0.514 0.430 0.009  -0.093 0.010  520 ALA EEE C   
1524 O O   . ALA A 191 ? 0.631 0.572 0.429 -0.028 -0.118 -0.063 520 ALA EEE O   
1525 C CB  . ALA A 191 ? 0.529 0.521 0.399 0.024  -0.020 0.002  520 ALA EEE CB  
1526 N N   . PRO A 192 ? 0.531 0.524 0.459 0.025  -0.072 -0.024 521 PRO EEE N   
1527 C CA  . PRO A 192 ? 0.544 0.542 0.487 -0.006 -0.097 -0.045 521 PRO EEE CA  
1528 C C   . PRO A 192 ? 0.647 0.466 0.494 0.001  -0.083 -0.005 521 PRO EEE C   
1529 O O   . PRO A 192 ? 0.508 0.477 0.488 -0.015 -0.058 0.043  521 PRO EEE O   
1530 C CB  . PRO A 192 ? 0.516 0.604 0.574 0.012  -0.100 -0.038 521 PRO EEE CB  
1531 C CG  . PRO A 192 ? 0.520 0.617 0.567 0.021  -0.073 -0.035 521 PRO EEE CG  
1532 C CD  . PRO A 192 ? 0.510 0.528 0.482 0.007  -0.064 -0.026 521 PRO EEE CD  
1533 N N   . ALA A 193 ? 0.684 0.431 0.501 0.058  -0.109 -0.002 522 ALA EEE N   
1534 C CA  . ALA A 193 ? 0.673 0.442 0.540 0.071  -0.106 -0.022 522 ALA EEE CA  
1535 C C   . ALA A 193 ? 0.665 0.452 0.641 0.104  -0.136 -0.020 522 ALA EEE C   
1536 O O   . ALA A 193 ? 0.714 0.516 0.744 0.151  -0.173 0.002  522 ALA EEE O   
1537 C CB  . ALA A 193 ? 0.740 0.510 0.569 0.054  -0.090 -0.003 522 ALA EEE CB  
1538 N N   . THR A 194 ? 0.650 0.535 0.527 0.057  -0.079 -0.001 523 THR EEE N   
1539 C CA  . THR A 194 ? 0.650 0.621 0.580 0.060  -0.113 -0.038 523 THR EEE CA  
1540 C C   . THR A 194 ? 0.609 0.607 0.492 0.119  -0.104 -0.016 523 THR EEE C   
1541 O O   . THR A 194 ? 0.615 0.620 0.580 0.110  -0.095 -0.058 523 THR EEE O   
1542 C CB  . THR A 194 ? 0.718 0.823 0.589 0.065  -0.062 -0.060 523 THR EEE CB  
1543 O OG1 . THR A 194 ? 0.822 0.971 0.913 0.018  -0.088 -0.123 523 THR EEE OG1 
1544 C CG2 . THR A 194 ? 0.769 0.836 0.535 0.004  -0.079 0.028  523 THR EEE CG2 
1545 N N   . VAL A 195 ? 0.633 0.488 0.373 0.109  -0.135 -0.004 524 VAL EEE N   
1546 C CA  . VAL A 195 ? 0.639 0.513 0.406 0.093  -0.137 -0.022 524 VAL EEE CA  
1547 C C   . VAL A 195 ? 0.669 0.539 0.431 0.073  -0.131 0.010  524 VAL EEE C   
1548 O O   . VAL A 195 ? 0.697 0.517 0.384 0.038  -0.108 0.027  524 VAL EEE O   
1549 C CB  . VAL A 195 ? 0.642 0.504 0.423 0.097  -0.121 0.000  524 VAL EEE CB  
1550 C CG1 . VAL A 195 ? 0.684 0.486 0.456 0.098  -0.095 -0.010 524 VAL EEE CG1 
1551 C CG2 . VAL A 195 ? 0.647 0.524 0.434 0.119  -0.052 0.011  524 VAL EEE CG2 
1552 N N   . CYS A 196 ? 0.673 0.556 0.498 0.068  -0.153 0.001  525 CYS EEE N   
1553 C CA  . CYS A 196 ? 0.697 0.543 0.481 0.058  -0.153 0.010  525 CYS EEE CA  
1554 C C   . CYS A 196 ? 0.742 0.530 0.432 0.043  -0.162 0.064  525 CYS EEE C   
1555 O O   . CYS A 196 ? 0.743 0.561 0.459 0.020  -0.187 0.078  525 CYS EEE O   
1556 C CB  . CYS A 196 ? 0.760 0.568 0.571 0.095  -0.158 0.013  525 CYS EEE CB  
1557 S SG  . CYS A 196 ? 0.811 0.587 0.641 0.101  -0.157 -0.027 525 CYS EEE SG  
1558 N N   . GLY A 197 ? 0.840 0.558 0.439 0.027  -0.133 0.056  526 GLY EEE N   
1559 C CA  . GLY A 197 ? 0.922 0.648 0.494 0.016  -0.224 0.061  526 GLY EEE CA  
1560 C C   . GLY A 197 ? 0.969 0.625 0.565 0.054  -0.261 0.084  526 GLY EEE C   
1561 O O   . GLY A 197 ? 0.977 0.572 0.603 0.068  -0.333 0.063  526 GLY EEE O   
1562 N N   . PRO A 198 ? 1.131 0.682 0.545 -0.002 -0.376 0.143  527 PRO EEE N   
1563 C CA  . PRO A 198 ? 1.141 0.696 0.745 0.003  -0.340 0.102  527 PRO EEE CA  
1564 C C   . PRO A 198 ? 1.258 0.667 0.646 0.113  -0.426 0.118  527 PRO EEE C   
1565 O O   . PRO A 198 ? 1.317 0.692 0.845 0.080  -0.440 0.113  527 PRO EEE O   
1566 C CB  . PRO A 198 ? 1.183 0.762 0.714 0.012  -0.397 0.068  527 PRO EEE CB  
1567 C CG  . PRO A 198 ? 1.184 0.780 0.746 -0.012 -0.350 0.039  527 PRO EEE CG  
1568 C CD  . PRO A 198 ? 1.168 0.710 0.676 0.014  -0.335 0.102  527 PRO EEE CD  
1569 N N   . VAL B 2   ? 0.934 0.659 0.590 -0.082 -0.287 0.154  2   VAL FFF N   
1570 C CA  . VAL B 2   ? 0.869 0.697 0.591 -0.135 -0.238 0.118  2   VAL FFF CA  
1571 C C   . VAL B 2   ? 0.790 0.695 0.526 -0.127 -0.141 0.128  2   VAL FFF C   
1572 O O   . VAL B 2   ? 0.838 0.765 0.462 -0.145 -0.071 0.146  2   VAL FFF O   
1573 C CB  . VAL B 2   ? 0.985 0.657 0.699 -0.203 -0.177 0.138  2   VAL FFF CB  
1574 C CG1 . VAL B 2   ? 0.974 0.600 0.732 -0.260 -0.167 0.148  2   VAL FFF CG1 
1575 C CG2 . VAL B 2   ? 1.019 0.691 0.775 -0.130 -0.195 0.144  2   VAL FFF CG2 
1576 N N   . GLN B 3   ? 0.648 0.714 0.546 -0.058 -0.130 0.159  3   GLN FFF N   
1577 C CA  . GLN B 3   ? 0.626 0.682 0.622 -0.091 -0.095 0.123  3   GLN FFF CA  
1578 C C   . GLN B 3   ? 0.548 0.605 0.536 -0.050 -0.021 0.141  3   GLN FFF C   
1579 O O   . GLN B 3   ? 0.553 0.612 0.551 -0.026 -0.026 0.147  3   GLN FFF O   
1580 C CB  . GLN B 3   ? 0.678 0.815 0.706 -0.120 -0.055 0.116  3   GLN FFF CB  
1581 C CG  . GLN B 3   ? 0.787 0.906 0.805 -0.103 -0.136 0.092  3   GLN FFF CG  
1582 C CD  . GLN B 3   ? 0.921 0.959 0.849 -0.085 -0.104 0.087  3   GLN FFF CD  
1583 O OE1 . GLN B 3   ? 0.975 0.955 1.034 -0.083 -0.121 0.072  3   GLN FFF OE1 
1584 N NE2 . GLN B 3   ? 1.142 0.940 0.906 -0.078 -0.173 0.122  3   GLN FFF NE2 
1585 N N   . LEU B 4   ? 0.521 0.565 0.456 -0.093 -0.017 0.083  4   LEU FFF N   
1586 C CA  . LEU B 4   ? 0.532 0.518 0.454 -0.106 -0.029 0.099  4   LEU FFF CA  
1587 C C   . LEU B 4   ? 0.568 0.524 0.474 -0.179 0.002  0.054  4   LEU FFF C   
1588 O O   . LEU B 4   ? 0.642 0.459 0.473 -0.184 -0.045 0.095  4   LEU FFF O   
1589 C CB  . LEU B 4   ? 0.554 0.556 0.473 -0.074 0.011  0.117  4   LEU FFF CB  
1590 C CG  . LEU B 4   ? 0.586 0.542 0.594 -0.133 0.072  0.093  4   LEU FFF CG  
1591 C CD1 . LEU B 4   ? 0.569 0.535 0.614 -0.133 0.053  0.108  4   LEU FFF CD1 
1592 C CD2 . LEU B 4   ? 0.582 0.588 0.593 -0.113 0.100  0.052  4   LEU FFF CD2 
1593 N N   . VAL B 5   ? 0.581 0.602 0.468 -0.187 -0.003 0.076  5   VAL FFF N   
1594 C CA  . VAL B 5   ? 0.626 0.636 0.450 -0.188 -0.014 0.100  5   VAL FFF CA  
1595 C C   . VAL B 5   ? 0.633 0.564 0.438 -0.176 0.040  0.092  5   VAL FFF C   
1596 O O   . VAL B 5   ? 0.567 0.577 0.398 -0.165 0.070  0.060  5   VAL FFF O   
1597 C CB  . VAL B 5   ? 0.626 0.753 0.499 -0.166 0.004  0.132  5   VAL FFF CB  
1598 C CG1 . VAL B 5   ? 0.630 0.811 0.553 -0.203 0.041  0.143  5   VAL FFF CG1 
1599 C CG2 . VAL B 5   ? 0.646 0.827 0.545 -0.125 0.010  0.119  5   VAL FFF CG2 
1600 N N   . GLU B 6   ? 0.725 0.591 0.454 -0.126 0.038  0.086  6   GLU FFF N   
1601 C CA  . GLU B 6   ? 0.734 0.588 0.462 -0.149 0.031  0.077  6   GLU FFF CA  
1602 C C   . GLU B 6   ? 0.681 0.581 0.464 -0.130 0.014  0.091  6   GLU FFF C   
1603 O O   . GLU B 6   ? 0.698 0.583 0.439 -0.153 -0.013 0.104  6   GLU FFF O   
1604 C CB  . GLU B 6   ? 0.817 0.595 0.438 -0.173 0.066  0.043  6   GLU FFF CB  
1605 C CG  . GLU B 6   ? 0.894 0.580 0.436 -0.157 0.062  0.055  6   GLU FFF CG  
1606 C CD  . GLU B 6   ? 0.929 0.643 0.493 -0.135 0.052  -0.009 6   GLU FFF CD  
1607 O OE1 . GLU B 6   ? 1.005 0.669 0.612 -0.152 0.083  -0.068 6   GLU FFF OE1 
1608 O OE2 . GLU B 6   ? 0.677 0.488 0.398 -0.051 -0.129 0.019  6   GLU FFF OE2 
1609 N N   . SER B 7   ? 0.688 0.528 0.447 -0.080 0.018  0.064  7   SER FFF N   
1610 C CA  . SER B 7   ? 0.670 0.542 0.443 -0.065 0.076  0.050  7   SER FFF CA  
1611 C C   . SER B 7   ? 0.644 0.528 0.420 -0.070 0.102  0.050  7   SER FFF C   
1612 O O   . SER B 7   ? 0.629 0.445 0.393 -0.035 0.089  0.084  7   SER FFF O   
1613 C CB  . SER B 7   ? 0.652 0.553 0.503 -0.032 0.061  0.059  7   SER FFF CB  
1614 O OG  . SER B 7   ? 0.726 0.522 0.354 -0.035 0.079  0.085  7   SER FFF OG  
1615 N N   . GLY B 8   ? 0.625 0.497 0.404 -0.055 0.168  0.025  8   GLY FFF N   
1616 C CA  . GLY B 8   ? 0.669 0.480 0.469 -0.026 0.147  0.043  8   GLY FFF CA  
1617 C C   . GLY B 8   ? 0.675 0.512 0.502 -0.045 0.185  0.014  8   GLY FFF C   
1618 O O   . GLY B 8   ? 0.715 0.535 0.528 -0.080 0.130  0.039  8   GLY FFF O   
1619 N N   . GLY B 9   ? 0.727 0.511 0.592 -0.007 0.139  -0.028 9   GLY FFF N   
1620 C CA  . GLY B 9   ? 0.829 0.530 0.509 0.002  0.193  -0.028 9   GLY FFF CA  
1621 C C   . GLY B 9   ? 0.873 0.513 0.432 0.017  0.187  -0.035 9   GLY FFF C   
1622 O O   . GLY B 9   ? 0.941 0.561 0.437 -0.017 0.221  0.072  9   GLY FFF O   
1623 N N   . GLY B 10  ? 0.879 0.526 0.367 0.016  0.139  -0.031 10  GLY FFF N   
1624 C CA  . GLY B 10  ? 0.835 0.555 0.452 -0.002 0.184  -0.015 10  GLY FFF CA  
1625 C C   . GLY B 10  ? 0.821 0.518 0.453 -0.036 0.172  0.025  10  GLY FFF C   
1626 O O   . GLY B 10  ? 0.747 0.431 0.400 0.028  0.129  -0.038 10  GLY FFF O   
1627 N N   . LEU B 11  ? 0.803 0.558 0.408 -0.041 0.228  0.013  11  LEU FFF N   
1628 C CA  . LEU B 11  ? 0.865 0.548 0.437 -0.011 0.193  0.005  11  LEU FFF CA  
1629 C C   . LEU B 11  ? 0.824 0.528 0.438 0.023  0.198  0.008  11  LEU FFF C   
1630 O O   . LEU B 11  ? 0.834 0.621 0.351 0.077  0.153  0.022  11  LEU FFF O   
1631 C CB  . LEU B 11  ? 0.959 0.572 0.442 -0.029 0.195  0.050  11  LEU FFF CB  
1632 C CG  . LEU B 11  ? 1.005 0.602 0.570 -0.013 0.181  0.048  11  LEU FFF CG  
1633 C CD1 . LEU B 11  ? 1.053 0.582 0.517 -0.019 0.151  0.050  11  LEU FFF CD1 
1634 C CD2 . LEU B 11  ? 1.028 0.620 0.662 -0.079 0.169  0.043  11  LEU FFF CD2 
1635 N N   . MET B 12  ? 0.830 0.455 0.351 0.034  0.211  0.071  12  MET FFF N   
1636 C CA  . MET B 12  ? 0.882 0.491 0.420 0.068  0.149  0.044  12  MET FFF CA  
1637 C C   . MET B 12  ? 0.895 0.504 0.389 0.084  0.122  0.046  12  MET FFF C   
1638 O O   . MET B 12  ? 0.946 0.501 0.447 0.121  0.155  -0.004 12  MET FFF O   
1639 C CB  . MET B 12  ? 0.948 0.523 0.433 0.026  0.139  0.092  12  MET FFF CB  
1640 C CG  . MET B 12  ? 1.010 0.556 0.484 0.054  0.109  0.053  12  MET FFF CG  
1641 S SD  . MET B 12  ? 1.240 0.615 0.446 0.041  0.093  -0.037 12  MET FFF SD  
1642 C CE  . MET B 12  ? 1.117 0.613 0.401 0.036  0.235  0.049  12  MET FFF CE  
1643 N N   . GLN B 13  ? 0.893 0.498 0.305 0.077  0.171  0.038  13  GLN FFF N   
1644 C CA  . GLN B 13  ? 0.953 0.552 0.423 0.128  0.111  0.048  13  GLN FFF CA  
1645 C C   . GLN B 13  ? 0.889 0.498 0.462 0.172  0.095  0.017  13  GLN FFF C   
1646 O O   . GLN B 13  ? 0.842 0.481 0.389 0.186  0.077  0.047  13  GLN FFF O   
1647 C CB  . GLN B 13  ? 1.065 0.692 0.384 0.168  0.105  0.050  13  GLN FFF CB  
1648 C CG  . GLN B 13  ? 1.169 0.759 0.496 0.111  0.076  0.055  13  GLN FFF CG  
1649 C CD  . GLN B 13  ? 1.313 0.820 0.540 0.113  0.062  0.108  13  GLN FFF CD  
1650 O OE1 . GLN B 13  ? 1.515 0.777 0.587 0.115  0.084  0.177  13  GLN FFF OE1 
1651 N NE2 . GLN B 13  ? 1.369 0.921 0.706 0.077  -0.002 -0.005 13  GLN FFF NE2 
1652 N N   . ALA B 14  ? 0.865 0.486 0.468 0.183  0.109  0.047  14  ALA FFF N   
1653 C CA  . ALA B 14  ? 0.889 0.516 0.485 0.152  0.107  0.069  14  ALA FFF CA  
1654 C C   . ALA B 14  ? 0.882 0.525 0.458 0.160  0.111  0.074  14  ALA FFF C   
1655 O O   . ALA B 14  ? 0.785 0.506 0.430 0.205  0.122  0.063  14  ALA FFF O   
1656 C CB  . ALA B 14  ? 0.915 0.545 0.566 0.149  0.150  0.043  14  ALA FFF CB  
1657 N N   . GLY B 15  ? 0.817 0.479 0.516 0.192  0.076  0.026  15  GLY FFF N   
1658 C CA  . GLY B 15  ? 0.809 0.573 0.457 0.221  0.035  0.009  15  GLY FFF CA  
1659 C C   . GLY B 15  ? 0.758 0.553 0.473 0.206  0.011  0.004  15  GLY FFF C   
1660 O O   . GLY B 15  ? 0.786 0.561 0.473 0.211  0.012  -0.026 15  GLY FFF O   
1661 N N   . GLY B 16  ? 0.726 0.531 0.456 0.226  0.061  0.011  16  GLY FFF N   
1662 C CA  . GLY B 16  ? 0.749 0.501 0.406 0.217  0.048  0.011  16  GLY FFF CA  
1663 C C   . GLY B 16  ? 0.763 0.485 0.402 0.215  0.080  0.001  16  GLY FFF C   
1664 O O   . GLY B 16  ? 0.710 0.494 0.389 0.176  0.037  0.033  16  GLY FFF O   
1665 N N   . SER B 17  ? 0.766 0.452 0.315 0.196  0.091  0.007  17  SER FFF N   
1666 C CA  . SER B 17  ? 0.833 0.498 0.279 0.201  0.097  0.032  17  SER FFF CA  
1667 C C   . SER B 17  ? 0.814 0.517 0.256 0.186  0.090  0.063  17  SER FFF C   
1668 O O   . SER B 17  ? 0.824 0.528 0.306 0.245  0.126  0.110  17  SER FFF O   
1669 C CB  . SER B 17  ? 0.949 0.510 0.252 0.190  0.081  0.018  17  SER FFF CB  
1670 O OG  . SER B 17  ? 0.984 0.633 0.449 0.116  0.202  0.015  17  SER FFF OG  
1671 N N   . LEU B 18  ? 0.788 0.483 0.224 0.148  0.103  0.048  18  LEU FFF N   
1672 C CA  . LEU B 18  ? 0.764 0.437 0.257 0.118  0.117  0.039  18  LEU FFF CA  
1673 C C   . LEU B 18  ? 0.657 0.424 0.324 0.111  0.090  0.034  18  LEU FFF C   
1674 O O   . LEU B 18  ? 0.658 0.419 0.326 0.100  0.075  0.051  18  LEU FFF O   
1675 C CB  . LEU B 18  ? 0.825 0.430 0.374 0.069  0.111  -0.014 18  LEU FFF CB  
1676 C CG  . LEU B 18  ? 0.876 0.460 0.363 0.038  0.124  -0.035 18  LEU FFF CG  
1677 C CD1 . LEU B 18  ? 0.934 0.535 0.375 0.004  0.135  -0.058 18  LEU FFF CD1 
1678 C CD2 . LEU B 18  ? 0.881 0.533 0.436 0.001  0.137  0.007  18  LEU FFF CD2 
1679 N N   . ARG B 19  ? 0.650 0.431 0.278 0.119  0.122  0.076  19  ARG FFF N   
1680 C CA  . ARG B 19  ? 0.629 0.405 0.285 0.090  0.131  0.055  19  ARG FFF CA  
1681 C C   . ARG B 19  ? 0.608 0.450 0.316 0.050  0.138  0.056  19  ARG FFF C   
1682 O O   . ARG B 19  ? 0.637 0.454 0.355 0.046  0.179  0.084  19  ARG FFF O   
1683 C CB  . ARG B 19  ? 0.601 0.458 0.262 0.101  0.117  0.040  19  ARG FFF CB  
1684 C CG  . ARG B 19  ? 0.616 0.472 0.267 0.078  0.076  0.027  19  ARG FFF CG  
1685 C CD  . ARG B 19  ? 0.641 0.527 0.270 0.104  0.049  -0.003 19  ARG FFF CD  
1686 N NE  . ARG B 19  ? 0.652 0.580 0.381 0.034  0.084  0.059  19  ARG FFF NE  
1687 C CZ  . ARG B 19  ? 0.570 0.593 0.265 0.110  0.035  0.057  19  ARG FFF CZ  
1688 N NH1 . ARG B 19  ? 0.676 0.570 0.239 0.244  0.068  0.094  19  ARG FFF NH1 
1689 N NH2 . ARG B 19  ? 0.592 0.521 0.345 0.034  0.029  0.006  19  ARG FFF NH2 
1690 N N   . LEU B 20  ? 0.575 0.404 0.273 0.049  0.131  0.002  20  LEU FFF N   
1691 C CA  . LEU B 20  ? 0.536 0.393 0.371 0.031  0.108  -0.038 20  LEU FFF CA  
1692 C C   . LEU B 20  ? 0.517 0.378 0.306 -0.003 0.122  -0.009 20  LEU FFF C   
1693 O O   . LEU B 20  ? 0.524 0.381 0.295 -0.011 0.058  -0.004 20  LEU FFF O   
1694 C CB  . LEU B 20  ? 0.545 0.445 0.364 0.016  0.144  -0.024 20  LEU FFF CB  
1695 C CG  . LEU B 20  ? 0.614 0.460 0.415 0.026  0.151  -0.074 20  LEU FFF CG  
1696 C CD1 . LEU B 20  ? 0.623 0.479 0.401 0.046  0.151  -0.069 20  LEU FFF CD1 
1697 C CD2 . LEU B 20  ? 0.687 0.476 0.493 -0.013 0.158  -0.074 20  LEU FFF CD2 
1698 N N   . SER B 21  ? 0.532 0.405 0.310 0.026  0.115  -0.001 21  SER FFF N   
1699 C CA  . SER B 21  ? 0.537 0.414 0.339 0.044  0.086  0.034  21  SER FFF CA  
1700 C C   . SER B 21  ? 0.541 0.396 0.337 0.009  0.100  0.029  21  SER FFF C   
1701 O O   . SER B 21  ? 0.562 0.420 0.306 -0.002 0.078  0.049  21  SER FFF O   
1702 C CB  . SER B 21  ? 0.561 0.432 0.368 0.066  0.105  0.065  21  SER FFF CB  
1703 O OG  . SER B 21  ? 0.589 0.494 0.377 0.075  0.101  0.077  21  SER FFF OG  
1704 N N   . CYS B 22  ? 0.504 0.418 0.329 0.001  0.043  0.037  22  CYS FFF N   
1705 C CA  . CYS B 22  ? 0.502 0.465 0.353 -0.009 0.033  0.039  22  CYS FFF CA  
1706 C C   . CYS B 22  ? 0.488 0.470 0.337 -0.004 0.039  0.040  22  CYS FFF C   
1707 O O   . CYS B 22  ? 0.477 0.455 0.445 -0.004 -0.013 0.032  22  CYS FFF O   
1708 C CB  . CYS B 22  ? 0.503 0.491 0.341 0.007  0.031  0.026  22  CYS FFF CB  
1709 S SG  . CYS B 22  ? 0.600 0.495 0.392 0.008  -0.022 0.051  22  CYS FFF SG  
1710 N N   . ALA B 23  ? 0.468 0.513 0.379 -0.048 0.012  0.021  23  ALA FFF N   
1711 C CA  . ALA B 23  ? 0.472 0.559 0.434 -0.015 0.021  0.049  23  ALA FFF CA  
1712 C C   . ALA B 23  ? 0.486 0.562 0.397 -0.031 0.032  0.030  23  ALA FFF C   
1713 O O   . ALA B 23  ? 0.511 0.648 0.383 -0.047 -0.029 0.033  23  ALA FFF O   
1714 C CB  . ALA B 23  ? 0.457 0.619 0.508 -0.009 0.053  0.048  23  ALA FFF CB  
1715 N N   . VAL B 24  ? 0.498 0.558 0.408 -0.016 -0.011 0.011  24  VAL FFF N   
1716 C CA  . VAL B 24  ? 0.540 0.576 0.415 0.014  0.019  0.046  24  VAL FFF CA  
1717 C C   . VAL B 24  ? 0.554 0.602 0.481 0.031  0.042  0.037  24  VAL FFF C   
1718 O O   . VAL B 24  ? 0.540 0.579 0.446 0.078  0.022  0.050  24  VAL FFF O   
1719 C CB  . VAL B 24  ? 0.555 0.633 0.433 0.005  0.038  0.042  24  VAL FFF CB  
1720 C CG1 . VAL B 24  ? 0.621 0.659 0.379 -0.034 0.070  0.053  24  VAL FFF CG1 
1721 C CG2 . VAL B 24  ? 0.520 0.698 0.455 -0.005 0.062  0.050  24  VAL FFF CG2 
1722 N N   . SER B 25  ? 0.559 0.696 0.491 0.028  0.032  0.086  25  SER FFF N   
1723 C CA  . SER B 25  ? 0.611 0.757 0.616 0.099  -0.032 0.110  25  SER FFF CA  
1724 C C   . SER B 25  ? 0.617 0.809 0.683 0.104  -0.071 0.161  25  SER FFF C   
1725 O O   . SER B 25  ? 0.686 0.887 0.575 0.093  -0.178 0.120  25  SER FFF O   
1726 C CB  . SER B 25  ? 0.638 0.760 0.707 0.097  -0.009 0.101  25  SER FFF CB  
1727 O OG  . SER B 25  ? 0.754 0.774 0.799 0.008  -0.025 0.067  25  SER FFF OG  
1728 N N   . GLY B 26  ? 0.619 0.777 0.763 0.079  0.001  0.170  26  GLY FFF N   
1729 C CA  . GLY B 26  ? 0.644 0.740 0.777 0.047  -0.022 0.192  26  GLY FFF CA  
1730 C C   . GLY B 26  ? 0.624 0.807 0.881 -0.016 -0.004 0.163  26  GLY FFF C   
1731 O O   . GLY B 26  ? 0.599 0.747 0.864 -0.058 0.044  0.154  26  GLY FFF O   
1732 N N   . ARG B 27  ? 0.761 0.767 0.967 -0.029 0.001  0.189  27  ARG FFF N   
1733 C CA  . ARG B 27  ? 0.748 0.817 1.036 -0.065 0.019  0.154  27  ARG FFF CA  
1734 C C   . ARG B 27  ? 0.679 0.760 0.897 -0.120 -0.043 0.110  27  ARG FFF C   
1735 O O   . ARG B 27  ? 0.618 0.838 0.925 -0.127 -0.115 0.076  27  ARG FFF O   
1736 C CB  . ARG B 27  ? 0.897 0.924 1.176 0.081  -0.009 0.166  27  ARG FFF CB  
1737 C CG  . ARG B 27  ? 0.988 1.056 1.288 0.149  0.038  0.119  27  ARG FFF CG  
1738 C CD  . ARG B 27  ? 1.105 1.099 1.396 0.210  0.016  0.138  27  ARG FFF CD  
1739 N NE  . ARG B 27  ? 1.128 1.210 1.492 0.174  0.050  0.166  27  ARG FFF NE  
1740 C CZ  . ARG B 27  ? 1.284 1.181 1.489 0.165  0.083  0.269  27  ARG FFF CZ  
1741 N NH1 . ARG B 27  ? 1.335 1.256 1.479 0.119  0.097  0.307  27  ARG FFF NH1 
1742 N NH2 . ARG B 27  ? 1.315 1.184 1.460 0.169  0.152  0.238  27  ARG FFF NH2 
1743 N N   . THR B 28  ? 0.612 0.695 0.804 -0.083 -0.008 0.141  28  THR FFF N   
1744 C CA  A THR B 28  ? 0.653 0.641 0.795 -0.079 0.019  0.111  28  THR FFF CA  
1745 C CA  B THR B 28  ? 0.597 0.618 0.743 -0.065 -0.030 0.132  28  THR FFF CA  
1746 C C   . THR B 28  ? 0.635 0.635 0.668 -0.068 0.020  0.131  28  THR FFF C   
1747 O O   . THR B 28  ? 0.690 0.700 0.661 -0.116 0.055  0.065  28  THR FFF O   
1748 C CB  A THR B 28  ? 0.701 0.703 0.847 -0.020 0.016  0.109  28  THR FFF CB  
1749 C CB  B THR B 28  ? 0.583 0.554 0.736 -0.077 -0.011 0.139  28  THR FFF CB  
1750 O OG1 A THR B 28  ? 0.732 0.743 0.869 -0.021 0.068  0.074  28  THR FFF OG1 
1751 O OG1 B THR B 28  ? 0.540 0.469 0.734 -0.111 -0.027 0.171  28  THR FFF OG1 
1752 C CG2 A THR B 28  ? 0.748 0.735 0.872 -0.018 0.017  0.068  28  THR FFF CG2 
1753 C CG2 B THR B 28  ? 0.552 0.534 0.729 -0.058 -0.032 0.131  28  THR FFF CG2 
1754 N N   . PHE B 29  ? 0.592 0.604 0.605 -0.077 -0.002 0.071  29  PHE FFF N   
1755 C CA  . PHE B 29  ? 0.549 0.608 0.527 -0.070 -0.008 0.070  29  PHE FFF CA  
1756 C C   . PHE B 29  ? 0.589 0.480 0.485 -0.050 -0.065 0.081  29  PHE FFF C   
1757 O O   . PHE B 29  ? 0.555 0.499 0.529 -0.003 -0.090 0.026  29  PHE FFF O   
1758 C CB  . PHE B 29  ? 0.597 0.614 0.498 -0.053 -0.017 0.043  29  PHE FFF CB  
1759 C CG  . PHE B 29  ? 0.615 0.594 0.441 -0.056 0.009  -0.004 29  PHE FFF CG  
1760 C CD1 . PHE B 29  ? 0.604 0.594 0.426 -0.027 -0.017 -0.057 29  PHE FFF CD1 
1761 C CD2 . PHE B 29  ? 0.588 0.645 0.503 -0.052 -0.029 -0.003 29  PHE FFF CD2 
1762 C CE1 . PHE B 29  ? 0.660 0.629 0.477 -0.047 0.020  -0.031 29  PHE FFF CE1 
1763 C CE2 . PHE B 29  ? 0.641 0.643 0.476 -0.055 -0.026 0.033  29  PHE FFF CE2 
1764 C CZ  . PHE B 29  ? 0.648 0.627 0.506 -0.055 -0.049 -0.028 29  PHE FFF CZ  
1765 N N   . SER B 30  ? 0.528 0.507 0.560 -0.060 -0.068 0.036  30  SER FFF N   
1766 C CA  . SER B 30  ? 0.547 0.506 0.443 -0.008 -0.086 0.093  30  SER FFF CA  
1767 C C   . SER B 30  ? 0.560 0.521 0.394 0.010  -0.052 0.094  30  SER FFF C   
1768 O O   . SER B 30  ? 0.754 0.482 0.500 0.030  -0.010 0.014  30  SER FFF O   
1769 C CB  . SER B 30  ? 0.606 0.614 0.374 -0.035 -0.055 0.054  30  SER FFF CB  
1770 O OG  . SER B 30  ? 0.651 0.676 0.390 -0.038 -0.042 0.035  30  SER FFF OG  
1771 N N   . THR B 31  ? 0.436 0.509 0.421 0.055  -0.019 0.016  31  THR FFF N   
1772 C CA  . THR B 31  ? 0.481 0.510 0.358 0.052  0.001  0.039  31  THR FFF CA  
1773 C C   . THR B 31  ? 0.451 0.472 0.306 0.062  -0.026 0.012  31  THR FFF C   
1774 O O   . THR B 31  ? 0.502 0.477 0.371 0.013  -0.030 -0.014 31  THR FFF O   
1775 C CB  . THR B 31  ? 0.470 0.578 0.342 0.030  -0.027 0.056  31  THR FFF CB  
1776 O OG1 . THR B 31  ? 0.492 0.621 0.391 -0.025 0.028  0.084  31  THR FFF OG1 
1777 C CG2 . THR B 31  ? 0.511 0.521 0.356 0.007  -0.005 -0.005 31  THR FFF CG2 
1778 N N   . ALA B 32  ? 0.427 0.451 0.271 0.039  -0.044 0.009  32  ALA FFF N   
1779 C CA  . ALA B 32  ? 0.424 0.442 0.307 0.018  -0.031 -0.003 32  ALA FFF CA  
1780 C C   . ALA B 32  ? 0.389 0.409 0.292 -0.002 -0.012 -0.009 32  ALA FFF C   
1781 O O   . ALA B 32  ? 0.439 0.413 0.252 -0.002 -0.042 -0.011 32  ALA FFF O   
1782 C CB  . ALA B 32  ? 0.455 0.462 0.287 0.003  -0.037 -0.005 32  ALA FFF CB  
1783 N N   . ALA B 33  ? 0.405 0.413 0.275 -0.017 -0.012 0.020  33  ALA FFF N   
1784 C CA  . ALA B 33  ? 0.401 0.428 0.246 -0.003 -0.000 0.014  33  ALA FFF CA  
1785 C C   . ALA B 33  ? 0.411 0.407 0.280 0.001  -0.006 0.024  33  ALA FFF C   
1786 O O   . ALA B 33  ? 0.426 0.440 0.256 0.008  -0.010 0.027  33  ALA FFF O   
1787 C CB  . ALA B 33  ? 0.429 0.435 0.232 -0.018 0.016  0.012  33  ALA FFF CB  
1788 N N   . MET B 34  ? 0.428 0.429 0.236 -0.013 -0.018 0.015  34  MET FFF N   
1789 C CA  A MET B 34  ? 0.455 0.413 0.312 -0.014 -0.019 0.006  34  MET FFF CA  
1790 C CA  B MET B 34  ? 0.409 0.421 0.217 -0.024 -0.004 -0.004 34  MET FFF CA  
1791 C C   . MET B 34  ? 0.424 0.411 0.277 -0.028 0.014  -0.014 34  MET FFF C   
1792 O O   . MET B 34  ? 0.441 0.390 0.353 -0.005 -0.011 -0.023 34  MET FFF O   
1793 C CB  A MET B 34  ? 0.493 0.452 0.346 -0.005 0.018  0.025  34  MET FFF CB  
1794 C CB  B MET B 34  ? 0.390 0.393 0.220 -0.018 0.001  -0.005 34  MET FFF CB  
1795 C CG  A MET B 34  ? 0.528 0.466 0.431 0.015  0.020  0.048  34  MET FFF CG  
1796 C CG  B MET B 34  ? 0.345 0.400 0.203 -0.039 0.010  -0.001 34  MET FFF CG  
1797 S SD  A MET B 34  ? 0.518 0.514 0.593 0.003  -0.002 0.032  34  MET FFF SD  
1798 S SD  B MET B 34  ? 0.368 0.408 0.184 -0.029 0.021  0.007  34  MET FFF SD  
1799 C CE  A MET B 34  ? 0.505 0.543 0.549 0.007  0.008  0.070  34  MET FFF CE  
1800 C CE  B MET B 34  ? 0.347 0.428 0.209 -0.048 0.024  0.019  34  MET FFF CE  
1801 N N   . GLY B 35  ? 0.444 0.422 0.301 -0.022 -0.023 -0.030 35  GLY FFF N   
1802 C CA  . GLY B 35  ? 0.466 0.412 0.334 -0.012 0.004  -0.008 35  GLY FFF CA  
1803 C C   . GLY B 35  ? 0.475 0.446 0.307 -0.013 0.000  0.027  35  GLY FFF C   
1804 O O   . GLY B 35  ? 0.469 0.416 0.338 -0.012 0.034  0.027  35  GLY FFF O   
1805 N N   . TRP B 36  ? 0.524 0.396 0.241 0.015  0.027  0.001  36  TRP FFF N   
1806 C CA  . TRP B 36  ? 0.506 0.395 0.264 0.009  0.042  0.017  36  TRP FFF CA  
1807 C C   . TRP B 36  ? 0.539 0.394 0.252 0.002  0.055  0.031  36  TRP FFF C   
1808 O O   . TRP B 36  ? 0.521 0.394 0.328 0.008  0.058  -0.009 36  TRP FFF O   
1809 C CB  . TRP B 36  ? 0.529 0.401 0.265 0.039  0.048  0.030  36  TRP FFF CB  
1810 C CG  . TRP B 36  ? 0.539 0.398 0.284 0.026  0.069  0.020  36  TRP FFF CG  
1811 C CD1 . TRP B 36  ? 0.514 0.397 0.259 0.046  0.055  0.022  36  TRP FFF CD1 
1812 C CD2 . TRP B 36  ? 0.525 0.411 0.282 0.028  0.056  0.006  36  TRP FFF CD2 
1813 N NE1 . TRP B 36  ? 0.522 0.402 0.259 0.043  0.053  0.005  36  TRP FFF NE1 
1814 C CE2 . TRP B 36  ? 0.498 0.446 0.278 0.035  0.043  -0.008 36  TRP FFF CE2 
1815 C CE3 . TRP B 36  ? 0.524 0.452 0.298 -0.008 0.058  0.060  36  TRP FFF CE3 
1816 C CZ2 . TRP B 36  ? 0.514 0.426 0.267 0.030  0.052  0.008  36  TRP FFF CZ2 
1817 C CZ3 . TRP B 36  ? 0.531 0.467 0.347 0.009  0.091  0.010  36  TRP FFF CZ3 
1818 C CH2 . TRP B 36  ? 0.540 0.430 0.332 -0.016 0.111  0.029  36  TRP FFF CH2 
1819 N N   . PHE B 37  ? 0.570 0.407 0.272 0.003  0.025  0.013  37  PHE FFF N   
1820 C CA  . PHE B 37  ? 0.617 0.400 0.316 -0.011 0.065  -0.001 37  PHE FFF CA  
1821 C C   . PHE B 37  ? 0.623 0.389 0.335 0.007  0.062  -0.009 37  PHE FFF C   
1822 O O   . PHE B 37  ? 0.601 0.449 0.313 -0.004 0.048  -0.050 37  PHE FFF O   
1823 C CB  . PHE B 37  ? 0.634 0.403 0.338 -0.009 0.040  0.037  37  PHE FFF CB  
1824 C CG  . PHE B 37  ? 0.678 0.449 0.393 -0.053 0.040  0.059  37  PHE FFF CG  
1825 C CD1 . PHE B 37  ? 0.675 0.450 0.368 -0.051 0.005  0.069  37  PHE FFF CD1 
1826 C CD2 . PHE B 37  ? 0.669 0.515 0.483 -0.049 0.073  0.076  37  PHE FFF CD2 
1827 C CE1 . PHE B 37  ? 0.683 0.469 0.420 -0.070 0.020  0.077  37  PHE FFF CE1 
1828 C CE2 . PHE B 37  ? 0.686 0.499 0.480 -0.057 0.041  0.078  37  PHE FFF CE2 
1829 C CZ  . PHE B 37  ? 0.681 0.474 0.478 -0.048 0.044  0.133  37  PHE FFF CZ  
1830 N N   . ARG B 38  ? 0.640 0.427 0.309 0.005  0.078  -0.035 38  ARG FFF N   
1831 C CA  . ARG B 38  ? 0.663 0.392 0.327 -0.001 0.065  -0.069 38  ARG FFF CA  
1832 C C   . ARG B 38  ? 0.676 0.413 0.362 -0.035 0.073  -0.099 38  ARG FFF C   
1833 O O   . ARG B 38  ? 0.749 0.432 0.368 -0.078 0.097  -0.056 38  ARG FFF O   
1834 C CB  . ARG B 38  ? 0.653 0.372 0.386 -0.012 0.044  -0.042 38  ARG FFF CB  
1835 C CG  . ARG B 38  ? 0.664 0.453 0.366 0.012  0.062  -0.048 38  ARG FFF CG  
1836 C CD  . ARG B 38  ? 0.680 0.479 0.384 0.042  0.069  0.005  38  ARG FFF CD  
1837 N NE  . ARG B 38  ? 0.691 0.505 0.368 0.075  0.101  0.029  38  ARG FFF NE  
1838 C CZ  . ARG B 38  ? 0.679 0.539 0.377 0.068  0.096  -0.011 38  ARG FFF CZ  
1839 N NH1 . ARG B 38  ? 0.696 0.501 0.365 0.096  0.101  0.054  38  ARG FFF NH1 
1840 N NH2 . ARG B 38  ? 0.692 0.575 0.415 0.101  0.123  -0.030 38  ARG FFF NH2 
1841 N N   . GLN B 39  ? 0.736 0.420 0.353 -0.063 0.093  -0.077 39  GLN FFF N   
1842 C CA  . GLN B 39  ? 0.807 0.422 0.371 -0.060 0.089  -0.092 39  GLN FFF CA  
1843 C C   . GLN B 39  ? 0.810 0.473 0.368 -0.046 0.068  -0.048 39  GLN FFF C   
1844 O O   . GLN B 39  ? 0.772 0.424 0.412 -0.086 0.037  -0.055 39  GLN FFF O   
1845 C CB  . GLN B 39  ? 0.851 0.483 0.387 -0.065 0.065  -0.071 39  GLN FFF CB  
1846 C CG  . GLN B 39  ? 0.941 0.519 0.456 -0.065 0.036  -0.118 39  GLN FFF CG  
1847 C CD  . GLN B 39  ? 0.991 0.634 0.392 -0.070 0.029  -0.151 39  GLN FFF CD  
1848 O OE1 . GLN B 39  ? 0.941 0.853 0.523 -0.017 0.016  -0.119 39  GLN FFF OE1 
1849 N NE2 . GLN B 39  ? 1.078 0.784 0.325 -0.097 -0.005 -0.163 39  GLN FFF NE2 
1850 N N   . ALA B 40  ? 0.883 0.545 0.434 0.011  0.126  -0.066 40  ALA FFF N   
1851 C CA  . ALA B 40  ? 1.004 0.546 0.507 0.029  0.198  -0.066 40  ALA FFF CA  
1852 C C   . ALA B 40  ? 1.138 0.572 0.603 -0.040 0.202  -0.101 40  ALA FFF C   
1853 O O   . ALA B 40  ? 1.123 0.442 0.610 -0.035 0.205  -0.091 40  ALA FFF O   
1854 C CB  . ALA B 40  ? 1.023 0.642 0.525 0.069  0.164  -0.059 40  ALA FFF CB  
1855 N N   . PRO B 41  ? 1.306 0.606 0.774 -0.081 0.297  -0.068 41  PRO FFF N   
1856 C CA  . PRO B 41  ? 1.347 0.655 0.844 -0.131 0.264  -0.061 41  PRO FFF CA  
1857 C C   . PRO B 41  ? 1.352 0.603 0.884 -0.080 0.255  -0.093 41  PRO FFF C   
1858 O O   . PRO B 41  ? 1.336 0.425 1.002 0.020  0.309  -0.126 41  PRO FFF O   
1859 C CB  . PRO B 41  ? 1.418 0.679 0.891 -0.160 0.255  -0.025 41  PRO FFF CB  
1860 C CG  . PRO B 41  ? 1.411 0.653 0.880 -0.151 0.263  0.013  41  PRO FFF CG  
1861 C CD  . PRO B 41  ? 1.391 0.651 0.759 -0.076 0.281  -0.097 41  PRO FFF CD  
1862 N N   . GLY B 42  ? 1.387 0.627 0.878 -0.112 0.252  -0.136 42  GLY FFF N   
1863 C CA  . GLY B 42  ? 1.371 0.710 0.872 -0.105 0.241  -0.153 42  GLY FFF CA  
1864 C C   . GLY B 42  ? 1.347 0.713 0.806 -0.087 0.254  -0.219 42  GLY FFF C   
1865 O O   . GLY B 42  ? 1.315 0.552 0.926 -0.040 0.269  -0.274 42  GLY FFF O   
1866 N N   . LYS B 43  ? 1.304 0.754 0.630 -0.043 0.246  -0.203 43  LYS FFF N   
1867 C CA  . LYS B 43  ? 1.204 0.799 0.581 -0.009 0.180  -0.160 43  LYS FFF CA  
1868 C C   . LYS B 43  ? 1.155 0.750 0.439 -0.060 0.205  -0.174 43  LYS FFF C   
1869 O O   . LYS B 43  ? 1.109 0.671 0.549 -0.098 0.154  -0.105 43  LYS FFF O   
1870 C CB  . LYS B 43  ? 1.221 0.917 0.626 0.035  0.130  -0.121 43  LYS FFF CB  
1871 C CG  . LYS B 43  ? 1.215 1.027 0.677 0.063  0.015  -0.100 43  LYS FFF CG  
1872 C CD  . LYS B 43  ? 1.249 1.124 0.731 0.022  -0.032 -0.075 43  LYS FFF CD  
1873 C CE  . LYS B 43  ? 1.209 1.198 0.684 0.036  -0.118 -0.066 43  LYS FFF CE  
1874 N NZ  . LYS B 43  ? 1.297 1.235 0.476 0.050  -0.104 -0.085 43  LYS FFF NZ  
1875 N N   . GLU B 44  ? 1.156 0.712 0.411 -0.049 0.179  -0.154 44  GLU FFF N   
1876 C CA  . GLU B 44  ? 1.178 0.734 0.445 -0.012 0.168  -0.164 44  GLU FFF CA  
1877 C C   . GLU B 44  ? 1.032 0.644 0.373 -0.027 0.108  -0.091 44  GLU FFF C   
1878 O O   . GLU B 44  ? 1.033 0.471 0.410 -0.051 0.082  -0.102 44  GLU FFF O   
1879 C CB  . GLU B 44  ? 1.282 0.832 0.462 -0.017 0.251  -0.178 44  GLU FFF CB  
1880 C CG  . GLU B 44  ? 1.410 0.880 0.519 -0.015 0.269  -0.245 44  GLU FFF CG  
1881 C CD  . GLU B 44  ? 1.449 1.084 0.678 -0.056 0.294  -0.131 44  GLU FFF CD  
1882 O OE1 . GLU B 44  ? 1.523 1.110 0.690 -0.068 0.231  -0.192 44  GLU FFF OE1 
1883 O OE2 . GLU B 44  ? 1.594 1.185 0.904 -0.005 0.196  -0.308 44  GLU FFF OE2 
1884 N N   . ARG B 45  ? 1.030 0.615 0.280 -0.044 0.059  -0.121 45  ARG FFF N   
1885 C CA  . ARG B 45  ? 1.006 0.565 0.314 -0.041 0.078  -0.109 45  ARG FFF CA  
1886 C C   . ARG B 45  ? 0.991 0.586 0.342 -0.035 0.144  -0.071 45  ARG FFF C   
1887 O O   . ARG B 45  ? 1.053 0.615 0.341 -0.070 0.181  -0.085 45  ARG FFF O   
1888 C CB  . ARG B 45  ? 1.101 0.585 0.401 -0.009 0.030  -0.066 45  ARG FFF CB  
1889 C CG  . ARG B 45  ? 1.213 0.598 0.366 -0.009 0.030  -0.066 45  ARG FFF CG  
1890 C CD  . ARG B 45  ? 1.306 0.709 0.450 0.049  -0.027 -0.095 45  ARG FFF CD  
1891 N NE  . ARG B 45  ? 1.430 0.756 0.470 0.054  -0.066 -0.049 45  ARG FFF NE  
1892 C CZ  . ARG B 45  ? 1.489 0.928 0.575 0.095  -0.040 0.047  45  ARG FFF CZ  
1893 N NH1 . ARG B 45  ? 1.485 1.027 0.604 0.100  -0.082 -0.056 45  ARG FFF NH1 
1894 N NH2 . ARG B 45  ? 1.505 0.999 0.561 0.131  0.164  -0.064 45  ARG FFF NH2 
1895 N N   . GLU B 46  ? 0.833 0.522 0.326 -0.014 0.186  -0.066 46  GLU FFF N   
1896 C CA  . GLU B 46  ? 0.829 0.536 0.377 -0.004 0.197  -0.115 46  GLU FFF CA  
1897 C C   . GLU B 46  ? 0.699 0.461 0.421 -0.052 0.177  -0.083 46  GLU FFF C   
1898 O O   . GLU B 46  ? 0.730 0.442 0.342 -0.077 0.155  -0.066 46  GLU FFF O   
1899 C CB  . GLU B 46  ? 0.903 0.596 0.511 0.035  0.159  -0.099 46  GLU FFF CB  
1900 C CG  . GLU B 46  ? 0.975 0.612 0.476 0.107  0.212  -0.162 46  GLU FFF CG  
1901 C CD  . GLU B 46  ? 1.065 0.613 0.511 0.127  0.182  -0.139 46  GLU FFF CD  
1902 O OE1 . GLU B 46  ? 1.050 0.534 0.507 0.108  0.234  -0.074 46  GLU FFF OE1 
1903 O OE2 . GLU B 46  ? 1.019 0.766 0.487 0.123  0.177  -0.164 46  GLU FFF OE2 
1904 N N   . PHE B 47  ? 0.676 0.422 0.342 -0.034 0.132  -0.058 47  PHE FFF N   
1905 C CA  . PHE B 47  ? 0.607 0.405 0.350 -0.007 0.082  -0.051 47  PHE FFF CA  
1906 C C   . PHE B 47  ? 0.590 0.436 0.347 0.027  0.092  -0.057 47  PHE FFF C   
1907 O O   . PHE B 47  ? 0.589 0.413 0.354 0.026  0.070  -0.080 47  PHE FFF O   
1908 C CB  . PHE B 47  ? 0.600 0.427 0.366 -0.021 0.073  -0.045 47  PHE FFF CB  
1909 C CG  . PHE B 47  ? 0.562 0.394 0.332 0.011  0.086  -0.034 47  PHE FFF CG  
1910 C CD1 . PHE B 47  ? 0.550 0.417 0.312 0.013  0.045  -0.017 47  PHE FFF CD1 
1911 C CD2 . PHE B 47  ? 0.562 0.385 0.326 0.030  0.089  -0.023 47  PHE FFF CD2 
1912 C CE1 . PHE B 47  ? 0.534 0.415 0.314 0.022  0.072  -0.032 47  PHE FFF CE1 
1913 C CE2 . PHE B 47  ? 0.574 0.424 0.330 0.022  0.061  -0.041 47  PHE FFF CE2 
1914 C CZ  . PHE B 47  ? 0.549 0.424 0.313 0.024  0.043  -0.007 47  PHE FFF CZ  
1915 N N   . VAL B 48  ? 0.556 0.412 0.343 0.026  0.096  -0.044 48  VAL FFF N   
1916 C CA  . VAL B 48  ? 0.521 0.431 0.339 0.037  0.090  -0.031 48  VAL FFF CA  
1917 C C   . VAL B 48  ? 0.486 0.428 0.304 0.048  0.096  -0.009 48  VAL FFF C   
1918 O O   . VAL B 48  ? 0.475 0.448 0.343 0.060  0.099  0.003  48  VAL FFF O   
1919 C CB  . VAL B 48  ? 0.573 0.445 0.354 0.002  0.100  -0.028 48  VAL FFF CB  
1920 C CG1 . VAL B 48  ? 0.562 0.454 0.369 0.024  0.108  -0.035 48  VAL FFF CG1 
1921 C CG2 . VAL B 48  ? 0.618 0.461 0.344 0.002  0.127  -0.026 48  VAL FFF CG2 
1922 N N   . ALA B 49  ? 0.465 0.414 0.287 0.032  0.069  -0.010 49  ALA FFF N   
1923 C CA  . ALA B 49  ? 0.475 0.424 0.245 0.011  0.061  0.013  49  ALA FFF CA  
1924 C C   . ALA B 49  ? 0.454 0.409 0.277 -0.003 0.060  0.006  49  ALA FFF C   
1925 O O   . ALA B 49  ? 0.452 0.402 0.286 0.005  0.038  -0.031 49  ALA FFF O   
1926 C CB  . ALA B 49  ? 0.503 0.427 0.239 -0.008 0.075  0.018  49  ALA FFF CB  
1927 N N   . ALA B 50  ? 0.454 0.397 0.233 -0.001 0.030  -0.004 50  ALA FFF N   
1928 C CA  . ALA B 50  ? 0.464 0.405 0.271 0.025  0.036  -0.017 50  ALA FFF CA  
1929 C C   . ALA B 50  ? 0.425 0.412 0.211 0.035  0.029  0.001  50  ALA FFF C   
1930 O O   . ALA B 50  ? 0.420 0.402 0.261 0.017  0.033  -0.015 50  ALA FFF O   
1931 C CB  . ALA B 50  ? 0.516 0.453 0.248 0.014  0.057  -0.039 50  ALA FFF CB  
1932 N N   . ILE B 51  ? 0.429 0.404 0.254 0.034  0.002  -0.012 51  ILE FFF N   
1933 C CA  . ILE B 51  ? 0.426 0.373 0.259 0.025  0.026  -0.006 51  ILE FFF CA  
1934 C C   . ILE B 51  ? 0.396 0.381 0.210 0.010  0.024  -0.005 51  ILE FFF C   
1935 O O   . ILE B 51  ? 0.434 0.378 0.236 0.004  -0.017 0.007  51  ILE FFF O   
1936 C CB  . ILE B 51  ? 0.451 0.403 0.244 0.024  0.024  -0.006 51  ILE FFF CB  
1937 C CG1 . ILE B 51  ? 0.474 0.383 0.255 -0.000 0.023  0.004  51  ILE FFF CG1 
1938 C CG2 . ILE B 51  ? 0.468 0.386 0.256 0.004  0.024  -0.023 51  ILE FFF CG2 
1939 C CD1 . ILE B 51  ? 0.446 0.385 0.249 0.039  0.020  0.009  51  ILE FFF CD1 
1940 N N   . ARG B 52  ? 0.381 0.362 0.267 0.019  0.018  0.016  52  ARG FFF N   
1941 C CA  . ARG B 52  ? 0.397 0.380 0.240 0.039  0.010  0.013  52  ARG FFF CA  
1942 C C   . ARG B 52  ? 0.379 0.382 0.286 0.030  0.012  -0.003 52  ARG FFF C   
1943 O O   . ARG B 52  ? 0.398 0.432 0.287 0.019  -0.005 0.002  52  ARG FFF O   
1944 C CB  . ARG B 52  ? 0.413 0.406 0.281 0.019  0.014  -0.012 52  ARG FFF CB  
1945 C CG  . ARG B 52  ? 0.407 0.399 0.287 0.019  -0.007 -0.021 52  ARG FFF CG  
1946 C CD  . ARG B 52  ? 0.406 0.382 0.274 0.016  -0.019 -0.024 52  ARG FFF CD  
1947 N NE  . ARG B 52  ? 0.404 0.367 0.305 0.025  -0.008 -0.014 52  ARG FFF NE  
1948 C CZ  . ARG B 52  ? 0.411 0.383 0.311 0.030  0.000  -0.010 52  ARG FFF CZ  
1949 N NH1 . ARG B 52  ? 0.388 0.409 0.308 0.015  0.016  0.010  52  ARG FFF NH1 
1950 N NH2 . ARG B 52  ? 0.413 0.396 0.246 0.010  0.029  0.011  52  ARG FFF NH2 
1951 N N   . TRP B 53  ? 0.384 0.410 0.251 0.019  -0.016 0.019  53  TRP FFF N   
1952 C CA  . TRP B 53  ? 0.404 0.427 0.305 0.017  0.019  0.022  53  TRP FFF CA  
1953 C C   . TRP B 53  ? 0.437 0.431 0.296 0.001  0.024  0.027  53  TRP FFF C   
1954 O O   . TRP B 53  ? 0.527 0.408 0.292 0.040  0.025  0.022  53  TRP FFF O   
1955 C CB  . TRP B 53  ? 0.419 0.450 0.323 0.003  0.002  0.033  53  TRP FFF CB  
1956 C CG  . TRP B 53  ? 0.427 0.445 0.307 -0.012 0.003  0.026  53  TRP FFF CG  
1957 C CD1 . TRP B 53  ? 0.446 0.489 0.319 0.005  0.031  0.016  53  TRP FFF CD1 
1958 C CD2 . TRP B 53  ? 0.459 0.479 0.295 -0.036 0.007  0.028  53  TRP FFF CD2 
1959 N NE1 . TRP B 53  ? 0.404 0.535 0.389 0.008  0.058  -0.007 53  TRP FFF NE1 
1960 C CE2 . TRP B 53  ? 0.434 0.503 0.297 -0.051 -0.004 0.019  53  TRP FFF CE2 
1961 C CE3 . TRP B 53  ? 0.476 0.467 0.282 -0.051 -0.010 0.075  53  TRP FFF CE3 
1962 C CZ2 . TRP B 53  ? 0.498 0.521 0.343 -0.065 -0.018 0.050  53  TRP FFF CZ2 
1963 C CZ3 . TRP B 53  ? 0.479 0.472 0.304 -0.097 -0.023 0.044  53  TRP FFF CZ3 
1964 C CH2 . TRP B 53  ? 0.491 0.489 0.293 -0.088 -0.016 0.075  53  TRP FFF CH2 
1965 N N   . SER B 54  ? 0.464 0.392 0.273 0.011  -0.013 0.031  54  SER FFF N   
1966 C CA  . SER B 54  ? 0.497 0.401 0.277 0.005  -0.006 0.023  54  SER FFF CA  
1967 C C   . SER B 54  ? 0.493 0.407 0.278 0.030  -0.004 -0.013 54  SER FFF C   
1968 O O   . SER B 54  ? 0.485 0.437 0.295 0.037  0.008  -0.021 54  SER FFF O   
1969 C CB  . SER B 54  ? 0.565 0.405 0.292 -0.034 0.036  0.033  54  SER FFF CB  
1970 O OG  . SER B 54  ? 0.613 0.417 0.426 -0.014 0.031  0.009  54  SER FFF OG  
1971 N N   . GLY B 55  ? 0.526 0.414 0.294 -0.000 -0.027 -0.015 55  GLY FFF N   
1972 C CA  . GLY B 55  ? 0.519 0.433 0.318 0.027  -0.047 -0.035 55  GLY FFF CA  
1973 C C   . GLY B 55  ? 0.463 0.453 0.301 -0.009 -0.076 -0.011 55  GLY FFF C   
1974 O O   . GLY B 55  ? 0.481 0.465 0.296 0.031  -0.101 -0.023 55  GLY FFF O   
1975 N N   . GLY B 56  ? 0.476 0.424 0.265 0.011  -0.033 -0.016 56  GLY FFF N   
1976 C CA  . GLY B 56  ? 0.487 0.428 0.228 0.018  -0.013 -0.000 56  GLY FFF CA  
1977 C C   . GLY B 56  ? 0.461 0.407 0.253 0.013  -0.007 0.032  56  GLY FFF C   
1978 O O   . GLY B 56  ? 0.442 0.420 0.231 0.043  0.001  0.034  56  GLY FFF O   
1979 N N   . SER B 57  ? 0.416 0.395 0.311 0.011  0.010  0.013  57  SER FFF N   
1980 C CA  . SER B 57  ? 0.433 0.407 0.343 0.018  0.010  0.003  57  SER FFF CA  
1981 C C   . SER B 57  ? 0.387 0.425 0.304 0.003  0.009  0.013  57  SER FFF C   
1982 O O   . SER B 57  ? 0.406 0.435 0.291 -0.004 -0.010 -0.024 57  SER FFF O   
1983 C CB  . SER B 57  ? 0.433 0.425 0.387 -0.015 0.001  0.017  57  SER FFF CB  
1984 O OG  . SER B 57  ? 0.485 0.469 0.351 -0.027 0.009  -0.025 57  SER FFF OG  
1985 N N   . ALA B 58  ? 0.437 0.423 0.296 0.023  -0.002 -0.003 58  ALA FFF N   
1986 C CA  . ALA B 58  ? 0.436 0.426 0.310 0.036  0.011  -0.009 58  ALA FFF CA  
1987 C C   . ALA B 58  ? 0.403 0.447 0.297 0.022  0.006  -0.012 58  ALA FFF C   
1988 O O   . ALA B 58  ? 0.378 0.480 0.328 0.048  0.017  -0.017 58  ALA FFF O   
1989 C CB  . ALA B 58  ? 0.445 0.463 0.320 0.023  0.059  -0.002 58  ALA FFF CB  
1990 N N   . TYR B 59  ? 0.434 0.397 0.336 0.042  0.007  -0.020 59  TYR FFF N   
1991 C CA  . TYR B 59  ? 0.451 0.428 0.319 0.065  0.022  -0.002 59  TYR FFF CA  
1992 C C   . TYR B 59  ? 0.448 0.428 0.326 0.057  0.037  -0.007 59  TYR FFF C   
1993 O O   . TYR B 59  ? 0.458 0.440 0.326 0.053  0.045  0.007  59  TYR FFF O   
1994 C CB  . TYR B 59  ? 0.460 0.431 0.323 0.057  0.032  0.009  59  TYR FFF CB  
1995 C CG  . TYR B 59  ? 0.473 0.450 0.326 0.049  0.057  0.005  59  TYR FFF CG  
1996 C CD1 . TYR B 59  ? 0.485 0.475 0.357 0.042  0.025  -0.021 59  TYR FFF CD1 
1997 C CD2 . TYR B 59  ? 0.502 0.438 0.399 0.019  0.090  -0.001 59  TYR FFF CD2 
1998 C CE1 . TYR B 59  ? 0.542 0.526 0.361 0.041  0.074  -0.008 59  TYR FFF CE1 
1999 C CE2 . TYR B 59  ? 0.549 0.498 0.413 0.047  0.109  -0.004 59  TYR FFF CE2 
2000 C CZ  . TYR B 59  ? 0.552 0.495 0.409 0.043  0.090  -0.017 59  TYR FFF CZ  
2001 O OH  . TYR B 59  ? 0.599 0.566 0.405 0.097  0.095  -0.012 59  TYR FFF OH  
2002 N N   . TYR B 60  ? 0.475 0.455 0.316 0.073  0.044  -0.012 60  TYR FFF N   
2003 C CA  . TYR B 60  ? 0.486 0.452 0.352 0.057  0.047  -0.008 60  TYR FFF CA  
2004 C C   . TYR B 60  ? 0.507 0.450 0.394 0.061  0.095  -0.000 60  TYR FFF C   
2005 O O   . TYR B 60  ? 0.511 0.446 0.430 0.062  0.114  -0.000 60  TYR FFF O   
2006 C CB  . TYR B 60  ? 0.511 0.446 0.344 0.068  0.050  0.011  60  TYR FFF CB  
2007 C CG  . TYR B 60  ? 0.490 0.427 0.345 0.073  0.046  -0.000 60  TYR FFF CG  
2008 C CD1 . TYR B 60  ? 0.472 0.405 0.358 0.075  0.045  -0.023 60  TYR FFF CD1 
2009 C CD2 . TYR B 60  ? 0.515 0.417 0.366 0.077  0.056  0.014  60  TYR FFF CD2 
2010 C CE1 . TYR B 60  ? 0.488 0.419 0.313 0.083  0.030  -0.016 60  TYR FFF CE1 
2011 C CE2 . TYR B 60  ? 0.518 0.440 0.370 0.082  0.021  -0.037 60  TYR FFF CE2 
2012 C CZ  . TYR B 60  ? 0.535 0.425 0.332 0.072  0.020  -0.019 60  TYR FFF CZ  
2013 O OH  . TYR B 60  ? 0.492 0.450 0.317 0.071  0.018  -0.010 60  TYR FFF OH  
2014 N N   . ALA B 61  ? 0.518 0.465 0.424 0.075  0.091  -0.036 61  ALA FFF N   
2015 C CA  . ALA B 61  ? 0.521 0.492 0.500 0.118  0.148  -0.017 61  ALA FFF CA  
2016 C C   . ALA B 61  ? 0.547 0.463 0.486 0.137  0.160  -0.006 61  ALA FFF C   
2017 O O   . ALA B 61  ? 0.552 0.446 0.453 0.092  0.076  0.000  61  ALA FFF O   
2018 C CB  . ALA B 61  ? 0.521 0.518 0.485 0.102  0.174  -0.064 61  ALA FFF CB  
2019 N N   . ASP B 62  ? 0.544 0.529 0.555 0.129  0.229  0.054  62  ASP FFF N   
2020 C CA  . ASP B 62  ? 0.628 0.574 0.585 0.153  0.189  0.071  62  ASP FFF CA  
2021 C C   . ASP B 62  ? 0.605 0.555 0.570 0.129  0.186  0.045  62  ASP FFF C   
2022 O O   . ASP B 62  ? 0.610 0.646 0.588 0.188  0.146  0.072  62  ASP FFF O   
2023 C CB  . ASP B 62  ? 0.698 0.615 0.643 0.171  0.241  0.053  62  ASP FFF CB  
2024 C CG  . ASP B 62  ? 0.762 0.645 0.725 0.157  0.279  0.071  62  ASP FFF CG  
2025 O OD1 . ASP B 62  ? 0.847 0.629 0.836 0.128  0.306  0.091  62  ASP FFF OD1 
2026 O OD2 . ASP B 62  ? 0.779 0.799 0.796 0.189  0.326  0.087  62  ASP FFF OD2 
2027 N N   . SER B 63  ? 0.667 0.497 0.562 0.107  0.234  -0.036 63  SER FFF N   
2028 C CA  . SER B 63  ? 0.723 0.552 0.514 0.095  0.214  -0.004 63  SER FFF CA  
2029 C C   . SER B 63  ? 0.696 0.490 0.520 0.150  0.179  -0.017 63  SER FFF C   
2030 O O   . SER B 63  ? 0.768 0.486 0.589 0.179  0.200  0.027  63  SER FFF O   
2031 C CB  . SER B 63  ? 0.786 0.589 0.552 0.041  0.213  -0.014 63  SER FFF CB  
2032 O OG  . SER B 63  ? 0.786 0.738 0.540 0.032  0.128  -0.056 63  SER FFF OG  
2033 N N   . VAL B 64  ? 0.630 0.477 0.500 0.136  0.133  -0.009 64  VAL FFF N   
2034 C CA  . VAL B 64  ? 0.615 0.457 0.468 0.141  0.129  0.009  64  VAL FFF CA  
2035 C C   . VAL B 64  ? 0.571 0.509 0.520 0.142  0.111  -0.010 64  VAL FFF C   
2036 O O   . VAL B 64  ? 0.569 0.574 0.469 0.173  0.053  -0.011 64  VAL FFF O   
2037 C CB  . VAL B 64  ? 0.618 0.452 0.411 0.116  0.123  0.014  64  VAL FFF CB  
2038 C CG1 . VAL B 64  ? 0.662 0.436 0.408 0.101  0.158  0.008  64  VAL FFF CG1 
2039 C CG2 . VAL B 64  ? 0.630 0.449 0.395 0.117  0.121  0.015  64  VAL FFF CG2 
2040 N N   . LYS B 65  ? 0.590 0.604 0.520 0.145  0.166  -0.030 65  LYS FFF N   
2041 C CA  . LYS B 65  ? 0.652 0.671 0.638 0.107  0.101  -0.025 65  LYS FFF CA  
2042 C C   . LYS B 65  ? 0.671 0.626 0.694 0.133  0.048  -0.021 65  LYS FFF C   
2043 O O   . LYS B 65  ? 0.618 0.684 0.783 0.218  0.038  -0.072 65  LYS FFF O   
2044 C CB  . LYS B 65  ? 0.689 0.742 0.673 0.099  0.121  -0.010 65  LYS FFF CB  
2045 C CG  . LYS B 65  ? 0.698 0.803 0.681 0.121  0.102  0.033  65  LYS FFF CG  
2046 C CD  . LYS B 65  ? 0.717 0.855 0.747 0.074  0.092  0.079  65  LYS FFF CD  
2047 C CE  . LYS B 65  ? 0.754 0.921 0.698 0.028  0.140  0.122  65  LYS FFF CE  
2048 N NZ  . LYS B 65  ? 0.703 0.977 0.824 0.000  0.119  0.150  65  LYS FFF NZ  
2049 N N   . GLY B 66  ? 0.682 0.580 0.685 0.131  0.005  -0.021 66  GLY FFF N   
2050 C CA  . GLY B 66  ? 0.643 0.618 0.685 0.106  -0.022 -0.031 66  GLY FFF CA  
2051 C C   . GLY B 66  ? 0.640 0.603 0.642 0.094  -0.060 -0.061 66  GLY FFF C   
2052 O O   . GLY B 66  ? 0.717 0.701 0.666 0.052  -0.052 0.003  66  GLY FFF O   
2053 N N   . ARG B 67  ? 0.619 0.563 0.529 0.136  -0.043 -0.014 67  ARG FFF N   
2054 C CA  . ARG B 67  ? 0.633 0.573 0.466 0.137  -0.032 -0.006 67  ARG FFF CA  
2055 C C   . ARG B 67  ? 0.630 0.538 0.355 0.143  -0.006 0.030  67  ARG FFF C   
2056 O O   . ARG B 67  ? 0.700 0.611 0.329 0.204  0.016  -0.051 67  ARG FFF O   
2057 C CB  . ARG B 67  ? 0.675 0.555 0.443 0.153  0.016  0.003  67  ARG FFF CB  
2058 C CG  . ARG B 67  ? 0.709 0.533 0.496 0.156  0.018  0.024  67  ARG FFF CG  
2059 C CD  . ARG B 67  ? 0.715 0.522 0.506 0.156  0.019  0.011  67  ARG FFF CD  
2060 N NE  . ARG B 67  ? 0.652 0.505 0.443 0.123  0.087  0.025  67  ARG FFF NE  
2061 C CZ  . ARG B 67  ? 0.675 0.527 0.454 0.122  0.064  0.006  67  ARG FFF CZ  
2062 N NH1 . ARG B 67  ? 0.697 0.476 0.458 0.142  0.053  0.036  67  ARG FFF NH1 
2063 N NH2 . ARG B 67  ? 0.678 0.490 0.428 0.128  0.091  0.006  67  ARG FFF NH2 
2064 N N   . PHE B 68  ? 0.562 0.498 0.386 0.131  -0.005 0.038  68  PHE FFF N   
2065 C CA  . PHE B 68  ? 0.517 0.458 0.350 0.106  0.057  0.037  68  PHE FFF CA  
2066 C C   . PHE B 68  ? 0.519 0.463 0.353 0.087  0.025  0.002  68  PHE FFF C   
2067 O O   . PHE B 68  ? 0.547 0.439 0.405 0.080  0.033  0.013  68  PHE FFF O   
2068 C CB  . PHE B 68  ? 0.563 0.437 0.366 0.091  0.029  0.029  68  PHE FFF CB  
2069 C CG  . PHE B 68  ? 0.557 0.452 0.369 0.072  0.035  0.050  68  PHE FFF CG  
2070 C CD1 . PHE B 68  ? 0.568 0.412 0.366 0.091  0.039  0.025  68  PHE FFF CD1 
2071 C CD2 . PHE B 68  ? 0.560 0.434 0.375 0.065  0.034  0.021  68  PHE FFF CD2 
2072 C CE1 . PHE B 68  ? 0.556 0.417 0.372 0.070  0.031  0.065  68  PHE FFF CE1 
2073 C CE2 . PHE B 68  ? 0.576 0.437 0.386 0.069  0.053  0.027  68  PHE FFF CE2 
2074 C CZ  . PHE B 68  ? 0.565 0.425 0.416 0.084  0.029  0.017  68  PHE FFF CZ  
2075 N N   . THR B 69  ? 0.557 0.445 0.281 0.089  0.030  0.002  69  THR FFF N   
2076 C CA  . THR B 69  ? 0.539 0.432 0.281 0.062  0.010  -0.002 69  THR FFF CA  
2077 C C   . THR B 69  ? 0.502 0.409 0.284 0.034  0.021  0.002  69  THR FFF C   
2078 O O   . THR B 69  ? 0.500 0.393 0.315 0.028  0.016  0.024  69  THR FFF O   
2079 C CB  . THR B 69  ? 0.606 0.484 0.302 0.082  -0.037 -0.038 69  THR FFF CB  
2080 O OG1 . THR B 69  ? 0.664 0.499 0.307 0.081  -0.067 0.012  69  THR FFF OG1 
2081 C CG2 . THR B 69  ? 0.631 0.500 0.277 0.082  -0.011 -0.022 69  THR FFF CG2 
2082 N N   . ILE B 70  ? 0.488 0.398 0.248 0.065  0.018  -0.029 70  ILE FFF N   
2083 C CA  . ILE B 70  ? 0.497 0.420 0.235 0.054  0.007  -0.016 70  ILE FFF CA  
2084 C C   . ILE B 70  ? 0.490 0.425 0.243 0.050  0.001  -0.019 70  ILE FFF C   
2085 O O   . ILE B 70  ? 0.491 0.467 0.297 0.069  -0.021 -0.027 70  ILE FFF O   
2086 C CB  . ILE B 70  ? 0.498 0.403 0.231 0.037  0.004  -0.005 70  ILE FFF CB  
2087 C CG1 . ILE B 70  ? 0.510 0.424 0.239 0.026  -0.003 0.007  70  ILE FFF CG1 
2088 C CG2 . ILE B 70  ? 0.500 0.403 0.276 0.043  0.008  0.007  70  ILE FFF CG2 
2089 C CD1 . ILE B 70  ? 0.502 0.415 0.227 0.011  0.024  0.008  70  ILE FFF CD1 
2090 N N   . SER B 71  ? 0.502 0.430 0.271 0.052  -0.002 0.003  71  SER FFF N   
2091 C CA  . SER B 71  ? 0.481 0.431 0.268 0.061  0.021  -0.007 71  SER FFF CA  
2092 C C   . SER B 71  ? 0.483 0.405 0.284 0.033  0.014  -0.003 71  SER FFF C   
2093 O O   . SER B 71  ? 0.452 0.397 0.287 0.056  0.034  -0.023 71  SER FFF O   
2094 C CB  . SER B 71  ? 0.480 0.443 0.280 0.058  0.025  0.019  71  SER FFF CB  
2095 O OG  . SER B 71  ? 0.546 0.423 0.210 0.036  0.038  0.017  71  SER FFF OG  
2096 N N   . ARG B 72  ? 0.470 0.420 0.239 0.046  0.015  -0.029 72  ARG FFF N   
2097 C CA  . ARG B 72  ? 0.459 0.419 0.272 0.039  0.022  -0.020 72  ARG FFF CA  
2098 C C   . ARG B 72  ? 0.451 0.413 0.267 0.048  0.032  -0.004 72  ARG FFF C   
2099 O O   . ARG B 72  ? 0.459 0.376 0.290 0.035  0.044  -0.002 72  ARG FFF O   
2100 C CB  . ARG B 72  ? 0.452 0.428 0.242 0.041  0.014  -0.040 72  ARG FFF CB  
2101 C CG  . ARG B 72  ? 0.507 0.425 0.245 0.037  -0.011 -0.009 72  ARG FFF CG  
2102 C CD  . ARG B 72  ? 0.489 0.435 0.252 0.033  -0.015 -0.007 72  ARG FFF CD  
2103 N NE  . ARG B 72  ? 0.520 0.461 0.267 -0.003 0.016  -0.012 72  ARG FFF NE  
2104 C CZ  . ARG B 72  ? 0.500 0.459 0.305 0.005  -0.003 -0.005 72  ARG FFF CZ  
2105 N NH1 . ARG B 72  ? 0.558 0.477 0.286 0.020  -0.005 -0.018 72  ARG FFF NH1 
2106 N NH2 . ARG B 72  ? 0.500 0.454 0.279 0.002  0.017  0.004  72  ARG FFF NH2 
2107 N N   . ASP B 73  ? 0.457 0.467 0.311 0.070  0.018  -0.019 73  ASP FFF N   
2108 C CA  . ASP B 73  ? 0.484 0.483 0.324 0.080  0.049  -0.022 73  ASP FFF CA  
2109 C C   . ASP B 73  ? 0.491 0.422 0.363 0.080  0.065  -0.006 73  ASP FFF C   
2110 O O   . ASP B 73  ? 0.493 0.482 0.346 0.070  0.039  -0.015 73  ASP FFF O   
2111 C CB  . ASP B 73  ? 0.571 0.514 0.305 0.092  0.083  -0.024 73  ASP FFF CB  
2112 C CG  . ASP B 73  ? 0.618 0.579 0.333 0.151  0.127  -0.011 73  ASP FFF CG  
2113 O OD1 . ASP B 73  ? 0.722 0.550 0.372 0.149  0.115  -0.046 73  ASP FFF OD1 
2114 O OD2 . ASP B 73  ? 0.787 0.713 0.334 0.241  0.145  0.020  73  ASP FFF OD2 
2115 N N   . LYS B 74  ? 0.521 0.423 0.371 0.061  0.082  -0.012 74  LYS FFF N   
2116 C CA  . LYS B 74  ? 0.558 0.443 0.431 0.070  0.050  0.012  74  LYS FFF CA  
2117 C C   . LYS B 74  ? 0.554 0.499 0.446 0.058  0.061  0.028  74  LYS FFF C   
2118 O O   . LYS B 74  ? 0.621 0.524 0.393 0.089  0.058  0.064  74  LYS FFF O   
2119 C CB  . LYS B 74  ? 0.597 0.500 0.473 0.004  0.034  0.001  74  LYS FFF CB  
2120 C CG  . LYS B 74  ? 0.625 0.565 0.512 0.007  0.059  -0.034 74  LYS FFF CG  
2121 C CD  . LYS B 74  ? 0.692 0.599 0.616 -0.027 0.075  0.016  74  LYS FFF CD  
2122 C CE  . LYS B 74  ? 0.621 0.596 0.676 0.001  0.077  0.030  74  LYS FFF CE  
2123 N NZ  . LYS B 74  ? 0.582 0.639 0.665 -0.040 0.091  -0.020 74  LYS FFF NZ  
2124 N N   . ALA B 75  ? 0.591 0.570 0.447 0.094  0.040  0.030  75  ALA FFF N   
2125 C CA  . ALA B 75  ? 0.619 0.578 0.460 0.112  0.067  0.045  75  ALA FFF CA  
2126 C C   . ALA B 75  ? 0.566 0.550 0.459 0.144  0.067  0.036  75  ALA FFF C   
2127 O O   . ALA B 75  ? 0.568 0.539 0.505 0.151  0.072  0.083  75  ALA FFF O   
2128 C CB  . ALA B 75  ? 0.649 0.621 0.467 0.117  0.056  0.027  75  ALA FFF CB  
2129 N N   . LYS B 76  ? 0.603 0.528 0.424 0.119  0.142  0.047  76  LYS FFF N   
2130 C CA  . LYS B 76  ? 0.578 0.532 0.432 0.123  0.145  0.072  76  LYS FFF CA  
2131 C C   . LYS B 76  ? 0.513 0.459 0.441 0.060  0.078  0.075  76  LYS FFF C   
2132 O O   . LYS B 76  ? 0.494 0.526 0.481 0.006  0.096  0.067  76  LYS FFF O   
2133 C CB  . LYS B 76  ? 0.681 0.591 0.456 0.144  0.144  0.122  76  LYS FFF CB  
2134 C CG  . LYS B 76  ? 0.760 0.651 0.470 0.218  0.148  0.081  76  LYS FFF CG  
2135 C CD  . LYS B 76  ? 0.811 0.724 0.464 0.249  0.148  0.123  76  LYS FFF CD  
2136 C CE  . LYS B 76  ? 0.856 0.802 0.471 0.279  0.213  0.176  76  LYS FFF CE  
2137 N NZ  . LYS B 76  ? 0.869 0.904 0.507 0.365  0.253  0.141  76  LYS FFF NZ  
2138 N N   . ASN B 77  ? 0.494 0.468 0.431 0.039  0.066  0.047  77  ASN FFF N   
2139 C CA  . ASN B 77  ? 0.520 0.478 0.383 0.064  0.052  0.089  77  ASN FFF CA  
2140 C C   . ASN B 77  ? 0.467 0.476 0.392 0.025  0.019  0.069  77  ASN FFF C   
2141 O O   . ASN B 77  ? 0.443 0.497 0.434 0.036  0.006  0.052  77  ASN FFF O   
2142 C CB  . ASN B 77  ? 0.561 0.566 0.480 0.079  -0.000 0.066  77  ASN FFF CB  
2143 C CG  . ASN B 77  ? 0.678 0.610 0.548 0.133  0.005  0.134  77  ASN FFF CG  
2144 O OD1 . ASN B 77  ? 0.827 0.816 0.541 0.101  0.094  0.119  77  ASN FFF OD1 
2145 N ND2 . ASN B 77  ? 0.755 0.699 0.630 0.180  0.031  0.113  77  ASN FFF ND2 
2146 N N   . THR B 78  ? 0.444 0.447 0.328 0.029  0.045  0.043  78  THR FFF N   
2147 C CA  . THR B 78  ? 0.457 0.439 0.357 0.007  0.050  0.051  78  THR FFF CA  
2148 C C   . THR B 78  ? 0.463 0.398 0.332 -0.003 0.047  0.029  78  THR FFF C   
2149 O O   . THR B 78  ? 0.424 0.443 0.298 0.020  0.023  -0.001 78  THR FFF O   
2150 C CB  . THR B 78  ? 0.486 0.494 0.369 0.025  0.058  0.069  78  THR FFF CB  
2151 O OG1 . THR B 78  ? 0.485 0.565 0.382 0.034  0.058  0.022  78  THR FFF OG1 
2152 C CG2 . THR B 78  ? 0.506 0.501 0.374 0.031  0.010  0.069  78  THR FFF CG2 
2153 N N   . VAL B 79  ? 0.447 0.416 0.311 0.018  0.034  0.024  79  VAL FFF N   
2154 C CA  . VAL B 79  ? 0.461 0.403 0.286 0.023  0.043  -0.004 79  VAL FFF CA  
2155 C C   . VAL B 79  ? 0.428 0.403 0.275 0.006  0.039  -0.000 79  VAL FFF C   
2156 O O   . VAL B 79  ? 0.470 0.418 0.302 -0.019 0.011  0.022  79  VAL FFF O   
2157 C CB  . VAL B 79  ? 0.462 0.406 0.288 0.008  0.052  -0.009 79  VAL FFF CB  
2158 C CG1 . VAL B 79  ? 0.481 0.403 0.313 0.015  0.058  -0.032 79  VAL FFF CG1 
2159 C CG2 . VAL B 79  ? 0.466 0.392 0.259 0.005  0.057  -0.028 79  VAL FFF CG2 
2160 N N   . TYR B 80  ? 0.470 0.396 0.262 0.019  0.021  -0.001 80  TYR FFF N   
2161 C CA  . TYR B 80  ? 0.478 0.374 0.275 0.022  0.032  0.003  80  TYR FFF CA  
2162 C C   . TYR B 80  ? 0.487 0.380 0.289 0.006  0.059  -0.011 80  TYR FFF C   
2163 O O   . TYR B 80  ? 0.463 0.382 0.326 0.025  0.062  0.017  80  TYR FFF O   
2164 C CB  . TYR B 80  ? 0.523 0.384 0.256 0.061  0.048  0.012  80  TYR FFF CB  
2165 C CG  . TYR B 80  ? 0.528 0.455 0.263 0.100  0.050  0.010  80  TYR FFF CG  
2166 C CD1 . TYR B 80  ? 0.571 0.505 0.273 0.076  0.051  0.043  80  TYR FFF CD1 
2167 C CD2 . TYR B 80  ? 0.579 0.473 0.344 0.081  0.057  -0.018 80  TYR FFF CD2 
2168 C CE1 . TYR B 80  ? 0.581 0.531 0.272 0.098  0.045  0.057  80  TYR FFF CE1 
2169 C CE2 . TYR B 80  ? 0.579 0.539 0.375 0.108  0.057  -0.028 80  TYR FFF CE2 
2170 C CZ  . TYR B 80  ? 0.615 0.546 0.313 0.105  0.074  -0.015 80  TYR FFF CZ  
2171 O OH  . TYR B 80  ? 0.603 0.625 0.304 0.125  0.042  -0.053 80  TYR FFF OH  
2172 N N   . LEU B 81  ? 0.506 0.395 0.273 0.020  0.028  0.003  81  LEU FFF N   
2173 C CA  . LEU B 81  ? 0.508 0.375 0.279 0.035  0.031  0.058  81  LEU FFF CA  
2174 C C   . LEU B 81  ? 0.534 0.387 0.239 0.034  0.036  0.031  81  LEU FFF C   
2175 O O   . LEU B 81  ? 0.499 0.402 0.242 0.057  0.092  0.009  81  LEU FFF O   
2176 C CB  . LEU B 81  ? 0.532 0.419 0.302 0.048  0.046  0.038  81  LEU FFF CB  
2177 C CG  . LEU B 81  ? 0.533 0.444 0.237 0.041  0.054  0.027  81  LEU FFF CG  
2178 C CD1 . LEU B 81  ? 0.551 0.451 0.217 0.039  0.067  0.016  81  LEU FFF CD1 
2179 C CD2 . LEU B 81  ? 0.574 0.459 0.268 0.051  0.051  0.001  81  LEU FFF CD2 
2180 N N   . GLN B 82  ? 0.551 0.376 0.279 0.060  0.017  0.042  82  GLN FFF N   
2181 C CA  . GLN B 82  ? 0.573 0.391 0.286 0.060  0.009  0.053  82  GLN FFF CA  
2182 C C   . GLN B 82  ? 0.571 0.407 0.347 0.059  0.006  0.012  82  GLN FFF C   
2183 O O   . GLN B 82  ? 0.605 0.402 0.382 0.078  0.037  0.039  82  GLN FFF O   
2184 C CB  . GLN B 82  ? 0.590 0.403 0.239 0.043  0.031  0.055  82  GLN FFF CB  
2185 C CG  . GLN B 82  ? 0.601 0.423 0.251 0.079  0.010  0.055  82  GLN FFF CG  
2186 C CD  . GLN B 82  ? 0.600 0.462 0.232 0.130  0.050  0.044  82  GLN FFF CD  
2187 O OE1 . GLN B 82  ? 0.637 0.551 0.298 0.194  0.113  0.077  82  GLN FFF OE1 
2188 N NE2 . GLN B 82  ? 0.637 0.476 0.292 0.151  0.124  0.071  82  GLN FFF NE2 
2189 N N   . MET B 83  ? 0.577 0.397 0.342 0.088  0.006  0.016  83  MET FFF N   
2190 C CA  . MET B 83  ? 0.589 0.394 0.357 0.098  0.025  0.015  83  MET FFF CA  
2191 C C   . MET B 83  ? 0.612 0.434 0.360 0.089  -0.004 0.006  83  MET FFF C   
2192 O O   . MET B 83  ? 0.747 0.455 0.395 0.101  0.033  0.077  83  MET FFF O   
2193 C CB  . MET B 83  ? 0.599 0.406 0.351 0.085  0.036  0.003  83  MET FFF CB  
2194 C CG  . MET B 83  ? 0.612 0.408 0.326 0.088  0.022  -0.020 83  MET FFF CG  
2195 S SD  . MET B 83  ? 0.698 0.450 0.367 0.038  0.015  -0.044 83  MET FFF SD  
2196 C CE  . MET B 83  ? 0.652 0.461 0.356 0.004  0.059  -0.036 83  MET FFF CE  
2197 N N   . ASN B 84  ? 0.607 0.455 0.417 0.098  -0.005 0.035  84  ASN FFF N   
2198 C CA  . ASN B 84  ? 0.699 0.497 0.402 0.135  -0.016 0.044  84  ASN FFF CA  
2199 C C   . ASN B 84  ? 0.714 0.508 0.421 0.143  -0.011 0.039  84  ASN FFF C   
2200 O O   . ASN B 84  ? 0.738 0.581 0.425 0.175  0.037  0.068  84  ASN FFF O   
2201 C CB  . ASN B 84  ? 0.778 0.507 0.421 0.140  -0.035 0.011  84  ASN FFF CB  
2202 C CG  . ASN B 84  ? 0.794 0.515 0.481 0.165  -0.036 0.019  84  ASN FFF CG  
2203 O OD1 . ASN B 84  ? 0.895 0.503 0.376 0.168  -0.032 0.059  84  ASN FFF OD1 
2204 N ND2 . ASN B 84  ? 0.810 0.504 0.539 0.187  -0.028 0.033  84  ASN FFF ND2 
2205 N N   . SER B 85  ? 0.720 0.485 0.480 0.130  -0.006 0.066  85  SER FFF N   
2206 C CA  . SER B 85  ? 0.718 0.531 0.487 0.134  0.024  0.012  85  SER FFF CA  
2207 C C   . SER B 85  ? 0.687 0.490 0.442 0.152  0.026  0.048  85  SER FFF C   
2208 O O   . SER B 85  ? 0.750 0.532 0.453 0.124  0.046  -0.027 85  SER FFF O   
2209 C CB  . SER B 85  ? 0.741 0.548 0.524 0.100  0.014  0.012  85  SER FFF CB  
2210 O OG  . SER B 85  ? 0.776 0.581 0.625 0.104  -0.022 -0.049 85  SER FFF OG  
2211 N N   . LEU B 86  ? 0.704 0.478 0.435 0.161  0.043  0.012  86  LEU FFF N   
2212 C CA  . LEU B 86  ? 0.724 0.490 0.424 0.153  0.036  0.025  86  LEU FFF CA  
2213 C C   . LEU B 86  ? 0.759 0.505 0.466 0.168  0.065  0.004  86  LEU FFF C   
2214 O O   . LEU B 86  ? 0.754 0.473 0.450 0.181  0.151  0.038  86  LEU FFF O   
2215 C CB  . LEU B 86  ? 0.735 0.487 0.366 0.155  0.041  0.012  86  LEU FFF CB  
2216 C CG  . LEU B 86  ? 0.727 0.474 0.448 0.142  0.041  -0.002 86  LEU FFF CG  
2217 C CD1 . LEU B 86  ? 0.748 0.477 0.452 0.100  0.049  0.004  86  LEU FFF CD1 
2218 C CD2 . LEU B 86  ? 0.738 0.496 0.456 0.135  0.036  0.010  86  LEU FFF CD2 
2219 N N   . LYS B 87  ? 0.814 0.548 0.480 0.177  0.150  0.000  87  LYS FFF N   
2220 C CA  . LYS B 87  ? 0.818 0.539 0.561 0.177  0.139  -0.029 87  LYS FFF CA  
2221 C C   . LYS B 87  ? 0.792 0.490 0.499 0.171  0.153  -0.023 87  LYS FFF C   
2222 O O   . LYS B 87  ? 0.771 0.455 0.435 0.148  0.153  -0.039 87  LYS FFF O   
2223 C CB  . LYS B 87  ? 0.861 0.640 0.618 0.218  0.237  -0.095 87  LYS FFF CB  
2224 C CG  . LYS B 87  ? 0.876 0.651 0.763 0.224  0.229  -0.073 87  LYS FFF CG  
2225 C CD  . LYS B 87  ? 0.934 0.756 0.832 0.211  0.278  0.013  87  LYS FFF CD  
2226 C CE  . LYS B 87  ? 0.947 0.832 0.858 0.195  0.329  0.065  87  LYS FFF CE  
2227 N NZ  . LYS B 87  ? 0.933 0.878 1.061 0.201  0.352  0.053  87  LYS FFF NZ  
2228 N N   . TYR B 88  ? 0.857 0.486 0.533 0.151  0.093  -0.025 88  TYR FFF N   
2229 C CA  . TYR B 88  ? 0.910 0.511 0.607 0.091  0.119  -0.090 88  TYR FFF CA  
2230 C C   . TYR B 88  ? 0.882 0.443 0.624 0.085  0.121  -0.093 88  TYR FFF C   
2231 O O   . TYR B 88  ? 0.921 0.459 0.606 0.075  0.130  -0.083 88  TYR FFF O   
2232 C CB  . TYR B 88  ? 0.933 0.544 0.739 0.117  0.131  -0.141 88  TYR FFF CB  
2233 C CG  . TYR B 88  ? 1.095 0.725 0.932 -0.033 0.104  -0.184 88  TYR FFF CG  
2234 C CD1 . TYR B 88  ? 1.184 0.894 0.975 -0.157 0.129  -0.176 88  TYR FFF CD1 
2235 C CD2 . TYR B 88  ? 1.201 0.891 0.945 -0.108 0.078  -0.241 88  TYR FFF CD2 
2236 C CE1 . TYR B 88  ? 1.249 0.954 1.032 -0.179 0.107  -0.243 88  TYR FFF CE1 
2237 C CE2 . TYR B 88  ? 1.301 0.924 0.958 -0.149 0.062  -0.282 88  TYR FFF CE2 
2238 C CZ  . TYR B 88  ? 1.289 0.965 0.984 -0.211 0.018  -0.283 88  TYR FFF CZ  
2239 O OH  . TYR B 88  ? 1.346 0.993 0.978 -0.210 -0.017 -0.316 88  TYR FFF OH  
2240 N N   . GLU B 89  ? 0.845 0.489 0.567 0.128  0.140  -0.079 89  GLU FFF N   
2241 C CA  . GLU B 89  ? 0.870 0.584 0.561 0.149  0.121  -0.058 89  GLU FFF CA  
2242 C C   . GLU B 89  ? 0.781 0.550 0.365 0.114  0.139  -0.045 89  GLU FFF C   
2243 O O   . GLU B 89  ? 0.799 0.602 0.303 0.087  0.193  -0.053 89  GLU FFF O   
2244 C CB  . GLU B 89  ? 0.879 0.748 0.623 0.182  0.143  -0.046 89  GLU FFF CB  
2245 C CG  . GLU B 89  ? 0.951 0.818 0.697 0.248  0.111  -0.046 89  GLU FFF CG  
2246 C CD  . GLU B 89  ? 0.997 0.831 0.647 0.315  0.127  -0.089 89  GLU FFF CD  
2247 O OE1 . GLU B 89  ? 0.910 0.771 0.623 0.364  0.158  -0.077 89  GLU FFF OE1 
2248 O OE2 . GLU B 89  ? 1.118 0.894 0.894 0.372  0.104  -0.209 89  GLU FFF OE2 
2249 N N   . ASP B 90  ? 0.750 0.491 0.380 0.120  0.094  -0.078 90  ASP FFF N   
2250 C CA  . ASP B 90  ? 0.762 0.431 0.407 0.081  0.103  -0.055 90  ASP FFF CA  
2251 C C   . ASP B 90  ? 0.769 0.405 0.363 0.065  0.113  -0.060 90  ASP FFF C   
2252 O O   . ASP B 90  ? 0.762 0.452 0.363 0.067  0.118  -0.015 90  ASP FFF O   
2253 C CB  . ASP B 90  ? 0.713 0.446 0.409 0.083  0.079  -0.054 90  ASP FFF CB  
2254 C CG  . ASP B 90  ? 0.727 0.459 0.434 0.068  0.079  -0.013 90  ASP FFF CG  
2255 O OD1 . ASP B 90  ? 0.672 0.485 0.396 0.066  0.066  -0.016 90  ASP FFF OD1 
2256 O OD2 . ASP B 90  ? 0.733 0.494 0.411 0.113  0.099  -0.022 90  ASP FFF OD2 
2257 N N   . THR B 91  ? 0.761 0.398 0.392 0.066  0.143  -0.022 91  THR FFF N   
2258 C CA  . THR B 91  ? 0.774 0.416 0.390 0.048  0.133  -0.044 91  THR FFF CA  
2259 C C   . THR B 91  ? 0.804 0.421 0.422 0.050  0.121  -0.021 91  THR FFF C   
2260 O O   . THR B 91  ? 0.896 0.441 0.428 0.045  0.140  -0.043 91  THR FFF O   
2261 C CB  . THR B 91  ? 0.803 0.429 0.431 0.030  0.121  -0.033 91  THR FFF CB  
2262 O OG1 . THR B 91  ? 0.788 0.403 0.434 0.081  0.121  -0.040 91  THR FFF OG1 
2263 C CG2 . THR B 91  ? 0.820 0.422 0.405 -0.005 0.111  -0.049 91  THR FFF CG2 
2264 N N   . ALA B 92  ? 0.767 0.415 0.400 0.017  0.119  -0.046 92  ALA FFF N   
2265 C CA  . ALA B 92  ? 0.747 0.406 0.411 -0.014 0.093  -0.075 92  ALA FFF CA  
2266 C C   . ALA B 92  ? 0.706 0.428 0.393 -0.033 0.085  -0.071 92  ALA FFF C   
2267 O O   . ALA B 92  ? 0.702 0.422 0.355 -0.034 0.055  -0.057 92  ALA FFF O   
2268 C CB  . ALA B 92  ? 0.769 0.409 0.387 -0.008 0.119  -0.065 92  ALA FFF CB  
2269 N N   . VAL B 93  ? 0.687 0.450 0.405 -0.034 0.059  -0.085 93  VAL FFF N   
2270 C CA  . VAL B 93  ? 0.672 0.427 0.488 -0.048 0.101  -0.042 93  VAL FFF CA  
2271 C C   . VAL B 93  ? 0.617 0.429 0.421 -0.030 0.097  -0.051 93  VAL FFF C   
2272 O O   . VAL B 93  ? 0.659 0.415 0.358 -0.036 0.099  -0.023 93  VAL FFF O   
2273 C CB  . VAL B 93  ? 0.710 0.496 0.529 -0.040 0.064  -0.031 93  VAL FFF CB  
2274 C CG1 . VAL B 93  ? 0.715 0.517 0.551 -0.051 0.059  0.000  93  VAL FFF CG1 
2275 C CG2 . VAL B 93  ? 0.744 0.536 0.616 -0.057 0.077  -0.046 93  VAL FFF CG2 
2276 N N   . TYR B 94  ? 0.644 0.412 0.329 -0.036 0.071  -0.024 94  TYR FFF N   
2277 C CA  . TYR B 94  ? 0.612 0.426 0.383 -0.046 0.076  -0.001 94  TYR FFF CA  
2278 C C   . TYR B 94  ? 0.594 0.459 0.347 -0.057 0.044  0.023  94  TYR FFF C   
2279 O O   . TYR B 94  ? 0.604 0.451 0.455 -0.053 0.091  0.024  94  TYR FFF O   
2280 C CB  . TYR B 94  ? 0.593 0.401 0.362 -0.030 0.070  0.008  94  TYR FFF CB  
2281 C CG  . TYR B 94  ? 0.590 0.417 0.334 -0.023 0.096  -0.032 94  TYR FFF CG  
2282 C CD1 . TYR B 94  ? 0.620 0.416 0.322 -0.002 0.081  -0.020 94  TYR FFF CD1 
2283 C CD2 . TYR B 94  ? 0.586 0.410 0.276 -0.022 0.085  -0.054 94  TYR FFF CD2 
2284 C CE1 . TYR B 94  ? 0.613 0.429 0.288 -0.007 0.065  -0.052 94  TYR FFF CE1 
2285 C CE2 . TYR B 94  ? 0.605 0.406 0.334 -0.004 0.070  -0.035 94  TYR FFF CE2 
2286 C CZ  . TYR B 94  ? 0.615 0.410 0.302 -0.009 0.062  -0.015 94  TYR FFF CZ  
2287 O OH  . TYR B 94  ? 0.617 0.423 0.345 0.013  0.075  -0.029 94  TYR FFF OH  
2288 N N   . TYR B 95  ? 0.587 0.444 0.318 -0.082 0.048  -0.011 95  TYR FFF N   
2289 C CA  . TYR B 95  ? 0.591 0.476 0.324 -0.061 0.045  -0.015 95  TYR FFF CA  
2290 C C   . TYR B 95  ? 0.538 0.472 0.308 -0.054 0.040  -0.011 95  TYR FFF C   
2291 O O   . TYR B 95  ? 0.531 0.451 0.330 -0.070 0.029  -0.003 95  TYR FFF O   
2292 C CB  . TYR B 95  ? 0.586 0.485 0.317 -0.083 0.010  -0.009 95  TYR FFF CB  
2293 C CG  . TYR B 95  ? 0.617 0.479 0.386 -0.101 0.013  0.002  95  TYR FFF CG  
2294 C CD1 . TYR B 95  ? 0.666 0.497 0.420 -0.077 0.019  0.007  95  TYR FFF CD1 
2295 C CD2 . TYR B 95  ? 0.613 0.518 0.484 -0.132 0.039  -0.002 95  TYR FFF CD2 
2296 C CE1 . TYR B 95  ? 0.694 0.536 0.442 -0.120 0.001  0.002  95  TYR FFF CE1 
2297 C CE2 . TYR B 95  ? 0.688 0.532 0.482 -0.126 -0.009 -0.025 95  TYR FFF CE2 
2298 C CZ  . TYR B 95  ? 0.697 0.538 0.478 -0.125 0.008  -0.023 95  TYR FFF CZ  
2299 O OH  . TYR B 95  ? 0.758 0.596 0.567 -0.208 -0.024 -0.024 95  TYR FFF OH  
2300 N N   . CYS B 96  ? 0.563 0.506 0.281 -0.032 0.072  0.056  96  CYS FFF N   
2301 C CA  . CYS B 96  ? 0.614 0.514 0.317 -0.037 0.017  0.046  96  CYS FFF CA  
2302 C C   . CYS B 96  ? 0.502 0.481 0.336 -0.064 -0.020 0.032  96  CYS FFF C   
2303 O O   . CYS B 96  ? 0.523 0.477 0.315 -0.073 -0.024 0.041  96  CYS FFF O   
2304 C CB  . CYS B 96  ? 0.726 0.720 0.284 -0.009 0.059  0.048  96  CYS FFF CB  
2305 S SG  . CYS B 96  ? 0.777 0.885 0.443 0.213  0.067  0.010  96  CYS FFF SG  
2306 N N   . ALA B 97  ? 0.514 0.468 0.344 -0.061 -0.012 0.032  97  ALA FFF N   
2307 C CA  . ALA B 97  ? 0.491 0.464 0.354 -0.037 -0.023 0.036  97  ALA FFF CA  
2308 C C   . ALA B 97  ? 0.479 0.469 0.326 -0.035 -0.032 0.038  97  ALA FFF C   
2309 O O   . ALA B 97  ? 0.473 0.433 0.284 -0.064 -0.007 0.059  97  ALA FFF O   
2310 C CB  . ALA B 97  ? 0.560 0.484 0.348 -0.031 0.005  0.021  97  ALA FFF CB  
2311 N N   . ARG B 98  ? 0.518 0.499 0.275 -0.028 -0.049 0.034  98  ARG FFF N   
2312 C CA  . ARG B 98  ? 0.494 0.498 0.264 -0.047 -0.020 0.043  98  ARG FFF CA  
2313 C C   . ARG B 98  ? 0.479 0.436 0.278 -0.050 -0.025 0.044  98  ARG FFF C   
2314 O O   . ARG B 98  ? 0.528 0.493 0.253 -0.058 -0.032 0.038  98  ARG FFF O   
2315 C CB  . ARG B 98  ? 0.551 0.578 0.355 -0.024 0.049  0.058  98  ARG FFF CB  
2316 C CG  . ARG B 98  ? 0.557 0.576 0.396 -0.005 0.064  0.103  98  ARG FFF CG  
2317 C CD  . ARG B 98  ? 0.559 0.654 0.468 0.024  0.099  0.122  98  ARG FFF CD  
2318 N NE  . ARG B 98  ? 0.552 0.684 0.537 0.018  0.087  0.128  98  ARG FFF NE  
2319 C CZ  . ARG B 98  ? 0.590 0.634 0.493 0.054  0.099  0.113  98  ARG FFF CZ  
2320 N NH1 . ARG B 98  ? 0.718 0.665 0.623 0.028  0.019  0.097  98  ARG FFF NH1 
2321 N NH2 . ARG B 98  ? 0.626 0.621 0.708 -0.032 0.034  0.072  98  ARG FFF NH2 
2322 N N   . THR B 99  ? 0.456 0.486 0.317 -0.079 -0.019 0.031  99  THR FFF N   
2323 C CA  . THR B 99  ? 0.484 0.483 0.322 -0.078 -0.025 0.052  99  THR FFF CA  
2324 C C   . THR B 99  ? 0.462 0.504 0.314 -0.030 -0.040 0.037  99  THR FFF C   
2325 O O   . THR B 99  ? 0.479 0.450 0.315 -0.067 -0.023 0.026  99  THR FFF O   
2326 C CB  . THR B 99  ? 0.486 0.512 0.335 -0.063 -0.026 0.072  99  THR FFF CB  
2327 O OG1 . THR B 99  ? 0.590 0.500 0.285 -0.102 0.013  0.032  99  THR FFF OG1 
2328 C CG2 . THR B 99  ? 0.453 0.481 0.360 -0.081 0.001  0.066  99  THR FFF CG2 
2329 N N   . GLU B 100 ? 0.468 0.535 0.281 -0.045 -0.085 0.030  100 GLU FFF N   
2330 C CA  A GLU B 100 ? 0.490 0.539 0.325 -0.033 -0.053 0.026  100 GLU FFF CA  
2331 C CA  B GLU B 100 ? 0.473 0.543 0.323 -0.020 -0.052 0.013  100 GLU FFF CA  
2332 C C   . GLU B 100 ? 0.447 0.485 0.318 -0.020 -0.070 0.010  100 GLU FFF C   
2333 O O   . GLU B 100 ? 0.479 0.480 0.290 -0.006 -0.053 0.009  100 GLU FFF O   
2334 C CB  A GLU B 100 ? 0.514 0.587 0.400 -0.025 -0.082 0.057  100 GLU FFF CB  
2335 C CB  B GLU B 100 ? 0.491 0.604 0.396 0.003  -0.074 0.025  100 GLU FFF CB  
2336 C CG  A GLU B 100 ? 0.558 0.604 0.451 -0.064 -0.066 0.061  100 GLU FFF CG  
2337 C CG  B GLU B 100 ? 0.508 0.649 0.425 -0.006 -0.057 -0.007 100 GLU FFF CG  
2338 C CD  A GLU B 100 ? 0.588 0.600 0.488 -0.069 -0.107 0.090  100 GLU FFF CD  
2339 C CD  B GLU B 100 ? 0.514 0.669 0.459 0.000  -0.087 -0.032 100 GLU FFF CD  
2340 O OE1 A GLU B 100 ? 0.591 0.479 0.494 -0.143 -0.142 0.048  100 GLU FFF OE1 
2341 O OE1 B GLU B 100 ? 0.567 0.757 0.478 0.004  -0.178 0.011  100 GLU FFF OE1 
2342 O OE2 A GLU B 100 ? 0.659 0.609 0.481 -0.056 -0.094 0.203  100 GLU FFF OE2 
2343 O OE2 B GLU B 100 ? 0.466 0.715 0.429 0.007  -0.067 -0.092 100 GLU FFF OE2 
2344 N N   . TYR B 101 ? 0.438 0.461 0.259 -0.039 -0.057 0.018  101 TYR FFF N   
2345 C CA  . TYR B 101 ? 0.453 0.407 0.303 -0.029 -0.031 0.023  101 TYR FFF CA  
2346 C C   . TYR B 101 ? 0.443 0.391 0.299 -0.016 -0.008 0.019  101 TYR FFF C   
2347 O O   . TYR B 101 ? 0.464 0.409 0.273 -0.015 -0.027 0.030  101 TYR FFF O   
2348 C CB  . TYR B 101 ? 0.519 0.407 0.284 -0.036 -0.036 0.025  101 TYR FFF CB  
2349 C CG  . TYR B 101 ? 0.529 0.397 0.305 -0.040 -0.039 -0.005 101 TYR FFF CG  
2350 C CD1 . TYR B 101 ? 0.571 0.421 0.298 -0.059 -0.027 -0.008 101 TYR FFF CD1 
2351 C CD2 . TYR B 101 ? 0.552 0.417 0.321 -0.026 -0.052 0.005  101 TYR FFF CD2 
2352 C CE1 . TYR B 101 ? 0.598 0.426 0.329 -0.055 0.003  0.030  101 TYR FFF CE1 
2353 C CE2 . TYR B 101 ? 0.582 0.423 0.319 -0.042 -0.032 -0.016 101 TYR FFF CE2 
2354 C CZ  . TYR B 101 ? 0.586 0.432 0.309 -0.045 -0.019 -0.007 101 TYR FFF CZ  
2355 O OH  . TYR B 101 ? 0.639 0.455 0.392 -0.057 0.052  -0.011 101 TYR FFF OH  
2356 N N   . VAL B 102 ? 0.423 0.396 0.226 -0.017 0.034  0.019  102 VAL FFF N   
2357 C CA  . VAL B 102 ? 0.438 0.378 0.262 -0.029 0.012  0.021  102 VAL FFF CA  
2358 C C   . VAL B 102 ? 0.440 0.367 0.296 0.003  -0.001 -0.008 102 VAL FFF C   
2359 O O   . VAL B 102 ? 0.440 0.389 0.291 -0.023 0.012  0.001  102 VAL FFF O   
2360 C CB  . VAL B 102 ? 0.408 0.385 0.267 -0.016 0.011  0.021  102 VAL FFF CB  
2361 C CG1 . VAL B 102 ? 0.420 0.423 0.230 -0.009 0.007  -0.011 102 VAL FFF CG1 
2362 C CG2 . VAL B 102 ? 0.409 0.415 0.232 -0.024 0.007  0.022  102 VAL FFF CG2 
2363 N N   . SER B 103 ? 0.455 0.359 0.293 0.016  -0.002 -0.019 103 SER FFF N   
2364 C CA  . SER B 103 ? 0.465 0.418 0.278 0.004  0.020  -0.018 103 SER FFF CA  
2365 C C   . SER B 103 ? 0.425 0.376 0.303 -0.006 0.045  -0.016 103 SER FFF C   
2366 O O   . SER B 103 ? 0.469 0.440 0.294 0.011  0.043  0.000  103 SER FFF O   
2367 C CB  . SER B 103 ? 0.466 0.407 0.324 0.006  -0.003 -0.014 103 SER FFF CB  
2368 O OG  . SER B 103 ? 0.483 0.438 0.308 0.024  0.030  -0.051 103 SER FFF OG  
2369 N N   . TYR B 104 ? 0.454 0.370 0.301 -0.003 0.055  0.013  104 TYR FFF N   
2370 C CA  . TYR B 104 ? 0.432 0.406 0.345 -0.012 0.048  0.006  104 TYR FFF CA  
2371 C C   . TYR B 104 ? 0.419 0.421 0.292 0.001  0.060  0.001  104 TYR FFF C   
2372 O O   . TYR B 104 ? 0.413 0.400 0.320 -0.017 0.028  0.013  104 TYR FFF O   
2373 C CB  . TYR B 104 ? 0.418 0.408 0.308 -0.000 0.047  0.002  104 TYR FFF CB  
2374 C CG  . TYR B 104 ? 0.435 0.452 0.365 0.015  0.061  -0.019 104 TYR FFF CG  
2375 C CD1 . TYR B 104 ? 0.413 0.437 0.370 -0.012 0.073  -0.006 104 TYR FFF CD1 
2376 C CD2 . TYR B 104 ? 0.464 0.480 0.349 0.035  0.076  -0.019 104 TYR FFF CD2 
2377 C CE1 . TYR B 104 ? 0.454 0.462 0.393 0.024  0.071  -0.016 104 TYR FFF CE1 
2378 C CE2 . TYR B 104 ? 0.465 0.468 0.332 0.037  0.083  -0.011 104 TYR FFF CE2 
2379 C CZ  . TYR B 104 ? 0.462 0.497 0.390 0.029  0.084  -0.036 104 TYR FFF CZ  
2380 O OH  . TYR B 104 ? 0.520 0.585 0.439 0.095  0.092  -0.064 104 TYR FFF OH  
2381 N N   . LEU B 105 ? 0.464 0.450 0.308 0.006  0.059  -0.009 105 LEU FFF N   
2382 C CA  . LEU B 105 ? 0.452 0.452 0.307 0.023  0.077  -0.018 105 LEU FFF CA  
2383 C C   . LEU B 105 ? 0.441 0.460 0.307 0.026  0.061  0.007  105 LEU FFF C   
2384 O O   . LEU B 105 ? 0.476 0.450 0.320 0.024  0.060  -0.015 105 LEU FFF O   
2385 C CB  . LEU B 105 ? 0.472 0.450 0.334 0.018  0.122  -0.015 105 LEU FFF CB  
2386 C CG  . LEU B 105 ? 0.494 0.485 0.395 0.035  0.124  -0.004 105 LEU FFF CG  
2387 C CD1 . LEU B 105 ? 0.541 0.525 0.416 0.033  0.090  -0.002 105 LEU FFF CD1 
2388 C CD2 . LEU B 105 ? 0.577 0.512 0.413 0.014  0.165  -0.012 105 LEU FFF CD2 
2389 N N   . LEU B 106 ? 0.444 0.439 0.309 0.043  0.043  -0.001 106 LEU FFF N   
2390 C CA  . LEU B 106 ? 0.443 0.433 0.318 0.040  0.037  0.008  106 LEU FFF CA  
2391 C C   . LEU B 106 ? 0.430 0.430 0.301 0.031  0.026  0.017  106 LEU FFF C   
2392 O O   . LEU B 106 ? 0.441 0.430 0.291 0.012  0.045  -0.007 106 LEU FFF O   
2393 C CB  . LEU B 106 ? 0.456 0.381 0.303 0.037  0.038  -0.006 106 LEU FFF CB  
2394 C CG  . LEU B 106 ? 0.488 0.409 0.339 0.014  0.050  0.002  106 LEU FFF CG  
2395 C CD1 . LEU B 106 ? 0.470 0.441 0.289 0.014  0.058  0.004  106 LEU FFF CD1 
2396 C CD2 . LEU B 106 ? 0.511 0.454 0.355 -0.005 0.028  -0.002 106 LEU FFF CD2 
2397 N N   . SER B 107 ? 0.485 0.431 0.295 0.058  0.056  0.021  107 SER FFF N   
2398 C CA  . SER B 107 ? 0.494 0.430 0.324 0.044  0.064  0.013  107 SER FFF CA  
2399 C C   . SER B 107 ? 0.487 0.424 0.341 0.046  0.055  0.012  107 SER FFF C   
2400 O O   . SER B 107 ? 0.520 0.416 0.301 0.062  0.104  -0.018 107 SER FFF O   
2401 C CB  . SER B 107 ? 0.498 0.405 0.372 0.074  0.069  0.042  107 SER FFF CB  
2402 O OG  . SER B 107 ? 0.509 0.489 0.343 0.069  0.122  0.044  107 SER FFF OG  
2403 N N   . ASP B 108 ? 0.478 0.394 0.323 0.045  0.076  -0.010 108 ASP FFF N   
2404 C CA  . ASP B 108 ? 0.550 0.447 0.295 0.026  0.054  -0.017 108 ASP FFF CA  
2405 C C   . ASP B 108 ? 0.569 0.447 0.288 0.007  0.043  0.003  108 ASP FFF C   
2406 O O   . ASP B 108 ? 0.620 0.459 0.263 -0.017 0.098  -0.034 108 ASP FFF O   
2407 C CB  . ASP B 108 ? 0.575 0.408 0.359 0.013  0.048  -0.031 108 ASP FFF CB  
2408 C CG  . ASP B 108 ? 0.594 0.436 0.345 0.023  0.054  -0.019 108 ASP FFF CG  
2409 O OD1 . ASP B 108 ? 0.604 0.460 0.308 0.007  0.107  0.020  108 ASP FFF OD1 
2410 O OD2 . ASP B 108 ? 0.609 0.449 0.330 0.009  0.092  0.009  108 ASP FFF OD2 
2411 N N   . TYR B 109 ? 0.512 0.423 0.321 0.031  0.069  0.011  109 TYR FFF N   
2412 C CA  . TYR B 109 ? 0.519 0.398 0.279 0.014  0.052  -0.002 109 TYR FFF CA  
2413 C C   . TYR B 109 ? 0.516 0.405 0.338 0.022  0.048  -0.006 109 TYR FFF C   
2414 O O   . TYR B 109 ? 0.528 0.426 0.349 -0.013 0.045  -0.037 109 TYR FFF O   
2415 C CB  . TYR B 109 ? 0.500 0.404 0.273 0.013  0.066  0.011  109 TYR FFF CB  
2416 C CG  . TYR B 109 ? 0.451 0.404 0.293 0.005  0.045  0.024  109 TYR FFF CG  
2417 C CD1 . TYR B 109 ? 0.459 0.396 0.291 0.015  0.028  0.003  109 TYR FFF CD1 
2418 C CD2 . TYR B 109 ? 0.478 0.417 0.280 0.019  0.035  -0.001 109 TYR FFF CD2 
2419 C CE1 . TYR B 109 ? 0.469 0.393 0.255 0.005  0.004  0.011  109 TYR FFF CE1 
2420 C CE2 . TYR B 109 ? 0.452 0.391 0.308 -0.011 0.027  0.004  109 TYR FFF CE2 
2421 C CZ  . TYR B 109 ? 0.462 0.379 0.261 0.002  0.027  0.015  109 TYR FFF CZ  
2422 O OH  . TYR B 109 ? 0.439 0.381 0.283 -0.005 0.014  0.026  109 TYR FFF OH  
2423 N N   . ALA B 110 ? 0.542 0.434 0.321 0.034  0.078  -0.022 110 ALA FFF N   
2424 C CA  . ALA B 110 ? 0.598 0.425 0.311 0.006  0.098  -0.007 110 ALA FFF CA  
2425 C C   . ALA B 110 ? 0.668 0.408 0.352 -0.002 0.072  -0.024 110 ALA FFF C   
2426 O O   . ALA B 110 ? 0.747 0.393 0.413 -0.014 0.106  -0.063 110 ALA FFF O   
2427 C CB  . ALA B 110 ? 0.593 0.469 0.357 0.018  0.109  -0.032 110 ALA FFF CB  
2428 N N   . THR B 111 ? 0.670 0.421 0.296 -0.004 0.098  -0.047 111 THR FFF N   
2429 C CA  . THR B 111 ? 0.730 0.509 0.310 0.010  0.074  -0.075 111 THR FFF CA  
2430 C C   . THR B 111 ? 0.710 0.529 0.284 -0.002 0.040  -0.099 111 THR FFF C   
2431 O O   . THR B 111 ? 0.785 0.493 0.285 -0.050 0.018  -0.062 111 THR FFF O   
2432 C CB  . THR B 111 ? 0.757 0.537 0.351 0.004  0.114  -0.040 111 THR FFF CB  
2433 O OG1 . THR B 111 ? 0.771 0.527 0.383 0.028  0.169  0.013  111 THR FFF OG1 
2434 C CG2 . THR B 111 ? 0.808 0.563 0.393 0.024  0.097  -0.029 111 THR FFF CG2 
2435 N N   . TRP B 112 ? 0.702 0.528 0.298 0.006  0.005  -0.102 112 TRP FFF N   
2436 C CA  . TRP B 112 ? 0.752 0.561 0.396 0.031  -0.032 -0.085 112 TRP FFF CA  
2437 C C   . TRP B 112 ? 0.763 0.575 0.381 0.018  0.011  -0.022 112 TRP FFF C   
2438 O O   . TRP B 112 ? 0.785 0.598 0.366 0.021  0.057  -0.010 112 TRP FFF O   
2439 C CB  . TRP B 112 ? 0.827 0.574 0.472 0.038  -0.086 -0.116 112 TRP FFF CB  
2440 C CG  . TRP B 112 ? 0.883 0.552 0.611 0.084  -0.120 -0.162 112 TRP FFF CG  
2441 C CD1 . TRP B 112 ? 0.887 0.659 0.661 0.064  -0.135 -0.140 112 TRP FFF CD1 
2442 C CD2 . TRP B 112 ? 0.947 0.531 0.568 0.066  -0.206 -0.191 112 TRP FFF CD2 
2443 N NE1 . TRP B 112 ? 0.998 0.591 0.655 0.059  -0.171 -0.155 112 TRP FFF NE1 
2444 C CE2 . TRP B 112 ? 0.941 0.547 0.648 0.054  -0.183 -0.188 112 TRP FFF CE2 
2445 C CE3 . TRP B 112 ? 0.958 0.524 0.682 0.076  -0.182 -0.167 112 TRP FFF CE3 
2446 C CZ2 . TRP B 112 ? 0.933 0.548 0.658 0.054  -0.232 -0.171 112 TRP FFF CZ2 
2447 C CZ3 . TRP B 112 ? 0.988 0.585 0.745 0.074  -0.199 -0.122 112 TRP FFF CZ3 
2448 C CH2 . TRP B 112 ? 0.959 0.573 0.753 0.063  -0.206 -0.136 112 TRP FFF CH2 
2449 N N   . PRO B 113 ? 0.795 0.627 0.334 0.010  0.019  -0.042 113 PRO FFF N   
2450 C CA  . PRO B 113 ? 0.829 0.696 0.407 -0.019 -0.008 0.025  113 PRO FFF CA  
2451 C C   . PRO B 113 ? 0.806 0.745 0.405 -0.040 0.061  0.104  113 PRO FFF C   
2452 O O   . PRO B 113 ? 0.925 0.804 0.510 0.054  0.019  0.130  113 PRO FFF O   
2453 C CB  . PRO B 113 ? 0.844 0.661 0.422 -0.063 -0.064 0.025  113 PRO FFF CB  
2454 C CG  . PRO B 113 ? 0.835 0.706 0.360 -0.035 -0.012 0.034  113 PRO FFF CG  
2455 C CD  . PRO B 113 ? 0.820 0.653 0.369 -0.023 -0.005 -0.011 113 PRO FFF CD  
2456 N N   . TYR B 114 ? 0.791 0.742 0.330 -0.006 -0.008 0.112  114 TYR FFF N   
2457 C CA  . TYR B 114 ? 0.721 0.736 0.382 -0.036 -0.004 0.117  114 TYR FFF CA  
2458 C C   . TYR B 114 ? 0.768 0.803 0.445 -0.057 -0.090 0.043  114 TYR FFF C   
2459 O O   . TYR B 114 ? 0.880 0.817 0.327 -0.105 0.007  0.027  114 TYR FFF O   
2460 C CB  . TYR B 114 ? 0.608 0.705 0.382 -0.032 0.005  0.139  114 TYR FFF CB  
2461 C CG  . TYR B 114 ? 0.569 0.646 0.388 -0.032 0.052  0.129  114 TYR FFF CG  
2462 C CD1 . TYR B 114 ? 0.546 0.670 0.397 -0.049 0.056  0.133  114 TYR FFF CD1 
2463 C CD2 . TYR B 114 ? 0.557 0.593 0.512 -0.028 0.011  0.074  114 TYR FFF CD2 
2464 C CE1 . TYR B 114 ? 0.548 0.652 0.388 -0.020 0.040  0.102  114 TYR FFF CE1 
2465 C CE2 . TYR B 114 ? 0.547 0.599 0.532 -0.022 0.027  0.043  114 TYR FFF CE2 
2466 C CZ  . TYR B 114 ? 0.534 0.515 0.552 -0.021 0.021  0.039  114 TYR FFF CZ  
2467 O OH  . TYR B 114 ? 0.540 0.490 0.615 -0.043 0.005  0.042  114 TYR FFF OH  
2468 N N   . ASP B 115 ? 0.725 0.777 0.425 -0.073 -0.055 0.079  115 ASP FFF N   
2469 C CA  . ASP B 115 ? 0.690 0.869 0.579 -0.122 -0.045 0.074  115 ASP FFF CA  
2470 C C   . ASP B 115 ? 0.646 0.787 0.443 -0.144 -0.147 0.057  115 ASP FFF C   
2471 O O   . ASP B 115 ? 0.646 0.835 0.380 -0.143 -0.149 0.042  115 ASP FFF O   
2472 C CB  . ASP B 115 ? 0.826 0.887 0.685 -0.121 -0.044 0.122  115 ASP FFF CB  
2473 C CG  . ASP B 115 ? 0.899 1.016 0.651 -0.177 0.016  0.074  115 ASP FFF CG  
2474 O OD1 . ASP B 115 ? 1.021 1.111 0.679 -0.052 0.128  0.122  115 ASP FFF OD1 
2475 O OD2 . ASP B 115 ? 0.856 1.217 0.389 -0.327 -0.251 0.136  115 ASP FFF OD2 
2476 N N   . TYR B 116 ? 0.588 0.683 0.448 -0.078 -0.087 0.124  116 TYR FFF N   
2477 C CA  . TYR B 116 ? 0.571 0.624 0.449 -0.065 -0.090 0.112  116 TYR FFF CA  
2478 C C   . TYR B 116 ? 0.504 0.597 0.425 -0.077 -0.061 0.091  116 TYR FFF C   
2479 O O   . TYR B 116 ? 0.522 0.570 0.367 -0.090 -0.088 0.037  116 TYR FFF O   
2480 C CB  . TYR B 116 ? 0.665 0.661 0.493 -0.026 -0.075 0.108  116 TYR FFF CB  
2481 C CG  . TYR B 116 ? 0.797 0.731 0.538 0.005  -0.129 0.145  116 TYR FFF CG  
2482 C CD1 . TYR B 116 ? 0.780 0.810 0.687 0.020  -0.152 0.160  116 TYR FFF CD1 
2483 C CD2 . TYR B 116 ? 0.828 0.753 0.656 -0.019 -0.157 0.149  116 TYR FFF CD2 
2484 C CE1 . TYR B 116 ? 0.888 0.846 0.714 0.016  -0.139 0.219  116 TYR FFF CE1 
2485 C CE2 . TYR B 116 ? 0.902 0.817 0.683 -0.019 -0.140 0.208  116 TYR FFF CE2 
2486 C CZ  . TYR B 116 ? 0.893 0.883 0.764 -0.003 -0.165 0.210  116 TYR FFF CZ  
2487 O OH  . TYR B 116 ? 0.986 0.935 0.864 0.003  -0.202 0.258  116 TYR FFF OH  
2488 N N   . TRP B 117 ? 0.536 0.554 0.414 -0.084 -0.051 0.018  117 TRP FFF N   
2489 C CA  . TRP B 117 ? 0.574 0.588 0.425 -0.067 -0.032 0.038  117 TRP FFF CA  
2490 C C   . TRP B 117 ? 0.535 0.545 0.454 -0.075 -0.043 0.046  117 TRP FFF C   
2491 O O   . TRP B 117 ? 0.524 0.537 0.558 -0.154 -0.082 0.052  117 TRP FFF O   
2492 C CB  . TRP B 117 ? 0.612 0.602 0.467 -0.040 -0.029 0.007  117 TRP FFF CB  
2493 C CG  . TRP B 117 ? 0.651 0.658 0.393 -0.057 -0.035 0.005  117 TRP FFF CG  
2494 C CD1 . TRP B 117 ? 0.692 0.713 0.424 -0.032 -0.022 0.036  117 TRP FFF CD1 
2495 C CD2 . TRP B 117 ? 0.652 0.599 0.405 -0.047 -0.031 -0.004 117 TRP FFF CD2 
2496 N NE1 . TRP B 117 ? 0.688 0.743 0.391 -0.029 -0.035 0.080  117 TRP FFF NE1 
2497 C CE2 . TRP B 117 ? 0.657 0.651 0.351 -0.049 -0.060 -0.031 117 TRP FFF CE2 
2498 C CE3 . TRP B 117 ? 0.665 0.558 0.376 -0.064 0.015  0.012  117 TRP FFF CE3 
2499 C CZ2 . TRP B 117 ? 0.635 0.651 0.424 -0.085 -0.020 -0.019 117 TRP FFF CZ2 
2500 C CZ3 . TRP B 117 ? 0.668 0.522 0.401 -0.054 0.004  0.004  117 TRP FFF CZ3 
2501 C CH2 . TRP B 117 ? 0.671 0.591 0.431 -0.077 0.017  0.008  117 TRP FFF CH2 
2502 N N   . GLY B 118 ? 0.540 0.518 0.413 -0.088 -0.047 0.002  118 GLY FFF N   
2503 C CA  . GLY B 118 ? 0.579 0.512 0.472 -0.099 -0.032 0.036  118 GLY FFF CA  
2504 C C   . GLY B 118 ? 0.583 0.538 0.511 -0.096 -0.002 -0.004 118 GLY FFF C   
2505 O O   . GLY B 118 ? 0.628 0.519 0.406 -0.073 -0.076 -0.028 118 GLY FFF O   
2506 N N   . GLN B 119 ? 0.586 0.560 0.573 -0.108 0.025  0.010  119 GLN FFF N   
2507 C CA  . GLN B 119 ? 0.647 0.536 0.685 -0.100 0.012  0.009  119 GLN FFF CA  
2508 C C   . GLN B 119 ? 0.611 0.530 0.633 -0.108 0.029  -0.006 119 GLN FFF C   
2509 O O   . GLN B 119 ? 0.736 0.479 0.637 -0.147 0.070  0.033  119 GLN FFF O   
2510 C CB  . GLN B 119 ? 0.646 0.583 0.751 -0.116 0.024  -0.010 119 GLN FFF CB  
2511 C CG  . GLN B 119 ? 0.713 0.726 0.864 -0.076 -0.052 0.030  119 GLN FFF CG  
2512 C CD  . GLN B 119 ? 0.854 0.896 0.889 -0.103 -0.089 -0.022 119 GLN FFF CD  
2513 O OE1 . GLN B 119 ? 1.028 1.008 1.120 -0.004 -0.087 0.126  119 GLN FFF OE1 
2514 N NE2 . GLN B 119 ? 0.899 1.040 0.757 -0.113 -0.167 -0.099 119 GLN FFF NE2 
2515 N N   . GLY B 120 ? 0.614 0.476 0.549 -0.085 0.059  0.008  120 GLY FFF N   
2516 C CA  . GLY B 120 ? 0.630 0.511 0.534 -0.051 0.095  0.039  120 GLY FFF CA  
2517 C C   . GLY B 120 ? 0.600 0.512 0.565 -0.063 0.091  0.064  120 GLY FFF C   
2518 O O   . GLY B 120 ? 0.624 0.556 0.672 -0.100 0.126  0.109  120 GLY FFF O   
2519 N N   . THR B 121 ? 0.680 0.491 0.489 -0.042 0.073  0.075  121 THR FFF N   
2520 C CA  . THR B 121 ? 0.643 0.485 0.483 -0.034 0.082  0.048  121 THR FFF CA  
2521 C C   . THR B 121 ? 0.644 0.458 0.401 -0.039 0.085  0.036  121 THR FFF C   
2522 O O   . THR B 121 ? 0.644 0.434 0.384 -0.048 0.072  -0.022 121 THR FFF O   
2523 C CB  . THR B 121 ? 0.711 0.525 0.525 0.008  0.086  -0.002 121 THR FFF CB  
2524 O OG1 . THR B 121 ? 0.724 0.524 0.682 0.004  0.068  -0.028 121 THR FFF OG1 
2525 C CG2 . THR B 121 ? 0.715 0.488 0.479 0.041  0.066  -0.044 121 THR FFF CG2 
2526 N N   . GLN B 122 ? 0.675 0.444 0.421 -0.038 0.065  0.039  122 GLN FFF N   
2527 C CA  . GLN B 122 ? 0.682 0.467 0.432 -0.005 0.087  0.012  122 GLN FFF CA  
2528 C C   . GLN B 122 ? 0.635 0.428 0.452 -0.026 0.114  -0.015 122 GLN FFF C   
2529 O O   . GLN B 122 ? 0.683 0.453 0.464 -0.003 0.125  -0.047 122 GLN FFF O   
2530 C CB  . GLN B 122 ? 0.713 0.487 0.505 -0.028 0.072  0.044  122 GLN FFF CB  
2531 C CG  . GLN B 122 ? 0.753 0.497 0.515 -0.002 0.102  0.040  122 GLN FFF CG  
2532 C CD  . GLN B 122 ? 0.760 0.466 0.460 -0.012 0.064  0.046  122 GLN FFF CD  
2533 O OE1 . GLN B 122 ? 0.861 0.510 0.431 -0.031 0.089  -0.040 122 GLN FFF OE1 
2534 N NE2 . GLN B 122 ? 0.756 0.445 0.468 0.017  0.085  0.059  122 GLN FFF NE2 
2535 N N   . VAL B 123 ? 0.627 0.391 0.371 -0.001 0.098  0.007  123 VAL FFF N   
2536 C CA  . VAL B 123 ? 0.663 0.426 0.339 0.008  0.116  0.012  123 VAL FFF CA  
2537 C C   . VAL B 123 ? 0.757 0.391 0.384 -0.012 0.116  -0.011 123 VAL FFF C   
2538 O O   . VAL B 123 ? 0.846 0.384 0.372 -0.037 0.141  -0.002 123 VAL FFF O   
2539 C CB  . VAL B 123 ? 0.664 0.407 0.324 0.019  0.110  0.010  123 VAL FFF CB  
2540 C CG1 . VAL B 123 ? 0.706 0.390 0.365 0.021  0.087  0.001  123 VAL FFF CG1 
2541 C CG2 . VAL B 123 ? 0.646 0.417 0.359 0.028  0.106  0.003  123 VAL FFF CG2 
2542 N N   . THR B 124 ? 0.841 0.409 0.381 -0.027 0.165  -0.016 124 THR FFF N   
2543 C CA  . THR B 124 ? 0.842 0.432 0.394 0.021  0.138  0.009  124 THR FFF CA  
2544 C C   . THR B 124 ? 0.815 0.426 0.413 0.045  0.145  0.003  124 THR FFF C   
2545 O O   . THR B 124 ? 0.924 0.448 0.392 0.109  0.141  0.008  124 THR FFF O   
2546 C CB  . THR B 124 ? 0.832 0.461 0.441 0.011  0.129  0.017  124 THR FFF CB  
2547 O OG1 . THR B 124 ? 0.859 0.441 0.466 -0.030 0.075  0.014  124 THR FFF OG1 
2548 C CG2 . THR B 124 ? 0.864 0.455 0.504 0.007  0.125  -0.008 124 THR FFF CG2 
2549 N N   . VAL B 125 ? 0.792 0.383 0.394 0.056  0.126  -0.004 125 VAL FFF N   
2550 C CA  . VAL B 125 ? 0.814 0.417 0.406 0.078  0.114  -0.002 125 VAL FFF CA  
2551 C C   . VAL B 125 ? 0.913 0.406 0.427 0.089  0.155  -0.035 125 VAL FFF C   
2552 O O   . VAL B 125 ? 0.999 0.441 0.421 0.134  0.145  -0.054 125 VAL FFF O   
2553 C CB  . VAL B 125 ? 0.772 0.422 0.418 0.095  0.094  0.007  125 VAL FFF CB  
2554 C CG1 . VAL B 125 ? 0.777 0.440 0.437 0.076  0.076  -0.033 125 VAL FFF CG1 
2555 C CG2 . VAL B 125 ? 0.789 0.430 0.389 0.072  0.093  0.008  125 VAL FFF CG2 
2556 N N   . SER B 126 ? 1.016 0.450 0.463 0.082  0.094  0.050  126 SER FFF N   
2557 C CA  . SER B 126 ? 1.086 0.445 0.610 0.110  0.129  0.049  126 SER FFF CA  
2558 C C   . SER B 126 ? 1.154 0.455 0.620 0.140  0.077  0.077  126 SER FFF C   
2559 O O   . SER B 126 ? 1.168 0.413 0.651 0.191  0.096  0.001  126 SER FFF O   
2560 C CB  . SER B 126 ? 1.115 0.526 0.602 0.070  0.141  0.040  126 SER FFF CB  
2561 O OG  . SER B 126 ? 1.105 0.466 0.679 0.077  0.240  0.070  126 SER FFF OG  
2562 N N   . SER B 127 ? 1.315 0.442 0.778 0.188  0.088  0.025  127 SER FFF N   
2563 C CA  . SER B 127 ? 1.368 0.530 0.842 0.228  0.057  0.001  127 SER FFF CA  
2564 C C   . SER B 127 ? 1.399 0.639 0.672 0.199  0.094  0.113  127 SER FFF C   
2565 O O   . SER B 127 ? 1.512 0.668 0.637 0.219  0.150  0.159  127 SER FFF O   
2566 C CB  . SER B 127 ? 1.399 0.523 0.958 0.279  0.042  -0.034 127 SER FFF CB  
2567 O OG  . SER B 127 ? 1.529 0.724 1.000 0.160  0.006  -0.108 127 SER FFF OG  
2568 C C1  . NAG C .   ? 0.603 0.652 0.567 -0.045 -0.199 0.123  601 NAG EEE C1  
2569 C C2  . NAG C .   ? 0.624 0.644 0.595 -0.062 -0.196 0.100  601 NAG EEE C2  
2570 C C3  . NAG C .   ? 0.707 0.702 0.626 -0.051 -0.244 0.140  601 NAG EEE C3  
2571 C C4  . NAG C .   ? 0.755 0.736 0.646 -0.090 -0.280 0.113  601 NAG EEE C4  
2572 C C5  . NAG C .   ? 0.714 0.738 0.646 -0.099 -0.279 0.113  601 NAG EEE C5  
2573 C C6  . NAG C .   ? 0.793 0.762 0.665 -0.179 -0.294 0.102  601 NAG EEE C6  
2574 C C7  . NAG C .   ? 0.532 0.596 0.488 0.000  -0.121 0.084  601 NAG EEE C7  
2575 C C8  . NAG C .   ? 0.543 0.606 0.507 -0.006 -0.094 0.128  601 NAG EEE C8  
2576 N N2  . NAG C .   ? 0.573 0.556 0.526 -0.014 -0.159 0.096  601 NAG EEE N2  
2577 O O3  . NAG C .   ? 0.731 0.740 0.652 0.000  -0.253 0.149  601 NAG EEE O3  
2578 O O4  . NAG C .   ? 0.768 0.744 0.700 -0.063 -0.376 0.112  601 NAG EEE O4  
2579 O O5  . NAG C .   ? 0.629 0.697 0.622 -0.079 -0.226 0.108  601 NAG EEE O5  
2580 O O6  . NAG C .   ? 0.928 0.784 0.717 -0.174 -0.240 0.063  601 NAG EEE O6  
2581 O O7  . NAG C .   ? 0.492 0.562 0.581 -0.050 -0.071 0.091  601 NAG EEE O7  
2582 C C1  . GOL D .   ? 0.806 0.762 0.453 0.034  -0.137 -0.010 602 GOL EEE C1  
2583 O O1  . GOL D .   ? 0.948 0.543 0.331 -0.014 -0.125 0.107  602 GOL EEE O1  
2584 C C2  . GOL D .   ? 0.708 0.873 0.477 0.002  -0.045 -0.141 602 GOL EEE C2  
2585 O O2  . GOL D .   ? 0.683 1.130 0.383 0.006  0.032  -0.244 602 GOL EEE O2  
2586 C C3  . GOL D .   ? 0.766 0.871 0.371 -0.016 0.098  -0.249 602 GOL EEE C3  
2587 O O3  . GOL D .   ? 0.691 0.781 0.482 0.048  0.143  -0.143 602 GOL EEE O3  
2588 C C1  . GOL E .   ? 0.656 0.509 0.359 0.028  -0.020 0.044  603 GOL EEE C1  
2589 O O1  . GOL E .   ? 0.761 0.532 0.406 0.088  -0.034 0.071  603 GOL EEE O1  
2590 C C2  . GOL E .   ? 0.638 0.553 0.332 0.043  -0.011 0.017  603 GOL EEE C2  
2591 O O2  . GOL E .   ? 0.579 0.521 0.408 0.023  -0.015 -0.027 603 GOL EEE O2  
2592 C C3  . GOL E .   ? 0.648 0.600 0.306 0.072  -0.058 -0.010 603 GOL EEE C3  
2593 O O3  . GOL E .   ? 0.583 0.542 0.266 0.092  -0.037 -0.049 603 GOL EEE O3  
2594 C C1  . GOL F .   ? 0.829 0.857 0.403 -0.146 -0.126 0.104  604 GOL EEE C1  
2595 O O1  . GOL F .   ? 0.827 0.888 0.573 -0.091 -0.079 0.149  604 GOL EEE O1  
2596 C C2  . GOL F .   ? 0.869 0.879 0.425 -0.110 -0.063 0.009  604 GOL EEE C2  
2597 O O2  . GOL F .   ? 0.827 0.896 0.710 -0.170 -0.054 -0.013 604 GOL EEE O2  
2598 C C3  . GOL F .   ? 0.807 0.868 0.599 -0.122 -0.081 -0.037 604 GOL EEE C3  
2599 O O3  . GOL F .   ? 0.689 0.866 0.620 -0.137 -0.050 -0.082 604 GOL EEE O3  
2600 N N   . NO3 G .   ? 0.691 0.630 0.660 -0.018 -0.051 -0.063 605 NO3 EEE N   
2601 O O1  . NO3 G .   ? 0.547 0.503 0.373 -0.023 -0.026 0.125  605 NO3 EEE O1  
2602 O O2  . NO3 G .   ? 0.570 0.497 0.419 0.041  -0.024 -0.003 605 NO3 EEE O2  
2603 O O3  . NO3 G .   ? 0.649 0.623 0.633 0.067  0.008  0.128  605 NO3 EEE O3  
2604 N N   . NO3 H .   ? 0.897 0.835 1.013 0.151  0.017  0.076  606 NO3 EEE N   
2605 O O1  . NO3 H .   ? 0.808 0.644 0.873 0.129  -0.147 0.265  606 NO3 EEE O1  
2606 O O2  . NO3 H .   ? 0.853 0.871 1.158 0.034  -0.080 0.102  606 NO3 EEE O2  
2607 O O3  . NO3 H .   ? 0.974 0.953 0.909 0.156  0.040  0.039  606 NO3 EEE O3  
2608 O O   . HOH I .   ? 0.583 0.619 0.435 -0.025 -0.005 -0.003 701 HOH EEE O   
2609 O O   . HOH I .   ? 0.519 0.704 0.587 0.108  0.034  0.116  702 HOH EEE O   
2610 O O   . HOH I .   ? 0.647 0.577 0.499 -0.096 -0.036 0.096  703 HOH EEE O   
2611 O O   . HOH I .   ? 0.638 0.567 0.356 0.093  0.067  0.018  704 HOH EEE O   
2612 O O   . HOH I .   ? 0.544 0.767 0.510 0.079  0.075  -0.022 705 HOH EEE O   
2613 O O   . HOH I .   ? 0.605 0.499 0.271 -0.080 -0.047 0.075  706 HOH EEE O   
2614 O O   . HOH I .   ? 0.492 0.662 0.947 -0.028 0.055  -0.026 707 HOH EEE O   
2615 O O   . HOH I .   ? 0.524 0.746 0.426 0.041  -0.077 -0.044 708 HOH EEE O   
2616 O O   . HOH I .   ? 0.672 1.007 0.828 -0.064 -0.061 -0.272 709 HOH EEE O   
2617 O O   . HOH I .   ? 0.594 0.538 0.341 -0.021 0.034  -0.026 710 HOH EEE O   
2618 O O   . HOH I .   ? 0.647 0.520 0.421 0.088  0.066  0.120  711 HOH EEE O   
2619 O O   . HOH I .   ? 0.751 0.670 0.549 0.178  -0.085 0.010  712 HOH EEE O   
2620 O O   . HOH I .   ? 0.440 0.530 0.574 -0.052 -0.110 0.017  713 HOH EEE O   
2621 O O   . HOH I .   ? 0.467 0.454 0.363 -0.003 -0.029 -0.001 714 HOH EEE O   
2622 O O   . HOH I .   ? 0.867 0.652 0.754 -0.058 -0.070 0.079  715 HOH EEE O   
2623 O O   . HOH I .   ? 0.841 0.560 0.442 -0.119 -0.070 -0.034 716 HOH EEE O   
2624 O O   . HOH I .   ? 1.169 0.534 0.362 -0.140 0.188  0.007  717 HOH EEE O   
2625 O O   . HOH I .   ? 0.635 0.633 0.436 -0.114 -0.134 0.062  718 HOH EEE O   
2626 O O   . HOH I .   ? 0.535 0.518 0.369 -0.021 -0.035 0.051  719 HOH EEE O   
2627 O O   . HOH I .   ? 0.558 0.470 0.461 -0.012 -0.046 0.066  720 HOH EEE O   
2628 O O   . HOH I .   ? 0.724 0.572 0.614 -0.073 -0.098 0.145  721 HOH EEE O   
2629 O O   . HOH I .   ? 0.698 0.675 0.491 -0.293 0.033  -0.005 722 HOH EEE O   
2630 O O   . HOH I .   ? 0.645 0.600 0.403 -0.051 0.024  0.019  723 HOH EEE O   
2631 O O   . HOH I .   ? 0.404 0.374 0.241 0.013  -0.008 0.009  724 HOH EEE O   
2632 O O   . HOH I .   ? 0.631 0.535 0.608 0.089  -0.095 -0.115 725 HOH EEE O   
2633 O O   . HOH I .   ? 1.217 0.593 0.720 -0.126 0.017  -0.077 726 HOH EEE O   
2634 O O   . HOH I .   ? 0.464 0.474 0.341 0.008  0.030  0.002  727 HOH EEE O   
2635 O O   . HOH I .   ? 0.574 0.707 0.529 -0.033 0.108  0.086  728 HOH EEE O   
2636 O O   . HOH I .   ? 0.594 0.953 0.540 -0.163 0.080  -0.012 729 HOH EEE O   
2637 O O   . HOH I .   ? 0.656 0.763 0.667 -0.118 -0.146 0.004  730 HOH EEE O   
2638 O O   . HOH I .   ? 0.926 1.142 0.890 0.104  0.023  0.425  731 HOH EEE O   
2639 O O   . HOH I .   ? 0.524 0.495 0.420 -0.004 0.054  0.124  732 HOH EEE O   
2640 O O   . HOH I .   ? 0.619 0.897 0.822 -0.244 -0.174 -0.040 733 HOH EEE O   
2641 O O   . HOH I .   ? 0.868 1.029 0.755 -0.145 -0.173 -0.048 734 HOH EEE O   
2642 O O   . HOH I .   ? 0.418 0.496 0.436 0.018  0.021  0.040  735 HOH EEE O   
2643 O O   . HOH I .   ? 0.588 0.605 0.425 -0.042 -0.091 0.118  736 HOH EEE O   
2644 O O   . HOH I .   ? 0.656 0.604 0.427 -0.119 -0.000 0.153  737 HOH EEE O   
2645 O O   . HOH I .   ? 0.681 0.548 0.240 -0.080 0.028  0.024  738 HOH EEE O   
2646 O O   . HOH I .   ? 0.460 0.589 0.694 -0.050 -0.052 0.071  739 HOH EEE O   
2647 O O   . HOH I .   ? 0.584 0.515 0.338 0.035  0.093  -0.041 740 HOH EEE O   
2648 O O   . HOH I .   ? 0.664 0.788 0.578 -0.001 0.071  -0.013 741 HOH EEE O   
2649 O O   . HOH I .   ? 0.408 0.429 0.331 -0.018 -0.019 -0.007 742 HOH EEE O   
2650 O O   . HOH I .   ? 0.511 0.472 0.409 -0.041 -0.091 -0.016 743 HOH EEE O   
2651 O O   . HOH I .   ? 1.197 0.522 0.243 0.100  0.005  -0.001 744 HOH EEE O   
2652 O O   . HOH I .   ? 0.502 0.559 0.297 -0.099 -0.010 0.064  745 HOH EEE O   
2653 O O   . HOH I .   ? 0.447 0.505 0.351 -0.023 -0.084 0.010  746 HOH EEE O   
2654 O O   . HOH I .   ? 0.547 0.417 0.231 -0.037 -0.024 0.026  747 HOH EEE O   
2655 O O   . HOH I .   ? 0.411 0.401 0.276 -0.027 -0.007 0.018  748 HOH EEE O   
2656 O O   . HOH I .   ? 0.505 0.588 0.898 0.051  -0.082 0.035  749 HOH EEE O   
2657 O O   . HOH I .   ? 0.482 0.447 0.384 -0.074 -0.043 0.023  750 HOH EEE O   
2658 O O   . HOH I .   ? 0.515 0.413 0.276 -0.086 -0.025 0.049  751 HOH EEE O   
2659 O O   . HOH I .   ? 0.444 0.432 0.345 0.022  -0.025 0.034  752 HOH EEE O   
2660 O O   . HOH I .   ? 0.936 0.976 0.611 -0.117 -0.190 -0.069 753 HOH EEE O   
2661 O O   . HOH I .   ? 0.448 0.482 0.333 -0.027 0.001  0.041  754 HOH EEE O   
2662 O O   . HOH I .   ? 0.548 0.700 0.311 -0.119 0.141  -0.014 755 HOH EEE O   
2663 O O   . HOH I .   ? 0.570 0.725 0.866 0.037  0.092  0.143  756 HOH EEE O   
2664 O O   . HOH I .   ? 0.690 0.600 0.409 -0.126 0.007  0.151  757 HOH EEE O   
2665 O O   . HOH I .   ? 0.472 0.511 0.995 -0.005 -0.159 0.093  758 HOH EEE O   
2666 O O   . HOH I .   ? 0.579 1.093 1.164 0.128  0.065  0.269  759 HOH EEE O   
2667 O O   . HOH I .   ? 0.770 0.679 0.418 -0.239 0.100  0.066  760 HOH EEE O   
2668 O O   . HOH I .   ? 0.466 0.399 0.290 -0.017 -0.044 0.034  761 HOH EEE O   
2669 O O   . HOH I .   ? 0.542 0.429 0.298 0.029  -0.009 -0.026 762 HOH EEE O   
2670 O O   . HOH I .   ? 0.653 0.571 0.377 0.032  0.137  0.042  763 HOH EEE O   
2671 O O   . HOH I .   ? 0.540 0.693 0.818 -0.167 -0.119 -0.005 764 HOH EEE O   
2672 O O   . HOH I .   ? 0.559 0.858 0.600 0.068  -0.015 0.016  765 HOH EEE O   
2673 O O   . HOH I .   ? 0.476 0.455 0.283 -0.054 -0.042 0.042  766 HOH EEE O   
2674 O O   . HOH I .   ? 0.515 0.382 0.270 -0.057 -0.004 0.008  767 HOH EEE O   
2675 O O   . HOH I .   ? 0.768 0.465 0.449 0.059  0.042  -0.024 768 HOH EEE O   
2676 O O   . HOH I .   ? 0.422 0.402 0.253 -0.042 0.015  0.005  769 HOH EEE O   
2677 O O   . HOH I .   ? 0.609 0.603 0.509 -0.016 0.094  -0.126 770 HOH EEE O   
2678 O O   . HOH I .   ? 0.546 0.505 0.411 -0.002 -0.059 0.083  771 HOH EEE O   
2679 O O   . HOH I .   ? 1.452 0.543 0.365 0.103  0.019  -0.023 772 HOH EEE O   
2680 O O   . HOH I .   ? 0.467 0.574 0.450 -0.063 0.076  0.058  773 HOH EEE O   
2681 O O   . HOH I .   ? 0.556 0.761 0.704 -0.191 0.052  0.286  774 HOH EEE O   
2682 O O   . HOH I .   ? 0.552 0.440 0.274 -0.018 0.003  -0.005 775 HOH EEE O   
2683 O O   . HOH I .   ? 0.742 0.655 0.838 -0.096 -0.234 -0.088 776 HOH EEE O   
2684 O O   . HOH I .   ? 0.570 0.678 0.734 0.036  -0.249 -0.053 777 HOH EEE O   
2685 O O   . HOH I .   ? 0.671 0.675 0.664 0.098  0.126  -0.032 778 HOH EEE O   
2686 O O   . HOH I .   ? 0.415 0.731 0.592 -0.121 -0.036 0.068  779 HOH EEE O   
2687 O O   . HOH I .   ? 0.509 0.690 0.721 0.025  0.150  -0.069 780 HOH EEE O   
2688 O O   . HOH I .   ? 0.739 0.741 0.651 0.109  -0.108 0.178  781 HOH EEE O   
2689 O O   . HOH I .   ? 0.750 0.487 0.311 0.092  -0.161 -0.071 782 HOH EEE O   
2690 O O   . HOH I .   ? 0.630 0.475 0.248 -0.052 0.042  0.039  783 HOH EEE O   
2691 O O   . HOH I .   ? 0.721 0.562 0.546 -0.198 0.100  0.075  784 HOH EEE O   
2692 O O   . HOH I .   ? 0.532 0.652 0.855 -0.065 -0.089 0.039  785 HOH EEE O   
2693 O O   . HOH I .   ? 0.567 0.837 0.455 0.006  -0.042 -0.033 786 HOH EEE O   
2694 O O   . HOH I .   ? 0.387 0.501 0.436 0.046  0.020  -0.028 787 HOH EEE O   
2695 O O   . HOH I .   ? 0.624 0.447 0.367 0.011  0.037  0.002  788 HOH EEE O   
2696 O O   . HOH I .   ? 1.149 0.564 0.260 -0.320 -0.089 0.053  789 HOH EEE O   
2697 O O   . HOH I .   ? 0.890 0.688 0.926 -0.258 -0.079 0.053  790 HOH EEE O   
2698 O O   . HOH I .   ? 0.897 0.712 0.353 -0.070 -0.064 -0.085 791 HOH EEE O   
2699 O O   . HOH I .   ? 0.733 0.998 0.808 -0.248 0.044  0.310  792 HOH EEE O   
2700 O O   . HOH I .   ? 0.691 0.756 0.345 -0.067 -0.120 0.143  793 HOH EEE O   
2701 O O   . HOH I .   ? 0.512 0.819 1.310 0.090  -0.078 -0.184 794 HOH EEE O   
2702 O O   . HOH I .   ? 0.531 0.919 0.530 -0.264 -0.151 0.218  795 HOH EEE O   
2703 O O   . HOH I .   ? 0.673 0.551 0.374 -0.136 -0.054 0.135  796 HOH EEE O   
2704 O O   . HOH I .   ? 0.466 0.560 0.358 -0.066 -0.050 -0.083 797 HOH EEE O   
2705 O O   . HOH I .   ? 0.706 0.462 0.318 0.055  -0.080 -0.058 798 HOH EEE O   
2706 O O   . HOH I .   ? 0.644 0.828 0.799 0.250  0.066  0.302  799 HOH EEE O   
2707 O O   . HOH I .   ? 0.892 0.940 0.498 -0.072 0.130  -0.311 800 HOH EEE O   
2708 O O   . HOH I .   ? 0.471 0.536 0.401 -0.022 -0.100 -0.001 801 HOH EEE O   
2709 O O   . HOH I .   ? 1.346 0.601 0.839 -0.161 0.158  -0.093 802 HOH EEE O   
2710 O O   . HOH I .   ? 0.789 0.643 0.641 -0.038 0.107  -0.108 803 HOH EEE O   
2711 O O   . HOH I .   ? 0.600 0.658 0.376 -0.053 0.009  0.121  804 HOH EEE O   
2712 O O   . HOH I .   ? 0.728 0.677 0.489 0.084  0.068  -0.039 805 HOH EEE O   
2713 O O   . HOH I .   ? 0.634 0.704 0.470 0.043  -0.056 0.197  806 HOH EEE O   
2714 O O   . HOH I .   ? 0.624 0.988 0.383 -0.246 -0.049 0.204  807 HOH EEE O   
2715 O O   . HOH I .   ? 0.863 0.888 0.573 0.102  -0.110 -0.117 808 HOH EEE O   
2716 O O   . HOH I .   ? 0.685 0.674 0.780 -0.052 -0.051 -0.309 809 HOH EEE O   
2717 O O   . HOH I .   ? 0.528 0.534 0.391 -0.019 -0.073 0.059  810 HOH EEE O   
2718 O O   . HOH I .   ? 0.544 0.607 0.645 0.083  0.069  -0.005 811 HOH EEE O   
2719 O O   . HOH I .   ? 0.855 0.794 1.257 -0.127 -0.082 0.075  812 HOH EEE O   
2720 O O   . HOH I .   ? 0.693 0.808 0.324 0.065  0.029  -0.048 813 HOH EEE O   
2721 O O   . HOH I .   ? 0.959 1.250 0.722 0.016  0.343  0.213  814 HOH EEE O   
2722 O O   . HOH I .   ? 1.307 0.709 0.285 0.327  -0.039 -0.030 815 HOH EEE O   
2723 O O   . HOH I .   ? 0.708 0.759 0.453 0.058  -0.075 -0.038 816 HOH EEE O   
2724 O O   . HOH I .   ? 0.446 0.484 0.514 -0.035 -0.110 -0.012 817 HOH EEE O   
2725 O O   . HOH I .   ? 0.509 0.518 0.317 -0.003 -0.023 0.044  818 HOH EEE O   
2726 O O   . HOH I .   ? 0.863 0.646 0.610 -0.205 0.069  -0.199 819 HOH EEE O   
2727 O O   . HOH I .   ? 0.604 0.741 0.405 -0.060 -0.080 0.051  820 HOH EEE O   
2728 O O   . HOH I .   ? 0.665 0.674 0.758 -0.067 0.005  0.068  821 HOH EEE O   
2729 O O   . HOH I .   ? 0.684 0.619 0.592 -0.012 0.170  0.098  822 HOH EEE O   
2730 O O   . HOH I .   ? 0.682 0.799 0.509 -0.014 -0.011 -0.179 823 HOH EEE O   
2731 O O   . HOH I .   ? 0.635 0.756 0.578 -0.100 -0.012 0.083  824 HOH EEE O   
2732 O O   . HOH I .   ? 0.650 0.756 0.445 -0.123 0.087  -0.021 825 HOH EEE O   
2733 O O   . HOH I .   ? 0.853 0.806 0.844 0.193  -0.133 -0.178 826 HOH EEE O   
2734 O O   . HOH I .   ? 1.264 1.012 0.525 -0.358 0.131  -0.044 827 HOH EEE O   
2735 O O   . HOH I .   ? 0.863 1.008 1.093 0.093  -0.136 0.368  828 HOH EEE O   
2736 O O   . HOH I .   ? 0.487 0.678 0.549 -0.034 0.091  -0.082 829 HOH EEE O   
2737 O O   . HOH I .   ? 0.838 0.665 1.055 0.089  -0.027 -0.298 830 HOH EEE O   
2738 O O   . HOH I .   ? 0.855 0.771 0.512 -0.099 0.174  -0.068 831 HOH EEE O   
2739 O O   . HOH I .   ? 0.649 0.540 0.474 0.000  0.000  0.126  832 HOH EEE O   
2740 O O   . HOH I .   ? 0.877 0.612 0.509 0.216  -0.030 -0.015 833 HOH EEE O   
2741 O O   . HOH I .   ? 0.629 0.863 0.544 -0.197 -0.020 0.024  834 HOH EEE O   
2742 O O   . HOH I .   ? 0.815 1.078 0.751 -0.205 -0.166 -0.164 835 HOH EEE O   
2743 O O   . HOH I .   ? 0.714 0.730 0.478 -0.104 0.071  0.065  836 HOH EEE O   
2744 O O   . HOH I .   ? 0.566 0.776 0.698 -0.105 0.004  0.085  837 HOH EEE O   
2745 O O   . HOH I .   ? 0.801 0.582 0.448 -0.037 -0.020 0.035  838 HOH EEE O   
2746 O O   . HOH I .   ? 0.529 0.490 0.710 -0.000 0.000  -0.095 839 HOH EEE O   
2747 O O   . HOH I .   ? 1.126 0.680 0.490 -0.151 -0.146 0.107  840 HOH EEE O   
2748 O O   . HOH I .   ? 0.637 0.478 0.358 0.000  0.000  -0.076 841 HOH EEE O   
2749 O O   . HOH I .   ? 0.845 0.756 0.462 -0.087 0.032  0.057  842 HOH EEE O   
2750 O O   . HOH I .   ? 1.253 0.685 0.954 0.012  0.058  0.087  843 HOH EEE O   
2751 O O   . HOH I .   ? 0.766 0.853 0.444 0.035  -0.102 -0.046 844 HOH EEE O   
2752 O O   . HOH I .   ? 0.611 0.572 0.451 0.050  0.252  0.044  845 HOH EEE O   
2753 O O   . HOH I .   ? 0.526 0.455 0.310 0.028  -0.005 -0.027 846 HOH EEE O   
2754 O O   . HOH I .   ? 0.748 0.743 0.600 -0.091 0.182  0.003  847 HOH EEE O   
2755 O O   . HOH J .   ? 0.890 0.816 0.584 0.165  0.340  0.086  201 HOH FFF O   
2756 O O   . HOH J .   ? 0.721 0.801 0.532 -0.109 0.048  -0.004 202 HOH FFF O   
2757 O O   . HOH J .   ? 0.746 0.506 0.340 -0.047 0.032  -0.006 203 HOH FFF O   
2758 O O   . HOH J .   ? 0.663 0.534 0.387 0.063  0.073  0.084  204 HOH FFF O   
2759 O O   . HOH J .   ? 0.907 0.739 0.528 0.183  0.350  0.066  205 HOH FFF O   
2760 O O   . HOH J .   ? 0.962 0.658 0.441 0.121  0.217  -0.005 206 HOH FFF O   
2761 O O   . HOH J .   ? 0.681 0.539 0.359 -0.119 -0.124 0.074  207 HOH FFF O   
2762 O O   . HOH J .   ? 0.587 0.565 0.479 -0.074 -0.045 0.102  208 HOH FFF O   
2763 O O   . HOH J .   ? 1.012 0.511 0.646 0.130  0.316  -0.030 209 HOH FFF O   
2764 O O   . HOH J .   ? 0.683 0.636 0.345 0.030  0.032  0.111  210 HOH FFF O   
2765 O O   . HOH J .   ? 0.757 0.537 0.385 0.099  0.077  -0.045 211 HOH FFF O   
2766 O O   . HOH J .   ? 1.121 0.486 0.712 0.022  0.173  0.094  212 HOH FFF O   
2767 O O   . HOH J .   ? 0.555 0.531 0.310 -0.054 -0.034 -0.000 213 HOH FFF O   
2768 O O   . HOH J .   ? 0.791 0.829 0.656 0.147  0.244  -0.059 214 HOH FFF O   
2769 O O   . HOH J .   ? 0.665 0.549 0.423 -0.048 0.066  0.032  215 HOH FFF O   
2770 O O   . HOH J .   ? 0.629 0.448 0.325 0.065  0.107  0.030  216 HOH FFF O   
2771 O O   . HOH J .   ? 0.762 0.671 0.697 0.166  0.012  0.129  217 HOH FFF O   
2772 O O   . HOH J .   ? 0.567 0.733 0.434 0.005  0.105  -0.042 218 HOH FFF O   
2773 O O   . HOH J .   ? 0.584 0.464 0.433 0.034  0.129  -0.056 219 HOH FFF O   
2774 O O   . HOH J .   ? 0.834 0.536 0.500 0.105  0.149  0.090  220 HOH FFF O   
2775 O O   . HOH J .   ? 1.120 0.830 0.913 0.010  0.165  -0.191 221 HOH FFF O   
2776 O O   . HOH J .   ? 0.781 1.115 0.401 0.297  -0.003 -0.111 222 HOH FFF O   
2777 O O   . HOH J .   ? 0.836 0.797 0.424 -0.188 0.073  -0.052 223 HOH FFF O   
2778 O O   . HOH J .   ? 0.698 0.664 0.467 0.034  0.124  -0.037 224 HOH FFF O   
2779 O O   . HOH J .   ? 0.848 1.084 0.525 -0.312 0.209  -0.131 225 HOH FFF O   
2780 O O   . HOH J .   ? 1.092 0.852 0.764 0.060  0.357  0.035  226 HOH FFF O   
2781 O O   . HOH J .   ? 0.818 0.450 0.486 -0.027 0.263  -0.139 227 HOH FFF O   
2782 O O   . HOH J .   ? 0.684 0.422 0.498 0.049  0.172  0.001  228 HOH FFF O   
2783 O O   . HOH J .   ? 0.579 0.648 1.123 0.017  0.213  0.015  229 HOH FFF O   
2784 O O   . HOH J .   ? 0.674 0.558 0.252 -0.149 -0.024 -0.005 230 HOH FFF O   
2785 O O   . HOH J .   ? 0.577 0.841 0.512 0.190  -0.005 -0.014 231 HOH FFF O   
2786 O O   . HOH J .   ? 0.767 0.803 0.484 0.186  0.289  0.055  232 HOH FFF O   
2787 O O   . HOH J .   ? 0.753 0.562 0.749 -0.118 0.158  0.123  233 HOH FFF O   
2788 O O   . HOH J .   ? 0.799 0.677 0.423 -0.070 -0.030 0.017  234 HOH FFF O   
2789 O O   . HOH J .   ? 0.458 0.445 0.297 0.035  -0.021 -0.055 235 HOH FFF O   
2790 O O   . HOH J .   ? 0.512 0.524 0.478 0.065  -0.096 -0.026 236 HOH FFF O   
2791 O O   . HOH J .   ? 0.828 0.676 0.555 0.174  0.043  -0.114 237 HOH FFF O   
2792 O O   . HOH J .   ? 0.716 0.822 0.573 -0.247 -0.090 0.190  238 HOH FFF O   
2793 O O   . HOH J .   ? 0.501 0.482 0.564 0.041  -0.025 0.052  239 HOH FFF O   
2794 O O   . HOH J .   ? 1.254 0.804 0.578 -0.140 0.053  -0.002 240 HOH FFF O   
2795 O O   . HOH J .   ? 0.456 0.616 0.231 0.071  0.028  0.048  241 HOH FFF O   
2796 O O   . HOH J .   ? 1.054 0.478 0.702 0.211  0.345  -0.021 242 HOH FFF O   
2797 O O   . HOH J .   ? 1.085 0.457 0.404 -0.016 0.041  -0.083 243 HOH FFF O   
2798 O O   . HOH J .   ? 1.069 0.852 0.504 -0.103 0.240  0.026  244 HOH FFF O   
2799 O O   . HOH J .   ? 0.577 0.476 0.472 0.059  -0.020 -0.056 245 HOH FFF O   
2800 O O   . HOH J .   ? 1.033 1.011 0.629 0.410  -0.009 -0.263 246 HOH FFF O   
2801 O O   . HOH J .   ? 1.038 0.995 0.568 -0.346 -0.222 -0.052 247 HOH FFF O   
2802 O O   . HOH J .   ? 0.925 0.663 0.799 0.247  0.176  -0.065 248 HOH FFF O   
2803 O O   . HOH J .   ? 0.606 0.668 0.445 -0.051 -0.006 -0.082 249 HOH FFF O   
2804 O O   . HOH J .   ? 0.473 0.508 0.506 0.089  0.009  -0.055 250 HOH FFF O   
2805 O O   . HOH J .   ? 0.812 0.611 0.326 0.172  0.204  0.194  251 HOH FFF O   
2806 O O   . HOH J .   ? 0.828 0.694 0.559 0.211  -0.182 -0.189 252 HOH FFF O   
2807 O O   . HOH J .   ? 1.436 0.679 0.403 0.265  0.111  0.004  253 HOH FFF O   
2808 O O   . HOH J .   ? 1.136 0.944 0.549 0.028  -0.178 0.110  254 HOH FFF O   
2809 O O   . HOH J .   ? 0.457 0.576 0.473 -0.037 -0.026 0.075  255 HOH FFF O   
2810 O O   . HOH J .   ? 0.809 0.831 0.784 -0.177 -0.001 -0.056 256 HOH FFF O   
2811 O O   . HOH J .   ? 1.095 1.124 0.989 -0.082 -0.376 -0.008 257 HOH FFF O   
2812 O O   . HOH J .   ? 0.625 0.660 1.012 -0.041 -0.265 0.145  258 HOH FFF O   
2813 O O   . HOH J .   ? 0.487 0.751 0.463 0.037  -0.049 -0.124 259 HOH FFF O   
# 
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   PRO 1   330 ?   ?   ?   EEE . n 
A 1 2   ASN 2   331 ?   ?   ?   EEE . n 
A 1 3   ILE 3   332 ?   ?   ?   EEE . n 
A 1 4   THR 4   333 ?   ?   ?   EEE . n 
A 1 5   ASN 5   334 334 ASN ASN EEE . n 
A 1 6   LEU 6   335 335 LEU LEU EEE . n 
A 1 7   CYS 7   336 336 CYS CYS EEE . n 
A 1 8   PRO 8   337 337 PRO PRO EEE . n 
A 1 9   PHE 9   338 338 PHE PHE EEE . n 
A 1 10  GLY 10  339 339 GLY GLY EEE . n 
A 1 11  GLU 11  340 340 GLU GLU EEE . n 
A 1 12  VAL 12  341 341 VAL VAL EEE . n 
A 1 13  PHE 13  342 342 PHE PHE EEE . n 
A 1 14  ASN 14  343 343 ASN ASN EEE . n 
A 1 15  ALA 15  344 344 ALA ALA EEE . n 
A 1 16  THR 16  345 345 THR THR EEE . n 
A 1 17  ARG 17  346 346 ARG ARG EEE . n 
A 1 18  PHE 18  347 347 PHE PHE EEE . n 
A 1 19  ALA 19  348 348 ALA ALA EEE . n 
A 1 20  SER 20  349 349 SER SER EEE . n 
A 1 21  VAL 21  350 350 VAL VAL EEE . n 
A 1 22  TYR 22  351 351 TYR TYR EEE . n 
A 1 23  ALA 23  352 352 ALA ALA EEE . n 
A 1 24  TRP 24  353 353 TRP TRP EEE . n 
A 1 25  ASN 25  354 354 ASN ASN EEE . n 
A 1 26  ARG 26  355 355 ARG ARG EEE . n 
A 1 27  LYS 27  356 356 LYS LYS EEE . n 
A 1 28  ARG 28  357 357 ARG ARG EEE . n 
A 1 29  ILE 29  358 358 ILE ILE EEE . n 
A 1 30  SER 30  359 359 SER SER EEE . n 
A 1 31  ASN 31  360 360 ASN ASN EEE . n 
A 1 32  CYS 32  361 361 CYS CYS EEE . n 
A 1 33  VAL 33  362 362 VAL VAL EEE . n 
A 1 34  ALA 34  363 363 ALA ALA EEE . n 
A 1 35  ASP 35  364 364 ASP ASP EEE . n 
A 1 36  TYR 36  365 365 TYR TYR EEE . n 
A 1 37  SER 37  366 366 SER SER EEE . n 
A 1 38  VAL 38  367 367 VAL VAL EEE . n 
A 1 39  LEU 39  368 368 LEU LEU EEE . n 
A 1 40  TYR 40  369 369 TYR TYR EEE . n 
A 1 41  ASN 41  370 370 ASN ASN EEE . n 
A 1 42  SER 42  371 371 SER SER EEE . n 
A 1 43  ALA 43  372 372 ALA ALA EEE . n 
A 1 44  SER 44  373 373 SER SER EEE . n 
A 1 45  PHE 45  374 374 PHE PHE EEE . n 
A 1 46  SER 46  375 375 SER SER EEE . n 
A 1 47  THR 47  376 376 THR THR EEE . n 
A 1 48  PHE 48  377 377 PHE PHE EEE . n 
A 1 49  LYS 49  378 378 LYS LYS EEE . n 
A 1 50  CYS 50  379 379 CYS CYS EEE . n 
A 1 51  TYR 51  380 380 TYR TYR EEE . n 
A 1 52  GLY 52  381 381 GLY GLY EEE . n 
A 1 53  VAL 53  382 382 VAL VAL EEE . n 
A 1 54  SER 54  383 383 SER SER EEE . n 
A 1 55  PRO 55  384 384 PRO PRO EEE . n 
A 1 56  THR 56  385 385 THR THR EEE . n 
A 1 57  LYS 57  386 386 LYS LYS EEE . n 
A 1 58  LEU 58  387 387 LEU LEU EEE . n 
A 1 59  ASN 59  388 388 ASN ASN EEE . n 
A 1 60  ASP 60  389 389 ASP ASP EEE . n 
A 1 61  LEU 61  390 390 LEU LEU EEE . n 
A 1 62  CYS 62  391 391 CYS CYS EEE . n 
A 1 63  PHE 63  392 392 PHE PHE EEE . n 
A 1 64  THR 64  393 393 THR THR EEE . n 
A 1 65  ASN 65  394 394 ASN ASN EEE . n 
A 1 66  VAL 66  395 395 VAL VAL EEE . n 
A 1 67  TYR 67  396 396 TYR TYR EEE . n 
A 1 68  ALA 68  397 397 ALA ALA EEE . n 
A 1 69  ASP 69  398 398 ASP ASP EEE . n 
A 1 70  SER 70  399 399 SER SER EEE . n 
A 1 71  PHE 71  400 400 PHE PHE EEE . n 
A 1 72  VAL 72  401 401 VAL VAL EEE . n 
A 1 73  ILE 73  402 402 ILE ILE EEE . n 
A 1 74  ARG 74  403 403 ARG ARG EEE . n 
A 1 75  GLY 75  404 404 GLY GLY EEE . n 
A 1 76  ASP 76  405 405 ASP ASP EEE . n 
A 1 77  GLU 77  406 406 GLU GLU EEE . n 
A 1 78  VAL 78  407 407 VAL VAL EEE . n 
A 1 79  ARG 79  408 408 ARG ARG EEE . n 
A 1 80  GLN 80  409 409 GLN GLN EEE . n 
A 1 81  ILE 81  410 410 ILE ILE EEE . n 
A 1 82  ALA 82  411 411 ALA ALA EEE . n 
A 1 83  PRO 83  412 412 PRO PRO EEE . n 
A 1 84  GLY 84  413 413 GLY GLY EEE . n 
A 1 85  GLN 85  414 414 GLN GLN EEE . n 
A 1 86  THR 86  415 415 THR THR EEE . n 
A 1 87  GLY 87  416 416 GLY GLY EEE . n 
A 1 88  LYS 88  417 417 LYS LYS EEE . n 
A 1 89  ILE 89  418 418 ILE ILE EEE . n 
A 1 90  ALA 90  419 419 ALA ALA EEE . n 
A 1 91  ASP 91  420 420 ASP ASP EEE . n 
A 1 92  TYR 92  421 421 TYR TYR EEE . n 
A 1 93  ASN 93  422 422 ASN ASN EEE . n 
A 1 94  TYR 94  423 423 TYR TYR EEE . n 
A 1 95  LYS 95  424 424 LYS LYS EEE . n 
A 1 96  LEU 96  425 425 LEU LEU EEE . n 
A 1 97  PRO 97  426 426 PRO PRO EEE . n 
A 1 98  ASP 98  427 427 ASP ASP EEE . n 
A 1 99  ASP 99  428 428 ASP ASP EEE . n 
A 1 100 PHE 100 429 429 PHE PHE EEE . n 
A 1 101 THR 101 430 430 THR THR EEE . n 
A 1 102 GLY 102 431 431 GLY GLY EEE . n 
A 1 103 CYS 103 432 432 CYS CYS EEE . n 
A 1 104 VAL 104 433 433 VAL VAL EEE . n 
A 1 105 ILE 105 434 434 ILE ILE EEE . n 
A 1 106 ALA 106 435 435 ALA ALA EEE . n 
A 1 107 TRP 107 436 436 TRP TRP EEE . n 
A 1 108 ASN 108 437 437 ASN ASN EEE . n 
A 1 109 SER 109 438 438 SER SER EEE . n 
A 1 110 ASN 110 439 439 ASN ASN EEE . n 
A 1 111 ASN 111 440 440 ASN ASN EEE . n 
A 1 112 LEU 112 441 441 LEU LEU EEE . n 
A 1 113 ASP 113 442 442 ASP ASP EEE . n 
A 1 114 SER 114 443 443 SER SER EEE . n 
A 1 115 LYS 115 444 444 LYS LYS EEE . n 
A 1 116 VAL 116 445 445 VAL VAL EEE . n 
A 1 117 GLY 117 446 446 GLY GLY EEE . n 
A 1 118 GLY 118 447 447 GLY GLY EEE . n 
A 1 119 ASN 119 448 448 ASN ASN EEE . n 
A 1 120 TYR 120 449 449 TYR TYR EEE . n 
A 1 121 ASN 121 450 450 ASN ASN EEE . n 
A 1 122 TYR 122 451 451 TYR TYR EEE . n 
A 1 123 LEU 123 452 452 LEU LEU EEE . n 
A 1 124 TYR 124 453 453 TYR TYR EEE . n 
A 1 125 ARG 125 454 454 ARG ARG EEE . n 
A 1 126 LEU 126 455 455 LEU LEU EEE . n 
A 1 127 PHE 127 456 456 PHE PHE EEE . n 
A 1 128 ARG 128 457 457 ARG ARG EEE . n 
A 1 129 LYS 129 458 458 LYS LYS EEE . n 
A 1 130 SER 130 459 459 SER SER EEE . n 
A 1 131 ASN 131 460 460 ASN ASN EEE . n 
A 1 132 LEU 132 461 461 LEU LEU EEE . n 
A 1 133 LYS 133 462 462 LYS LYS EEE . n 
A 1 134 PRO 134 463 463 PRO PRO EEE . n 
A 1 135 PHE 135 464 464 PHE PHE EEE . n 
A 1 136 GLU 136 465 465 GLU GLU EEE . n 
A 1 137 ARG 137 466 466 ARG ARG EEE . n 
A 1 138 ASP 138 467 467 ASP ASP EEE . n 
A 1 139 ILE 139 468 468 ILE ILE EEE . n 
A 1 140 SER 140 469 469 SER SER EEE . n 
A 1 141 THR 141 470 470 THR THR EEE . n 
A 1 142 GLU 142 471 471 GLU GLU EEE . n 
A 1 143 ILE 143 472 472 ILE ILE EEE . n 
A 1 144 TYR 144 473 473 TYR TYR EEE . n 
A 1 145 GLN 145 474 474 GLN GLN EEE . n 
A 1 146 ALA 146 475 475 ALA ALA EEE . n 
A 1 147 GLY 147 476 476 GLY GLY EEE . n 
A 1 148 SER 148 477 477 SER SER EEE . n 
A 1 149 THR 149 478 478 THR THR EEE . n 
A 1 150 PRO 150 479 479 PRO PRO EEE . n 
A 1 151 CYS 151 480 480 CYS CYS EEE . n 
A 1 152 ASN 152 481 481 ASN ASN EEE . n 
A 1 153 GLY 153 482 482 GLY GLY EEE . n 
A 1 154 VAL 154 483 483 VAL VAL EEE . n 
A 1 155 GLU 155 484 484 GLU GLU EEE . n 
A 1 156 GLY 156 485 485 GLY GLY EEE . n 
A 1 157 PHE 157 486 486 PHE PHE EEE . n 
A 1 158 ASN 158 487 487 ASN ASN EEE . n 
A 1 159 CYS 159 488 488 CYS CYS EEE . n 
A 1 160 TYR 160 489 489 TYR TYR EEE . n 
A 1 161 PHE 161 490 490 PHE PHE EEE . n 
A 1 162 PRO 162 491 491 PRO PRO EEE . n 
A 1 163 LEU 163 492 492 LEU LEU EEE . n 
A 1 164 GLN 164 493 493 GLN GLN EEE . n 
A 1 165 SER 165 494 494 SER SER EEE . n 
A 1 166 TYR 166 495 495 TYR TYR EEE . n 
A 1 167 GLY 167 496 496 GLY GLY EEE . n 
A 1 168 PHE 168 497 497 PHE PHE EEE . n 
A 1 169 GLN 169 498 498 GLN GLN EEE . n 
A 1 170 PRO 170 499 499 PRO PRO EEE . n 
A 1 171 THR 171 500 500 THR THR EEE . n 
A 1 172 ASN 172 501 501 ASN ASN EEE . n 
A 1 173 GLY 173 502 502 GLY GLY EEE . n 
A 1 174 VAL 174 503 503 VAL VAL EEE . n 
A 1 175 GLY 175 504 504 GLY GLY EEE . n 
A 1 176 TYR 176 505 505 TYR TYR EEE . n 
A 1 177 GLN 177 506 506 GLN GLN EEE . n 
A 1 178 PRO 178 507 507 PRO PRO EEE . n 
A 1 179 TYR 179 508 508 TYR TYR EEE . n 
A 1 180 ARG 180 509 509 ARG ARG EEE . n 
A 1 181 VAL 181 510 510 VAL VAL EEE . n 
A 1 182 VAL 182 511 511 VAL VAL EEE . n 
A 1 183 VAL 183 512 512 VAL VAL EEE . n 
A 1 184 LEU 184 513 513 LEU LEU EEE . n 
A 1 185 SER 185 514 514 SER SER EEE . n 
A 1 186 PHE 186 515 515 PHE PHE EEE . n 
A 1 187 GLU 187 516 516 GLU GLU EEE . n 
A 1 188 LEU 188 517 517 LEU LEU EEE . n 
A 1 189 LEU 189 518 518 LEU LEU EEE . n 
A 1 190 HIS 190 519 519 HIS HIS EEE . n 
A 1 191 ALA 191 520 520 ALA ALA EEE . n 
A 1 192 PRO 192 521 521 PRO PRO EEE . n 
A 1 193 ALA 193 522 522 ALA ALA EEE . n 
A 1 194 THR 194 523 523 THR THR EEE . n 
A 1 195 VAL 195 524 524 VAL VAL EEE . n 
A 1 196 CYS 196 525 525 CYS CYS EEE . n 
A 1 197 GLY 197 526 526 GLY GLY EEE . n 
A 1 198 PRO 198 527 527 PRO PRO EEE . n 
A 1 199 LYS 199 528 ?   ?   ?   EEE . n 
A 1 200 LYS 200 529 ?   ?   ?   EEE . n 
A 1 201 SER 201 530 ?   ?   ?   EEE . n 
A 1 202 THR 202 531 ?   ?   ?   EEE . n 
A 1 203 ASN 203 532 ?   ?   ?   EEE . n 
A 1 204 LYS 204 533 ?   ?   ?   EEE . n 
A 1 205 HIS 205 534 ?   ?   ?   EEE . n 
A 1 206 HIS 206 535 ?   ?   ?   EEE . n 
A 1 207 HIS 207 536 ?   ?   ?   EEE . n 
A 1 208 HIS 208 537 ?   ?   ?   EEE . n 
A 1 209 HIS 209 538 ?   ?   ?   EEE . n 
A 1 210 HIS 210 539 ?   ?   ?   EEE . n 
B 2 1   GLN 1   1   ?   ?   ?   FFF . n 
B 2 2   VAL 2   2   2   VAL VAL FFF . n 
B 2 3   GLN 3   3   3   GLN GLN FFF . n 
B 2 4   LEU 4   4   4   LEU LEU FFF . n 
B 2 5   VAL 5   5   5   VAL VAL FFF . n 
B 2 6   GLU 6   6   6   GLU GLU FFF . n 
B 2 7   SER 7   7   7   SER SER FFF . n 
B 2 8   GLY 8   8   8   GLY GLY FFF . n 
B 2 9   GLY 9   9   9   GLY GLY FFF . n 
B 2 10  GLY 10  10  10  GLY GLY FFF . n 
B 2 11  LEU 11  11  11  LEU LEU FFF . n 
B 2 12  MET 12  12  12  MET MET FFF . n 
B 2 13  GLN 13  13  13  GLN GLN FFF . n 
B 2 14  ALA 14  14  14  ALA ALA FFF . n 
B 2 15  GLY 15  15  15  GLY GLY FFF . n 
B 2 16  GLY 16  16  16  GLY GLY FFF . n 
B 2 17  SER 17  17  17  SER SER FFF . n 
B 2 18  LEU 18  18  18  LEU LEU FFF . n 
B 2 19  ARG 19  19  19  ARG ARG FFF . n 
B 2 20  LEU 20  20  20  LEU LEU FFF . n 
B 2 21  SER 21  21  21  SER SER FFF . n 
B 2 22  CYS 22  22  22  CYS CYS FFF . n 
B 2 23  ALA 23  23  23  ALA ALA FFF . n 
B 2 24  VAL 24  24  24  VAL VAL FFF . n 
B 2 25  SER 25  25  25  SER SER FFF . n 
B 2 26  GLY 26  26  26  GLY GLY FFF . n 
B 2 27  ARG 27  27  27  ARG ARG FFF . n 
B 2 28  THR 28  28  28  THR THR FFF . n 
B 2 29  PHE 29  29  29  PHE PHE FFF . n 
B 2 30  SER 30  30  30  SER SER FFF . n 
B 2 31  THR 31  31  31  THR THR FFF . n 
B 2 32  ALA 32  32  32  ALA ALA FFF . n 
B 2 33  ALA 33  33  33  ALA ALA FFF . n 
B 2 34  MET 34  34  34  MET MET FFF . n 
B 2 35  GLY 35  35  35  GLY GLY FFF . n 
B 2 36  TRP 36  36  36  TRP TRP FFF . n 
B 2 37  PHE 37  37  37  PHE PHE FFF . n 
B 2 38  ARG 38  38  38  ARG ARG FFF . n 
B 2 39  GLN 39  39  39  GLN GLN FFF . n 
B 2 40  ALA 40  40  40  ALA ALA FFF . n 
B 2 41  PRO 41  41  41  PRO PRO FFF . n 
B 2 42  GLY 42  42  42  GLY GLY FFF . n 
B 2 43  LYS 43  43  43  LYS LYS FFF . n 
B 2 44  GLU 44  44  44  GLU GLU FFF . n 
B 2 45  ARG 45  45  45  ARG ARG FFF . n 
B 2 46  GLU 46  46  46  GLU GLU FFF . n 
B 2 47  PHE 47  47  47  PHE PHE FFF . n 
B 2 48  VAL 48  48  48  VAL VAL FFF . n 
B 2 49  ALA 49  49  49  ALA ALA FFF . n 
B 2 50  ALA 50  50  50  ALA ALA FFF . n 
B 2 51  ILE 51  51  51  ILE ILE FFF . n 
B 2 52  ARG 52  52  52  ARG ARG FFF . n 
B 2 53  TRP 53  53  53  TRP TRP FFF . n 
B 2 54  SER 54  54  54  SER SER FFF . n 
B 2 55  GLY 55  55  55  GLY GLY FFF . n 
B 2 56  GLY 56  56  56  GLY GLY FFF . n 
B 2 57  SER 57  57  57  SER SER FFF . n 
B 2 58  ALA 58  58  58  ALA ALA FFF . n 
B 2 59  TYR 59  59  59  TYR TYR FFF . n 
B 2 60  TYR 60  60  60  TYR TYR FFF . n 
B 2 61  ALA 61  61  61  ALA ALA FFF . n 
B 2 62  ASP 62  62  62  ASP ASP FFF . n 
B 2 63  SER 63  63  63  SER SER FFF . n 
B 2 64  VAL 64  64  64  VAL VAL FFF . n 
B 2 65  LYS 65  65  65  LYS LYS FFF . n 
B 2 66  GLY 66  66  66  GLY GLY FFF . n 
B 2 67  ARG 67  67  67  ARG ARG FFF . n 
B 2 68  PHE 68  68  68  PHE PHE FFF . n 
B 2 69  THR 69  69  69  THR THR FFF . n 
B 2 70  ILE 70  70  70  ILE ILE FFF . n 
B 2 71  SER 71  71  71  SER SER FFF . n 
B 2 72  ARG 72  72  72  ARG ARG FFF . n 
B 2 73  ASP 73  73  73  ASP ASP FFF . n 
B 2 74  LYS 74  74  74  LYS LYS FFF . n 
B 2 75  ALA 75  75  75  ALA ALA FFF . n 
B 2 76  LYS 76  76  76  LYS LYS FFF . n 
B 2 77  ASN 77  77  77  ASN ASN FFF . n 
B 2 78  THR 78  78  78  THR THR FFF . n 
B 2 79  VAL 79  79  79  VAL VAL FFF . n 
B 2 80  TYR 80  80  80  TYR TYR FFF . n 
B 2 81  LEU 81  81  81  LEU LEU FFF . n 
B 2 82  GLN 82  82  82  GLN GLN FFF . n 
B 2 83  MET 83  83  83  MET MET FFF . n 
B 2 84  ASN 84  84  84  ASN ASN FFF . n 
B 2 85  SER 85  85  85  SER SER FFF . n 
B 2 86  LEU 86  86  86  LEU LEU FFF . n 
B 2 87  LYS 87  87  87  LYS LYS FFF . n 
B 2 88  TYR 88  88  88  TYR TYR FFF . n 
B 2 89  GLU 89  89  89  GLU GLU FFF . n 
B 2 90  ASP 90  90  90  ASP ASP FFF . n 
B 2 91  THR 91  91  91  THR THR FFF . n 
B 2 92  ALA 92  92  92  ALA ALA FFF . n 
B 2 93  VAL 93  93  93  VAL VAL FFF . n 
B 2 94  TYR 94  94  94  TYR TYR FFF . n 
B 2 95  TYR 95  95  95  TYR TYR FFF . n 
B 2 96  CYS 96  96  96  CYS CYS FFF . n 
B 2 97  ALA 97  97  97  ALA ALA FFF . n 
B 2 98  ARG 98  98  98  ARG ARG FFF . n 
B 2 99  THR 99  99  99  THR THR FFF . n 
B 2 100 GLU 100 100 100 GLU GLU FFF . n 
B 2 101 TYR 101 101 101 TYR TYR FFF . n 
B 2 102 VAL 102 102 102 VAL VAL FFF . n 
B 2 103 SER 103 103 103 SER SER FFF . n 
B 2 104 TYR 104 104 104 TYR TYR FFF . n 
B 2 105 LEU 105 105 105 LEU LEU FFF . n 
B 2 106 LEU 106 106 106 LEU LEU FFF . n 
B 2 107 SER 107 107 107 SER SER FFF . n 
B 2 108 ASP 108 108 108 ASP ASP FFF . n 
B 2 109 TYR 109 109 109 TYR TYR FFF . n 
B 2 110 ALA 110 110 110 ALA ALA FFF . n 
B 2 111 THR 111 111 111 THR THR FFF . n 
B 2 112 TRP 112 112 112 TRP TRP FFF . n 
B 2 113 PRO 113 113 113 PRO PRO FFF . n 
B 2 114 TYR 114 114 114 TYR TYR FFF . n 
B 2 115 ASP 115 115 115 ASP ASP FFF . n 
B 2 116 TYR 116 116 116 TYR TYR FFF . n 
B 2 117 TRP 117 117 117 TRP TRP FFF . n 
B 2 118 GLY 118 118 118 GLY GLY FFF . n 
B 2 119 GLN 119 119 119 GLN GLN FFF . n 
B 2 120 GLY 120 120 120 GLY GLY FFF . n 
B 2 121 THR 121 121 121 THR THR FFF . n 
B 2 122 GLN 122 122 122 GLN GLN FFF . n 
B 2 123 VAL 123 123 123 VAL VAL FFF . n 
B 2 124 THR 124 124 124 THR THR FFF . n 
B 2 125 VAL 125 125 125 VAL VAL FFF . n 
B 2 126 SER 126 126 126 SER SER FFF . n 
B 2 127 SER 127 127 127 SER SER FFF . n 
B 2 128 LYS 128 128 ?   ?   ?   FFF . n 
B 2 129 HIS 129 129 ?   ?   ?   FFF . n 
B 2 130 HIS 130 130 ?   ?   ?   FFF . n 
B 2 131 HIS 131 131 ?   ?   ?   FFF . n 
B 2 132 HIS 132 132 ?   ?   ?   FFF . n 
B 2 133 HIS 133 133 ?   ?   ?   FFF . n 
B 2 134 HIS 134 134 ?   ?   ?   FFF . n 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              james.naismith@strubi.ox.ac.uk 
_pdbx_contact_author.name_first         J 
_pdbx_contact_author.name_last          Naismith 
_pdbx_contact_author.name_mi            H 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-6744-5061 
# 
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 
C 3 NAG 1   601 601 NAG NAG EEE . 
D 4 GOL 1   602 3   GOL GOL EEE . 
E 4 GOL 1   603 4   GOL GOL EEE . 
F 4 GOL 1   604 5   GOL GOL EEE . 
G 5 NO3 1   605 7   NO3 NO3 EEE . 
H 5 NO3 1   606 8   NO3 NO3 EEE . 
I 6 HOH 1   701 179 HOH HOH EEE . 
I 6 HOH 2   702 14  HOH HOH EEE . 
I 6 HOH 3   703 142 HOH HOH EEE . 
I 6 HOH 4   704 70  HOH HOH EEE . 
I 6 HOH 5   705 21  HOH HOH EEE . 
I 6 HOH 6   706 43  HOH HOH EEE . 
I 6 HOH 7   707 158 HOH HOH EEE . 
I 6 HOH 8   708 103 HOH HOH EEE . 
I 6 HOH 9   709 2   HOH HOH EEE . 
I 6 HOH 10  710 67  HOH HOH EEE . 
I 6 HOH 11  711 69  HOH HOH EEE . 
I 6 HOH 12  712 10  HOH HOH EEE . 
I 6 HOH 13  713 51  HOH HOH EEE . 
I 6 HOH 14  714 41  HOH HOH EEE . 
I 6 HOH 15  715 26  HOH HOH EEE . 
I 6 HOH 16  716 170 HOH HOH EEE . 
I 6 HOH 17  717 15  HOH HOH EEE . 
I 6 HOH 18  718 53  HOH HOH EEE . 
I 6 HOH 19  719 40  HOH HOH EEE . 
I 6 HOH 20  720 25  HOH HOH EEE . 
I 6 HOH 21  721 109 HOH HOH EEE . 
I 6 HOH 22  722 84  HOH HOH EEE . 
I 6 HOH 23  723 114 HOH HOH EEE . 
I 6 HOH 24  724 147 HOH HOH EEE . 
I 6 HOH 25  725 162 HOH HOH EEE . 
I 6 HOH 26  726 108 HOH HOH EEE . 
I 6 HOH 27  727 23  HOH HOH EEE . 
I 6 HOH 28  728 34  HOH HOH EEE . 
I 6 HOH 29  729 55  HOH HOH EEE . 
I 6 HOH 30  730 28  HOH HOH EEE . 
I 6 HOH 31  731 13  HOH HOH EEE . 
I 6 HOH 32  732 149 HOH HOH EEE . 
I 6 HOH 33  733 123 HOH HOH EEE . 
I 6 HOH 34  734 18  HOH HOH EEE . 
I 6 HOH 35  735 22  HOH HOH EEE . 
I 6 HOH 36  736 119 HOH HOH EEE . 
I 6 HOH 37  737 127 HOH HOH EEE . 
I 6 HOH 38  738 21  HOH HOH EEE . 
I 6 HOH 39  739 55  HOH HOH EEE . 
I 6 HOH 40  740 152 HOH HOH EEE . 
I 6 HOH 41  741 56  HOH HOH EEE . 
I 6 HOH 42  742 16  HOH HOH EEE . 
I 6 HOH 43  743 77  HOH HOH EEE . 
I 6 HOH 44  744 34  HOH HOH EEE . 
I 6 HOH 45  745 14  HOH HOH EEE . 
I 6 HOH 46  746 42  HOH HOH EEE . 
I 6 HOH 47  747 30  HOH HOH EEE . 
I 6 HOH 48  748 148 HOH HOH EEE . 
I 6 HOH 49  749 134 HOH HOH EEE . 
I 6 HOH 50  750 12  HOH HOH EEE . 
I 6 HOH 51  751 1   HOH HOH EEE . 
I 6 HOH 52  752 20  HOH HOH EEE . 
I 6 HOH 53  753 11  HOH HOH EEE . 
I 6 HOH 54  754 29  HOH HOH EEE . 
I 6 HOH 55  755 106 HOH HOH EEE . 
I 6 HOH 56  756 16  HOH HOH EEE . 
I 6 HOH 57  757 46  HOH HOH EEE . 
I 6 HOH 58  758 60  HOH HOH EEE . 
I 6 HOH 59  759 21  HOH HOH EEE . 
I 6 HOH 60  760 58  HOH HOH EEE . 
I 6 HOH 61  761 18  HOH HOH EEE . 
I 6 HOH 62  762 10  HOH HOH EEE . 
I 6 HOH 63  763 24  HOH HOH EEE . 
I 6 HOH 64  764 68  HOH HOH EEE . 
I 6 HOH 65  765 137 HOH HOH EEE . 
I 6 HOH 66  766 9   HOH HOH EEE . 
I 6 HOH 67  767 5   HOH HOH EEE . 
I 6 HOH 68  768 23  HOH HOH EEE . 
I 6 HOH 69  769 4   HOH HOH EEE . 
I 6 HOH 70  770 104 HOH HOH EEE . 
I 6 HOH 71  771 85  HOH HOH EEE . 
I 6 HOH 72  772 115 HOH HOH EEE . 
I 6 HOH 73  773 73  HOH HOH EEE . 
I 6 HOH 74  774 32  HOH HOH EEE . 
I 6 HOH 75  775 64  HOH HOH EEE . 
I 6 HOH 76  776 75  HOH HOH EEE . 
I 6 HOH 77  777 118 HOH HOH EEE . 
I 6 HOH 78  778 19  HOH HOH EEE . 
I 6 HOH 79  779 82  HOH HOH EEE . 
I 6 HOH 80  780 125 HOH HOH EEE . 
I 6 HOH 81  781 129 HOH HOH EEE . 
I 6 HOH 82  782 74  HOH HOH EEE . 
I 6 HOH 83  783 19  HOH HOH EEE . 
I 6 HOH 84  784 58  HOH HOH EEE . 
I 6 HOH 85  785 27  HOH HOH EEE . 
I 6 HOH 86  786 56  HOH HOH EEE . 
I 6 HOH 87  787 33  HOH HOH EEE . 
I 6 HOH 88  788 76  HOH HOH EEE . 
I 6 HOH 89  789 171 HOH HOH EEE . 
I 6 HOH 90  790 44  HOH HOH EEE . 
I 6 HOH 91  791 33  HOH HOH EEE . 
I 6 HOH 92  792 52  HOH HOH EEE . 
I 6 HOH 93  793 79  HOH HOH EEE . 
I 6 HOH 94  794 8   HOH HOH EEE . 
I 6 HOH 95  795 48  HOH HOH EEE . 
I 6 HOH 96  796 111 HOH HOH EEE . 
I 6 HOH 97  797 59  HOH HOH EEE . 
I 6 HOH 98  798 61  HOH HOH EEE . 
I 6 HOH 99  799 28  HOH HOH EEE . 
I 6 HOH 100 800 45  HOH HOH EEE . 
I 6 HOH 101 801 66  HOH HOH EEE . 
I 6 HOH 102 802 107 HOH HOH EEE . 
I 6 HOH 103 803 173 HOH HOH EEE . 
I 6 HOH 104 804 22  HOH HOH EEE . 
I 6 HOH 105 805 131 HOH HOH EEE . 
I 6 HOH 106 806 42  HOH HOH EEE . 
I 6 HOH 107 807 57  HOH HOH EEE . 
I 6 HOH 108 808 110 HOH HOH EEE . 
I 6 HOH 109 809 3   HOH HOH EEE . 
I 6 HOH 110 810 80  HOH HOH EEE . 
I 6 HOH 111 811 105 HOH HOH EEE . 
I 6 HOH 112 812 29  HOH HOH EEE . 
I 6 HOH 113 813 63  HOH HOH EEE . 
I 6 HOH 114 814 48  HOH HOH EEE . 
I 6 HOH 115 815 172 HOH HOH EEE . 
I 6 HOH 116 816 102 HOH HOH EEE . 
I 6 HOH 117 817 62  HOH HOH EEE . 
I 6 HOH 118 818 47  HOH HOH EEE . 
I 6 HOH 119 819 97  HOH HOH EEE . 
I 6 HOH 120 820 126 HOH HOH EEE . 
I 6 HOH 121 821 92  HOH HOH EEE . 
I 6 HOH 122 822 30  HOH HOH EEE . 
I 6 HOH 123 823 37  HOH HOH EEE . 
I 6 HOH 124 824 32  HOH HOH EEE . 
I 6 HOH 125 825 29  HOH HOH EEE . 
I 6 HOH 126 826 30  HOH HOH EEE . 
I 6 HOH 127 827 19  HOH HOH EEE . 
I 6 HOH 128 828 38  HOH HOH EEE . 
I 6 HOH 129 829 182 HOH HOH EEE . 
I 6 HOH 130 830 18  HOH HOH EEE . 
I 6 HOH 131 831 155 HOH HOH EEE . 
I 6 HOH 132 832 168 HOH HOH EEE . 
I 6 HOH 133 833 177 HOH HOH EEE . 
I 6 HOH 134 834 96  HOH HOH EEE . 
I 6 HOH 135 835 45  HOH HOH EEE . 
I 6 HOH 136 836 113 HOH HOH EEE . 
I 6 HOH 137 837 121 HOH HOH EEE . 
I 6 HOH 138 838 101 HOH HOH EEE . 
I 6 HOH 139 839 159 HOH HOH EEE . 
I 6 HOH 140 840 175 HOH HOH EEE . 
I 6 HOH 141 841 120 HOH HOH EEE . 
I 6 HOH 142 842 128 HOH HOH EEE . 
I 6 HOH 143 843 12  HOH HOH EEE . 
I 6 HOH 144 844 157 HOH HOH EEE . 
I 6 HOH 145 845 145 HOH HOH EEE . 
I 6 HOH 146 846 146 HOH HOH EEE . 
I 6 HOH 147 847 174 HOH HOH EEE . 
J 6 HOH 1   201 24  HOH HOH FFF . 
J 6 HOH 2   202 181 HOH HOH FFF . 
J 6 HOH 3   203 36  HOH HOH FFF . 
J 6 HOH 4   204 81  HOH HOH FFF . 
J 6 HOH 5   205 25  HOH HOH FFF . 
J 6 HOH 6   206 9   HOH HOH FFF . 
J 6 HOH 7   207 78  HOH HOH FFF . 
J 6 HOH 8   208 7   HOH HOH FFF . 
J 6 HOH 9   209 43  HOH HOH FFF . 
J 6 HOH 10  210 133 HOH HOH FFF . 
J 6 HOH 11  211 72  HOH HOH FFF . 
J 6 HOH 12  212 36  HOH HOH FFF . 
J 6 HOH 13  213 44  HOH HOH FFF . 
J 6 HOH 14  214 41  HOH HOH FFF . 
J 6 HOH 15  215 35  HOH HOH FFF . 
J 6 HOH 16  216 150 HOH HOH FFF . 
J 6 HOH 17  217 99  HOH HOH FFF . 
J 6 HOH 18  218 154 HOH HOH FFF . 
J 6 HOH 19  219 49  HOH HOH FFF . 
J 6 HOH 20  220 26  HOH HOH FFF . 
J 6 HOH 21  221 47  HOH HOH FFF . 
J 6 HOH 22  222 51  HOH HOH FFF . 
J 6 HOH 23  223 143 HOH HOH FFF . 
J 6 HOH 24  224 176 HOH HOH FFF . 
J 6 HOH 25  225 20  HOH HOH FFF . 
J 6 HOH 26  226 14  HOH HOH FFF . 
J 6 HOH 27  227 89  HOH HOH FFF . 
J 6 HOH 28  228 13  HOH HOH FFF . 
J 6 HOH 29  229 25  HOH HOH FFF . 
J 6 HOH 30  230 165 HOH HOH FFF . 
J 6 HOH 31  231 37  HOH HOH FFF . 
J 6 HOH 32  232 88  HOH HOH FFF . 
J 6 HOH 33  233 139 HOH HOH FFF . 
J 6 HOH 34  234 91  HOH HOH FFF . 
J 6 HOH 35  235 15  HOH HOH FFF . 
J 6 HOH 36  236 50  HOH HOH FFF . 
J 6 HOH 37  237 117 HOH HOH FFF . 
J 6 HOH 38  238 94  HOH HOH FFF . 
J 6 HOH 39  239 38  HOH HOH FFF . 
J 6 HOH 40  240 156 HOH HOH FFF . 
J 6 HOH 41  241 163 HOH HOH FFF . 
J 6 HOH 42  242 112 HOH HOH FFF . 
J 6 HOH 43  243 52  HOH HOH FFF . 
J 6 HOH 44  244 132 HOH HOH FFF . 
J 6 HOH 45  245 65  HOH HOH FFF . 
J 6 HOH 46  246 57  HOH HOH FFF . 
J 6 HOH 47  247 116 HOH HOH FFF . 
J 6 HOH 48  248 39  HOH HOH FFF . 
J 6 HOH 49  249 167 HOH HOH FFF . 
J 6 HOH 50  250 31  HOH HOH FFF . 
J 6 HOH 51  251 169 HOH HOH FFF . 
J 6 HOH 52  252 180 HOH HOH FFF . 
J 6 HOH 53  253 11  HOH HOH FFF . 
J 6 HOH 54  254 161 HOH HOH FFF . 
J 6 HOH 55  255 153 HOH HOH FFF . 
J 6 HOH 56  256 140 HOH HOH FFF . 
J 6 HOH 57  257 130 HOH HOH FFF . 
J 6 HOH 58  258 136 HOH HOH FFF . 
J 6 HOH 59  259 166 HOH HOH FFF . 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
_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 
# 
_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_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 EEE HOH 832 ? I HOH . 
2 1 EEE HOH 839 ? I HOH . 
3 1 EEE HOH 841 ? I HOH . 
# 
_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       2022-03-23 
# 
_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_
_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 ? ? ? 5.8.0267 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .        4 
# 
_pdbx_entry_details.entry_id                 7Z1E 
_pdbx_entry_details.has_ligand_of_interest   Y 
_pdbx_entry_details.compound_details         ? 
_pdbx_entry_details.source_details           ? 
_pdbx_entry_details.nonpolymer_details       ? 
_pdbx_entry_details.sequence_details         ? 
# 
_pdbx_validate_symm_contact.id                1 
_pdbx_validate_symm_contact.PDB_model_num     1 
_pdbx_validate_symm_contact.auth_atom_id_1    NE2 
_pdbx_validate_symm_contact.auth_asym_id_1    EEE 
_pdbx_validate_symm_contact.auth_comp_id_1    HIS 
_pdbx_validate_symm_contact.auth_seq_id_1     519 
_pdbx_validate_symm_contact.PDB_ins_code_1    ? 
_pdbx_validate_symm_contact.label_alt_id_1    B 
_pdbx_validate_symm_contact.site_symmetry_1   1_555 
_pdbx_validate_symm_contact.auth_atom_id_2    O 
_pdbx_validate_symm_contact.auth_asym_id_2    FFF 
_pdbx_validate_symm_contact.auth_comp_id_2    HOH 
_pdbx_validate_symm_contact.auth_seq_id_2     201 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   5_554 
_pdbx_validate_symm_contact.dist              2.18 
# 
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 PHE EEE 377 ? ? -154.65 81.62  
2 1 VAL EEE 382 ? ? 167.39  136.65 
3 1 ASN EEE 422 ? ? -126.00 -57.57 
# 
_pdbx_validate_peptide_omega.id               1 
_pdbx_validate_peptide_omega.PDB_model_num    1 
_pdbx_validate_peptide_omega.auth_comp_id_1   SER 
_pdbx_validate_peptide_omega.auth_asym_id_1   EEE 
_pdbx_validate_peptide_omega.auth_seq_id_1    494 
_pdbx_validate_peptide_omega.PDB_ins_code_1   ? 
_pdbx_validate_peptide_omega.label_alt_id_1   ? 
_pdbx_validate_peptide_omega.auth_comp_id_2   TYR 
_pdbx_validate_peptide_omega.auth_asym_id_2   EEE 
_pdbx_validate_peptide_omega.auth_seq_id_2    495 
_pdbx_validate_peptide_omega.PDB_ins_code_2   ? 
_pdbx_validate_peptide_omega.label_alt_id_2   ? 
_pdbx_validate_peptide_omega.omega            149.16 
# 
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 EEE PRO 330 ? A PRO 1   
2  1 Y 1 EEE ASN 331 ? A ASN 2   
3  1 Y 1 EEE ILE 332 ? A ILE 3   
4  1 Y 1 EEE THR 333 ? A THR 4   
5  1 Y 1 EEE LYS 528 ? A LYS 199 
6  1 Y 1 EEE LYS 529 ? A LYS 200 
7  1 Y 1 EEE SER 530 ? A SER 201 
8  1 Y 1 EEE THR 531 ? A THR 202 
9  1 Y 1 EEE ASN 532 ? A ASN 203 
10 1 Y 1 EEE LYS 533 ? A LYS 204 
11 1 Y 1 EEE HIS 534 ? A HIS 205 
12 1 Y 1 EEE HIS 535 ? A HIS 206 
13 1 Y 1 EEE HIS 536 ? A HIS 207 
14 1 Y 1 EEE HIS 537 ? A HIS 208 
15 1 Y 1 EEE HIS 538 ? A HIS 209 
16 1 Y 1 EEE HIS 539 ? A HIS 210 
17 1 Y 1 FFF GLN 1   ? B GLN 1   
18 1 Y 1 FFF LYS 128 ? B LYS 128 
19 1 Y 1 FFF HIS 129 ? B HIS 129 
20 1 Y 1 FFF HIS 130 ? B HIS 130 
21 1 Y 1 FFF HIS 131 ? B HIS 131 
22 1 Y 1 FFF HIS 132 ? B HIS 132 
23 1 Y 1 FFF HIS 133 ? B HIS 133 
24 1 Y 1 FFF HIS 134 ? B HIS 134 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Wellcome Trust'                                     'United Kingdom' '100209/Z/12/Z)' 1 
'Engineering and Physical Sciences Research Council' 'United Kingdom' EP/S025243/1     2 
# 
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 
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_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        NAG 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   NAG 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 2-acetamido-2-deoxy-beta-D-glucopyranose NAG 
4 GLYCEROL                                 GOL 
5 'NITRATE ION'                            NO3 
6 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                ? 
# 
