data_7OAU
# 
_entry.id   7OAU 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.347 
_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   7OAU         pdb_00007oau 10.2210/pdb7oau/pdb 
WWPDB D_1292115388 ?            ?                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        7OAU 
_pdbx_database_status.recvd_initial_deposition_date   2021-04-20 
_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 
'Naismith, J.H.' 1 0000-0001-6744-5061 
'Mikolajek, H.'  2 0000-0003-0776-9974 
# 
_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                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Res Sq' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2693-5015 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
'A potent SARS-CoV-2 neutralising nanobody shows therapeutic efficacy in the Syrian golden hamster model of COVID-19' 
_citation.year                      2021 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.21203/rs.3.rs-548968/v1 
_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 'Huo, J.'          1  ? 
primary 'Mikolajek, H.'    2  ? 
primary 'Le Bas, A.'       3  ? 
primary 'Clark, J.'        4  ? 
primary 'Sharma, P.'       5  ? 
primary 'Kipar, A.'        6  ? 
primary 'Dormon, J.'       7  ? 
primary 'Norman, C.'       8  ? 
primary 'Weckener, M.'     9  ? 
primary 'Clare, D.'        10 ? 
primary 'Harrison, P.'     11 ? 
primary 'Tree, J.'         12 ? 
primary 'Buttigieg, K.'    13 ? 
primary 'Salguero, F.'     14 ? 
primary 'Watson, R.'       15 ? 
primary 'Knott, D.'        16 ? 
primary 'Carnell, O.'      17 ? 
primary 'Ngabo, D.'        18 ? 
primary 'Elmore, M.'       19 ? 
primary 'Fotheringham, S.' 20 ? 
primary 'Harding, A.'      21 ? 
primary 'Ward, P.'         22 ? 
primary 'Moynie, L.'       23 ? 
primary 'Dumoux, M.'       24 ? 
primary 'Hall, Y.'         25 ? 
primary 'Hiscox, J.'       26 ? 
primary 'Owen, A.'         27 ? 
primary 'James, W.'        28 ? 
primary 'Carroll, M.'      29 ? 
primary 'Stewart, J.'      30 ? 
primary 'Naismith, J.'     31 ? 
primary 'Owens, R.'        32 ? 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   100.330 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     7OAU 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     28.810 
_cell.length_a_esd                 ? 
_cell.length_b                     153.730 
_cell.length_b_esd                 ? 
_cell.length_c                     75.850 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
# 
_symmetry.entry_id                         7OAU 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                4 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1 21 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'                       23765.652 2   ? N501Y ? ? 
2 polymer     man C5                                       13907.522 2   ? ?     ? ? 
3 non-polymer syn 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208   2   ? ?     ? ? 
4 non-polymer syn GLYCEROL                                 92.094    1   ? ?     ? ? 
5 water       nat water                                    18.015    470 ? ?     ? ? 
# 
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
FPLQSYGFQPTYGVGYQPYRVVVLSFELLHAPATVCGPKKSTNKHHHHHH
;
;PNITNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQ
IAPGQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCY
FPLQSYGFQPTYGVGYQPYRVVVLSFELLHAPATVCGPKKSTNKHHHHHH
;
AAA,EEE ? 
2 'polypeptide(L)' no no 
;MAQVQLVESGGGSVQAGGSLTLSCVASGVTLGRHAIGWFRQAPGKERERVSCIRTFDGITSYVESTKGRFTISSNNAMNT
VYLQMNSLKPEDTAVYFCALGVTAACSDNPYFWGQGTQVTVSSHHHHHH
;
;MAQVQLVESGGGSVQAGGSLTLSCVASGVTLGRHAIGWFRQAPGKERERVSCIRTFDGITSYVESTKGRFTISSNNAMNT
VYLQMNSLKPEDTAVYFCALGVTAACSDNPYFWGQGTQVTVSSHHHHHH
;
BBB,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 TYR 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   MET n 
2 2   ALA n 
2 3   GLN n 
2 4   VAL n 
2 5   GLN n 
2 6   LEU n 
2 7   VAL n 
2 8   GLU n 
2 9   SER n 
2 10  GLY n 
2 11  GLY n 
2 12  GLY n 
2 13  SER n 
2 14  VAL n 
2 15  GLN n 
2 16  ALA n 
2 17  GLY n 
2 18  GLY n 
2 19  SER n 
2 20  LEU n 
2 21  THR n 
2 22  LEU n 
2 23  SER n 
2 24  CYS n 
2 25  VAL n 
2 26  ALA n 
2 27  SER n 
2 28  GLY n 
2 29  VAL n 
2 30  THR n 
2 31  LEU n 
2 32  GLY n 
2 33  ARG n 
2 34  HIS n 
2 35  ALA n 
2 36  ILE n 
2 37  GLY n 
2 38  TRP n 
2 39  PHE n 
2 40  ARG n 
2 41  GLN n 
2 42  ALA n 
2 43  PRO n 
2 44  GLY n 
2 45  LYS n 
2 46  GLU n 
2 47  ARG n 
2 48  GLU n 
2 49  ARG n 
2 50  VAL n 
2 51  SER n 
2 52  CYS n 
2 53  ILE n 
2 54  ARG n 
2 55  THR n 
2 56  PHE n 
2 57  ASP n 
2 58  GLY n 
2 59  ILE n 
2 60  THR n 
2 61  SER n 
2 62  TYR n 
2 63  VAL n 
2 64  GLU n 
2 65  SER n 
2 66  THR n 
2 67  LYS n 
2 68  GLY n 
2 69  ARG n 
2 70  PHE n 
2 71  THR n 
2 72  ILE n 
2 73  SER n 
2 74  SER n 
2 75  ASN n 
2 76  ASN n 
2 77  ALA n 
2 78  MET n 
2 79  ASN n 
2 80  THR n 
2 81  VAL n 
2 82  TYR n 
2 83  LEU n 
2 84  GLN n 
2 85  MET n 
2 86  ASN n 
2 87  SER n 
2 88  LEU n 
2 89  LYS n 
2 90  PRO n 
2 91  GLU n 
2 92  ASP n 
2 93  THR n 
2 94  ALA n 
2 95  VAL n 
2 96  TYR n 
2 97  PHE n 
2 98  CYS n 
2 99  ALA n 
2 100 LEU n 
2 101 GLY n 
2 102 VAL n 
2 103 THR n 
2 104 ALA n 
2 105 ALA n 
2 106 CYS n 
2 107 SER n 
2 108 ASP n 
2 109 ASN n 
2 110 PRO n 
2 111 TYR n 
2 112 PHE n 
2 113 TRP n 
2 114 GLY n 
2 115 GLN n 
2 116 GLY n 
2 117 THR n 
2 118 GLN n 
2 119 VAL n 
2 120 THR n 
2 121 VAL n 
2 122 SER n 
2 123 SER n 
2 124 HIS n 
2 125 HIS n 
2 126 HIS n 
2 127 HIS n 
2 128 HIS n 
2 129 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 '2019-nCoV, SARS-CoV-2' ? 'S, 2' ? ? ? ? ? ? 
'Severe acute respiratory syndrome coronavirus 2' 2697049 ? ? ? ? ? ? ? ? 'Homo sapiens'     9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
? ? ? ? ? 
2 1 sample 'Biological sequence' 1 129 ?                       ? ?      ? ? ? ? ? ? '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 7OAU        7OAU   ? 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 7OAU AAA 1 ? 203 ? P0DTC2 330 ? 532 ? 330 532 
2 2 7OAU BBB 1 ? 129 ? 7OAU   -1  ? 127 ? -1  127 
3 1 7OAU EEE 1 ? 203 ? P0DTC2 330 ? 532 ? 330 532 
4 2 7OAU FFF 1 ? 129 ? 7OAU   -1  ? 127 ? -1  127 
# 
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 7OAU TYR AAA 172 ? UNP P0DTC2 ASN 501 'engineered mutation' 501 1  
1 7OAU LYS AAA 204 ? UNP P0DTC2 ?   ?   'expression tag'      533 2  
1 7OAU HIS AAA 205 ? UNP P0DTC2 ?   ?   'expression tag'      534 3  
1 7OAU HIS AAA 206 ? UNP P0DTC2 ?   ?   'expression tag'      535 4  
1 7OAU HIS AAA 207 ? UNP P0DTC2 ?   ?   'expression tag'      536 5  
1 7OAU HIS AAA 208 ? UNP P0DTC2 ?   ?   'expression tag'      537 6  
1 7OAU HIS AAA 209 ? UNP P0DTC2 ?   ?   'expression tag'      538 7  
1 7OAU HIS AAA 210 ? UNP P0DTC2 ?   ?   'expression tag'      539 8  
3 7OAU TYR EEE 172 ? UNP P0DTC2 ASN 501 'engineered mutation' 501 9  
3 7OAU LYS EEE 204 ? UNP P0DTC2 ?   ?   'expression tag'      533 10 
3 7OAU HIS EEE 205 ? UNP P0DTC2 ?   ?   'expression tag'      534 11 
3 7OAU HIS EEE 206 ? UNP P0DTC2 ?   ?   'expression tag'      535 12 
3 7OAU HIS EEE 207 ? UNP P0DTC2 ?   ?   'expression tag'      536 13 
3 7OAU HIS EEE 208 ? UNP P0DTC2 ?   ?   'expression tag'      537 14 
3 7OAU HIS EEE 209 ? UNP P0DTC2 ?   ?   'expression tag'      538 15 
3 7OAU HIS EEE 210 ? UNP P0DTC2 ?   ?   'expression tag'      539 16 
# 
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 
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                   7OAU 
_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            2.19 
_exptl_crystal.density_method              ? 
_exptl_crystal.density_percent_sol         43.92 
_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    '0.2 M Ammonium fluoride and 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 PILATUS 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2021-03-21 
_diffrn_detector.pdbx_frequency               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9999 
_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 I24' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.9999 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I24 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       7OAU 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.65 
_reflns.d_resolution_low                               39 
_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                                     77705 
_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 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                6.6 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          10 
_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                                0.044 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   1 
_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                                    1.65 
_reflns_shell.d_res_low                                     1.69 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.2 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             5819 
_reflns_shell.percent_possible_all                          100 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               6 
_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                               0.56 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.6 
_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]                            0.020 
_refine.aniso_B[1][2]                            0.000 
_refine.aniso_B[1][3]                            0.707 
_refine.aniso_B[2][2]                            -2.163 
_refine.aniso_B[2][3]                            0.000 
_refine.aniso_B[3][3]                            1.768 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               29.120 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.968 
_refine.correlation_coeff_Fo_to_Fc_free          0.957 
_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                                 7OAU 
_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                            1.650 
_refine.ls_d_res_low                             38.462 
_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                     77679 
_refine.ls_number_reflns_R_free                  3776 
_refine.ls_number_reflns_R_work                  73903 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.967 
_refine.ls_percent_reflns_R_free                 4.861 
_refine.ls_R_factor_all                          0.177 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.1992 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1754 
_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               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      7OAO 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.096 
_refine.pdbx_overall_ESU_R_Free                  0.091 
_refine.pdbx_solvent_vdw_probe_radii             1.300 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             4.776 
_refine.overall_SU_ML                            0.078 
_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        4892 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         34 
_refine_hist.number_atoms_solvent             470 
_refine_hist.number_atoms_total               5396 
_refine_hist.d_res_high                       1.650 
_refine_hist.d_res_low                        38.462 
# 
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' ? 0.007  0.012  5183  ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.018  4667  ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.337  1.654  7089  ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 1.323  1.581  10739 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 6.913  5.000  664   ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 31.749 22.052 268   ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 11.560 15.000 775   ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 16.287 15.000 30    ? r_dihedral_angle_4_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.060  0.200  670   ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.006  0.020  6048  ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  1328  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.180  0.200  790   ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.173  0.200  4327  ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.168  0.200  2510  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.073  0.200  2576  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.152  0.200  353   ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.159  0.200  23    ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.159  0.200  92    ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.136  0.200  41    ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 1.314  1.658  2564  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 1.314  1.657  2563  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 1.893  2.480  3210  ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 1.892  2.481  3211  ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 2.179  1.947  2619  ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 2.179  1.948  2620  ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 3.356  2.823  3862  ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 3.355  2.824  3863  ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 5.963  20.602 5680  ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 5.961  20.579 5678  ? r_lrange_other                 ? ? 
'X-RAY DIFFRACTION' ? 0.056  0.050  6303  ? r_ncsr_local_group_1           ? ? 
'X-RAY DIFFRACTION' ? 0.064  0.050  3667  ? r_ncsr_local_group_2           ? ? 
# 
loop_
_refine_ls_restr_ncs.pdbx_refine_id 
_refine_ls_restr_ncs.dom_id 
_refine_ls_restr_ncs.ncs_model_details 
_refine_ls_restr_ncs.rms_dev_B_iso 
_refine_ls_restr_ncs.rms_dev_position 
_refine_ls_restr_ncs.weight_B_iso 
_refine_ls_restr_ncs.weight_position 
_refine_ls_restr_ncs.pdbx_ordinal 
_refine_ls_restr_ncs.pdbx_type 
_refine_ls_restr_ncs.pdbx_asym_id 
_refine_ls_restr_ncs.pdbx_auth_asym_id 
_refine_ls_restr_ncs.pdbx_number 
_refine_ls_restr_ncs.pdbx_rms 
_refine_ls_restr_ncs.pdbx_weight 
_refine_ls_restr_ncs.pdbx_ens_id 
'X-RAY DIFFRACTION' 1 ? ? 0.05597 ? 0.05010 1 'Local ncs' ? AAA ? ? ? 1 
'X-RAY DIFFRACTION' 2 ? ? 0.05597 ? 0.05010 2 'Local ncs' ? EEE ? ? ? 1 
'X-RAY DIFFRACTION' 3 ? ? 0.06415 ? 0.05010 3 'Local ncs' ? BBB ? ? ? 2 
'X-RAY DIFFRACTION' 4 ? ? 0.06415 ? 0.05010 4 'Local ncs' ? FFF ? ? ? 2 
# 
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' 1.650 1.693  . . 274 5545 99.9485  . . . 0.329 . 0.316 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 1.693 1.739  . . 289 5182 99.9817  . . . 0.287 . 0.286 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 1.739 1.790  . . 286 5189 99.9817  . . . 0.279 . 0.260 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 1.790 1.845  . . 242 5015 100.0000 . . . 0.227 . 0.229 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 1.845 1.905  . . 242 4908 99.9806  . . . 0.207 . 0.205 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 1.905 1.972  . . 220 4674 100.0000 . . . 0.216 . 0.185 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 1.972 2.046  . . 218 4631 99.9794  . . . 0.206 . 0.174 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.046 2.130  . . 219 4310 100.0000 . . . 0.179 . 0.169 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.130 2.224  . . 211 4282 99.9778  . . . 0.202 . 0.159 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.224 2.333  . . 195 3939 99.9758  . . . 0.184 . 0.153 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.333 2.459  . . 173 3863 100.0000 . . . 0.204 . 0.159 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.459 2.608  . . 229 3615 99.9740  . . . 0.180 . 0.161 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.608 2.788  . . 156 3364 100.0000 . . . 0.191 . 0.152 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 2.788 3.011  . . 160 3157 100.0000 . . . 0.189 . 0.158 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.011 3.298  . . 151 2934 100.0000 . . . 0.187 . 0.173 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.298 3.686  . . 135 2623 99.9275  . . . 0.201 . 0.171 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 3.686 4.255  . . 127 2321 99.9184  . . . 0.192 . 0.158 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 4.255 5.207  . . 117 1942 99.8061  . . . 0.149 . 0.148 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 5.207 7.347  . . 85  1547 99.9388  . . . 0.224 . 0.197 . . . . . . . . . . . 
'X-RAY DIFFRACTION' 7.347 38.462 . . 47  837  99.2144  . . . 0.239 . 0.196 . . . . . . . . . . . 
# 
loop_
_struct_ncs_dom.id 
_struct_ncs_dom.pdbx_ens_id 
_struct_ncs_dom.details 
1 1 AAA 
2 1 EEE 
3 2 BBB 
4 2 FFF 
# 
loop_
_struct_ncs_dom_lim.dom_id 
_struct_ncs_dom_lim.pdbx_component_id 
_struct_ncs_dom_lim.beg_auth_asym_id 
_struct_ncs_dom_lim.beg_auth_seq_id 
_struct_ncs_dom_lim.end_auth_asym_id 
_struct_ncs_dom_lim.end_auth_seq_id 
_struct_ncs_dom_lim.pdbx_refine_code 
_struct_ncs_dom_lim.beg_label_asym_id 
_struct_ncs_dom_lim.beg_label_comp_id 
_struct_ncs_dom_lim.beg_label_seq_id 
_struct_ncs_dom_lim.beg_label_alt_id 
_struct_ncs_dom_lim.end_label_asym_id 
_struct_ncs_dom_lim.end_label_comp_id 
_struct_ncs_dom_lim.end_label_seq_id 
_struct_ncs_dom_lim.end_label_alt_id 
_struct_ncs_dom_lim.pdbx_ens_id 
_struct_ncs_dom_lim.selection_details 
1 1 AAA 334 AAA 527 ? ? ? ? ? ? ? ? ? 1 ? 
2 1 EEE 334 EEE 527 ? ? ? ? ? ? ? ? ? 1 ? 
3 2 BBB 1   BBB 120 ? ? ? ? ? ? ? ? ? 2 ? 
4 2 FFF 1   FFF 120 ? ? ? ? ? ? ? ? ? 2 ? 
# 
loop_
_struct_ncs_ens.id 
_struct_ncs_ens.details 
1 'Local NCS retraints between domains:       1       2' 
2 'Local NCS retraints between domains:       3       4' 
# 
_struct.entry_id                     7OAU 
_struct.title                        'Nanobody C5 bound to Kent variant RBD (N501Y)' 
_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        7OAU 
_struct_keywords.text            'RBD, 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 1 ? 
D N N 2 ? 
E N N 3 ? 
F N N 4 ? 
G N N 3 ? 
H N N 5 ? 
I N N 5 ? 
J N N 5 ? 
K N N 5 ? 
# 
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 AAA 337 ASN AAA 343 1 ? 7 
HELX_P HELX_P2  AA2 SER A 20  ? TRP A 24  ? SER AAA 349 TRP AAA 353 5 ? 5 
HELX_P HELX_P3  AA3 ASP A 35  ? ASN A 41  ? ASP AAA 364 ASN AAA 370 1 ? 7 
HELX_P HELX_P4  AA4 SER A 54  ? ASP A 60  ? SER AAA 383 ASP AAA 389 5 ? 7 
HELX_P HELX_P5  AA5 ASP A 76  ? ILE A 81  ? ASP AAA 405 ILE AAA 410 5 ? 6 
HELX_P HELX_P6  AA6 GLY A 87  ? ASN A 93  ? GLY AAA 416 ASN AAA 422 1 ? 7 
HELX_P HELX_P7  AA7 SER A 109 ? SER A 114 ? SER AAA 438 SER AAA 443 1 ? 6 
HELX_P HELX_P8  AA8 GLY A 173 ? TYR A 176 ? GLY AAA 502 TYR AAA 505 5 ? 4 
HELX_P HELX_P9  AA9 ASN B 76  ? MET B 78  ? ASN BBB 74  MET BBB 76  5 ? 3 
HELX_P HELX_P10 AB1 LYS B 89  ? THR B 93  ? LYS BBB 87  THR BBB 91  5 ? 5 
HELX_P HELX_P11 AB2 PRO C 8   ? ASN C 14  ? PRO EEE 337 ASN EEE 343 1 ? 7 
HELX_P HELX_P12 AB3 SER C 20  ? TRP C 24  ? SER EEE 349 TRP EEE 353 5 ? 5 
HELX_P HELX_P13 AB4 ASP C 35  ? ASN C 41  ? ASP EEE 364 ASN EEE 370 1 ? 7 
HELX_P HELX_P14 AB5 SER C 54  ? ASP C 60  ? SER EEE 383 ASP EEE 389 5 ? 7 
HELX_P HELX_P15 AB6 ASP C 76  ? ILE C 81  ? ASP EEE 405 ILE EEE 410 5 ? 6 
HELX_P HELX_P16 AB7 GLY C 87  ? ASN C 93  ? GLY EEE 416 ASN EEE 422 1 ? 7 
HELX_P HELX_P17 AB8 SER C 109 ? SER C 114 ? SER EEE 438 SER EEE 443 1 ? 6 
HELX_P HELX_P18 AB9 GLY C 173 ? TYR C 176 ? GLY EEE 502 TYR EEE 505 5 ? 4 
HELX_P HELX_P19 AC1 ASN D 76  ? MET D 78  ? ASN FFF 74  MET FFF 76  5 ? 3 
HELX_P HELX_P20 AC2 LYS D 89  ? THR D 93  ? LYS FFF 87  THR FFF 91  5 ? 5 
# 
_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 ? ? AAA CYS 336 AAA CYS 361 1_555 ? ? ? ? ? ? ? 2.037 ? ? 
disulf2  disulf ?   ? A CYS 50  SG  ? ? ? 1_555 A CYS 103 SG ? ? AAA CYS 379 AAA CYS 432 1_555 ? ? ? ? ? ? ? 2.070 ? ? 
disulf3  disulf ?   ? A CYS 62  SG  ? ? ? 1_555 A CYS 196 SG ? ? AAA CYS 391 AAA CYS 525 1_555 ? ? ? ? ? ? ? 2.073 ? ? 
disulf4  disulf ?   ? A CYS 151 SG  ? ? ? 1_555 A CYS 159 SG ? ? AAA CYS 480 AAA CYS 488 1_555 ? ? ? ? ? ? ? 2.112 ? ? 
disulf5  disulf ?   ? B CYS 24  SG  ? ? ? 1_555 B CYS 98  SG ? ? BBB CYS 22  BBB CYS 96  1_555 ? ? ? ? ? ? ? 2.036 ? ? 
disulf6  disulf ?   ? B CYS 52  SG  ? ? ? 1_555 B CYS 106 SG ? ? BBB CYS 50  BBB CYS 104 1_555 ? ? ? ? ? ? ? 2.051 ? ? 
disulf7  disulf ?   ? C CYS 7   SG  ? ? ? 1_555 C CYS 32  SG ? ? EEE CYS 336 EEE CYS 361 1_555 ? ? ? ? ? ? ? 2.051 ? ? 
disulf8  disulf ?   ? C CYS 50  SG  ? ? ? 1_555 C CYS 103 SG ? ? EEE CYS 379 EEE CYS 432 1_555 ? ? ? ? ? ? ? 2.082 ? ? 
disulf9  disulf ?   ? C CYS 62  SG  ? ? ? 1_555 C CYS 196 SG ? ? EEE CYS 391 EEE CYS 525 1_555 ? ? ? ? ? ? ? 2.070 ? ? 
disulf10 disulf ?   ? C CYS 151 SG  ? ? ? 1_555 C CYS 159 SG ? ? EEE CYS 480 EEE CYS 488 1_555 ? ? ? ? ? ? ? 2.114 ? ? 
disulf11 disulf ?   ? D CYS 24  SG  ? ? ? 1_555 D CYS 98  SG ? ? FFF CYS 22  FFF CYS 96  1_555 ? ? ? ? ? ? ? 2.033 ? ? 
disulf12 disulf ?   ? D CYS 52  SG  ? ? ? 1_555 D CYS 106 SG ? ? FFF CYS 50  FFF CYS 104 1_555 ? ? ? ? ? ? ? 2.081 ? ? 
covale1  covale one ? A ASN 14  ND2 ? ? ? 1_555 E NAG .   C1 ? ? AAA ASN 343 AAA NAG 601 1_555 ? ? ? ? ? ? ? 1.442 ? 
N-Glycosylation 
covale2  covale one ? C ASN 14  ND2 ? ? ? 1_555 G NAG .   C1 ? ? EEE ASN 343 EEE NAG 601 1_555 ? ? ? ? ? ? ? 1.443 ? 
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 ? 
AA8 ? 5 ? 
AA9 ? 3 ? 
AB1 ? 2 ? 
AB2 ? 2 ? 
AB3 ? 4 ? 
AB4 ? 6 ? 
AB5 ? 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 
AA8 1 2 ? anti-parallel 
AA8 2 3 ? anti-parallel 
AA8 3 4 ? anti-parallel 
AA8 4 5 ? anti-parallel 
AA9 1 2 ? parallel      
AA9 2 3 ? anti-parallel 
AB1 1 2 ? anti-parallel 
AB2 1 2 ? anti-parallel 
AB3 1 2 ? anti-parallel 
AB3 2 3 ? anti-parallel 
AB3 3 4 ? anti-parallel 
AB4 1 2 ? parallel      
AB4 2 3 ? anti-parallel 
AB4 3 4 ? anti-parallel 
AB4 4 5 ? anti-parallel 
AB4 5 6 ? anti-parallel 
AB5 1 2 ? parallel      
AB5 2 3 ? anti-parallel 
AB5 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 AAA 354 ILE AAA 358 
AA1 2 ASN A 65  ? ARG A 74  ? ASN AAA 394 ARG AAA 403 
AA1 3 PRO A 178 ? GLU A 187 ? PRO AAA 507 GLU AAA 516 
AA1 4 GLY A 102 ? ASN A 108 ? GLY AAA 431 ASN AAA 437 
AA1 5 THR A 47  ? TYR A 51  ? THR AAA 376 TYR AAA 380 
AA2 1 CYS A 32  ? VAL A 33  ? CYS AAA 361 VAL AAA 362 
AA2 2 VAL A 195 ? CYS A 196 ? VAL AAA 524 CYS AAA 525 
AA2 3 CYS A 62  ? PHE A 63  ? CYS AAA 391 PHE AAA 392 
AA3 1 LEU A 123 ? ARG A 125 ? LEU AAA 452 ARG AAA 454 
AA3 2 LEU A 163 ? SER A 165 ? LEU AAA 492 SER AAA 494 
AA4 1 TYR A 144 ? GLN A 145 ? TYR AAA 473 GLN AAA 474 
AA4 2 CYS A 159 ? TYR A 160 ? CYS AAA 488 TYR AAA 489 
AA5 1 GLN B 5   ? SER B 9   ? GLN BBB 3   SER BBB 7   
AA5 2 LEU B 20  ? SER B 27  ? LEU BBB 18  SER BBB 25  
AA5 3 THR B 80  ? MET B 85  ? THR BBB 78  MET BBB 83  
AA5 4 PHE B 70  ? ASN B 75  ? PHE BBB 68  ASN BBB 73  
AA6 1 GLY B 12  ? GLN B 15  ? GLY BBB 10  GLN BBB 13  
AA6 2 THR B 117 ? SER B 122 ? THR BBB 115 SER BBB 120 
AA6 3 ALA B 94  ? LEU B 100 ? ALA BBB 92  LEU BBB 98  
AA6 4 ALA B 35  ? GLN B 41  ? ALA BBB 33  GLN BBB 39  
AA6 5 GLU B 48  ? ARG B 54  ? GLU BBB 46  ARG BBB 52  
AA6 6 THR B 60  ? TYR B 62  ? THR BBB 58  TYR BBB 60  
AA7 1 GLY B 12  ? GLN B 15  ? GLY BBB 10  GLN BBB 13  
AA7 2 THR B 117 ? SER B 122 ? THR BBB 115 SER BBB 120 
AA7 3 ALA B 94  ? LEU B 100 ? ALA BBB 92  LEU BBB 98  
AA7 4 PHE B 112 ? TRP B 113 ? PHE BBB 110 TRP BBB 111 
AA8 1 ASN C 25  ? ILE C 29  ? ASN EEE 354 ILE EEE 358 
AA8 2 ASN C 65  ? ARG C 74  ? ASN EEE 394 ARG EEE 403 
AA8 3 PRO C 178 ? GLU C 187 ? PRO EEE 507 GLU EEE 516 
AA8 4 GLY C 102 ? ASN C 108 ? GLY EEE 431 ASN EEE 437 
AA8 5 THR C 47  ? TYR C 51  ? THR EEE 376 TYR EEE 380 
AA9 1 CYS C 32  ? VAL C 33  ? CYS EEE 361 VAL EEE 362 
AA9 2 VAL C 195 ? CYS C 196 ? VAL EEE 524 CYS EEE 525 
AA9 3 CYS C 62  ? PHE C 63  ? CYS EEE 391 PHE EEE 392 
AB1 1 LEU C 123 ? ARG C 125 ? LEU EEE 452 ARG EEE 454 
AB1 2 LEU C 163 ? SER C 165 ? LEU EEE 492 SER EEE 494 
AB2 1 TYR C 144 ? GLN C 145 ? TYR EEE 473 GLN EEE 474 
AB2 2 CYS C 159 ? TYR C 160 ? CYS EEE 488 TYR EEE 489 
AB3 1 GLN D 5   ? SER D 9   ? GLN FFF 3   SER FFF 7   
AB3 2 LEU D 20  ? SER D 27  ? LEU FFF 18  SER FFF 25  
AB3 3 THR D 80  ? MET D 85  ? THR FFF 78  MET FFF 83  
AB3 4 PHE D 70  ? ASN D 75  ? PHE FFF 68  ASN FFF 73  
AB4 1 GLY D 12  ? GLN D 15  ? GLY FFF 10  GLN FFF 13  
AB4 2 THR D 117 ? SER D 122 ? THR FFF 115 SER FFF 120 
AB4 3 ALA D 94  ? LEU D 100 ? ALA FFF 92  LEU FFF 98  
AB4 4 ALA D 35  ? GLN D 41  ? ALA FFF 33  GLN FFF 39  
AB4 5 GLU D 48  ? ARG D 54  ? GLU FFF 46  ARG FFF 52  
AB4 6 THR D 60  ? TYR D 62  ? THR FFF 58  TYR FFF 60  
AB5 1 GLY D 12  ? GLN D 15  ? GLY FFF 10  GLN FFF 13  
AB5 2 THR D 117 ? SER D 122 ? THR FFF 115 SER FFF 120 
AB5 3 ALA D 94  ? LEU D 100 ? ALA FFF 92  LEU FFF 98  
AB5 4 PHE D 112 ? TRP D 113 ? PHE FFF 110 TRP FFF 111 
# 
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 AAA 358 O VAL A 66  ? O VAL AAA 395 
AA1 2 3 N ILE A 73  ? N ILE AAA 402 O TYR A 179 ? O TYR AAA 508 
AA1 3 4 O VAL A 182 ? O VAL AAA 511 N ILE A 105 ? N ILE AAA 434 
AA1 4 5 O GLY A 102 ? O GLY AAA 431 N TYR A 51  ? N TYR AAA 380 
AA2 1 2 N CYS A 32  ? N CYS AAA 361 O CYS A 196 ? O CYS AAA 525 
AA2 2 3 O VAL A 195 ? O VAL AAA 524 N PHE A 63  ? N PHE AAA 392 
AA3 1 2 N TYR A 124 ? N TYR AAA 453 O GLN A 164 ? O GLN AAA 493 
AA4 1 2 N TYR A 144 ? N TYR AAA 473 O TYR A 160 ? O TYR AAA 489 
AA5 1 2 N VAL B 7   ? N VAL BBB 5   O VAL B 25  ? O VAL BBB 23  
AA5 2 3 N LEU B 20  ? N LEU BBB 18  O MET B 85  ? O MET BBB 83  
AA5 3 4 O GLN B 84  ? O GLN BBB 82  N THR B 71  ? N THR BBB 69  
AA6 1 2 N GLY B 12  ? N GLY BBB 10  O THR B 120 ? O THR BBB 118 
AA6 2 3 O THR B 117 ? O THR BBB 115 N TYR B 96  ? N TYR BBB 94  
AA6 3 4 O PHE B 97  ? O PHE BBB 95  N PHE B 39  ? N PHE BBB 37  
AA6 4 5 N ILE B 36  ? N ILE BBB 34  O ILE B 53  ? O ILE BBB 51  
AA6 5 6 N CYS B 52  ? N CYS BBB 50  O SER B 61  ? O SER BBB 59  
AA7 1 2 N GLY B 12  ? N GLY BBB 10  O THR B 120 ? O THR BBB 118 
AA7 2 3 O THR B 117 ? O THR BBB 115 N TYR B 96  ? N TYR BBB 94  
AA7 3 4 N LEU B 100 ? N LEU BBB 98  O PHE B 112 ? O PHE BBB 110 
AA8 1 2 N ILE C 29  ? N ILE EEE 358 O VAL C 66  ? O VAL EEE 395 
AA8 2 3 N ILE C 73  ? N ILE EEE 402 O TYR C 179 ? O TYR EEE 508 
AA8 3 4 O VAL C 182 ? O VAL EEE 511 N ILE C 105 ? N ILE EEE 434 
AA8 4 5 O GLY C 102 ? O GLY EEE 431 N TYR C 51  ? N TYR EEE 380 
AA9 1 2 N CYS C 32  ? N CYS EEE 361 O CYS C 196 ? O CYS EEE 525 
AA9 2 3 O VAL C 195 ? O VAL EEE 524 N PHE C 63  ? N PHE EEE 392 
AB1 1 2 N TYR C 124 ? N TYR EEE 453 O GLN C 164 ? O GLN EEE 493 
AB2 1 2 N TYR C 144 ? N TYR EEE 473 O TYR C 160 ? O TYR EEE 489 
AB3 1 2 N VAL D 7   ? N VAL FFF 5   O VAL D 25  ? O VAL FFF 23  
AB3 2 3 N LEU D 20  ? N LEU FFF 18  O MET D 85  ? O MET FFF 83  
AB3 3 4 O GLN D 84  ? O GLN FFF 82  N THR D 71  ? N THR FFF 69  
AB4 1 2 N GLY D 12  ? N GLY FFF 10  O THR D 120 ? O THR FFF 118 
AB4 2 3 O THR D 117 ? O THR FFF 115 N TYR D 96  ? N TYR FFF 94  
AB4 3 4 O ALA D 99  ? O ALA FFF 97  N GLY D 37  ? N GLY FFF 35  
AB4 4 5 N ILE D 36  ? N ILE FFF 34  O ILE D 53  ? O ILE FFF 51  
AB4 5 6 N CYS D 52  ? N CYS FFF 50  O SER D 61  ? O SER FFF 59  
AB5 1 2 N GLY D 12  ? N GLY FFF 10  O THR D 120 ? O THR FFF 118 
AB5 2 3 O THR D 117 ? O THR FFF 115 N TYR D 96  ? N TYR FFF 94  
AB5 3 4 N LEU D 100 ? N LEU FFF 98  O PHE D 112 ? O PHE FFF 110 
# 
_atom_sites.entry_id                    7OAU 
_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]   0.034710 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.006327 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.006505 
_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]   0.013401 
_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 1.055   
# 
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_site.pdbx_tls_group_id 
ATOM   1    N N   . ASN A 1 5   ? 13.219  -9.412  -23.793 1.000 58.549 0 334 ASN AAA N   1 ? 1  
ATOM   2    C CA  . ASN A 1 5   ? 13.936  -8.105  -23.857 1.000 59.333 0 334 ASN AAA CA  1 ? 1  
ATOM   3    C C   . ASN A 1 5   ? 13.051  -7.087  -24.597 1.000 52.028 0 334 ASN AAA C   1 ? 1  
ATOM   4    O O   . ASN A 1 5   ? 13.009  -7.149  -25.839 1.000 47.925 0 334 ASN AAA O   1 ? 1  
ATOM   5    C CB  . ASN A 1 5   ? 15.312  -8.286  -24.506 1.000 63.779 0 334 ASN AAA CB  1 ? 1  
ATOM   6    C CG  . ASN A 1 5   ? 16.251  -7.131  -24.233 1.000 68.663 0 334 ASN AAA CG  1 ? 1  
ATOM   7    O OD1 . ASN A 1 5   ? 15.848  -5.974  -24.297 1.000 72.334 0 334 ASN AAA OD1 1 ? 1  
ATOM   8    N ND2 . ASN A 1 5   ? 17.502  -7.431  -23.924 1.000 70.930 0 334 ASN AAA ND2 1 ? 1  
ATOM   9    N N   . LEU A 1 6   ? 12.374  -6.192  -23.864 1.000 49.218 0 335 LEU AAA N   1 ? 1  
ATOM   10   C CA  . LEU A 1 6   ? 11.279  -5.323  -24.390 1.000 46.894 0 335 LEU AAA CA  1 ? 1  
ATOM   11   C C   . LEU A 1 6   ? 11.862  -4.158  -25.201 1.000 42.342 0 335 LEU AAA C   1 ? 1  
ATOM   12   O O   . LEU A 1 6   ? 12.792  -3.501  -24.715 1.000 45.360 0 335 LEU AAA O   1 ? 1  
ATOM   13   C CB  . LEU A 1 6   ? 10.429  -4.791  -23.231 1.000 49.590 0 335 LEU AAA CB  1 ? 1  
ATOM   14   C CG  . LEU A 1 6   ? 9.734   -5.839  -22.363 1.000 53.890 0 335 LEU AAA CG  1 ? 1  
ATOM   15   C CD1 . LEU A 1 6   ? 8.892   -5.167  -21.290 1.000 58.323 0 335 LEU AAA CD1 1 ? 1  
ATOM   16   C CD2 . LEU A 1 6   ? 8.867   -6.772  -23.195 1.000 54.004 0 335 LEU AAA CD2 1 ? 1  
ATOM   17   N N   . CYS A 1 7   ? 11.314  -3.889  -26.389 1.000 37.682 0 336 CYS AAA N   1 ? 1  
ATOM   18   C CA  . CYS A 1 7   ? 11.721  -2.733  -27.232 1.000 36.565 0 336 CYS AAA CA  1 ? 1  
ATOM   19   C C   . CYS A 1 7   ? 11.475  -1.445  -26.452 1.000 35.622 0 336 CYS AAA C   1 ? 1  
ATOM   20   O O   . CYS A 1 7   ? 10.450  -1.298  -25.796 1.000 38.518 0 336 CYS AAA O   1 ? 1  
ATOM   21   C CB  . CYS A 1 7   ? 10.967  -2.690  -28.554 1.000 35.901 0 336 CYS AAA CB  1 ? 1  
ATOM   22   S SG  . CYS A 1 7   ? 11.380  -4.061  -29.667 1.000 35.197 0 336 CYS AAA SG  1 ? 1  
ATOM   23   N N   . PRO A 1 8   ? 12.418  -0.484  -26.484 1.000 36.483 0 337 PRO AAA N   1 ? 1  
ATOM   24   C CA  . PRO A 1 8   ? 12.305  0.731   -25.671 1.000 37.228 0 337 PRO AAA CA  1 ? 1  
ATOM   25   C C   . PRO A 1 8   ? 11.387  1.799   -26.290 1.000 36.924 0 337 PRO AAA C   1 ? 1  
ATOM   26   O O   . PRO A 1 8   ? 11.824  2.912   -26.491 1.000 38.364 0 337 PRO AAA O   1 ? 1  
ATOM   27   C CB  . PRO A 1 8   ? 13.771  1.175   -25.615 1.000 38.481 0 337 PRO AAA CB  1 ? 1  
ATOM   28   C CG  . PRO A 1 8   ? 14.318  0.791   -26.964 1.000 39.149 0 337 PRO AAA CG  1 ? 1  
ATOM   29   C CD  . PRO A 1 8   ? 13.671  -0.542  -27.257 1.000 37.617 0 337 PRO AAA CD  1 ? 1  
ATOM   30   N N   . PHE A 1 9   ? 10.124  1.445   -26.543 1.000 37.153 0 338 PHE AAA N   1 ? 1  
ATOM   31   C CA  . PHE A 1 9   ? 9.112   2.350   -27.136 1.000 37.214 0 338 PHE AAA CA  1 ? 1  
ATOM   32   C C   . PHE A 1 9   ? 8.736   3.429   -26.123 1.000 37.390 0 338 PHE AAA C   1 ? 1  
ATOM   33   O O   . PHE A 1 9   ? 8.489   4.544   -26.566 1.000 35.920 0 338 PHE AAA O   1 ? 1  
ATOM   34   C CB  . PHE A 1 9   ? 7.899   1.580   -27.652 1.000 39.788 0 338 PHE AAA CB  1 ? 1  
ATOM   35   C CG  . PHE A 1 9   ? 8.142   0.892   -28.972 1.000 42.341 0 338 PHE AAA CG  1 ? 1  
ATOM   36   C CD1 . PHE A 1 9   ? 8.877   1.505   -29.975 1.000 46.269 0 338 PHE AAA CD1 1 ? 1  
ATOM   37   C CD2 . PHE A 1 9   ? 7.629   -0.369  -29.212 1.000 47.402 0 338 PHE AAA CD2 1 ? 1  
ATOM   38   C CE1 . PHE A 1 9   ? 9.101   0.870   -31.186 1.000 49.689 0 338 PHE AAA CE1 1 ? 1  
ATOM   39   C CE2 . PHE A 1 9   ? 7.853   -1.003  -30.423 1.000 48.399 0 338 PHE AAA CE2 1 ? 1  
ATOM   40   C CZ  . PHE A 1 9   ? 8.591   -0.384  -31.406 1.000 50.431 0 338 PHE AAA CZ  1 ? 1  
ATOM   41   N N   . GLY A 1 10  ? 8.763   3.132   -24.820 1.000 37.877 0 339 GLY AAA N   1 ? 1  
ATOM   42   C CA  . GLY A 1 10  ? 8.532   4.142   -23.768 1.000 38.508 0 339 GLY AAA CA  1 ? 1  
ATOM   43   C C   . GLY A 1 10  ? 9.412   5.365   -23.968 1.000 38.908 0 339 GLY AAA C   1 ? 1  
ATOM   44   O O   . GLY A 1 10  ? 8.887   6.486   -23.912 1.000 38.623 0 339 GLY AAA O   1 ? 1  
ATOM   45   N N   . GLU A 1 11  ? 10.712  5.164   -24.200 1.000 39.527 0 340 GLU AAA N   1 ? 1  
ATOM   46   C CA  . GLU A 1 11  ? 11.709  6.252   -24.393 1.000 41.097 0 340 GLU AAA CA  1 ? 1  
ATOM   47   C C   . GLU A 1 11  ? 11.315  7.111   -25.604 1.000 39.130 0 340 GLU AAA C   1 ? 1  
ATOM   48   O O   . GLU A 1 11  ? 11.629  8.305   -25.591 1.000 39.956 0 340 GLU AAA O   1 ? 1  
ATOM   49   C CB  . GLU A 1 11  ? 13.113  5.691   -24.620 1.000 45.768 0 340 GLU AAA CB  1 ? 1  
ATOM   50   C CG  . GLU A 1 11  ? 13.721  5.009   -23.412 1.000 52.040 0 340 GLU AAA CG  1 ? 1  
ATOM   51   C CD  . GLU A 1 11  ? 15.001  4.247   -23.727 1.000 55.383 0 340 GLU AAA CD  1 ? 1  
ATOM   52   O OE1 . GLU A 1 11  ? 15.648  4.567   -24.747 1.000 59.678 0 340 GLU AAA OE1 1 ? 1  
ATOM   53   O OE2 . GLU A 1 11  ? 15.337  3.317   -22.964 1.000 59.017 0 340 GLU AAA OE2 1 ? 1  
ATOM   54   N N   . VAL A 1 12  ? 10.663  6.530   -26.613 1.000 35.345 0 341 VAL AAA N   1 ? 2  
ATOM   55   C CA  . VAL A 1 12  ? 10.246  7.260   -27.845 1.000 31.890 0 341 VAL AAA CA  1 ? 2  
ATOM   56   C C   . VAL A 1 12  ? 8.937   8.015   -27.577 1.000 31.032 0 341 VAL AAA C   1 ? 2  
ATOM   57   O O   . VAL A 1 12  ? 8.925   9.242   -27.736 1.000 29.339 0 341 VAL AAA O   1 ? 2  
ATOM   58   C CB  . VAL A 1 12  ? 10.103  6.327   -29.062 1.000 32.576 0 341 VAL AAA CB  1 ? 2  
ATOM   59   C CG1 . VAL A 1 12  ? 9.631   7.102   -30.283 1.000 32.935 0 341 VAL AAA CG1 1 ? 2  
ATOM   60   C CG2 . VAL A 1 12  ? 11.399  5.588   -29.375 1.000 32.962 0 341 VAL AAA CG2 1 ? 2  
ATOM   61   N N   . PHE A 1 13  ? 7.872   7.305   -27.209 1.000 30.155 0 342 PHE AAA N   1 ? 2  
ATOM   62   C CA  . PHE A 1 13  ? 6.497   7.859   -27.150 1.000 30.301 0 342 PHE AAA CA  1 ? 2  
ATOM   63   C C   . PHE A 1 13  ? 6.354   8.786   -25.939 1.000 34.894 0 342 PHE AAA C   1 ? 2  
ATOM   64   O O   . PHE A 1 13  ? 5.551   9.722   -26.018 1.000 33.671 0 342 PHE AAA O   1 ? 2  
ATOM   65   C CB  . PHE A 1 13  ? 5.465   6.733   -27.113 1.000 31.545 0 342 PHE AAA CB  1 ? 2  
ATOM   66   C CG  . PHE A 1 13  ? 5.267   6.062   -28.446 1.000 30.828 0 342 PHE AAA CG  1 ? 2  
ATOM   67   C CD1 . PHE A 1 13  ? 6.073   5.009   -28.841 1.000 32.140 0 342 PHE AAA CD1 1 ? 2  
ATOM   68   C CD2 . PHE A 1 13  ? 4.276   6.493   -29.309 1.000 30.157 0 342 PHE AAA CD2 1 ? 2  
ATOM   69   C CE1 . PHE A 1 13  ? 5.896   4.406   -30.076 1.000 31.042 0 342 PHE AAA CE1 1 ? 2  
ATOM   70   C CE2 . PHE A 1 13  ? 4.094   5.881   -30.537 1.000 30.660 0 342 PHE AAA CE2 1 ? 2  
ATOM   71   C CZ  . PHE A 1 13  ? 4.903   4.838   -30.917 1.000 31.006 0 342 PHE AAA CZ  1 ? 2  
ATOM   72   N N   . ASN A 1 14  ? 7.099   8.535   -24.861 1.000 34.511 0 343 ASN AAA N   1 ? 2  
ATOM   73   C CA  . ASN A 1 14  ? 6.914   9.233   -23.563 1.000 39.634 0 343 ASN AAA CA  1 ? 2  
ATOM   74   C C   . ASN A 1 14  ? 8.104   10.150  -23.261 1.000 39.216 0 343 ASN AAA C   1 ? 2  
ATOM   75   O O   . ASN A 1 14  ? 8.167   10.633  -22.126 1.000 39.754 0 343 ASN AAA O   1 ? 2  
ATOM   76   C CB  . ASN A 1 14  ? 6.677   8.237   -22.427 1.000 43.594 0 343 ASN AAA CB  1 ? 2  
ATOM   77   C CG  . ASN A 1 14  ? 5.268   7.684   -22.413 1.000 47.778 0 343 ASN AAA CG  1 ? 2  
ATOM   78   O OD1 . ASN A 1 14  ? 4.342   8.287   -22.952 1.000 46.561 0 343 ASN AAA OD1 1 ? 2  
ATOM   79   N ND2 . ASN A 1 14  ? 5.097   6.528   -21.797 1.000 56.867 0 343 ASN AAA ND2 1 ? 2  
ATOM   80   N N   . ALA A 1 15  ? 8.979   10.424  -24.237 1.000 35.392 0 344 ALA AAA N   1 ? 2  
ATOM   81   C CA  . ALA A 1 15  ? 10.086  11.400  -24.096 1.000 36.262 0 344 ALA AAA CA  1 ? 2  
ATOM   82   C C   . ALA A 1 15  ? 9.493   12.729  -23.618 1.000 37.137 0 344 ALA AAA C   1 ? 2  
ATOM   83   O O   . ALA A 1 15  ? 8.436   13.126  -24.130 1.000 36.248 0 344 ALA AAA O   1 ? 2  
ATOM   84   C CB  . ALA A 1 15  ? 10.829  11.560  -25.398 1.000 34.988 0 344 ALA AAA CB  1 ? 2  
ATOM   85   N N   . THR A 1 16  ? 10.103  13.379  -22.634 1.000 39.123 0 345 THR AAA N   1 ? 2  
ATOM   86   C CA  . THR A 1 16  ? 9.615   14.686  -22.128 1.000 42.089 0 345 THR AAA CA  1 ? 2  
ATOM   87   C C   . THR A 1 16  ? 9.674   15.716  -23.256 1.000 40.548 0 345 THR AAA C   1 ? 2  
ATOM   88   O O   . THR A 1 16  ? 8.689   16.460  -23.428 1.000 39.771 0 345 THR AAA O   1 ? 2  
ATOM   89   C CB  . THR A 1 16  ? 10.416  15.128  -20.904 1.000 46.198 0 345 THR AAA CB  1 ? 2  
ATOM   90   O OG1 . THR A 1 16  ? 10.079  14.172  -19.903 1.000 50.349 0 345 THR AAA OG1 1 ? 2  
ATOM   91   C CG2 . THR A 1 16  ? 10.099  16.539  -20.460 1.000 49.455 0 345 THR AAA CG2 1 ? 2  
ATOM   92   N N   . ARG A 1 17  ? 10.784  15.748  -23.991 1.000 38.928 0 346 ARG AAA N   1 ? 2  
ATOM   93   C CA  . ARG A 1 17  ? 11.020  16.727  -25.076 1.000 40.843 0 346 ARG AAA CA  1 ? 2  
ATOM   94   C C   . ARG A 1 17  ? 11.077  15.980  -26.406 1.000 33.325 0 346 ARG AAA C   1 ? 2  
ATOM   95   O O   . ARG A 1 17  ? 11.654  14.879  -26.458 1.000 34.023 0 346 ARG AAA O   1 ? 2  
ATOM   96   C CB  . ARG A 1 17  ? 12.308  17.512  -24.820 1.000 48.634 0 346 ARG AAA CB  1 ? 2  
ATOM   97   C CG  . ARG A 1 17  ? 12.563  17.814  -23.351 1.000 55.783 0 346 ARG AAA CG  1 ? 2  
ATOM   98   C CD  . ARG A 1 17  ? 13.951  18.367  -23.084 1.000 64.144 0 346 ARG AAA CD  1 ? 2  
ATOM   99   N NE  . ARG A 1 17  ? 14.345  18.235  -21.682 1.000 71.934 0 346 ARG AAA NE  1 ? 2  
ATOM   100  C CZ  . ARG A 1 17  ? 15.533  18.585  -21.186 1.000 81.453 0 346 ARG AAA CZ  1 ? 2  
ATOM   101  N NH1 . ARG A 1 17  ? 16.463  19.099  -21.976 1.000 85.607 0 346 ARG AAA NH1 1 ? 2  
ATOM   102  N NH2 . ARG A 1 17  ? 15.790  18.423  -19.897 1.000 85.212 0 346 ARG AAA NH2 1 ? 2  
ATOM   103  N N   . PHE A 1 18  ? 10.417  16.539  -27.408 1.000 30.045 0 347 PHE AAA N   1 ? 2  
ATOM   104  C CA  . PHE A 1 18  ? 10.472  16.058  -28.806 1.000 25.824 0 347 PHE AAA CA  1 ? 2  
ATOM   105  C C   . PHE A 1 18  ? 11.343  17.023  -29.606 1.000 24.403 0 347 PHE AAA C   1 ? 2  
ATOM   106  O O   . PHE A 1 18  ? 11.524  18.183  -29.190 1.000 24.459 0 347 PHE AAA O   1 ? 2  
ATOM   107  C CB  . PHE A 1 18  ? 9.066   15.917  -29.388 1.000 25.331 0 347 PHE AAA CB  1 ? 2  
ATOM   108  C CG  . PHE A 1 18  ? 8.470   14.535  -29.273 1.000 25.002 0 347 PHE AAA CG  1 ? 2  
ATOM   109  C CD1 . PHE A 1 18  ? 8.556   13.819  -28.086 1.000 25.703 0 347 PHE AAA CD1 1 ? 2  
ATOM   110  C CD2 . PHE A 1 18  ? 7.825   13.949  -30.352 1.000 23.765 0 347 PHE AAA CD2 1 ? 2  
ATOM   111  C CE1 . PHE A 1 18  ? 7.996   12.551  -27.985 1.000 25.853 0 347 PHE AAA CE1 1 ? 2  
ATOM   112  C CE2 . PHE A 1 18  ? 7.261   12.686  -30.245 1.000 24.182 0 347 PHE AAA CE2 1 ? 2  
ATOM   113  C CZ  . PHE A 1 18  ? 7.346   11.989  -29.058 1.000 25.496 0 347 PHE AAA CZ  1 ? 2  
ATOM   114  N N   . ALA A 1 19  ? 11.842  16.522  -30.730 1.000 23.429 0 348 ALA AAA N   1 ? 2  
ATOM   115  C CA  . ALA A 1 19  ? 12.653  17.261  -31.719 1.000 22.999 0 348 ALA AAA CA  1 ? 2  
ATOM   116  C C   . ALA A 1 19  ? 11.788  18.286  -32.457 1.000 22.229 0 348 ALA AAA C   1 ? 2  
ATOM   117  O O   . ALA A 1 19  ? 10.590  18.024  -32.709 1.000 21.083 0 348 ALA AAA O   1 ? 2  
ATOM   118  C CB  . ALA A 1 19  ? 13.252  16.299  -32.698 1.000 22.908 0 348 ALA AAA CB  1 ? 2  
ATOM   119  N N   . SER A 1 20  ? 12.402  19.388  -32.869 1.000 21.412 0 349 SER AAA N   1 ? 2  
ATOM   120  C CA  . SER A 1 20  ? 11.868  20.206  -33.984 1.000 21.348 0 349 SER AAA CA  1 ? 2  
ATOM   121  C C   . SER A 1 20  ? 11.850  19.331  -35.242 1.000 19.964 0 349 SER AAA C   1 ? 2  
ATOM   122  O O   . SER A 1 20  ? 12.786  18.531  -35.455 1.000 20.684 0 349 SER AAA O   1 ? 2  
ATOM   123  C CB  . SER A 1 20  ? 12.649  21.469  -34.207 1.000 19.855 0 349 SER AAA CB  1 ? 2  
ATOM   124  O OG  . SER A 1 20  ? 12.427  22.417  -33.190 1.000 20.646 0 349 SER AAA OG  1 ? 2  
ATOM   125  N N   . VAL A 1 21  ? 10.809  19.470  -36.056 1.000 19.444 0 350 VAL AAA N   1 ? 2  
ATOM   126  C CA  . VAL A 1 21  ? 10.614  18.646  -37.272 1.000 19.457 0 350 VAL AAA CA  1 ? 2  
ATOM   127  C C   . VAL A 1 21  ? 11.831  18.789  -38.194 1.000 18.632 0 350 VAL AAA C   1 ? 2  
ATOM   128  O O   . VAL A 1 21  ? 12.219  17.790  -38.795 1.000 18.492 0 350 VAL AAA O   1 ? 2  
ATOM   129  C CB  . VAL A 1 21  ? 9.283   18.984  -37.975 1.000 17.433 0 350 VAL AAA CB  1 ? 2  
ATOM   130  C CG1 . VAL A 1 21  ? 9.228   20.434  -38.466 1.000 16.630 0 350 VAL AAA CG1 1 ? 2  
ATOM   131  C CG2 . VAL A 1 21  ? 8.992   17.987  -39.082 1.000 18.060 0 350 VAL AAA CG2 1 ? 2  
ATOM   132  N N   . TYR A 1 22  ? 12.421  19.974  -38.341 1.000 19.402 0 351 TYR AAA N   1 ? 2  
ATOM   133  C CA  . TYR A 1 22  ? 13.567  20.125  -39.283 1.000 20.571 0 351 TYR AAA CA  1 ? 2  
ATOM   134  C C   . TYR A 1 22  ? 14.737  19.265  -38.787 1.000 19.758 0 351 TYR AAA C   1 ? 2  
ATOM   135  O O   . TYR A 1 22  ? 15.518  18.788  -39.621 1.000 20.497 0 351 TYR AAA O   1 ? 2  
ATOM   136  C CB  . TYR A 1 22  ? 13.971  21.588  -39.463 1.000 19.411 0 351 TYR AAA CB  1 ? 2  
ATOM   137  C CG  . TYR A 1 22  ? 14.932  22.102  -38.427 1.000 19.850 0 351 TYR AAA CG  1 ? 2  
ATOM   138  C CD1 . TYR A 1 22  ? 14.496  22.595  -37.215 1.000 20.167 0 351 TYR AAA CD1 1 ? 2  
ATOM   139  C CD2 . TYR A 1 22  ? 16.294  22.078  -38.673 1.000 20.694 0 351 TYR AAA CD2 1 ? 2  
ATOM   140  C CE1 . TYR A 1 22  ? 15.395  23.041  -36.257 1.000 20.907 0 351 TYR AAA CE1 1 ? 2  
ATOM   141  C CE2 . TYR A 1 22  ? 17.198  22.522  -37.735 1.000 22.979 0 351 TYR AAA CE2 1 ? 2  
ATOM   142  C CZ  . TYR A 1 22  ? 16.748  23.016  -36.526 1.000 22.664 0 351 TYR AAA CZ  1 ? 2  
ATOM   143  O OH  . TYR A 1 22  ? 17.653  23.449  -35.614 1.000 25.849 0 351 TYR AAA OH  1 ? 2  
ATOM   144  N N   . ALA A 1 23  ? 14.882  19.112  -37.462 1.000 20.836 0 352 ALA AAA N   1 ? 2  
ATOM   145  C CA  . ALA A 1 23  ? 15.975  18.341  -36.815 1.000 21.527 0 352 ALA AAA CA  1 ? 2  
ATOM   146  C C   . ALA A 1 23  ? 15.403  17.036  -36.237 1.000 21.535 0 352 ALA AAA C   1 ? 2  
ATOM   147  O O   . ALA A 1 23  ? 15.802  16.636  -35.101 1.000 24.054 0 352 ALA AAA O   1 ? 2  
ATOM   148  C CB  . ALA A 1 23  ? 16.654  19.181  -35.747 1.000 23.170 0 352 ALA AAA CB  1 ? 2  
ATOM   149  N N   . TRP A 1 24  ? 14.523  16.388  -36.992 1.000 19.585 0 353 TRP AAA N   1 ? 2  
ATOM   150  C CA  . TRP A 1 24  ? 13.744  15.203  -36.533 1.000 20.948 0 353 TRP AAA CA  1 ? 2  
ATOM   151  C C   . TRP A 1 24  ? 14.666  14.123  -35.937 1.000 22.380 0 353 TRP AAA C   1 ? 2  
ATOM   152  O O   . TRP A 1 24  ? 15.787  13.883  -36.459 1.000 21.949 0 353 TRP AAA O   1 ? 2  
ATOM   153  C CB  . TRP A 1 24  ? 12.856  14.683  -37.649 1.000 21.153 0 353 TRP AAA CB  1 ? 2  
ATOM   154  C CG  . TRP A 1 24  ? 13.518  14.378  -38.955 1.000 19.533 0 353 TRP AAA CG  1 ? 2  
ATOM   155  C CD1 . TRP A 1 24  ? 13.631  15.211  -40.031 1.000 20.897 0 353 TRP AAA CD1 1 ? 2  
ATOM   156  C CD2 . TRP A 1 24  ? 14.059  13.114  -39.365 1.000 20.158 0 353 TRP AAA CD2 1 ? 2  
ATOM   157  N NE1 . TRP A 1 24  ? 14.209  14.550  -41.074 1.000 19.786 0 353 TRP AAA NE1 1 ? 2  
ATOM   158  C CE2 . TRP A 1 24  ? 14.506  13.274  -40.694 1.000 21.131 0 353 TRP AAA CE2 1 ? 2  
ATOM   159  C CE3 . TRP A 1 24  ? 14.215  11.866  -38.746 1.000 21.144 0 353 TRP AAA CE3 1 ? 2  
ATOM   160  C CZ2 . TRP A 1 24  ? 15.073  12.231  -41.422 1.000 22.811 0 353 TRP AAA CZ2 1 ? 2  
ATOM   161  C CZ3 . TRP A 1 24  ? 14.775  10.829  -39.467 1.000 22.313 0 353 TRP AAA CZ3 1 ? 2  
ATOM   162  C CH2 . TRP A 1 24  ? 15.193  11.009  -40.788 1.000 22.783 0 353 TRP AAA CH2 1 ? 2  
ATOM   163  N N   . ASN A 1 25  ? 14.243  13.548  -34.810 1.000 21.834 0 354 ASN AAA N   1 ? 2  
ATOM   164  C CA  . ASN A 1 25  ? 15.003  12.510  -34.082 1.000 23.742 0 354 ASN AAA CA  1 ? 2  
ATOM   165  C C   . ASN A 1 25  ? 14.752  11.152  -34.736 1.000 23.443 0 354 ASN AAA C   1 ? 2  
ATOM   166  O O   . ASN A 1 25  ? 13.589  10.868  -35.095 1.000 22.050 0 354 ASN AAA O   1 ? 2  
ATOM   167  C CB  . ASN A 1 25  ? 14.600  12.436  -32.621 1.000 25.895 0 354 ASN AAA CB  1 ? 2  
ATOM   168  C CG  . ASN A 1 25  ? 15.577  11.606  -31.817 1.000 34.014 0 354 ASN AAA CG  1 ? 2  
ATOM   169  O OD1 . ASN A 1 25  ? 16.671  12.077  -31.503 1.000 40.706 0 354 ASN AAA OD1 1 ? 2  
ATOM   170  N ND2 . ASN A 1 25  ? 15.217  10.364  -31.522 1.000 33.729 0 354 ASN AAA ND2 1 ? 2  
ATOM   171  N N   . ARG A 1 26  ? 15.792  10.338  -34.848 1.000 25.060 0 355 ARG AAA N   1 ? 2  
ATOM   172  C CA  . ARG A 1 26  ? 15.663  8.916   -35.247 1.000 26.333 0 355 ARG AAA CA  1 ? 2  
ATOM   173  C C   . ARG A 1 26  ? 16.246  8.017   -34.159 1.000 28.472 0 355 ARG AAA C   1 ? 2  
ATOM   174  O O   . ARG A 1 26  ? 17.397  8.234   -33.765 1.000 30.087 0 355 ARG AAA O   1 ? 2  
ATOM   175  C CB  . ARG A 1 26  ? 16.384  8.635   -36.561 1.000 27.477 0 355 ARG AAA CB  1 ? 2  
ATOM   176  C CG  . ARG A 1 26  ? 16.420  7.155   -36.901 1.000 28.080 0 355 ARG AAA CG  1 ? 2  
ATOM   177  C CD  . ARG A 1 26  ? 16.699  6.911   -38.358 1.000 30.220 0 355 ARG AAA CD  1 ? 2  
ATOM   178  N NE  . ARG A 1 26  ? 15.498  7.117   -39.146 1.000 28.305 0 355 ARG AAA NE  1 ? 2  
ATOM   179  C CZ  . ARG A 1 26  ? 15.367  6.772   -40.421 1.000 30.015 0 355 ARG AAA CZ  1 ? 2  
ATOM   180  N NH1 . ARG A 1 26  ? 16.373  6.203   -41.065 1.000 34.082 0 355 ARG AAA NH1 1 ? 2  
ATOM   181  N NH2 . ARG A 1 26  ? 14.232  6.989   -41.051 1.000 30.271 0 355 ARG AAA NH2 1 ? 2  
ATOM   182  N N   . LYS A 1 27  ? 15.471  7.031   -33.711 1.000 28.677 0 356 LYS AAA N   1 ? 2  
ATOM   183  C CA  . LYS A 1 27  ? 15.966  5.970   -32.806 1.000 30.681 0 356 LYS AAA CA  1 ? 2  
ATOM   184  C C   . LYS A 1 27  ? 15.846  4.631   -33.532 1.000 29.523 0 356 LYS AAA C   1 ? 2  
ATOM   185  O O   . LYS A 1 27  ? 14.767  4.330   -34.063 1.000 29.479 0 356 LYS AAA O   1 ? 2  
ATOM   186  C CB  . LYS A 1 27  ? 15.207  5.936   -31.477 1.000 33.435 0 356 LYS AAA CB  1 ? 2  
ATOM   187  C CG  . LYS A 1 27  ? 15.720  4.850   -30.536 1.000 36.498 0 356 LYS AAA CG  1 ? 2  
ATOM   188  C CD  . LYS A 1 27  ? 15.402  5.027   -29.079 1.000 40.476 0 356 LYS AAA CD  1 ? 2  
ATOM   189  C CE  . LYS A 1 27  ? 16.049  3.958   -28.219 1.000 44.314 0 356 LYS AAA CE  1 ? 2  
ATOM   190  N NZ  . LYS A 1 27  ? 17.493  4.212   -27.997 1.000 48.412 0 356 LYS AAA NZ  1 ? 2  
ATOM   191  N N   . ARG A 1 28  ? 16.941  3.886   -33.599 1.000 30.829 0 357 ARG AAA N   1 ? 2  
ATOM   192  C CA  . ARG A 1 28  ? 16.943  2.525   -34.190 1.000 32.176 0 357 ARG AAA CA  1 ? 2  
ATOM   193  C C   . ARG A 1 28  ? 16.532  1.552   -33.089 1.000 33.245 0 357 ARG AAA C   1 ? 2  
ATOM   194  O O   . ARG A 1 28  ? 17.137  1.593   -31.987 1.000 34.128 0 357 ARG AAA O   1 ? 2  
ATOM   195  C CB  . ARG A 1 28  ? 18.300  2.170   -34.799 1.000 35.205 0 357 ARG AAA CB  1 ? 2  
ATOM   196  C CG  . ARG A 1 28  ? 18.314  0.827   -35.529 1.000 38.055 0 357 ARG AAA CG  1 ? 2  
ATOM   197  C CD  . ARG A 1 28  ? 19.673  0.514   -36.116 1.000 40.952 0 357 ARG AAA CD  1 ? 2  
ATOM   198  N NE  . ARG A 1 28  ? 20.656  0.473   -35.045 1.000 43.740 0 357 ARG AAA NE  1 ? 2  
ATOM   199  C CZ  . ARG A 1 28  ? 20.840  -0.555  -34.227 1.000 48.588 0 357 ARG AAA CZ  1 ? 2  
ATOM   200  N NH1 . ARG A 1 28  ? 20.132  -1.664  -34.372 1.000 51.658 0 357 ARG AAA NH1 1 ? 2  
ATOM   201  N NH2 . ARG A 1 28  ? 21.758  -0.481  -33.281 1.000 51.224 0 357 ARG AAA NH2 1 ? 2  
ATOM   202  N N   . ILE A 1 29  ? 15.516  0.741   -33.378 1.000 32.333 0 358 ILE AAA N   1 ? 2  
ATOM   203  C CA  . ILE A 1 29  ? 14.969  -0.303  -32.469 1.000 34.062 0 358 ILE AAA CA  1 ? 2  
ATOM   204  C C   . ILE A 1 29  ? 15.404  -1.665  -33.021 1.000 33.978 0 358 ILE AAA C   1 ? 2  
ATOM   205  O O   . ILE A 1 29  ? 15.136  -1.941  -34.219 1.000 32.675 0 358 ILE AAA O   1 ? 2  
ATOM   206  C CB  . ILE A 1 29  ? 13.436  -0.180  -32.366 1.000 35.043 0 358 ILE AAA CB  1 ? 2  
ATOM   207  C CG1 . ILE A 1 29  ? 12.983  1.210   -31.910 1.000 37.524 0 358 ILE AAA CG1 1 ? 2  
ATOM   208  C CG2 . ILE A 1 29  ? 12.884  -1.275  -31.464 1.000 36.610 0 358 ILE AAA CG2 1 ? 2  
ATOM   209  C CD1 . ILE A 1 29  ? 13.144  1.461   -30.437 1.000 38.897 0 358 ILE AAA CD1 1 ? 2  
ATOM   210  N N   . SER A 1 30  ? 16.076  -2.483  -32.211 1.000 36.238 0 359 SER AAA N   1 ? 2  
ATOM   211  C CA  . SER A 1 30  ? 16.541  -3.823  -32.653 1.000 38.370 0 359 SER AAA CA  1 ? 2  
ATOM   212  C C   . SER A 1 30  ? 16.706  -4.771  -31.463 1.000 38.803 0 359 SER AAA C   1 ? 2  
ATOM   213  O O   . SER A 1 30  ? 16.738  -4.295  -30.309 1.000 37.769 0 359 SER AAA O   1 ? 2  
ATOM   214  C CB  . SER A 1 30  ? 17.805  -3.727  -33.459 1.000 42.803 0 359 SER AAA CB  1 ? 2  
ATOM   215  O OG  . SER A 1 30  ? 18.937  -3.625  -32.616 1.000 49.403 0 359 SER AAA OG  1 ? 2  
ATOM   216  N N   . ASN A 1 31  ? 16.778  -6.065  -31.763 1.000 39.463 0 360 ASN AAA N   1 ? 2  
ATOM   217  C CA  . ASN A 1 31  ? 17.081  -7.138  -30.780 1.000 42.305 0 360 ASN AAA CA  1 ? 2  
ATOM   218  C C   . ASN A 1 31  ? 16.119  -7.024  -29.596 1.000 40.134 0 360 ASN AAA C   1 ? 2  
ATOM   219  O O   . ASN A 1 31  ? 16.591  -6.940  -28.444 1.000 41.347 0 360 ASN AAA O   1 ? 2  
ATOM   220  C CB  . ASN A 1 31  ? 18.528  -7.054  -30.299 1.000 46.295 0 360 ASN AAA CB  1 ? 2  
ATOM   221  C CG  . ASN A 1 31  ? 19.515  -7.285  -31.418 1.000 50.238 0 360 ASN AAA CG  1 ? 2  
ATOM   222  O OD1 . ASN A 1 31  ? 19.781  -8.429  -31.787 1.000 57.983 0 360 ASN AAA OD1 1 ? 2  
ATOM   223  N ND2 . ASN A 1 31  ? 20.093  -6.216  -31.930 1.000 52.411 0 360 ASN AAA ND2 1 ? 2  
ATOM   224  N N   . CYS A 1 32  ? 14.811  -6.989  -29.875 1.000 37.681 0 361 CYS AAA N   1 ? 2  
ATOM   225  C CA  . CYS A 1 32  ? 13.802  -6.778  -28.815 1.000 37.212 0 361 CYS AAA CA  1 ? 2  
ATOM   226  C C   . CYS A 1 32  ? 12.422  -7.257  -29.259 1.000 36.830 0 361 CYS AAA C   1 ? 2  
ATOM   227  O O   . CYS A 1 32  ? 12.194  -7.453  -30.473 1.000 37.169 0 361 CYS AAA O   1 ? 2  
ATOM   228  C CB  . CYS A 1 32  ? 13.785  -5.313  -28.397 1.000 36.755 0 361 CYS AAA CB  1 ? 2  
ATOM   229  S SG  . CYS A 1 32  ? 13.413  -4.162  -29.746 1.000 34.613 0 361 CYS AAA SG  1 ? 2  
ATOM   230  N N   . VAL A 1 33  ? 11.546  -7.434  -28.276 1.000 38.287 0 362 VAL AAA N   1 ? 2  
ATOM   231  C CA  . VAL A 1 33  ? 10.127  -7.849  -28.457 1.000 39.972 0 362 VAL AAA CA  1 ? 2  
ATOM   232  C C   . VAL A 1 33  ? 9.257   -6.598  -28.295 1.000 39.027 0 362 VAL AAA C   1 ? 2  
ATOM   233  O O   . VAL A 1 33  ? 9.437   -5.869  -27.303 1.000 38.612 0 362 VAL AAA O   1 ? 2  
ATOM   234  C CB  . VAL A 1 33  ? 9.742   -8.974  -27.475 1.000 44.309 0 362 VAL AAA CB  1 ? 2  
ATOM   235  C CG1 . VAL A 1 33  ? 10.257  -8.723  -26.071 1.000 47.452 0 362 VAL AAA CG1 1 ? 2  
ATOM   236  C CG2 . VAL A 1 33  ? 8.248   -9.218  -27.437 1.000 45.261 0 362 VAL AAA CG2 1 ? 2  
ATOM   237  N N   . ALA A 1 34  ? 8.361   -6.365  -29.249 1.000 44.151 0 363 ALA AAA N   1 ? 3  
ATOM   238  C CA  . ALA A 1 34  ? 7.468   -5.188  -29.316 1.000 45.686 0 363 ALA AAA CA  1 ? 3  
ATOM   239  C C   . ALA A 1 34  ? 6.011   -5.658  -29.292 1.000 45.617 0 363 ALA AAA C   1 ? 3  
ATOM   240  O O   . ALA A 1 34  ? 5.668   -6.487  -30.139 1.000 41.637 0 363 ALA AAA O   1 ? 3  
ATOM   241  C CB  . ALA A 1 34  ? 7.766   -4.412  -30.576 1.000 45.570 0 363 ALA AAA CB  1 ? 3  
ATOM   242  N N   . ASP A 1 35  ? 5.189   -5.129  -28.379 1.000 47.724 0 364 ASP AAA N   1 ? 3  
ATOM   243  C CA  . ASP A 1 35  ? 3.715   -5.327  -28.407 1.000 47.617 0 364 ASP AAA CA  1 ? 3  
ATOM   244  C C   . ASP A 1 35  ? 3.081   -4.127  -29.130 1.000 44.662 0 364 ASP AAA C   1 ? 3  
ATOM   245  O O   . ASP A 1 35  ? 2.664   -3.160  -28.454 1.000 46.224 0 364 ASP AAA O   1 ? 3  
ATOM   246  C CB  . ASP A 1 35  ? 3.144   -5.558  -27.009 1.000 49.777 0 364 ASP AAA CB  1 ? 3  
ATOM   247  C CG  . ASP A 1 35  ? 1.681   -5.964  -27.022 1.000 51.986 0 364 ASP AAA CG  1 ? 3  
ATOM   248  O OD1 . ASP A 1 35  ? 1.047   -5.860  -28.097 1.000 50.926 0 364 ASP AAA OD1 1 ? 3  
ATOM   249  O OD2 . ASP A 1 35  ? 1.175   -6.344  -25.955 1.000 59.025 0 364 ASP AAA OD2 1 ? 3  
ATOM   250  N N   . TYR A 1 36  ? 3.000   -4.205  -30.457 1.000 41.034 0 365 TYR AAA N   1 ? 3  
ATOM   251  C CA  . TYR A 1 36  ? 2.419   -3.163  -31.342 1.000 39.234 0 365 TYR AAA CA  1 ? 3  
ATOM   252  C C   . TYR A 1 36  ? 0.914   -3.040  -31.093 1.000 40.632 0 365 TYR AAA C   1 ? 3  
ATOM   253  O O   . TYR A 1 36  ? 0.374   -1.923  -31.218 1.000 39.194 0 365 TYR AAA O   1 ? 3  
ATOM   254  C CB  . TYR A 1 36  ? 2.666   -3.488  -32.816 1.000 37.086 0 365 TYR AAA CB  1 ? 3  
ATOM   255  C CG  . TYR A 1 36  ? 4.117   -3.539  -33.202 1.000 36.961 0 365 TYR AAA CG  1 ? 3  
ATOM   256  C CD1 . TYR A 1 36  ? 4.832   -2.381  -33.453 1.000 36.112 0 365 TYR AAA CD1 1 ? 3  
ATOM   257  C CD2 . TYR A 1 36  ? 4.780   -4.749  -33.324 1.000 38.190 0 365 TYR AAA CD2 1 ? 3  
ATOM   258  C CE1 . TYR A 1 36  ? 6.168   -2.423  -33.809 1.000 36.076 0 365 TYR AAA CE1 1 ? 3  
ATOM   259  C CE2 . TYR A 1 36  ? 6.116   -4.811  -33.681 1.000 39.124 0 365 TYR AAA CE2 1 ? 3  
ATOM   260  C CZ  . TYR A 1 36  ? 6.811   -3.643  -33.932 1.000 39.538 0 365 TYR AAA CZ  1 ? 3  
ATOM   261  O OH  . TYR A 1 36  ? 8.130   -3.698  -34.275 1.000 42.549 0 365 TYR AAA OH  1 ? 3  
ATOM   262  N N   . SER A 1 37  ? 0.250   -4.149  -30.775 1.000 41.619 0 366 SER AAA N   1 ? 3  
ATOM   263  C CA  . SER A 1 37  ? -1.224  -4.211  -30.590 1.000 44.166 0 366 SER AAA CA  1 ? 3  
ATOM   264  C C   . SER A 1 37  ? -1.645  -3.258  -29.473 1.000 44.287 0 366 SER AAA C   1 ? 3  
ATOM   265  O O   . SER A 1 37  ? -2.701  -2.619  -29.625 1.000 44.703 0 366 SER AAA O   1 ? 3  
ATOM   266  C CB  . SER A 1 37  ? -1.710  -5.611  -30.332 1.000 46.432 0 366 SER AAA CB  1 ? 3  
ATOM   267  O OG  . SER A 1 37  ? -1.625  -6.371  -31.526 1.000 48.472 0 366 SER AAA OG  1 ? 3  
ATOM   268  N N   . VAL A 1 38  ? -0.844  -3.153  -28.410 1.000 45.504 0 367 VAL AAA N   1 ? 3  
ATOM   269  C CA  . VAL A 1 38  ? -1.154  -2.274  -27.246 1.000 47.266 0 367 VAL AAA CA  1 ? 3  
ATOM   270  C C   . VAL A 1 38  ? -1.064  -0.805  -27.696 1.000 44.929 0 367 VAL AAA C   1 ? 3  
ATOM   271  O O   . VAL A 1 38  ? -1.907  -0.008  -27.249 1.000 43.850 0 367 VAL AAA O   1 ? 3  
ATOM   272  C CB  . VAL A 1 38  ? -0.261  -2.601  -26.031 1.000 51.273 0 367 VAL AAA CB  1 ? 3  
ATOM   273  C CG1 . VAL A 1 38  ? 1.153   -2.068  -26.167 1.000 51.963 0 367 VAL AAA CG1 1 ? 3  
ATOM   274  C CG2 . VAL A 1 38  ? -0.887  -2.107  -24.737 1.000 55.800 0 367 VAL AAA CG2 1 ? 3  
ATOM   275  N N   . LEU A 1 39  ? -0.119  -0.455  -28.578 1.000 40.739 0 368 LEU AAA N   1 ? 3  
ATOM   276  C CA  . LEU A 1 39  ? -0.055  0.900   -29.201 1.000 39.611 0 368 LEU AAA CA  1 ? 3  
ATOM   277  C C   . LEU A 1 39  ? -1.273  1.080   -30.110 1.000 38.530 0 368 LEU AAA C   1 ? 3  
ATOM   278  O O   . LEU A 1 39  ? -1.953  2.095   -29.995 1.000 37.443 0 368 LEU AAA O   1 ? 3  
ATOM   279  C CB  . LEU A 1 39  ? 1.234   1.071   -30.011 1.000 38.598 0 368 LEU AAA CB  1 ? 3  
ATOM   280  C CG  . LEU A 1 39  ? 2.540   1.025   -29.226 1.000 40.606 0 368 LEU AAA CG  1 ? 3  
ATOM   281  C CD1 . LEU A 1 39  ? 3.729   1.028   -30.173 1.000 40.277 0 368 LEU AAA CD1 1 ? 3  
ATOM   282  C CD2 . LEU A 1 39  ? 2.631   2.185   -28.257 1.000 42.434 0 368 LEU AAA CD2 1 ? 3  
ATOM   283  N N   . TYR A 1 40  ? -1.545  0.119   -30.985 1.000 39.006 0 369 TYR AAA N   1 ? 3  
ATOM   284  C CA  . TYR A 1 40  ? -2.581  0.252   -32.043 1.000 40.338 0 369 TYR AAA CA  1 ? 3  
ATOM   285  C C   . TYR A 1 40  ? -3.971  0.366   -31.399 1.000 43.275 0 369 TYR AAA C   1 ? 3  
ATOM   286  O O   . TYR A 1 40  ? -4.823  1.078   -31.944 1.000 43.240 0 369 TYR AAA O   1 ? 3  
ATOM   287  C CB  . TYR A 1 40  ? -2.515  -0.925  -33.023 1.000 42.424 0 369 TYR AAA CB  1 ? 3  
ATOM   288  C CG  . TYR A 1 40  ? -3.516  -0.863  -34.150 1.000 43.227 0 369 TYR AAA CG  1 ? 3  
ATOM   289  C CD1 . TYR A 1 40  ? -3.663  0.281   -34.919 1.000 42.591 0 369 TYR AAA CD1 1 ? 3  
ATOM   290  C CD2 . TYR A 1 40  ? -4.308  -1.956  -34.460 1.000 46.386 0 369 TYR AAA CD2 1 ? 3  
ATOM   291  C CE1 . TYR A 1 40  ? -4.584  0.351   -35.949 1.000 44.160 0 369 TYR AAA CE1 1 ? 3  
ATOM   292  C CE2 . TYR A 1 40  ? -5.229  -1.913  -35.497 1.000 49.329 0 369 TYR AAA CE2 1 ? 3  
ATOM   293  C CZ  . TYR A 1 40  ? -5.370  -0.752  -36.241 1.000 49.496 0 369 TYR AAA CZ  1 ? 3  
ATOM   294  O OH  . TYR A 1 40  ? -6.272  -0.707  -37.263 1.000 56.544 0 369 TYR AAA OH  1 ? 3  
ATOM   295  N N   . ASN A 1 41  ? -4.196  -0.313  -30.272 1.000 45.326 0 370 ASN AAA N   1 ? 3  
ATOM   296  C CA  . ASN A 1 41  ? -5.523  -0.352  -29.597 1.000 49.969 0 370 ASN AAA CA  1 ? 3  
ATOM   297  C C   . ASN A 1 41  ? -5.590  0.710   -28.491 1.000 52.135 0 370 ASN AAA C   1 ? 3  
ATOM   298  O O   . ASN A 1 41  ? -6.616  0.757   -27.795 1.000 58.320 0 370 ASN AAA O   1 ? 3  
ATOM   299  C CB  . ASN A 1 41  ? -5.843  -1.763  -29.101 1.000 52.663 0 370 ASN AAA CB  1 ? 3  
ATOM   300  C CG  . ASN A 1 41  ? -5.946  -2.758  -30.238 1.000 53.321 0 370 ASN AAA CG  1 ? 3  
ATOM   301  O OD1 . ASN A 1 41  ? -6.408  -2.430  -31.330 1.000 52.804 0 370 ASN AAA OD1 1 ? 3  
ATOM   302  N ND2 . ASN A 1 41  ? -5.506  -3.980  -29.995 1.000 56.219 0 370 ASN AAA ND2 1 ? 3  
ATOM   303  N N   . SER A 1 42  ? -4.559  1.547   -28.353 1.000 52.513 0 371 SER AAA N   1 ? 3  
ATOM   304  C CA  . SER A 1 42  ? -4.523  2.713   -27.431 1.000 53.088 0 371 SER AAA CA  1 ? 3  
ATOM   305  C C   . SER A 1 42  ? -5.530  3.769   -27.894 1.000 54.258 0 371 SER AAA C   1 ? 3  
ATOM   306  O O   . SER A 1 42  ? -5.566  4.061   -29.104 1.000 59.979 0 371 SER AAA O   1 ? 3  
ATOM   307  C CB  . SER A 1 42  ? -3.138  3.321   -27.367 1.000 50.917 0 371 SER AAA CB  1 ? 3  
ATOM   308  O OG  . SER A 1 42  ? -3.077  4.337   -26.382 1.000 54.409 0 371 SER AAA OG  1 ? 3  
ATOM   309  N N   . ALA A 1 43  ? -6.247  4.390   -26.958 1.000 52.038 0 372 ALA AAA N   1 ? 3  
ATOM   310  C CA  . ALA A 1 43  ? -7.101  5.576   -27.209 1.000 51.299 0 372 ALA AAA CA  1 ? 3  
ATOM   311  C C   . ALA A 1 43  ? -6.248  6.855   -27.201 1.000 48.210 0 372 ALA AAA C   1 ? 3  
ATOM   312  O O   . ALA A 1 43  ? -6.804  7.937   -27.413 1.000 46.507 0 372 ALA AAA O   1 ? 3  
ATOM   313  C CB  . ALA A 1 43  ? -8.203  5.642   -26.174 1.000 53.904 0 372 ALA AAA CB  1 ? 3  
ATOM   314  N N   . SER A 1 44  ? -4.938  6.744   -26.963 1.000 47.589 0 373 SER AAA N   1 ? 3  
ATOM   315  C CA  . SER A 1 44  ? -4.008  7.897   -26.817 1.000 47.141 0 373 SER AAA CA  1 ? 3  
ATOM   316  C C   . SER A 1 44  ? -3.748  8.582   -28.168 1.000 41.956 0 373 SER AAA C   1 ? 3  
ATOM   317  O O   . SER A 1 44  ? -3.328  9.741   -28.143 1.000 42.428 0 373 SER AAA O   1 ? 3  
ATOM   318  C CB  . SER A 1 44  ? -2.706  7.473   -26.188 1.000 49.211 0 373 SER AAA CB  1 ? 3  
ATOM   319  O OG  . SER A 1 44  ? -2.892  7.088   -24.837 1.000 55.047 0 373 SER AAA OG  1 ? 3  
ATOM   320  N N   . PHE A 1 45  ? -3.970  7.905   -29.299 1.000 39.608 0 374 PHE AAA N   1 ? 3  
ATOM   321  C CA  . PHE A 1 45  ? -3.502  8.366   -30.635 1.000 36.291 0 374 PHE AAA CA  1 ? 3  
ATOM   322  C C   . PHE A 1 45  ? -4.680  8.802   -31.507 1.000 37.560 0 374 PHE AAA C   1 ? 3  
ATOM   323  O O   . PHE A 1 45  ? -5.646  8.036   -31.644 1.000 37.945 0 374 PHE AAA O   1 ? 3  
ATOM   324  C CB  . PHE A 1 45  ? -2.695  7.266   -31.321 1.000 34.419 0 374 PHE AAA CB  1 ? 3  
ATOM   325  C CG  . PHE A 1 45  ? -1.536  6.790   -30.490 1.000 32.692 0 374 PHE AAA CG  1 ? 3  
ATOM   326  C CD1 . PHE A 1 45  ? -0.574  7.686   -30.044 1.000 31.482 0 374 PHE AAA CD1 1 ? 3  
ATOM   327  C CD2 . PHE A 1 45  ? -1.406  5.453   -30.151 1.000 31.322 0 374 PHE AAA CD2 1 ? 3  
ATOM   328  C CE1 . PHE A 1 45  ? 0.493   7.248   -29.273 1.000 31.123 0 374 PHE AAA CE1 1 ? 3  
ATOM   329  C CE2 . PHE A 1 45  ? -0.344  5.023   -29.373 1.000 31.576 0 374 PHE AAA CE2 1 ? 3  
ATOM   330  C CZ  . PHE A 1 45  ? 0.611   5.916   -28.943 1.000 31.833 0 374 PHE AAA CZ  1 ? 3  
ATOM   331  N N   . SER A 1 46  ? -4.587  9.996   -32.101 1.000 36.521 0 375 SER AAA N   1 ? 3  
ATOM   332  C CA  . SER A 1 46  ? -5.617  10.529  -33.031 1.000 36.861 0 375 SER AAA CA  1 ? 3  
ATOM   333  C C   . SER A 1 46  ? -5.301  10.099  -34.467 1.000 36.118 0 375 SER AAA C   1 ? 3  
ATOM   334  O O   . SER A 1 46  ? -6.235  10.092  -35.280 1.000 36.329 0 375 SER AAA O   1 ? 3  
ATOM   335  C CB  . SER A 1 46  ? -5.757  12.011  -32.917 1.000 37.325 0 375 SER AAA CB  1 ? 3  
ATOM   336  O OG  . SER A 1 46  ? -4.498  12.644  -32.985 1.000 36.332 0 375 SER AAA OG  1 ? 3  
ATOM   337  N N   . THR A 1 47  ? -4.039  9.769   -34.765 1.000 34.386 0 376 THR AAA N   1 ? 3  
ATOM   338  C CA  . THR A 1 47  ? -3.603  9.175   -36.056 1.000 33.530 0 376 THR AAA CA  1 ? 3  
ATOM   339  C C   . THR A 1 47  ? -2.835  7.884   -35.773 1.000 32.859 0 376 THR AAA C   1 ? 3  
ATOM   340  O O   . THR A 1 47  ? -1.934  7.890   -34.915 1.000 31.096 0 376 THR AAA O   1 ? 3  
ATOM   341  C CB  . THR A 1 47  ? -2.736  10.148  -36.872 1.000 32.783 0 376 THR AAA CB  1 ? 3  
ATOM   342  O OG1 . THR A 1 47  ? -3.543  11.276  -37.208 1.000 32.211 0 376 THR AAA OG1 1 ? 3  
ATOM   343  C CG2 . THR A 1 47  ? -2.175  9.532   -38.137 1.000 31.675 0 376 THR AAA CG2 1 ? 3  
ATOM   344  N N   . PHE A 1 48  ? -3.180  6.814   -36.476 1.000 33.841 0 377 PHE AAA N   1 ? 3  
ATOM   345  C CA  . PHE A 1 48  ? -2.418  5.545   -36.486 1.000 34.304 0 377 PHE AAA CA  1 ? 3  
ATOM   346  C C   . PHE A 1 48  ? -2.675  4.903   -37.845 1.000 35.259 0 377 PHE AAA C   1 ? 3  
ATOM   347  O O   . PHE A 1 48  ? -3.628  4.112   -37.957 1.000 33.763 0 377 PHE AAA O   1 ? 3  
ATOM   348  C CB  . PHE A 1 48  ? -2.817  4.647   -35.306 1.000 35.296 0 377 PHE AAA CB  1 ? 3  
ATOM   349  C CG  . PHE A 1 48  ? -1.748  3.656   -34.914 1.000 35.598 0 377 PHE AAA CG  1 ? 3  
ATOM   350  C CD1 . PHE A 1 48  ? -1.231  2.764   -35.841 1.000 35.218 0 377 PHE AAA CD1 1 ? 3  
ATOM   351  C CD2 . PHE A 1 48  ? -1.247  3.622   -33.621 1.000 35.579 0 377 PHE AAA CD2 1 ? 3  
ATOM   352  C CE1 . PHE A 1 48  ? -0.225  1.880   -35.493 1.000 34.462 0 377 PHE AAA CE1 1 ? 3  
ATOM   353  C CE2 . PHE A 1 48  ? -0.257  2.719   -33.272 1.000 36.173 0 377 PHE AAA CE2 1 ? 3  
ATOM   354  C CZ  . PHE A 1 48  ? 0.254   1.852   -34.206 1.000 34.892 0 377 PHE AAA CZ  1 ? 3  
ATOM   355  N N   . LYS A 1 49  ? -1.881  5.291   -38.846 1.000 34.201 0 378 LYS AAA N   1 ? 3  
ATOM   356  C CA  . LYS A 1 49  ? -2.081  4.913   -40.270 1.000 36.776 0 378 LYS AAA CA  1 ? 3  
ATOM   357  C C   . LYS A 1 49  ? -0.857  4.130   -40.731 1.000 34.950 0 378 LYS AAA C   1 ? 3  
ATOM   358  O O   . LYS A 1 49  ? 0.265   4.652   -40.624 1.000 31.701 0 378 LYS AAA O   1 ? 3  
ATOM   359  C CB  . LYS A 1 49  ? -2.332  6.152   -41.132 1.000 42.028 0 378 LYS AAA CB  1 ? 3  
ATOM   360  C CG  . LYS A 1 49  ? -3.611  6.900   -40.776 1.000 49.032 0 378 LYS AAA CG  1 ? 3  
ATOM   361  C CD  . LYS A 1 49  ? -3.886  8.151   -41.579 1.000 53.828 0 378 LYS AAA CD  1 ? 3  
ATOM   362  C CE  . LYS A 1 49  ? -5.269  8.709   -41.306 1.000 56.614 0 378 LYS AAA CE  1 ? 3  
ATOM   363  N NZ  . LYS A 1 49  ? -5.530  9.952   -42.072 1.000 60.299 0 378 LYS AAA NZ  1 ? 3  
ATOM   364  N N   . CYS A 1 50  ? -1.063  2.901   -41.196 1.000 33.074 0 379 CYS AAA N   1 ? 3  
ATOM   365  C CA  . CYS A 1 50  ? 0.041   2.020   -41.632 1.000 33.315 0 379 CYS AAA CA  1 ? 3  
ATOM   366  C C   . CYS A 1 50  ? 0.002   1.899   -43.157 1.000 33.431 0 379 CYS AAA C   1 ? 3  
ATOM   367  O O   . CYS A 1 50  ? -1.091  1.998   -43.749 1.000 33.444 0 379 CYS AAA O   1 ? 3  
ATOM   368  C CB  . CYS A 1 50  ? -0.001  0.674   -40.919 1.000 36.020 0 379 CYS AAA CB  1 ? 3  
ATOM   369  S SG  . CYS A 1 50  ? 0.132   0.827   -39.114 1.000 39.756 0 379 CYS AAA SG  1 ? 3  
ATOM   370  N N   . TYR A 1 51  ? 1.186   1.739   -43.740 1.000 32.486 0 380 TYR AAA N   1 ? 3  
ATOM   371  C CA  . TYR A 1 51  ? 1.440   1.627   -45.197 1.000 34.375 0 380 TYR AAA CA  1 ? 3  
ATOM   372  C C   . TYR A 1 51  ? 2.326   0.398   -45.431 1.000 35.028 0 380 TYR AAA C   1 ? 3  
ATOM   373  O O   . TYR A 1 51  ? 3.347   0.238   -44.730 1.000 34.879 0 380 TYR AAA O   1 ? 3  
ATOM   374  C CB  . TYR A 1 51  ? 2.087   2.928   -45.685 1.000 33.948 0 380 TYR AAA CB  1 ? 3  
ATOM   375  C CG  . TYR A 1 51  ? 1.289   4.171   -45.394 1.000 33.838 0 380 TYR AAA CG  1 ? 3  
ATOM   376  C CD1 . TYR A 1 51  ? 0.344   4.638   -46.295 1.000 34.912 0 380 TYR AAA CD1 1 ? 3  
ATOM   377  C CD2 . TYR A 1 51  ? 1.457   4.875   -44.209 1.000 32.700 0 380 TYR AAA CD2 1 ? 3  
ATOM   378  C CE1 . TYR A 1 51  ? -0.401  5.778   -46.039 1.000 35.112 0 380 TYR AAA CE1 1 ? 3  
ATOM   379  C CE2 . TYR A 1 51  ? 0.726   6.022   -43.944 1.000 32.522 0 380 TYR AAA CE2 1 ? 3  
ATOM   380  C CZ  . TYR A 1 51  ? -0.210  6.473   -44.857 1.000 33.989 0 380 TYR AAA CZ  1 ? 3  
ATOM   381  O OH  . TYR A 1 51  ? -0.938  7.595   -44.590 1.000 36.599 0 380 TYR AAA OH  1 ? 3  
ATOM   382  N N   . GLY A 1 52  ? 1.935   -0.473  -46.361 1.000 38.384 0 381 GLY AAA N   1 ? 3  
ATOM   383  C CA  . GLY A 1 52  ? 2.721   -1.659  -46.750 1.000 39.942 0 381 GLY AAA CA  1 ? 3  
ATOM   384  C C   . GLY A 1 52  ? 2.633   -2.808  -45.749 1.000 41.740 0 381 GLY AAA C   1 ? 3  
ATOM   385  O O   . GLY A 1 52  ? 3.204   -3.879  -46.040 1.000 41.040 0 381 GLY AAA O   1 ? 3  
ATOM   386  N N   . VAL A 1 53  ? 1.938   -2.625  -44.623 1.000 42.854 0 382 VAL AAA N   1 ? 3  
ATOM   387  C CA  . VAL A 1 53  ? 1.730   -3.668  -43.572 1.000 45.434 0 382 VAL AAA CA  1 ? 3  
ATOM   388  C C   . VAL A 1 53  ? 0.349   -3.456  -42.954 1.000 44.796 0 382 VAL AAA C   1 ? 3  
ATOM   389  O O   . VAL A 1 53  ? -0.086  -2.296  -42.903 1.000 44.877 0 382 VAL AAA O   1 ? 3  
ATOM   390  C CB  . VAL A 1 53  ? 2.813   -3.612  -42.479 1.000 47.496 0 382 VAL AAA CB  1 ? 3  
ATOM   391  C CG1 . VAL A 1 53  ? 4.160   -4.097  -42.991 1.000 52.503 0 382 VAL AAA CG1 1 ? 3  
ATOM   392  C CG2 . VAL A 1 53  ? 2.926   -2.228  -41.856 1.000 46.834 0 382 VAL AAA CG2 1 ? 3  
ATOM   393  N N   . SER A 1 54  ? -0.297  -4.525  -42.484 1.000 46.325 0 383 SER AAA N   1 ? 3  
ATOM   394  C CA  . SER A 1 54  ? -1.539  -4.436  -41.671 1.000 47.074 0 383 SER AAA CA  1 ? 3  
ATOM   395  C C   . SER A 1 54  ? -1.158  -4.280  -40.202 1.000 43.854 0 383 SER AAA C   1 ? 3  
ATOM   396  O O   . SER A 1 54  ? -0.376  -5.072  -39.671 1.000 39.973 0 383 SER AAA O   1 ? 3  
ATOM   397  C CB  . SER A 1 54  ? -2.453  -5.614  -41.860 1.000 51.058 0 383 SER AAA CB  1 ? 3  
ATOM   398  O OG  . SER A 1 54  ? -3.618  -5.452  -41.055 1.000 53.551 0 383 SER AAA OG  1 ? 3  
ATOM   399  N N   . PRO A 1 55  ? -1.700  -3.268  -39.492 1.000 40.752 0 384 PRO AAA N   1 ? 3  
ATOM   400  C CA  . PRO A 1 55  ? -1.404  -3.102  -38.072 1.000 39.825 0 384 PRO AAA CA  1 ? 3  
ATOM   401  C C   . PRO A 1 55  ? -1.863  -4.310  -37.238 1.000 40.080 0 384 PRO AAA C   1 ? 3  
ATOM   402  O O   . PRO A 1 55  ? -1.234  -4.564  -36.232 1.000 39.994 0 384 PRO AAA O   1 ? 3  
ATOM   403  C CB  . PRO A 1 55  ? -2.158  -1.821  -37.682 1.000 40.497 0 384 PRO AAA CB  1 ? 3  
ATOM   404  C CG  . PRO A 1 55  ? -3.252  -1.719  -38.719 1.000 42.966 0 384 PRO AAA CG  1 ? 3  
ATOM   405  C CD  . PRO A 1 55  ? -2.639  -2.257  -39.996 1.000 42.783 0 384 PRO AAA CD  1 ? 3  
ATOM   406  N N   . THR A 1 56  ? -2.884  -5.055  -37.687 1.000 41.245 0 385 THR AAA N   1 ? 3  
ATOM   407  C CA  . THR A 1 56  ? -3.420  -6.236  -36.957 1.000 41.784 0 385 THR AAA CA  1 ? 3  
ATOM   408  C C   . THR A 1 56  ? -2.431  -7.409  -37.008 1.000 40.338 0 385 THR AAA C   1 ? 3  
ATOM   409  O O   . THR A 1 56  ? -2.583  -8.321  -36.175 1.000 41.152 0 385 THR AAA O   1 ? 3  
ATOM   410  C CB  . THR A 1 56  ? -4.797  -6.663  -37.482 1.000 44.830 0 385 THR AAA CB  1 ? 3  
ATOM   411  O OG1 . THR A 1 56  ? -4.649  -7.090  -38.836 1.000 45.979 0 385 THR AAA OG1 1 ? 3  
ATOM   412  C CG2 . THR A 1 56  ? -5.830  -5.559  -37.395 1.000 46.053 0 385 THR AAA CG2 1 ? 3  
ATOM   413  N N   . LYS A 1 57  ? -1.468  -7.396  -37.930 1.000 38.549 0 386 LYS AAA N   1 ? 3  
ATOM   414  C CA  . LYS A 1 57  ? -0.487  -8.505  -38.109 1.000 40.078 0 386 LYS AAA CA  1 ? 3  
ATOM   415  C C   . LYS A 1 57  ? 0.836   -8.198  -37.398 1.000 36.885 0 386 LYS AAA C   1 ? 3  
ATOM   416  O O   . LYS A 1 57  ? 1.655   -9.131  -37.312 1.000 37.496 0 386 LYS AAA O   1 ? 3  
ATOM   417  C CB  . LYS A 1 57  ? -0.197  -8.749  -39.595 1.000 42.948 0 386 LYS AAA CB  1 ? 3  
ATOM   418  C CG  . LYS A 1 57  ? -1.392  -9.159  -40.446 1.000 47.991 0 386 LYS AAA CG  1 ? 3  
ATOM   419  C CD  . LYS A 1 57  ? -2.038  -10.457 -40.031 1.000 53.731 0 386 LYS AAA CD  1 ? 3  
ATOM   420  C CE  . LYS A 1 57  ? -2.924  -11.041 -41.115 1.000 57.774 0 386 LYS AAA CE  1 ? 3  
ATOM   421  N NZ  . LYS A 1 57  ? -3.804  -12.113 -40.592 1.000 63.273 0 386 LYS AAA NZ  1 ? 3  
ATOM   422  N N   . LEU A 1 58  ? 1.057   -6.970  -36.914 1.000 34.575 0 387 LEU AAA N   1 ? 3  
ATOM   423  C CA  . LEU A 1 58  ? 2.412   -6.520  -36.488 1.000 34.094 0 387 LEU AAA CA  1 ? 3  
ATOM   424  C C   . LEU A 1 58  ? 2.942   -7.424  -35.370 1.000 34.286 0 387 LEU AAA C   1 ? 3  
ATOM   425  O O   . LEU A 1 58  ? 4.146   -7.709  -35.375 1.000 35.153 0 387 LEU AAA O   1 ? 3  
ATOM   426  C CB  . LEU A 1 58  ? 2.402   -5.048  -36.053 1.000 33.369 0 387 LEU AAA CB  1 ? 3  
ATOM   427  C CG  . LEU A 1 58  ? 2.321   -4.022  -37.181 1.000 32.916 0 387 LEU AAA CG  1 ? 3  
ATOM   428  C CD1 . LEU A 1 58  ? 2.232   -2.621  -36.593 1.000 32.586 0 387 LEU AAA CD1 1 ? 3  
ATOM   429  C CD2 . LEU A 1 58  ? 3.503   -4.114  -38.136 1.000 33.240 0 387 LEU AAA CD2 1 ? 3  
ATOM   430  N N   . ASN A 1 59  ? 2.094   -7.898  -34.461 1.000 35.238 0 388 ASN AAA N   1 ? 3  
ATOM   431  C CA  . ASN A 1 59  ? 2.571   -8.769  -33.353 1.000 37.301 0 388 ASN AAA CA  1 ? 3  
ATOM   432  C C   . ASN A 1 59  ? 3.022   -10.134 -33.890 1.000 36.536 0 388 ASN AAA C   1 ? 3  
ATOM   433  O O   . ASN A 1 59  ? 3.694   -10.846 -33.141 1.000 38.115 0 388 ASN AAA O   1 ? 3  
ATOM   434  C CB  . ASN A 1 59  ? 1.532   -8.937  -32.254 1.000 39.867 0 388 ASN AAA CB  1 ? 3  
ATOM   435  C CG  . ASN A 1 59  ? 1.569   -7.782  -31.279 1.000 41.605 0 388 ASN AAA CG  1 ? 3  
ATOM   436  O OD1 . ASN A 1 59  ? 2.162   -6.737  -31.558 1.000 41.838 0 388 ASN AAA OD1 1 ? 3  
ATOM   437  N ND2 . ASN A 1 59  ? 0.939   -7.966  -30.135 1.000 43.954 0 388 ASN AAA ND2 1 ? 3  
ATOM   438  N N   . ASP A 1 60  ? 2.703   -10.472 -35.137 1.000 36.079 0 389 ASP AAA N   1 ? 3  
ATOM   439  C CA  . ASP A 1 60  ? 3.044   -11.799 -35.727 1.000 36.987 0 389 ASP AAA CA  1 ? 3  
ATOM   440  C C   . ASP A 1 60  ? 4.229   -11.668 -36.697 1.000 34.628 0 389 ASP AAA C   1 ? 3  
ATOM   441  O O   . ASP A 1 60  ? 4.532   -12.655 -37.397 1.000 35.175 0 389 ASP AAA O   1 ? 3  
ATOM   442  C CB  . ASP A 1 60  ? 1.817   -12.399 -36.410 1.000 40.265 0 389 ASP AAA CB  1 ? 3  
ATOM   443  C CG  . ASP A 1 60  ? 0.653   -12.641 -35.463 1.000 44.097 0 389 ASP AAA CG  1 ? 3  
ATOM   444  O OD1 . ASP A 1 60  ? 0.897   -13.187 -34.356 1.000 44.339 0 389 ASP AAA OD1 1 ? 3  
ATOM   445  O OD2 . ASP A 1 60  ? -0.485  -12.281 -35.837 1.000 46.417 0 389 ASP AAA OD2 1 ? 3  
ATOM   446  N N   . LEU A 1 61  ? 4.880   -10.503 -36.755 1.000 32.714 0 390 LEU AAA N   1 ? 3  
ATOM   447  C CA  . LEU A 1 61  ? 5.953   -10.254 -37.749 1.000 31.071 0 390 LEU AAA CA  1 ? 3  
ATOM   448  C C   . LEU A 1 61  ? 7.282   -9.984  -37.048 1.000 30.660 0 390 LEU AAA C   1 ? 3  
ATOM   449  O O   . LEU A 1 61  ? 7.285   -9.505  -35.894 1.000 30.668 0 390 LEU AAA O   1 ? 3  
ATOM   450  C CB  . LEU A 1 61  ? 5.556   -9.091  -38.661 1.000 30.651 0 390 LEU AAA CB  1 ? 3  
ATOM   451  C CG  . LEU A 1 61  ? 4.254   -9.276  -39.439 1.000 31.432 0 390 LEU AAA CG  1 ? 3  
ATOM   452  C CD1 . LEU A 1 61  ? 3.979   -8.030  -40.288 1.000 31.497 0 390 LEU AAA CD1 1 ? 3  
ATOM   453  C CD2 . LEU A 1 61  ? 4.301   -10.524 -40.309 1.000 32.176 0 390 LEU AAA CD2 1 ? 3  
ATOM   454  N N   . CYS A 1 62  ? 8.370   -10.274 -37.755 1.000 30.365 0 391 CYS AAA N   1 ? 3  
ATOM   455  C CA  . CYS A 1 62  ? 9.762   -9.960  -37.360 1.000 30.848 0 391 CYS AAA CA  1 ? 3  
ATOM   456  C C   . CYS A 1 62  ? 10.368  -9.067  -38.440 1.000 29.239 0 391 CYS AAA C   1 ? 3  
ATOM   457  O O   . CYS A 1 62  ? 10.167  -9.350  -39.633 1.000 29.051 0 391 CYS AAA O   1 ? 3  
ATOM   458  C CB  . CYS A 1 62  ? 10.592  -11.223 -37.177 1.000 33.637 0 391 CYS AAA CB  1 ? 3  
ATOM   459  S SG  . CYS A 1 62  ? 10.101  -12.201 -35.734 1.000 36.695 0 391 CYS AAA SG  1 ? 3  
ATOM   460  N N   . PHE A 1 63  ? 11.088  -8.031  -38.029 1.000 28.266 0 392 PHE AAA N   1 ? 3  
ATOM   461  C CA  . PHE A 1 63  ? 11.771  -7.093  -38.950 1.000 28.062 0 392 PHE AAA CA  1 ? 3  
ATOM   462  C C   . PHE A 1 63  ? 13.260  -7.084  -38.620 1.000 28.699 0 392 PHE AAA C   1 ? 3  
ATOM   463  O O   . PHE A 1 63  ? 13.647  -7.436  -37.484 1.000 29.010 0 392 PHE AAA O   1 ? 3  
ATOM   464  C CB  . PHE A 1 63  ? 11.111  -5.718  -38.850 1.000 27.711 0 392 PHE AAA CB  1 ? 3  
ATOM   465  C CG  . PHE A 1 63  ? 9.674   -5.721  -39.301 1.000 27.937 0 392 PHE AAA CG  1 ? 3  
ATOM   466  C CD1 . PHE A 1 63  ? 9.363   -5.805  -40.645 1.000 28.929 0 392 PHE AAA CD1 1 ? 3  
ATOM   467  C CD2 . PHE A 1 63  ? 8.639   -5.658  -38.386 1.000 30.225 0 392 PHE AAA CD2 1 ? 3  
ATOM   468  C CE1 . PHE A 1 63  ? 8.045   -5.787  -41.072 1.000 29.480 0 392 PHE AAA CE1 1 ? 3  
ATOM   469  C CE2 . PHE A 1 63  ? 7.319   -5.649  -38.816 1.000 30.558 0 392 PHE AAA CE2 1 ? 3  
ATOM   470  C CZ  . PHE A 1 63  ? 7.029   -5.723  -40.158 1.000 29.411 0 392 PHE AAA CZ  1 ? 3  
ATOM   471  N N   . THR A 1 64  ? 14.078  -6.691  -39.589 1.000 29.242 0 393 THR AAA N   1 ? 3  
ATOM   472  C CA  . THR A 1 64  ? 15.549  -6.617  -39.428 1.000 32.010 0 393 THR AAA CA  1 ? 3  
ATOM   473  C C   . THR A 1 64  ? 15.872  -5.400  -38.547 1.000 33.816 0 393 THR AAA C   1 ? 3  
ATOM   474  O O   . THR A 1 64  ? 16.803  -5.497  -37.733 1.000 37.763 0 393 THR AAA O   1 ? 3  
ATOM   475  C CB  . THR A 1 64  ? 16.217  -6.762  -40.802 1.000 33.225 0 393 THR AAA CB  1 ? 3  
ATOM   476  O OG1 . THR A 1 64  ? 15.620  -5.860  -41.726 1.000 32.775 0 393 THR AAA OG1 1 ? 3  
ATOM   477  C CG2 . THR A 1 64  ? 16.078  -8.161  -41.368 1.000 33.855 0 393 THR AAA CG2 1 ? 3  
ATOM   478  N N   . ASN A 1 65  ? 15.088  -4.325  -38.646 1.000 33.971 0 394 ASN AAA N   1 ? 3  
ATOM   479  C CA  . ASN A 1 65  ? 15.163  -3.145  -37.744 1.000 35.127 0 394 ASN AAA CA  1 ? 3  
ATOM   480  C C   . ASN A 1 65  ? 13.823  -2.418  -37.759 1.000 32.676 0 394 ASN AAA C   1 ? 3  
ATOM   481  O O   . ASN A 1 65  ? 13.080  -2.580  -38.737 1.000 29.440 0 394 ASN AAA O   1 ? 3  
ATOM   482  C CB  . ASN A 1 65  ? 16.231  -2.136  -38.166 1.000 38.141 0 394 ASN AAA CB  1 ? 3  
ATOM   483  C CG  . ASN A 1 65  ? 17.628  -2.574  -37.794 1.000 42.065 0 394 ASN AAA CG  1 ? 3  
ATOM   484  O OD1 . ASN A 1 65  ? 17.935  -2.773  -36.618 1.000 40.343 0 394 ASN AAA OD1 1 ? 3  
ATOM   485  N ND2 . ASN A 1 65  ? 18.464  -2.757  -38.803 1.000 44.413 0 394 ASN AAA ND2 1 ? 3  
ATOM   486  N N   . VAL A 1 66  ? 13.561  -1.633  -36.718 1.000 32.363 0 395 VAL AAA N   1 ? 3  
ATOM   487  C CA  . VAL A 1 66  ? 12.485  -0.608  -36.713 1.000 31.115 0 395 VAL AAA CA  1 ? 3  
ATOM   488  C C   . VAL A 1 66  ? 13.156  0.733   -36.436 1.000 31.737 0 395 VAL AAA C   1 ? 3  
ATOM   489  O O   . VAL A 1 66  ? 13.932  0.814   -35.478 1.000 33.351 0 395 VAL AAA O   1 ? 3  
ATOM   490  C CB  . VAL A 1 66  ? 11.377  -0.944  -35.698 1.000 32.797 0 395 VAL AAA CB  1 ? 3  
ATOM   491  C CG1 . VAL A 1 66  ? 10.290  0.114   -35.676 1.000 33.164 0 395 VAL AAA CG1 1 ? 3  
ATOM   492  C CG2 . VAL A 1 66  ? 10.783  -2.311  -35.972 1.000 33.599 0 395 VAL AAA CG2 1 ? 3  
ATOM   493  N N   . TYR A 1 67  ? 12.934  1.725   -37.292 1.000 31.162 0 396 TYR AAA N   1 ? 4  
ATOM   494  C CA  . TYR A 1 67  ? 13.374  3.120   -37.041 1.000 30.886 0 396 TYR AAA CA  1 ? 4  
ATOM   495  C C   . TYR A 1 67  ? 12.162  3.881   -36.510 1.000 29.504 0 396 TYR AAA C   1 ? 4  
ATOM   496  O O   . TYR A 1 67  ? 11.075  3.792   -37.112 1.000 30.146 0 396 TYR AAA O   1 ? 4  
ATOM   497  C CB  . TYR A 1 67  ? 14.014  3.715   -38.297 1.000 33.056 0 396 TYR AAA CB  1 ? 4  
ATOM   498  C CG  . TYR A 1 67  ? 15.143  2.874   -38.838 1.000 37.031 0 396 TYR AAA CG  1 ? 4  
ATOM   499  C CD1 . TYR A 1 67  ? 16.439  3.005   -38.359 1.000 40.910 0 396 TYR AAA CD1 1 ? 4  
ATOM   500  C CD2 . TYR A 1 67  ? 14.902  1.904   -39.802 1.000 42.696 0 396 TYR AAA CD2 1 ? 4  
ATOM   501  C CE1 . TYR A 1 67  ? 17.466  2.193   -38.827 1.000 41.943 0 396 TYR AAA CE1 1 ? 4  
ATOM   502  C CE2 . TYR A 1 67  ? 15.909  1.075   -40.272 1.000 42.870 0 396 TYR AAA CE2 1 ? 4  
ATOM   503  C CZ  . TYR A 1 67  ? 17.196  1.229   -39.789 1.000 43.248 0 396 TYR AAA CZ  1 ? 4  
ATOM   504  O OH  . TYR A 1 67  ? 18.167  0.429   -40.317 1.000 46.213 0 396 TYR AAA OH  1 ? 4  
ATOM   505  N N   . ALA A 1 68  ? 12.334  4.545   -35.362 1.000 27.857 0 397 ALA AAA N   1 ? 4  
ATOM   506  C CA  . ALA A 1 68  ? 11.314  5.411   -34.733 1.000 25.547 0 397 ALA AAA CA  1 ? 4  
ATOM   507  C C   . ALA A 1 68  ? 11.774  6.863   -34.891 1.000 24.987 0 397 ALA AAA C   1 ? 4  
ATOM   508  O O   . ALA A 1 68  ? 12.770  7.264   -34.244 1.000 26.013 0 397 ALA AAA O   1 ? 4  
ATOM   509  C CB  . ALA A 1 68  ? 11.129  5.047   -33.288 1.000 26.313 0 397 ALA AAA CB  1 ? 4  
ATOM   510  N N   . ASP A 1 69  ? 11.127  7.575   -35.805 1.000 23.920 0 398 ASP AAA N   1 ? 4  
ATOM   511  C CA  . ASP A 1 69  ? 11.378  9.006   -36.078 1.000 22.795 0 398 ASP AAA CA  1 ? 4  
ATOM   512  C C   . ASP A 1 69  ? 10.356  9.809   -35.279 1.000 23.511 0 398 ASP AAA C   1 ? 4  
ATOM   513  O O   . ASP A 1 69  ? 9.160   9.425   -35.276 1.000 23.970 0 398 ASP AAA O   1 ? 4  
ATOM   514  C CB  . ASP A 1 69  ? 11.312  9.279   -37.577 1.000 23.584 0 398 ASP AAA CB  1 ? 4  
ATOM   515  C CG  . ASP A 1 69  ? 12.364  8.527   -38.374 1.000 24.334 0 398 ASP AAA CG  1 ? 4  
ATOM   516  O OD1 . ASP A 1 69  ? 13.386  8.131   -37.776 1.000 27.071 0 398 ASP AAA OD1 1 ? 4  
ATOM   517  O OD2 . ASP A 1 69  ? 12.174  8.366   -39.603 1.000 25.414 0 398 ASP AAA OD2 1 ? 4  
ATOM   518  N N   . SER A 1 70  ? 10.762  10.906  -34.646 1.000 21.002 0 399 SER AAA N   1 ? 4  
ATOM   519  C CA  . SER A 1 70  ? 9.790   11.679  -33.838 1.000 20.735 0 399 SER AAA CA  1 ? 4  
ATOM   520  C C   . SER A 1 70  ? 10.081  13.176  -33.937 1.000 20.659 0 399 SER AAA C   1 ? 4  
ATOM   521  O O   . SER A 1 70  ? 11.255  13.583  -34.106 1.000 20.450 0 399 SER AAA O   1 ? 4  
ATOM   522  C CB  . SER A 1 70  ? 9.754   11.189  -32.424 1.000 22.413 0 399 SER AAA CB  1 ? 4  
ATOM   523  O OG  . SER A 1 70  ? 11.034  11.259  -31.824 1.000 24.418 0 399 SER AAA OG  1 ? 4  
ATOM   524  N N   . PHE A 1 71  ? 9.019   13.959  -33.807 1.000 19.614 0 400 PHE AAA N   1 ? 4  
ATOM   525  C CA  . PHE A 1 71  ? 9.061   15.429  -33.959 1.000 20.061 0 400 PHE AAA CA  1 ? 4  
ATOM   526  C C   . PHE A 1 71  ? 7.684   15.991  -33.655 1.000 20.600 0 400 PHE AAA C   1 ? 4  
ATOM   527  O O   . PHE A 1 71  ? 6.719   15.209  -33.505 1.000 21.025 0 400 PHE AAA O   1 ? 4  
ATOM   528  C CB  . PHE A 1 71  ? 9.466   15.819  -35.386 1.000 19.119 0 400 PHE AAA CB  1 ? 4  
ATOM   529  C CG  . PHE A 1 71  ? 8.709   15.121  -36.486 1.000 18.680 0 400 PHE AAA CG  1 ? 4  
ATOM   530  C CD1 . PHE A 1 71  ? 7.452   15.553  -36.872 1.000 19.372 0 400 PHE AAA CD1 1 ? 4  
ATOM   531  C CD2 . PHE A 1 71  ? 9.241   14.000  -37.111 1.000 19.467 0 400 PHE AAA CD2 1 ? 4  
ATOM   532  C CE1 . PHE A 1 71  ? 6.763   14.900  -37.883 1.000 20.778 0 400 PHE AAA CE1 1 ? 4  
ATOM   533  C CE2 . PHE A 1 71  ? 8.542   13.340  -38.109 1.000 20.842 0 400 PHE AAA CE2 1 ? 4  
ATOM   534  C CZ  . PHE A 1 71  ? 7.303   13.784  -38.488 1.000 21.487 0 400 PHE AAA CZ  1 ? 4  
ATOM   535  N N   . VAL A 1 72  ? 7.614   17.321  -33.593 1.000 21.273 0 401 VAL AAA N   1 ? 4  
ATOM   536  C CA  . VAL A 1 72  ? 6.353   18.082  -33.390 1.000 20.283 0 401 VAL AAA CA  1 ? 4  
ATOM   537  C C   . VAL A 1 72  ? 6.069   18.926  -34.637 1.000 18.749 0 401 VAL AAA C   1 ? 4  
ATOM   538  O O   . VAL A 1 72  ? 6.967   19.579  -35.167 1.000 18.361 0 401 VAL AAA O   1 ? 4  
ATOM   539  C CB  . VAL A 1 72  ? 6.435   18.939  -32.116 1.000 21.292 0 401 VAL AAA CB  1 ? 4  
ATOM   540  C CG1 . VAL A 1 72  ? 5.382   20.049  -32.055 1.000 22.729 0 401 VAL AAA CG1 1 ? 4  
ATOM   541  C CG2 . VAL A 1 72  ? 6.361   18.064  -30.881 1.000 22.939 0 401 VAL AAA CG2 1 ? 4  
ATOM   542  N N   . ILE A 1 73  ? 4.806   18.966  -35.028 1.000 18.824 0 402 ILE AAA N   1 ? 4  
ATOM   543  C CA  . ILE A 1 73  ? 4.293   19.828  -36.122 1.000 19.828 0 402 ILE AAA CA  1 ? 4  
ATOM   544  C C   . ILE A 1 73  ? 2.907   20.281  -35.694 1.000 20.584 0 402 ILE AAA C   1 ? 4  
ATOM   545  O O   . ILE A 1 73  ? 2.422   19.827  -34.622 1.000 22.392 0 402 ILE AAA O   1 ? 4  
ATOM   546  C CB  . ILE A 1 73  ? 4.265   19.064  -37.464 1.000 19.341 0 402 ILE AAA CB  1 ? 4  
ATOM   547  C CG1 . ILE A 1 73  ? 3.534   17.720  -37.357 1.000 21.928 0 402 ILE AAA CG1 1 ? 4  
ATOM   548  C CG2 . ILE A 1 73  ? 5.677   18.867  -38.001 1.000 19.427 0 402 ILE AAA CG2 1 ? 4  
ATOM   549  C CD1 . ILE A 1 73  ? 3.341   17.006  -38.684 1.000 21.649 0 402 ILE AAA CD1 1 ? 4  
ATOM   550  N N   . ARG A 1 74  ? 2.253   21.063  -36.541 1.000 20.276 0 403 ARG AAA N   1 ? 4  
ATOM   551  C CA  . ARG A 1 74  ? 0.867   21.515  -36.301 1.000 22.242 0 403 ARG AAA CA  1 ? 4  
ATOM   552  C C   . ARG A 1 74  ? -0.109  20.391  -36.610 1.000 22.985 0 403 ARG AAA C   1 ? 4  
ATOM   553  O O   . ARG A 1 74  ? 0.168   19.592  -37.528 1.000 22.882 0 403 ARG AAA O   1 ? 4  
ATOM   554  C CB  . ARG A 1 74  ? 0.517   22.711  -37.187 1.000 24.052 0 403 ARG AAA CB  1 ? 4  
ATOM   555  C CG  . ARG A 1 74  ? 1.137   24.014  -36.741 1.000 25.660 0 403 ARG AAA CG  1 ? 4  
ATOM   556  C CD  . ARG A 1 74  ? 1.102   25.053  -37.846 1.000 27.164 0 403 ARG AAA CD  1 ? 4  
ATOM   557  N NE  . ARG A 1 74  ? -0.204  25.304  -38.462 1.000 28.038 0 403 ARG AAA NE  1 ? 4  
ATOM   558  C CZ  . ARG A 1 74  ? -0.541  26.446  -39.079 1.000 30.337 0 403 ARG AAA CZ  1 ? 4  
ATOM   559  N NH1 . ARG A 1 74  ? 0.294   27.478  -39.089 1.000 29.422 0 403 ARG AAA NH1 1 ? 4  
ATOM   560  N NH2 . ARG A 1 74  ? -1.733  26.573  -39.643 1.000 30.903 0 403 ARG AAA NH2 1 ? 4  
ATOM   561  N N   . GLY A 1 75  ? -1.256  20.380  -35.923 1.000 22.429 0 404 GLY AAA N   1 ? 4  
ATOM   562  C CA  . GLY A 1 75  ? -2.333  19.418  -36.207 1.000 23.244 0 404 GLY AAA CA  1 ? 4  
ATOM   563  C C   . GLY A 1 75  ? -2.660  19.370  -37.687 1.000 23.234 0 404 GLY AAA C   1 ? 4  
ATOM   564  O O   . GLY A 1 75  ? -2.823  18.272  -38.229 1.000 22.768 0 404 GLY AAA O   1 ? 4  
ATOM   565  N N   . ASP A 1 76  ? -2.726  20.526  -38.336 1.000 24.505 0 405 ASP AAA N   1 ? 4  
ATOM   566  C CA  . ASP A 1 76  ? -3.186  20.618  -39.744 1.000 25.534 0 405 ASP AAA CA  1 ? 4  
ATOM   567  C C   . ASP A 1 76  ? -2.044  20.201  -40.693 1.000 23.836 0 405 ASP AAA C   1 ? 4  
ATOM   568  O O   . ASP A 1 76  ? -2.271  20.222  -41.924 1.000 25.973 0 405 ASP AAA O   1 ? 4  
ATOM   569  C CB  . ASP A 1 76  ? -3.789  21.996  -40.044 1.000 27.824 0 405 ASP AAA CB  1 ? 4  
ATOM   570  C CG  . ASP A 1 76  ? -2.857  23.199  -39.987 1.000 28.180 0 405 ASP AAA CG  1 ? 4  
ATOM   571  O OD1 . ASP A 1 76  ? -1.616  23.010  -39.889 1.000 26.034 0 405 ASP AAA OD1 1 ? 4  
ATOM   572  O OD2 . ASP A 1 76  ? -3.381  24.327  -40.034 1.000 29.568 0 405 ASP AAA OD2 1 ? 4  
ATOM   573  N N   . GLU A 1 77  ? -0.864  19.850  -40.182 1.000 22.286 0 406 GLU AAA N   1 ? 4  
ATOM   574  C CA  . GLU A 1 77  ? 0.276   19.394  -41.020 1.000 22.021 0 406 GLU AAA CA  1 ? 4  
ATOM   575  C C   . GLU A 1 77  ? 0.454   17.878  -40.922 1.000 22.741 0 406 GLU AAA C   1 ? 4  
ATOM   576  O O   . GLU A 1 77  ? 1.260   17.329  -41.700 1.000 22.816 0 406 GLU AAA O   1 ? 4  
ATOM   577  C CB  . GLU A 1 77  ? 1.579   20.067  -40.591 1.000 20.970 0 406 GLU AAA CB  1 ? 4  
ATOM   578  C CG  . GLU A 1 77  ? 1.584   21.553  -40.886 1.000 22.223 0 406 GLU AAA CG  1 ? 4  
ATOM   579  C CD  . GLU A 1 77  ? 2.783   22.290  -40.314 1.000 23.977 0 406 GLU AAA CD  1 ? 4  
ATOM   580  O OE1 . GLU A 1 77  ? 3.288   21.871  -39.240 1.000 23.385 0 406 GLU AAA OE1 1 ? 4  
ATOM   581  O OE2 . GLU A 1 77  ? 3.224   23.288  -40.943 1.000 26.611 0 406 GLU AAA OE2 1 ? 4  
ATOM   582  N N   . VAL A 1 78  ? -0.219  17.219  -39.986 1.000 23.300 0 407 VAL AAA N   1 ? 4  
ATOM   583  C CA  . VAL A 1 78  ? -0.045  15.753  -39.790 1.000 23.562 0 407 VAL AAA CA  1 ? 4  
ATOM   584  C C   . VAL A 1 78  ? -0.385  15.034  -41.106 1.000 24.949 0 407 VAL AAA C   1 ? 4  
ATOM   585  O O   . VAL A 1 78  ? 0.244   14.008  -41.394 1.000 23.945 0 407 VAL AAA O   1 ? 4  
ATOM   586  C CB  . VAL A 1 78  ? -0.866  15.232  -38.599 1.000 25.688 0 407 VAL AAA CB  1 ? 4  
ATOM   587  C CG1 . VAL A 1 78  ? -0.803  13.701  -38.537 1.000 27.670 0 407 VAL AAA CG1 1 ? 4  
ATOM   588  C CG2 . VAL A 1 78  ? -0.384  15.842  -37.290 1.000 24.801 0 407 VAL AAA CG2 1 ? 4  
ATOM   589  N N   . ARG A 1 79  ? -1.340  15.547  -41.881 1.000 26.676 0 408 ARG AAA N   1 ? 4  
ATOM   590  C CA  . ARG A 1 79  ? -1.728  14.973  -43.195 1.000 28.047 0 408 ARG AAA CA  1 ? 4  
ATOM   591  C C   . ARG A 1 79  ? -0.516  14.921  -44.135 1.000 27.442 0 408 ARG AAA C   1 ? 4  
ATOM   592  O O   . ARG A 1 79  ? -0.553  14.120  -45.073 1.000 26.722 0 408 ARG AAA O   1 ? 4  
ATOM   593  C CB  . ARG A 1 79  ? -2.864  15.765  -43.844 1.000 32.484 0 408 ARG AAA CB  1 ? 4  
ATOM   594  C CG  . ARG A 1 79  ? -2.557  17.246  -44.026 1.000 34.365 0 408 ARG AAA CG  1 ? 4  
ATOM   595  C CD  . ARG A 1 79  ? -3.612  17.957  -44.843 1.000 40.437 0 408 ARG AAA CD  1 ? 4  
ATOM   596  N NE  . ARG A 1 79  ? -3.581  17.549  -46.242 1.000 44.947 0 408 ARG AAA NE  1 ? 4  
ATOM   597  C CZ  . ARG A 1 79  ? -2.680  17.940  -47.139 1.000 46.574 0 408 ARG AAA CZ  1 ? 4  
ATOM   598  N NH1 . ARG A 1 79  ? -1.706  18.770  -46.807 1.000 47.726 0 408 ARG AAA NH1 1 ? 4  
ATOM   599  N NH2 . ARG A 1 79  ? -2.770  17.507  -48.385 1.000 53.247 0 408 ARG AAA NH2 1 ? 4  
ATOM   600  N N   . GLN A 1 80  ? 0.517   15.739  -43.914 1.000 25.247 0 409 GLN AAA N   1 ? 4  
ATOM   601  C CA  . GLN A 1 80  ? 1.716   15.756  -44.794 1.000 25.790 0 409 GLN AAA CA  1 ? 4  
ATOM   602  C C   . GLN A 1 80  ? 2.650   14.585  -44.466 1.000 24.981 0 409 GLN AAA C   1 ? 4  
ATOM   603  O O   . GLN A 1 80  ? 3.515   14.280  -45.298 1.000 26.302 0 409 GLN AAA O   1 ? 4  
ATOM   604  C CB  . GLN A 1 80  ? 2.450   17.089  -44.689 1.000 23.878 0 409 GLN AAA CB  1 ? 4  
ATOM   605  C CG  . GLN A 1 80  ? 1.708   18.224  -45.375 1.000 25.107 0 409 GLN AAA CG  1 ? 4  
ATOM   606  C CD  . GLN A 1 80  ? 2.474   19.520  -45.323 1.000 24.355 0 409 GLN AAA CD  1 ? 4  
ATOM   607  O OE1 . GLN A 1 80  ? 3.675   19.575  -45.601 1.000 23.508 0 409 GLN AAA OE1 1 ? 4  
ATOM   608  N NE2 . GLN A 1 80  ? 1.772   20.585  -44.973 1.000 25.794 0 409 GLN AAA NE2 1 ? 4  
ATOM   609  N N   . ILE A 1 81  ? 2.477   13.922  -43.324 1.000 25.333 0 410 ILE AAA N   1 ? 4  
ATOM   610  C CA  . ILE A 1 81  ? 3.340   12.774  -42.930 1.000 24.841 0 410 ILE AAA CA  1 ? 4  
ATOM   611  C C   . ILE A 1 81  ? 2.680   11.512  -43.500 1.000 25.731 0 410 ILE AAA C   1 ? 4  
ATOM   612  O O   . ILE A 1 81  ? 2.088   10.720  -42.756 1.000 25.579 0 410 ILE AAA O   1 ? 4  
ATOM   613  C CB  . ILE A 1 81  ? 3.564   12.736  -41.404 1.000 23.634 0 410 ILE AAA CB  1 ? 4  
ATOM   614  C CG1 . ILE A 1 81  ? 3.947   14.113  -40.845 1.000 23.071 0 410 ILE AAA CG1 1 ? 4  
ATOM   615  C CG2 . ILE A 1 81  ? 4.577   11.667  -41.061 1.000 23.516 0 410 ILE AAA CG2 1 ? 4  
ATOM   616  C CD1 . ILE A 1 81  ? 5.183   14.739  -41.514 1.000 22.670 0 410 ILE AAA CD1 1 ? 4  
ATOM   617  N N   . ALA A 1 82  ? 2.739   11.381  -44.822 1.000 26.454 0 411 ALA AAA N   1 ? 4  
ATOM   618  C CA  . ALA A 1 82  ? 2.189   10.250  -45.590 1.000 29.399 0 411 ALA AAA CA  1 ? 4  
ATOM   619  C C   . ALA A 1 82  ? 2.932   10.194  -46.917 1.000 30.315 0 411 ALA AAA C   1 ? 4  
ATOM   620  O O   . ALA A 1 82  ? 3.426   11.221  -47.383 1.000 28.100 0 411 ALA AAA O   1 ? 4  
ATOM   621  C CB  . ALA A 1 82  ? 0.700   10.416  -45.800 1.000 30.627 0 411 ALA AAA CB  1 ? 4  
ATOM   622  N N   . PRO A 1 83  ? 3.034   9.010   -47.552 1.000 31.160 0 412 PRO AAA N   1 ? 4  
ATOM   623  C CA  . PRO A 1 83  ? 3.607   8.927   -48.893 1.000 33.641 0 412 PRO AAA CA  1 ? 4  
ATOM   624  C C   . PRO A 1 83  ? 2.859   9.839   -49.873 1.000 34.048 0 412 PRO AAA C   1 ? 4  
ATOM   625  O O   . PRO A 1 83  ? 1.644   9.926   -49.769 1.000 34.142 0 412 PRO AAA O   1 ? 4  
ATOM   626  C CB  . PRO A 1 83  ? 3.397   7.466   -49.315 1.000 35.478 0 412 PRO AAA CB  1 ? 4  
ATOM   627  C CG  . PRO A 1 83  ? 3.185   6.710   -48.014 1.000 35.690 0 412 PRO AAA CG  1 ? 4  
ATOM   628  C CD  . PRO A 1 83  ? 2.589   7.703   -47.037 1.000 32.673 0 412 PRO AAA CD  1 ? 4  
ATOM   629  N N   . GLY A 1 84  ? 3.590   10.459  -50.802 1.000 33.835 0 413 GLY AAA N   1 ? 4  
ATOM   630  C CA  . GLY A 1 84  ? 3.025   11.183  -51.957 1.000 37.065 0 413 GLY AAA CA  1 ? 4  
ATOM   631  C C   . GLY A 1 84  ? 2.512   12.578  -51.613 1.000 36.923 0 413 GLY AAA C   1 ? 4  
ATOM   632  O O   . GLY A 1 84  ? 1.854   13.176  -52.473 1.000 38.923 0 413 GLY AAA O   1 ? 4  
ATOM   633  N N   . GLN A 1 85  ? 2.780   13.098  -50.411 1.000 32.833 0 414 GLN AAA N   1 ? 4  
ATOM   634  C CA  . GLN A 1 85  ? 2.229   14.412  -49.986 1.000 33.008 0 414 GLN AAA CA  1 ? 4  
ATOM   635  C C   . GLN A 1 85  ? 3.199   15.535  -50.360 1.000 32.362 0 414 GLN AAA C   1 ? 4  
ATOM   636  O O   . GLN A 1 85  ? 4.401   15.258  -50.603 1.000 31.949 0 414 GLN AAA O   1 ? 4  
ATOM   637  C CB  . GLN A 1 85  ? 1.929   14.437  -48.487 1.000 31.759 0 414 GLN AAA CB  1 ? 4  
ATOM   638  C CG  . GLN A 1 85  ? 0.892   13.422  -48.055 1.000 34.979 0 414 GLN AAA CG  1 ? 4  
ATOM   639  C CD  . GLN A 1 85  ? -0.392  13.536  -48.835 1.000 41.025 0 414 GLN AAA CD  1 ? 4  
ATOM   640  O OE1 . GLN A 1 85  ? -1.064  14.561  -48.814 1.000 46.408 0 414 GLN AAA OE1 1 ? 4  
ATOM   641  N NE2 . GLN A 1 85  ? -0.744  12.470  -49.535 1.000 44.884 0 414 GLN AAA NE2 1 ? 4  
ATOM   642  N N   . THR A 1 86  ? 2.675   16.761  -50.395 1.000 31.903 0 415 THR AAA N   1 ? 4  
ATOM   643  C CA  . THR A 1 86  ? 3.415   18.008  -50.688 1.000 33.020 0 415 THR AAA CA  1 ? 4  
ATOM   644  C C   . THR A 1 86  ? 3.058   19.044  -49.613 1.000 30.499 0 415 THR AAA C   1 ? 4  
ATOM   645  O O   . THR A 1 86  ? 2.030   18.867  -48.928 1.000 30.482 0 415 THR AAA O   1 ? 4  
ATOM   646  C CB  . THR A 1 86  ? 3.110   18.485  -52.115 1.000 35.841 0 415 THR AAA CB  1 ? 4  
ATOM   647  O OG1 . THR A 1 86  ? 4.068   19.495  -52.417 1.000 46.087 0 415 THR AAA OG1 1 ? 4  
ATOM   648  C CG2 . THR A 1 86  ? 1.712   19.034  -52.283 1.000 36.238 0 415 THR AAA CG2 1 ? 4  
ATOM   649  N N   . GLY A 1 87  ? 3.855   20.101  -49.505 1.000 30.425 0 416 GLY AAA N   1 ? 4  
ATOM   650  C CA  . GLY A 1 87  ? 3.696   21.151  -48.486 1.000 26.404 0 416 GLY AAA CA  1 ? 4  
ATOM   651  C C   . GLY A 1 87  ? 5.020   21.415  -47.798 1.000 25.300 0 416 GLY AAA C   1 ? 4  
ATOM   652  O O   . GLY A 1 87  ? 6.004   20.695  -48.077 1.000 21.726 0 416 GLY AAA O   1 ? 4  
ATOM   653  N N   . LYS A 1 88  ? 5.078   22.443  -46.955 1.000 25.313 0 417 LYS AAA N   1 ? 4  
ATOM   654  C CA  . LYS A 1 88  ? 6.357   22.877  -46.337 1.000 24.388 0 417 LYS AAA CA  1 ? 4  
ATOM   655  C C   . LYS A 1 88  ? 6.957   21.709  -45.551 1.000 22.182 0 417 LYS AAA C   1 ? 4  
ATOM   656  O O   . LYS A 1 88  ? 8.193   21.571  -45.551 1.000 20.919 0 417 LYS AAA O   1 ? 4  
ATOM   657  C CB  . LYS A 1 88  ? 6.163   24.111  -45.446 1.000 28.332 0 417 LYS AAA CB  1 ? 4  
ATOM   658  C CG  . LYS A 1 88  ? 5.523   25.307  -46.137 1.000 34.096 0 417 LYS AAA CG  1 ? 4  
ATOM   659  C CD  . LYS A 1 88  ? 6.247   25.771  -47.391 1.000 39.133 0 417 LYS AAA CD  1 ? 4  
ATOM   660  C CE  . LYS A 1 88  ? 5.486   26.851  -48.130 1.000 41.715 0 417 LYS AAA CE  1 ? 4  
ATOM   661  N NZ  . LYS A 1 88  ? 6.186   27.244  -49.373 1.000 41.409 0 417 LYS AAA NZ  1 ? 4  
ATOM   662  N N   . ILE A 1 89  ? 6.145   20.908  -44.868 1.000 20.553 0 418 ILE AAA N   1 ? 4  
ATOM   663  C CA  . ILE A 1 89  ? 6.700   19.828  -44.002 1.000 20.962 0 418 ILE AAA CA  1 ? 4  
ATOM   664  C C   . ILE A 1 89  ? 7.189   18.675  -44.893 1.000 20.509 0 418 ILE AAA C   1 ? 4  
ATOM   665  O O   . ILE A 1 89  ? 8.365   18.278  -44.763 1.000 20.734 0 418 ILE AAA O   1 ? 4  
ATOM   666  C CB  . ILE A 1 89  ? 5.696   19.376  -42.929 1.000 20.583 0 418 ILE AAA CB  1 ? 4  
ATOM   667  C CG1 . ILE A 1 89  ? 5.258   20.550  -42.048 1.000 21.329 0 418 ILE AAA CG1 1 ? 4  
ATOM   668  C CG2 . ILE A 1 89  ? 6.281   18.226  -42.126 1.000 21.099 0 418 ILE AAA CG2 1 ? 4  
ATOM   669  C CD1 . ILE A 1 89  ? 6.394   21.307  -41.414 1.000 20.387 0 418 ILE AAA CD1 1 ? 4  
ATOM   670  N N   . ALA A 1 90  ? 6.355   18.155  -45.786 1.000 20.338 0 419 ALA AAA N   1 ? 4  
ATOM   671  C CA  . ALA A 1 90  ? 6.749   17.050  -46.694 1.000 21.862 0 419 ALA AAA CA  1 ? 4  
ATOM   672  C C   . ALA A 1 90  ? 7.949   17.460  -47.564 1.000 22.645 0 419 ALA AAA C   1 ? 4  
ATOM   673  O O   . ALA A 1 90  ? 8.820   16.619  -47.776 1.000 24.818 0 419 ALA AAA O   1 ? 4  
ATOM   674  C CB  . ALA A 1 90  ? 5.592   16.621  -47.551 1.000 23.883 0 419 ALA AAA CB  1 ? 4  
ATOM   675  N N   . ASP A 1 91  ? 7.970   18.698  -48.068 1.000 21.721 0 420 ASP AAA N   1 ? 4  
ATOM   676  C CA  . ASP A 1 91  ? 8.958   19.151  -49.079 1.000 23.237 0 420 ASP AAA CA  1 ? 4  
ATOM   677  C C   . ASP A 1 91  ? 10.269  19.494  -48.373 1.000 21.102 0 420 ASP AAA C   1 ? 4  
ATOM   678  O O   . ASP A 1 91  ? 11.325  19.182  -48.918 1.000 22.995 0 420 ASP AAA O   1 ? 4  
ATOM   679  C CB  . ASP A 1 91  ? 8.443   20.344  -49.895 1.000 24.639 0 420 ASP AAA CB  1 ? 4  
ATOM   680  C CG  . ASP A 1 91  ? 7.206   20.076  -50.748 1.000 29.669 0 420 ASP AAA CG  1 ? 4  
ATOM   681  O OD1 . ASP A 1 91  ? 6.895   18.887  -51.003 1.000 33.835 0 420 ASP AAA OD1 1 ? 4  
ATOM   682  O OD2 . ASP A 1 91  ? 6.556   21.070  -51.146 1.000 32.101 0 420 ASP AAA OD2 1 ? 4  
ATOM   683  N N   . TYR A 1 92  ? 10.220  20.165  -47.229 1.000 20.246 0 421 TYR AAA N   1 ? 4  
ATOM   684  C CA  . TYR A 1 92  ? 11.424  20.834  -46.674 1.000 20.293 0 421 TYR AAA CA  1 ? 4  
ATOM   685  C C   . TYR A 1 92  ? 11.841  20.281  -45.314 1.000 19.252 0 421 TYR AAA C   1 ? 4  
ATOM   686  O O   . TYR A 1 92  ? 12.936  20.692  -44.878 1.000 19.770 0 421 TYR AAA O   1 ? 4  
ATOM   687  C CB  . TYR A 1 92  ? 11.210  22.346  -46.572 1.000 18.579 0 421 TYR AAA CB  1 ? 4  
ATOM   688  C CG  . TYR A 1 92  ? 10.923  23.078  -47.855 1.000 20.660 0 421 TYR AAA CG  1 ? 4  
ATOM   689  C CD1 . TYR A 1 92  ? 11.323  22.591  -49.087 1.000 21.594 0 421 TYR AAA CD1 1 ? 4  
ATOM   690  C CD2 . TYR A 1 92  ? 10.349  24.343  -47.817 1.000 21.281 0 421 TYR AAA CD2 1 ? 4  
ATOM   691  C CE1 . TYR A 1 92  ? 11.080  23.298  -50.255 1.000 23.995 0 421 TYR AAA CE1 1 ? 4  
ATOM   692  C CE2 . TYR A 1 92  ? 10.110  25.063  -48.972 1.000 22.301 0 421 TYR AAA CE2 1 ? 4  
ATOM   693  C CZ  . TYR A 1 92  ? 10.482  24.543  -50.197 1.000 26.293 0 421 TYR AAA CZ  1 ? 4  
ATOM   694  O OH  . TYR A 1 92  ? 10.264  25.271  -51.337 1.000 25.971 0 421 TYR AAA OH  1 ? 4  
ATOM   695  N N   . ASN A 1 93  ? 11.060  19.412  -44.663 1.000 20.304 0 422 ASN AAA N   1 ? 4  
ATOM   696  C CA  . ASN A 1 93  ? 11.356  19.029  -43.260 1.000 19.754 0 422 ASN AAA CA  1 ? 4  
ATOM   697  C C   . ASN A 1 93  ? 11.459  17.509  -43.078 1.000 20.116 0 422 ASN AAA C   1 ? 4  
ATOM   698  O O   . ASN A 1 93  ? 12.470  17.066  -42.538 1.000 21.543 0 422 ASN AAA O   1 ? 4  
ATOM   699  C CB  . ASN A 1 93  ? 10.333  19.620  -42.301 1.000 18.746 0 422 ASN AAA CB  1 ? 4  
ATOM   700  C CG  . ASN A 1 93  ? 10.445  21.130  -42.193 1.000 18.633 0 422 ASN AAA CG  1 ? 4  
ATOM   701  O OD1 . ASN A 1 93  ? 11.105  21.623  -41.298 1.000 19.775 0 422 ASN AAA OD1 1 ? 4  
ATOM   702  N ND2 . ASN A 1 93  ? 9.839   21.858  -43.116 1.000 18.522 0 422 ASN AAA ND2 1 ? 4  
ATOM   703  N N   . TYR A 1 94  ? 10.433  16.756  -43.474 1.000 19.349 0 423 TYR AAA N   1 ? 4  
ATOM   704  C CA  . TYR A 1 94  ? 10.367  15.288  -43.285 1.000 20.491 0 423 TYR AAA CA  1 ? 4  
ATOM   705  C C   . TYR A 1 94  ? 9.540   14.666  -44.404 1.000 21.062 0 423 TYR AAA C   1 ? 4  
ATOM   706  O O   . TYR A 1 94  ? 8.327   14.953  -44.508 1.000 21.141 0 423 TYR AAA O   1 ? 4  
ATOM   707  C CB  . TYR A 1 94  ? 9.801   14.928  -41.917 1.000 20.309 0 423 TYR AAA CB  1 ? 4  
ATOM   708  C CG  . TYR A 1 94  ? 9.860   13.457  -41.613 1.000 20.301 0 423 TYR AAA CG  1 ? 4  
ATOM   709  C CD1 . TYR A 1 94  ? 10.992  12.891  -41.050 1.000 21.518 0 423 TYR AAA CD1 1 ? 4  
ATOM   710  C CD2 . TYR A 1 94  ? 8.807   12.614  -41.931 1.000 21.667 0 423 TYR AAA CD2 1 ? 4  
ATOM   711  C CE1 . TYR A 1 94  ? 11.070  11.535  -40.779 1.000 21.626 0 423 TYR AAA CE1 1 ? 4  
ATOM   712  C CE2 . TYR A 1 94  ? 8.876   11.252  -41.678 1.000 21.595 0 423 TYR AAA CE2 1 ? 4  
ATOM   713  C CZ  . TYR A 1 94  ? 9.991   10.714  -41.072 1.000 21.772 0 423 TYR AAA CZ  1 ? 4  
ATOM   714  O OH  . TYR A 1 94  ? 10.047  9.370   -40.820 1.000 22.512 0 423 TYR AAA OH  1 ? 4  
ATOM   715  N N   . LYS A 1 95  ? 10.183  13.810  -45.192 1.000 21.248 0 424 LYS AAA N   1 ? 4  
ATOM   716  C CA  . LYS A 1 95  ? 9.625   13.250  -46.436 1.000 23.036 0 424 LYS AAA CA  1 ? 4  
ATOM   717  C C   . LYS A 1 95  ? 9.586   11.724  -46.338 1.000 24.125 0 424 LYS AAA C   1 ? 4  
ATOM   718  O O   . LYS A 1 95  ? 10.644  11.114  -46.161 1.000 24.130 0 424 LYS AAA O   1 ? 4  
ATOM   719  C CB  . LYS A 1 95  ? 10.484  13.644  -47.639 1.000 23.506 0 424 LYS AAA CB  1 ? 4  
ATOM   720  C CG  . LYS A 1 95  ? 9.980   13.124  -48.981 1.000 26.312 0 424 LYS AAA CG  1 ? 4  
ATOM   721  C CD  . LYS A 1 95  ? 8.537   13.481  -49.231 1.000 29.101 0 424 LYS AAA CD  1 ? 4  
ATOM   722  C CE  . LYS A 1 95  ? 8.059   13.175  -50.633 1.000 32.100 0 424 LYS AAA CE  1 ? 4  
ATOM   723  N NZ  . LYS A 1 95  ? 6.633   13.548  -50.777 1.000 32.404 0 424 LYS AAA NZ  1 ? 4  
ATOM   724  N N   . LEU A 1 96  ? 8.403   11.142  -46.476 1.000 25.144 0 425 LEU AAA N   1 ? 4  
ATOM   725  C CA  . LEU A 1 96  ? 8.241   9.676   -46.593 1.000 26.400 0 425 LEU AAA CA  1 ? 4  
ATOM   726  C C   . LEU A 1 96  ? 8.352   9.278   -48.060 1.000 30.092 0 425 LEU AAA C   1 ? 4  
ATOM   727  O O   . LEU A 1 96  ? 7.943   10.028  -48.945 1.000 32.858 0 425 LEU AAA O   1 ? 4  
ATOM   728  C CB  . LEU A 1 96  ? 6.884   9.263   -46.030 1.000 27.131 0 425 LEU AAA CB  1 ? 4  
ATOM   729  C CG  . LEU A 1 96  ? 6.778   9.311   -44.515 1.000 26.716 0 425 LEU AAA CG  1 ? 4  
ATOM   730  C CD1 . LEU A 1 96  ? 5.377   8.901   -44.082 1.000 27.014 0 425 LEU AAA CD1 1 ? 4  
ATOM   731  C CD2 . LEU A 1 96  ? 7.834   8.421   -43.883 1.000 28.984 0 425 LEU AAA CD2 1 ? 4  
ATOM   732  N N   . PRO A 1 97  ? 8.904   8.077   -48.338 1.000 30.156 0 426 PRO AAA N   1 ? 4  
ATOM   733  C CA  . PRO A 1 97  ? 8.990   7.556   -49.701 1.000 33.526 0 426 PRO AAA CA  1 ? 4  
ATOM   734  C C   . PRO A 1 97  ? 7.642   7.019   -50.197 1.000 37.268 0 426 PRO AAA C   1 ? 4  
ATOM   735  O O   . PRO A 1 97  ? 6.791   6.695   -49.389 1.000 35.560 0 426 PRO AAA O   1 ? 4  
ATOM   736  C CB  . PRO A 1 97  ? 9.994   6.403   -49.563 1.000 34.207 0 426 PRO AAA CB  1 ? 4  
ATOM   737  C CG  . PRO A 1 97  ? 9.744   5.889   -48.151 1.000 32.735 0 426 PRO AAA CG  1 ? 4  
ATOM   738  C CD  . PRO A 1 97  ? 9.460   7.145   -47.342 1.000 30.742 0 426 PRO AAA CD  1 ? 4  
ATOM   739  N N   . ASP A 1 98  ? 7.493   6.904   -51.519 1.000 40.362 0 427 ASP AAA N   1 ? 4  
ATOM   740  C CA  . ASP A 1 98  ? 6.285   6.308   -52.150 1.000 42.497 0 427 ASP AAA CA  1 ? 4  
ATOM   741  C C   . ASP A 1 98  ? 6.091   4.872   -51.644 1.000 41.606 0 427 ASP AAA C   1 ? 4  
ATOM   742  O O   . ASP A 1 98  ? 4.926   4.491   -51.421 1.000 43.760 0 427 ASP AAA O   1 ? 4  
ATOM   743  C CB  . ASP A 1 98  ? 6.375   6.353   -53.677 1.000 45.274 0 427 ASP AAA CB  1 ? 4  
ATOM   744  C CG  . ASP A 1 98  ? 6.381   7.753   -54.264 1.000 49.232 0 427 ASP AAA CG  1 ? 4  
ATOM   745  O OD1 . ASP A 1 98  ? 6.004   8.705   -53.547 1.000 48.944 0 427 ASP AAA OD1 1 ? 4  
ATOM   746  O OD2 . ASP A 1 98  ? 6.780   7.880   -55.439 1.000 55.831 0 427 ASP AAA OD2 1 ? 4  
ATOM   747  N N   . ASP A 1 99  ? 7.187   4.115   -51.475 1.000 41.719 0 428 ASP AAA N   1 ? 4  
ATOM   748  C CA  . ASP A 1 99  ? 7.182   2.659   -51.148 1.000 44.974 0 428 ASP AAA CA  1 ? 4  
ATOM   749  C C   . ASP A 1 99  ? 7.313   2.454   -49.628 1.000 41.417 0 428 ASP AAA C   1 ? 4  
ATOM   750  O O   . ASP A 1 99  ? 7.783   1.373   -49.201 1.000 44.545 0 428 ASP AAA O   1 ? 4  
ATOM   751  C CB  . ASP A 1 99  ? 8.284   1.909   -51.908 1.000 47.520 0 428 ASP AAA CB  1 ? 4  
ATOM   752  C CG  . ASP A 1 99  ? 9.706   2.329   -51.554 1.000 49.329 0 428 ASP AAA CG  1 ? 4  
ATOM   753  O OD1 . ASP A 1 99  ? 9.861   3.285   -50.764 1.000 45.857 0 428 ASP AAA OD1 1 ? 4  
ATOM   754  O OD2 . ASP A 1 99  ? 10.654  1.701   -52.079 1.000 52.662 0 428 ASP AAA OD2 1 ? 4  
ATOM   755  N N   . PHE A 1 100 ? 6.875   3.425   -48.835 1.000 38.023 0 429 PHE AAA N   1 ? 4  
ATOM   756  C CA  . PHE A 1 100 ? 6.984   3.417   -47.353 1.000 35.556 0 429 PHE AAA CA  1 ? 4  
ATOM   757  C C   . PHE A 1 100 ? 6.353   2.143   -46.782 1.000 36.257 0 429 PHE AAA C   1 ? 4  
ATOM   758  O O   . PHE A 1 100 ? 5.207   1.814   -47.153 1.000 36.172 0 429 PHE AAA O   1 ? 4  
ATOM   759  C CB  . PHE A 1 100 ? 6.306   4.654   -46.772 1.000 33.161 0 429 PHE AAA CB  1 ? 4  
ATOM   760  C CG  . PHE A 1 100 ? 6.311   4.723   -45.267 1.000 32.617 0 429 PHE AAA CG  1 ? 4  
ATOM   761  C CD1 . PHE A 1 100 ? 7.490   4.555   -44.558 1.000 31.345 0 429 PHE AAA CD1 1 ? 4  
ATOM   762  C CD2 . PHE A 1 100 ? 5.140   4.969   -44.564 1.000 32.609 0 429 PHE AAA CD2 1 ? 4  
ATOM   763  C CE1 . PHE A 1 100 ? 7.497   4.633   -43.178 1.000 30.764 0 429 PHE AAA CE1 1 ? 4  
ATOM   764  C CE2 . PHE A 1 100 ? 5.147   5.035   -43.185 1.000 30.392 0 429 PHE AAA CE2 1 ? 4  
ATOM   765  C CZ  . PHE A 1 100 ? 6.329   4.876   -42.499 1.000 31.455 0 429 PHE AAA CZ  1 ? 4  
ATOM   766  N N   . THR A 1 101 ? 7.086   1.451   -45.905 1.000 35.595 0 430 THR AAA N   1 ? 4  
ATOM   767  C CA  . THR A 1 101 ? 6.565   0.338   -45.065 1.000 36.605 0 430 THR AAA CA  1 ? 4  
ATOM   768  C C   . THR A 1 101 ? 6.706   0.768   -43.607 1.000 34.226 0 430 THR AAA C   1 ? 4  
ATOM   769  O O   . THR A 1 101 ? 7.843   0.838   -43.115 1.000 32.461 0 430 THR AAA O   1 ? 4  
ATOM   770  C CB  . THR A 1 101 ? 7.256   -1.000  -45.349 1.000 39.034 0 430 THR AAA CB  1 ? 4  
ATOM   771  O OG1 . THR A 1 101 ? 7.083   -1.331  -46.725 1.000 42.841 0 430 THR AAA OG1 1 ? 4  
ATOM   772  C CG2 . THR A 1 101 ? 6.690   -2.125  -44.512 1.000 40.592 0 430 THR AAA CG2 1 ? 4  
ATOM   773  N N   . GLY A 1 102 ? 5.588   1.088   -42.959 1.000 32.401 0 431 GLY AAA N   1 ? 4  
ATOM   774  C CA  . GLY A 1 102 ? 5.604   1.640   -41.599 1.000 31.232 0 431 GLY AAA CA  1 ? 4  
ATOM   775  C C   . GLY A 1 102 ? 4.278   2.238   -41.194 1.000 30.667 0 431 GLY AAA C   1 ? 4  
ATOM   776  O O   . GLY A 1 102 ? 3.294   2.117   -41.941 1.000 32.256 0 431 GLY AAA O   1 ? 4  
ATOM   777  N N   . CYS A 1 103 ? 4.256   2.846   -40.013 1.000 28.912 0 432 CYS AAA N   1 ? 4  
ATOM   778  C CA  . CYS A 1 103 ? 3.034   3.442   -39.427 1.000 29.981 0 432 CYS AAA CA  1 ? 4  
ATOM   779  C C   . CYS A 1 103 ? 3.364   4.873   -39.002 1.000 27.131 0 432 CYS AAA C   1 ? 4  
ATOM   780  O O   . CYS A 1 103 ? 4.498   5.121   -38.556 1.000 27.132 0 432 CYS AAA O   1 ? 4  
ATOM   781  C CB  . CYS A 1 103 ? 2.509   2.633   -38.250 1.000 31.811 0 432 CYS AAA CB  1 ? 4  
ATOM   782  S SG  . CYS A 1 103 ? 2.153   0.906   -38.672 1.000 36.420 0 432 CYS AAA SG  1 ? 4  
ATOM   783  N N   . VAL A 1 104 ? 2.411   5.770   -39.219 1.000 26.633 0 433 VAL AAA N   1 ? 4  
ATOM   784  C CA  . VAL A 1 104 ? 2.459   7.186   -38.767 1.000 25.074 0 433 VAL AAA CA  1 ? 4  
ATOM   785  C C   . VAL A 1 104 ? 1.501   7.314   -37.597 1.000 25.030 0 433 VAL AAA C   1 ? 4  
ATOM   786  O O   . VAL A 1 104 ? 0.319   6.972   -37.764 1.000 26.303 0 433 VAL AAA O   1 ? 4  
ATOM   787  C CB  . VAL A 1 104 ? 2.104   8.156   -39.901 1.000 24.606 0 433 VAL AAA CB  1 ? 4  
ATOM   788  C CG1 . VAL A 1 104 ? 2.096   9.599   -39.415 1.000 24.707 0 433 VAL AAA CG1 1 ? 4  
ATOM   789  C CG2 . VAL A 1 104 ? 3.044   7.973   -41.073 1.000 25.705 0 433 VAL AAA CG2 1 ? 4  
ATOM   790  N N   . ILE A 1 105 ? 2.036   7.704   -36.451 1.000 24.099 0 434 ILE AAA N   1 ? 4  
ATOM   791  C CA  . ILE A 1 105 ? 1.293   7.752   -35.171 1.000 25.691 0 434 ILE AAA CA  1 ? 4  
ATOM   792  C C   . ILE A 1 105 ? 1.370   9.197   -34.683 1.000 24.322 0 434 ILE AAA C   1 ? 4  
ATOM   793  O O   . ILE A 1 105 ? 2.475   9.753   -34.652 1.000 23.687 0 434 ILE AAA O   1 ? 4  
ATOM   794  C CB  . ILE A 1 105 ? 1.872   6.746   -34.166 1.000 25.679 0 434 ILE AAA CB  1 ? 4  
ATOM   795  C CG1 . ILE A 1 105 ? 1.954   5.332   -34.758 1.000 29.090 0 434 ILE AAA CG1 1 ? 4  
ATOM   796  C CG2 . ILE A 1 105 ? 1.075   6.784   -32.871 1.000 27.514 0 434 ILE AAA CG2 1 ? 4  
ATOM   797  C CD1 . ILE A 1 105 ? 2.855   4.391   -33.985 1.000 28.728 0 434 ILE AAA CD1 1 ? 4  
ATOM   798  N N   . ALA A 1 106 ? 0.233   9.807   -34.373 1.000 25.780 0 435 ALA AAA N   1 ? 4  
ATOM   799  C CA  . ALA A 1 106 ? 0.228   11.201  -33.881 1.000 26.367 0 435 ALA AAA CA  1 ? 4  
ATOM   800  C C   . ALA A 1 106 ? -0.791  11.380  -32.758 1.000 28.139 0 435 ALA AAA C   1 ? 4  
ATOM   801  O O   . ALA A 1 106 ? -1.802  10.654  -32.709 1.000 29.041 0 435 ALA AAA O   1 ? 4  
ATOM   802  C CB  . ALA A 1 106 ? -0.021  12.171  -35.011 1.000 26.885 0 435 ALA AAA CB  1 ? 4  
ATOM   803  N N   . TRP A 1 107 ? -0.520  12.348  -31.890 1.000 26.659 0 436 TRP AAA N   1 ? 4  
ATOM   804  C CA  . TRP A 1 107 ? -1.451  12.742  -30.804 1.000 27.665 0 436 TRP AAA CA  1 ? 4  
ATOM   805  C C   . TRP A 1 107 ? -1.264  14.223  -30.481 1.000 26.614 0 436 TRP AAA C   1 ? 4  
ATOM   806  O O   . TRP A 1 107 ? -0.153  14.757  -30.628 1.000 25.043 0 436 TRP AAA O   1 ? 4  
ATOM   807  C CB  . TRP A 1 107 ? -1.276  11.854  -29.572 1.000 29.090 0 436 TRP AAA CB  1 ? 4  
ATOM   808  C CG  . TRP A 1 107 ? 0.036   11.970  -28.864 1.000 28.150 0 436 TRP AAA CG  1 ? 4  
ATOM   809  C CD1 . TRP A 1 107 ? 0.303   12.688  -27.735 1.000 28.706 0 436 TRP AAA CD1 1 ? 4  
ATOM   810  C CD2 . TRP A 1 107 ? 1.276   11.334  -29.238 1.000 27.909 0 436 TRP AAA CD2 1 ? 4  
ATOM   811  N NE1 . TRP A 1 107 ? 1.619   12.541  -27.379 1.000 29.647 0 436 TRP AAA NE1 1 ? 4  
ATOM   812  C CE2 . TRP A 1 107 ? 2.233   11.701  -28.271 1.000 28.418 0 436 TRP AAA CE2 1 ? 4  
ATOM   813  C CE3 . TRP A 1 107 ? 1.656   10.483  -30.276 1.000 28.140 0 436 TRP AAA CE3 1 ? 4  
ATOM   814  C CZ2 . TRP A 1 107 ? 3.550   11.253  -28.329 1.000 28.298 0 436 TRP AAA CZ2 1 ? 4  
ATOM   815  C CZ3 . TRP A 1 107 ? 2.954   10.038  -30.331 1.000 27.677 0 436 TRP AAA CZ3 1 ? 4  
ATOM   816  C CH2 . TRP A 1 107 ? 3.885   10.412  -29.362 1.000 28.078 0 436 TRP AAA CH2 1 ? 4  
ATOM   817  N N   . ASN A 1 108 ? -2.359  14.848  -30.078 1.000 27.902 0 437 ASN AAA N   1 ? 4  
ATOM   818  C CA  . ASN A 1 108 ? -2.395  16.269  -29.669 1.000 27.940 0 437 ASN AAA CA  1 ? 4  
ATOM   819  C C   . ASN A 1 108 ? -1.502  16.409  -28.436 1.000 29.069 0 437 ASN AAA C   1 ? 4  
ATOM   820  O O   . ASN A 1 108 ? -1.677  15.620  -27.499 1.000 28.778 0 437 ASN AAA O   1 ? 4  
ATOM   821  C CB  . ASN A 1 108 ? -3.829  16.728  -29.405 1.000 30.360 0 437 ASN AAA CB  1 ? 4  
ATOM   822  C CG  . ASN A 1 108 ? -3.886  18.205  -29.102 1.000 31.134 0 437 ASN AAA CG  1 ? 4  
ATOM   823  O OD1 . ASN A 1 108 ? -3.334  18.650  -28.101 1.000 31.871 0 437 ASN AAA OD1 1 ? 4  
ATOM   824  N ND2 . ASN A 1 108 ? -4.540  18.958  -29.967 1.000 31.917 0 437 ASN AAA ND2 1 ? 4  
ATOM   825  N N   . SER A 1 109 ? -0.549  17.345  -28.463 1.000 27.730 0 438 SER AAA N   1 ? 4  
ATOM   826  C CA  . SER A 1 109 ? 0.415   17.577  -27.356 1.000 28.550 0 438 SER AAA CA  1 ? 4  
ATOM   827  C C   . SER A 1 109 ? 0.296   19.008  -26.820 1.000 30.182 0 438 SER AAA C   1 ? 4  
ATOM   828  O O   . SER A 1 109 ? 1.274   19.511  -26.250 1.000 28.871 0 438 SER AAA O   1 ? 4  
ATOM   829  C CB  . SER A 1 109 ? 1.811   17.242  -27.801 1.000 27.304 0 438 SER AAA CB  1 ? 4  
ATOM   830  O OG  . SER A 1 109 ? 2.257   18.133  -28.810 1.000 27.620 0 438 SER AAA OG  1 ? 4  
ATOM   831  N N   . ASN A 1 110 ? -0.886  19.627  -26.936 1.000 30.734 0 439 ASN AAA N   1 ? 4  
ATOM   832  C CA  . ASN A 1 110 ? -1.097  21.045  -26.553 1.000 32.931 0 439 ASN AAA CA  1 ? 4  
ATOM   833  C C   . ASN A 1 110 ? -0.735  21.235  -25.072 1.000 36.219 0 439 ASN AAA C   1 ? 4  
ATOM   834  O O   . ASN A 1 110 ? -0.213  22.291  -24.725 1.000 37.444 0 439 ASN AAA O   1 ? 4  
ATOM   835  C CB  . ASN A 1 110 ? -2.532  21.495  -26.844 1.000 33.967 0 439 ASN AAA CB  1 ? 4  
ATOM   836  C CG  . ASN A 1 110 ? -2.665  22.999  -26.862 1.000 32.854 0 439 ASN AAA CG  1 ? 4  
ATOM   837  O OD1 . ASN A 1 110 ? -1.808  23.682  -27.396 1.000 32.750 0 439 ASN AAA OD1 1 ? 4  
ATOM   838  N ND2 . ASN A 1 110 ? -3.732  23.515  -26.283 1.000 37.078 0 439 ASN AAA ND2 1 ? 4  
ATOM   839  N N   . ASN A 1 111 ? -0.994  20.238  -24.230 1.000 38.780 0 440 ASN AAA N   1 ? 4  
ATOM   840  C CA  . ASN A 1 111 ? -0.785  20.341  -22.764 1.000 44.897 0 440 ASN AAA CA  1 ? 4  
ATOM   841  C C   . ASN A 1 111 ? 0.711   20.290  -22.433 1.000 44.393 0 440 ASN AAA C   1 ? 4  
ATOM   842  O O   . ASN A 1 111 ? 1.089   20.862  -21.400 1.000 46.947 0 440 ASN AAA O   1 ? 4  
ATOM   843  C CB  . ASN A 1 111 ? -1.623  19.300  -22.020 1.000 47.491 0 440 ASN AAA CB  1 ? 4  
ATOM   844  C CG  . ASN A 1 111 ? -3.086  19.696  -21.955 1.000 54.103 0 440 ASN AAA CG  1 ? 4  
ATOM   845  O OD1 . ASN A 1 111 ? -3.414  20.884  -21.914 1.000 53.821 0 440 ASN AAA OD1 1 ? 4  
ATOM   846  N ND2 . ASN A 1 111 ? -3.973  18.713  -21.945 1.000 54.329 0 440 ASN AAA ND2 1 ? 4  
ATOM   847  N N   . LEU A 1 112 ? 1.530   19.654  -23.274 1.000 42.119 0 441 LEU AAA N   1 ? 4  
ATOM   848  C CA  . LEU A 1 112 ? 3.007   19.530  -23.077 1.000 41.235 0 441 LEU AAA CA  1 ? 4  
ATOM   849  C C   . LEU A 1 112 ? 3.742   20.660  -23.815 1.000 40.427 0 441 LEU AAA C   1 ? 4  
ATOM   850  O O   . LEU A 1 112 ? 4.733   21.184  -23.274 1.000 40.304 0 441 LEU AAA O   1 ? 4  
ATOM   851  C CB  . LEU A 1 112 ? 3.498   18.176  -23.604 1.000 42.535 0 441 LEU AAA CB  1 ? 4  
ATOM   852  C CG  . LEU A 1 112 ? 2.778   16.935  -23.086 1.000 47.379 0 441 LEU AAA CG  1 ? 4  
ATOM   853  C CD1 . LEU A 1 112 ? 3.039   15.725  -23.980 1.000 45.086 0 441 LEU AAA CD1 1 ? 4  
ATOM   854  C CD2 . LEU A 1 112 ? 3.188   16.650  -21.657 1.000 48.886 0 441 LEU AAA CD2 1 ? 4  
ATOM   855  N N   . ASP A 1 113 ? 3.313   21.001  -25.033 1.000 34.235 0 442 ASP AAA N   1 ? 4  
ATOM   856  C CA  . ASP A 1 113 ? 4.181   21.713  -26.002 1.000 31.493 0 442 ASP AAA CA  1 ? 4  
ATOM   857  C C   . ASP A 1 113 ? 3.760   23.167  -26.233 1.000 32.360 0 442 ASP AAA C   1 ? 4  
ATOM   858  O O   . ASP A 1 113 ? 4.471   23.856  -26.978 1.000 32.748 0 442 ASP AAA O   1 ? 4  
ATOM   859  C CB  . ASP A 1 113 ? 4.244   20.931  -27.303 1.000 30.377 0 442 ASP AAA CB  1 ? 4  
ATOM   860  C CG  . ASP A 1 113 ? 5.088   19.677  -27.156 1.000 29.114 0 442 ASP AAA CG  1 ? 4  
ATOM   861  O OD1 . ASP A 1 113 ? 6.097   19.743  -26.422 1.000 27.534 0 442 ASP AAA OD1 1 ? 4  
ATOM   862  O OD2 . ASP A 1 113 ? 4.743   18.668  -27.790 1.000 28.272 0 442 ASP AAA OD2 1 ? 4  
ATOM   863  N N   . SER A 1 114 ? 2.649   23.615  -25.664 1.000 33.858 0 443 SER AAA N   1 ? 4  
ATOM   864  C CA  A SER A 1 114 ? 2.294   25.057  -25.645 0.500 36.568 0 443 SER AAA CA  1 ? 4  
ATOM   865  C CA  B SER A 1 114 ? 2.283   25.056  -25.645 0.500 35.246 0 443 SER AAA CA  1 ? 4  
ATOM   866  C C   . SER A 1 114 ? 2.435   25.577  -24.214 1.000 38.664 0 443 SER AAA C   1 ? 4  
ATOM   867  O O   . SER A 1 114 ? 2.401   24.753  -23.290 1.000 38.130 0 443 SER AAA O   1 ? 4  
ATOM   868  C CB  A SER A 1 114 ? 0.919   25.313  -26.194 0.500 37.551 0 443 SER AAA CB  1 ? 4  
ATOM   869  C CB  B SER A 1 114 ? 0.894   25.296  -26.195 0.500 34.794 0 443 SER AAA CB  1 ? 4  
ATOM   870  O OG  A SER A 1 114 ? 0.742   26.706  -26.400 0.500 38.190 0 443 SER AAA OG  1 ? 4  
ATOM   871  O OG  B SER A 1 114 ? -0.122  24.903  -25.271 0.500 33.351 0 443 SER AAA OG  1 ? 4  
ATOM   872  N N   . LYS A 1 115 ? 2.618   26.883  -24.067 1.000 41.604 0 444 LYS AAA N   1 ? 4  
ATOM   873  C CA  . LYS A 1 115 ? 2.687   27.528  -22.737 1.000 45.522 0 444 LYS AAA CA  1 ? 4  
ATOM   874  C C   . LYS A 1 115 ? 2.211   28.968  -22.882 1.000 46.020 0 444 LYS AAA C   1 ? 4  
ATOM   875  O O   . LYS A 1 115 ? 2.170   29.469  -24.026 1.000 40.862 0 444 LYS AAA O   1 ? 4  
ATOM   876  C CB  . LYS A 1 115 ? 4.097   27.426  -22.148 1.000 50.688 0 444 LYS AAA CB  1 ? 4  
ATOM   877  C CG  . LYS A 1 115 ? 5.199   28.079  -22.966 1.000 49.699 0 444 LYS AAA CG  1 ? 4  
ATOM   878  C CD  . LYS A 1 115 ? 6.495   28.251  -22.203 1.000 54.939 0 444 LYS AAA CD  1 ? 4  
ATOM   879  C CE  . LYS A 1 115 ? 7.664   28.540  -23.124 1.000 59.036 0 444 LYS AAA CE  1 ? 4  
ATOM   880  N NZ  . LYS A 1 115 ? 8.825   29.079  -22.379 1.000 65.744 0 444 LYS AAA NZ  1 ? 4  
ATOM   881  N N   . VAL A 1 116 ? 1.843   29.570  -21.755 1.000 47.056 0 445 VAL AAA N   1 ? 4  
ATOM   882  C CA  . VAL A 1 116 ? 1.452   31.006  -21.654 1.000 50.811 0 445 VAL AAA CA  1 ? 4  
ATOM   883  C C   . VAL A 1 116 ? 2.599   31.837  -22.239 1.000 48.296 0 445 VAL AAA C   1 ? 4  
ATOM   884  O O   . VAL A 1 116 ? 3.764   31.589  -21.866 1.000 49.552 0 445 VAL AAA O   1 ? 4  
ATOM   885  C CB  . VAL A 1 116 ? 1.128   31.393  -20.200 1.000 55.059 0 445 VAL AAA CB  1 ? 4  
ATOM   886  C CG1 . VAL A 1 116 ? 0.833   32.881  -20.055 1.000 57.368 0 445 VAL AAA CG1 1 ? 4  
ATOM   887  C CG2 . VAL A 1 116 ? -0.027  30.562  -19.657 1.000 59.513 0 445 VAL AAA CG2 1 ? 4  
ATOM   888  N N   . GLY A 1 117 ? 2.278   32.738  -23.169 1.000 46.044 0 446 GLY AAA N   1 ? 4  
ATOM   889  C CA  . GLY A 1 117 ? 3.267   33.575  -23.870 1.000 44.766 0 446 GLY AAA CA  1 ? 4  
ATOM   890  C C   . GLY A 1 117 ? 3.803   32.884  -25.107 1.000 40.716 0 446 GLY AAA C   1 ? 4  
ATOM   891  O O   . GLY A 1 117 ? 4.590   33.515  -25.828 1.000 39.865 0 446 GLY AAA O   1 ? 4  
ATOM   892  N N   . GLY A 1 118 ? 3.413   31.622  -25.326 1.000 38.446 0 447 GLY AAA N   1 ? 4  
ATOM   893  C CA  . GLY A 1 118 ? 3.784   30.835  -26.509 1.000 35.415 0 447 GLY AAA CA  1 ? 4  
ATOM   894  C C   . GLY A 1 118 ? 5.030   30.012  -26.252 1.000 32.500 0 447 GLY AAA C   1 ? 4  
ATOM   895  O O   . GLY A 1 118 ? 5.934   30.501  -25.544 1.000 31.937 0 447 GLY AAA O   1 ? 4  
ATOM   896  N N   . ASN A 1 119 ? 5.084   28.801  -26.810 1.000 29.737 0 448 ASN AAA N   1 ? 4  
ATOM   897  C CA  . ASN A 1 119 ? 6.314   27.977  -26.831 1.000 28.861 0 448 ASN AAA CA  1 ? 4  
ATOM   898  C C   . ASN A 1 119 ? 6.977   28.178  -28.190 1.000 27.017 0 448 ASN AAA C   1 ? 4  
ATOM   899  O O   . ASN A 1 119 ? 6.430   27.678  -29.191 1.000 25.860 0 448 ASN AAA O   1 ? 4  
ATOM   900  C CB  . ASN A 1 119 ? 6.030   26.502  -26.557 1.000 29.010 0 448 ASN AAA CB  1 ? 4  
ATOM   901  C CG  . ASN A 1 119 ? 7.281   25.656  -26.616 1.000 31.070 0 448 ASN AAA CG  1 ? 4  
ATOM   902  O OD1 . ASN A 1 119 ? 8.390   26.175  -26.715 1.000 33.578 0 448 ASN AAA OD1 1 ? 4  
ATOM   903  N ND2 . ASN A 1 119 ? 7.116   24.348  -26.510 1.000 33.905 0 448 ASN AAA ND2 1 ? 4  
ATOM   904  N N   . TYR A 1 120 ? 8.111   28.876  -28.217 1.000 27.591 0 449 TYR AAA N   1 ? 4  
ATOM   905  C CA  . TYR A 1 120 ? 8.823   29.255  -29.464 1.000 24.734 0 449 TYR AAA CA  1 ? 4  
ATOM   906  C C   . TYR A 1 120 ? 9.952   28.262  -29.771 1.000 25.219 0 449 TYR AAA C   1 ? 4  
ATOM   907  O O   . TYR A 1 120 ? 10.624  28.413  -30.825 1.000 26.020 0 449 TYR AAA O   1 ? 4  
ATOM   908  C CB  . TYR A 1 120 ? 9.298   30.710  -29.368 1.000 25.673 0 449 TYR AAA CB  1 ? 4  
ATOM   909  C CG  . TYR A 1 120 ? 8.184   31.716  -29.479 1.000 25.038 0 449 TYR AAA CG  1 ? 4  
ATOM   910  C CD1 . TYR A 1 120 ? 7.360   31.998  -28.406 1.000 25.647 0 449 TYR AAA CD1 1 ? 4  
ATOM   911  C CD2 . TYR A 1 120 ? 7.912   32.356  -30.679 1.000 24.998 0 449 TYR AAA CD2 1 ? 4  
ATOM   912  C CE1 . TYR A 1 120 ? 6.302   32.885  -28.522 1.000 27.654 0 449 TYR AAA CE1 1 ? 4  
ATOM   913  C CE2 . TYR A 1 120 ? 6.880   33.271  -30.800 1.000 24.695 0 449 TYR AAA CE2 1 ? 4  
ATOM   914  C CZ  . TYR A 1 120 ? 6.057   33.530  -29.720 1.000 26.094 0 449 TYR AAA CZ  1 ? 4  
ATOM   915  O OH  . TYR A 1 120 ? 5.025   34.419  -29.828 1.000 28.895 0 449 TYR AAA OH  1 ? 4  
ATOM   916  N N   . ASN A 1 121 ? 10.114  27.224  -28.947 1.000 25.910 0 450 ASN AAA N   1 ? 4  
ATOM   917  C CA  . ASN A 1 121 ? 11.243  26.256  -29.047 1.000 26.098 0 450 ASN AAA CA  1 ? 4  
ATOM   918  C C   . ASN A 1 121 ? 11.164  25.428  -30.336 1.000 24.567 0 450 ASN AAA C   1 ? 4  
ATOM   919  O O   . ASN A 1 121 ? 12.247  25.072  -30.829 1.000 24.419 0 450 ASN AAA O   1 ? 4  
ATOM   920  C CB  . ASN A 1 121 ? 11.339  25.345  -27.823 1.000 31.278 0 450 ASN AAA CB  1 ? 4  
ATOM   921  C CG  . ASN A 1 121 ? 11.640  26.112  -26.551 1.000 36.213 0 450 ASN AAA CG  1 ? 4  
ATOM   922  O OD1 . ASN A 1 121 ? 12.270  27.164  -26.591 1.000 41.043 0 450 ASN AAA OD1 1 ? 4  
ATOM   923  N ND2 . ASN A 1 121 ? 11.206  25.593  -25.416 1.000 43.017 0 450 ASN AAA ND2 1 ? 4  
ATOM   924  N N   . TYR A 1 122 ? 9.957   25.117  -30.838 1.000 21.456 0 451 TYR AAA N   1 ? 4  
ATOM   925  C CA  . TYR A 1 122 ? 9.745   24.219  -31.995 1.000 22.015 0 451 TYR AAA CA  1 ? 4  
ATOM   926  C C   . TYR A 1 122 ? 9.848   25.040  -33.281 1.000 19.303 0 451 TYR AAA C   1 ? 4  
ATOM   927  O O   . TYR A 1 122 ? 9.136   26.073  -33.410 1.000 19.787 0 451 TYR AAA O   1 ? 4  
ATOM   928  C CB  . TYR A 1 122 ? 8.409   23.490  -31.888 1.000 22.374 0 451 TYR AAA CB  1 ? 4  
ATOM   929  C CG  . TYR A 1 122 ? 8.381   22.441  -30.811 1.000 21.728 0 451 TYR AAA CG  1 ? 4  
ATOM   930  C CD1 . TYR A 1 122 ? 9.051   21.238  -30.980 1.000 23.911 0 451 TYR AAA CD1 1 ? 4  
ATOM   931  C CD2 . TYR A 1 122 ? 7.674   22.631  -29.631 1.000 24.246 0 451 TYR AAA CD2 1 ? 4  
ATOM   932  C CE1 . TYR A 1 122 ? 9.032   20.253  -30.001 1.000 24.534 0 451 TYR AAA CE1 1 ? 4  
ATOM   933  C CE2 . TYR A 1 122 ? 7.654   21.655  -28.643 1.000 24.195 0 451 TYR AAA CE2 1 ? 4  
ATOM   934  C CZ  . TYR A 1 122 ? 8.321   20.459  -28.835 1.000 26.164 0 451 TYR AAA CZ  1 ? 4  
ATOM   935  O OH  . TYR A 1 122 ? 8.298   19.482  -27.871 1.000 28.097 0 451 TYR AAA OH  1 ? 4  
ATOM   936  N N   . LEU A 1 123 ? 10.733  24.596  -34.176 1.000 17.944 0 452 LEU AAA N   1 ? 4  
ATOM   937  C CA  . LEU A 1 123 ? 11.033  25.269  -35.459 1.000 17.451 0 452 LEU AAA CA  1 ? 4  
ATOM   938  C C   . LEU A 1 123 ? 10.649  24.359  -36.626 1.000 18.282 0 452 LEU AAA C   1 ? 4  
ATOM   939  O O   . LEU A 1 123 ? 10.580  23.124  -36.483 1.000 18.310 0 452 LEU AAA O   1 ? 4  
ATOM   940  C CB  . LEU A 1 123 ? 12.528  25.618  -35.536 1.000 18.736 0 452 LEU AAA CB  1 ? 4  
ATOM   941  C CG  . LEU A 1 123 ? 13.115  26.395  -34.359 1.000 20.697 0 452 LEU AAA CG  1 ? 4  
ATOM   942  C CD1 . LEU A 1 123 ? 14.592  26.721  -34.580 1.000 20.834 0 452 LEU AAA CD1 1 ? 4  
ATOM   943  C CD2 . LEU A 1 123 ? 12.333  27.663  -34.103 1.000 21.352 0 452 LEU AAA CD2 1 ? 4  
ATOM   944  N N   . TYR A 1 124 ? 10.510  24.976  -37.788 1.000 16.802 0 453 TYR AAA N   1 ? 4  
ATOM   945  C CA  . TYR A 1 124 ? 10.313  24.285  -39.077 1.000 17.013 0 453 TYR AAA CA  1 ? 4  
ATOM   946  C C   . TYR A 1 124 ? 11.140  25.042  -40.107 1.000 17.455 0 453 TYR AAA C   1 ? 4  
ATOM   947  O O   . TYR A 1 124 ? 11.369  26.271  -39.940 1.000 19.105 0 453 TYR AAA O   1 ? 4  
ATOM   948  C CB  . TYR A 1 124 ? 8.824   24.193  -39.411 1.000 17.690 0 453 TYR AAA CB  1 ? 4  
ATOM   949  C CG  . TYR A 1 124 ? 8.178   25.533  -39.622 1.000 19.886 0 453 TYR AAA CG  1 ? 4  
ATOM   950  C CD1 . TYR A 1 124 ? 7.631   26.216  -38.549 1.000 20.458 0 453 TYR AAA CD1 1 ? 4  
ATOM   951  C CD2 . TYR A 1 124 ? 8.152   26.151  -40.867 1.000 20.431 0 453 TYR AAA CD2 1 ? 4  
ATOM   952  C CE1 . TYR A 1 124 ? 7.084   27.481  -38.696 1.000 21.358 0 453 TYR AAA CE1 1 ? 4  
ATOM   953  C CE2 . TYR A 1 124 ? 7.598   27.412  -41.030 1.000 21.026 0 453 TYR AAA CE2 1 ? 4  
ATOM   954  C CZ  . TYR A 1 124 ? 7.051   28.075  -39.943 1.000 22.516 0 453 TYR AAA CZ  1 ? 4  
ATOM   955  O OH  . TYR A 1 124 ? 6.501   29.325  -40.028 1.000 25.054 0 453 TYR AAA OH  1 ? 4  
ATOM   956  N N   . ARG A 1 125 ? 11.529  24.341  -41.166 1.000 17.362 0 454 ARG AAA N   1 ? 4  
ATOM   957  C CA  . ARG A 1 125 ? 12.190  24.966  -42.334 1.000 17.923 0 454 ARG AAA CA  1 ? 4  
ATOM   958  C C   . ARG A 1 125 ? 11.093  25.456  -43.278 1.000 17.957 0 454 ARG AAA C   1 ? 4  
ATOM   959  O O   . ARG A 1 125 ? 10.239  24.650  -43.639 1.000 18.732 0 454 ARG AAA O   1 ? 4  
ATOM   960  C CB  . ARG A 1 125 ? 13.158  23.990  -43.006 1.000 18.399 0 454 ARG AAA CB  1 ? 4  
ATOM   961  C CG  . ARG A 1 125 ? 13.933  24.599  -44.171 1.000 18.981 0 454 ARG AAA CG  1 ? 4  
ATOM   962  C CD  . ARG A 1 125 ? 14.930  23.624  -44.784 1.000 20.161 0 454 ARG AAA CD  1 ? 4  
ATOM   963  N NE  . ARG A 1 125 ? 15.818  23.100  -43.763 1.000 19.321 0 454 ARG AAA NE  1 ? 4  
ATOM   964  C CZ  . ARG A 1 125 ? 16.907  23.701  -43.309 1.000 20.087 0 454 ARG AAA CZ  1 ? 4  
ATOM   965  N NH1 . ARG A 1 125 ? 17.285  24.871  -43.791 1.000 20.886 0 454 ARG AAA NH1 1 ? 4  
ATOM   966  N NH2 . ARG A 1 125 ? 17.578  23.153  -42.309 1.000 21.786 0 454 ARG AAA NH2 1 ? 4  
ATOM   967  N N   . LEU A 1 126 ? 11.127  26.744  -43.645 1.000 18.812 0 455 LEU AAA N   1 ? 4  
ATOM   968  C CA  . LEU A 1 126 ? 10.114  27.384  -44.517 1.000 18.117 0 455 LEU AAA CA  1 ? 4  
ATOM   969  C C   . LEU A 1 126 ? 10.636  27.516  -45.947 1.000 18.409 0 455 LEU AAA C   1 ? 4  
ATOM   970  O O   . LEU A 1 126 ? 9.817   27.625  -46.850 1.000 18.933 0 455 LEU AAA O   1 ? 4  
ATOM   971  C CB  . LEU A 1 126 ? 9.770   28.764  -43.950 1.000 20.014 0 455 LEU AAA CB  1 ? 4  
ATOM   972  C CG  . LEU A 1 126 ? 8.680   29.536  -44.687 1.000 21.780 0 455 LEU AAA CG  1 ? 4  
ATOM   973  C CD1 . LEU A 1 126 ? 7.403   28.728  -44.828 1.000 23.649 0 455 LEU AAA CD1 1 ? 4  
ATOM   974  C CD2 . LEU A 1 126 ? 8.387   30.861  -44.000 1.000 24.945 0 455 LEU AAA CD2 1 ? 4  
ATOM   975  N N   . PHE A 1 127 ? 11.951  27.587  -46.135 1.000 18.428 0 456 PHE AAA N   1 ? 4  
ATOM   976  C CA  . PHE A 1 127 ? 12.588  27.848  -47.445 1.000 19.011 0 456 PHE AAA CA  1 ? 4  
ATOM   977  C C   . PHE A 1 127 ? 13.685  26.820  -47.716 1.000 19.935 0 456 PHE AAA C   1 ? 4  
ATOM   978  O O   . PHE A 1 127 ? 14.463  26.493  -46.782 1.000 18.206 0 456 PHE AAA O   1 ? 4  
ATOM   979  C CB  . PHE A 1 127 ? 13.204  29.244  -47.469 1.000 20.160 0 456 PHE AAA CB  1 ? 4  
ATOM   980  C CG  . PHE A 1 127 ? 12.223  30.347  -47.176 1.000 21.043 0 456 PHE AAA CG  1 ? 4  
ATOM   981  C CD1 . PHE A 1 127 ? 11.326  30.774  -48.140 1.000 23.415 0 456 PHE AAA CD1 1 ? 4  
ATOM   982  C CD2 . PHE A 1 127 ? 12.182  30.927  -45.920 1.000 22.890 0 456 PHE AAA CD2 1 ? 4  
ATOM   983  C CE1 . PHE A 1 127 ? 10.436  31.805  -47.872 1.000 23.474 0 456 PHE AAA CE1 1 ? 4  
ATOM   984  C CE2 . PHE A 1 127 ? 11.259  31.915  -45.632 1.000 22.718 0 456 PHE AAA CE2 1 ? 4  
ATOM   985  C CZ  . PHE A 1 127 ? 10.398  32.357  -46.612 1.000 23.153 0 456 PHE AAA CZ  1 ? 4  
ATOM   986  N N   . ARG A 1 128 ? 13.735  26.322  -48.955 1.000 18.565 0 457 ARG AAA N   1 ? 4  
ATOM   987  C CA  . ARG A 1 128 ? 14.812  25.411  -49.417 1.000 19.675 0 457 ARG AAA CA  1 ? 4  
ATOM   988  C C   . ARG A 1 128 ? 14.865  25.472  -50.944 1.000 21.295 0 457 ARG AAA C   1 ? 4  
ATOM   989  O O   . ARG A 1 128 ? 13.815  25.659  -51.567 1.000 22.014 0 457 ARG AAA O   1 ? 4  
ATOM   990  C CB  . ARG A 1 128 ? 14.553  23.998  -48.882 1.000 19.406 0 457 ARG AAA CB  1 ? 4  
ATOM   991  C CG  . ARG A 1 128 ? 15.788  23.108  -48.829 1.000 19.219 0 457 ARG AAA CG  1 ? 4  
ATOM   992  C CD  . ARG A 1 128 ? 15.510  21.760  -48.172 1.000 21.081 0 457 ARG AAA CD  1 ? 4  
ATOM   993  N NE  . ARG A 1 128 ? 16.754  21.019  -47.980 1.000 21.513 0 457 ARG AAA NE  1 ? 4  
ATOM   994  C CZ  . ARG A 1 128 ? 17.258  20.120  -48.816 1.000 23.516 0 457 ARG AAA CZ  1 ? 4  
ATOM   995  N NH1 . ARG A 1 128 ? 16.609  19.781  -49.913 1.000 25.237 0 457 ARG AAA NH1 1 ? 4  
ATOM   996  N NH2 . ARG A 1 128 ? 18.413  19.533  -48.538 1.000 26.622 0 457 ARG AAA NH2 1 ? 4  
ATOM   997  N N   . LYS A 1 129 ? 16.050  25.313  -51.518 1.000 22.973 0 458 LYS AAA N   1 ? 4  
ATOM   998  C CA  . LYS A 1 129 ? 16.248  25.405  -52.995 1.000 24.550 0 458 LYS AAA CA  1 ? 4  
ATOM   999  C C   . LYS A 1 129 ? 15.674  24.174  -53.700 1.000 24.951 0 458 LYS AAA C   1 ? 4  
ATOM   1000 O O   . LYS A 1 129 ? 15.455  24.232  -54.922 1.000 26.112 0 458 LYS AAA O   1 ? 4  
ATOM   1001 C CB  . LYS A 1 129 ? 17.737  25.573  -53.297 1.000 27.096 0 458 LYS AAA CB  1 ? 4  
ATOM   1002 C CG  . LYS A 1 129 ? 18.302  26.927  -52.894 1.000 29.598 0 458 LYS AAA CG  1 ? 4  
ATOM   1003 C CD  . LYS A 1 129 ? 19.830  26.971  -52.918 1.000 34.515 0 458 LYS AAA CD  1 ? 4  
ATOM   1004 C CE  . LYS A 1 129 ? 20.403  27.132  -54.305 1.000 44.726 0 458 LYS AAA CE  1 ? 4  
ATOM   1005 N NZ  . LYS A 1 129 ? 21.880  27.274  -54.254 1.000 50.770 0 458 LYS AAA NZ  1 ? 4  
ATOM   1006 N N   . SER A 1 130 ? 15.480  23.072  -52.983 1.000 24.517 0 459 SER AAA N   1 ? 4  
ATOM   1007 C CA  . SER A 1 130 ? 14.944  21.808  -53.550 1.000 26.077 0 459 SER AAA CA  1 ? 4  
ATOM   1008 C C   . SER A 1 130 ? 14.250  21.009  -52.458 1.000 25.848 0 459 SER AAA C   1 ? 4  
ATOM   1009 O O   . SER A 1 130 ? 14.480  21.298  -51.263 1.000 22.743 0 459 SER AAA O   1 ? 4  
ATOM   1010 C CB  . SER A 1 130 ? 16.040  21.003  -54.212 1.000 29.559 0 459 SER AAA CB  1 ? 4  
ATOM   1011 O OG  . SER A 1 130 ? 16.938  20.510  -53.229 1.000 30.058 0 459 SER AAA OG  1 ? 4  
ATOM   1012 N N   . ASN A 1 131 ? 13.423  20.050  -52.858 1.000 26.484 0 460 ASN AAA N   1 ? 4  
ATOM   1013 C CA  . ASN A 1 131 ? 12.695  19.165  -51.918 1.000 28.188 0 460 ASN AAA CA  1 ? 4  
ATOM   1014 C C   . ASN A 1 131 ? 13.674  18.157  -51.320 1.000 27.560 0 460 ASN AAA C   1 ? 4  
ATOM   1015 O O   . ASN A 1 131 ? 14.616  17.749  -52.006 1.000 28.293 0 460 ASN AAA O   1 ? 4  
ATOM   1016 C CB  . ASN A 1 131 ? 11.540  18.443  -52.598 1.000 28.419 0 460 ASN AAA CB  1 ? 4  
ATOM   1017 C CG  . ASN A 1 131 ? 10.446  19.392  -53.039 1.000 31.464 0 460 ASN AAA CG  1 ? 4  
ATOM   1018 O OD1 . ASN A 1 131 ? 10.446  20.572  -52.678 1.000 29.452 0 460 ASN AAA OD1 1 ? 4  
ATOM   1019 N ND2 . ASN A 1 131 ? 9.519   18.881  -53.833 1.000 34.718 0 460 ASN AAA ND2 1 ? 4  
ATOM   1020 N N   . LEU A 1 132 ? 13.436  17.775  -50.071 1.000 25.853 0 461 LEU AAA N   1 ? 4  
ATOM   1021 C CA  . LEU A 1 132 ? 14.145  16.654  -49.412 1.000 26.743 0 461 LEU AAA CA  1 ? 4  
ATOM   1022 C C   . LEU A 1 132 ? 13.899  15.363  -50.188 1.000 29.068 0 461 LEU AAA C   1 ? 4  
ATOM   1023 O O   . LEU A 1 132 ? 12.775  15.164  -50.698 1.000 29.826 0 461 LEU AAA O   1 ? 4  
ATOM   1024 C CB  . LEU A 1 132 ? 13.615  16.482  -47.993 1.000 24.965 0 461 LEU AAA CB  1 ? 4  
ATOM   1025 C CG  . LEU A 1 132 ? 13.966  17.599  -47.020 1.000 24.644 0 461 LEU AAA CG  1 ? 4  
ATOM   1026 C CD1 . LEU A 1 132 ? 13.382  17.271  -45.672 1.000 23.861 0 461 LEU AAA CD1 1 ? 4  
ATOM   1027 C CD2 . LEU A 1 132 ? 15.469  17.792  -46.910 1.000 24.903 0 461 LEU AAA CD2 1 ? 4  
ATOM   1028 N N   . LYS A 1 133 ? 14.904  14.495  -50.199 1.000 28.403 0 462 LYS AAA N   1 ? 4  
ATOM   1029 C CA  . LYS A 1 133 ? 14.731  13.068  -50.566 1.000 30.993 0 462 LYS AAA CA  1 ? 4  
ATOM   1030 C C   . LYS A 1 133 ? 14.074  12.380  -49.376 1.000 29.345 0 462 LYS AAA C   1 ? 4  
ATOM   1031 O O   . LYS A 1 133 ? 14.111  12.895  -48.254 1.000 24.949 0 462 LYS AAA O   1 ? 4  
ATOM   1032 C CB  . LYS A 1 133 ? 16.071  12.439  -50.954 1.000 35.131 0 462 LYS AAA CB  1 ? 4  
ATOM   1033 C CG  . LYS A 1 133 ? 16.715  13.044  -52.197 1.000 39.925 0 462 LYS AAA CG  1 ? 4  
ATOM   1034 C CD  . LYS A 1 133 ? 18.078  12.463  -52.523 1.000 47.959 0 462 LYS AAA CD  1 ? 4  
ATOM   1035 C CE  . LYS A 1 133 ? 19.100  12.641  -51.418 1.000 53.477 0 462 LYS AAA CE  1 ? 4  
ATOM   1036 N NZ  . LYS A 1 133 ? 20.489  12.474  -51.915 1.000 59.386 0 462 LYS AAA NZ  1 ? 4  
ATOM   1037 N N   . PRO A 1 134 ? 13.409  11.223  -49.579 1.000 29.837 0 463 PRO AAA N   1 ? 4  
ATOM   1038 C CA  . PRO A 1 134 ? 12.824  10.488  -48.458 1.000 29.562 0 463 PRO AAA CA  1 ? 4  
ATOM   1039 C C   . PRO A 1 134 ? 13.856  10.213  -47.355 1.000 29.323 0 463 PRO AAA C   1 ? 4  
ATOM   1040 O O   . PRO A 1 134 ? 14.968  9.821   -47.676 1.000 28.544 0 463 PRO AAA O   1 ? 4  
ATOM   1041 C CB  . PRO A 1 134 ? 12.306  9.197   -49.099 1.000 31.657 0 463 PRO AAA CB  1 ? 4  
ATOM   1042 C CG  . PRO A 1 134 ? 12.081  9.572   -50.553 1.000 33.666 0 463 PRO AAA CG  1 ? 4  
ATOM   1043 C CD  . PRO A 1 134 ? 13.192  10.551  -50.868 1.000 33.110 0 463 PRO AAA CD  1 ? 4  
ATOM   1044 N N   . PHE A 1 135 ? 13.480  10.508  -46.109 1.000 27.629 0 464 PHE AAA N   1 ? 4  
ATOM   1045 C CA  . PHE A 1 135 ? 14.275  10.278  -44.878 1.000 28.005 0 464 PHE AAA CA  1 ? 4  
ATOM   1046 C C   . PHE A 1 135 ? 15.556  11.123  -44.890 1.000 29.373 0 464 PHE AAA C   1 ? 4  
ATOM   1047 O O   . PHE A 1 135 ? 16.465  10.819  -44.110 1.000 27.672 0 464 PHE AAA O   1 ? 4  
ATOM   1048 C CB  . PHE A 1 135 ? 14.581  8.785   -44.727 1.000 29.987 0 464 PHE AAA CB  1 ? 4  
ATOM   1049 C CG  . PHE A 1 135 ? 13.367  7.911   -44.532 1.000 29.543 0 464 PHE AAA CG  1 ? 4  
ATOM   1050 C CD1 . PHE A 1 135 ? 12.456  8.165   -43.515 1.000 28.312 0 464 PHE AAA CD1 1 ? 4  
ATOM   1051 C CD2 . PHE A 1 135 ? 13.175  6.780   -45.313 1.000 30.966 0 464 PHE AAA CD2 1 ? 4  
ATOM   1052 C CE1 . PHE A 1 135 ? 11.351  7.346   -43.328 1.000 29.662 0 464 PHE AAA CE1 1 ? 4  
ATOM   1053 C CE2 . PHE A 1 135 ? 12.063  5.969   -45.129 1.000 31.800 0 464 PHE AAA CE2 1 ? 4  
ATOM   1054 C CZ  . PHE A 1 135 ? 11.164  6.237   -44.123 1.000 30.399 0 464 PHE AAA CZ  1 ? 4  
ATOM   1055 N N   . GLU A 1 136 ? 15.605  12.183  -45.707 1.000 26.664 0 465 GLU AAA N   1 ? 4  
ATOM   1056 C CA  . GLU A 1 136 ? 16.700  13.184  -45.650 1.000 27.741 0 465 GLU AAA CA  1 ? 4  
ATOM   1057 C C   . GLU A 1 136 ? 16.429  14.100  -44.458 1.000 25.891 0 465 GLU AAA C   1 ? 4  
ATOM   1058 O O   . GLU A 1 136 ? 15.239  14.409  -44.183 1.000 23.700 0 465 GLU AAA O   1 ? 4  
ATOM   1059 C CB  . GLU A 1 136 ? 16.806  13.972  -46.953 1.000 29.349 0 465 GLU AAA CB  1 ? 4  
ATOM   1060 C CG  . GLU A 1 136 ? 18.050  14.849  -47.017 1.000 32.151 0 465 GLU AAA CG  1 ? 4  
ATOM   1061 C CD  . GLU A 1 136 ? 18.295  15.530  -48.355 1.000 34.638 0 465 GLU AAA CD  1 ? 4  
ATOM   1062 O OE1 . GLU A 1 136 ? 17.434  15.401  -49.248 1.000 32.422 0 465 GLU AAA OE1 1 ? 4  
ATOM   1063 O OE2 . GLU A 1 136 ? 19.359  16.179  -48.503 1.000 37.688 0 465 GLU AAA OE2 1 ? 4  
ATOM   1064 N N   . ARG A 1 137 ? 17.492  14.473  -43.754 1.000 24.543 0 466 ARG AAA N   1 ? 4  
ATOM   1065 C CA  . ARG A 1 137 ? 17.449  15.488  -42.682 1.000 23.663 0 466 ARG AAA CA  1 ? 4  
ATOM   1066 C C   . ARG A 1 137 ? 18.351  16.651  -43.094 1.000 22.954 0 466 ARG AAA C   1 ? 4  
ATOM   1067 O O   . ARG A 1 137 ? 19.517  16.412  -43.472 1.000 25.020 0 466 ARG AAA O   1 ? 4  
ATOM   1068 C CB  . ARG A 1 137 ? 17.881  14.923  -41.328 1.000 25.244 0 466 ARG AAA CB  1 ? 4  
ATOM   1069 C CG  . ARG A 1 137 ? 17.647  15.925  -40.205 1.000 25.888 0 466 ARG AAA CG  1 ? 4  
ATOM   1070 C CD  . ARG A 1 137 ? 18.249  15.543  -38.874 1.000 30.450 0 466 ARG AAA CD  1 ? 4  
ATOM   1071 N NE  . ARG A 1 137 ? 17.671  14.320  -38.375 1.000 29.969 0 466 ARG AAA NE  1 ? 4  
ATOM   1072 C CZ  . ARG A 1 137 ? 18.273  13.121  -38.348 1.000 38.097 0 466 ARG AAA CZ  1 ? 4  
ATOM   1073 N NH1 . ARG A 1 137 ? 19.516  12.966  -38.786 1.000 39.273 0 466 ARG AAA NH1 1 ? 4  
ATOM   1074 N NH2 . ARG A 1 137 ? 17.625  12.071  -37.860 1.000 36.163 0 466 ARG AAA NH2 1 ? 4  
ATOM   1075 N N   . ASP A 1 138 ? 17.840  17.863  -43.001 1.000 20.944 0 467 ASP AAA N   1 ? 4  
ATOM   1076 C CA  . ASP A 1 138 ? 18.611  19.097  -43.307 1.000 20.426 0 467 ASP AAA CA  1 ? 4  
ATOM   1077 C C   . ASP A 1 138 ? 18.614  19.946  -42.042 1.000 18.575 0 467 ASP AAA C   1 ? 4  
ATOM   1078 O O   . ASP A 1 138 ? 17.526  20.396  -41.655 1.000 19.122 0 467 ASP AAA O   1 ? 4  
ATOM   1079 C CB  . ASP A 1 138 ? 18.021  19.818  -44.525 1.000 22.779 0 467 ASP AAA CB  1 ? 4  
ATOM   1080 C CG  . ASP A 1 138 ? 18.823  21.041  -44.948 1.000 24.417 0 467 ASP AAA CG  1 ? 4  
ATOM   1081 O OD1 . ASP A 1 138 ? 19.828  21.341  -44.264 1.000 25.384 0 467 ASP AAA OD1 1 ? 4  
ATOM   1082 O OD2 . ASP A 1 138 ? 18.465  21.663  -45.974 1.000 25.594 0 467 ASP AAA OD2 1 ? 4  
ATOM   1083 N N   . ILE A 1 139 ? 19.782  20.153  -41.415 1.000 20.649 0 468 ILE AAA N   1 ? 4  
ATOM   1084 C CA  . ILE A 1 139 ? 19.885  21.033  -40.208 1.000 20.699 0 468 ILE AAA CA  1 ? 4  
ATOM   1085 C C   . ILE A 1 139 ? 20.750  22.258  -40.521 1.000 20.625 0 468 ILE AAA C   1 ? 4  
ATOM   1086 O O   . ILE A 1 139 ? 21.199  22.920  -39.563 1.000 20.452 0 468 ILE AAA O   1 ? 4  
ATOM   1087 C CB  . ILE A 1 139 ? 20.408  20.269  -38.973 1.000 21.542 0 468 ILE AAA CB  1 ? 4  
ATOM   1088 C CG1 . ILE A 1 139 ? 21.795  19.669  -39.215 1.000 23.193 0 468 ILE AAA CG1 1 ? 4  
ATOM   1089 C CG2 . ILE A 1 139 ? 19.395  19.218  -38.530 1.000 22.232 0 468 ILE AAA CG2 1 ? 4  
ATOM   1090 C CD1 . ILE A 1 139 ? 22.430  19.107  -37.976 1.000 25.171 0 468 ILE AAA CD1 1 ? 4  
ATOM   1091 N N   . SER A 1 140 ? 20.974  22.557  -41.804 1.000 20.184 0 469 SER AAA N   1 ? 4  
ATOM   1092 C CA  . SER A 1 140 ? 21.760  23.732  -42.253 1.000 21.269 0 469 SER AAA CA  1 ? 4  
ATOM   1093 C C   . SER A 1 140 ? 20.951  25.008  -41.992 1.000 20.405 0 469 SER AAA C   1 ? 4  
ATOM   1094 O O   . SER A 1 140 ? 19.693  24.940  -41.901 1.000 20.429 0 469 SER AAA O   1 ? 4  
ATOM   1095 C CB  . SER A 1 140 ? 22.183  23.611  -43.711 1.000 22.356 0 469 SER AAA CB  1 ? 4  
ATOM   1096 O OG  . SER A 1 140 ? 21.050  23.641  -44.575 1.000 22.354 0 469 SER AAA OG  1 ? 4  
ATOM   1097 N N   . THR A 1 141 ? 21.637  26.140  -41.883 1.000 21.945 0 470 THR AAA N   1 ? 4  
ATOM   1098 C CA  . THR A 1 141 ? 21.018  27.466  -41.628 1.000 21.521 0 470 THR AAA CA  1 ? 4  
ATOM   1099 C C   . THR A 1 141 ? 21.672  28.511  -42.537 1.000 23.330 0 470 THR AAA C   1 ? 4  
ATOM   1100 O O   . THR A 1 141 ? 21.917  29.644  -42.073 1.000 22.908 0 470 THR AAA O   1 ? 4  
ATOM   1101 C CB  . THR A 1 141 ? 21.086  27.816  -40.140 1.000 23.162 0 470 THR AAA CB  1 ? 4  
ATOM   1102 O OG1 . THR A 1 141 ? 22.443  27.672  -39.734 1.000 23.543 0 470 THR AAA OG1 1 ? 4  
ATOM   1103 C CG2 . THR A 1 141 ? 20.183  26.951  -39.293 1.000 23.972 0 470 THR AAA CG2 1 ? 4  
ATOM   1104 N N   . GLU A 1 142 ? 21.897  28.150  -43.802 1.000 21.413 0 471 GLU AAA N   1 ? 4  
ATOM   1105 C CA  . GLU A 1 142 ? 22.390  29.074  -44.850 1.000 22.915 0 471 GLU AAA CA  1 ? 4  
ATOM   1106 C C   . GLU A 1 142 ? 21.282  30.084  -45.146 1.000 18.680 0 471 GLU AAA C   1 ? 4  
ATOM   1107 O O   . GLU A 1 142 ? 20.096  29.707  -45.167 1.000 19.789 0 471 GLU AAA O   1 ? 4  
ATOM   1108 C CB  . GLU A 1 142 ? 22.814  28.299  -46.101 1.000 27.490 0 471 GLU AAA CB  1 ? 4  
ATOM   1109 C CG  . GLU A 1 142 ? 24.010  27.399  -45.850 1.000 34.221 0 471 GLU AAA CG  1 ? 4  
ATOM   1110 C CD  . GLU A 1 142 ? 24.850  27.071  -47.070 1.000 42.518 0 471 GLU AAA CD  1 ? 4  
ATOM   1111 O OE1 . GLU A 1 142 ? 24.273  26.976  -48.173 1.000 49.400 0 471 GLU AAA OE1 1 ? 4  
ATOM   1112 O OE2 . GLU A 1 142 ? 26.084  26.930  -46.913 1.000 51.642 0 471 GLU AAA OE2 1 ? 4  
ATOM   1113 N N   . ILE A 1 143 ? 21.640  31.345  -45.335 1.000 20.963 0 472 ILE AAA N   1 ? 4  
ATOM   1114 C CA  . ILE A 1 143 ? 20.637  32.386  -45.705 1.000 20.664 0 472 ILE AAA CA  1 ? 4  
ATOM   1115 C C   . ILE A 1 143 ? 20.088  32.015  -47.081 1.000 19.414 0 472 ILE AAA C   1 ? 4  
ATOM   1116 O O   . ILE A 1 143 ? 20.881  31.734  -47.984 1.000 21.383 0 472 ILE AAA O   1 ? 4  
ATOM   1117 C CB  . ILE A 1 143 ? 21.221  33.806  -45.653 1.000 20.915 0 472 ILE AAA CB  1 ? 4  
ATOM   1118 C CG1 . ILE A 1 143 ? 21.795  34.098  -44.261 1.000 23.547 0 472 ILE AAA CG1 1 ? 4  
ATOM   1119 C CG2 . ILE A 1 143 ? 20.165  34.823  -46.077 1.000 21.673 0 472 ILE AAA CG2 1 ? 4  
ATOM   1120 C CD1 . ILE A 1 143 ? 20.818  33.853  -43.129 1.000 23.514 0 472 ILE AAA CD1 1 ? 4  
ATOM   1121 N N   . TYR A 1 144 ? 18.767  31.958  -47.192 1.000 18.326 0 473 TYR AAA N   1 ? 4  
ATOM   1122 C CA  . TYR A 1 144 ? 18.050  31.580  -48.427 1.000 18.871 0 473 TYR AAA CA  1 ? 4  
ATOM   1123 C C   . TYR A 1 144 ? 17.837  32.839  -49.279 1.000 18.791 0 473 TYR AAA C   1 ? 4  
ATOM   1124 O O   . TYR A 1 144 ? 17.239  33.837  -48.818 1.000 17.598 0 473 TYR AAA O   1 ? 4  
ATOM   1125 C CB  . TYR A 1 144 ? 16.729  30.907  -48.062 1.000 18.885 0 473 TYR AAA CB  1 ? 4  
ATOM   1126 C CG  . TYR A 1 144 ? 15.855  30.636  -49.248 1.000 19.031 0 473 TYR AAA CG  1 ? 4  
ATOM   1127 C CD1 . TYR A 1 144 ? 16.024  29.482  -49.995 1.000 19.948 0 473 TYR AAA CD1 1 ? 4  
ATOM   1128 C CD2 . TYR A 1 144 ? 14.875  31.539  -49.635 1.000 20.305 0 473 TYR AAA CD2 1 ? 4  
ATOM   1129 C CE1 . TYR A 1 144 ? 15.224  29.213  -51.090 1.000 22.510 0 473 TYR AAA CE1 1 ? 4  
ATOM   1130 C CE2 . TYR A 1 144 ? 14.081  31.290  -50.744 1.000 20.237 0 473 TYR AAA CE2 1 ? 4  
ATOM   1131 C CZ  . TYR A 1 144 ? 14.256  30.128  -51.466 1.000 20.878 0 473 TYR AAA CZ  1 ? 4  
ATOM   1132 O OH  . TYR A 1 144 ? 13.473  29.888  -52.552 1.000 23.188 0 473 TYR AAA OH  1 ? 4  
ATOM   1133 N N   . GLN A 1 145 ? 18.293  32.782  -50.524 1.000 19.041 0 474 GLN AAA N   1 ? 4  
ATOM   1134 C CA  . GLN A 1 145 ? 18.100  33.890  -51.489 1.000 19.606 0 474 GLN AAA CA  1 ? 4  
ATOM   1135 C C   . GLN A 1 145 ? 16.682  33.831  -52.055 1.000 19.200 0 474 GLN AAA C   1 ? 4  
ATOM   1136 O O   . GLN A 1 145 ? 16.380  32.906  -52.839 1.000 18.596 0 474 GLN AAA O   1 ? 4  
ATOM   1137 C CB  . GLN A 1 145 ? 19.154  33.834  -52.579 1.000 21.544 0 474 GLN AAA CB  1 ? 4  
ATOM   1138 C CG  . GLN A 1 145 ? 19.163  35.084  -53.439 1.000 21.511 0 474 GLN AAA CG  1 ? 4  
ATOM   1139 C CD  . GLN A 1 145 ? 20.069  34.954  -54.633 1.000 24.185 0 474 GLN AAA CD  1 ? 4  
ATOM   1140 O OE1 . GLN A 1 145 ? 21.192  34.452  -54.522 1.000 24.544 0 474 GLN AAA OE1 1 ? 4  
ATOM   1141 N NE2 . GLN A 1 145 ? 19.608  35.451  -55.779 1.000 25.574 0 474 GLN AAA NE2 1 ? 4  
ATOM   1142 N N   . ALA A 1 146 ? 15.842  34.788  -51.670 1.000 19.538 0 475 ALA AAA N   1 ? 4  
ATOM   1143 C CA  . ALA A 1 146 ? 14.414  34.853  -52.061 1.000 21.821 0 475 ALA AAA CA  1 ? 4  
ATOM   1144 C C   . ALA A 1 146 ? 14.175  35.967  -53.094 1.000 23.564 0 475 ALA AAA C   1 ? 4  
ATOM   1145 O O   . ALA A 1 146 ? 12.997  36.204  -53.435 1.000 26.075 0 475 ALA AAA O   1 ? 4  
ATOM   1146 C CB  . ALA A 1 146 ? 13.560  35.053  -50.840 1.000 22.991 0 475 ALA AAA CB  1 ? 4  
ATOM   1147 N N   . GLY A 1 147 ? 15.219  36.663  -53.536 1.000 21.623 0 476 GLY AAA N   1 ? 4  
ATOM   1148 C CA  . GLY A 1 147 ? 15.126  37.775  -54.495 1.000 24.813 0 476 GLY AAA CA  1 ? 4  
ATOM   1149 C C   . GLY A 1 147 ? 16.207  37.650  -55.539 1.000 24.103 0 476 GLY AAA C   1 ? 4  
ATOM   1150 O O   . GLY A 1 147 ? 16.890  36.603  -55.562 1.000 24.348 0 476 GLY AAA O   1 ? 4  
ATOM   1151 N N   . SER A 1 148 ? 16.393  38.687  -56.353 1.000 26.235 0 477 SER AAA N   1 ? 4  
ATOM   1152 C CA  . SER A 1 148 ? 17.333  38.671  -57.495 1.000 27.124 0 477 SER AAA CA  1 ? 4  
ATOM   1153 C C   . SER A 1 148 ? 18.747  39.016  -57.024 1.000 27.984 0 477 SER AAA C   1 ? 4  
ATOM   1154 O O   . SER A 1 148 ? 19.638  38.901  -57.828 1.000 32.306 0 477 SER AAA O   1 ? 4  
ATOM   1155 C CB  . SER A 1 148 ? 16.902  39.640  -58.543 1.000 29.431 0 477 SER AAA CB  1 ? 4  
ATOM   1156 O OG  . SER A 1 148 ? 16.963  40.949  -57.996 1.000 29.131 0 477 SER AAA OG  1 ? 4  
ATOM   1157 N N   . THR A 1 149 ? 18.924  39.437  -55.767 1.000 28.830 0 478 THR AAA N   1 ? 4  
ATOM   1158 C CA  A THR A 1 149 ? 20.211  39.952  -55.229 0.500 29.750 0 478 THR AAA CA  1 ? 4  
ATOM   1159 C CA  B THR A 1 149 ? 20.214  39.951  -55.236 0.500 29.210 0 478 THR AAA CA  1 ? 4  
ATOM   1160 C C   . THR A 1 149 ? 20.892  38.879  -54.382 1.000 27.779 0 478 THR AAA C   1 ? 4  
ATOM   1161 O O   . THR A 1 149 ? 20.268  38.282  -53.521 1.000 24.960 0 478 THR AAA O   1 ? 4  
ATOM   1162 C CB  A THR A 1 149 ? 19.965  41.224  -54.411 0.500 30.665 0 478 THR AAA CB  1 ? 4  
ATOM   1163 C CB  B THR A 1 149 ? 20.000  41.254  -54.454 0.500 29.552 0 478 THR AAA CB  1 ? 4  
ATOM   1164 O OG1 A THR A 1 149 ? 19.199  42.112  -55.227 0.500 34.652 0 478 THR AAA OG1 1 ? 4  
ATOM   1165 O OG1 B THR A 1 149 ? 18.917  41.093  -53.536 0.500 29.094 0 478 THR AAA OG1 1 ? 4  
ATOM   1166 C CG2 A THR A 1 149 ? 21.239  41.908  -53.961 0.500 31.894 0 478 THR AAA CG2 1 ? 4  
ATOM   1167 C CG2 B THR A 1 149 ? 19.718  42.433  -55.362 0.500 32.070 0 478 THR AAA CG2 1 ? 4  
ATOM   1168 N N   . PRO A 1 150 ? 22.202  38.615  -54.576 1.000 27.861 0 479 PRO AAA N   1 ? 4  
ATOM   1169 C CA  . PRO A 1 150 ? 22.900  37.658  -53.723 1.000 27.517 0 479 PRO AAA CA  1 ? 4  
ATOM   1170 C C   . PRO A 1 150 ? 22.881  38.133  -52.263 1.000 24.733 0 479 PRO AAA C   1 ? 4  
ATOM   1171 O O   . PRO A 1 150 ? 22.943  39.346  -52.009 1.000 25.266 0 479 PRO AAA O   1 ? 4  
ATOM   1172 C CB  . PRO A 1 150 ? 24.337  37.616  -54.267 1.000 30.972 0 479 PRO AAA CB  1 ? 4  
ATOM   1173 C CG  . PRO A 1 150 ? 24.470  38.841  -55.135 1.000 33.402 0 479 PRO AAA CG  1 ? 4  
ATOM   1174 C CD  . PRO A 1 150 ? 23.076  39.167  -55.630 1.000 32.271 0 479 PRO AAA CD  1 ? 4  
ATOM   1175 N N   . CYS A 1 151 ? 22.802  37.191  -51.338 1.000 24.320 0 480 CYS AAA N   1 ? 4  
ATOM   1176 C CA  . CYS A 1 151 ? 22.711  37.496  -49.889 1.000 23.852 0 480 CYS AAA CA  1 ? 4  
ATOM   1177 C C   . CYS A 1 151 ? 24.104  37.624  -49.270 1.000 26.573 0 480 CYS AAA C   1 ? 4  
ATOM   1178 O O   . CYS A 1 151 ? 24.234  38.390  -48.282 1.000 25.493 0 480 CYS AAA O   1 ? 4  
ATOM   1179 C CB  . CYS A 1 151 ? 21.892  36.443  -49.175 1.000 24.198 0 480 CYS AAA CB  1 ? 4  
ATOM   1180 S SG  . CYS A 1 151 ? 20.211  36.388  -49.843 1.000 28.292 0 480 CYS AAA SG  1 ? 4  
ATOM   1181 N N   . ASN A 1 152 ? 25.085  36.872  -49.777 1.000 27.475 0 481 ASN AAA N   1 ? 4  
ATOM   1182 C CA  . ASN A 1 152 ? 26.475  36.883  -49.239 1.000 28.988 0 481 ASN AAA CA  1 ? 4  
ATOM   1183 C C   . ASN A 1 152 ? 26.425  36.542  -47.738 1.000 27.329 0 481 ASN AAA C   1 ? 4  
ATOM   1184 O O   . ASN A 1 152 ? 27.255  37.074  -46.972 1.000 29.395 0 481 ASN AAA O   1 ? 4  
ATOM   1185 C CB  . ASN A 1 152 ? 27.154  38.221  -49.537 1.000 30.790 0 481 ASN AAA CB  1 ? 4  
ATOM   1186 C CG  . ASN A 1 152 ? 27.191  38.542  -51.019 1.000 33.470 0 481 ASN AAA CG  1 ? 4  
ATOM   1187 O OD1 . ASN A 1 152 ? 27.571  37.703  -51.829 1.000 35.947 0 481 ASN AAA OD1 1 ? 4  
ATOM   1188 N ND2 . ASN A 1 152 ? 26.800  39.745  -51.396 1.000 34.955 0 481 ASN AAA ND2 1 ? 4  
ATOM   1189 N N   . GLY A 1 153 ? 25.496  35.666  -47.347 1.000 25.452 0 482 GLY AAA N   1 ? 4  
ATOM   1190 C CA  . GLY A 1 153 ? 25.356  35.148  -45.977 1.000 26.874 0 482 GLY AAA CA  1 ? 4  
ATOM   1191 C C   . GLY A 1 153 ? 24.736  36.163  -45.030 1.000 25.353 0 482 GLY AAA C   1 ? 4  
ATOM   1192 O O   . GLY A 1 153 ? 24.779  35.915  -43.808 1.000 25.944 0 482 GLY AAA O   1 ? 4  
ATOM   1193 N N   . VAL A 1 154 ? 24.138  37.249  -45.539 1.000 23.641 0 483 VAL AAA N   1 ? 4  
ATOM   1194 C CA  . VAL A 1 154 ? 23.558  38.302  -44.655 1.000 23.133 0 483 VAL AAA CA  1 ? 4  
ATOM   1195 C C   . VAL A 1 154 ? 22.035  38.188  -44.649 1.000 22.186 0 483 VAL AAA C   1 ? 4  
ATOM   1196 O O   . VAL A 1 154 ? 21.420  38.309  -45.711 1.000 20.728 0 483 VAL AAA O   1 ? 4  
ATOM   1197 C CB  . VAL A 1 154 ? 24.007  39.713  -45.051 1.000 24.383 0 483 VAL AAA CB  1 ? 4  
ATOM   1198 C CG1 . VAL A 1 154 ? 23.417  40.761  -44.109 1.000 24.934 0 483 VAL AAA CG1 1 ? 4  
ATOM   1199 C CG2 . VAL A 1 154 ? 25.528  39.830  -45.120 1.000 24.789 0 483 VAL AAA CG2 1 ? 4  
ATOM   1200 N N   . GLU A 1 155 ? 21.458  37.986  -43.471 1.000 20.227 0 484 GLU AAA N   1 ? 4  
ATOM   1201 C CA  . GLU A 1 155 ? 19.982  38.008  -43.293 1.000 20.822 0 484 GLU AAA CA  1 ? 4  
ATOM   1202 C C   . GLU A 1 155 ? 19.497  39.434  -43.540 1.000 19.548 0 484 GLU AAA C   1 ? 4  
ATOM   1203 O O   . GLU A 1 155 ? 20.042  40.380  -42.932 1.000 19.952 0 484 GLU AAA O   1 ? 4  
ATOM   1204 C CB  . GLU A 1 155 ? 19.621  37.516  -41.895 1.000 21.088 0 484 GLU AAA CB  1 ? 4  
ATOM   1205 C CG  . GLU A 1 155 ? 18.133  37.325  -41.676 1.000 20.850 0 484 GLU AAA CG  1 ? 4  
ATOM   1206 C CD  . GLU A 1 155 ? 17.827  36.717  -40.318 1.000 22.402 0 484 GLU AAA CD  1 ? 4  
ATOM   1207 O OE1 . GLU A 1 155 ? 18.783  36.459  -39.567 1.000 22.582 0 484 GLU AAA OE1 1 ? 4  
ATOM   1208 O OE2 . GLU A 1 155 ? 16.638  36.537  -40.013 1.000 21.621 0 484 GLU AAA OE2 1 ? 4  
ATOM   1209 N N   . GLY A 1 156 ? 18.515  39.606  -44.420 1.000 19.466 0 485 GLY AAA N   1 ? 4  
ATOM   1210 C CA  . GLY A 1 156 ? 18.024  40.953  -44.764 1.000 20.062 0 485 GLY AAA CA  1 ? 4  
ATOM   1211 C C   . GLY A 1 156 ? 16.910  40.883  -45.782 1.000 19.385 0 485 GLY AAA C   1 ? 4  
ATOM   1212 O O   . GLY A 1 156 ? 16.257  39.838  -45.892 1.000 19.302 0 485 GLY AAA O   1 ? 4  
ATOM   1213 N N   . PHE A 1 157 ? 16.671  41.991  -46.470 1.000 21.426 0 486 PHE AAA N   1 ? 4  
ATOM   1214 C CA  . PHE A 1 157 ? 15.600  42.106  -47.476 1.000 20.754 0 486 PHE AAA CA  1 ? 4  
ATOM   1215 C C   . PHE A 1 157 ? 15.783  40.976  -48.497 1.000 20.920 0 486 PHE AAA C   1 ? 4  
ATOM   1216 O O   . PHE A 1 157 ? 16.876  40.877  -49.096 1.000 18.964 0 486 PHE AAA O   1 ? 4  
ATOM   1217 C CB  . PHE A 1 157 ? 15.640  43.489  -48.124 1.000 22.784 0 486 PHE AAA CB  1 ? 4  
ATOM   1218 C CG  . PHE A 1 157 ? 14.608  43.660  -49.205 1.000 22.725 0 486 PHE AAA CG  1 ? 4  
ATOM   1219 C CD1 . PHE A 1 157 ? 13.266  43.728  -48.876 1.000 24.920 0 486 PHE AAA CD1 1 ? 4  
ATOM   1220 C CD2 . PHE A 1 157 ? 14.966  43.692  -50.542 1.000 25.606 0 486 PHE AAA CD2 1 ? 4  
ATOM   1221 C CE1 . PHE A 1 157 ? 12.304  43.884  -49.862 1.000 27.967 0 486 PHE AAA CE1 1 ? 4  
ATOM   1222 C CE2 . PHE A 1 157 ? 14.003  43.842  -51.531 1.000 27.611 0 486 PHE AAA CE2 1 ? 4  
ATOM   1223 C CZ  . PHE A 1 157 ? 12.676  43.935  -51.191 1.000 29.035 0 486 PHE AAA CZ  1 ? 4  
ATOM   1224 N N   . ASN A 1 158 ? 14.761  40.125  -48.638 1.000 20.778 0 487 ASN AAA N   1 ? 4  
ATOM   1225 C CA  . ASN A 1 158 ? 14.709  38.983  -49.593 1.000 21.355 0 487 ASN AAA CA  1 ? 4  
ATOM   1226 C C   . ASN A 1 158 ? 15.845  37.985  -49.330 1.000 21.962 0 487 ASN AAA C   1 ? 4  
ATOM   1227 O O   . ASN A 1 158 ? 16.189  37.246  -50.262 1.000 21.662 0 487 ASN AAA O   1 ? 4  
ATOM   1228 C CB  . ASN A 1 158 ? 14.772  39.476  -51.039 1.000 22.981 0 487 ASN AAA CB  1 ? 4  
ATOM   1229 C CG  . ASN A 1 158 ? 13.449  40.029  -51.530 1.000 26.650 0 487 ASN AAA CG  1 ? 4  
ATOM   1230 O OD1 . ASN A 1 158 ? 12.410  39.822  -50.912 1.000 28.887 0 487 ASN AAA OD1 1 ? 4  
ATOM   1231 N ND2 . ASN A 1 158 ? 13.478  40.719  -52.653 1.000 29.319 0 487 ASN AAA ND2 1 ? 4  
ATOM   1232 N N   . CYS A 1 159 ? 16.389  37.962  -48.107 1.000 19.785 0 488 CYS AAA N   1 ? 4  
ATOM   1233 C CA  . CYS A 1 159 ? 17.534  37.128  -47.692 1.000 19.874 0 488 CYS AAA CA  1 ? 4  
ATOM   1234 C C   . CYS A 1 159 ? 17.174  36.514  -46.342 1.000 18.791 0 488 CYS AAA C   1 ? 4  
ATOM   1235 O O   . CYS A 1 159 ? 17.372  37.164  -45.321 1.000 17.895 0 488 CYS AAA O   1 ? 4  
ATOM   1236 C CB  . CYS A 1 159 ? 18.825  37.933  -47.681 1.000 19.857 0 488 CYS AAA CB  1 ? 4  
ATOM   1237 S SG  . CYS A 1 159 ? 19.387  38.273  -49.366 1.000 22.476 0 488 CYS AAA SG  1 ? 4  
ATOM   1238 N N   . TYR A 1 160 ? 16.583  35.324  -46.376 1.000 18.975 0 489 TYR AAA N   1 ? 4  
ATOM   1239 C CA  . TYR A 1 160 ? 15.849  34.737  -45.232 1.000 19.229 0 489 TYR AAA CA  1 ? 4  
ATOM   1240 C C   . TYR A 1 160 ? 16.668  33.695  -44.487 1.000 20.001 0 489 TYR AAA C   1 ? 4  
ATOM   1241 O O   . TYR A 1 160 ? 17.173  32.745  -45.072 1.000 18.286 0 489 TYR AAA O   1 ? 4  
ATOM   1242 C CB  . TYR A 1 160 ? 14.553  34.087  -45.712 1.000 20.859 0 489 TYR AAA CB  1 ? 4  
ATOM   1243 C CG  . TYR A 1 160 ? 13.593  35.039  -46.370 1.000 23.715 0 489 TYR AAA CG  1 ? 4  
ATOM   1244 C CD1 . TYR A 1 160 ? 13.464  36.353  -45.937 1.000 29.088 0 489 TYR AAA CD1 1 ? 4  
ATOM   1245 C CD2 . TYR A 1 160 ? 12.802  34.621  -47.424 1.000 24.754 0 489 TYR AAA CD2 1 ? 4  
ATOM   1246 C CE1 . TYR A 1 160 ? 12.596  37.233  -46.561 1.000 31.052 0 489 TYR AAA CE1 1 ? 4  
ATOM   1247 C CE2 . TYR A 1 160 ? 11.896  35.475  -48.019 1.000 30.309 0 489 TYR AAA CE2 1 ? 4  
ATOM   1248 C CZ  . TYR A 1 160 ? 11.801  36.784  -47.595 1.000 30.371 0 489 TYR AAA CZ  1 ? 4  
ATOM   1249 O OH  . TYR A 1 160 ? 10.918  37.626  -48.194 1.000 41.980 0 489 TYR AAA OH  1 ? 4  
ATOM   1250 N N   . PHE A 1 161 ? 16.701  33.828  -43.165 1.000 18.222 0 490 PHE AAA N   1 ? 4  
ATOM   1251 C CA  . PHE A 1 161 ? 17.044  32.688  -42.302 1.000 18.826 0 490 PHE AAA CA  1 ? 4  
ATOM   1252 C C   . PHE A 1 161 ? 15.987  31.616  -42.569 1.000 18.224 0 490 PHE AAA C   1 ? 4  
ATOM   1253 O O   . PHE A 1 161 ? 14.793  31.915  -42.612 1.000 18.875 0 490 PHE AAA O   1 ? 4  
ATOM   1254 C CB  . PHE A 1 161 ? 17.087  33.139  -40.845 1.000 18.775 0 490 PHE AAA CB  1 ? 4  
ATOM   1255 C CG  . PHE A 1 161 ? 17.717  32.133  -39.922 1.000 19.296 0 490 PHE AAA CG  1 ? 4  
ATOM   1256 C CD1 . PHE A 1 161 ? 19.092  32.060  -39.803 1.000 21.001 0 490 PHE AAA CD1 1 ? 4  
ATOM   1257 C CD2 . PHE A 1 161 ? 16.943  31.248  -39.188 1.000 19.615 0 490 PHE AAA CD2 1 ? 4  
ATOM   1258 C CE1 . PHE A 1 161 ? 19.680  31.148  -38.936 1.000 23.450 0 490 PHE AAA CE1 1 ? 4  
ATOM   1259 C CE2 . PHE A 1 161 ? 17.531  30.331  -38.328 1.000 21.756 0 490 PHE AAA CE2 1 ? 4  
ATOM   1260 C CZ  . PHE A 1 161 ? 18.901  30.274  -38.216 1.000 21.622 0 490 PHE AAA CZ  1 ? 4  
ATOM   1261 N N   . PRO A 1 162 ? 16.376  30.354  -42.843 1.000 18.567 0 491 PRO AAA N   1 ? 4  
ATOM   1262 C CA  . PRO A 1 162 ? 15.430  29.386  -43.386 1.000 20.076 0 491 PRO AAA CA  1 ? 4  
ATOM   1263 C C   . PRO A 1 162 ? 14.498  28.710  -42.371 1.000 17.504 0 491 PRO AAA C   1 ? 4  
ATOM   1264 O O   . PRO A 1 162 ? 13.559  28.062  -42.808 1.000 18.787 0 491 PRO AAA O   1 ? 4  
ATOM   1265 C CB  . PRO A 1 162 ? 16.343  28.362  -44.072 1.000 18.776 0 491 PRO AAA CB  1 ? 4  
ATOM   1266 C CG  . PRO A 1 162 ? 17.604  28.401  -43.274 1.000 19.576 0 491 PRO AAA CG  1 ? 4  
ATOM   1267 C CD  . PRO A 1 162 ? 17.759  29.855  -42.860 1.000 19.295 0 491 PRO AAA CD  1 ? 4  
ATOM   1268 N N   . LEU A 1 163 ? 14.779  28.867  -41.073 1.000 17.124 0 492 LEU AAA N   1 ? 4  
ATOM   1269 C CA  . LEU A 1 163 ? 13.980  28.265  -39.984 1.000 19.297 0 492 LEU AAA CA  1 ? 4  
ATOM   1270 C C   . LEU A 1 163 ? 13.105  29.332  -39.334 1.000 18.641 0 492 LEU AAA C   1 ? 4  
ATOM   1271 O O   . LEU A 1 163 ? 13.558  30.468  -39.120 1.000 19.647 0 492 LEU AAA O   1 ? 4  
ATOM   1272 C CB  . LEU A 1 163 ? 14.862  27.627  -38.916 1.000 19.138 0 492 LEU AAA CB  1 ? 4  
ATOM   1273 C CG  . LEU A 1 163 ? 15.944  26.666  -39.385 1.000 19.745 0 492 LEU AAA CG  1 ? 4  
ATOM   1274 C CD1 . LEU A 1 163 ? 16.684  26.107  -38.166 1.000 22.463 0 492 LEU AAA CD1 1 ? 4  
ATOM   1275 C CD2 . LEU A 1 163 ? 15.358  25.549  -40.235 1.000 20.850 0 492 LEU AAA CD2 1 ? 4  
ATOM   1276 N N   . GLN A 1 164 ? 11.882  28.955  -38.998 1.000 18.887 0 493 GLN AAA N   1 ? 4  
ATOM   1277 C CA  . GLN A 1 164 ? 10.967  29.839  -38.262 1.000 18.765 0 493 GLN AAA CA  1 ? 4  
ATOM   1278 C C   . GLN A 1 164 ? 10.342  29.058  -37.110 1.000 18.095 0 493 GLN AAA C   1 ? 4  
ATOM   1279 O O   . GLN A 1 164 ? 10.309  27.812  -37.158 1.000 16.765 0 493 GLN AAA O   1 ? 4  
ATOM   1280 C CB  . GLN A 1 164 ? 9.896   30.394  -39.190 1.000 20.077 0 493 GLN AAA CB  1 ? 4  
ATOM   1281 C CG  . GLN A 1 164 ? 10.486  31.105  -40.401 1.000 19.735 0 493 GLN AAA CG  1 ? 4  
ATOM   1282 C CD  . GLN A 1 164 ? 9.604   32.220  -40.892 1.000 20.930 0 493 GLN AAA CD  1 ? 4  
ATOM   1283 O OE1 . GLN A 1 164 ? 8.387   32.233  -40.668 1.000 24.613 0 493 GLN AAA OE1 1 ? 4  
ATOM   1284 N NE2 . GLN A 1 164 ? 10.212  33.135  -41.622 1.000 20.482 0 493 GLN AAA NE2 1 ? 4  
ATOM   1285 N N   . SER A 1 165 ? 9.844   29.799  -36.136 1.000 17.033 0 494 SER AAA N   1 ? 4  
ATOM   1286 C CA  . SER A 1 165 ? 9.217   29.237  -34.924 1.000 18.801 0 494 SER AAA CA  1 ? 4  
ATOM   1287 C C   . SER A 1 165 ? 7.707   29.125  -35.119 1.000 19.335 0 494 SER AAA C   1 ? 4  
ATOM   1288 O O   . SER A 1 165 ? 7.072   30.087  -35.582 1.000 20.560 0 494 SER AAA O   1 ? 4  
ATOM   1289 C CB  . SER A 1 165 ? 9.539   30.072  -33.716 1.000 19.782 0 494 SER AAA CB  1 ? 4  
ATOM   1290 O OG  . SER A 1 165 ? 8.907   29.527  -32.569 1.000 20.921 0 494 SER AAA OG  1 ? 4  
ATOM   1291 N N   . TYR A 1 166 ? 7.135   28.009  -34.672 1.000 19.339 0 495 TYR AAA N   1 ? 4  
ATOM   1292 C CA  . TYR A 1 166 ? 5.664   27.830  -34.584 1.000 20.198 0 495 TYR AAA CA  1 ? 4  
ATOM   1293 C C   . TYR A 1 166 ? 5.047   28.787  -33.554 1.000 21.975 0 495 TYR AAA C   1 ? 4  
ATOM   1294 O O   . TYR A 1 166 ? 3.896   29.185  -33.746 1.000 22.546 0 495 TYR AAA O   1 ? 4  
ATOM   1295 C CB  . TYR A 1 166 ? 5.321   26.401  -34.182 1.000 21.015 0 495 TYR AAA CB  1 ? 4  
ATOM   1296 C CG  . TYR A 1 166 ? 5.434   25.383  -35.281 1.000 19.196 0 495 TYR AAA CG  1 ? 4  
ATOM   1297 C CD1 . TYR A 1 166 ? 4.535   25.373  -36.335 1.000 19.693 0 495 TYR AAA CD1 1 ? 4  
ATOM   1298 C CD2 . TYR A 1 166 ? 6.401   24.398  -35.240 1.000 20.378 0 495 TYR AAA CD2 1 ? 4  
ATOM   1299 C CE1 . TYR A 1 166 ? 4.606   24.414  -37.329 1.000 20.405 0 495 TYR AAA CE1 1 ? 4  
ATOM   1300 C CE2 . TYR A 1 166 ? 6.483   23.427  -36.221 1.000 20.289 0 495 TYR AAA CE2 1 ? 4  
ATOM   1301 C CZ  . TYR A 1 166 ? 5.581   23.435  -37.271 1.000 19.513 0 495 TYR AAA CZ  1 ? 4  
ATOM   1302 O OH  . TYR A 1 166 ? 5.654   22.484  -38.244 1.000 21.552 0 495 TYR AAA OH  1 ? 4  
ATOM   1303 N N   . GLY A 1 167 ? 5.749   29.118  -32.468 1.000 22.472 0 496 GLY AAA N   1 ? 4  
ATOM   1304 C CA  . GLY A 1 167 ? 5.196   29.959  -31.387 1.000 23.253 0 496 GLY AAA CA  1 ? 4  
ATOM   1305 C C   . GLY A 1 167 ? 3.855   29.440  -30.897 1.000 25.383 0 496 GLY AAA C   1 ? 4  
ATOM   1306 O O   . GLY A 1 167 ? 2.884   30.223  -30.868 1.000 25.145 0 496 GLY AAA O   1 ? 4  
ATOM   1307 N N   . PHE A 1 168 ? 3.793   28.167  -30.504 1.000 25.416 0 497 PHE AAA N   1 ? 4  
ATOM   1308 C CA  . PHE A 1 168 ? 2.538   27.500  -30.073 1.000 28.175 0 497 PHE AAA CA  1 ? 4  
ATOM   1309 C C   . PHE A 1 168 ? 1.931   28.220  -28.864 1.000 32.171 0 497 PHE AAA C   1 ? 4  
ATOM   1310 O O   . PHE A 1 168 ? 2.574   28.252  -27.802 1.000 33.042 0 497 PHE AAA O   1 ? 4  
ATOM   1311 C CB  . PHE A 1 168 ? 2.771   26.023  -29.763 1.000 25.289 0 497 PHE AAA CB  1 ? 4  
ATOM   1312 C CG  . PHE A 1 168 ? 3.120   25.164  -30.953 1.000 23.263 0 497 PHE AAA CG  1 ? 4  
ATOM   1313 C CD1 . PHE A 1 168 ? 2.187   24.903  -31.946 1.000 24.462 0 497 PHE AAA CD1 1 ? 4  
ATOM   1314 C CD2 . PHE A 1 168 ? 4.361   24.557  -31.044 1.000 22.030 0 497 PHE AAA CD2 1 ? 4  
ATOM   1315 C CE1 . PHE A 1 168 ? 2.495   24.079  -33.017 1.000 22.465 0 497 PHE AAA CE1 1 ? 4  
ATOM   1316 C CE2 . PHE A 1 168 ? 4.667   23.726  -32.114 1.000 21.449 0 497 PHE AAA CE2 1 ? 4  
ATOM   1317 C CZ  . PHE A 1 168 ? 3.737   23.486  -33.095 1.000 22.107 0 497 PHE AAA CZ  1 ? 4  
ATOM   1318 N N   . GLN A 1 169 ? 0.708   28.739  -29.037 1.000 35.985 0 498 GLN AAA N   1 ? 4  
ATOM   1319 C CA  . GLN A 1 169 ? -0.109  29.440  -28.013 1.000 40.382 0 498 GLN AAA CA  1 ? 4  
ATOM   1320 C C   . GLN A 1 169 ? -1.192  28.467  -27.558 1.000 42.977 0 498 GLN AAA C   1 ? 4  
ATOM   1321 O O   . GLN A 1 169 ? -1.822  27.838  -28.403 1.000 38.135 0 498 GLN AAA O   1 ? 4  
ATOM   1322 C CB  . GLN A 1 169 ? -0.768  30.693  -28.600 1.000 41.620 0 498 GLN AAA CB  1 ? 4  
ATOM   1323 C CG  . GLN A 1 169 ? 0.192   31.734  -29.173 1.000 41.856 0 498 GLN AAA CG  1 ? 4  
ATOM   1324 C CD  . GLN A 1 169 ? 0.829   32.573  -28.099 1.000 44.401 0 498 GLN AAA CD  1 ? 4  
ATOM   1325 O OE1 . GLN A 1 169 ? 0.608   32.358  -26.916 1.000 50.166 0 498 GLN AAA OE1 1 ? 4  
ATOM   1326 N NE2 . GLN A 1 169 ? 1.628   33.544  -28.505 1.000 46.051 0 498 GLN AAA NE2 1 ? 4  
ATOM   1327 N N   . PRO A 1 170 ? -1.443  28.298  -26.239 1.000 48.177 0 499 PRO AAA N   1 ? 4  
ATOM   1328 C CA  . PRO A 1 170 ? -2.372  27.267  -25.769 1.000 49.355 0 499 PRO AAA CA  1 ? 4  
ATOM   1329 C C   . PRO A 1 170 ? -3.805  27.498  -26.284 1.000 50.047 0 499 PRO AAA C   1 ? 4  
ATOM   1330 O O   . PRO A 1 170 ? -4.582  26.546  -26.324 1.000 46.775 0 499 PRO AAA O   1 ? 4  
ATOM   1331 C CB  . PRO A 1 170 ? -2.315  27.369  -24.232 1.000 54.536 0 499 PRO AAA CB  1 ? 4  
ATOM   1332 C CG  . PRO A 1 170 ? -1.758  28.754  -23.954 1.000 54.414 0 499 PRO AAA CG  1 ? 4  
ATOM   1333 C CD  . PRO A 1 170 ? -0.884  29.104  -25.144 1.000 51.138 0 499 PRO AAA CD  1 ? 4  
ATOM   1334 N N   . THR A 1 171 ? -4.105  28.741  -26.677 1.000 48.903 0 500 THR AAA N   1 ? 4  
ATOM   1335 C CA  . THR A 1 171 ? -5.436  29.208  -27.139 1.000 55.398 0 500 THR AAA CA  1 ? 4  
ATOM   1336 C C   . THR A 1 171 ? -5.566  29.042  -28.656 1.000 51.014 0 500 THR AAA C   1 ? 4  
ATOM   1337 O O   . THR A 1 171 ? -6.656  29.305  -29.181 1.000 54.200 0 500 THR AAA O   1 ? 4  
ATOM   1338 C CB  . THR A 1 171 ? -5.664  30.654  -26.686 1.000 59.017 0 500 THR AAA CB  1 ? 4  
ATOM   1339 O OG1 . THR A 1 171 ? -4.457  31.368  -26.963 1.000 61.408 0 500 THR AAA OG1 1 ? 4  
ATOM   1340 C CG2 . THR A 1 171 ? -6.000  30.755  -25.215 1.000 61.494 0 500 THR AAA CG2 1 ? 4  
ATOM   1341 N N   . TYR A 1 172 ? -4.506  28.608  -29.340 1.000 47.473 0 501 TYR AAA N   1 ? 4  
ATOM   1342 C CA  . TYR A 1 172 ? -4.550  28.205  -30.769 1.000 44.138 0 501 TYR AAA CA  1 ? 4  
ATOM   1343 C C   . TYR A 1 172 ? -5.732  27.241  -30.974 1.000 46.368 0 501 TYR AAA C   1 ? 4  
ATOM   1344 O O   . TYR A 1 172 ? -6.010  26.434  -30.057 1.000 45.027 0 501 TYR AAA O   1 ? 4  
ATOM   1345 C CB  . TYR A 1 172 ? -3.215  27.551  -31.159 1.000 41.850 0 501 TYR AAA CB  1 ? 4  
ATOM   1346 C CG  . TYR A 1 172 ? -2.091  28.426  -31.672 1.000 39.321 0 501 TYR AAA CG  1 ? 4  
ATOM   1347 C CD1 . TYR A 1 172 ? -2.120  29.814  -31.676 1.000 43.068 0 501 TYR AAA CD1 1 ? 4  
ATOM   1348 C CD2 . TYR A 1 172 ? -0.951  27.823  -32.163 1.000 36.788 0 501 TYR AAA CD2 1 ? 4  
ATOM   1349 C CE1 . TYR A 1 172 ? -1.048  30.557  -32.163 1.000 39.521 0 501 TYR AAA CE1 1 ? 4  
ATOM   1350 C CE2 . TYR A 1 172 ? 0.115   28.546  -32.661 1.000 33.894 0 501 TYR AAA CE2 1 ? 4  
ATOM   1351 C CZ  . TYR A 1 172 ? 0.078   29.926  -32.663 1.000 39.052 0 501 TYR AAA CZ  1 ? 4  
ATOM   1352 O OH  . TYR A 1 172 ? 1.163   30.598  -33.193 1.000 32.166 0 501 TYR AAA OH  1 ? 4  
ATOM   1353 N N   . GLY A 1 173 ? -6.437  27.328  -32.110 1.000 46.373 0 502 GLY AAA N   1 ? 4  
ATOM   1354 C CA  . GLY A 1 173 ? -7.382  26.278  -32.558 1.000 48.236 0 502 GLY AAA CA  1 ? 4  
ATOM   1355 C C   . GLY A 1 173 ? -6.669  24.959  -32.854 1.000 42.628 0 502 GLY AAA C   1 ? 4  
ATOM   1356 O O   . GLY A 1 173 ? -5.450  24.994  -33.077 1.000 38.646 0 502 GLY AAA O   1 ? 4  
ATOM   1357 N N   . VAL A 1 174 ? -7.393  23.840  -32.899 1.000 43.179 0 503 VAL AAA N   1 ? 4  
ATOM   1358 C CA  . VAL A 1 174 ? -6.815  22.461  -32.974 1.000 43.857 0 503 VAL AAA CA  1 ? 4  
ATOM   1359 C C   . VAL A 1 174 ? -5.849  22.326  -34.166 1.000 39.620 0 503 VAL AAA C   1 ? 4  
ATOM   1360 O O   . VAL A 1 174 ? -4.784  21.680  -34.004 1.000 37.191 0 503 VAL AAA O   1 ? 4  
ATOM   1361 C CB  . VAL A 1 174 ? -7.926  21.391  -33.011 1.000 48.621 0 503 VAL AAA CB  1 ? 4  
ATOM   1362 C CG1 . VAL A 1 174 ? -8.674  21.371  -34.337 1.000 49.859 0 503 VAL AAA CG1 1 ? 4  
ATOM   1363 C CG2 . VAL A 1 174 ? -7.377  20.008  -32.691 1.000 49.189 0 503 VAL AAA CG2 1 ? 4  
ATOM   1364 N N   . GLY A 1 175 ? -6.165  22.916  -35.324 1.000 37.599 0 504 GLY AAA N   1 ? 4  
ATOM   1365 C CA  . GLY A 1 175 ? -5.287  22.865  -36.513 1.000 32.096 0 504 GLY AAA CA  1 ? 4  
ATOM   1366 C C   . GLY A 1 175 ? -3.911  23.467  -36.247 1.000 30.802 0 504 GLY AAA C   1 ? 4  
ATOM   1367 O O   . GLY A 1 175 ? -2.943  23.080  -36.942 1.000 30.058 0 504 GLY AAA O   1 ? 4  
ATOM   1368 N N   . TYR A 1 176 ? -3.803  24.452  -35.348 1.000 31.397 0 505 TYR AAA N   1 ? 4  
ATOM   1369 C CA  . TYR A 1 176 ? -2.518  25.157  -35.085 1.000 29.555 0 505 TYR AAA CA  1 ? 4  
ATOM   1370 C C   . TYR A 1 176 ? -1.826  24.550  -33.866 1.000 26.855 0 505 TYR AAA C   1 ? 4  
ATOM   1371 O O   . TYR A 1 176 ? -0.672  24.919  -33.601 1.000 26.452 0 505 TYR AAA O   1 ? 4  
ATOM   1372 C CB  . TYR A 1 176 ? -2.676  26.639  -34.721 1.000 37.683 0 505 TYR AAA CB  1 ? 4  
ATOM   1373 C CG  . TYR A 1 176 ? -3.671  27.459  -35.499 1.000 40.687 0 505 TYR AAA CG  1 ? 4  
ATOM   1374 C CD1 . TYR A 1 176 ? -3.461  27.803  -36.823 1.000 44.105 0 505 TYR AAA CD1 1 ? 4  
ATOM   1375 C CD2 . TYR A 1 176 ? -4.809  27.938  -34.873 1.000 52.518 0 505 TYR AAA CD2 1 ? 4  
ATOM   1376 C CE1 . TYR A 1 176 ? -4.370  28.586  -37.513 1.000 46.449 0 505 TYR AAA CE1 1 ? 4  
ATOM   1377 C CE2 . TYR A 1 176 ? -5.737  28.712  -35.553 1.000 54.862 0 505 TYR AAA CE2 1 ? 4  
ATOM   1378 C CZ  . TYR A 1 176 ? -5.509  29.044  -36.878 1.000 52.359 0 505 TYR AAA CZ  1 ? 4  
ATOM   1379 O OH  . TYR A 1 176 ? -6.412  29.803  -37.560 1.000 55.976 0 505 TYR AAA OH  1 ? 4  
ATOM   1380 N N   . GLN A 1 177 ? -2.506  23.684  -33.115 1.000 26.234 0 506 GLN AAA N   1 ? 4  
ATOM   1381 C CA  . GLN A 1 177 ? -1.933  23.122  -31.865 1.000 25.893 0 506 GLN AAA CA  1 ? 4  
ATOM   1382 C C   . GLN A 1 177 ? -0.818  22.142  -32.208 1.000 23.899 0 506 GLN AAA C   1 ? 4  
ATOM   1383 O O   . GLN A 1 177 ? -0.801  21.558  -33.294 1.000 23.287 0 506 GLN AAA O   1 ? 4  
ATOM   1384 C CB  . GLN A 1 177 ? -3.016  22.466  -31.028 1.000 28.673 0 506 GLN AAA CB  1 ? 4  
ATOM   1385 C CG  . GLN A 1 177 ? -3.907  23.483  -30.334 1.000 30.738 0 506 GLN AAA CG  1 ? 4  
ATOM   1386 C CD  . GLN A 1 177 ? -5.042  22.825  -29.597 1.000 32.516 0 506 GLN AAA CD  1 ? 4  
ATOM   1387 O OE1 . GLN A 1 177 ? -5.029  21.625  -29.310 1.000 31.357 0 506 GLN AAA OE1 1 ? 4  
ATOM   1388 N NE2 . GLN A 1 177 ? -6.046  23.627  -29.272 1.000 35.889 0 506 GLN AAA NE2 1 ? 4  
ATOM   1389 N N   . PRO A 1 178 ? 0.158   21.961  -31.294 1.000 22.914 0 507 PRO AAA N   1 ? 4  
ATOM   1390 C CA  . PRO A 1 178 ? 1.242   21.016  -31.522 1.000 22.046 0 507 PRO AAA CA  1 ? 4  
ATOM   1391 C C   . PRO A 1 178 ? 0.711   19.582  -31.442 1.000 22.912 0 507 PRO AAA C   1 ? 4  
ATOM   1392 O O   . PRO A 1 178 ? -0.087  19.267  -30.558 1.000 24.440 0 507 PRO AAA O   1 ? 4  
ATOM   1393 C CB  . PRO A 1 178 ? 2.232   21.338  -30.399 1.000 22.543 0 507 PRO AAA CB  1 ? 4  
ATOM   1394 C CG  . PRO A 1 178 ? 1.336   21.837  -29.276 1.000 24.631 0 507 PRO AAA CG  1 ? 4  
ATOM   1395 C CD  . PRO A 1 178 ? 0.249   22.619  -29.978 1.000 24.642 0 507 PRO AAA CD  1 ? 4  
ATOM   1396 N N   . TYR A 1 179 ? 1.169   18.747  -32.369 1.000 23.361 0 508 TYR AAA N   1 ? 4  
ATOM   1397 C CA  . TYR A 1 179 ? 0.990   17.281  -32.369 1.000 22.916 0 508 TYR AAA CA  1 ? 4  
ATOM   1398 C C   . TYR A 1 179 ? 2.371   16.649  -32.305 1.000 23.211 0 508 TYR AAA C   1 ? 4  
ATOM   1399 O O   . TYR A 1 179 ? 3.300   17.101  -33.024 1.000 21.134 0 508 TYR AAA O   1 ? 4  
ATOM   1400 C CB  . TYR A 1 179 ? 0.192   16.829  -33.595 1.000 23.895 0 508 TYR AAA CB  1 ? 4  
ATOM   1401 C CG  . TYR A 1 179 ? -1.291  16.999  -33.397 1.000 24.897 0 508 TYR AAA CG  1 ? 4  
ATOM   1402 C CD1 . TYR A 1 179 ? -1.824  18.265  -33.214 1.000 26.153 0 508 TYR AAA CD1 1 ? 4  
ATOM   1403 C CD2 . TYR A 1 179 ? -2.163  15.925  -33.341 1.000 27.230 0 508 TYR AAA CD2 1 ? 4  
ATOM   1404 C CE1 . TYR A 1 179 ? -3.175  18.463  -32.984 1.000 27.522 0 508 TYR AAA CE1 1 ? 4  
ATOM   1405 C CE2 . TYR A 1 179 ? -3.521  16.109  -33.112 1.000 27.760 0 508 TYR AAA CE2 1 ? 4  
ATOM   1406 C CZ  . TYR A 1 179 ? -4.031  17.385  -32.948 1.000 28.908 0 508 TYR AAA CZ  1 ? 4  
ATOM   1407 O OH  . TYR A 1 179 ? -5.361  17.613  -32.727 1.000 32.847 0 508 TYR AAA OH  1 ? 4  
ATOM   1408 N N   . ARG A 1 180 ? 2.508   15.662  -31.430 1.000 23.611 0 509 ARG AAA N   1 ? 4  
ATOM   1409 C CA  . ARG A 1 180 ? 3.688   14.775  -31.417 1.000 23.145 0 509 ARG AAA CA  1 ? 4  
ATOM   1410 C C   . ARG A 1 180 ? 3.434   13.667  -32.429 1.000 23.388 0 509 ARG AAA C   1 ? 4  
ATOM   1411 O O   . ARG A 1 180 ? 2.293   13.162  -32.505 1.000 26.458 0 509 ARG AAA O   1 ? 4  
ATOM   1412 C CB  . ARG A 1 180 ? 3.969   14.265  -30.009 1.000 24.795 0 509 ARG AAA CB  1 ? 4  
ATOM   1413 C CG  . ARG A 1 180 ? 4.579   15.340  -29.145 1.000 24.735 0 509 ARG AAA CG  1 ? 4  
ATOM   1414 C CD  . ARG A 1 180 ? 4.803   14.924  -27.722 1.000 26.817 0 509 ARG AAA CD  1 ? 4  
ATOM   1415 N NE  . ARG A 1 180 ? 5.468   16.040  -27.089 1.000 27.124 0 509 ARG AAA NE  1 ? 4  
ATOM   1416 C CZ  . ARG A 1 180 ? 6.266   15.948  -26.041 1.000 28.951 0 509 ARG AAA CZ  1 ? 4  
ATOM   1417 N NH1 . ARG A 1 180 ? 6.467   14.783  -25.453 1.000 32.743 0 509 ARG AAA NH1 1 ? 4  
ATOM   1418 N NH2 . ARG A 1 180 ? 6.825   17.032  -25.554 1.000 29.255 0 509 ARG AAA NH2 1 ? 4  
ATOM   1419 N N   . VAL A 1 181 ? 4.458   13.384  -33.226 1.000 22.691 0 510 VAL AAA N   1 ? 4  
ATOM   1420 C CA  . VAL A 1 181 ? 4.403   12.387  -34.320 1.000 23.021 0 510 VAL AAA CA  1 ? 4  
ATOM   1421 C C   . VAL A 1 181 ? 5.528   11.379  -34.087 1.000 22.933 0 510 VAL AAA C   1 ? 4  
ATOM   1422 O O   . VAL A 1 181 ? 6.705   11.793  -33.874 1.000 21.979 0 510 VAL AAA O   1 ? 4  
ATOM   1423 C CB  . VAL A 1 181 ? 4.500   13.065  -35.701 1.000 22.757 0 510 VAL AAA CB  1 ? 4  
ATOM   1424 C CG1 . VAL A 1 181 ? 4.450   12.049  -36.829 1.000 23.965 0 510 VAL AAA CG1 1 ? 4  
ATOM   1425 C CG2 . VAL A 1 181 ? 3.440   14.137  -35.895 1.000 23.225 0 510 VAL AAA CG2 1 ? 4  
ATOM   1426 N N   . VAL A 1 182 ? 5.184   10.098  -34.169 1.000 23.661 0 511 VAL AAA N   1 ? 4  
ATOM   1427 C CA  . VAL A 1 182 ? 6.165   8.989   -34.236 1.000 23.645 0 511 VAL AAA CA  1 ? 4  
ATOM   1428 C C   . VAL A 1 182 ? 5.907   8.248   -35.543 1.000 22.242 0 511 VAL AAA C   1 ? 4  
ATOM   1429 O O   . VAL A 1 182 ? 4.756   7.825   -35.796 1.000 23.178 0 511 VAL AAA O   1 ? 4  
ATOM   1430 C CB  . VAL A 1 182 ? 6.084   8.057   -33.019 1.000 25.056 0 511 VAL AAA CB  1 ? 4  
ATOM   1431 C CG1 . VAL A 1 182 ? 6.990   6.846   -33.203 1.000 26.177 0 511 VAL AAA CG1 1 ? 4  
ATOM   1432 C CG2 . VAL A 1 182 ? 6.412   8.806   -31.743 1.000 25.433 0 511 VAL AAA CG2 1 ? 4  
ATOM   1433 N N   . VAL A 1 183 ? 6.946   8.147   -36.358 1.000 21.506 0 512 VAL AAA N   1 ? 4  
ATOM   1434 C CA  . VAL A 1 183 ? 6.894   7.352   -37.609 1.000 24.017 0 512 VAL AAA CA  1 ? 4  
ATOM   1435 C C   . VAL A 1 183 ? 7.716   6.092   -37.353 1.000 24.972 0 512 VAL AAA C   1 ? 4  
ATOM   1436 O O   . VAL A 1 183 ? 8.924   6.207   -37.055 1.000 24.681 0 512 VAL AAA O   1 ? 4  
ATOM   1437 C CB  . VAL A 1 183 ? 7.411   8.155   -38.813 1.000 24.256 0 512 VAL AAA CB  1 ? 4  
ATOM   1438 C CG1 . VAL A 1 183 ? 7.355   7.321   -40.076 1.000 25.869 0 512 VAL AAA CG1 1 ? 4  
ATOM   1439 C CG2 . VAL A 1 183 ? 6.663   9.463   -38.985 1.000 23.735 0 512 VAL AAA CG2 1 ? 4  
ATOM   1440 N N   . LEU A 1 184 ? 7.079   4.928   -37.434 1.000 26.257 0 513 LEU AAA N   1 ? 4  
ATOM   1441 C CA  . LEU A 1 184 ? 7.784   3.631   -37.342 1.000 26.547 0 513 LEU AAA CA  1 ? 4  
ATOM   1442 C C   . LEU A 1 184 ? 8.045   3.164   -38.773 1.000 26.478 0 513 LEU AAA C   1 ? 4  
ATOM   1443 O O   . LEU A 1 184 ? 7.066   3.033   -39.517 1.000 27.699 0 513 LEU AAA O   1 ? 4  
ATOM   1444 C CB  . LEU A 1 184 ? 6.926   2.633   -36.570 1.000 28.419 0 513 LEU AAA CB  1 ? 4  
ATOM   1445 C CG  . LEU A 1 184 ? 6.571   3.030   -35.141 1.000 28.947 0 513 LEU AAA CG  1 ? 4  
ATOM   1446 C CD1 . LEU A 1 184 ? 5.811   1.897   -34.466 1.000 30.569 0 513 LEU AAA CD1 1 ? 4  
ATOM   1447 C CD2 . LEU A 1 184 ? 7.822   3.414   -34.353 1.000 29.448 0 513 LEU AAA CD2 1 ? 4  
ATOM   1448 N N   . SER A 1 185 ? 9.314   3.012   -39.145 1.000 28.980 0 514 SER AAA N   1 ? 5  
ATOM   1449 C CA  . SER A 1 185 ? 9.761   2.384   -40.413 1.000 30.904 0 514 SER AAA CA  1 ? 5  
ATOM   1450 C C   . SER A 1 185 ? 10.136  0.931   -40.122 1.000 28.196 0 514 SER AAA C   1 ? 5  
ATOM   1451 O O   . SER A 1 185 ? 10.967  0.728   -39.228 1.000 27.203 0 514 SER AAA O   1 ? 5  
ATOM   1452 C CB  . SER A 1 185 ? 10.937  3.125   -41.007 1.000 32.483 0 514 SER AAA CB  1 ? 5  
ATOM   1453 O OG  . SER A 1 185 ? 10.522  4.311   -41.645 1.000 38.774 0 514 SER AAA OG  1 ? 5  
ATOM   1454 N N   . PHE A 1 186 ? 9.574   -0.022  -40.867 1.000 28.680 0 515 PHE AAA N   1 ? 5  
ATOM   1455 C CA  . PHE A 1 186 ? 9.860   -1.478  -40.737 1.000 28.115 0 515 PHE AAA CA  1 ? 5  
ATOM   1456 C C   . PHE A 1 186 ? 10.772  -1.908  -41.886 1.000 28.969 0 515 PHE AAA C   1 ? 5  
ATOM   1457 O O   . PHE A 1 186 ? 10.393  -1.799  -43.057 1.000 30.615 0 515 PHE AAA O   1 ? 5  
ATOM   1458 C CB  . PHE A 1 186 ? 8.579   -2.303  -40.697 1.000 30.274 0 515 PHE AAA CB  1 ? 5  
ATOM   1459 C CG  . PHE A 1 186 ? 7.629   -1.904  -39.607 1.000 31.306 0 515 PHE AAA CG  1 ? 5  
ATOM   1460 C CD1 . PHE A 1 186 ? 7.972   -2.061  -38.273 1.000 34.508 0 515 PHE AAA CD1 1 ? 5  
ATOM   1461 C CD2 . PHE A 1 186 ? 6.397   -1.368  -39.912 1.000 35.191 0 515 PHE AAA CD2 1 ? 5  
ATOM   1462 C CE1 . PHE A 1 186 ? 7.100   -1.673  -37.269 1.000 34.892 0 515 PHE AAA CE1 1 ? 5  
ATOM   1463 C CE2 . PHE A 1 186 ? 5.522   -0.992  -38.904 1.000 36.134 0 515 PHE AAA CE2 1 ? 5  
ATOM   1464 C CZ  . PHE A 1 186 ? 5.871   -1.147  -37.587 1.000 34.355 0 515 PHE AAA CZ  1 ? 5  
ATOM   1465 N N   . GLU A 1 187 ? 11.970  -2.366  -41.543 1.000 29.004 0 516 GLU AAA N   1 ? 5  
ATOM   1466 C CA  . GLU A 1 187 ? 12.994  -2.819  -42.509 1.000 32.554 0 516 GLU AAA CA  1 ? 5  
ATOM   1467 C C   . GLU A 1 187 ? 12.863  -4.338  -42.690 1.000 31.807 0 516 GLU AAA C   1 ? 5  
ATOM   1468 O O   . GLU A 1 187 ? 12.749  -5.026  -41.657 1.000 31.474 0 516 GLU AAA O   1 ? 5  
ATOM   1469 C CB  . GLU A 1 187 ? 14.349  -2.396  -41.961 1.000 35.884 0 516 GLU AAA CB  1 ? 5  
ATOM   1470 C CG  . GLU A 1 187 ? 15.495  -2.616  -42.921 1.000 40.059 0 516 GLU AAA CG  1 ? 5  
ATOM   1471 C CD  . GLU A 1 187 ? 16.821  -2.431  -42.210 1.000 43.690 0 516 GLU AAA CD  1 ? 5  
ATOM   1472 O OE1 . GLU A 1 187 ? 17.226  -3.359  -41.469 1.000 44.112 0 516 GLU AAA OE1 1 ? 5  
ATOM   1473 O OE2 . GLU A 1 187 ? 17.405  -1.349  -42.353 1.000 43.974 0 516 GLU AAA OE2 1 ? 5  
ATOM   1474 N N   . LEU A 1 188 ? 12.879  -4.810  -43.946 1.000 34.370 0 517 LEU AAA N   1 ? 5  
ATOM   1475 C CA  . LEU A 1 188 ? 12.645  -6.220  -44.368 1.000 37.015 0 517 LEU AAA CA  1 ? 5  
ATOM   1476 C C   . LEU A 1 188 ? 13.812  -6.714  -45.232 1.000 37.287 0 517 LEU AAA C   1 ? 5  
ATOM   1477 O O   . LEU A 1 188 ? 13.525  -7.286  -46.303 1.000 39.303 0 517 LEU AAA O   1 ? 5  
ATOM   1478 C CB  . LEU A 1 188 ? 11.357  -6.330  -45.202 1.000 42.754 0 517 LEU AAA CB  1 ? 5  
ATOM   1479 C CG  . LEU A 1 188 ? 10.058  -5.819  -44.589 1.000 47.686 0 517 LEU AAA CG  1 ? 5  
ATOM   1480 C CD1 . LEU A 1 188 ? 9.873   -4.339  -44.854 1.000 48.771 0 517 LEU AAA CD1 1 ? 5  
ATOM   1481 C CD2 . LEU A 1 188 ? 8.861   -6.591  -45.136 1.000 53.105 0 517 LEU AAA CD2 1 ? 5  
ATOM   1482 N N   . LEU A 1 189 ? 15.064  -6.556  -44.796 1.000 35.018 0 518 LEU AAA N   1 ? 5  
ATOM   1483 C CA  . LEU A 1 189 ? 16.237  -7.084  -45.544 1.000 33.667 0 518 LEU AAA CA  1 ? 5  
ATOM   1484 C C   . LEU A 1 189 ? 16.164  -8.621  -45.530 1.000 32.866 0 518 LEU AAA C   1 ? 5  
ATOM   1485 O O   . LEU A 1 189 ? 15.525  -9.182  -44.599 1.000 29.965 0 518 LEU AAA O   1 ? 5  
ATOM   1486 C CB  . LEU A 1 189 ? 17.543  -6.608  -44.896 1.000 36.589 0 518 LEU AAA CB  1 ? 5  
ATOM   1487 C CG  . LEU A 1 189 ? 17.790  -5.098  -44.852 1.000 40.288 0 518 LEU AAA CG  1 ? 5  
ATOM   1488 C CD1 . LEU A 1 189 ? 19.218  -4.803  -44.415 1.000 42.388 0 518 LEU AAA CD1 1 ? 5  
ATOM   1489 C CD2 . LEU A 1 189 ? 17.507  -4.456  -46.202 1.000 44.048 0 518 LEU AAA CD2 1 ? 5  
ATOM   1490 N N   . HIS A 1 190 ? 16.776  -9.279  -46.518 1.000 30.517 0 519 HIS AAA N   1 ? 5  
ATOM   1491 C CA  . HIS A 1 190 ? 16.998  -10.752 -46.527 1.000 31.534 0 519 HIS AAA CA  1 ? 5  
ATOM   1492 C C   . HIS A 1 190 ? 18.139  -11.042 -45.551 1.000 30.180 0 519 HIS AAA C   1 ? 5  
ATOM   1493 O O   . HIS A 1 190 ? 19.272  -11.300 -45.994 1.000 32.300 0 519 HIS AAA O   1 ? 5  
ATOM   1494 C CB  . HIS A 1 190 ? 17.236  -11.269 -47.951 1.000 33.651 0 519 HIS AAA CB  1 ? 5  
ATOM   1495 C CG  . HIS A 1 190 ? 16.109  -10.969 -48.878 1.000 35.233 0 519 HIS AAA CG  1 ? 5  
ATOM   1496 N ND1 . HIS A 1 190 ? 14.814  -11.375 -48.615 1.000 37.286 0 519 HIS AAA ND1 1 ? 5  
ATOM   1497 C CD2 . HIS A 1 190 ? 16.069  -10.300 -50.053 1.000 38.262 0 519 HIS AAA CD2 1 ? 5  
ATOM   1498 C CE1 . HIS A 1 190 ? 14.023  -10.966 -49.592 1.000 39.536 0 519 HIS AAA CE1 1 ? 5  
ATOM   1499 N NE2 . HIS A 1 190 ? 14.772  -10.311 -50.490 1.000 39.850 0 519 HIS AAA NE2 1 ? 5  
ATOM   1500 N N   . ALA A 1 191 ? 17.836  -10.951 -44.258 1.000 28.296 0 520 ALA AAA N   1 ? 5  
ATOM   1501 C CA  . ALA A 1 191 ? 18.796  -11.080 -43.140 1.000 29.543 0 520 ALA AAA CA  1 ? 5  
ATOM   1502 C C   . ALA A 1 191 ? 18.041  -11.561 -41.908 1.000 28.170 0 520 ALA AAA C   1 ? 5  
ATOM   1503 O O   . ALA A 1 191 ? 16.806  -11.561 -41.903 1.000 27.890 0 520 ALA AAA O   1 ? 5  
ATOM   1504 C CB  . ALA A 1 191 ? 19.477  -9.759  -42.895 1.000 29.253 0 520 ALA AAA CB  1 ? 5  
ATOM   1505 N N   . PRO A 1 192 ? 18.745  -11.983 -40.838 1.000 30.064 0 521 PRO AAA N   1 ? 5  
ATOM   1506 C CA  . PRO A 1 192 ? 18.083  -12.314 -39.578 1.000 31.534 0 521 PRO AAA CA  1 ? 5  
ATOM   1507 C C   . PRO A 1 192 ? 17.221  -11.139 -39.103 1.000 30.595 0 521 PRO AAA C   1 ? 5  
ATOM   1508 O O   . PRO A 1 192 ? 17.662  -9.997  -39.175 1.000 32.117 0 521 PRO AAA O   1 ? 5  
ATOM   1509 C CB  . PRO A 1 192 ? 19.243  -12.637 -38.620 1.000 33.447 0 521 PRO AAA CB  1 ? 5  
ATOM   1510 C CG  . PRO A 1 192 ? 20.361  -13.081 -39.547 1.000 33.457 0 521 PRO AAA CG  1 ? 5  
ATOM   1511 C CD  . PRO A 1 192 ? 20.202  -12.209 -40.779 1.000 32.143 0 521 PRO AAA CD  1 ? 5  
ATOM   1512 N N   . ALA A 1 193 ? 15.992  -11.424 -38.678 1.000 29.998 0 522 ALA AAA N   1 ? 5  
ATOM   1513 C CA  . ALA A 1 193 ? 15.021  -10.391 -38.245 1.000 30.256 0 522 ALA AAA CA  1 ? 5  
ATOM   1514 C C   . ALA A 1 193 ? 14.886  -10.458 -36.724 1.000 32.054 0 522 ALA AAA C   1 ? 5  
ATOM   1515 O O   . ALA A 1 193 ? 14.338  -11.450 -36.226 1.000 34.635 0 522 ALA AAA O   1 ? 5  
ATOM   1516 C CB  . ALA A 1 193 ? 13.703  -10.578 -38.941 1.000 31.238 0 522 ALA AAA CB  1 ? 5  
ATOM   1517 N N   . THR A 1 194 ? 15.353  -9.420  -36.039 1.000 32.071 0 523 THR AAA N   1 ? 5  
ATOM   1518 C CA  . THR A 1 194 ? 15.657  -9.390  -34.588 1.000 38.301 0 523 THR AAA CA  1 ? 5  
ATOM   1519 C C   . THR A 1 194 ? 14.647  -8.531  -33.812 1.000 35.769 0 523 THR AAA C   1 ? 5  
ATOM   1520 O O   . THR A 1 194 ? 14.722  -8.537  -32.564 1.000 37.594 0 523 THR AAA O   1 ? 5  
ATOM   1521 C CB  . THR A 1 194 ? 17.096  -8.899  -34.398 1.000 43.184 0 523 THR AAA CB  1 ? 5  
ATOM   1522 O OG1 . THR A 1 194 ? 17.367  -8.960  -33.004 1.000 53.226 0 523 THR AAA OG1 1 ? 5  
ATOM   1523 C CG2 . THR A 1 194 ? 17.336  -7.503  -34.930 1.000 45.116 0 523 THR AAA CG2 1 ? 5  
ATOM   1524 N N   . VAL A 1 195 ? 13.744  -7.824  -34.497 1.000 32.648 0 524 VAL AAA N   1 ? 5  
ATOM   1525 C CA  . VAL A 1 195 ? 12.625  -7.087  -33.837 1.000 32.166 0 524 VAL AAA CA  1 ? 5  
ATOM   1526 C C   . VAL A 1 195 ? 11.323  -7.816  -34.148 1.000 31.856 0 524 VAL AAA C   1 ? 5  
ATOM   1527 O O   . VAL A 1 195 ? 10.897  -7.793  -35.319 1.000 31.295 0 524 VAL AAA O   1 ? 5  
ATOM   1528 C CB  . VAL A 1 195 ? 12.539  -5.617  -34.278 1.000 31.946 0 524 VAL AAA CB  1 ? 5  
ATOM   1529 C CG1 . VAL A 1 195 ? 11.580  -4.844  -33.374 1.000 31.547 0 524 VAL AAA CG1 1 ? 5  
ATOM   1530 C CG2 . VAL A 1 195 ? 13.910  -4.982  -34.309 1.000 33.383 0 524 VAL AAA CG2 1 ? 5  
ATOM   1531 N N   . CYS A 1 196 ? 10.724  -8.443  -33.134 1.000 34.213 0 525 CYS AAA N   1 ? 5  
ATOM   1532 C CA  . CYS A 1 196 ? 9.552   -9.342  -33.278 1.000 36.507 0 525 CYS AAA CA  1 ? 5  
ATOM   1533 C C   . CYS A 1 196 ? 8.448   -8.941  -32.305 1.000 37.695 0 525 CYS AAA C   1 ? 5  
ATOM   1534 O O   . CYS A 1 196 ? 8.742   -8.256  -31.311 1.000 39.810 0 525 CYS AAA O   1 ? 5  
ATOM   1535 C CB  . CYS A 1 196 ? 9.929   -10.799 -33.038 1.000 38.222 0 525 CYS AAA CB  1 ? 5  
ATOM   1536 S SG  . CYS A 1 196 ? 11.204  -11.391 -34.177 1.000 40.027 0 525 CYS AAA SG  1 ? 5  
ATOM   1537 N N   . GLY A 1 197 ? 7.218   -9.354  -32.605 1.000 39.614 0 526 GLY AAA N   1 ? 5  
ATOM   1538 C CA  . GLY A 1 197 ? 6.100   -9.314  -31.652 1.000 42.366 0 526 GLY AAA CA  1 ? 5  
ATOM   1539 C C   . GLY A 1 197 ? 6.321   -10.303 -30.508 1.000 45.750 0 526 GLY AAA C   1 ? 5  
ATOM   1540 O O   . GLY A 1 197 ? 7.297   -11.050 -30.513 1.000 48.920 0 526 GLY AAA O   1 ? 5  
ATOM   1541 N N   . PRO A 1 198 ? 5.408   -10.347 -29.510 1.000 49.032 0 527 PRO AAA N   1 ? 5  
ATOM   1542 C CA  . PRO A 1 198 ? 5.555   -11.221 -28.340 1.000 52.805 0 527 PRO AAA CA  1 ? 5  
ATOM   1543 C C   . PRO A 1 198 ? 5.600   -12.721 -28.665 1.000 55.971 0 527 PRO AAA C   1 ? 5  
ATOM   1544 O O   . PRO A 1 198 ? 4.959   -13.162 -29.606 1.000 57.601 0 527 PRO AAA O   1 ? 5  
ATOM   1545 C CB  . PRO A 1 198 ? 4.311   -10.916 -27.487 1.000 54.097 0 527 PRO AAA CB  1 ? 5  
ATOM   1546 C CG  . PRO A 1 198 ? 3.830   -9.567  -27.983 1.000 51.725 0 527 PRO AAA CG  1 ? 5  
ATOM   1547 C CD  . PRO A 1 198 ? 4.176   -9.545  -29.456 1.000 49.131 0 527 PRO AAA CD  1 ? 5  
ATOM   1548 N N   . GLN B 2 3   ? 4.392   42.784  -52.783 1.000 54.995 0 1   GLN BBB N   1 ? 6  
ATOM   1549 C CA  . GLN B 2 3   ? 5.409   43.176  -51.779 1.000 53.056 0 1   GLN BBB CA  1 ? 6  
ATOM   1550 C C   . GLN B 2 3   ? 4.846   42.869  -50.384 1.000 46.853 0 1   GLN BBB C   1 ? 6  
ATOM   1551 O O   . GLN B 2 3   ? 3.632   42.615  -50.252 1.000 49.788 0 1   GLN BBB O   1 ? 6  
ATOM   1552 C CB  . GLN B 2 3   ? 5.792   44.650  -51.972 1.000 56.842 0 1   GLN BBB CB  1 ? 6  
ATOM   1553 C CG  . GLN B 2 3   ? 6.693   45.254  -50.887 1.000 59.156 0 1   GLN BBB CG  1 ? 6  
ATOM   1554 C CD  . GLN B 2 3   ? 8.096   44.685  -50.787 1.000 60.347 0 1   GLN BBB CD  1 ? 6  
ATOM   1555 O OE1 . GLN B 2 3   ? 8.303   43.502  -50.506 1.000 54.104 0 1   GLN BBB OE1 1 ? 6  
ATOM   1556 N NE2 . GLN B 2 3   ? 9.088   45.548  -50.965 1.000 55.971 0 1   GLN BBB NE2 1 ? 6  
ATOM   1557 N N   . VAL B 2 4   ? 5.698   42.902  -49.368 1.000 39.072 0 2   VAL BBB N   1 ? 6  
ATOM   1558 C CA  . VAL B 2 4   ? 5.261   42.887  -47.943 1.000 34.389 0 2   VAL BBB CA  1 ? 6  
ATOM   1559 C C   . VAL B 2 4   ? 4.264   44.033  -47.711 1.000 32.154 0 2   VAL BBB C   1 ? 6  
ATOM   1560 O O   . VAL B 2 4   ? 4.493   45.152  -48.199 1.000 33.417 0 2   VAL BBB O   1 ? 6  
ATOM   1561 C CB  . VAL B 2 4   ? 6.475   42.969  -46.999 1.000 34.066 0 2   VAL BBB CB  1 ? 6  
ATOM   1562 C CG1 . VAL B 2 4   ? 6.039   43.103  -45.554 1.000 33.482 0 2   VAL BBB CG1 1 ? 6  
ATOM   1563 C CG2 . VAL B 2 4   ? 7.401   41.777  -47.165 1.000 34.458 0 2   VAL BBB CG2 1 ? 6  
ATOM   1564 N N   . GLN B 2 5   ? 3.168   43.755  -47.009 1.000 29.689 0 3   GLN BBB N   1 ? 6  
ATOM   1565 C CA  . GLN B 2 5   ? 2.196   44.766  -46.526 1.000 31.011 0 3   GLN BBB CA  1 ? 6  
ATOM   1566 C C   . GLN B 2 5   ? 1.944   44.512  -45.044 1.000 28.312 0 3   GLN BBB C   1 ? 6  
ATOM   1567 O O   . GLN B 2 5   ? 1.923   43.328  -44.639 1.000 25.591 0 3   GLN BBB O   1 ? 6  
ATOM   1568 C CB  . GLN B 2 5   ? 0.860   44.696  -47.269 1.000 35.713 0 3   GLN BBB CB  1 ? 6  
ATOM   1569 C CG  . GLN B 2 5   ? 0.982   44.858  -48.782 1.000 42.816 0 3   GLN BBB CG  1 ? 6  
ATOM   1570 C CD  . GLN B 2 5   ? 1.132   46.297  -49.211 1.000 52.020 0 3   GLN BBB CD  1 ? 6  
ATOM   1571 O OE1 . GLN B 2 5   ? 0.699   47.225  -48.526 1.000 58.388 0 3   GLN BBB OE1 1 ? 6  
ATOM   1572 N NE2 . GLN B 2 5   ? 1.739   46.494  -50.373 1.000 56.863 0 3   GLN BBB NE2 1 ? 6  
ATOM   1573 N N   . LEU B 2 6   ? 1.780   45.586  -44.272 1.000 26.007 0 4   LEU BBB N   1 ? 6  
ATOM   1574 C CA  . LEU B 2 6   ? 1.350   45.512  -42.854 1.000 25.281 0 4   LEU BBB CA  1 ? 6  
ATOM   1575 C C   . LEU B 2 6   ? -0.047  46.111  -42.759 1.000 26.310 0 4   LEU BBB C   1 ? 6  
ATOM   1576 O O   . LEU B 2 6   ? -0.197  47.310  -43.044 1.000 31.495 0 4   LEU BBB O   1 ? 6  
ATOM   1577 C CB  . LEU B 2 6   ? 2.368   46.242  -41.984 1.000 24.565 0 4   LEU BBB CB  1 ? 6  
ATOM   1578 C CG  . LEU B 2 6   ? 3.779   45.671  -42.083 1.000 25.597 0 4   LEU BBB CG  1 ? 6  
ATOM   1579 C CD1 . LEU B 2 6   ? 4.769   46.546  -41.327 1.000 25.446 0 4   LEU BBB CD1 1 ? 6  
ATOM   1580 C CD2 . LEU B 2 6   ? 3.813   44.235  -41.573 1.000 25.303 0 4   LEU BBB CD2 1 ? 6  
ATOM   1581 N N   . VAL B 2 7   ? -1.038  45.276  -42.455 1.000 24.520 0 5   VAL BBB N   1 ? 6  
ATOM   1582 C CA  . VAL B 2 7   ? -2.467  45.697  -42.373 1.000 24.797 0 5   VAL BBB CA  1 ? 6  
ATOM   1583 C C   . VAL B 2 7   ? -2.756  46.052  -40.912 1.000 24.741 0 5   VAL BBB C   1 ? 6  
ATOM   1584 O O   . VAL B 2 7   ? -2.755  45.143  -40.092 1.000 24.286 0 5   VAL BBB O   1 ? 6  
ATOM   1585 C CB  . VAL B 2 7   ? -3.401  44.591  -42.896 1.000 26.867 0 5   VAL BBB CB  1 ? 6  
ATOM   1586 C CG1 . VAL B 2 7   ? -4.860  45.029  -42.843 1.000 27.854 0 5   VAL BBB CG1 1 ? 6  
ATOM   1587 C CG2 . VAL B 2 7   ? -3.008  44.163  -44.305 1.000 28.823 0 5   VAL BBB CG2 1 ? 6  
ATOM   1588 N N   . GLU B 2 8   ? -2.983  47.326  -40.604 1.000 24.302 0 6   GLU BBB N   1 ? 6  
ATOM   1589 C CA  . GLU B 2 8   ? -3.276  47.777  -39.218 1.000 26.528 0 6   GLU BBB CA  1 ? 6  
ATOM   1590 C C   . GLU B 2 8   ? -4.787  47.938  -39.023 1.000 27.055 0 6   GLU BBB C   1 ? 6  
ATOM   1591 O O   . GLU B 2 8   ? -5.484  48.331  -39.966 1.000 25.930 0 6   GLU BBB O   1 ? 6  
ATOM   1592 C CB  . GLU B 2 8   ? -2.594  49.110  -38.923 1.000 28.713 0 6   GLU BBB CB  1 ? 6  
ATOM   1593 C CG  . GLU B 2 8   ? -1.093  49.077  -39.108 1.000 31.761 0 6   GLU BBB CG  1 ? 6  
ATOM   1594 C CD  . GLU B 2 8   ? -0.500  50.434  -39.432 1.000 33.664 0 6   GLU BBB CD  1 ? 6  
ATOM   1595 O OE1 . GLU B 2 8   ? -1.179  51.214  -40.117 1.000 39.948 0 6   GLU BBB OE1 1 ? 6  
ATOM   1596 O OE2 . GLU B 2 8   ? 0.617   50.713  -38.981 1.000 28.701 0 6   GLU BBB OE2 1 ? 6  
ATOM   1597 N N   . SER B 2 9   ? -5.262  47.681  -37.811 1.000 26.093 0 7   SER BBB N   1 ? 6  
ATOM   1598 C CA  A SER B 2 9   ? -6.669  47.925  -37.416 0.500 26.535 0 7   SER BBB CA  1 ? 6  
ATOM   1599 C CA  B SER B 2 9   ? -6.668  47.952  -37.421 0.500 26.900 0 7   SER BBB CA  1 ? 6  
ATOM   1600 C C   . SER B 2 9   ? -6.715  48.305  -35.932 1.000 27.049 0 7   SER BBB C   1 ? 6  
ATOM   1601 O O   . SER B 2 9   ? -5.700  48.090  -35.221 1.000 25.274 0 7   SER BBB O   1 ? 6  
ATOM   1602 C CB  A SER B 2 9   ? -7.494  46.718  -37.720 0.500 27.306 0 7   SER BBB CB  1 ? 6  
ATOM   1603 C CB  B SER B 2 9   ? -7.561  46.793  -37.772 0.500 28.166 0 7   SER BBB CB  1 ? 6  
ATOM   1604 O OG  A SER B 2 9   ? -6.960  45.582  -37.057 0.500 26.149 0 7   SER BBB OG  1 ? 6  
ATOM   1605 O OG  B SER B 2 9   ? -8.924  47.212  -37.880 0.500 28.595 0 7   SER BBB OG  1 ? 6  
ATOM   1606 N N   . GLY B 2 10  ? -7.842  48.837  -35.487 1.000 28.301 0 8   GLY BBB N   1 ? 6  
ATOM   1607 C CA  . GLY B 2 10  ? -8.014  49.256  -34.089 1.000 28.909 0 8   GLY BBB CA  1 ? 6  
ATOM   1608 C C   . GLY B 2 10  ? -7.728  50.738  -33.945 1.000 30.457 0 8   GLY BBB C   1 ? 6  
ATOM   1609 O O   . GLY B 2 10  ? -7.530  51.420  -34.964 1.000 32.402 0 8   GLY BBB O   1 ? 6  
ATOM   1610 N N   . GLY B 2 11  ? -7.678  51.225  -32.720 1.000 32.906 0 9   GLY BBB N   1 ? 6  
ATOM   1611 C CA  . GLY B 2 11  ? -7.392  52.650  -32.492 1.000 35.089 0 9   GLY BBB CA  1 ? 6  
ATOM   1612 C C   . GLY B 2 11  ? -8.627  53.497  -32.724 1.000 36.921 0 9   GLY BBB C   1 ? 6  
ATOM   1613 O O   . GLY B 2 11  ? -9.732  52.936  -32.823 1.000 39.285 0 9   GLY BBB O   1 ? 6  
ATOM   1614 N N   . GLY B 2 12  ? -8.449  54.816  -32.782 1.000 31.988 0 10  GLY BBB N   1 ? 6  
ATOM   1615 C CA  . GLY B 2 12  ? -9.552  55.791  -32.759 1.000 32.693 0 10  GLY BBB CA  1 ? 6  
ATOM   1616 C C   . GLY B 2 12  ? -9.554  56.542  -31.440 1.000 32.376 0 10  GLY BBB C   1 ? 6  
ATOM   1617 O O   . GLY B 2 12  ? -8.481  56.727  -30.885 1.000 29.653 0 10  GLY BBB O   1 ? 6  
ATOM   1618 N N   . SER B 2 13  ? -10.729 56.881  -30.923 1.000 34.150 0 11  SER BBB N   1 ? 6  
ATOM   1619 C CA  . SER B 2 13  ? -10.908 57.751  -29.740 1.000 36.222 0 11  SER BBB CA  1 ? 6  
ATOM   1620 C C   . SER B 2 13  ? -11.184 56.907  -28.493 1.000 37.015 0 11  SER BBB C   1 ? 6  
ATOM   1621 O O   . SER B 2 13  ? -11.868 55.885  -28.605 1.000 38.201 0 11  SER BBB O   1 ? 6  
ATOM   1622 C CB  . SER B 2 13  ? -12.001 58.738  -29.995 1.000 39.679 0 11  SER BBB CB  1 ? 6  
ATOM   1623 O OG  . SER B 2 13  ? -11.620 59.599  -31.056 1.000 43.330 0 11  SER BBB OG  1 ? 6  
ATOM   1624 N N   . VAL B 2 14  ? -10.650 57.337  -27.350 1.000 35.917 0 12  VAL BBB N   1 ? 6  
ATOM   1625 C CA  . VAL B 2 14  ? -10.931 56.730  -26.018 1.000 37.732 0 12  VAL BBB CA  1 ? 6  
ATOM   1626 C C   . VAL B 2 14  ? -10.706 57.815  -24.962 1.000 36.883 0 12  VAL BBB C   1 ? 6  
ATOM   1627 O O   . VAL B 2 14  ? -9.930  58.749  -25.230 1.000 35.294 0 12  VAL BBB O   1 ? 6  
ATOM   1628 C CB  . VAL B 2 14  ? -10.058 55.483  -25.778 1.000 39.577 0 12  VAL BBB CB  1 ? 6  
ATOM   1629 C CG1 . VAL B 2 14  ? -8.584  55.839  -25.634 1.000 41.089 0 12  VAL BBB CG1 1 ? 6  
ATOM   1630 C CG2 . VAL B 2 14  ? -10.542 54.684  -24.581 1.000 43.113 0 12  VAL BBB CG2 1 ? 6  
ATOM   1631 N N   . GLN B 2 15  ? -11.393 57.742  -23.828 1.000 37.498 0 13  GLN BBB N   1 ? 6  
ATOM   1632 C CA  . GLN B 2 15  ? -11.173 58.720  -22.733 1.000 38.962 0 13  GLN BBB CA  1 ? 6  
ATOM   1633 C C   . GLN B 2 15  ? -9.951  58.255  -21.931 1.000 35.842 0 13  GLN BBB C   1 ? 6  
ATOM   1634 O O   . GLN B 2 15  ? -9.624  57.062  -21.988 1.000 33.492 0 13  GLN BBB O   1 ? 6  
ATOM   1635 C CB  . GLN B 2 15  ? -12.443 58.933  -21.905 1.000 43.854 0 13  GLN BBB CB  1 ? 6  
ATOM   1636 C CG  . GLN B 2 15  ? -12.890 57.721  -21.102 1.000 48.917 0 13  GLN BBB CG  1 ? 6  
ATOM   1637 C CD  . GLN B 2 15  ? -14.318 57.869  -20.624 1.000 53.466 0 13  GLN BBB CD  1 ? 6  
ATOM   1638 O OE1 . GLN B 2 15  ? -14.670 58.847  -19.966 1.000 61.411 0 13  GLN BBB OE1 1 ? 6  
ATOM   1639 N NE2 . GLN B 2 15  ? -15.163 56.904  -20.960 1.000 54.648 0 13  GLN BBB NE2 1 ? 6  
ATOM   1640 N N   . ALA B 2 16  ? -9.271  59.188  -21.262 1.000 34.490 0 14  ALA BBB N   1 ? 6  
ATOM   1641 C CA  . ALA B 2 16  ? -8.095  58.904  -20.410 1.000 34.934 0 14  ALA BBB CA  1 ? 6  
ATOM   1642 C C   . ALA B 2 16  ? -8.474  57.838  -19.375 1.000 35.370 0 14  ALA BBB C   1 ? 6  
ATOM   1643 O O   . ALA B 2 16  ? -9.594  57.934  -18.812 1.000 36.330 0 14  ALA BBB O   1 ? 6  
ATOM   1644 C CB  . ALA B 2 16  ? -7.597  60.169  -19.760 1.000 35.223 0 14  ALA BBB CB  1 ? 6  
ATOM   1645 N N   . GLY B 2 17  ? -7.574  56.878  -19.146 1.000 34.897 0 15  GLY BBB N   1 ? 6  
ATOM   1646 C CA  . GLY B 2 17  ? -7.758  55.721  -18.250 1.000 36.050 0 15  GLY BBB CA  1 ? 6  
ATOM   1647 C C   . GLY B 2 17  ? -8.333  54.522  -18.985 1.000 35.507 0 15  GLY BBB C   1 ? 6  
ATOM   1648 O O   . GLY B 2 17  ? -8.358  53.423  -18.391 1.000 37.128 0 15  GLY BBB O   1 ? 6  
ATOM   1649 N N   . GLY B 2 18  ? -8.807  54.721  -20.219 1.000 34.134 0 16  GLY BBB N   1 ? 6  
ATOM   1650 C CA  . GLY B 2 18  ? -9.406  53.669  -21.059 1.000 33.592 0 16  GLY BBB CA  1 ? 6  
ATOM   1651 C C   . GLY B 2 18  ? -8.355  52.795  -21.711 1.000 32.764 0 16  GLY BBB C   1 ? 6  
ATOM   1652 O O   . GLY B 2 18  ? -7.143  53.043  -21.513 1.000 30.942 0 16  GLY BBB O   1 ? 6  
ATOM   1653 N N   . SER B 2 19  ? -8.809  51.802  -22.480 1.000 32.816 0 17  SER BBB N   1 ? 6  
ATOM   1654 C CA  . SER B 2 19  ? -7.949  50.833  -23.196 1.000 33.282 0 17  SER BBB CA  1 ? 6  
ATOM   1655 C C   . SER B 2 19  ? -8.317  50.796  -24.678 1.000 31.334 0 17  SER BBB C   1 ? 6  
ATOM   1656 O O   . SER B 2 19  ? -9.487  51.040  -25.020 1.000 29.618 0 17  SER BBB O   1 ? 6  
ATOM   1657 C CB  . SER B 2 19  ? -8.064  49.469  -22.586 1.000 36.200 0 17  SER BBB CB  1 ? 6  
ATOM   1658 O OG  . SER B 2 19  ? -7.690  49.503  -21.218 1.000 38.699 0 17  SER BBB OG  1 ? 6  
ATOM   1659 N N   . LEU B 2 20  ? -7.329  50.481  -25.502 1.000 29.058 0 18  LEU BBB N   1 ? 6  
ATOM   1660 C CA  . LEU B 2 20  ? -7.495  50.181  -26.944 1.000 30.531 0 18  LEU BBB CA  1 ? 6  
ATOM   1661 C C   . LEU B 2 20  ? -6.619  48.978  -27.257 1.000 31.119 0 18  LEU BBB C   1 ? 6  
ATOM   1662 O O   . LEU B 2 20  ? -5.591  48.805  -26.564 1.000 30.310 0 18  LEU BBB O   1 ? 6  
ATOM   1663 C CB  . LEU B 2 20  ? -7.055  51.383  -27.789 1.000 32.680 0 18  LEU BBB CB  1 ? 6  
ATOM   1664 C CG  . LEU B 2 20  ? -8.036  52.546  -27.873 1.000 36.483 0 18  LEU BBB CG  1 ? 6  
ATOM   1665 C CD1 . LEU B 2 20  ? -7.381  53.694  -28.629 1.000 37.085 0 18  LEU BBB CD1 1 ? 6  
ATOM   1666 C CD2 . LEU B 2 20  ? -9.339  52.136  -28.548 1.000 38.052 0 18  LEU BBB CD2 1 ? 6  
ATOM   1667 N N   . THR B 2 21  ? -7.014  48.202  -28.262 1.000 29.474 0 19  THR BBB N   1 ? 6  
ATOM   1668 C CA  . THR B 2 21  ? -6.201  47.117  -28.850 1.000 28.001 0 19  THR BBB CA  1 ? 6  
ATOM   1669 C C   . THR B 2 21  ? -5.956  47.418  -30.324 1.000 26.194 0 19  THR BBB C   1 ? 6  
ATOM   1670 O O   . THR B 2 21  ? -6.948  47.544  -31.069 1.000 28.385 0 19  THR BBB O   1 ? 6  
ATOM   1671 C CB  . THR B 2 21  ? -6.875  45.753  -28.688 1.000 29.534 0 19  THR BBB CB  1 ? 6  
ATOM   1672 O OG1 . THR B 2 21  ? -7.232  45.663  -27.313 1.000 32.129 0 19  THR BBB OG1 1 ? 6  
ATOM   1673 C CG2 . THR B 2 21  ? -5.967  44.614  -29.098 1.000 29.889 0 19  THR BBB CG2 1 ? 6  
ATOM   1674 N N   . LEU B 2 22  ? -4.683  47.537  -30.701 1.000 24.463 0 20  LEU BBB N   1 ? 6  
ATOM   1675 C CA  . LEU B 2 22  ? -4.235  47.644  -32.103 1.000 24.194 0 20  LEU BBB CA  1 ? 6  
ATOM   1676 C C   . LEU B 2 22  ? -3.886  46.238  -32.578 1.000 23.386 0 20  LEU BBB C   1 ? 6  
ATOM   1677 O O   . LEU B 2 22  ? -3.344  45.437  -31.778 1.000 23.255 0 20  LEU BBB O   1 ? 6  
ATOM   1678 C CB  . LEU B 2 22  ? -2.998  48.540  -32.198 1.000 24.171 0 20  LEU BBB CB  1 ? 6  
ATOM   1679 C CG  . LEU B 2 22  ? -3.160  49.923  -31.586 1.000 26.324 0 20  LEU BBB CG  1 ? 6  
ATOM   1680 C CD1 . LEU B 2 22  ? -1.940  50.767  -31.880 1.000 27.328 0 20  LEU BBB CD1 1 ? 6  
ATOM   1681 C CD2 . LEU B 2 22  ? -4.427  50.588  -32.091 1.000 29.116 0 20  LEU BBB CD2 1 ? 6  
ATOM   1682 N N   . SER B 2 23  ? -4.135  45.973  -33.851 1.000 22.877 0 21  SER BBB N   1 ? 6  
ATOM   1683 C CA  . SER B 2 23  ? -3.736  44.718  -34.510 1.000 23.599 0 21  SER BBB CA  1 ? 6  
ATOM   1684 C C   . SER B 2 23  ? -2.927  45.081  -35.748 1.000 22.203 0 21  SER BBB C   1 ? 6  
ATOM   1685 O O   . SER B 2 23  ? -3.134  46.161  -36.342 1.000 21.200 0 21  SER BBB O   1 ? 6  
ATOM   1686 C CB  . SER B 2 23  ? -4.930  43.842  -34.840 1.000 27.906 0 21  SER BBB CB  1 ? 6  
ATOM   1687 O OG  . SER B 2 23  ? -5.736  44.435  -35.839 1.000 33.241 0 21  SER BBB OG  1 ? 6  
ATOM   1688 N N   . CYS B 2 24  ? -1.965  44.237  -36.057 1.000 21.516 0 22  CYS BBB N   1 ? 6  
ATOM   1689 C CA  . CYS B 2 24  ? -1.148  44.328  -37.273 1.000 21.351 0 22  CYS BBB CA  1 ? 6  
ATOM   1690 C C   . CYS B 2 24  ? -1.028  42.931  -37.876 1.000 21.261 0 22  CYS BBB C   1 ? 6  
ATOM   1691 O O   . CYS B 2 24  ? -0.504  42.036  -37.199 1.000 22.160 0 22  CYS BBB O   1 ? 6  
ATOM   1692 C CB  . CYS B 2 24  ? 0.218   44.920  -36.968 1.000 21.494 0 22  CYS BBB CB  1 ? 6  
ATOM   1693 S SG  . CYS B 2 24  ? 1.211   45.049  -38.472 1.000 24.312 0 22  CYS BBB SG  1 ? 6  
ATOM   1694 N N   . VAL B 2 25  ? -1.494  42.780  -39.112 1.000 21.178 0 23  VAL BBB N   1 ? 6  
ATOM   1695 C CA  . VAL B 2 25  ? -1.375  41.524  -39.888 1.000 22.027 0 23  VAL BBB CA  1 ? 6  
ATOM   1696 C C   . VAL B 2 25  ? -0.313  41.736  -40.960 1.000 21.673 0 23  VAL BBB C   1 ? 6  
ATOM   1697 O O   . VAL B 2 25  ? -0.420  42.696  -41.741 1.000 23.238 0 23  VAL BBB O   1 ? 6  
ATOM   1698 C CB  . VAL B 2 25  ? -2.719  41.094  -40.494 1.000 24.024 0 23  VAL BBB CB  1 ? 6  
ATOM   1699 C CG1 . VAL B 2 25  ? -2.587  39.791  -41.268 1.000 26.130 0 23  VAL BBB CG1 1 ? 6  
ATOM   1700 C CG2 . VAL B 2 25  ? -3.771  40.983  -39.404 1.000 25.975 0 23  VAL BBB CG2 1 ? 6  
ATOM   1701 N N   . ALA B 2 26  ? 0.679   40.869  -40.982 1.000 22.338 0 24  ALA BBB N   1 ? 6  
ATOM   1702 C CA  . ALA B 2 26  ? 1.728   40.876  -42.015 1.000 22.785 0 24  ALA BBB CA  1 ? 6  
ATOM   1703 C C   . ALA B 2 26  ? 1.222   40.061  -43.201 1.000 24.202 0 24  ALA BBB C   1 ? 6  
ATOM   1704 O O   . ALA B 2 26  ? 0.636   38.979  -42.992 1.000 24.309 0 24  ALA BBB O   1 ? 6  
ATOM   1705 C CB  . ALA B 2 26  ? 3.017   40.348  -41.436 1.000 23.194 0 24  ALA BBB CB  1 ? 6  
ATOM   1706 N N   . SER B 2 27  ? 1.456   40.537  -44.416 1.000 25.630 0 25  SER BBB N   1 ? 6  
ATOM   1707 C CA  . SER B 2 27  ? 1.309   39.705  -45.631 1.000 27.133 0 25  SER BBB CA  1 ? 6  
ATOM   1708 C C   . SER B 2 27  ? 2.579   39.812  -46.466 1.000 26.559 0 25  SER BBB C   1 ? 6  
ATOM   1709 O O   . SER B 2 27  ? 3.194   40.889  -46.460 1.000 26.373 0 25  SER BBB O   1 ? 6  
ATOM   1710 C CB  . SER B 2 27  ? 0.092   40.068  -46.443 1.000 31.275 0 25  SER BBB CB  1 ? 6  
ATOM   1711 O OG  . SER B 2 27  ? 0.154   41.411  -46.869 1.000 34.561 0 25  SER BBB OG  1 ? 6  
ATOM   1712 N N   . GLY B 2 28  ? 2.902   38.740  -47.189 1.000 26.520 0 26  GLY BBB N   1 ? 6  
ATOM   1713 C CA  . GLY B 2 28  ? 4.089   38.636  -48.053 1.000 26.718 0 26  GLY BBB CA  1 ? 6  
ATOM   1714 C C   . GLY B 2 28  ? 5.299   38.175  -47.273 1.000 26.215 0 26  GLY BBB C   1 ? 6  
ATOM   1715 O O   . GLY B 2 28  ? 6.389   38.103  -47.854 1.000 27.740 0 26  GLY BBB O   1 ? 6  
ATOM   1716 N N   . VAL B 2 29  ? 5.099   37.918  -45.989 1.000 26.937 0 27  VAL BBB N   1 ? 6  
ATOM   1717 C CA  . VAL B 2 29  ? 6.104   37.397  -45.027 1.000 28.035 0 27  VAL BBB CA  1 ? 6  
ATOM   1718 C C   . VAL B 2 29  ? 5.308   36.566  -44.020 1.000 27.241 0 27  VAL BBB C   1 ? 6  
ATOM   1719 O O   . VAL B 2 29  ? 4.122   36.894  -43.763 1.000 27.762 0 27  VAL BBB O   1 ? 6  
ATOM   1720 C CB  . VAL B 2 29  ? 6.888   38.528  -44.339 1.000 28.680 0 27  VAL BBB CB  1 ? 6  
ATOM   1721 C CG1 . VAL B 2 29  ? 5.963   39.463  -43.575 1.000 31.458 0 27  VAL BBB CG1 1 ? 6  
ATOM   1722 C CG2 . VAL B 2 29  ? 7.991   37.989  -43.435 1.000 29.268 0 27  VAL BBB CG2 1 ? 6  
ATOM   1723 N N   . THR B 2 30  ? 5.922   35.513  -43.498 1.000 24.217 0 28  THR BBB N   1 ? 6  
ATOM   1724 C CA  . THR B 2 30  ? 5.322   34.620  -42.483 1.000 23.704 0 28  THR BBB CA  1 ? 6  
ATOM   1725 C C   . THR B 2 30  ? 5.990   34.941  -41.151 1.000 21.600 0 28  THR BBB C   1 ? 6  
ATOM   1726 O O   . THR B 2 30  ? 7.223   34.903  -41.107 1.000 21.641 0 28  THR BBB O   1 ? 6  
ATOM   1727 C CB  . THR B 2 30  ? 5.506   33.151  -42.885 1.000 24.562 0 28  THR BBB CB  1 ? 6  
ATOM   1728 O OG1 . THR B 2 30  ? 4.898   32.959  -44.168 1.000 26.307 0 28  THR BBB OG1 1 ? 6  
ATOM   1729 C CG2 . THR B 2 30  ? 4.898   32.196  -41.887 1.000 25.383 0 28  THR BBB CG2 1 ? 6  
ATOM   1730 N N   . LEU B 2 31  ? 5.225   35.291  -40.131 1.000 21.299 0 29  LEU BBB N   1 ? 6  
ATOM   1731 C CA  . LEU B 2 31  ? 5.781   35.547  -38.774 1.000 20.459 0 29  LEU BBB CA  1 ? 6  
ATOM   1732 C C   . LEU B 2 31  ? 6.404   34.253  -38.239 1.000 19.686 0 29  LEU BBB C   1 ? 6  
ATOM   1733 O O   . LEU B 2 31  ? 5.942   33.148  -38.620 1.000 20.158 0 29  LEU BBB O   1 ? 6  
ATOM   1734 C CB  . LEU B 2 31  ? 4.685   36.060  -37.830 1.000 21.341 0 29  LEU BBB CB  1 ? 6  
ATOM   1735 C CG  . LEU B 2 31  ? 4.139   37.448  -38.164 1.000 23.117 0 29  LEU BBB CG  1 ? 6  
ATOM   1736 C CD1 . LEU B 2 31  ? 3.288   37.957  -37.015 1.000 23.566 0 29  LEU BBB CD1 1 ? 6  
ATOM   1737 C CD2 . LEU B 2 31  ? 5.248   38.429  -38.506 1.000 22.672 0 29  LEU BBB CD2 1 ? 6  
ATOM   1738 N N   . GLY B 2 32  ? 7.475   34.387  -37.447 1.000 18.553 0 30  GLY BBB N   1 ? 6  
ATOM   1739 C CA  . GLY B 2 32  ? 8.214   33.263  -36.860 1.000 18.741 0 30  GLY BBB CA  1 ? 6  
ATOM   1740 C C   . GLY B 2 32  ? 9.712   33.427  -36.969 1.000 18.036 0 30  GLY BBB C   1 ? 6  
ATOM   1741 O O   . GLY B 2 32  ? 10.421  32.610  -36.396 1.000 19.001 0 30  GLY BBB O   1 ? 6  
ATOM   1742 N N   . ARG B 2 33  ? 10.200  34.429  -37.687 1.000 18.124 0 31  ARG BBB N   1 ? 6  
ATOM   1743 C CA  . ARG B 2 33  ? 11.662  34.726  -37.663 1.000 18.690 0 31  ARG BBB CA  1 ? 6  
ATOM   1744 C C   . ARG B 2 33  ? 11.901  36.173  -37.251 1.000 19.517 0 31  ARG BBB C   1 ? 6  
ATOM   1745 O O   . ARG B 2 33  ? 12.824  36.402  -36.450 1.000 21.557 0 31  ARG BBB O   1 ? 6  
ATOM   1746 C CB  . ARG B 2 33  ? 12.323  34.471  -39.013 1.000 19.143 0 31  ARG BBB CB  1 ? 6  
ATOM   1747 C CG  . ARG B 2 33  ? 13.802  34.841  -39.055 1.000 19.013 0 31  ARG BBB CG  1 ? 6  
ATOM   1748 C CD  . ARG B 2 33  ? 14.619  34.172  -37.976 1.000 19.156 0 31  ARG BBB CD  1 ? 6  
ATOM   1749 N NE  . ARG B 2 33  ? 16.021  34.577  -38.050 1.000 19.975 0 31  ARG BBB NE  1 ? 6  
ATOM   1750 C CZ  . ARG B 2 33  ? 16.969  34.180  -37.215 1.000 20.903 0 31  ARG BBB CZ  1 ? 6  
ATOM   1751 N NH1 . ARG B 2 33  ? 16.693  33.307  -36.252 1.000 21.129 0 31  ARG BBB NH1 1 ? 6  
ATOM   1752 N NH2 . ARG B 2 33  ? 18.210  34.632  -37.360 1.000 20.263 0 31  ARG BBB NH2 1 ? 6  
ATOM   1753 N N   . HIS B 2 34  ? 11.121  37.106  -37.784 1.000 19.545 0 32  HIS BBB N   1 ? 6  
ATOM   1754 C CA  . HIS B 2 34  ? 11.459  38.546  -37.713 1.000 19.375 0 32  HIS BBB CA  1 ? 6  
ATOM   1755 C C   . HIS B 2 34  ? 10.953  39.218  -36.442 1.000 18.199 0 32  HIS BBB C   1 ? 6  
ATOM   1756 O O   . HIS B 2 34  ? 9.917   38.826  -35.881 1.000 18.192 0 32  HIS BBB O   1 ? 6  
ATOM   1757 C CB  . HIS B 2 34  ? 11.014  39.254  -38.984 1.000 20.296 0 32  HIS BBB CB  1 ? 6  
ATOM   1758 C CG  . HIS B 2 34  ? 11.586  38.592  -40.179 1.000 21.002 0 32  HIS BBB CG  1 ? 6  
ATOM   1759 N ND1 . HIS B 2 34  ? 10.800  37.877  -41.051 1.000 22.270 0 32  HIS BBB ND1 1 ? 6  
ATOM   1760 C CD2 . HIS B 2 34  ? 12.862  38.429  -40.586 1.000 23.806 0 32  HIS BBB CD2 1 ? 6  
ATOM   1761 C CE1 . HIS B 2 34  ? 11.560  37.346  -41.988 1.000 23.893 0 32  HIS BBB CE1 1 ? 6  
ATOM   1762 N NE2 . HIS B 2 34  ? 12.820  37.675  -41.736 1.000 25.691 0 32  HIS BBB NE2 1 ? 6  
ATOM   1763 N N   . ALA B 2 35  ? 11.637  40.297  -36.092 1.000 19.166 0 33  ALA BBB N   1 ? 6  
ATOM   1764 C CA  . ALA B 2 35  ? 11.207  41.295  -35.090 1.000 20.254 0 33  ALA BBB CA  1 ? 6  
ATOM   1765 C C   . ALA B 2 35  ? 10.092  42.144  -35.698 1.000 19.445 0 33  ALA BBB C   1 ? 6  
ATOM   1766 O O   . ALA B 2 35  ? 10.230  42.586  -36.844 1.000 20.807 0 33  ALA BBB O   1 ? 6  
ATOM   1767 C CB  . ALA B 2 35  ? 12.377  42.149  -34.667 1.000 20.683 0 33  ALA BBB CB  1 ? 6  
ATOM   1768 N N   . ILE B 2 36  ? 8.990   42.280  -34.987 1.000 19.099 0 34  ILE BBB N   1 ? 6  
ATOM   1769 C CA  . ILE B 2 36  ? 7.853   43.127  -35.432 1.000 20.211 0 34  ILE BBB CA  1 ? 6  
ATOM   1770 C C   . ILE B 2 36  ? 7.362   43.894  -34.209 1.000 21.197 0 34  ILE BBB C   1 ? 6  
ATOM   1771 O O   . ILE B 2 36  ? 7.433   43.358  -33.084 1.000 20.967 0 34  ILE BBB O   1 ? 6  
ATOM   1772 C CB  . ILE B 2 36  ? 6.746   42.287  -36.091 1.000 21.785 0 34  ILE BBB CB  1 ? 6  
ATOM   1773 C CG1 . ILE B 2 36  ? 5.704   43.178  -36.773 1.000 22.621 0 34  ILE BBB CG1 1 ? 6  
ATOM   1774 C CG2 . ILE B 2 36  ? 6.110   41.349  -35.087 1.000 21.944 0 34  ILE BBB CG2 1 ? 6  
ATOM   1775 C CD1 . ILE B 2 36  ? 4.712   42.428  -37.607 1.000 23.225 0 34  ILE BBB CD1 1 ? 6  
ATOM   1776 N N   . GLY B 2 37  ? 6.910   45.120  -34.412 1.000 22.378 0 35  GLY BBB N   1 ? 6  
ATOM   1777 C CA  . GLY B 2 37  ? 6.498   45.957  -33.281 1.000 21.890 0 35  GLY BBB CA  1 ? 6  
ATOM   1778 C C   . GLY B 2 37  ? 5.802   47.222  -33.710 1.000 22.786 0 35  GLY BBB C   1 ? 6  
ATOM   1779 O O   . GLY B 2 37  ? 5.355   47.336  -34.877 1.000 20.483 0 35  GLY BBB O   1 ? 6  
ATOM   1780 N N   . TRP B 2 38  ? 5.714   48.141  -32.757 1.000 21.937 0 36  TRP BBB N   1 ? 6  
ATOM   1781 C CA  A TRP B 2 38  ? 4.992   49.420  -32.923 0.500 22.003 0 36  TRP BBB CA  1 ? 6  
ATOM   1782 C CA  B TRP B 2 38  ? 4.993   49.422  -32.933 0.500 21.765 0 36  TRP BBB CA  1 ? 6  
ATOM   1783 C C   . TRP B 2 38  ? 5.931   50.587  -32.643 1.000 21.638 0 36  TRP BBB C   1 ? 6  
ATOM   1784 O O   . TRP B 2 38  ? 6.752   50.474  -31.720 1.000 21.313 0 36  TRP BBB O   1 ? 6  
ATOM   1785 C CB  A TRP B 2 38  ? 3.776   49.438  -31.999 0.500 22.969 0 36  TRP BBB CB  1 ? 6  
ATOM   1786 C CB  B TRP B 2 38  ? 3.741   49.481  -32.052 0.500 22.357 0 36  TRP BBB CB  1 ? 6  
ATOM   1787 C CG  A TRP B 2 38  ? 2.841   48.303  -32.269 0.500 22.779 0 36  TRP BBB CG  1 ? 6  
ATOM   1788 C CG  B TRP B 2 38  ? 2.507   49.049  -32.780 0.500 22.072 0 36  TRP BBB CG  1 ? 6  
ATOM   1789 C CD1 A TRP B 2 38  ? 2.908   47.035  -31.774 0.500 22.566 0 36  TRP BBB CD1 1 ? 6  
ATOM   1790 C CD1 B TRP B 2 38  ? 1.713   49.804  -33.594 0.500 22.046 0 36  TRP BBB CD1 1 ? 6  
ATOM   1791 C CD2 A TRP B 2 38  ? 1.707   48.336  -33.147 0.500 23.212 0 36  TRP BBB CD2 1 ? 6  
ATOM   1792 C CD2 B TRP B 2 38  ? 1.923   47.741  -32.745 0.500 21.431 0 36  TRP BBB CD2 1 ? 6  
ATOM   1793 N NE1 A TRP B 2 38  ? 1.873   46.283  -32.257 0.500 23.277 0 36  TRP BBB NE1 1 ? 6  
ATOM   1794 N NE1 B TRP B 2 38  ? 0.670   49.056  -34.067 0.500 22.412 0 36  TRP BBB NE1 1 ? 6  
ATOM   1795 C CE2 A TRP B 2 38  ? 1.114   47.057  -33.096 0.500 23.564 0 36  TRP BBB CE2 1 ? 6  
ATOM   1796 C CE2 B TRP B 2 38  ? 0.776   47.786  -33.566 0.500 21.453 0 36  TRP BBB CE2 1 ? 6  
ATOM   1797 C CE3 A TRP B 2 38  ? 1.119   49.331  -33.938 0.500 23.595 0 36  TRP BBB CE3 1 ? 6  
ATOM   1798 C CE3 B TRP B 2 38  ? 2.274   46.545  -32.110 0.500 21.153 0 36  TRP BBB CE3 1 ? 6  
ATOM   1799 C CZ2 A TRP B 2 38  ? -0.032  46.747  -33.824 0.500 24.416 0 36  TRP BBB CZ2 1 ? 6  
ATOM   1800 C CZ2 B TRP B 2 38  ? -0.028  46.669  -33.761 0.500 22.195 0 36  TRP BBB CZ2 1 ? 6  
ATOM   1801 C CZ3 A TRP B 2 38  ? -0.012  49.020  -34.658 0.500 24.060 0 36  TRP BBB CZ3 1 ? 6  
ATOM   1802 C CZ3 B TRP B 2 38  ? 1.475   45.444  -32.307 0.500 21.034 0 36  TRP BBB CZ3 1 ? 6  
ATOM   1803 C CH2 A TRP B 2 38  ? -0.575  47.747  -34.597 0.500 23.437 0 36  TRP BBB CH2 1 ? 6  
ATOM   1804 C CH2 B TRP B 2 38  ? 0.343   45.514  -33.116 0.500 20.891 0 36  TRP BBB CH2 1 ? 6  
ATOM   1805 N N   . PHE B 2 39  ? 5.770   51.639  -33.431 1.000 20.487 0 37  PHE BBB N   1 ? 7  
ATOM   1806 C CA  . PHE B 2 39  ? 6.340   52.984  -33.236 1.000 20.568 0 37  PHE BBB CA  1 ? 7  
ATOM   1807 C C   . PHE B 2 39  ? 5.144   53.921  -33.098 1.000 20.618 0 37  PHE BBB C   1 ? 7  
ATOM   1808 O O   . PHE B 2 39  ? 4.012   53.541  -33.459 1.000 21.445 0 37  PHE BBB O   1 ? 7  
ATOM   1809 C CB  . PHE B 2 39  ? 7.234   53.372  -34.410 1.000 21.943 0 37  PHE BBB CB  1 ? 7  
ATOM   1810 C CG  . PHE B 2 39  ? 8.607   52.750  -34.406 1.000 23.709 0 37  PHE BBB CG  1 ? 7  
ATOM   1811 C CD1 . PHE B 2 39  ? 8.759   51.382  -34.581 1.000 25.263 0 37  PHE BBB CD1 1 ? 7  
ATOM   1812 C CD2 . PHE B 2 39  ? 9.741   53.527  -34.238 1.000 24.555 0 37  PHE BBB CD2 1 ? 7  
ATOM   1813 C CE1 . PHE B 2 39  ? 10.023  50.806  -34.584 1.000 27.059 0 37  PHE BBB CE1 1 ? 7  
ATOM   1814 C CE2 . PHE B 2 39  ? 11.005  52.957  -34.259 1.000 26.648 0 37  PHE BBB CE2 1 ? 7  
ATOM   1815 C CZ  . PHE B 2 39  ? 11.141  51.593  -34.393 1.000 26.563 0 37  PHE BBB CZ  1 ? 7  
ATOM   1816 N N   . ARG B 2 40  ? 5.372   55.130  -32.601 1.000 21.196 0 38  ARG BBB N   1 ? 7  
ATOM   1817 C CA  . ARG B 2 40  ? 4.311   56.157  -32.579 1.000 22.362 0 38  ARG BBB CA  1 ? 7  
ATOM   1818 C C   . ARG B 2 40  ? 4.934   57.520  -32.853 1.000 22.235 0 38  ARG BBB C   1 ? 7  
ATOM   1819 O O   . ARG B 2 40  ? 6.132   57.677  -32.678 1.000 22.787 0 38  ARG BBB O   1 ? 7  
ATOM   1820 C CB  . ARG B 2 40  ? 3.539   56.164  -31.256 1.000 21.698 0 38  ARG BBB CB  1 ? 7  
ATOM   1821 C CG  . ARG B 2 40  ? 4.354   56.636  -30.060 1.000 24.152 0 38  ARG BBB CG  1 ? 7  
ATOM   1822 C CD  . ARG B 2 40  ? 3.503   56.587  -28.821 1.000 26.456 0 38  ARG BBB CD  1 ? 7  
ATOM   1823 N NE  . ARG B 2 40  ? 4.255   56.796  -27.596 1.000 29.048 0 38  ARG BBB NE  1 ? 7  
ATOM   1824 C CZ  . ARG B 2 40  ? 3.713   56.791  -26.382 1.000 31.233 0 38  ARG BBB CZ  1 ? 7  
ATOM   1825 N NH1 . ARG B 2 40  ? 2.416   56.573  -26.237 1.000 28.379 0 38  ARG BBB NH1 1 ? 7  
ATOM   1826 N NH2 . ARG B 2 40  ? 4.478   56.974  -25.316 1.000 35.242 0 38  ARG BBB NH2 1 ? 7  
ATOM   1827 N N   . GLN B 2 41  ? 4.120   58.427  -33.363 1.000 21.757 0 39  GLN BBB N   1 ? 7  
ATOM   1828 C CA  . GLN B 2 41  ? 4.552   59.821  -33.606 1.000 22.209 0 39  GLN BBB CA  1 ? 7  
ATOM   1829 C C   . GLN B 2 41  ? 3.461   60.721  -33.031 1.000 22.258 0 39  GLN BBB C   1 ? 7  
ATOM   1830 O O   . GLN B 2 41  ? 2.347   60.775  -33.617 1.000 22.752 0 39  GLN BBB O   1 ? 7  
ATOM   1831 C CB  . GLN B 2 41  ? 4.798   60.098  -35.085 1.000 24.961 0 39  GLN BBB CB  1 ? 7  
ATOM   1832 C CG  . GLN B 2 41  ? 5.270   61.524  -35.312 1.000 27.673 0 39  GLN BBB CG  1 ? 7  
ATOM   1833 C CD  . GLN B 2 41  ? 5.747   61.752  -36.722 1.000 31.587 0 39  GLN BBB CD  1 ? 7  
ATOM   1834 O OE1 . GLN B 2 41  ? 5.377   61.042  -37.646 1.000 37.397 0 39  GLN BBB OE1 1 ? 7  
ATOM   1835 N NE2 . GLN B 2 41  ? 6.579   62.758  -36.891 1.000 33.229 0 39  GLN BBB NE2 1 ? 7  
ATOM   1836 N N   . ALA B 2 42  ? 3.762   61.314  -31.878 1.000 23.028 0 40  ALA BBB N   1 ? 7  
ATOM   1837 C CA  . ALA B 2 42  ? 2.882   62.261  -31.172 1.000 24.132 0 40  ALA BBB CA  1 ? 7  
ATOM   1838 C C   . ALA B 2 42  ? 3.121   63.645  -31.763 1.000 25.041 0 40  ALA BBB C   1 ? 7  
ATOM   1839 O O   . ALA B 2 42  ? 4.188   63.913  -32.321 1.000 23.918 0 40  ALA BBB O   1 ? 7  
ATOM   1840 C CB  . ALA B 2 42  ? 3.160   62.214  -29.681 1.000 25.524 0 40  ALA BBB CB  1 ? 7  
ATOM   1841 N N   . PRO B 2 43  ? 2.135   64.561  -31.682 1.000 26.517 0 41  PRO BBB N   1 ? 7  
ATOM   1842 C CA  . PRO B 2 43  ? 2.330   65.926  -32.176 1.000 27.356 0 41  PRO BBB CA  1 ? 7  
ATOM   1843 C C   . PRO B 2 43  ? 3.603   66.552  -31.588 1.000 28.161 0 41  PRO BBB C   1 ? 7  
ATOM   1844 O O   . PRO B 2 43  ? 3.828   66.448  -30.375 1.000 25.445 0 41  PRO BBB O   1 ? 7  
ATOM   1845 C CB  . PRO B 2 43  ? 1.049   66.642  -31.733 1.000 28.720 0 41  PRO BBB CB  1 ? 7  
ATOM   1846 C CG  . PRO B 2 43  ? 0.016   65.532  -31.685 1.000 28.711 0 41  PRO BBB CG  1 ? 7  
ATOM   1847 C CD  . PRO B 2 43  ? 0.778   64.334  -31.156 1.000 27.105 0 41  PRO BBB CD  1 ? 7  
ATOM   1848 N N   . GLY B 2 44  ? 4.436   67.118  -32.465 1.000 26.790 0 42  GLY BBB N   1 ? 7  
ATOM   1849 C CA  . GLY B 2 44  ? 5.652   67.867  -32.091 1.000 30.451 0 42  GLY BBB CA  1 ? 7  
ATOM   1850 C C   . GLY B 2 44  ? 6.790   66.990  -31.610 1.000 29.419 0 42  GLY BBB C   1 ? 7  
ATOM   1851 O O   . GLY B 2 44  ? 7.791   67.545  -31.114 1.000 28.860 0 42  GLY BBB O   1 ? 7  
ATOM   1852 N N   . LYS B 2 45  ? 6.673   65.671  -31.761 1.000 29.166 0 43  LYS BBB N   1 ? 7  
ATOM   1853 C CA  . LYS B 2 45  ? 7.709   64.702  -31.320 1.000 31.621 0 43  LYS BBB CA  1 ? 7  
ATOM   1854 C C   . LYS B 2 45  ? 8.147   63.836  -32.501 1.000 29.372 0 43  LYS BBB C   1 ? 7  
ATOM   1855 O O   . LYS B 2 45  ? 7.338   63.558  -33.396 1.000 27.950 0 43  LYS BBB O   1 ? 7  
ATOM   1856 C CB  . LYS B 2 45  ? 7.173   63.839  -30.178 1.000 33.813 0 43  LYS BBB CB  1 ? 7  
ATOM   1857 C CG  . LYS B 2 45  ? 6.740   64.622  -28.948 1.000 38.891 0 43  LYS BBB CG  1 ? 7  
ATOM   1858 C CD  . LYS B 2 45  ? 6.372   63.751  -27.777 1.000 43.814 0 43  LYS BBB CD  1 ? 7  
ATOM   1859 C CE  . LYS B 2 45  ? 7.546   62.974  -27.215 1.000 47.832 0 43  LYS BBB CE  1 ? 7  
ATOM   1860 N NZ  . LYS B 2 45  ? 7.257   62.475  -25.850 1.000 49.748 0 43  LYS BBB NZ  1 ? 7  
ATOM   1861 N N   . GLU B 2 46  ? 9.407   63.424  -32.484 1.000 29.751 0 44  GLU BBB N   1 ? 7  
ATOM   1862 C CA  . GLU B 2 46  ? 9.969   62.476  -33.464 1.000 30.682 0 44  GLU BBB CA  1 ? 7  
ATOM   1863 C C   . GLU B 2 46  ? 9.288   61.126  -33.264 1.000 27.336 0 44  GLU BBB C   1 ? 7  
ATOM   1864 O O   . GLU B 2 46  ? 8.946   60.788  -32.114 1.000 26.866 0 44  GLU BBB O   1 ? 7  
ATOM   1865 C CB  . GLU B 2 46  ? 11.483  62.362  -33.288 1.000 34.467 0 44  GLU BBB CB  1 ? 7  
ATOM   1866 C CG  . GLU B 2 46  ? 12.237  63.569  -33.808 1.000 38.402 0 44  GLU BBB CG  1 ? 7  
ATOM   1867 C CD  . GLU B 2 46  ? 13.739  63.355  -33.856 1.000 43.781 0 44  GLU BBB CD  1 ? 7  
ATOM   1868 O OE1 . GLU B 2 46  ? 14.260  63.071  -34.958 1.000 48.500 0 44  GLU BBB OE1 1 ? 7  
ATOM   1869 O OE2 . GLU B 2 46  ? 14.379  63.459  -32.790 1.000 48.692 0 44  GLU BBB OE2 1 ? 7  
ATOM   1870 N N   . ARG B 2 47  ? 9.135   60.375  -34.349 1.000 27.015 0 45  ARG BBB N   1 ? 7  
ATOM   1871 C CA  . ARG B 2 47  ? 8.662   58.972  -34.289 1.000 26.798 0 45  ARG BBB CA  1 ? 7  
ATOM   1872 C C   . ARG B 2 47  ? 9.559   58.205  -33.316 1.000 26.085 0 45  ARG BBB C   1 ? 7  
ATOM   1873 O O   . ARG B 2 47  ? 10.795  58.392  -33.369 1.000 26.345 0 45  ARG BBB O   1 ? 7  
ATOM   1874 C CB  . ARG B 2 47  ? 8.703   58.337  -35.674 1.000 29.800 0 45  ARG BBB CB  1 ? 7  
ATOM   1875 C CG  . ARG B 2 47  ? 7.941   57.025  -35.764 1.000 31.225 0 45  ARG BBB CG  1 ? 7  
ATOM   1876 C CD  . ARG B 2 47  ? 7.854   56.534  -37.190 1.000 35.802 0 45  ARG BBB CD  1 ? 7  
ATOM   1877 N NE  . ARG B 2 47  ? 7.223   57.508  -38.065 1.000 42.715 0 45  ARG BBB NE  1 ? 7  
ATOM   1878 C CZ  . ARG B 2 47  ? 6.839   57.288  -39.317 1.000 43.942 0 45  ARG BBB CZ  1 ? 7  
ATOM   1879 N NH1 . ARG B 2 47  ? 6.997   56.100  -39.869 1.000 41.147 0 45  ARG BBB NH1 1 ? 7  
ATOM   1880 N NH2 . ARG B 2 47  ? 6.274   58.265  -40.005 1.000 45.295 0 45  ARG BBB NH2 1 ? 7  
ATOM   1881 N N   . GLU B 2 48  ? 8.963   57.381  -32.457 1.000 24.737 0 46  GLU BBB N   1 ? 7  
ATOM   1882 C CA  . GLU B 2 48  ? 9.707   56.675  -31.387 1.000 25.051 0 46  GLU BBB CA  1 ? 7  
ATOM   1883 C C   . GLU B 2 48  ? 9.200   55.235  -31.255 1.000 22.955 0 46  GLU BBB C   1 ? 7  
ATOM   1884 O O   . GLU B 2 48  ? 8.005   54.976  -31.531 1.000 21.204 0 46  GLU BBB O   1 ? 7  
ATOM   1885 C CB  . GLU B 2 48  ? 9.570   57.417  -30.057 1.000 28.210 0 46  GLU BBB CB  1 ? 7  
ATOM   1886 C CG  . GLU B 2 48  ? 8.155   57.443  -29.510 1.000 30.981 0 46  GLU BBB CG  1 ? 7  
ATOM   1887 C CD  . GLU B 2 48  ? 7.968   58.215  -28.215 1.000 39.008 0 46  GLU BBB CD  1 ? 7  
ATOM   1888 O OE1 . GLU B 2 48  ? 8.958   58.774  -27.721 1.000 43.389 0 46  GLU BBB OE1 1 ? 7  
ATOM   1889 O OE2 . GLU B 2 48  ? 6.824   58.242  -27.699 1.000 40.543 0 46  GLU BBB OE2 1 ? 7  
ATOM   1890 N N   . ARG B 2 49  ? 10.077  54.359  -30.776 1.000 23.384 0 47  ARG BBB N   1 ? 7  
ATOM   1891 C CA  . ARG B 2 49  ? 9.752   52.958  -30.421 1.000 24.685 0 47  ARG BBB CA  1 ? 7  
ATOM   1892 C C   . ARG B 2 49  ? 8.679   52.958  -29.335 1.000 23.181 0 47  ARG BBB C   1 ? 7  
ATOM   1893 O O   . ARG B 2 49  ? 8.749   53.808  -28.424 1.000 22.799 0 47  ARG BBB O   1 ? 7  
ATOM   1894 C CB  . ARG B 2 49  ? 10.990  52.217  -29.909 1.000 27.688 0 47  ARG BBB CB  1 ? 7  
ATOM   1895 C CG  . ARG B 2 49  ? 12.058  51.989  -30.962 1.000 32.425 0 47  ARG BBB CG  1 ? 7  
ATOM   1896 C CD  . ARG B 2 49  ? 13.313  51.327  -30.419 1.000 37.397 0 47  ARG BBB CD  1 ? 7  
ATOM   1897 N NE  . ARG B 2 49  ? 14.194  50.835  -31.479 1.000 41.105 0 47  ARG BBB NE  1 ? 7  
ATOM   1898 C CZ  . ARG B 2 49  ? 13.985  49.733  -32.199 1.000 41.475 0 47  ARG BBB CZ  1 ? 7  
ATOM   1899 N NH1 . ARG B 2 49  ? 12.898  49.003  -32.008 1.000 42.206 0 47  ARG BBB NH1 1 ? 7  
ATOM   1900 N NH2 . ARG B 2 49  ? 14.863  49.376  -33.123 1.000 41.244 0 47  ARG BBB NH2 1 ? 7  
ATOM   1901 N N   . VAL B 2 50  ? 7.730   52.034  -29.448 1.000 21.996 0 48  VAL BBB N   1 ? 7  
ATOM   1902 C CA  . VAL B 2 50  ? 6.722   51.738  -28.401 1.000 22.007 0 48  VAL BBB CA  1 ? 7  
ATOM   1903 C C   . VAL B 2 50  ? 7.003   50.332  -27.855 1.000 23.719 0 48  VAL BBB C   1 ? 7  
ATOM   1904 O O   . VAL B 2 50  ? 7.208   50.163  -26.625 1.000 23.608 0 48  VAL BBB O   1 ? 7  
ATOM   1905 C CB  . VAL B 2 50  ? 5.307   51.883  -28.978 1.000 22.061 0 48  VAL BBB CB  1 ? 7  
ATOM   1906 C CG1 . VAL B 2 50  ? 4.254   51.339  -28.022 1.000 23.987 0 48  VAL BBB CG1 1 ? 7  
ATOM   1907 C CG2 . VAL B 2 50  ? 5.024   53.330  -29.370 1.000 22.480 0 48  VAL BBB CG2 1 ? 7  
ATOM   1908 N N   . SER B 2 51  ? 6.995   49.324  -28.716 1.000 21.808 0 49  SER BBB N   1 ? 7  
ATOM   1909 C CA  . SER B 2 51  ? 7.103   47.920  -28.255 1.000 22.934 0 49  SER BBB CA  1 ? 7  
ATOM   1910 C C   . SER B 2 51  ? 7.513   47.034  -29.416 1.000 23.365 0 49  SER BBB C   1 ? 7  
ATOM   1911 O O   . SER B 2 51  ? 7.215   47.393  -30.566 1.000 22.881 0 49  SER BBB O   1 ? 7  
ATOM   1912 C CB  . SER B 2 51  ? 5.811   47.443  -27.650 1.000 24.262 0 49  SER BBB CB  1 ? 7  
ATOM   1913 O OG  . SER B 2 51  ? 6.003   46.159  -27.082 1.000 28.646 0 49  SER BBB OG  1 ? 7  
ATOM   1914 N N   . CYS B 2 52  ? 8.198   45.934  -29.112 1.000 21.679 0 50  CYS BBB N   1 ? 7  
ATOM   1915 C CA  . CYS B 2 52  ? 8.660   44.997  -30.155 1.000 20.965 0 50  CYS BBB CA  1 ? 7  
ATOM   1916 C C   . CYS B 2 52  ? 8.577   43.575  -29.617 1.000 20.293 0 50  CYS BBB C   1 ? 7  
ATOM   1917 O O   . CYS B 2 52  ? 8.781   43.357  -28.388 1.000 20.305 0 50  CYS BBB O   1 ? 7  
ATOM   1918 C CB  . CYS B 2 52  ? 10.072  45.361  -30.592 1.000 22.598 0 50  CYS BBB CB  1 ? 7  
ATOM   1919 S SG  . CYS B 2 52  ? 10.665  44.419  -32.014 1.000 27.136 0 50  CYS BBB SG  1 ? 7  
ATOM   1920 N N   . ILE B 2 53  ? 8.300   42.635  -30.509 1.000 19.776 0 51  ILE BBB N   1 ? 7  
ATOM   1921 C CA  . ILE B 2 53  ? 8.410   41.189  -30.180 1.000 19.488 0 51  ILE BBB CA  1 ? 7  
ATOM   1922 C C   . ILE B 2 53  ? 9.283   40.495  -31.228 1.000 19.986 0 51  ILE BBB C   1 ? 7  
ATOM   1923 O O   . ILE B 2 53  ? 9.121   40.741  -32.446 1.000 20.414 0 51  ILE BBB O   1 ? 7  
ATOM   1924 C CB  . ILE B 2 53  ? 7.024   40.538  -30.031 1.000 20.284 0 51  ILE BBB CB  1 ? 7  
ATOM   1925 C CG1 . ILE B 2 53  ? 7.155   39.117  -29.488 1.000 20.964 0 51  ILE BBB CG1 1 ? 7  
ATOM   1926 C CG2 . ILE B 2 53  ? 6.247   40.549  -31.335 1.000 20.488 0 51  ILE BBB CG2 1 ? 7  
ATOM   1927 C CD1 . ILE B 2 53  ? 5.857   38.538  -29.010 1.000 22.198 0 51  ILE BBB CD1 1 ? 7  
ATOM   1928 N N   . ARG B 2 54  ? 10.186  39.649  -30.758 1.000 19.248 0 52  ARG BBB N   1 ? 7  
ATOM   1929 C CA  . ARG B 2 54  ? 10.985  38.749  -31.612 1.000 19.614 0 52  ARG BBB CA  1 ? 7  
ATOM   1930 C C   . ARG B 2 54  ? 10.099  37.531  -31.901 1.000 19.353 0 52  ARG BBB C   1 ? 7  
ATOM   1931 O O   . ARG B 2 54  ? 9.879   36.760  -30.980 1.000 18.557 0 52  ARG BBB O   1 ? 7  
ATOM   1932 C CB  . ARG B 2 54  ? 12.285  38.413  -30.872 1.000 21.361 0 52  ARG BBB CB  1 ? 7  
ATOM   1933 C CG  . ARG B 2 54  ? 13.181  39.604  -30.572 1.000 23.133 0 52  ARG BBB CG  1 ? 7  
ATOM   1934 C CD  . ARG B 2 54  ? 14.163  39.282  -29.450 1.000 27.324 0 52  ARG BBB CD  1 ? 7  
ATOM   1935 N NE  . ARG B 2 54  ? 14.859  38.036  -29.722 1.000 28.086 0 52  ARG BBB NE  1 ? 7  
ATOM   1936 C CZ  . ARG B 2 54  ? 16.028  37.931  -30.347 1.000 32.871 0 52  ARG BBB CZ  1 ? 7  
ATOM   1937 N NH1 . ARG B 2 54  ? 16.715  39.005  -30.694 1.000 34.574 0 52  ARG BBB NH1 1 ? 7  
ATOM   1938 N NH2 . ARG B 2 54  ? 16.537  36.736  -30.597 1.000 37.153 0 52  ARG BBB NH2 1 ? 7  
ATOM   1939 N N   . THR B 2 55  ? 9.586   37.356  -33.124 1.000 17.238 0 53  THR BBB N   1 ? 8  
ATOM   1940 C CA  . THR B 2 55  ? 8.647   36.245  -33.414 1.000 17.846 0 53  THR BBB CA  1 ? 8  
ATOM   1941 C C   . THR B 2 55  ? 9.423   34.928  -33.498 1.000 17.607 0 53  THR BBB C   1 ? 8  
ATOM   1942 O O   . THR B 2 55  ? 8.759   33.882  -33.554 1.000 18.551 0 53  THR BBB O   1 ? 8  
ATOM   1943 C CB  . THR B 2 55  ? 7.763   36.503  -34.642 1.000 17.908 0 53  THR BBB CB  1 ? 8  
ATOM   1944 O OG1 . THR B 2 55  ? 8.557   36.504  -35.823 1.000 18.104 0 53  THR BBB OG1 1 ? 8  
ATOM   1945 C CG2 . THR B 2 55  ? 6.988   37.796  -34.519 1.000 18.723 0 53  THR BBB CG2 1 ? 8  
ATOM   1946 N N   . PHE B 2 56  ? 10.763  34.942  -33.448 1.000 17.165 0 54  PHE BBB N   1 ? 8  
ATOM   1947 C CA  . PHE B 2 56  ? 11.564  33.693  -33.452 1.000 17.828 0 54  PHE BBB CA  1 ? 8  
ATOM   1948 C C   . PHE B 2 56  ? 11.565  33.053  -32.059 1.000 19.093 0 54  PHE BBB C   1 ? 8  
ATOM   1949 O O   . PHE B 2 56  ? 11.603  31.807  -31.971 1.000 19.063 0 54  PHE BBB O   1 ? 8  
ATOM   1950 C CB  . PHE B 2 56  ? 12.999  33.977  -33.905 1.000 17.954 0 54  PHE BBB CB  1 ? 8  
ATOM   1951 C CG  . PHE B 2 56  ? 13.820  32.731  -34.114 1.000 18.788 0 54  PHE BBB CG  1 ? 8  
ATOM   1952 C CD1 . PHE B 2 56  ? 13.579  31.896  -35.200 1.000 19.363 0 54  PHE BBB CD1 1 ? 8  
ATOM   1953 C CD2 . PHE B 2 56  ? 14.884  32.440  -33.272 1.000 21.407 0 54  PHE BBB CD2 1 ? 8  
ATOM   1954 C CE1 . PHE B 2 56  ? 14.351  30.760  -35.402 1.000 19.870 0 54  PHE BBB CE1 1 ? 8  
ATOM   1955 C CE2 . PHE B 2 56  ? 15.647  31.299  -33.473 1.000 22.399 0 54  PHE BBB CE2 1 ? 8  
ATOM   1956 C CZ  . PHE B 2 56  ? 15.381  30.474  -34.537 1.000 21.331 0 54  PHE BBB CZ  1 ? 8  
ATOM   1957 N N   . ASP B 2 57  ? 11.527  33.855  -30.995 1.000 19.708 0 55  ASP BBB N   1 ? 8  
ATOM   1958 C CA  . ASP B 2 57  ? 11.704  33.313  -29.622 1.000 21.855 0 55  ASP BBB CA  1 ? 8  
ATOM   1959 C C   . ASP B 2 57  ? 10.755  33.972  -28.614 1.000 21.318 0 55  ASP BBB C   1 ? 8  
ATOM   1960 O O   . ASP B 2 57  ? 10.834  33.604  -27.405 1.000 21.389 0 55  ASP BBB O   1 ? 8  
ATOM   1961 C CB  . ASP B 2 57  ? 13.182  33.369  -29.221 1.000 23.714 0 55  ASP BBB CB  1 ? 8  
ATOM   1962 C CG  . ASP B 2 57  ? 13.752  34.772  -29.127 1.000 25.289 0 55  ASP BBB CG  1 ? 8  
ATOM   1963 O OD1 . ASP B 2 57  ? 12.958  35.722  -29.093 1.000 23.788 0 55  ASP BBB OD1 1 ? 8  
ATOM   1964 O OD2 . ASP B 2 57  ? 15.003  34.889  -29.040 1.000 29.927 0 55  ASP BBB OD2 1 ? 8  
ATOM   1965 N N   . GLY B 2 58  ? 9.843   34.845  -29.050 1.000 19.711 0 56  GLY BBB N   1 ? 8  
ATOM   1966 C CA  . GLY B 2 58  ? 8.757   35.371  -28.203 1.000 21.939 0 56  GLY BBB CA  1 ? 8  
ATOM   1967 C C   . GLY B 2 58  ? 9.192   36.480  -27.252 1.000 22.743 0 56  GLY BBB C   1 ? 8  
ATOM   1968 O O   . GLY B 2 58  ? 8.350   36.948  -26.500 1.000 22.994 0 56  GLY BBB O   1 ? 8  
ATOM   1969 N N   . ILE B 2 59  ? 10.460  36.895  -27.263 1.000 23.573 0 57  ILE BBB N   1 ? 8  
ATOM   1970 C CA  . ILE B 2 59  ? 11.004  37.875  -26.284 1.000 25.167 0 57  ILE BBB CA  1 ? 8  
ATOM   1971 C C   . ILE B 2 59  ? 10.506  39.276  -26.657 1.000 23.561 0 57  ILE BBB C   1 ? 8  
ATOM   1972 O O   . ILE B 2 59  ? 10.666  39.696  -27.818 1.000 21.873 0 57  ILE BBB O   1 ? 8  
ATOM   1973 C CB  . ILE B 2 59  ? 12.535  37.777  -26.192 1.000 27.208 0 57  ILE BBB CB  1 ? 8  
ATOM   1974 C CG1 . ILE B 2 59  ? 12.957  36.429  -25.601 1.000 30.536 0 57  ILE BBB CG1 1 ? 8  
ATOM   1975 C CG2 . ILE B 2 59  ? 13.096  38.954  -25.411 1.000 28.203 0 57  ILE BBB CG2 1 ? 8  
ATOM   1976 C CD1 . ILE B 2 59  ? 14.445  36.213  -25.561 1.000 34.265 0 57  ILE BBB CD1 1 ? 8  
ATOM   1977 N N   . THR B 2 60  ? 9.877   39.950  -25.693 1.000 24.070 0 58  THR BBB N   1 ? 8  
ATOM   1978 C CA  . THR B 2 60  ? 9.256   41.283  -25.881 1.000 23.149 0 58  THR BBB CA  1 ? 8  
ATOM   1979 C C   . THR B 2 60  ? 10.139  42.372  -25.281 1.000 25.866 0 58  THR BBB C   1 ? 8  
ATOM   1980 O O   . THR B 2 60  ? 10.908  42.098  -24.307 1.000 26.958 0 58  THR BBB O   1 ? 8  
ATOM   1981 C CB  . THR B 2 60  ? 7.853   41.327  -25.284 1.000 23.645 0 58  THR BBB CB  1 ? 8  
ATOM   1982 O OG1 . THR B 2 60  ? 7.975   41.150  -23.869 1.000 25.132 0 58  THR BBB OG1 1 ? 8  
ATOM   1983 C CG2 . THR B 2 60  ? 6.937   40.288  -25.885 1.000 24.358 0 58  THR BBB CG2 1 ? 8  
ATOM   1984 N N   . SER B 2 61  ? 9.981   43.587  -25.803 1.000 26.393 0 59  SER BBB N   1 ? 8  
ATOM   1985 C CA  . SER B 2 61  ? 10.721  44.788  -25.344 1.000 27.974 0 59  SER BBB CA  1 ? 8  
ATOM   1986 C C   . SER B 2 61  ? 9.791   46.003  -25.392 1.000 26.882 0 59  SER BBB C   1 ? 8  
ATOM   1987 O O   . SER B 2 61  ? 8.856   46.032  -26.232 1.000 23.253 0 59  SER BBB O   1 ? 8  
ATOM   1988 C CB  . SER B 2 61  ? 11.978  45.016  -26.135 1.000 30.568 0 59  SER BBB CB  1 ? 8  
ATOM   1989 O OG  . SER B 2 61  ? 11.669  45.096  -27.508 1.000 33.043 0 59  SER BBB OG  1 ? 8  
ATOM   1990 N N   . TYR B 2 62  ? 10.018  46.937  -24.465 1.000 25.875 0 60  TYR BBB N   1 ? 8  
ATOM   1991 C CA  . TYR B 2 62  ? 9.184   48.138  -24.251 1.000 26.899 0 60  TYR BBB CA  1 ? 8  
ATOM   1992 C C   . TYR B 2 62  ? 10.110  49.327  -23.993 1.000 29.122 0 60  TYR BBB C   1 ? 8  
ATOM   1993 O O   . TYR B 2 62  ? 11.287  49.128  -23.675 1.000 32.275 0 60  TYR BBB O   1 ? 8  
ATOM   1994 C CB  . TYR B 2 62  ? 8.241   47.909  -23.068 1.000 27.396 0 60  TYR BBB CB  1 ? 8  
ATOM   1995 C CG  . TYR B 2 62  ? 7.308   46.740  -23.245 1.000 26.116 0 60  TYR BBB CG  1 ? 8  
ATOM   1996 C CD1 . TYR B 2 62  ? 6.062   46.909  -23.829 1.000 26.073 0 60  TYR BBB CD1 1 ? 8  
ATOM   1997 C CD2 . TYR B 2 62  ? 7.660   45.471  -22.816 1.000 26.738 0 60  TYR BBB CD2 1 ? 8  
ATOM   1998 C CE1 . TYR B 2 62  ? 5.201   45.841  -24.013 1.000 26.529 0 60  TYR BBB CE1 1 ? 8  
ATOM   1999 C CE2 . TYR B 2 62  ? 6.814   44.388  -23.004 1.000 26.955 0 60  TYR BBB CE2 1 ? 8  
ATOM   2000 C CZ  . TYR B 2 62  ? 5.579   44.577  -23.606 1.000 25.043 0 60  TYR BBB CZ  1 ? 8  
ATOM   2001 O OH  . TYR B 2 62  ? 4.716   43.546  -23.814 1.000 23.554 0 60  TYR BBB OH  1 ? 8  
ATOM   2002 N N   . VAL B 2 63  ? 9.594   50.534  -24.157 1.000 28.208 0 61  VAL BBB N   1 ? 8  
ATOM   2003 C CA  . VAL B 2 63  ? 10.318  51.770  -23.758 1.000 29.347 0 61  VAL BBB CA  1 ? 8  
ATOM   2004 C C   . VAL B 2 63  ? 9.755   52.196  -22.397 1.000 30.990 0 61  VAL BBB C   1 ? 8  
ATOM   2005 O O   . VAL B 2 63  ? 8.636   51.778  -22.063 1.000 32.696 0 61  VAL BBB O   1 ? 8  
ATOM   2006 C CB  . VAL B 2 63  ? 10.189  52.865  -24.835 1.000 29.556 0 61  VAL BBB CB  1 ? 8  
ATOM   2007 C CG1 . VAL B 2 63  ? 10.907  52.463  -26.116 1.000 31.119 0 61  VAL BBB CG1 1 ? 8  
ATOM   2008 C CG2 . VAL B 2 63  ? 8.738   53.224  -25.137 1.000 28.766 0 61  VAL BBB CG2 1 ? 8  
ATOM   2009 N N   . GLU B 2 64  ? 10.471  53.050  -21.678 1.000 32.856 0 62  GLU BBB N   1 ? 8  
ATOM   2010 C CA  . GLU B 2 64  ? 10.135  53.439  -20.279 1.000 34.485 0 62  GLU BBB CA  1 ? 8  
ATOM   2011 C C   . GLU B 2 64  ? 8.689   53.942  -20.183 1.000 34.044 0 62  GLU BBB C   1 ? 8  
ATOM   2012 O O   . GLU B 2 64  ? 8.045   53.638  -19.174 1.000 36.869 0 62  GLU BBB O   1 ? 8  
ATOM   2013 C CB  . GLU B 2 64  ? 11.125  54.481  -19.766 1.000 38.643 0 62  GLU BBB CB  1 ? 8  
ATOM   2014 C CG  . GLU B 2 64  ? 12.557  53.980  -19.723 1.000 42.333 0 62  GLU BBB CG  1 ? 8  
ATOM   2015 C CD  . GLU B 2 64  ? 12.836  52.827  -18.771 1.000 45.486 0 62  GLU BBB CD  1 ? 8  
ATOM   2016 O OE1 . GLU B 2 64  ? 12.576  52.986  -17.573 1.000 53.653 0 62  GLU BBB OE1 1 ? 8  
ATOM   2017 O OE2 . GLU B 2 64  ? 13.314  51.776  -19.232 1.000 50.117 0 62  GLU BBB OE2 1 ? 8  
ATOM   2018 N N   . SER B 2 65  ? 8.187   54.675  -21.179 1.000 31.913 0 63  SER BBB N   1 ? 8  
ATOM   2019 C CA  . SER B 2 65  ? 6.844   55.311  -21.147 1.000 31.912 0 63  SER BBB CA  1 ? 8  
ATOM   2020 C C   . SER B 2 65  ? 5.726   54.291  -21.407 1.000 31.370 0 63  SER BBB C   1 ? 8  
ATOM   2021 O O   . SER B 2 65  ? 4.553   54.660  -21.181 1.000 35.495 0 63  SER BBB O   1 ? 8  
ATOM   2022 C CB  . SER B 2 65  ? 6.763   56.482  -22.104 1.000 32.768 0 63  SER BBB CB  1 ? 8  
ATOM   2023 O OG  . SER B 2 65  ? 6.953   56.071  -23.447 1.000 31.480 0 63  SER BBB OG  1 ? 8  
ATOM   2024 N N   . THR B 2 66  ? 6.054   53.077  -21.862 1.000 31.255 0 64  THR BBB N   1 ? 8  
ATOM   2025 C CA  . THR B 2 66  ? 5.053   52.050  -22.277 1.000 31.492 0 64  THR BBB CA  1 ? 8  
ATOM   2026 C C   . THR B 2 66  ? 5.104   50.800  -21.385 1.000 32.493 0 64  THR BBB C   1 ? 8  
ATOM   2027 O O   . THR B 2 66  ? 4.059   50.108  -21.319 1.000 33.174 0 64  THR BBB O   1 ? 8  
ATOM   2028 C CB  . THR B 2 66  ? 5.216   51.686  -23.759 1.000 29.488 0 64  THR BBB CB  1 ? 8  
ATOM   2029 O OG1 . THR B 2 66  ? 6.433   50.964  -23.962 1.000 29.734 0 64  THR BBB OG1 1 ? 8  
ATOM   2030 C CG2 . THR B 2 66  ? 5.192   52.919  -24.634 1.000 30.718 0 64  THR BBB CG2 1 ? 8  
ATOM   2031 N N   . LYS B 2 67  ? 6.240   50.507  -20.735 1.000 32.921 0 65  LYS BBB N   1 ? 8  
ATOM   2032 C CA  . LYS B 2 67  ? 6.387   49.335  -19.821 1.000 34.399 0 65  LYS BBB CA  1 ? 8  
ATOM   2033 C C   . LYS B 2 67  ? 5.188   49.283  -18.869 1.000 31.709 0 65  LYS BBB C   1 ? 8  
ATOM   2034 O O   . LYS B 2 67  ? 4.829   50.343  -18.321 1.000 32.198 0 65  LYS BBB O   1 ? 8  
ATOM   2035 C CB  . LYS B 2 67  ? 7.655   49.430  -18.963 1.000 40.500 0 65  LYS BBB CB  1 ? 8  
ATOM   2036 C CG  . LYS B 2 67  ? 8.926   48.861  -19.563 1.000 44.083 0 65  LYS BBB CG  1 ? 8  
ATOM   2037 C CD  . LYS B 2 67  ? 10.158  49.169  -18.730 1.000 49.207 0 65  LYS BBB CD  1 ? 8  
ATOM   2038 C CE  . LYS B 2 67  ? 11.437  48.663  -19.368 1.000 53.460 0 65  LYS BBB CE  1 ? 8  
ATOM   2039 N NZ  . LYS B 2 67  ? 12.638  49.072  -18.599 1.000 53.794 0 65  LYS BBB NZ  1 ? 8  
ATOM   2040 N N   . GLY B 2 68  ? 4.626   48.087  -18.654 1.000 33.348 0 66  GLY BBB N   1 ? 8  
ATOM   2041 C CA  . GLY B 2 68  ? 3.549   47.831  -17.680 1.000 33.809 0 66  GLY BBB CA  1 ? 8  
ATOM   2042 C C   . GLY B 2 68  ? 2.168   48.110  -18.254 1.000 35.174 0 66  GLY BBB C   1 ? 8  
ATOM   2043 O O   . GLY B 2 68  ? 1.321   47.200  -18.202 1.000 38.263 0 66  GLY BBB O   1 ? 8  
ATOM   2044 N N   . ARG B 2 69  ? 1.952   49.310  -18.800 1.000 31.954 0 67  ARG BBB N   1 ? 8  
ATOM   2045 C CA  . ARG B 2 69  ? 0.646   49.786  -19.327 1.000 32.695 0 67  ARG BBB CA  1 ? 8  
ATOM   2046 C C   . ARG B 2 69  ? 0.326   49.077  -20.647 1.000 29.660 0 67  ARG BBB C   1 ? 8  
ATOM   2047 O O   . ARG B 2 69  ? -0.847  48.758  -20.888 1.000 30.222 0 67  ARG BBB O   1 ? 8  
ATOM   2048 C CB  . ARG B 2 69  ? 0.665   51.300  -19.565 1.000 32.883 0 67  ARG BBB CB  1 ? 8  
ATOM   2049 C CG  . ARG B 2 69  ? 0.777   52.130  -18.298 1.000 35.326 0 67  ARG BBB CG  1 ? 8  
ATOM   2050 C CD  . ARG B 2 69  ? 0.515   53.604  -18.558 1.000 35.779 0 67  ARG BBB CD  1 ? 8  
ATOM   2051 N NE  . ARG B 2 69  ? 1.362   54.171  -19.602 1.000 33.546 0 67  ARG BBB NE  1 ? 8  
ATOM   2052 C CZ  . ARG B 2 69  ? 0.941   54.831  -20.684 1.000 34.241 0 67  ARG BBB CZ  1 ? 8  
ATOM   2053 N NH1 . ARG B 2 69  ? -0.349  55.017  -20.918 1.000 33.479 0 67  ARG BBB NH1 1 ? 8  
ATOM   2054 N NH2 . ARG B 2 69  ? 1.828   55.318  -21.533 1.000 32.797 0 67  ARG BBB NH2 1 ? 8  
ATOM   2055 N N   . PHE B 2 70  ? 1.328   48.890  -21.505 1.000 30.187 0 68  PHE BBB N   1 ? 8  
ATOM   2056 C CA  . PHE B 2 70  ? 1.145   48.274  -22.841 1.000 28.356 0 68  PHE BBB CA  1 ? 8  
ATOM   2057 C C   . PHE B 2 70  ? 1.673   46.840  -22.809 1.000 28.383 0 68  PHE BBB C   1 ? 8  
ATOM   2058 O O   . PHE B 2 70  ? 2.684   46.571  -22.138 1.000 30.733 0 68  PHE BBB O   1 ? 8  
ATOM   2059 C CB  . PHE B 2 70  ? 1.848   49.099  -23.924 1.000 28.637 0 68  PHE BBB CB  1 ? 8  
ATOM   2060 C CG  . PHE B 2 70  ? 1.301   50.478  -24.193 1.000 28.909 0 68  PHE BBB CG  1 ? 8  
ATOM   2061 C CD1 . PHE B 2 70  ? 0.329   51.061  -23.393 1.000 30.096 0 68  PHE BBB CD1 1 ? 8  
ATOM   2062 C CD2 . PHE B 2 70  ? 1.803   51.216  -25.252 1.000 30.759 0 68  PHE BBB CD2 1 ? 8  
ATOM   2063 C CE1 . PHE B 2 70  ? -0.147  52.336  -23.668 1.000 30.609 0 68  PHE BBB CE1 1 ? 8  
ATOM   2064 C CE2 . PHE B 2 70  ? 1.336   52.496  -25.518 1.000 30.164 0 68  PHE BBB CE2 1 ? 8  
ATOM   2065 C CZ  . PHE B 2 70  ? 0.365   53.056  -24.730 1.000 30.238 0 68  PHE BBB CZ  1 ? 8  
ATOM   2066 N N   . THR B 2 71  ? 1.034   45.949  -23.571 1.000 27.822 0 69  THR BBB N   1 ? 8  
ATOM   2067 C CA  . THR B 2 71  ? 1.432   44.533  -23.726 1.000 27.131 0 69  THR BBB CA  1 ? 8  
ATOM   2068 C C   . THR B 2 71  ? 1.418   44.190  -25.214 1.000 25.861 0 69  THR BBB C   1 ? 8  
ATOM   2069 O O   . THR B 2 71  ? 0.362   44.348  -25.861 1.000 26.380 0 69  THR BBB O   1 ? 8  
ATOM   2070 C CB  . THR B 2 71  ? 0.515   43.608  -22.922 1.000 29.702 0 69  THR BBB CB  1 ? 8  
ATOM   2071 O OG1 . THR B 2 71  ? 0.564   44.039  -21.561 1.000 31.373 0 69  THR BBB OG1 1 ? 8  
ATOM   2072 C CG2 . THR B 2 71  ? 0.908   42.148  -23.025 1.000 29.814 0 69  THR BBB CG2 1 ? 8  
ATOM   2073 N N   . ILE B 2 72  ? 2.557   43.764  -25.748 1.000 25.022 0 70  ILE BBB N   1 ? 8  
ATOM   2074 C CA  . ILE B 2 72  ? 2.644   43.237  -27.138 1.000 23.956 0 70  ILE BBB CA  1 ? 8  
ATOM   2075 C C   . ILE B 2 72  ? 2.598   41.705  -27.078 1.000 26.860 0 70  ILE BBB C   1 ? 8  
ATOM   2076 O O   . ILE B 2 72  ? 3.115   41.125  -26.118 1.000 27.353 0 70  ILE BBB O   1 ? 8  
ATOM   2077 C CB  . ILE B 2 72  ? 3.900   43.755  -27.857 1.000 24.081 0 70  ILE BBB CB  1 ? 8  
ATOM   2078 C CG1 . ILE B 2 72  ? 3.791   43.521  -29.368 1.000 23.009 0 70  ILE BBB CG1 1 ? 8  
ATOM   2079 C CG2 . ILE B 2 72  ? 5.160   43.137  -27.271 1.000 25.267 0 70  ILE BBB CG2 1 ? 8  
ATOM   2080 C CD1 . ILE B 2 72  ? 4.926   44.116  -30.159 1.000 24.052 0 70  ILE BBB CD1 1 ? 8  
ATOM   2081 N N   . SER B 2 73  ? 1.985   41.085  -28.075 1.000 25.829 0 71  SER BBB N   1 ? 8  
ATOM   2082 C CA  A SER B 2 73  ? 1.879   39.610  -28.199 0.500 26.114 0 71  SER BBB CA  1 ? 8  
ATOM   2083 C CA  B SER B 2 73  ? 1.854   39.612  -28.199 0.500 28.192 0 71  SER BBB CA  1 ? 8  
ATOM   2084 C C   . SER B 2 73  ? 1.807   39.251  -29.683 1.000 27.997 0 71  SER BBB C   1 ? 8  
ATOM   2085 O O   . SER B 2 73  ? 1.441   40.145  -30.482 1.000 25.220 0 71  SER BBB O   1 ? 8  
ATOM   2086 C CB  A SER B 2 73  ? 0.700   39.063  -27.426 0.500 25.322 0 71  SER BBB CB  1 ? 8  
ATOM   2087 C CB  B SER B 2 73  ? 0.631   39.122  -27.476 0.500 29.417 0 71  SER BBB CB  1 ? 8  
ATOM   2088 O OG  A SER B 2 73  ? -0.524  39.649  -27.839 0.500 23.478 0 71  SER BBB OG  1 ? 8  
ATOM   2089 O OG  B SER B 2 73  ? 0.768   39.325  -26.081 0.500 34.128 0 71  SER BBB OG  1 ? 8  
ATOM   2090 N N   . SER B 2 74  ? 2.193   38.024  -30.020 1.000 29.332 0 72  SER BBB N   1 ? 8  
ATOM   2091 C CA  . SER B 2 74  ? 2.184   37.513  -31.411 1.000 27.994 0 72  SER BBB CA  1 ? 8  
ATOM   2092 C C   . SER B 2 74  ? 1.310   36.259  -31.455 1.000 28.512 0 72  SER BBB C   1 ? 8  
ATOM   2093 O O   . SER B 2 74  ? 1.285   35.514  -30.470 1.000 30.090 0 72  SER BBB O   1 ? 8  
ATOM   2094 C CB  . SER B 2 74  ? 3.566   37.209  -31.904 1.000 31.452 0 72  SER BBB CB  1 ? 8  
ATOM   2095 O OG  . SER B 2 74  ? 3.523   36.786  -33.255 1.000 35.633 0 72  SER BBB OG  1 ? 8  
ATOM   2096 N N   . ASN B 2 75  ? 0.590   36.078  -32.556 1.000 24.905 0 73  ASN BBB N   1 ? 8  
ATOM   2097 C CA  . ASN B 2 75  ? 0.020   34.780  -32.967 1.000 25.931 0 73  ASN BBB CA  1 ? 8  
ATOM   2098 C C   . ASN B 2 75  ? 0.700   34.438  -34.282 1.000 22.282 0 73  ASN BBB C   1 ? 8  
ATOM   2099 O O   . ASN B 2 75  ? 0.240   34.912  -35.333 1.000 22.615 0 73  ASN BBB O   1 ? 8  
ATOM   2100 C CB  . ASN B 2 75  ? -1.504  34.825  -33.096 1.000 27.540 0 73  ASN BBB CB  1 ? 8  
ATOM   2101 C CG  . ASN B 2 75  ? -2.102  33.464  -33.396 1.000 30.457 0 73  ASN BBB CG  1 ? 8  
ATOM   2102 O OD1 . ASN B 2 75  ? -1.608  32.721  -34.251 1.000 29.845 0 73  ASN BBB OD1 1 ? 8  
ATOM   2103 N ND2 . ASN B 2 75  ? -3.159  33.119  -32.681 1.000 33.377 0 73  ASN BBB ND2 1 ? 8  
ATOM   2104 N N   . ASN B 2 76  ? 1.812   33.717  -34.222 1.000 22.233 0 74  ASN BBB N   1 ? 8  
ATOM   2105 C CA  . ASN B 2 76  ? 2.609   33.420  -35.436 1.000 21.649 0 74  ASN BBB CA  1 ? 8  
ATOM   2106 C C   . ASN B 2 76  ? 1.715   32.735  -36.469 1.000 21.863 0 74  ASN BBB C   1 ? 8  
ATOM   2107 O O   . ASN B 2 76  ? 1.822   33.100  -37.649 1.000 22.227 0 74  ASN BBB O   1 ? 8  
ATOM   2108 C CB  . ASN B 2 76  ? 3.839   32.574  -35.126 1.000 23.330 0 74  ASN BBB CB  1 ? 8  
ATOM   2109 C CG  . ASN B 2 76  ? 4.964   33.370  -34.497 1.000 21.216 0 74  ASN BBB CG  1 ? 8  
ATOM   2110 O OD1 . ASN B 2 76  ? 4.849   34.575  -34.239 1.000 20.700 0 74  ASN BBB OD1 1 ? 8  
ATOM   2111 N ND2 . ASN B 2 76  ? 6.070   32.689  -34.249 1.000 21.093 0 74  ASN BBB ND2 1 ? 8  
ATOM   2112 N N   . ALA B 2 77  ? 0.894   31.758  -36.057 1.000 22.175 0 75  ALA BBB N   1 ? 8  
ATOM   2113 C CA  . ALA B 2 77  ? 0.034   30.970  -36.971 1.000 23.776 0 75  ALA BBB CA  1 ? 8  
ATOM   2114 C C   . ALA B 2 77  ? -0.877  31.897  -37.784 1.000 24.411 0 75  ALA BBB C   1 ? 8  
ATOM   2115 O O   . ALA B 2 77  ? -1.106  31.574  -38.977 1.000 26.584 0 75  ALA BBB O   1 ? 8  
ATOM   2116 C CB  . ALA B 2 77  ? -0.780  29.941  -36.214 1.000 25.087 0 75  ALA BBB CB  1 ? 8  
ATOM   2117 N N   . MET B 2 78  ? -1.356  32.986  -37.179 1.000 24.693 0 76  MET BBB N   1 ? 8  
ATOM   2118 C CA  A MET B 2 78  ? -2.331  33.917  -37.807 0.500 26.766 0 76  MET BBB CA  1 ? 8  
ATOM   2119 C CA  B MET B 2 78  ? -2.330  33.914  -37.812 0.500 25.831 0 76  MET BBB CA  1 ? 8  
ATOM   2120 C C   . MET B 2 78  ? -1.590  35.133  -38.374 1.000 24.745 0 76  MET BBB C   1 ? 8  
ATOM   2121 O O   . MET B 2 78  ? -2.254  36.032  -38.928 1.000 24.985 0 76  MET BBB O   1 ? 8  
ATOM   2122 C CB  A MET B 2 78  ? -3.378  34.351  -36.779 0.500 30.974 0 76  MET BBB CB  1 ? 8  
ATOM   2123 C CB  B MET B 2 78  ? -3.387  34.333  -36.789 0.500 28.409 0 76  MET BBB CB  1 ? 8  
ATOM   2124 C CG  A MET B 2 78  ? -4.192  33.192  -36.244 0.500 36.330 0 76  MET BBB CG  1 ? 8  
ATOM   2125 C CG  B MET B 2 78  ? -4.211  33.159  -36.287 0.500 31.913 0 76  MET BBB CG  1 ? 8  
ATOM   2126 S SD  A MET B 2 78  ? -5.351  32.582  -37.471 0.500 44.791 0 76  MET BBB SD  1 ? 8  
ATOM   2127 S SD  B MET B 2 78  ? -5.466  33.653  -35.083 0.500 35.600 0 76  MET BBB SD  1 ? 8  
ATOM   2128 C CE  A MET B 2 78  ? -6.488  33.967  -37.541 0.500 43.177 0 76  MET BBB CE  1 ? 8  
ATOM   2129 C CE  B MET B 2 78  ? -5.988  35.229  -35.759 0.500 35.495 0 76  MET BBB CE  1 ? 8  
ATOM   2130 N N   . ASN B 2 79  ? -0.257  35.154  -38.255 1.000 22.577 0 77  ASN BBB N   1 ? 8  
ATOM   2131 C CA  . ASN B 2 79  ? 0.573   36.234  -38.836 1.000 23.245 0 77  ASN BBB CA  1 ? 8  
ATOM   2132 C C   . ASN B 2 79  ? 0.163   37.601  -38.277 1.000 22.047 0 77  ASN BBB C   1 ? 8  
ATOM   2133 O O   . ASN B 2 79  ? 0.263   38.600  -39.013 1.000 21.667 0 77  ASN BBB O   1 ? 8  
ATOM   2134 C CB  . ASN B 2 79  ? 0.447   36.249  -40.355 1.000 23.277 0 77  ASN BBB CB  1 ? 8  
ATOM   2135 C CG  . ASN B 2 79  ? 1.759   35.958  -41.037 1.000 28.045 0 77  ASN BBB CG  1 ? 8  
ATOM   2136 O OD1 . ASN B 2 79  ? 2.465   35.004  -40.674 1.000 24.081 0 77  ASN BBB OD1 1 ? 8  
ATOM   2137 N ND2 . ASN B 2 79  ? 2.061   36.774  -42.036 1.000 30.795 0 77  ASN BBB ND2 1 ? 8  
ATOM   2138 N N   . THR B 2 80  ? -0.251  37.650  -37.006 1.000 22.609 0 78  THR BBB N   1 ? 8  
ATOM   2139 C CA  . THR B 2 80  ? -0.858  38.847  -36.396 1.000 22.409 0 78  THR BBB CA  1 ? 8  
ATOM   2140 C C   . THR B 2 80  ? -0.104  39.178  -35.117 1.000 24.140 0 78  THR BBB C   1 ? 8  
ATOM   2141 O O   . THR B 2 80  ? 0.184   38.242  -34.331 1.000 25.184 0 78  THR BBB O   1 ? 8  
ATOM   2142 C CB  . THR B 2 80  ? -2.353  38.655  -36.108 1.000 25.194 0 78  THR BBB CB  1 ? 8  
ATOM   2143 O OG1 . THR B 2 80  ? -3.016  38.216  -37.291 1.000 25.926 0 78  THR BBB OG1 1 ? 8  
ATOM   2144 C CG2 . THR B 2 80  ? -3.017  39.930  -35.624 1.000 26.221 0 78  THR BBB CG2 1 ? 8  
ATOM   2145 N N   . VAL B 2 81  ? 0.176   40.460  -34.916 1.000 23.034 0 79  VAL BBB N   1 ? 8  
ATOM   2146 C CA  . VAL B 2 81  ? 0.688   40.986  -33.621 1.000 25.104 0 79  VAL BBB CA  1 ? 8  
ATOM   2147 C C   . VAL B 2 81  ? -0.337  41.963  -33.058 1.000 25.566 0 79  VAL BBB C   1 ? 8  
ATOM   2148 O O   . VAL B 2 81  ? -1.115  42.564  -33.831 1.000 24.747 0 79  VAL BBB O   1 ? 8  
ATOM   2149 C CB  . VAL B 2 81  ? 2.092   41.587  -33.779 1.000 26.995 0 79  VAL BBB CB  1 ? 8  
ATOM   2150 C CG1 . VAL B 2 81  ? 3.066   40.499  -34.203 1.000 32.232 0 79  VAL BBB CG1 1 ? 8  
ATOM   2151 C CG2 . VAL B 2 81  ? 2.127   42.761  -34.744 1.000 28.721 0 79  VAL BBB CG2 1 ? 8  
ATOM   2152 N N   . TYR B 2 82  ? -0.377  42.064  -31.737 1.000 25.157 0 80  TYR BBB N   1 ? 8  
ATOM   2153 C CA  . TYR B 2 82  ? -1.394  42.854  -31.010 1.000 26.442 0 80  TYR BBB CA  1 ? 8  
ATOM   2154 C C   . TYR B 2 82  ? -0.677  43.792  -30.059 1.000 27.207 0 80  TYR BBB C   1 ? 8  
ATOM   2155 O O   . TYR B 2 82  ? 0.353   43.380  -29.483 1.000 27.806 0 80  TYR BBB O   1 ? 8  
ATOM   2156 C CB  . TYR B 2 82  ? -2.320  41.961  -30.190 1.000 28.581 0 80  TYR BBB CB  1 ? 8  
ATOM   2157 C CG  . TYR B 2 82  ? -2.950  40.852  -30.981 1.000 30.744 0 80  TYR BBB CG  1 ? 8  
ATOM   2158 C CD1 . TYR B 2 82  ? -2.317  39.626  -31.097 1.000 32.324 0 80  TYR BBB CD1 1 ? 8  
ATOM   2159 C CD2 . TYR B 2 82  ? -4.172  41.030  -31.613 1.000 31.068 0 80  TYR BBB CD2 1 ? 8  
ATOM   2160 C CE1 . TYR B 2 82  ? -2.876  38.600  -31.842 1.000 35.173 0 80  TYR BBB CE1 1 ? 8  
ATOM   2161 C CE2 . TYR B 2 82  ? -4.752  40.009  -32.343 1.000 31.972 0 80  TYR BBB CE2 1 ? 8  
ATOM   2162 C CZ  . TYR B 2 82  ? -4.104  38.790  -32.453 1.000 35.672 0 80  TYR BBB CZ  1 ? 8  
ATOM   2163 O OH  . TYR B 2 82  ? -4.653  37.773  -33.179 1.000 38.329 0 80  TYR BBB OH  1 ? 8  
ATOM   2164 N N   . LEU B 2 83  ? -1.194  45.011  -29.928 1.000 25.326 0 81  LEU BBB N   1 ? 8  
ATOM   2165 C CA  . LEU B 2 83  ? -0.742  45.941  -28.880 1.000 24.850 0 81  LEU BBB CA  1 ? 8  
ATOM   2166 C C   . LEU B 2 83  ? -1.941  46.280  -28.003 1.000 25.390 0 81  LEU BBB C   1 ? 8  
ATOM   2167 O O   . LEU B 2 83  ? -2.856  46.994  -28.487 1.000 24.725 0 81  LEU BBB O   1 ? 8  
ATOM   2168 C CB  . LEU B 2 83  ? -0.119  47.192  -29.486 1.000 25.156 0 81  LEU BBB CB  1 ? 8  
ATOM   2169 C CG  . LEU B 2 83  ? 0.557   48.089  -28.456 1.000 26.844 0 81  LEU BBB CG  1 ? 8  
ATOM   2170 C CD1 . LEU B 2 83  ? 1.723   47.367  -27.794 1.000 28.162 0 81  LEU BBB CD1 1 ? 8  
ATOM   2171 C CD2 . LEU B 2 83  ? 0.985   49.391  -29.098 1.000 26.650 0 81  LEU BBB CD2 1 ? 8  
ATOM   2172 N N   . GLN B 2 84  ? -1.945  45.726  -26.792 1.000 25.458 0 82  GLN BBB N   1 ? 8  
ATOM   2173 C CA  A GLN B 2 84  ? -2.957  46.042  -25.754 0.500 27.320 0 82  GLN BBB CA  1 ? 8  
ATOM   2174 C CA  B GLN B 2 84  ? -2.959  46.044  -25.757 0.500 27.418 0 82  GLN BBB CA  1 ? 8  
ATOM   2175 C C   . GLN B 2 84  ? -2.493  47.299  -25.003 1.000 28.240 0 82  GLN BBB C   1 ? 8  
ATOM   2176 O O   . GLN B 2 84  ? -1.445  47.239  -24.317 1.000 29.444 0 82  GLN BBB O   1 ? 8  
ATOM   2177 C CB  A GLN B 2 84  ? -3.158  44.846  -24.816 0.500 28.397 0 82  GLN BBB CB  1 ? 8  
ATOM   2178 C CB  B GLN B 2 84  ? -3.175  44.851  -24.819 0.500 28.597 0 82  GLN BBB CB  1 ? 8  
ATOM   2179 C CG  A GLN B 2 84  ? -4.212  45.080  -23.742 0.500 30.041 0 82  GLN BBB CG  1 ? 8  
ATOM   2180 C CG  B GLN B 2 84  ? -4.235  45.096  -23.751 0.500 30.430 0 82  GLN BBB CG  1 ? 8  
ATOM   2181 C CD  A GLN B 2 84  ? -5.544  45.439  -24.353 0.500 31.203 0 82  GLN BBB CD  1 ? 8  
ATOM   2182 C CD  B GLN B 2 84  ? -4.155  44.103  -22.619 0.500 32.044 0 82  GLN BBB CD  1 ? 8  
ATOM   2183 O OE1 A GLN B 2 84  ? -5.895  44.967  -25.432 0.500 31.129 0 82  GLN BBB OE1 1 ? 8  
ATOM   2184 O OE1 B GLN B 2 84  ? -3.569  44.373  -21.573 0.500 33.820 0 82  GLN BBB OE1 1 ? 8  
ATOM   2185 N NE2 A GLN B 2 84  ? -6.299  46.272  -23.657 0.500 31.383 0 82  GLN BBB NE2 1 ? 8  
ATOM   2186 N NE2 B GLN B 2 84  ? -4.715  42.923  -22.836 0.500 34.010 0 82  GLN BBB NE2 1 ? 8  
ATOM   2187 N N   . MET B 2 85  ? -3.246  48.387  -25.122 1.000 28.132 0 83  MET BBB N   1 ? 8  
ATOM   2188 C CA  A MET B 2 85  ? -2.891  49.694  -24.506 0.500 27.337 0 83  MET BBB CA  1 ? 8  
ATOM   2189 C CA  B MET B 2 85  ? -2.891  49.695  -24.506 0.500 28.390 0 83  MET BBB CA  1 ? 8  
ATOM   2190 C C   . MET B 2 85  ? -3.881  50.006  -23.382 1.000 30.055 0 83  MET BBB C   1 ? 8  
ATOM   2191 O O   . MET B 2 85  ? -5.038  50.343  -23.694 1.000 33.123 0 83  MET BBB O   1 ? 8  
ATOM   2192 C CB  A MET B 2 85  ? -2.908  50.807  -25.555 0.500 27.126 0 83  MET BBB CB  1 ? 8  
ATOM   2193 C CB  B MET B 2 85  ? -2.913  50.809  -25.554 0.500 29.775 0 83  MET BBB CB  1 ? 8  
ATOM   2194 C CG  A MET B 2 85  ? -1.922  50.554  -26.687 0.500 26.427 0 83  MET BBB CG  1 ? 8  
ATOM   2195 C CG  B MET B 2 85  ? -1.941  50.567  -26.701 0.500 30.472 0 83  MET BBB CG  1 ? 8  
ATOM   2196 S SD  A MET B 2 85  ? -1.553  52.056  -27.640 0.500 25.236 0 83  MET BBB SD  1 ? 8  
ATOM   2197 S SD  B MET B 2 85  ? -2.424  51.481  -28.201 0.500 31.608 0 83  MET BBB SD  1 ? 8  
ATOM   2198 C CE  A MET B 2 85  ? -3.145  52.325  -28.421 0.500 25.179 0 83  MET BBB CE  1 ? 8  
ATOM   2199 C CE  B MET B 2 85  ? -2.181  53.169  -27.653 0.500 32.310 0 83  MET BBB CE  1 ? 8  
ATOM   2200 N N   . ASN B 2 86  ? -3.416  49.892  -22.135 1.000 30.367 0 84  ASN BBB N   1 ? 8  
ATOM   2201 C CA  . ASN B 2 86  ? -4.238  50.133  -20.919 1.000 31.948 0 84  ASN BBB CA  1 ? 8  
ATOM   2202 C C   . ASN B 2 86  ? -3.826  51.469  -20.286 1.000 31.470 0 84  ASN BBB C   1 ? 8  
ATOM   2203 O O   . ASN B 2 86  ? -2.700  51.939  -20.548 1.000 30.130 0 84  ASN BBB O   1 ? 8  
ATOM   2204 C CB  . ASN B 2 86  ? -4.112  48.974  -19.920 1.000 36.237 0 84  ASN BBB CB  1 ? 8  
ATOM   2205 C CG  . ASN B 2 86  ? -4.669  47.661  -20.448 1.000 38.320 0 84  ASN BBB CG  1 ? 8  
ATOM   2206 O OD1 . ASN B 2 86  ? -5.577  47.644  -21.275 1.000 36.946 0 84  ASN BBB OD1 1 ? 8  
ATOM   2207 N ND2 . ASN B 2 86  ? -4.146  46.546  -19.964 1.000 43.486 0 84  ASN BBB ND2 1 ? 8  
ATOM   2208 N N   . SER B 2 87  ? -4.691  52.051  -19.451 1.000 32.251 0 85  SER BBB N   1 ? 8  
ATOM   2209 C CA  . SER B 2 87  ? -4.373  53.255  -18.644 1.000 33.873 0 85  SER BBB CA  1 ? 8  
ATOM   2210 C C   . SER B 2 87  ? -3.858  54.384  -19.550 1.000 34.175 0 85  SER BBB C   1 ? 8  
ATOM   2211 O O   . SER B 2 87  ? -2.818  55.013  -19.229 1.000 31.954 0 85  SER BBB O   1 ? 8  
ATOM   2212 C CB  . SER B 2 87  ? -3.372  52.890  -17.582 1.000 36.317 0 85  SER BBB CB  1 ? 8  
ATOM   2213 O OG  . SER B 2 87  ? -3.885  51.851  -16.760 1.000 36.113 0 85  SER BBB OG  1 ? 8  
ATOM   2214 N N   . LEU B 2 88  ? -4.542  54.600  -20.672 1.000 31.522 0 86  LEU BBB N   1 ? 8  
ATOM   2215 C CA  . LEU B 2 88  ? -4.136  55.585  -21.702 1.000 31.008 0 86  LEU BBB CA  1 ? 8  
ATOM   2216 C C   . LEU B 2 88  ? -4.230  57.005  -21.135 1.000 30.181 0 86  LEU BBB C   1 ? 8  
ATOM   2217 O O   . LEU B 2 88  ? -5.125  57.278  -20.291 1.000 29.403 0 86  LEU BBB O   1 ? 8  
ATOM   2218 C CB  . LEU B 2 88  ? -5.010  55.409  -22.945 1.000 29.928 0 86  LEU BBB CB  1 ? 8  
ATOM   2219 C CG  . LEU B 2 88  ? -4.604  54.250  -23.851 1.000 29.244 0 86  LEU BBB CG  1 ? 8  
ATOM   2220 C CD1 . LEU B 2 88  ? -5.692  53.938  -24.854 1.000 29.230 0 86  LEU BBB CD1 1 ? 8  
ATOM   2221 C CD2 . LEU B 2 88  ? -3.293  54.561  -24.554 1.000 29.433 0 86  LEU BBB CD2 1 ? 8  
ATOM   2222 N N   . LYS B 2 89  ? -3.310  57.858  -21.578 1.000 29.233 0 87  LYS BBB N   1 ? 8  
ATOM   2223 C CA  . LYS B 2 89  ? -3.175  59.274  -21.158 1.000 31.752 0 87  LYS BBB CA  1 ? 8  
ATOM   2224 C C   . LYS B 2 89  ? -3.294  60.144  -22.407 1.000 29.293 0 87  LYS BBB C   1 ? 8  
ATOM   2225 O O   . LYS B 2 89  ? -3.049  59.675  -23.522 1.000 28.304 0 87  LYS BBB O   1 ? 8  
ATOM   2226 C CB  . LYS B 2 89  ? -1.839  59.455  -20.431 1.000 35.646 0 87  LYS BBB CB  1 ? 8  
ATOM   2227 C CG  . LYS B 2 89  ? -1.536  58.400  -19.367 1.000 41.407 0 87  LYS BBB CG  1 ? 8  
ATOM   2228 C CD  . LYS B 2 89  ? -0.072  58.349  -18.946 1.000 45.188 0 87  LYS BBB CD  1 ? 8  
ATOM   2229 C CE  . LYS B 2 89  ? 0.232   59.170  -17.711 1.000 52.099 0 87  LYS BBB CE  1 ? 8  
ATOM   2230 N NZ  . LYS B 2 89  ? -0.385  58.590  -16.496 1.000 54.601 0 87  LYS BBB NZ  1 ? 8  
ATOM   2231 N N   . PRO B 2 90  ? -3.706  61.421  -22.281 1.000 28.812 0 88  PRO BBB N   1 ? 8  
ATOM   2232 C CA  . PRO B 2 90  ? -3.776  62.327  -23.428 1.000 28.407 0 88  PRO BBB CA  1 ? 8  
ATOM   2233 C C   . PRO B 2 90  ? -2.459  62.341  -24.216 1.000 28.657 0 88  PRO BBB C   1 ? 8  
ATOM   2234 O O   . PRO B 2 90  ? -2.503  62.376  -25.437 1.000 28.203 0 88  PRO BBB O   1 ? 8  
ATOM   2235 C CB  . PRO B 2 90  ? -4.085  63.687  -22.764 1.000 29.751 0 88  PRO BBB CB  1 ? 8  
ATOM   2236 C CG  . PRO B 2 90  ? -4.846  63.310  -21.527 1.000 30.237 0 88  PRO BBB CG  1 ? 8  
ATOM   2237 C CD  . PRO B 2 90  ? -4.140  62.071  -21.027 1.000 30.459 0 88  PRO BBB CD  1 ? 8  
ATOM   2238 N N   . GLU B 2 91  ? -1.325  62.275  -23.510 1.000 30.419 0 89  GLU BBB N   1 ? 8  
ATOM   2239 C CA  . GLU B 2 91  ? 0.035   62.311  -24.117 1.000 31.431 0 89  GLU BBB CA  1 ? 8  
ATOM   2240 C C   . GLU B 2 91  ? 0.318   61.036  -24.928 1.000 29.315 0 89  GLU BBB C   1 ? 8  
ATOM   2241 O O   . GLU B 2 91  ? 1.321   61.054  -25.679 1.000 29.223 0 89  GLU BBB O   1 ? 8  
ATOM   2242 C CB  . GLU B 2 91  ? 1.128   62.528  -23.069 1.000 34.730 0 89  GLU BBB CB  1 ? 8  
ATOM   2243 C CG  . GLU B 2 91  ? 1.086   61.579  -21.893 1.000 38.331 0 89  GLU BBB CG  1 ? 8  
ATOM   2244 C CD  . GLU B 2 91  ? 0.394   62.154  -20.666 1.000 42.444 0 89  GLU BBB CD  1 ? 8  
ATOM   2245 O OE1 . GLU B 2 91  ? -0.711  62.744  -20.811 1.000 37.692 0 89  GLU BBB OE1 1 ? 8  
ATOM   2246 O OE2 . GLU B 2 91  ? 0.963   62.010  -19.559 1.000 50.807 0 89  GLU BBB OE2 1 ? 8  
ATOM   2247 N N   . ASP B 2 92  ? -0.524  59.997  -24.835 1.000 27.523 0 90  ASP BBB N   1 ? 8  
ATOM   2248 C CA  . ASP B 2 92  ? -0.437  58.784  -25.702 1.000 26.602 0 90  ASP BBB CA  1 ? 8  
ATOM   2249 C C   . ASP B 2 92  ? -1.082  59.059  -27.063 1.000 25.302 0 90  ASP BBB C   1 ? 8  
ATOM   2250 O O   . ASP B 2 92  ? -1.001  58.180  -27.934 1.000 25.558 0 90  ASP BBB O   1 ? 8  
ATOM   2251 C CB  . ASP B 2 92  ? -1.082  57.564  -25.044 1.000 26.381 0 90  ASP BBB CB  1 ? 8  
ATOM   2252 C CG  . ASP B 2 92  ? -0.340  57.076  -23.812 1.000 28.667 0 90  ASP BBB CG  1 ? 8  
ATOM   2253 O OD1 . ASP B 2 92  ? 0.913   57.019  -23.854 1.000 29.199 0 90  ASP BBB OD1 1 ? 8  
ATOM   2254 O OD2 . ASP B 2 92  ? -1.015  56.750  -22.808 1.000 30.170 0 90  ASP BBB OD2 1 ? 8  
ATOM   2255 N N   . THR B 2 93  ? -1.723  60.218  -27.245 1.000 25.716 0 91  THR BBB N   1 ? 8  
ATOM   2256 C CA  . THR B 2 93  ? -2.310  60.622  -28.552 1.000 24.435 0 91  THR BBB CA  1 ? 8  
ATOM   2257 C C   . THR B 2 93  ? -1.187  60.682  -29.585 1.000 24.819 0 91  THR BBB C   1 ? 8  
ATOM   2258 O O   . THR B 2 93  ? -0.200  61.400  -29.352 1.000 24.690 0 91  THR BBB O   1 ? 8  
ATOM   2259 C CB  . THR B 2 93  ? -3.047  61.964  -28.471 1.000 25.528 0 91  THR BBB CB  1 ? 8  
ATOM   2260 O OG1 . THR B 2 93  ? -4.138  61.799  -27.558 1.000 24.412 0 91  THR BBB OG1 1 ? 8  
ATOM   2261 C CG2 . THR B 2 93  ? -3.541  62.433  -29.822 1.000 26.187 0 91  THR BBB CG2 1 ? 8  
ATOM   2262 N N   . ALA B 2 94  ? -1.329  59.940  -30.681 1.000 24.606 0 92  ALA BBB N   1 ? 8  
ATOM   2263 C CA  . ALA B 2 94  ? -0.259  59.750  -31.681 1.000 24.080 0 92  ALA BBB CA  1 ? 8  
ATOM   2264 C C   . ALA B 2 94  ? -0.788  58.929  -32.852 1.000 22.800 0 92  ALA BBB C   1 ? 8  
ATOM   2265 O O   . ALA B 2 94  ? -1.827  58.271  -32.714 1.000 21.623 0 92  ALA BBB O   1 ? 8  
ATOM   2266 C CB  . ALA B 2 94  ? 0.951   59.104  -31.041 1.000 23.707 0 92  ALA BBB CB  1 ? 8  
ATOM   2267 N N   . VAL B 2 95  ? -0.065  58.948  -33.960 1.000 22.076 0 93  VAL BBB N   1 ? 8  
ATOM   2268 C CA  . VAL B 2 95  ? -0.211  57.931  -35.032 1.000 22.647 0 93  VAL BBB CA  1 ? 8  
ATOM   2269 C C   . VAL B 2 95  ? 0.672   56.757  -34.610 1.000 22.627 0 93  VAL BBB C   1 ? 8  
ATOM   2270 O O   . VAL B 2 95  ? 1.852   56.984  -34.329 1.000 22.247 0 93  VAL BBB O   1 ? 8  
ATOM   2271 C CB  . VAL B 2 95  ? 0.158   58.460  -36.424 1.000 23.482 0 93  VAL BBB CB  1 ? 8  
ATOM   2272 C CG1 . VAL B 2 95  ? 0.023   57.374  -37.482 1.000 25.228 0 93  VAL BBB CG1 1 ? 8  
ATOM   2273 C CG2 . VAL B 2 95  ? -0.696  59.658  -36.799 1.000 25.333 0 93  VAL BBB CG2 1 ? 8  
ATOM   2274 N N   . TYR B 2 96  ? 0.091   55.570  -34.548 1.000 21.268 0 94  TYR BBB N   1 ? 8  
ATOM   2275 C CA  . TYR B 2 96  ? 0.777   54.304  -34.186 1.000 21.795 0 94  TYR BBB CA  1 ? 8  
ATOM   2276 C C   . TYR B 2 96  ? 1.036   53.549  -35.481 1.000 21.559 0 94  TYR BBB C   1 ? 8  
ATOM   2277 O O   . TYR B 2 96  ? 0.095   53.440  -36.286 1.000 22.961 0 94  TYR BBB O   1 ? 8  
ATOM   2278 C CB  . TYR B 2 96  ? -0.050  53.534  -33.158 1.000 21.024 0 94  TYR BBB CB  1 ? 8  
ATOM   2279 C CG  . TYR B 2 96  ? 0.018   54.126  -31.778 1.000 20.690 0 94  TYR BBB CG  1 ? 8  
ATOM   2280 C CD1 . TYR B 2 96  ? -0.643  55.304  -31.477 1.000 22.646 0 94  TYR BBB CD1 1 ? 8  
ATOM   2281 C CD2 . TYR B 2 96  ? 0.747   53.524  -30.766 1.000 21.189 0 94  TYR BBB CD2 1 ? 8  
ATOM   2282 C CE1 . TYR B 2 96  ? -0.584  55.861  -30.209 1.000 21.425 0 94  TYR BBB CE1 1 ? 8  
ATOM   2283 C CE2 . TYR B 2 96  ? 0.831   54.077  -29.500 1.000 21.776 0 94  TYR BBB CE2 1 ? 8  
ATOM   2284 C CZ  . TYR B 2 96  ? 0.173   55.265  -29.218 1.000 22.252 0 94  TYR BBB CZ  1 ? 8  
ATOM   2285 O OH  . TYR B 2 96  ? 0.244   55.838  -27.972 1.000 21.955 0 94  TYR BBB OH  1 ? 8  
ATOM   2286 N N   . PHE B 2 97  ? 2.297   53.155  -35.709 1.000 21.223 0 95  PHE BBB N   1 ? 8  
ATOM   2287 C CA  . PHE B 2 97  ? 2.747   52.447  -36.925 1.000 22.352 0 95  PHE BBB CA  1 ? 8  
ATOM   2288 C C   . PHE B 2 97  ? 3.220   51.045  -36.544 1.000 21.555 0 95  PHE BBB C   1 ? 8  
ATOM   2289 O O   . PHE B 2 97  ? 4.077   50.922  -35.656 1.000 22.823 0 95  PHE BBB O   1 ? 8  
ATOM   2290 C CB  . PHE B 2 97  ? 3.920   53.169  -37.586 1.000 23.205 0 95  PHE BBB CB  1 ? 8  
ATOM   2291 C CG  . PHE B 2 97  ? 3.665   54.605  -37.961 1.000 23.557 0 95  PHE BBB CG  1 ? 8  
ATOM   2292 C CD1 . PHE B 2 97  ? 3.884   55.622  -37.048 1.000 26.405 0 95  PHE BBB CD1 1 ? 8  
ATOM   2293 C CD2 . PHE B 2 97  ? 3.229   54.940  -39.234 1.000 24.516 0 95  PHE BBB CD2 1 ? 8  
ATOM   2294 C CE1 . PHE B 2 97  ? 3.669   56.946  -37.403 1.000 26.707 0 95  PHE BBB CE1 1 ? 8  
ATOM   2295 C CE2 . PHE B 2 97  ? 3.005   56.267  -39.584 1.000 26.677 0 95  PHE BBB CE2 1 ? 8  
ATOM   2296 C CZ  . PHE B 2 97  ? 3.229   57.265  -38.668 1.000 28.371 0 95  PHE BBB CZ  1 ? 8  
ATOM   2297 N N   . CYS B 2 98  ? 2.685   50.037  -37.219 1.000 22.702 0 96  CYS BBB N   1 ? 8  
ATOM   2298 C CA  . CYS B 2 98  ? 3.250   48.675  -37.233 1.000 23.123 0 96  CYS BBB CA  1 ? 8  
ATOM   2299 C C   . CYS B 2 98  ? 4.533   48.747  -38.048 1.000 22.160 0 96  CYS BBB C   1 ? 8  
ATOM   2300 O O   . CYS B 2 98  ? 4.543   49.474  -39.055 1.000 22.842 0 96  CYS BBB O   1 ? 8  
ATOM   2301 C CB  . CYS B 2 98  ? 2.282   47.682  -37.840 1.000 23.009 0 96  CYS BBB CB  1 ? 8  
ATOM   2302 S SG  . CYS B 2 98  ? 2.872   45.972  -37.742 1.000 27.023 0 96  CYS BBB SG  1 ? 8  
ATOM   2303 N N   . ALA B 2 99  ? 5.581   48.069  -37.600 1.000 22.036 0 97  ALA BBB N   1 ? 8  
ATOM   2304 C CA  . ALA B 2 99  ? 6.902   48.087  -38.255 1.000 21.030 0 97  ALA BBB CA  1 ? 8  
ATOM   2305 C C   . ALA B 2 99  ? 7.545   46.706  -38.140 1.000 20.491 0 97  ALA BBB C   1 ? 8  
ATOM   2306 O O   . ALA B 2 99  ? 7.555   46.124  -37.067 1.000 20.602 0 97  ALA BBB O   1 ? 8  
ATOM   2307 C CB  . ALA B 2 99  ? 7.778   49.156  -37.674 1.000 23.397 0 97  ALA BBB CB  1 ? 8  
ATOM   2308 N N   . LEU B 2 100 ? 8.056   46.221  -39.264 1.000 21.099 0 98  LEU BBB N   1 ? 8  
ATOM   2309 C CA  . LEU B 2 100 ? 8.604   44.847  -39.393 1.000 20.927 0 98  LEU BBB CA  1 ? 8  
ATOM   2310 C C   . LEU B 2 100 ? 10.074  44.967  -39.787 1.000 21.357 0 98  LEU BBB C   1 ? 8  
ATOM   2311 O O   . LEU B 2 100 ? 10.381  45.700  -40.749 1.000 21.082 0 98  LEU BBB O   1 ? 8  
ATOM   2312 C CB  . LEU B 2 100 ? 7.797   44.092  -40.449 1.000 21.099 0 98  LEU BBB CB  1 ? 8  
ATOM   2313 C CG  . LEU B 2 100 ? 8.329   42.719  -40.835 1.000 20.149 0 98  LEU BBB CG  1 ? 8  
ATOM   2314 C CD1 . LEU B 2 100 ? 8.271   41.757  -39.670 1.000 21.173 0 98  LEU BBB CD1 1 ? 8  
ATOM   2315 C CD2 . LEU B 2 100 ? 7.539   42.175  -42.021 1.000 21.917 0 98  LEU BBB CD2 1 ? 8  
ATOM   2316 N N   . GLY B 2 101 ? 10.945  44.263  -39.074 1.000 20.696 0 99  GLY BBB N   1 ? 8  
ATOM   2317 C CA  . GLY B 2 101 ? 12.374  44.204  -39.415 1.000 20.719 0 99  GLY BBB CA  1 ? 8  
ATOM   2318 C C   . GLY B 2 101 ? 12.632  43.125  -40.453 1.000 21.898 0 99  GLY BBB C   1 ? 8  
ATOM   2319 O O   . GLY B 2 101 ? 11.711  42.334  -40.755 1.000 22.949 0 99  GLY BBB O   1 ? 8  
ATOM   2320 N N   . VAL B 2 102 ? 13.856  43.102  -40.968 1.000 21.544 0 100 VAL BBB N   1 ? 8  
ATOM   2321 C CA  . VAL B 2 102 ? 14.370  42.040  -41.873 1.000 23.042 0 100 VAL BBB CA  1 ? 8  
ATOM   2322 C C   . VAL B 2 102 ? 15.366  41.162  -41.111 1.000 21.822 0 100 VAL BBB C   1 ? 8  
ATOM   2323 O O   . VAL B 2 102 ? 16.001  40.321  -41.755 1.000 21.600 0 100 VAL BBB O   1 ? 8  
ATOM   2324 C CB  . VAL B 2 102 ? 14.962  42.636  -43.163 1.000 24.780 0 100 VAL BBB CB  1 ? 8  
ATOM   2325 C CG1 . VAL B 2 102 ? 13.860  43.229  -44.029 1.000 25.950 0 100 VAL BBB CG1 1 ? 8  
ATOM   2326 C CG2 . VAL B 2 102 ? 16.066  43.657  -42.906 1.000 26.082 0 100 VAL BBB CG2 1 ? 8  
ATOM   2327 N N   . THR B 2 103 ? 15.467  41.315  -39.785 1.000 21.986 0 101 THR BBB N   1 ? 8  
ATOM   2328 C CA  . THR B 2 103 ? 16.278  40.410  -38.919 1.000 22.290 0 101 THR BBB CA  1 ? 8  
ATOM   2329 C C   . THR B 2 103 ? 15.430  39.923  -37.744 1.000 21.625 0 101 THR BBB C   1 ? 8  
ATOM   2330 O O   . THR B 2 103 ? 14.249  40.336  -37.619 1.000 21.874 0 101 THR BBB O   1 ? 8  
ATOM   2331 C CB  . THR B 2 103 ? 17.560  41.090  -38.417 1.000 24.339 0 101 THR BBB CB  1 ? 8  
ATOM   2332 O OG1 . THR B 2 103 ? 17.209  41.976  -37.351 1.000 23.664 0 101 THR BBB OG1 1 ? 8  
ATOM   2333 C CG2 . THR B 2 103 ? 18.283  41.858  -39.497 1.000 25.500 0 101 THR BBB CG2 1 ? 8  
ATOM   2334 N N   . ALA B 2 104 ? 15.999  39.051  -36.923 1.000 21.289 0 102 ALA BBB N   1 ? 8  
ATOM   2335 C CA  . ALA B 2 104 ? 15.322  38.520  -35.722 1.000 21.539 0 102 ALA BBB CA  1 ? 8  
ATOM   2336 C C   . ALA B 2 104 ? 15.394  39.528  -34.567 1.000 21.971 0 102 ALA BBB C   1 ? 8  
ATOM   2337 O O   . ALA B 2 104 ? 14.674  39.322  -33.580 1.000 22.801 0 102 ALA BBB O   1 ? 8  
ATOM   2338 C CB  . ALA B 2 104 ? 15.913  37.186  -35.345 1.000 22.508 0 102 ALA BBB CB  1 ? 8  
ATOM   2339 N N   . ALA B 2 105 ? 16.239  40.562  -34.640 1.000 23.446 0 103 ALA BBB N   1 ? 8  
ATOM   2340 C CA  . ALA B 2 105 ? 16.567  41.413  -33.465 1.000 25.724 0 103 ALA BBB CA  1 ? 8  
ATOM   2341 C C   . ALA B 2 105 ? 15.642  42.633  -33.409 1.000 24.933 0 103 ALA BBB C   1 ? 8  
ATOM   2342 O O   . ALA B 2 105 ? 15.542  43.367  -34.396 1.000 24.934 0 103 ALA BBB O   1 ? 8  
ATOM   2343 C CB  . ALA B 2 105 ? 18.024  41.827  -33.469 1.000 27.292 0 103 ALA BBB CB  1 ? 8  
ATOM   2344 N N   . CYS B 2 106 ? 14.983  42.823  -32.269 1.000 26.008 0 104 CYS BBB N   1 ? 8  
ATOM   2345 C CA  . CYS B 2 106 ? 14.135  44.003  -31.985 1.000 26.996 0 104 CYS BBB CA  1 ? 8  
ATOM   2346 C C   . CYS B 2 106 ? 15.004  45.252  -31.867 1.000 27.360 0 104 CYS BBB C   1 ? 8  
ATOM   2347 O O   . CYS B 2 106 ? 14.473  46.345  -32.090 1.000 31.628 0 104 CYS BBB O   1 ? 8  
ATOM   2348 C CB  . CYS B 2 106 ? 13.308  43.794  -30.723 1.000 28.399 0 104 CYS BBB CB  1 ? 8  
ATOM   2349 S SG  . CYS B 2 106 ? 11.753  42.950  -31.084 1.000 28.895 0 104 CYS BBB SG  1 ? 8  
ATOM   2350 N N   . SER B 2 107 ? 16.289  45.103  -31.546 1.000 26.447 0 105 SER BBB N   1 ? 8  
ATOM   2351 C CA  . SER B 2 107 ? 17.236  46.239  -31.432 1.000 27.871 0 105 SER BBB CA  1 ? 8  
ATOM   2352 C C   . SER B 2 107 ? 17.601  46.790  -32.823 1.000 27.421 0 105 SER BBB C   1 ? 8  
ATOM   2353 O O   . SER B 2 107 ? 18.102  47.923  -32.900 1.000 28.251 0 105 SER BBB O   1 ? 8  
ATOM   2354 C CB  . SER B 2 107 ? 18.450  45.832  -30.646 1.000 29.186 0 105 SER BBB CB  1 ? 8  
ATOM   2355 O OG  . SER B 2 107 ? 19.061  44.690  -31.215 1.000 29.957 0 105 SER BBB OG  1 ? 8  
ATOM   2356 N N   . ASP B 2 108 ? 17.344  46.041  -33.898 1.000 28.492 0 106 ASP BBB N   1 ? 8  
ATOM   2357 C CA  . ASP B 2 108 ? 17.628  46.513  -35.283 1.000 30.634 0 106 ASP BBB CA  1 ? 8  
ATOM   2358 C C   . ASP B 2 108 ? 16.529  47.473  -35.758 1.000 31.297 0 106 ASP BBB C   1 ? 8  
ATOM   2359 O O   . ASP B 2 108 ? 15.418  47.458  -35.209 1.000 28.245 0 106 ASP BBB O   1 ? 8  
ATOM   2360 C CB  . ASP B 2 108 ? 17.804  45.338  -36.241 1.000 31.347 0 106 ASP BBB CB  1 ? 8  
ATOM   2361 C CG  . ASP B 2 108 ? 19.115  44.598  -36.047 1.000 33.602 0 106 ASP BBB CG  1 ? 8  
ATOM   2362 O OD1 . ASP B 2 108 ? 20.027  45.157  -35.373 1.000 33.343 0 106 ASP BBB OD1 1 ? 8  
ATOM   2363 O OD2 . ASP B 2 108 ? 19.214  43.476  -36.556 1.000 34.755 0 106 ASP BBB OD2 1 ? 8  
ATOM   2364 N N   . ASN B 2 109 ? 16.843  48.269  -36.779 1.000 36.200 0 107 ASN BBB N   1 ? 9  
ATOM   2365 C CA  . ASN B 2 109 ? 15.936  49.290  -37.355 1.000 36.193 0 107 ASN BBB CA  1 ? 9  
ATOM   2366 C C   . ASN B 2 109 ? 14.834  48.583  -38.135 1.000 30.784 0 107 ASN BBB C   1 ? 9  
ATOM   2367 O O   . ASN B 2 109 ? 15.092  47.597  -38.819 1.000 28.988 0 107 ASN BBB O   1 ? 9  
ATOM   2368 C CB  . ASN B 2 109 ? 16.709  50.252  -38.260 1.000 40.277 0 107 ASN BBB CB  1 ? 9  
ATOM   2369 C CG  . ASN B 2 109 ? 17.953  50.805  -37.593 1.000 46.868 0 107 ASN BBB CG  1 ? 9  
ATOM   2370 O OD1 . ASN B 2 109 ? 17.897  51.264  -36.453 1.000 53.126 0 107 ASN BBB OD1 1 ? 9  
ATOM   2371 N ND2 . ASN B 2 109 ? 19.077  50.740  -38.285 1.000 51.322 0 107 ASN BBB ND2 1 ? 9  
ATOM   2372 N N   . PRO B 2 110 ? 13.572  49.051  -38.086 1.000 30.722 0 108 PRO BBB N   1 ? 9  
ATOM   2373 C CA  . PRO B 2 110 ? 12.530  48.466  -38.925 1.000 29.047 0 108 PRO BBB CA  1 ? 9  
ATOM   2374 C C   . PRO B 2 110 ? 12.794  48.763  -40.405 1.000 27.944 0 108 PRO BBB C   1 ? 9  
ATOM   2375 O O   . PRO B 2 110 ? 13.471  49.740  -40.728 1.000 29.886 0 108 PRO BBB O   1 ? 9  
ATOM   2376 C CB  . PRO B 2 110 ? 11.205  49.068  -38.458 1.000 32.394 0 108 PRO BBB CB  1 ? 9  
ATOM   2377 C CG  . PRO B 2 110 ? 11.615  50.305  -37.675 1.000 34.607 0 108 PRO BBB CG  1 ? 9  
ATOM   2378 C CD  . PRO B 2 110 ? 13.060  50.126  -37.229 1.000 35.151 0 108 PRO BBB CD  1 ? 9  
ATOM   2379 N N   . TYR B 2 111 ? 12.282  47.887  -41.252 1.000 24.823 0 109 TYR BBB N   1 ? 9  
ATOM   2380 C CA  . TYR B 2 111 ? 12.440  47.957  -42.720 1.000 24.606 0 109 TYR BBB CA  1 ? 9  
ATOM   2381 C C   . TYR B 2 111 ? 11.099  48.299  -43.361 1.000 23.611 0 109 TYR BBB C   1 ? 9  
ATOM   2382 O O   . TYR B 2 111 ? 11.078  49.167  -44.259 1.000 27.656 0 109 TYR BBB O   1 ? 9  
ATOM   2383 C CB  . TYR B 2 111 ? 12.971  46.634  -43.264 1.000 25.302 0 109 TYR BBB CB  1 ? 9  
ATOM   2384 C CG  . TYR B 2 111 ? 13.435  46.734  -44.687 1.000 26.418 0 109 TYR BBB CG  1 ? 9  
ATOM   2385 C CD1 . TYR B 2 111 ? 12.544  46.607  -45.738 1.000 26.760 0 109 TYR BBB CD1 1 ? 9  
ATOM   2386 C CD2 . TYR B 2 111 ? 14.771  46.965  -44.981 1.000 28.420 0 109 TYR BBB CD2 1 ? 9  
ATOM   2387 C CE1 . TYR B 2 111 ? 12.970  46.719  -47.048 1.000 28.566 0 109 TYR BBB CE1 1 ? 9  
ATOM   2388 C CE2 . TYR B 2 111 ? 15.211  47.073  -46.287 1.000 29.406 0 109 TYR BBB CE2 1 ? 9  
ATOM   2389 C CZ  . TYR B 2 111 ? 14.307  46.940  -47.321 1.000 30.543 0 109 TYR BBB CZ  1 ? 9  
ATOM   2390 O OH  . TYR B 2 111 ? 14.737  47.040  -48.611 1.000 31.060 0 109 TYR BBB OH  1 ? 9  
ATOM   2391 N N   . PHE B 2 112 ? 10.031  47.618  -42.944 1.000 22.572 0 110 PHE BBB N   1 ? 9  
ATOM   2392 C CA  . PHE B 2 112 ? 8.666   47.781  -43.509 1.000 22.331 0 110 PHE BBB CA  1 ? 9  
ATOM   2393 C C   . PHE B 2 112 ? 7.787   48.534  -42.517 1.000 24.110 0 110 PHE BBB C   1 ? 9  
ATOM   2394 O O   . PHE B 2 112 ? 7.866   48.238  -41.303 1.000 21.755 0 110 PHE BBB O   1 ? 9  
ATOM   2395 C CB  . PHE B 2 112 ? 8.029   46.434  -43.837 1.000 22.250 0 110 PHE BBB CB  1 ? 9  
ATOM   2396 C CG  . PHE B 2 112 ? 8.832   45.546  -44.749 1.000 22.604 0 110 PHE BBB CG  1 ? 9  
ATOM   2397 C CD1 . PHE B 2 112 ? 8.850   45.762  -46.117 1.000 23.906 0 110 PHE BBB CD1 1 ? 9  
ATOM   2398 C CD2 . PHE B 2 112 ? 9.552   44.477  -44.236 1.000 22.520 0 110 PHE BBB CD2 1 ? 9  
ATOM   2399 C CE1 . PHE B 2 112 ? 9.574   44.924  -46.953 1.000 25.496 0 110 PHE BBB CE1 1 ? 9  
ATOM   2400 C CE2 . PHE B 2 112 ? 10.283  43.649  -45.071 1.000 23.607 0 110 PHE BBB CE2 1 ? 9  
ATOM   2401 C CZ  . PHE B 2 112 ? 10.290  43.874  -46.428 1.000 25.354 0 110 PHE BBB CZ  1 ? 9  
ATOM   2402 N N   . TRP B 2 113 ? 6.984   49.477  -43.018 1.000 24.639 0 111 TRP BBB N   1 ? 9  
ATOM   2403 C CA  . TRP B 2 113 ? 6.115   50.345  -42.180 1.000 25.931 0 111 TRP BBB CA  1 ? 9  
ATOM   2404 C C   . TRP B 2 113 ? 4.650   50.224  -42.604 1.000 26.636 0 111 TRP BBB C   1 ? 9  
ATOM   2405 O O   . TRP B 2 113 ? 4.371   50.266  -43.810 1.000 27.041 0 111 TRP BBB O   1 ? 9  
ATOM   2406 C CB  . TRP B 2 113 ? 6.575   51.795  -42.300 1.000 26.395 0 111 TRP BBB CB  1 ? 9  
ATOM   2407 C CG  . TRP B 2 113 ? 7.924   52.066  -41.730 1.000 26.408 0 111 TRP BBB CG  1 ? 9  
ATOM   2408 C CD1 . TRP B 2 113 ? 9.120   52.052  -42.390 1.000 28.929 0 111 TRP BBB CD1 1 ? 9  
ATOM   2409 C CD2 . TRP B 2 113 ? 8.211   52.448  -40.380 1.000 26.976 0 111 TRP BBB CD2 1 ? 9  
ATOM   2410 N NE1 . TRP B 2 113 ? 10.134  52.382  -41.533 1.000 30.330 0 111 TRP BBB NE1 1 ? 9  
ATOM   2411 C CE2 . TRP B 2 113 ? 9.603   52.634  -40.292 1.000 28.620 0 111 TRP BBB CE2 1 ? 9  
ATOM   2412 C CE3 . TRP B 2 113 ? 7.425   52.638  -39.238 1.000 28.366 0 111 TRP BBB CE3 1 ? 9  
ATOM   2413 C CZ2 . TRP B 2 113 ? 10.226  53.016  -39.107 1.000 31.061 0 111 TRP BBB CZ2 1 ? 9  
ATOM   2414 C CZ3 . TRP B 2 113 ? 8.043   53.019  -38.072 1.000 28.556 0 111 TRP BBB CZ3 1 ? 9  
ATOM   2415 C CH2 . TRP B 2 113 ? 9.426   53.192  -38.004 1.000 29.643 0 111 TRP BBB CH2 1 ? 9  
ATOM   2416 N N   . GLY B 2 114 ? 3.739   50.173  -41.633 1.000 24.670 0 112 GLY BBB N   1 ? 9  
ATOM   2417 C CA  . GLY B 2 114 ? 2.305   50.378  -41.880 1.000 24.844 0 112 GLY BBB CA  1 ? 9  
ATOM   2418 C C   . GLY B 2 114 ? 2.012   51.841  -42.177 1.000 25.452 0 112 GLY BBB C   1 ? 9  
ATOM   2419 O O   . GLY B 2 114 ? 2.891   52.675  -41.978 1.000 25.309 0 112 GLY BBB O   1 ? 9  
ATOM   2420 N N   . GLN B 2 115 ? 0.806   52.135  -42.656 1.000 27.681 0 113 GLN BBB N   1 ? 9  
ATOM   2421 C CA  . GLN B 2 115 ? 0.394   53.508  -43.049 1.000 31.022 0 113 GLN BBB CA  1 ? 9  
ATOM   2422 C C   . GLN B 2 115 ? 0.176   54.332  -41.785 1.000 28.123 0 113 GLN BBB C   1 ? 9  
ATOM   2423 O O   . GLN B 2 115 ? 0.245   55.565  -41.871 1.000 31.318 0 113 GLN BBB O   1 ? 9  
ATOM   2424 C CB  . GLN B 2 115 ? -0.850  53.473  -43.938 1.000 35.259 0 113 GLN BBB CB  1 ? 9  
ATOM   2425 C CG  . GLN B 2 115 ? -0.535  52.977  -45.343 1.000 44.348 0 113 GLN BBB CG  1 ? 9  
ATOM   2426 C CD  . GLN B 2 115 ? -1.649  53.238  -46.324 1.000 51.533 0 113 GLN BBB CD  1 ? 9  
ATOM   2427 O OE1 . GLN B 2 115 ? -2.803  53.424  -45.945 1.000 59.731 0 113 GLN BBB OE1 1 ? 9  
ATOM   2428 N NE2 . GLN B 2 115 ? -1.304  53.253  -47.602 1.000 59.876 0 113 GLN BBB NE2 1 ? 9  
ATOM   2429 N N   . GLY B 2 116 ? -0.085  53.677  -40.658 1.000 24.591 0 114 GLY BBB N   1 ? 9  
ATOM   2430 C CA  . GLY B 2 116 ? -0.287  54.326  -39.352 1.000 24.091 0 114 GLY BBB CA  1 ? 9  
ATOM   2431 C C   . GLY B 2 116 ? -1.756  54.422  -38.990 1.000 26.088 0 114 GLY BBB C   1 ? 9  
ATOM   2432 O O   . GLY B 2 116 ? -2.598  54.546  -39.905 1.000 26.096 0 114 GLY BBB O   1 ? 9  
ATOM   2433 N N   . THR B 2 117 ? -2.055  54.345  -37.696 1.000 23.503 0 115 THR BBB N   1 ? 9  
ATOM   2434 C CA  A THR B 2 117 ? -3.438  54.436  -37.167 0.500 25.836 0 115 THR BBB CA  1 ? 9  
ATOM   2435 C CA  B THR B 2 117 ? -3.434  54.420  -37.154 0.500 24.874 0 115 THR BBB CA  1 ? 9  
ATOM   2436 C C   . THR B 2 117 ? -3.488  55.515  -36.081 1.000 24.299 0 115 THR BBB C   1 ? 9  
ATOM   2437 O O   . THR B 2 117 ? -2.658  55.463  -35.152 1.000 22.268 0 115 THR BBB O   1 ? 9  
ATOM   2438 C CB  A THR B 2 117 ? -3.948  53.071  -36.677 0.500 27.387 0 115 THR BBB CB  1 ? 9  
ATOM   2439 C CB  B THR B 2 117 ? -3.876  53.052  -36.611 0.500 25.191 0 115 THR BBB CB  1 ? 9  
ATOM   2440 O OG1 A THR B 2 117 ? -5.301  53.259  -36.260 0.500 31.383 0 115 THR BBB OG1 1 ? 9  
ATOM   2441 O OG1 B THR B 2 117 ? -3.669  52.078  -37.634 0.500 25.251 0 115 THR BBB OG1 1 ? 9  
ATOM   2442 C CG2 A THR B 2 117 ? -3.146  52.482  -35.539 0.500 27.555 0 115 THR BBB CG2 1 ? 9  
ATOM   2443 C CG2 B THR B 2 117 ? -5.322  53.028  -36.167 0.500 27.421 0 115 THR BBB CG2 1 ? 9  
ATOM   2444 N N   . GLN B 2 118 ? -4.439  56.435  -36.201 1.000 25.171 0 116 GLN BBB N   1 ? 9  
ATOM   2445 C CA  . GLN B 2 118 ? -4.627  57.520  -35.209 1.000 24.264 0 116 GLN BBB CA  1 ? 9  
ATOM   2446 C C   . GLN B 2 118 ? -5.198  56.915  -33.928 1.000 24.844 0 116 GLN BBB C   1 ? 9  
ATOM   2447 O O   . GLN B 2 118 ? -6.220  56.213  -34.014 1.000 25.451 0 116 GLN BBB O   1 ? 9  
ATOM   2448 C CB  . GLN B 2 118 ? -5.564  58.592  -35.762 1.000 26.240 0 116 GLN BBB CB  1 ? 9  
ATOM   2449 C CG  . GLN B 2 118 ? -5.722  59.795  -34.850 1.000 26.247 0 116 GLN BBB CG  1 ? 9  
ATOM   2450 C CD  . GLN B 2 118 ? -4.446  60.591  -34.707 1.000 26.747 0 116 GLN BBB CD  1 ? 9  
ATOM   2451 O OE1 . GLN B 2 118 ? -3.798  60.938  -35.683 1.000 28.358 0 116 GLN BBB OE1 1 ? 9  
ATOM   2452 N NE2 . GLN B 2 118 ? -4.066  60.877  -33.477 1.000 26.940 0 116 GLN BBB NE2 1 ? 9  
ATOM   2453 N N   . VAL B 2 119 ? -4.570  57.229  -32.797 1.000 24.791 0 117 VAL BBB N   1 ? 9  
ATOM   2454 C CA  . VAL B 2 119 ? -5.116  57.043  -31.424 1.000 24.464 0 117 VAL BBB CA  1 ? 9  
ATOM   2455 C C   . VAL B 2 119 ? -5.254  58.430  -30.795 1.000 24.666 0 117 VAL BBB C   1 ? 9  
ATOM   2456 O O   . VAL B 2 119 ? -4.262  59.158  -30.717 1.000 23.572 0 117 VAL BBB O   1 ? 9  
ATOM   2457 C CB  . VAL B 2 119 ? -4.221  56.111  -30.592 1.000 24.276 0 117 VAL BBB CB  1 ? 9  
ATOM   2458 C CG1 . VAL B 2 119 ? -4.631  56.063  -29.129 1.000 27.642 0 117 VAL BBB CG1 1 ? 9  
ATOM   2459 C CG2 . VAL B 2 119 ? -4.182  54.705  -31.204 1.000 24.940 0 117 VAL BBB CG2 1 ? 9  
ATOM   2460 N N   . THR B 2 120 ? -6.462  58.780  -30.369 1.000 25.418 0 118 THR BBB N   1 ? 9  
ATOM   2461 C CA  . THR B 2 120 ? -6.740  60.068  -29.699 1.000 27.686 0 118 THR BBB CA  1 ? 9  
ATOM   2462 C C   . THR B 2 120 ? -7.313  59.773  -28.313 1.000 27.346 0 118 THR BBB C   1 ? 9  
ATOM   2463 O O   . THR B 2 120 ? -8.404  59.200  -28.230 1.000 28.620 0 118 THR BBB O   1 ? 9  
ATOM   2464 C CB  . THR B 2 120 ? -7.631  60.949  -30.580 1.000 30.341 0 118 THR BBB CB  1 ? 9  
ATOM   2465 O OG1 . THR B 2 120 ? -6.981  61.056  -31.850 1.000 29.089 0 118 THR BBB OG1 1 ? 9  
ATOM   2466 C CG2 . THR B 2 120 ? -7.846  62.321  -29.981 1.000 31.770 0 118 THR BBB CG2 1 ? 9  
ATOM   2467 N N   . VAL B 2 121 ? -6.584  60.168  -27.276 1.000 26.989 0 119 VAL BBB N   1 ? 9  
ATOM   2468 C CA  . VAL B 2 121 ? -6.996  60.015  -25.854 1.000 28.808 0 119 VAL BBB CA  1 ? 9  
ATOM   2469 C C   . VAL B 2 121 ? -7.463  61.375  -25.330 1.000 28.753 0 119 VAL BBB C   1 ? 9  
ATOM   2470 O O   . VAL B 2 121 ? -6.627  62.289  -25.260 1.000 29.455 0 119 VAL BBB O   1 ? 9  
ATOM   2471 C CB  . VAL B 2 121 ? -5.838  59.446  -25.018 1.000 28.399 0 119 VAL BBB CB  1 ? 9  
ATOM   2472 C CG1 . VAL B 2 121 ? -6.290  59.167  -23.590 1.000 29.181 0 119 VAL BBB CG1 1 ? 9  
ATOM   2473 C CG2 . VAL B 2 121 ? -5.257  58.193  -25.667 1.000 28.035 0 119 VAL BBB CG2 1 ? 9  
ATOM   2474 N N   . SER B 2 122 ? -8.750  61.504  -24.986 1.000 31.416 0 120 SER BBB N   1 ? 9  
ATOM   2475 C CA  . SER B 2 122 ? -9.346  62.769  -24.475 1.000 33.135 0 120 SER BBB CA  1 ? 9  
ATOM   2476 C C   . SER B 2 122 ? -9.105  62.881  -22.968 1.000 35.890 0 120 SER BBB C   1 ? 9  
ATOM   2477 O O   . SER B 2 122 ? -9.196  61.859  -22.266 1.000 38.311 0 120 SER BBB O   1 ? 9  
ATOM   2478 C CB  . SER B 2 122 ? -10.814 62.858  -24.800 1.000 35.430 0 120 SER BBB CB  1 ? 9  
ATOM   2479 O OG  . SER B 2 122 ? -11.510 61.708  -24.332 1.000 39.322 0 120 SER BBB OG  1 ? 9  
ATOM   2480 N N   . SER B 2 123 ? -8.832  64.094  -22.491 1.000 37.527 0 121 SER BBB N   1 ? 9  
ATOM   2481 C CA  . SER B 2 123 ? -8.659  64.399  -21.051 1.000 38.704 0 121 SER BBB CA  1 ? 9  
ATOM   2482 C C   . SER B 2 123 ? -10.032 64.456  -20.373 1.000 40.159 0 121 SER BBB C   1 ? 9  
ATOM   2483 O O   . SER B 2 123 ? -11.035 64.653  -21.078 1.000 37.092 0 121 SER BBB O   1 ? 9  
ATOM   2484 C CB  . SER B 2 123 ? -7.904  65.675  -20.847 1.000 41.954 0 121 SER BBB CB  1 ? 9  
ATOM   2485 O OG  . SER B 2 123 ? -7.913  66.030  -19.473 1.000 45.848 0 121 SER BBB OG  1 ? 9  
ATOM   2486 N N   . HIS B 2 124 ? -10.048 64.273  -19.049 1.000 41.863 0 122 HIS BBB N   1 ? 9  
ATOM   2487 C CA  . HIS B 2 124 ? -11.230 64.472  -18.177 1.000 45.243 0 122 HIS BBB CA  1 ? 9  
ATOM   2488 C C   . HIS B 2 124 ? -11.294 65.945  -17.776 1.000 44.848 0 122 HIS BBB C   1 ? 9  
ATOM   2489 O O   . HIS B 2 124 ? -12.343 66.288  -17.271 1.000 47.617 0 122 HIS BBB O   1 ? 9  
ATOM   2490 C CB  . HIS B 2 124 ? -11.175 63.555  -16.950 1.000 47.090 0 122 HIS BBB CB  1 ? 9  
ATOM   2491 C CG  . HIS B 2 124 ? -11.292 62.113  -17.294 1.000 47.161 0 122 HIS BBB CG  1 ? 9  
ATOM   2492 N ND1 . HIS B 2 124 ? -12.354 61.619  -18.032 1.000 48.232 0 122 HIS BBB ND1 1 ? 9  
ATOM   2493 C CD2 . HIS B 2 124 ? -10.494 61.061  -17.012 1.000 47.912 0 122 HIS BBB CD2 1 ? 9  
ATOM   2494 C CE1 . HIS B 2 124 ? -12.191 60.321  -18.206 1.000 47.605 0 122 HIS BBB CE1 1 ? 9  
ATOM   2495 N NE2 . HIS B 2 124 ? -11.062 59.954  -17.583 1.000 47.392 0 122 HIS BBB NE2 1 ? 9  
ATOM   2496 N N   . ASN C 1 5   ? 8.208   2.671   14.501  1.000 55.006 0 334 ASN EEE N   1 ? 10 
ATOM   2497 C CA  . ASN C 1 5   ? 7.523   1.346   14.432  1.000 54.179 0 334 ASN EEE CA  1 ? 10 
ATOM   2498 C C   . ASN C 1 5   ? 8.419   0.362   13.657  1.000 47.576 0 334 ASN EEE C   1 ? 10 
ATOM   2499 O O   . ASN C 1 5   ? 8.444   0.445   12.426  1.000 43.557 0 334 ASN EEE O   1 ? 10 
ATOM   2500 C CB  . ASN C 1 5   ? 6.132   1.511   13.812  1.000 56.977 0 334 ASN EEE CB  1 ? 10 
ATOM   2501 C CG  . ASN C 1 5   ? 5.225   0.327   14.070  1.000 60.742 0 334 ASN EEE CG  1 ? 10 
ATOM   2502 O OD1 . ASN C 1 5   ? 5.661   -0.819  14.026  1.000 61.074 0 334 ASN EEE OD1 1 ? 10 
ATOM   2503 N ND2 . ASN C 1 5   ? 3.957   0.595   14.342  1.000 65.141 0 334 ASN EEE ND2 1 ? 10 
ATOM   2504 N N   . LEU C 1 6   ? 9.128   -0.532  14.356  1.000 45.191 0 335 LEU EEE N   1 ? 10 
ATOM   2505 C CA  . LEU C 1 6   ? 10.243  -1.354  13.796  1.000 43.338 0 335 LEU EEE CA  1 ? 10 
ATOM   2506 C C   . LEU C 1 6   ? 9.687   -2.528  12.978  1.000 38.101 0 335 LEU EEE C   1 ? 10 
ATOM   2507 O O   . LEU C 1 6   ? 8.797   -3.234  13.483  1.000 36.141 0 335 LEU EEE O   1 ? 10 
ATOM   2508 C CB  . LEU C 1 6   ? 11.124  -1.872  14.939  1.000 47.632 0 335 LEU EEE CB  1 ? 10 
ATOM   2509 C CG  . LEU C 1 6   ? 11.765  -0.810  15.835  1.000 53.491 0 335 LEU EEE CG  1 ? 10 
ATOM   2510 C CD1 . LEU C 1 6   ? 12.619  -1.468  16.910  1.000 55.753 0 335 LEU EEE CD1 1 ? 10 
ATOM   2511 C CD2 . LEU C 1 6   ? 12.599  0.173   15.022  1.000 56.647 0 335 LEU EEE CD2 1 ? 10 
ATOM   2512 N N   . CYS C 1 7   ? 10.216  -2.756  11.771  1.000 34.566 0 336 CYS EEE N   1 ? 10 
ATOM   2513 C CA  . CYS C 1 7   ? 9.809   -3.899  10.911  1.000 31.842 0 336 CYS EEE CA  1 ? 10 
ATOM   2514 C C   . CYS C 1 7   ? 10.095  -5.209  11.645  1.000 31.565 0 336 CYS EEE C   1 ? 10 
ATOM   2515 O O   . CYS C 1 7   ? 11.141  -5.356  12.269  1.000 30.935 0 336 CYS EEE O   1 ? 10 
ATOM   2516 C CB  . CYS C 1 7   ? 10.525  -3.891  9.566   1.000 31.708 0 336 CYS EEE CB  1 ? 10 
ATOM   2517 S SG  . CYS C 1 7   ? 10.086  -2.499  8.491   1.000 32.869 0 336 CYS EEE SG  1 ? 10 
ATOM   2518 N N   . PRO C 1 8   ? 9.174   -6.191  11.610  1.000 31.563 0 337 PRO EEE N   1 ? 10 
ATOM   2519 C CA  . PRO C 1 8   ? 9.351   -7.446  12.353  1.000 32.002 0 337 PRO EEE CA  1 ? 10 
ATOM   2520 C C   . PRO C 1 8   ? 10.267  -8.465  11.654  1.000 31.497 0 337 PRO EEE C   1 ? 10 
ATOM   2521 O O   . PRO C 1 8   ? 9.846   -9.607  11.405  1.000 32.966 0 337 PRO EEE O   1 ? 10 
ATOM   2522 C CB  . PRO C 1 8   ? 7.909   -7.952  12.460  1.000 33.676 0 337 PRO EEE CB  1 ? 10 
ATOM   2523 C CG  . PRO C 1 8   ? 7.292   -7.507  11.153  1.000 34.436 0 337 PRO EEE CG  1 ? 10 
ATOM   2524 C CD  . PRO C 1 8   ? 7.888   -6.134  10.900  1.000 33.117 0 337 PRO EEE CD  1 ? 10 
ATOM   2525 N N   . PHE C 1 9   ? 11.510  -8.068  11.384  1.000 30.381 0 338 PHE EEE N   1 ? 10 
ATOM   2526 C CA  . PHE C 1 9   ? 12.521  -8.947  10.742  1.000 30.227 0 338 PHE EEE CA  1 ? 10 
ATOM   2527 C C   . PHE C 1 9   ? 12.936  -10.051 11.721  1.000 28.947 0 338 PHE EEE C   1 ? 10 
ATOM   2528 O O   . PHE C 1 9   ? 13.202  -11.156 11.247  1.000 30.109 0 338 PHE EEE O   1 ? 10 
ATOM   2529 C CB  . PHE C 1 9   ? 13.713  -8.155  10.202  1.000 31.193 0 338 PHE EEE CB  1 ? 10 
ATOM   2530 C CG  . PHE C 1 9   ? 13.418  -7.410  8.925   1.000 34.816 0 338 PHE EEE CG  1 ? 10 
ATOM   2531 C CD1 . PHE C 1 9   ? 12.671  -7.992  7.914   1.000 35.178 0 338 PHE EEE CD1 1 ? 10 
ATOM   2532 C CD2 . PHE C 1 9   ? 13.876  -6.114  8.738   1.000 39.113 0 338 PHE EEE CD2 1 ? 10 
ATOM   2533 C CE1 . PHE C 1 9   ? 12.386  -7.298  6.747   1.000 38.592 0 338 PHE EEE CE1 1 ? 10 
ATOM   2534 C CE2 . PHE C 1 9   ? 13.595  -5.426  7.567   1.000 40.916 0 338 PHE EEE CE2 1 ? 10 
ATOM   2535 C CZ  . PHE C 1 9   ? 12.837  -6.011  6.582   1.000 39.891 0 338 PHE EEE CZ  1 ? 10 
ATOM   2536 N N   . GLY C 1 10  ? 12.920  -9.788  13.033  1.000 29.588 0 339 GLY EEE N   1 ? 10 
ATOM   2537 C CA  . GLY C 1 10  ? 13.184  -10.824 14.051  1.000 30.103 0 339 GLY EEE CA  1 ? 10 
ATOM   2538 C C   . GLY C 1 10  ? 12.366  -12.088 13.807  1.000 27.879 0 339 GLY EEE C   1 ? 10 
ATOM   2539 O O   . GLY C 1 10  ? 12.931  -13.199 13.860  1.000 26.748 0 339 GLY EEE O   1 ? 10 
ATOM   2540 N N   . GLU C 1 11  ? 11.059  -11.936 13.568  1.000 29.214 0 340 GLU EEE N   1 ? 10 
ATOM   2541 C CA  . GLU C 1 11  ? 10.112  -13.060 13.369  1.000 31.563 0 340 GLU EEE CA  1 ? 10 
ATOM   2542 C C   . GLU C 1 11  ? 10.530  -13.884 12.147  1.000 29.288 0 340 GLU EEE C   1 ? 10 
ATOM   2543 O O   . GLU C 1 11  ? 10.261  -15.091 12.134  1.000 30.587 0 340 GLU EEE O   1 ? 10 
ATOM   2544 C CB  . GLU C 1 11  ? 8.689   -12.544 13.176  1.000 34.704 0 340 GLU EEE CB  1 ? 10 
ATOM   2545 C CG  . GLU C 1 11  ? 8.065   -12.020 14.452  1.000 41.606 0 340 GLU EEE CG  1 ? 10 
ATOM   2546 C CD  . GLU C 1 11  ? 6.808   -11.204 14.212  1.000 46.130 0 340 GLU EEE CD  1 ? 10 
ATOM   2547 O OE1 . GLU C 1 11  ? 6.156   -11.443 13.171  1.000 45.472 0 340 GLU EEE OE1 1 ? 10 
ATOM   2548 O OE2 . GLU C 1 11  ? 6.500   -10.330 15.053  1.000 49.990 0 340 GLU EEE OE2 1 ? 10 
ATOM   2549 N N   . VAL C 1 12  ? 11.143  -13.247 11.148  1.000 27.636 0 341 VAL EEE N   1 ? 10 
ATOM   2550 C CA  . VAL C 1 12  ? 11.567  -13.926 9.892   1.000 27.119 0 341 VAL EEE CA  1 ? 10 
ATOM   2551 C C   . VAL C 1 12  ? 12.909  -14.623 10.130  1.000 25.271 0 341 VAL EEE C   1 ? 10 
ATOM   2552 O O   . VAL C 1 12  ? 12.987  -15.852 9.921   1.000 26.565 0 341 VAL EEE O   1 ? 10 
ATOM   2553 C CB  . VAL C 1 12  ? 11.654  -12.948 8.708   1.000 28.286 0 341 VAL EEE CB  1 ? 10 
ATOM   2554 C CG1 . VAL C 1 12  ? 12.157  -13.667 7.461   1.000 29.943 0 341 VAL EEE CG1 1 ? 10 
ATOM   2555 C CG2 . VAL C 1 12  ? 10.320  -12.270 8.435   1.000 31.137 0 341 VAL EEE CG2 1 ? 10 
ATOM   2556 N N   . PHE C 1 13  ? 13.938  -13.868 10.510  1.000 23.717 0 342 PHE EEE N   1 ? 10 
ATOM   2557 C CA  . PHE C 1 13  ? 15.331  -14.371 10.580  1.000 23.939 0 342 PHE EEE CA  1 ? 10 
ATOM   2558 C C   . PHE C 1 13  ? 15.512  -15.350 11.743  1.000 24.440 0 342 PHE EEE C   1 ? 10 
ATOM   2559 O O   . PHE C 1 13  ? 16.349  -16.254 11.596  1.000 24.409 0 342 PHE EEE O   1 ? 10 
ATOM   2560 C CB  . PHE C 1 13  ? 16.319  -13.214 10.663  1.000 23.830 0 342 PHE EEE CB  1 ? 10 
ATOM   2561 C CG  . PHE C 1 13  ? 16.494  -12.510 9.344   1.000 23.890 0 342 PHE EEE CG  1 ? 10 
ATOM   2562 C CD1 . PHE C 1 13  ? 15.637  -11.492 8.962   1.000 24.969 0 342 PHE EEE CD1 1 ? 10 
ATOM   2563 C CD2 . PHE C 1 13  ? 17.471  -12.913 8.457   1.000 25.102 0 342 PHE EEE CD2 1 ? 10 
ATOM   2564 C CE1 . PHE C 1 13  ? 15.794  -10.851 7.743   1.000 25.110 0 342 PHE EEE CE1 1 ? 10 
ATOM   2565 C CE2 . PHE C 1 13  ? 17.633  -12.266 7.247   1.000 25.885 0 342 PHE EEE CE2 1 ? 10 
ATOM   2566 C CZ  . PHE C 1 13  ? 16.801  -11.233 6.897   1.000 26.009 0 342 PHE EEE CZ  1 ? 10 
ATOM   2567 N N   . ASN C 1 14  ? 14.755  -15.176 12.828  1.000 25.777 0 343 ASN EEE N   1 ? 10 
ATOM   2568 C CA  . ASN C 1 14  ? 14.974  -15.922 14.092  1.000 27.239 0 343 ASN EEE CA  1 ? 10 
ATOM   2569 C C   . ASN C 1 14  ? 13.813  -16.877 14.374  1.000 27.922 0 343 ASN EEE C   1 ? 10 
ATOM   2570 O O   . ASN C 1 14  ? 13.761  -17.384 15.503  1.000 29.464 0 343 ASN EEE O   1 ? 10 
ATOM   2571 C CB  . ASN C 1 14  ? 15.209  -14.972 15.265  1.000 30.132 0 343 ASN EEE CB  1 ? 10 
ATOM   2572 C CG  . ASN C 1 14  ? 16.619  -14.424 15.291  1.000 33.785 0 343 ASN EEE CG  1 ? 10 
ATOM   2573 O OD1 . ASN C 1 14  ? 17.539  -15.079 14.788  1.000 32.663 0 343 ASN EEE OD1 1 ? 10 
ATOM   2574 N ND2 . ASN C 1 14  ? 16.783  -13.238 15.852  1.000 38.467 0 343 ASN EEE ND2 1 ? 10 
ATOM   2575 N N   . ALA C 1 15  ? 12.952  -17.157 13.393  1.000 26.201 0 344 ALA EEE N   1 ? 10 
ATOM   2576 C CA  . ALA C 1 15  ? 11.899  -18.190 13.507  1.000 26.200 0 344 ALA EEE CA  1 ? 10 
ATOM   2577 C C   . ALA C 1 15  ? 12.541  -19.511 13.957  1.000 25.283 0 344 ALA EEE C   1 ? 10 
ATOM   2578 O O   . ALA C 1 15  ? 13.619  -19.873 13.481  1.000 23.980 0 344 ALA EEE O   1 ? 10 
ATOM   2579 C CB  . ALA C 1 15  ? 11.152  -18.360 12.199  1.000 26.827 0 344 ALA EEE CB  1 ? 10 
ATOM   2580 N N   . THR C 1 16  ? 11.913  -20.199 14.896  1.000 26.680 0 345 THR EEE N   1 ? 10 
ATOM   2581 C CA  A THR C 1 16  ? 12.430  -21.481 15.437  0.500 27.191 0 345 THR EEE CA  1 ? 10 
ATOM   2582 C CA  B THR C 1 16  ? 12.430  -21.481 15.438  0.500 28.211 0 345 THR EEE CA  1 ? 10 
ATOM   2583 C C   . THR C 1 16  ? 12.485  -22.517 14.315  1.000 27.787 0 345 THR EEE C   1 ? 10 
ATOM   2584 O O   . THR C 1 16  ? 13.526  -23.202 14.196  1.000 27.385 0 345 THR EEE O   1 ? 10 
ATOM   2585 C CB  A THR C 1 16  ? 11.561  -21.971 16.599  0.500 29.150 0 345 THR EEE CB  1 ? 10 
ATOM   2586 C CB  B THR C 1 16  ? 11.556  -21.970 16.596  0.500 31.385 0 345 THR EEE CB  1 ? 10 
ATOM   2587 O OG1 A THR C 1 16  ? 11.664  -20.967 17.606  0.500 29.112 0 345 THR EEE OG1 1 ? 10 
ATOM   2588 O OG1 B THR C 1 16  ? 10.230  -22.096 16.083  0.500 34.547 0 345 THR EEE OG1 1 ? 10 
ATOM   2589 C CG2 A THR C 1 16  ? 11.983  -23.327 17.115  0.500 29.718 0 345 THR EEE CG2 1 ? 10 
ATOM   2590 C CG2 B THR C 1 16  ? 11.575  -21.021 17.771  0.500 32.408 0 345 THR EEE CG2 1 ? 10 
ATOM   2591 N N   . ARG C 1 17  ? 11.402  -22.616 13.548  1.000 29.610 0 346 ARG EEE N   1 ? 10 
ATOM   2592 C CA  . ARG C 1 17  ? 11.296  -23.565 12.408  1.000 33.147 0 346 ARG EEE CA  1 ? 10 
ATOM   2593 C C   . ARG C 1 17  ? 11.114  -22.770 11.118  1.000 30.474 0 346 ARG EEE C   1 ? 10 
ATOM   2594 O O   . ARG C 1 17  ? 10.477  -21.728 11.141  1.000 28.652 0 346 ARG EEE O   1 ? 10 
ATOM   2595 C CB  . ARG C 1 17  ? 10.144  -24.551 12.618  1.000 38.673 0 346 ARG EEE CB  1 ? 10 
ATOM   2596 C CG  . ARG C 1 17  ? 10.596  -25.897 13.173  1.000 43.373 0 346 ARG EEE CG  1 ? 10 
ATOM   2597 C CD  . ARG C 1 17  ? 9.494   -26.934 13.127  1.000 50.068 0 346 ARG EEE CD  1 ? 10 
ATOM   2598 N NE  . ARG C 1 17  ? 8.279   -26.504 13.812  1.000 56.508 0 346 ARG EEE NE  1 ? 10 
ATOM   2599 C CZ  . ARG C 1 17  ? 8.139   -26.404 15.135  1.000 61.104 0 346 ARG EEE CZ  1 ? 10 
ATOM   2600 N NH1 . ARG C 1 17  ? 9.153   -26.672 15.945  1.000 61.277 0 346 ARG EEE NH1 1 ? 10 
ATOM   2601 N NH2 . ARG C 1 17  ? 6.980   -26.021 15.647  1.000 64.411 0 346 ARG EEE NH2 1 ? 10 
ATOM   2602 N N   . PHE C 1 18  ? 11.706  -23.265 10.039  1.000 23.019 0 347 PHE EEE N   1 ? 11 
ATOM   2603 C CA  . PHE C 1 18  ? 11.585  -22.697 8.675   1.000 20.826 0 347 PHE EEE CA  1 ? 11 
ATOM   2604 C C   . PHE C 1 18  ? 10.702  -23.627 7.852   1.000 20.498 0 347 PHE EEE C   1 ? 11 
ATOM   2605 O O   . PHE C 1 18  ? 10.540  -24.822 8.221   1.000 21.677 0 347 PHE EEE O   1 ? 11 
ATOM   2606 C CB  . PHE C 1 18  ? 12.966  -22.506 8.046   1.000 20.323 0 347 PHE EEE CB  1 ? 11 
ATOM   2607 C CG  . PHE C 1 18  ? 13.565  -21.134 8.247   1.000 20.834 0 347 PHE EEE CG  1 ? 11 
ATOM   2608 C CD1 . PHE C 1 18  ? 13.515  -20.502 9.487   1.000 21.659 0 347 PHE EEE CD1 1 ? 11 
ATOM   2609 C CD2 . PHE C 1 18  ? 14.163  -20.466 7.196   1.000 21.563 0 347 PHE EEE CD2 1 ? 11 
ATOM   2610 C CE1 . PHE C 1 18  ? 14.032  -19.225 9.648   1.000 21.849 0 347 PHE EEE CE1 1 ? 11 
ATOM   2611 C CE2 . PHE C 1 18  ? 14.696  -19.197 7.373   1.000 21.924 0 347 PHE EEE CE2 1 ? 11 
ATOM   2612 C CZ  . PHE C 1 18  ? 14.630  -18.584 8.590   1.000 21.549 0 347 PHE EEE CZ  1 ? 11 
ATOM   2613 N N   . ALA C 1 19  ? 10.189  -23.095 6.748   1.000 21.403 0 348 ALA EEE N   1 ? 11 
ATOM   2614 C CA  . ALA C 1 19  ? 9.366   -23.809 5.755   1.000 21.054 0 348 ALA EEE CA  1 ? 11 
ATOM   2615 C C   . ALA C 1 19  ? 10.234  -24.780 4.951   1.000 20.438 0 348 ALA EEE C   1 ? 11 
ATOM   2616 O O   . ALA C 1 19  ? 11.423  -24.493 4.697   1.000 18.368 0 348 ALA EEE O   1 ? 11 
ATOM   2617 C CB  . ALA C 1 19  ? 8.697   -22.820 4.834   1.000 22.217 0 348 ALA EEE CB  1 ? 11 
ATOM   2618 N N   . SER C 1 20  ? 9.635   -25.886 4.510   1.000 19.329 0 349 SER EEE N   1 ? 11 
ATOM   2619 C CA  . SER C 1 20  ? 10.146  -26.637 3.339   1.000 18.397 0 349 SER EEE CA  1 ? 11 
ATOM   2620 C C   . SER C 1 20  ? 10.137  -25.709 2.126   1.000 17.982 0 349 SER EEE C   1 ? 11 
ATOM   2621 O O   . SER C 1 20  ? 9.205   -24.936 1.958   1.000 19.276 0 349 SER EEE O   1 ? 11 
ATOM   2622 C CB  . SER C 1 20  ? 9.359   -27.909 3.073   1.000 20.039 0 349 SER EEE CB  1 ? 11 
ATOM   2623 O OG  . SER C 1 20  ? 9.597   -28.880 4.093   1.000 20.051 0 349 SER EEE OG  1 ? 11 
ATOM   2624 N N   . VAL C 1 21  ? 11.176  -25.793 1.306   1.000 16.690 0 350 VAL EEE N   1 ? 11 
ATOM   2625 C CA  . VAL C 1 21  ? 11.344  -24.937 0.106   1.000 17.131 0 350 VAL EEE CA  1 ? 11 
ATOM   2626 C C   . VAL C 1 21  ? 10.128  -25.080 -0.814  1.000 17.170 0 350 VAL EEE C   1 ? 11 
ATOM   2627 O O   . VAL C 1 21  ? 9.705   -24.061 -1.368  1.000 18.166 0 350 VAL EEE O   1 ? 11 
ATOM   2628 C CB  . VAL C 1 21  ? 12.681  -25.219 -0.601  1.000 16.457 0 350 VAL EEE CB  1 ? 11 
ATOM   2629 C CG1 . VAL C 1 21  ? 12.760  -26.648 -1.168  1.000 16.081 0 350 VAL EEE CG1 1 ? 11 
ATOM   2630 C CG2 . VAL C 1 21  ? 12.934  -24.167 -1.652  1.000 17.464 0 350 VAL EEE CG2 1 ? 11 
ATOM   2631 N N   . TYR C 1 22  ? 9.553   -26.271 -0.998  1.000 18.334 0 351 TYR EEE N   1 ? 11 
ATOM   2632 C CA  . TYR C 1 22  ? 8.399   -26.399 -1.931  1.000 17.637 0 351 TYR EEE CA  1 ? 11 
ATOM   2633 C C   . TYR C 1 22  ? 7.214   -25.580 -1.396  1.000 19.611 0 351 TYR EEE C   1 ? 11 
ATOM   2634 O O   . TYR C 1 22  ? 6.433   -25.055 -2.208  1.000 19.958 0 351 TYR EEE O   1 ? 11 
ATOM   2635 C CB  . TYR C 1 22  ? 8.009   -27.859 -2.159  1.000 18.827 0 351 TYR EEE CB  1 ? 11 
ATOM   2636 C CG  . TYR C 1 22  ? 7.042   -28.411 -1.154  1.000 19.435 0 351 TYR EEE CG  1 ? 11 
ATOM   2637 C CD1 . TYR C 1 22  ? 7.463   -28.951 0.052   1.000 19.121 0 351 TYR EEE CD1 1 ? 11 
ATOM   2638 C CD2 . TYR C 1 22  ? 5.684   -28.383 -1.426  1.000 19.682 0 351 TYR EEE CD2 1 ? 11 
ATOM   2639 C CE1 . TYR C 1 22  ? 6.547   -29.435 0.975   1.000 20.431 0 351 TYR EEE CE1 1 ? 11 
ATOM   2640 C CE2 . TYR C 1 22  ? 4.770   -28.866 -0.520  1.000 20.363 0 351 TYR EEE CE2 1 ? 11 
ATOM   2641 C CZ  . TYR C 1 22  ? 5.195   -29.385 0.681   1.000 20.681 0 351 TYR EEE CZ  1 ? 11 
ATOM   2642 O OH  . TYR C 1 22  ? 4.222   -29.873 1.500   1.000 22.678 0 351 TYR EEE OH  1 ? 11 
ATOM   2643 N N   . ALA C 1 23  ? 7.086   -25.473 -0.072  1.000 19.014 0 352 ALA EEE N   1 ? 11 
ATOM   2644 C CA  . ALA C 1 23  ? 6.000   -24.731 0.615   1.000 18.986 0 352 ALA EEE CA  1 ? 11 
ATOM   2645 C C   . ALA C 1 23  ? 6.562   -23.451 1.246   1.000 18.606 0 352 ALA EEE C   1 ? 11 
ATOM   2646 O O   . ALA C 1 23  ? 6.196   -23.123 2.414   1.000 19.232 0 352 ALA EEE O   1 ? 11 
ATOM   2647 C CB  . ALA C 1 23  ? 5.342   -25.617 1.649   1.000 20.280 0 352 ALA EEE CB  1 ? 11 
ATOM   2648 N N   . TRP C 1 24  ? 7.414   -22.754 0.511   1.000 17.845 0 353 TRP EEE N   1 ? 11 
ATOM   2649 C CA  . TRP C 1 24  ? 8.186   -21.586 1.009   1.000 18.946 0 353 TRP EEE CA  1 ? 11 
ATOM   2650 C C   . TRP C 1 24  ? 7.249   -20.555 1.649   1.000 19.259 0 353 TRP EEE C   1 ? 11 
ATOM   2651 O O   . TRP C 1 24  ? 6.130   -20.296 1.118   1.000 20.684 0 353 TRP EEE O   1 ? 11 
ATOM   2652 C CB  . TRP C 1 24  ? 9.058   -20.993 -0.098  1.000 18.544 0 353 TRP EEE CB  1 ? 11 
ATOM   2653 C CG  . TRP C 1 24  ? 8.393   -20.665 -1.397  1.000 18.184 0 353 TRP EEE CG  1 ? 11 
ATOM   2654 C CD1 . TRP C 1 24  ? 8.286   -21.463 -2.503  1.000 18.966 0 353 TRP EEE CD1 1 ? 11 
ATOM   2655 C CD2 . TRP C 1 24  ? 7.811   -19.402 -1.762  1.000 19.900 0 353 TRP EEE CD2 1 ? 11 
ATOM   2656 N NE1 . TRP C 1 24  ? 7.681   -20.781 -3.529  1.000 20.697 0 353 TRP EEE NE1 1 ? 11 
ATOM   2657 C CE2 . TRP C 1 24  ? 7.366   -19.518 -3.098  1.000 20.984 0 353 TRP EEE CE2 1 ? 11 
ATOM   2658 C CE3 . TRP C 1 24  ? 7.642   -18.185 -1.097  1.000 21.232 0 353 TRP EEE CE3 1 ? 11 
ATOM   2659 C CZ2 . TRP C 1 24  ? 6.783   -18.455 -3.781  1.000 22.111 0 353 TRP EEE CZ2 1 ? 11 
ATOM   2660 C CZ3 . TRP C 1 24  ? 7.053   -17.136 -1.770  1.000 22.734 0 353 TRP EEE CZ3 1 ? 11 
ATOM   2661 C CH2 . TRP C 1 24  ? 6.623   -17.275 -3.090  1.000 23.917 0 353 TRP EEE CH2 1 ? 11 
ATOM   2662 N N   . ASN C 1 25  ? 7.671   -20.019 2.794   1.000 20.857 0 354 ASN EEE N   1 ? 11 
ATOM   2663 C CA  . ASN C 1 25  ? 6.908   -19.026 3.576   1.000 22.611 0 354 ASN EEE CA  1 ? 11 
ATOM   2664 C C   . ASN C 1 25  ? 7.117   -17.641 2.970   1.000 21.441 0 354 ASN EEE C   1 ? 11 
ATOM   2665 O O   . ASN C 1 25  ? 8.246   -17.322 2.600   1.000 21.497 0 354 ASN EEE O   1 ? 11 
ATOM   2666 C CB  . ASN C 1 25  ? 7.343   -18.977 5.038   1.000 24.175 0 354 ASN EEE CB  1 ? 11 
ATOM   2667 C CG  . ASN C 1 25  ? 6.353   -18.213 5.878   1.000 30.660 0 354 ASN EEE CG  1 ? 11 
ATOM   2668 O OD1 . ASN C 1 25  ? 5.283   -18.738 6.189   1.000 38.821 0 354 ASN EEE OD1 1 ? 11 
ATOM   2669 N ND2 . ASN C 1 25  ? 6.676   -16.973 6.209   1.000 31.797 0 354 ASN EEE ND2 1 ? 11 
ATOM   2670 N N   . ARG C 1 26  ? 6.050   -16.855 2.885   1.000 22.737 0 355 ARG EEE N   1 ? 11 
ATOM   2671 C CA  . ARG C 1 26  ? 6.133   -15.418 2.533   1.000 22.089 0 355 ARG EEE CA  1 ? 11 
ATOM   2672 C C   . ARG C 1 26  ? 5.532   -14.589 3.663   1.000 25.622 0 355 ARG EEE C   1 ? 11 
ATOM   2673 O O   . ARG C 1 26  ? 4.382   -14.867 4.071   1.000 26.523 0 355 ARG EEE O   1 ? 11 
ATOM   2674 C CB  . ARG C 1 26  ? 5.391   -15.109 1.233   1.000 24.579 0 355 ARG EEE CB  1 ? 11 
ATOM   2675 C CG  . ARG C 1 26  ? 5.275   -13.615 0.949   1.000 24.878 0 355 ARG EEE CG  1 ? 11 
ATOM   2676 C CD  . ARG C 1 26  ? 4.988   -13.335 -0.512  1.000 25.772 0 355 ARG EEE CD  1 ? 11 
ATOM   2677 N NE  . ARG C 1 26  ? 6.197   -13.474 -1.309  1.000 24.774 0 355 ARG EEE NE  1 ? 11 
ATOM   2678 C CZ  . ARG C 1 26  ? 6.310   -13.105 -2.576  1.000 27.105 0 355 ARG EEE CZ  1 ? 11 
ATOM   2679 N NH1 . ARG C 1 26  ? 5.280   -12.576 -3.209  1.000 29.306 0 355 ARG EEE NH1 1 ? 11 
ATOM   2680 N NH2 . ARG C 1 26  ? 7.458   -13.241 -3.211  1.000 27.066 0 355 ARG EEE NH2 1 ? 11 
ATOM   2681 N N   . LYS C 1 27  ? 6.279   -13.590 4.127   1.000 24.692 0 356 LYS EEE N   1 ? 11 
ATOM   2682 C CA  . LYS C 1 27  ? 5.771   -12.569 5.067   1.000 25.988 0 356 LYS EEE CA  1 ? 11 
ATOM   2683 C C   . LYS C 1 27  ? 5.844   -11.212 4.367   1.000 25.684 0 356 LYS EEE C   1 ? 11 
ATOM   2684 O O   . LYS C 1 27  ? 6.910   -10.851 3.875   1.000 23.704 0 356 LYS EEE O   1 ? 11 
ATOM   2685 C CB  . LYS C 1 27  ? 6.535   -12.566 6.391   1.000 27.978 0 356 LYS EEE CB  1 ? 11 
ATOM   2686 C CG  . LYS C 1 27  ? 6.041   -11.498 7.362   1.000 30.967 0 356 LYS EEE CG  1 ? 11 
ATOM   2687 C CD  . LYS C 1 27  ? 6.342   -11.762 8.812   1.000 35.270 0 356 LYS EEE CD  1 ? 11 
ATOM   2688 C CE  . LYS C 1 27  ? 5.746   -10.723 9.736   1.000 36.246 0 356 LYS EEE CE  1 ? 11 
ATOM   2689 N NZ  . LYS C 1 27  ? 4.301   -10.950 9.975   1.000 39.533 0 356 LYS EEE NZ  1 ? 11 
ATOM   2690 N N   . ARG C 1 28  ? 4.710   -10.519 4.304   1.000 27.724 0 357 ARG EEE N   1 ? 11 
ATOM   2691 C CA  . ARG C 1 28  ? 4.628   -9.133  3.775   1.000 27.740 0 357 ARG EEE CA  1 ? 11 
ATOM   2692 C C   . ARG C 1 28  ? 4.996   -8.185  4.911   1.000 27.614 0 357 ARG EEE C   1 ? 11 
ATOM   2693 O O   . ARG C 1 28  ? 4.384   -8.289  6.002   1.000 29.629 0 357 ARG EEE O   1 ? 11 
ATOM   2694 C CB  . ARG C 1 28  ? 3.234   -8.822  3.226   1.000 28.245 0 357 ARG EEE CB  1 ? 11 
ATOM   2695 C CG  . ARG C 1 28  ? 3.164   -7.483  2.504   1.000 29.762 0 357 ARG EEE CG  1 ? 11 
ATOM   2696 C CD  . ARG C 1 28  ? 1.775   -7.218  1.941   1.000 31.750 0 357 ARG EEE CD  1 ? 11 
ATOM   2697 N NE  . ARG C 1 28  ? 0.820   -7.125  3.029   1.000 32.543 0 357 ARG EEE NE  1 ? 11 
ATOM   2698 C CZ  . ARG C 1 28  ? 0.678   -6.068  3.820   1.000 36.926 0 357 ARG EEE CZ  1 ? 11 
ATOM   2699 N NH1 . ARG C 1 28  ? 1.399   -4.971  3.629   1.000 39.445 0 357 ARG EEE NH1 1 ? 11 
ATOM   2700 N NH2 . ARG C 1 28  ? -0.216  -6.090  4.791   1.000 39.517 0 357 ARG EEE NH2 1 ? 11 
ATOM   2701 N N   . ILE C 1 29  ? 5.981   -7.322  4.661   1.000 27.039 0 358 ILE EEE N   1 ? 11 
ATOM   2702 C CA  . ILE C 1 29  ? 6.502   -6.311  5.618   1.000 29.036 0 358 ILE EEE CA  1 ? 11 
ATOM   2703 C C   . ILE C 1 29  ? 6.043   -4.943  5.106   1.000 29.526 0 358 ILE EEE C   1 ? 11 
ATOM   2704 O O   . ILE C 1 29  ? 6.300   -4.650  3.920   1.000 27.758 0 358 ILE EEE O   1 ? 11 
ATOM   2705 C CB  . ILE C 1 29  ? 8.038   -6.397  5.738   1.000 29.673 0 358 ILE EEE CB  1 ? 11 
ATOM   2706 C CG1 . ILE C 1 29  ? 8.507   -7.789  6.179   1.000 32.851 0 358 ILE EEE CG1 1 ? 11 
ATOM   2707 C CG2 . ILE C 1 29  ? 8.573   -5.303  6.659   1.000 32.018 0 358 ILE EEE CG2 1 ? 11 
ATOM   2708 C CD1 . ILE C 1 29  ? 8.365   -8.048  7.643   1.000 34.327 0 358 ILE EEE CD1 1 ? 11 
ATOM   2709 N N   . SER C 1 30  ? 5.376   -4.148  5.938   1.000 30.297 0 359 SER EEE N   1 ? 11 
ATOM   2710 C CA  . SER C 1 30  ? 4.897   -2.797  5.540   1.000 31.021 0 359 SER EEE CA  1 ? 11 
ATOM   2711 C C   . SER C 1 30  ? 4.728   -1.894  6.764   1.000 32.259 0 359 SER EEE C   1 ? 11 
ATOM   2712 O O   . SER C 1 30  ? 4.718   -2.415  7.907   1.000 31.659 0 359 SER EEE O   1 ? 11 
ATOM   2713 C CB  . SER C 1 30  ? 3.631   -2.874  4.732   1.000 34.140 0 359 SER EEE CB  1 ? 11 
ATOM   2714 O OG  . SER C 1 30  ? 2.494   -3.044  5.567   1.000 39.382 0 359 SER EEE OG  1 ? 11 
ATOM   2715 N N   . ASN C 1 31  ? 4.602   -0.590  6.512   1.000 31.765 0 360 ASN EEE N   1 ? 11 
ATOM   2716 C CA  . ASN C 1 31  ? 4.269   0.427   7.549   1.000 34.872 0 360 ASN EEE CA  1 ? 11 
ATOM   2717 C C   . ASN C 1 31  ? 5.249   0.306   8.716   1.000 33.884 0 360 ASN EEE C   1 ? 11 
ATOM   2718 O O   . ASN C 1 31  ? 4.786   0.161   9.870   1.000 36.145 0 360 ASN EEE O   1 ? 11 
ATOM   2719 C CB  . ASN C 1 31  ? 2.830   0.282   8.040   1.000 37.837 0 360 ASN EEE CB  1 ? 11 
ATOM   2720 C CG  . ASN C 1 31  ? 1.834   0.444   6.917   1.000 41.834 0 360 ASN EEE CG  1 ? 11 
ATOM   2721 O OD1 . ASN C 1 31  ? 1.312   -0.546  6.418   1.000 46.955 0 360 ASN EEE OD1 1 ? 11 
ATOM   2722 N ND2 . ASN C 1 31  ? 1.619   1.673   6.477   1.000 47.288 0 360 ASN EEE ND2 1 ? 11 
ATOM   2723 N N   . CYS C 1 32  ? 6.556   0.348   8.427   1.000 30.812 0 361 CYS EEE N   1 ? 11 
ATOM   2724 C CA  . CYS C 1 32  ? 7.589   0.142   9.465   1.000 31.205 0 361 CYS EEE CA  1 ? 11 
ATOM   2725 C C   . CYS C 1 32  ? 8.950   0.675   9.010   1.000 31.229 0 361 CYS EEE C   1 ? 11 
ATOM   2726 O O   . CYS C 1 32  ? 9.164   0.903   7.797   1.000 29.655 0 361 CYS EEE O   1 ? 11 
ATOM   2727 C CB  . CYS C 1 32  ? 7.661   -1.332  9.852   1.000 29.536 0 361 CYS EEE CB  1 ? 11 
ATOM   2728 S SG  . CYS C 1 32  ? 8.036   -2.441  8.469   1.000 28.680 0 361 CYS EEE SG  1 ? 11 
ATOM   2729 N N   . VAL C 1 33  ? 9.840   0.855   9.979   1.000 33.418 0 362 VAL EEE N   1 ? 11 
ATOM   2730 C CA  . VAL C 1 33  ? 11.248  1.301   9.775   1.000 35.001 0 362 VAL EEE CA  1 ? 11 
ATOM   2731 C C   . VAL C 1 33  ? 12.154  0.071   9.890   1.000 35.816 0 362 VAL EEE C   1 ? 11 
ATOM   2732 O O   . VAL C 1 33  ? 12.009  -0.688  10.870  1.000 33.540 0 362 VAL EEE O   1 ? 11 
ATOM   2733 C CB  . VAL C 1 33  ? 11.635  2.417   10.767  1.000 37.819 0 362 VAL EEE CB  1 ? 11 
ATOM   2734 C CG1 . VAL C 1 33  ? 11.149  2.126   12.177  1.000 40.218 0 362 VAL EEE CG1 1 ? 11 
ATOM   2735 C CG2 . VAL C 1 33  ? 13.128  2.701   10.758  1.000 39.456 0 362 VAL EEE CG2 1 ? 11 
ATOM   2736 N N   . ALA C 1 34  ? 13.036  -0.115  8.910   1.000 35.283 0 363 ALA EEE N   1 ? 11 
ATOM   2737 C CA  . ALA C 1 34  ? 13.979  -1.251  8.813   1.000 38.556 0 363 ALA EEE CA  1 ? 11 
ATOM   2738 C C   . ALA C 1 34  ? 15.415  -0.717  8.808   1.000 37.487 0 363 ALA EEE C   1 ? 11 
ATOM   2739 O O   . ALA C 1 34  ? 15.704  0.151   7.977   1.000 35.370 0 363 ALA EEE O   1 ? 11 
ATOM   2740 C CB  . ALA C 1 34  ? 13.682  -2.018  7.549   1.000 38.863 0 363 ALA EEE CB  1 ? 11 
ATOM   2741 N N   . ASP C 1 35  ? 16.279  -1.212  9.699   1.000 37.781 0 364 ASP EEE N   1 ? 11 
ATOM   2742 C CA  . ASP C 1 35  ? 17.744  -0.954  9.634   1.000 37.982 0 364 ASP EEE CA  1 ? 11 
ATOM   2743 C C   . ASP C 1 35  ? 18.399  -2.117  8.877   1.000 38.217 0 364 ASP EEE C   1 ? 11 
ATOM   2744 O O   . ASP C 1 35  ? 18.829  -3.091  9.526   1.000 37.964 0 364 ASP EEE O   1 ? 11 
ATOM   2745 C CB  . ASP C 1 35  ? 18.350  -0.739  11.020  1.000 41.279 0 364 ASP EEE CB  1 ? 11 
ATOM   2746 C CG  . ASP C 1 35  ? 19.783  -0.230  10.962  1.000 44.457 0 364 ASP EEE CG  1 ? 11 
ATOM   2747 O OD1 . ASP C 1 35  ? 20.418  -0.359  9.888   1.000 42.269 0 364 ASP EEE OD1 1 ? 11 
ATOM   2748 O OD2 . ASP C 1 35  ? 20.236  0.347   11.970  1.000 52.141 0 364 ASP EEE OD2 1 ? 11 
ATOM   2749 N N   . TYR C 1 36  ? 18.454  -2.019  7.550   1.000 33.331 0 365 TYR EEE N   1 ? 11 
ATOM   2750 C CA  . TYR C 1 36  ? 19.035  -3.038  6.641   1.000 33.136 0 365 TYR EEE CA  1 ? 11 
ATOM   2751 C C   . TYR C 1 36  ? 20.543  -3.151  6.875   1.000 34.021 0 365 TYR EEE C   1 ? 11 
ATOM   2752 O O   . TYR C 1 36  ? 21.086  -4.262  6.730   1.000 32.384 0 365 TYR EEE O   1 ? 11 
ATOM   2753 C CB  . TYR C 1 36  ? 18.757  -2.681  5.178   1.000 32.944 0 365 TYR EEE CB  1 ? 11 
ATOM   2754 C CG  . TYR C 1 36  ? 17.295  -2.669  4.818   1.000 32.356 0 365 TYR EEE CG  1 ? 11 
ATOM   2755 C CD1 . TYR C 1 36  ? 16.599  -3.842  4.575   1.000 32.057 0 365 TYR EEE CD1 1 ? 11 
ATOM   2756 C CD2 . TYR C 1 36  ? 16.600  -1.475  4.735   1.000 34.157 0 365 TYR EEE CD2 1 ? 11 
ATOM   2757 C CE1 . TYR C 1 36  ? 15.254  -3.828  4.245   1.000 34.899 0 365 TYR EEE CE1 1 ? 11 
ATOM   2758 C CE2 . TYR C 1 36  ? 15.255  -1.445  4.406   1.000 34.509 0 365 TYR EEE CE2 1 ? 11 
ATOM   2759 C CZ  . TYR C 1 36  ? 14.581  -2.622  4.159   1.000 35.989 0 365 TYR EEE CZ  1 ? 11 
ATOM   2760 O OH  . TYR C 1 36  ? 13.256  -2.561  3.838   1.000 41.355 0 365 TYR EEE OH  1 ? 11 
ATOM   2761 N N   . SER C 1 37  ? 21.201  -2.038  7.205   1.000 34.023 0 366 SER EEE N   1 ? 11 
ATOM   2762 C CA  . SER C 1 37  ? 22.676  -1.975  7.386   1.000 37.396 0 366 SER EEE CA  1 ? 11 
ATOM   2763 C C   . SER C 1 37  ? 23.106  -2.951  8.487   1.000 39.646 0 366 SER EEE C   1 ? 11 
ATOM   2764 O O   . SER C 1 37  ? 24.163  -3.586  8.328   1.000 39.923 0 366 SER EEE O   1 ? 11 
ATOM   2765 C CB  . SER C 1 37  ? 23.145  -0.573  7.658   1.000 40.838 0 366 SER EEE CB  1 ? 11 
ATOM   2766 O OG  . SER C 1 37  ? 23.003  0.215   6.482   1.000 46.492 0 366 SER EEE OG  1 ? 11 
ATOM   2767 N N   . VAL C 1 38  ? 22.315  -3.079  9.554   1.000 40.057 0 367 VAL EEE N   1 ? 11 
ATOM   2768 C CA  . VAL C 1 38  ? 22.623  -3.984  10.700  1.000 39.918 0 367 VAL EEE CA  1 ? 11 
ATOM   2769 C C   . VAL C 1 38  ? 22.538  -5.443  10.221  1.000 39.541 0 367 VAL EEE C   1 ? 11 
ATOM   2770 O O   . VAL C 1 38  ? 23.384  -6.251  10.662  1.000 43.083 0 367 VAL EEE O   1 ? 11 
ATOM   2771 C CB  . VAL C 1 38  ? 21.700  -3.680  11.897  1.000 44.171 0 367 VAL EEE CB  1 ? 11 
ATOM   2772 C CG1 . VAL C 1 38  ? 21.795  -4.737  12.989  1.000 45.872 0 367 VAL EEE CG1 1 ? 11 
ATOM   2773 C CG2 . VAL C 1 38  ? 21.976  -2.295  12.465  1.000 45.748 0 367 VAL EEE CG2 1 ? 11 
ATOM   2774 N N   . LEU C 1 39  ? 21.583  -5.786  9.340   1.000 34.445 0 368 LEU EEE N   1 ? 11 
ATOM   2775 C CA  . LEU C 1 39  ? 21.519  -7.136  8.711   1.000 33.453 0 368 LEU EEE CA  1 ? 11 
ATOM   2776 C C   . LEU C 1 39  ? 22.737  -7.296  7.802   1.000 31.091 0 368 LEU EEE C   1 ? 11 
ATOM   2777 O O   . LEU C 1 39  ? 23.429  -8.313  7.908   1.000 30.155 0 368 LEU EEE O   1 ? 11 
ATOM   2778 C CB  . LEU C 1 39  ? 20.234  -7.317  7.898   1.000 33.828 0 368 LEU EEE CB  1 ? 11 
ATOM   2779 C CG  . LEU C 1 39  ? 18.928  -7.316  8.684   1.000 35.606 0 368 LEU EEE CG  1 ? 11 
ATOM   2780 C CD1 . LEU C 1 39  ? 17.748  -7.361  7.727   1.000 35.011 0 368 LEU EEE CD1 1 ? 11 
ATOM   2781 C CD2 . LEU C 1 39  ? 18.878  -8.492  9.645   1.000 36.756 0 368 LEU EEE CD2 1 ? 11 
ATOM   2782 N N   . TYR C 1 40  ? 22.993  -6.310  6.939   1.000 30.521 0 369 TYR EEE N   1 ? 11 
ATOM   2783 C CA  . TYR C 1 40  ? 24.036  -6.416  5.886   1.000 31.774 0 369 TYR EEE CA  1 ? 11 
ATOM   2784 C C   . TYR C 1 40  ? 25.422  -6.561  6.525   1.000 32.597 0 369 TYR EEE C   1 ? 11 
ATOM   2785 O O   . TYR C 1 40  ? 26.261  -7.283  5.966   1.000 35.643 0 369 TYR EEE O   1 ? 11 
ATOM   2786 C CB  . TYR C 1 40  ? 23.971  -5.225  4.930   1.000 32.242 0 369 TYR EEE CB  1 ? 11 
ATOM   2787 C CG  . TYR C 1 40  ? 24.990  -5.269  3.818   1.000 34.332 0 369 TYR EEE CG  1 ? 11 
ATOM   2788 C CD1 . TYR C 1 40  ? 25.122  -6.397  3.025   1.000 32.978 0 369 TYR EEE CD1 1 ? 11 
ATOM   2789 C CD2 . TYR C 1 40  ? 25.797  -4.180  3.537   1.000 35.062 0 369 TYR EEE CD2 1 ? 11 
ATOM   2790 C CE1 . TYR C 1 40  ? 26.050  -6.456  1.997   1.000 35.099 0 369 TYR EEE CE1 1 ? 11 
ATOM   2791 C CE2 . TYR C 1 40  ? 26.735  -4.226  2.518   1.000 37.991 0 369 TYR EEE CE2 1 ? 11 
ATOM   2792 C CZ  . TYR C 1 40  ? 26.855  -5.366  1.741   1.000 37.800 0 369 TYR EEE CZ  1 ? 11 
ATOM   2793 O OH  . TYR C 1 40  ? 27.758  -5.432  0.722   1.000 42.304 0 369 TYR EEE OH  1 ? 11 
ATOM   2794 N N   . ASN C 1 41  ? 25.656  -5.892  7.652   1.000 35.212 0 370 ASN EEE N   1 ? 11 
ATOM   2795 C CA  . ASN C 1 41  ? 26.984  -5.857  8.317   1.000 39.064 0 370 ASN EEE CA  1 ? 11 
ATOM   2796 C C   . ASN C 1 41  ? 27.068  -6.942  9.399   1.000 37.908 0 370 ASN EEE C   1 ? 11 
ATOM   2797 O O   . ASN C 1 41  ? 28.109  -6.991  10.078  1.000 40.092 0 370 ASN EEE O   1 ? 11 
ATOM   2798 C CB  . ASN C 1 41  ? 27.286  -4.452  8.834   1.000 41.934 0 370 ASN EEE CB  1 ? 11 
ATOM   2799 C CG  . ASN C 1 41  ? 27.414  -3.451  7.704   1.000 46.146 0 370 ASN EEE CG  1 ? 11 
ATOM   2800 O OD1 . ASN C 1 41  ? 27.895  -3.789  6.620   1.000 44.405 0 370 ASN EEE OD1 1 ? 11 
ATOM   2801 N ND2 . ASN C 1 41  ? 26.961  -2.228  7.934   1.000 48.004 0 370 ASN EEE ND2 1 ? 11 
ATOM   2802 N N   . SER C 1 42  ? 26.043  -7.792  9.533   1.000 37.296 0 371 SER EEE N   1 ? 11 
ATOM   2803 C CA  . SER C 1 42  ? 26.030  -8.979  10.426  1.000 37.192 0 371 SER EEE CA  1 ? 11 
ATOM   2804 C C   . SER C 1 42  ? 27.081  -9.996  9.959   1.000 38.399 0 371 SER EEE C   1 ? 11 
ATOM   2805 O O   . SER C 1 42  ? 27.137  -10.270 8.744   1.000 43.150 0 371 SER EEE O   1 ? 11 
ATOM   2806 C CB  . SER C 1 42  ? 24.670  -9.628  10.463  1.000 34.767 0 371 SER EEE CB  1 ? 11 
ATOM   2807 O OG  . SER C 1 42  ? 24.638  -10.689 11.406  1.000 35.905 0 371 SER EEE OG  1 ? 11 
ATOM   2808 N N   . ALA C 1 43  ? 27.803  -10.607 10.898  1.000 35.749 0 372 ALA EEE N   1 ? 11 
ATOM   2809 C CA  . ALA C 1 43  ? 28.708  -11.752 10.649  1.000 36.272 0 372 ALA EEE CA  1 ? 11 
ATOM   2810 C C   . ALA C 1 43  ? 27.909  -13.060 10.575  1.000 34.532 0 372 ALA EEE C   1 ? 11 
ATOM   2811 O O   . ALA C 1 43  ? 28.524  -14.092 10.298  1.000 34.403 0 372 ALA EEE O   1 ? 11 
ATOM   2812 C CB  . ALA C 1 43  ? 29.757  -11.818 11.731  1.000 40.041 0 372 ALA EEE CB  1 ? 11 
ATOM   2813 N N   . SER C 1 44  ? 26.591  -13.018 10.798  1.000 33.441 0 373 SER EEE N   1 ? 11 
ATOM   2814 C CA  . SER C 1 44  ? 25.712  -14.211 10.897  1.000 33.774 0 373 SER EEE CA  1 ? 11 
ATOM   2815 C C   . SER C 1 44  ? 25.524  -14.888 9.533   1.000 29.956 0 373 SER EEE C   1 ? 11 
ATOM   2816 O O   . SER C 1 44  ? 25.138  -16.061 9.528   1.000 30.168 0 373 SER EEE O   1 ? 11 
ATOM   2817 C CB  . SER C 1 44  ? 24.360  -13.844 11.482  1.000 36.378 0 373 SER EEE CB  1 ? 11 
ATOM   2818 O OG  . SER C 1 44  ? 24.483  -13.493 12.850  1.000 41.984 0 373 SER EEE OG  1 ? 11 
ATOM   2819 N N   . PHE C 1 45  ? 25.713  -14.171 8.422   1.000 28.899 0 374 PHE EEE N   1 ? 11 
ATOM   2820 C CA  . PHE C 1 45  ? 25.247  -14.602 7.078   1.000 26.334 0 374 PHE EEE CA  1 ? 11 
ATOM   2821 C C   . PHE C 1 45  ? 26.430  -14.969 6.184   1.000 28.206 0 374 PHE EEE C   1 ? 11 
ATOM   2822 O O   . PHE C 1 45  ? 27.356  -14.155 6.074   1.000 30.659 0 374 PHE EEE O   1 ? 11 
ATOM   2823 C CB  . PHE C 1 45  ? 24.408  -13.508 6.434   1.000 25.522 0 374 PHE EEE CB  1 ? 11 
ATOM   2824 C CG  . PHE C 1 45  ? 23.251  -13.072 7.286   1.000 24.179 0 374 PHE EEE CG  1 ? 11 
ATOM   2825 C CD1 . PHE C 1 45  ? 22.327  -13.996 7.741   1.000 23.527 0 374 PHE EEE CD1 1 ? 11 
ATOM   2826 C CD2 . PHE C 1 45  ? 23.075  -11.734 7.614   1.000 24.895 0 374 PHE EEE CD2 1 ? 11 
ATOM   2827 C CE1 . PHE C 1 45  ? 21.260  -13.594 8.529   1.000 22.775 0 374 PHE EEE CE1 1 ? 11 
ATOM   2828 C CE2 . PHE C 1 45  ? 21.995  -11.338 8.383   1.000 24.172 0 374 PHE EEE CE2 1 ? 11 
ATOM   2829 C CZ  . PHE C 1 45  ? 21.092  -12.271 8.840   1.000 23.444 0 374 PHE EEE CZ  1 ? 11 
ATOM   2830 N N   . SER C 1 46  ? 26.384  -16.148 5.558   1.000 28.268 0 375 SER EEE N   1 ? 11 
ATOM   2831 C CA  . SER C 1 46  ? 27.442  -16.603 4.616   1.000 29.050 0 375 SER EEE CA  1 ? 11 
ATOM   2832 C C   . SER C 1 46  ? 27.119  -16.131 3.193   1.000 27.890 0 375 SER EEE C   1 ? 11 
ATOM   2833 O O   . SER C 1 46  ? 28.051  -16.047 2.376   1.000 28.376 0 375 SER EEE O   1 ? 11 
ATOM   2834 C CB  . SER C 1 46  ? 27.639  -18.090 4.683   1.000 29.239 0 375 SER EEE CB  1 ? 11 
ATOM   2835 O OG  . SER C 1 46  ? 26.413  -18.777 4.533   1.000 29.553 0 375 SER EEE OG  1 ? 11 
ATOM   2836 N N   . THR C 1 47  ? 25.847  -15.843 2.900   1.000 24.307 0 376 THR EEE N   1 ? 11 
ATOM   2837 C CA  . THR C 1 47  ? 25.399  -15.208 1.629   1.000 24.626 0 376 THR EEE CA  1 ? 11 
ATOM   2838 C C   . THR C 1 47  ? 24.605  -13.944 1.959   1.000 24.581 0 376 THR EEE C   1 ? 11 
ATOM   2839 O O   . THR C 1 47  ? 23.696  -14.015 2.802   1.000 23.567 0 376 THR EEE O   1 ? 11 
ATOM   2840 C CB  . THR C 1 47  ? 24.548  -16.162 0.784   1.000 24.472 0 376 THR EEE CB  1 ? 11 
ATOM   2841 O OG1 . THR C 1 47  ? 25.351  -17.297 0.444   1.000 26.182 0 376 THR EEE OG1 1 ? 11 
ATOM   2842 C CG2 . THR C 1 47  ? 23.986  -15.503 -0.460  1.000 24.957 0 376 THR EEE CG2 1 ? 11 
ATOM   2843 N N   . PHE C 1 48  ? 24.942  -12.825 1.319   1.000 25.140 0 377 PHE EEE N   1 ? 11 
ATOM   2844 C CA  . PHE C 1 48  ? 24.097  -11.611 1.311   1.000 25.990 0 377 PHE EEE CA  1 ? 11 
ATOM   2845 C C   . PHE C 1 48  ? 24.335  -10.922 -0.030  1.000 28.128 0 377 PHE EEE C   1 ? 11 
ATOM   2846 O O   . PHE C 1 48  ? 25.273  -10.114 -0.110  1.000 28.150 0 377 PHE EEE O   1 ? 11 
ATOM   2847 C CB  . PHE C 1 48  ? 24.407  -10.730 2.523   1.000 26.912 0 377 PHE EEE CB  1 ? 11 
ATOM   2848 C CG  . PHE C 1 48  ? 23.300  -9.787  2.916   1.000 25.878 0 377 PHE EEE CG  1 ? 11 
ATOM   2849 C CD1 . PHE C 1 48  ? 22.750  -8.898  2.006   1.000 26.405 0 377 PHE EEE CD1 1 ? 11 
ATOM   2850 C CD2 . PHE C 1 48  ? 22.813  -9.778  4.217   1.000 26.562 0 377 PHE EEE CD2 1 ? 11 
ATOM   2851 C CE1 . PHE C 1 48  ? 21.733  -8.039  2.383   1.000 28.049 0 377 PHE EEE CE1 1 ? 11 
ATOM   2852 C CE2 . PHE C 1 48  ? 21.796  -8.914  4.592   1.000 27.541 0 377 PHE EEE CE2 1 ? 11 
ATOM   2853 C CZ  . PHE C 1 48  ? 21.252  -8.050  3.674   1.000 27.084 0 377 PHE EEE CZ  1 ? 11 
ATOM   2854 N N   . LYS C 1 49  ? 23.550  -11.297 -1.040  1.000 28.108 0 378 LYS EEE N   1 ? 11 
ATOM   2855 C CA  . LYS C 1 49  ? 23.722  -10.864 -2.451  1.000 29.519 0 378 LYS EEE CA  1 ? 11 
ATOM   2856 C C   . LYS C 1 49  ? 22.478  -10.099 -2.884  1.000 27.768 0 378 LYS EEE C   1 ? 11 
ATOM   2857 O O   . LYS C 1 49  ? 21.364  -10.656 -2.794  1.000 25.652 0 378 LYS EEE O   1 ? 11 
ATOM   2858 C CB  . LYS C 1 49  ? 23.974  -12.076 -3.349  1.000 32.461 0 378 LYS EEE CB  1 ? 11 
ATOM   2859 C CG  . LYS C 1 49  ? 25.294  -12.782 -3.072  1.000 40.674 0 378 LYS EEE CG  1 ? 11 
ATOM   2860 C CD  . LYS C 1 49  ? 25.539  -14.018 -3.925  1.000 45.401 0 378 LYS EEE CD  1 ? 11 
ATOM   2861 C CE  . LYS C 1 49  ? 26.872  -14.678 -3.636  1.000 49.755 0 378 LYS EEE CE  1 ? 11 
ATOM   2862 N NZ  . LYS C 1 49  ? 27.214  -15.689 -4.668  1.000 54.495 0 378 LYS EEE NZ  1 ? 11 
ATOM   2863 N N   . CYS C 1 50  ? 22.649  -8.857  -3.327  1.000 27.816 0 379 CYS EEE N   1 ? 11 
ATOM   2864 C CA  . CYS C 1 50  ? 21.512  -8.007  -3.751  1.000 29.083 0 379 CYS EEE CA  1 ? 11 
ATOM   2865 C C   . CYS C 1 50  ? 21.553  -7.845  -5.270  1.000 29.643 0 379 CYS EEE C   1 ? 11 
ATOM   2866 O O   . CYS C 1 50  ? 22.654  -7.890  -5.864  1.000 31.650 0 379 CYS EEE O   1 ? 11 
ATOM   2867 C CB  . CYS C 1 50  ? 21.503  -6.669  -3.024  1.000 31.192 0 379 CYS EEE CB  1 ? 11 
ATOM   2868 S SG  . CYS C 1 50  ? 21.376  -6.847  -1.225  1.000 31.349 0 379 CYS EEE SG  1 ? 11 
ATOM   2869 N N   . TYR C 1 51  ? 20.370  -7.687  -5.845  1.000 28.784 0 380 TYR EEE N   1 ? 11 
ATOM   2870 C CA  . TYR C 1 51  ? 20.100  -7.531  -7.291  1.000 30.626 0 380 TYR EEE CA  1 ? 11 
ATOM   2871 C C   . TYR C 1 51  ? 19.192  -6.307  -7.476  1.000 29.249 0 380 TYR EEE C   1 ? 11 
ATOM   2872 O O   . TYR C 1 51  ? 18.173  -6.176  -6.761  1.000 29.447 0 380 TYR EEE O   1 ? 11 
ATOM   2873 C CB  . TYR C 1 51  ? 19.476  -8.828  -7.813  1.000 29.901 0 380 TYR EEE CB  1 ? 11 
ATOM   2874 C CG  . TYR C 1 51  ? 20.306  -10.060 -7.554  1.000 29.372 0 380 TYR EEE CG  1 ? 11 
ATOM   2875 C CD1 . TYR C 1 51  ? 21.261  -10.473 -8.475  1.000 31.696 0 380 TYR EEE CD1 1 ? 11 
ATOM   2876 C CD2 . TYR C 1 51  ? 20.154  -10.811 -6.394  1.000 29.024 0 380 TYR EEE CD2 1 ? 11 
ATOM   2877 C CE1 . TYR C 1 51  ? 22.036  -11.599 -8.254  1.000 32.076 0 380 TYR EEE CE1 1 ? 11 
ATOM   2878 C CE2 . TYR C 1 51  ? 20.927  -11.939 -6.162  1.000 29.534 0 380 TYR EEE CE2 1 ? 11 
ATOM   2879 C CZ  . TYR C 1 51  ? 21.870  -12.334 -7.097  1.000 30.103 0 380 TYR EEE CZ  1 ? 11 
ATOM   2880 O OH  . TYR C 1 51  ? 22.644  -13.444 -6.894  1.000 31.369 0 380 TYR EEE OH  1 ? 11 
ATOM   2881 N N   . GLY C 1 52  ? 19.553  -5.412  -8.395  1.000 32.701 0 381 GLY EEE N   1 ? 11 
ATOM   2882 C CA  . GLY C 1 52  ? 18.718  -4.251  -8.762  1.000 32.420 0 381 GLY EEE CA  1 ? 11 
ATOM   2883 C C   . GLY C 1 52  ? 18.768  -3.114  -7.749  1.000 34.759 0 381 GLY EEE C   1 ? 11 
ATOM   2884 O O   . GLY C 1 52  ? 18.178  -2.064  -8.043  1.000 35.233 0 381 GLY EEE O   1 ? 11 
ATOM   2885 N N   . VAL C 1 53  ? 19.450  -3.295  -6.613  1.000 34.632 0 382 VAL EEE N   1 ? 11 
ATOM   2886 C CA  . VAL C 1 53  ? 19.634  -2.268  -5.544  1.000 36.895 0 382 VAL EEE CA  1 ? 11 
ATOM   2887 C C   . VAL C 1 53  ? 20.991  -2.520  -4.884  1.000 33.741 0 382 VAL EEE C   1 ? 11 
ATOM   2888 O O   . VAL C 1 53  ? 21.397  -3.694  -4.821  1.000 33.622 0 382 VAL EEE O   1 ? 11 
ATOM   2889 C CB  . VAL C 1 53  ? 18.516  -2.311  -4.483  1.000 40.320 0 382 VAL EEE CB  1 ? 11 
ATOM   2890 C CG1 . VAL C 1 53  ? 17.191  -1.809  -5.026  1.000 47.791 0 382 VAL EEE CG1 1 ? 11 
ATOM   2891 C CG2 . VAL C 1 53  ? 18.360  -3.693  -3.864  1.000 38.698 0 382 VAL EEE CG2 1 ? 11 
ATOM   2892 N N   . SER C 1 54  ? 21.649  -1.468  -4.396  1.000 34.665 0 383 SER EEE N   1 ? 11 
ATOM   2893 C CA  . SER C 1 54  ? 22.879  -1.568  -3.570  1.000 35.879 0 383 SER EEE CA  1 ? 11 
ATOM   2894 C C   . SER C 1 54  ? 22.483  -1.778  -2.112  1.000 33.198 0 383 SER EEE C   1 ? 11 
ATOM   2895 O O   . SER C 1 54  ? 21.674  -1.027  -1.574  1.000 31.224 0 383 SER EEE O   1 ? 11 
ATOM   2896 C CB  . SER C 1 54  ? 23.761  -0.363  -3.707  1.000 39.798 0 383 SER EEE CB  1 ? 11 
ATOM   2897 O OG  . SER C 1 54  ? 24.919  -0.517  -2.891  1.000 45.070 0 383 SER EEE OG  1 ? 11 
ATOM   2898 N N   . PRO C 1 55  ? 23.061  -2.776  -1.413  1.000 31.452 0 384 PRO EEE N   1 ? 11 
ATOM   2899 C CA  . PRO C 1 55  ? 22.764  -2.979  0.007   1.000 31.295 0 384 PRO EEE CA  1 ? 11 
ATOM   2900 C C   . PRO C 1 55  ? 23.144  -1.762  0.864   1.000 31.089 0 384 PRO EEE C   1 ? 11 
ATOM   2901 O O   . PRO C 1 55  ? 22.500  -1.532  1.858   1.000 32.647 0 384 PRO EEE O   1 ? 11 
ATOM   2902 C CB  . PRO C 1 55  ? 23.606  -4.217  0.371   1.000 31.974 0 384 PRO EEE CB  1 ? 11 
ATOM   2903 C CG  . PRO C 1 55  ? 24.711  -4.224  -0.657  1.000 33.753 0 384 PRO EEE CG  1 ? 11 
ATOM   2904 C CD  . PRO C 1 55  ? 24.037  -3.745  -1.926  1.000 33.303 0 384 PRO EEE CD  1 ? 11 
ATOM   2905 N N   . THR C 1 56  ? 24.141  -0.978  0.439   1.000 30.539 0 385 THR EEE N   1 ? 11 
ATOM   2906 C CA  . THR C 1 56  ? 24.645  0.191   1.208   1.000 32.379 0 385 THR EEE CA  1 ? 11 
ATOM   2907 C C   . THR C 1 56  ? 23.644  1.350   1.127   1.000 33.059 0 385 THR EEE C   1 ? 11 
ATOM   2908 O O   . THR C 1 56  ? 23.764  2.259   1.966   1.000 33.846 0 385 THR EEE O   1 ? 11 
ATOM   2909 C CB  . THR C 1 56  ? 26.036  0.623   0.733   1.000 33.974 0 385 THR EEE CB  1 ? 11 
ATOM   2910 O OG1 . THR C 1 56  ? 25.919  1.038   -0.626  1.000 34.694 0 385 THR EEE OG1 1 ? 11 
ATOM   2911 C CG2 . THR C 1 56  ? 27.063  -0.481  0.857   1.000 36.275 0 385 THR EEE CG2 1 ? 11 
ATOM   2912 N N   . LYS C 1 57  ? 22.702  1.320   0.177   1.000 31.003 0 386 LYS EEE N   1 ? 11 
ATOM   2913 C CA  . LYS C 1 57  ? 21.713  2.418   -0.036  1.000 33.032 0 386 LYS EEE CA  1 ? 11 
ATOM   2914 C C   . LYS C 1 57  ? 20.372  2.097   0.631   1.000 31.930 0 386 LYS EEE C   1 ? 11 
ATOM   2915 O O   . LYS C 1 57  ? 19.532  3.029   0.717   1.000 32.192 0 386 LYS EEE O   1 ? 11 
ATOM   2916 C CB  . LYS C 1 57  ? 21.492  2.655   -1.531  1.000 35.759 0 386 LYS EEE CB  1 ? 11 
ATOM   2917 C CG  . LYS C 1 57  ? 22.719  3.161   -2.281  1.000 40.727 0 386 LYS EEE CG  1 ? 11 
ATOM   2918 C CD  . LYS C 1 57  ? 22.460  3.504   -3.728  1.000 44.312 0 386 LYS EEE CD  1 ? 11 
ATOM   2919 C CE  . LYS C 1 57  ? 23.731  3.890   -4.457  1.000 49.775 0 386 LYS EEE CE  1 ? 11 
ATOM   2920 N NZ  . LYS C 1 57  ? 23.441  4.555   -5.750  1.000 52.894 0 386 LYS EEE NZ  1 ? 11 
ATOM   2921 N N   . LEU C 1 58  ? 20.158  0.848   1.072   1.000 29.898 0 387 LEU EEE N   1 ? 11 
ATOM   2922 C CA  . LEU C 1 58  ? 18.816  0.375   1.508   1.000 28.827 0 387 LEU EEE CA  1 ? 11 
ATOM   2923 C C   . LEU C 1 58  ? 18.286  1.263   2.644   1.000 29.581 0 387 LEU EEE C   1 ? 11 
ATOM   2924 O O   . LEU C 1 58  ? 17.076  1.518   2.652   1.000 27.489 0 387 LEU EEE O   1 ? 11 
ATOM   2925 C CB  . LEU C 1 58  ? 18.876  -1.097  1.937   1.000 28.510 0 387 LEU EEE CB  1 ? 11 
ATOM   2926 C CG  . LEU C 1 58  ? 18.962  -2.117  0.805   1.000 28.602 0 387 LEU EEE CG  1 ? 11 
ATOM   2927 C CD1 . LEU C 1 58  ? 19.099  -3.523  1.367   1.000 29.243 0 387 LEU EEE CD1 1 ? 11 
ATOM   2928 C CD2 . LEU C 1 58  ? 17.746  -2.041  -0.104  1.000 28.630 0 387 LEU EEE CD2 1 ? 11 
ATOM   2929 N N   . ASN C 1 59  ? 19.138  1.736   3.558   1.000 28.309 0 388 ASN EEE N   1 ? 11 
ATOM   2930 C CA  . ASN C 1 59  ? 18.677  2.579   4.691   1.000 30.616 0 388 ASN EEE CA  1 ? 11 
ATOM   2931 C C   . ASN C 1 59  ? 18.154  3.929   4.175   1.000 31.350 0 388 ASN EEE C   1 ? 11 
ATOM   2932 O O   . ASN C 1 59  ? 17.464  4.600   4.940   1.000 32.629 0 388 ASN EEE O   1 ? 11 
ATOM   2933 C CB  . ASN C 1 59  ? 19.763  2.755   5.749   1.000 32.878 0 388 ASN EEE CB  1 ? 11 
ATOM   2934 C CG  . ASN C 1 59  ? 19.789  1.602   6.726   1.000 32.963 0 388 ASN EEE CG  1 ? 11 
ATOM   2935 O OD1 . ASN C 1 59  ? 19.195  0.553   6.478   1.000 33.918 0 388 ASN EEE OD1 1 ? 11 
ATOM   2936 N ND2 . ASN C 1 59  ? 20.456  1.802   7.850   1.000 35.836 0 388 ASN EEE ND2 1 ? 11 
ATOM   2937 N N   . ASP C 1 60  ? 18.447  4.297   2.926   1.000 30.283 0 389 ASP EEE N   1 ? 11 
ATOM   2938 C CA  . ASP C 1 60  ? 18.079  5.625   2.363   1.000 32.303 0 389 ASP EEE CA  1 ? 11 
ATOM   2939 C C   . ASP C 1 60  ? 16.890  5.487   1.398   1.000 30.871 0 389 ASP EEE C   1 ? 11 
ATOM   2940 O O   . ASP C 1 60  ? 16.556  6.489   0.715   1.000 30.971 0 389 ASP EEE O   1 ? 11 
ATOM   2941 C CB  . ASP C 1 60  ? 19.294  6.253   1.685   1.000 35.321 0 389 ASP EEE CB  1 ? 11 
ATOM   2942 C CG  . ASP C 1 60  ? 20.454  6.514   2.638   1.000 39.516 0 389 ASP EEE CG  1 ? 11 
ATOM   2943 O OD1 . ASP C 1 60  ? 20.204  7.026   3.745   1.000 42.648 0 389 ASP EEE OD1 1 ? 11 
ATOM   2944 O OD2 . ASP C 1 60  ? 21.596  6.210   2.258   1.000 44.946 0 389 ASP EEE OD2 1 ? 11 
ATOM   2945 N N   . LEU C 1 61  ? 16.261  4.314   1.334   1.000 28.962 0 390 LEU EEE N   1 ? 11 
ATOM   2946 C CA  . LEU C 1 61  ? 15.173  4.058   0.360   1.000 28.345 0 390 LEU EEE CA  1 ? 11 
ATOM   2947 C C   . LEU C 1 61  ? 13.874  3.713   1.099   1.000 29.003 0 390 LEU EEE C   1 ? 11 
ATOM   2948 O O   . LEU C 1 61  ? 13.919  3.219   2.268   1.000 29.505 0 390 LEU EEE O   1 ? 11 
ATOM   2949 C CB  . LEU C 1 61  ? 15.585  2.918   -0.574  1.000 29.033 0 390 LEU EEE CB  1 ? 11 
ATOM   2950 C CG  . LEU C 1 61  ? 16.878  3.121   -1.360  1.000 28.844 0 390 LEU EEE CG  1 ? 11 
ATOM   2951 C CD1 . LEU C 1 61  ? 17.172  1.893   -2.205  1.000 29.628 0 390 LEU EEE CD1 1 ? 11 
ATOM   2952 C CD2 . LEU C 1 61  ? 16.793  4.355   -2.233  1.000 30.748 0 390 LEU EEE CD2 1 ? 11 
ATOM   2953 N N   . CYS C 1 62  ? 12.754  3.965   0.430   1.000 28.190 0 391 CYS EEE N   1 ? 11 
ATOM   2954 C CA  . CYS C 1 62  ? 11.391  3.616   0.888   1.000 29.833 0 391 CYS EEE CA  1 ? 11 
ATOM   2955 C C   . CYS C 1 62  ? 10.744  2.732   -0.180  1.000 28.619 0 391 CYS EEE C   1 ? 11 
ATOM   2956 O O   . CYS C 1 62  ? 10.881  3.044   -1.382  1.000 30.256 0 391 CYS EEE O   1 ? 11 
ATOM   2957 C CB  . CYS C 1 62  ? 10.542  4.855   1.129   1.000 32.574 0 391 CYS EEE CB  1 ? 11 
ATOM   2958 S SG  . CYS C 1 62  ? 11.096  5.831   2.554   1.000 36.820 0 391 CYS EEE SG  1 ? 11 
ATOM   2959 N N   . PHE C 1 63  ? 10.060  1.677   0.239   1.000 26.400 0 392 PHE EEE N   1 ? 11 
ATOM   2960 C CA  . PHE C 1 63  ? 9.386   0.723   -0.668  1.000 26.847 0 392 PHE EEE CA  1 ? 11 
ATOM   2961 C C   . PHE C 1 63  ? 7.904   0.659   -0.302  1.000 26.173 0 392 PHE EEE C   1 ? 11 
ATOM   2962 O O   . PHE C 1 63  ? 7.536   0.998   0.847   1.000 25.321 0 392 PHE EEE O   1 ? 11 
ATOM   2963 C CB  . PHE C 1 63  ? 10.097  -0.626  -0.599  1.000 25.890 0 392 PHE EEE CB  1 ? 11 
ATOM   2964 C CG  . PHE C 1 63  ? 11.510  -0.562  -1.123  1.000 26.967 0 392 PHE EEE CG  1 ? 11 
ATOM   2965 C CD1 . PHE C 1 63  ? 11.754  -0.460  -2.482  1.000 28.305 0 392 PHE EEE CD1 1 ? 11 
ATOM   2966 C CD2 . PHE C 1 63  ? 12.586  -0.607  -0.259  1.000 30.059 0 392 PHE EEE CD2 1 ? 11 
ATOM   2967 C CE1 . PHE C 1 63  ? 13.053  -0.407  -2.965  1.000 29.739 0 392 PHE EEE CE1 1 ? 11 
ATOM   2968 C CE2 . PHE C 1 63  ? 13.886  -0.550  -0.741  1.000 29.399 0 392 PHE EEE CE2 1 ? 11 
ATOM   2969 C CZ  . PHE C 1 63  ? 14.113  -0.439  -2.094  1.000 30.235 0 392 PHE EEE CZ  1 ? 11 
ATOM   2970 N N   . THR C 1 64  ? 7.079   0.240   -1.256  1.000 26.610 0 393 THR EEE N   1 ? 11 
ATOM   2971 C CA  . THR C 1 64  ? 5.616   0.103   -1.049  1.000 28.802 0 393 THR EEE CA  1 ? 11 
ATOM   2972 C C   . THR C 1 64  ? 5.375   -1.140  -0.184  1.000 28.861 0 393 THR EEE C   1 ? 11 
ATOM   2973 O O   . THR C 1 64  ? 4.482   -1.105  0.674   1.000 30.970 0 393 THR EEE O   1 ? 11 
ATOM   2974 C CB  . THR C 1 64  ? 4.888   0.221   -2.393  1.000 31.724 0 393 THR EEE CB  1 ? 11 
ATOM   2975 O OG1 . THR C 1 64  ? 5.509   -0.649  -3.337  1.000 33.974 0 393 THR EEE OG1 1 ? 11 
ATOM   2976 C CG2 . THR C 1 64  ? 4.911   1.637   -2.930  1.000 33.232 0 393 THR EEE CG2 1 ? 11 
ATOM   2977 N N   . ASN C 1 65  ? 6.175   -2.190  -0.372  1.000 29.602 0 394 ASN EEE N   1 ? 11 
ATOM   2978 C CA  . ASN C 1 65  ? 6.162   -3.409  0.478   1.000 28.073 0 394 ASN EEE CA  1 ? 11 
ATOM   2979 C C   . ASN C 1 65  ? 7.525   -4.073  0.396   1.000 26.509 0 394 ASN EEE C   1 ? 11 
ATOM   2980 O O   . ASN C 1 65  ? 8.246   -3.828  -0.574  1.000 25.659 0 394 ASN EEE O   1 ? 11 
ATOM   2981 C CB  . ASN C 1 65  ? 5.110   -4.439  0.066   1.000 29.678 0 394 ASN EEE CB  1 ? 11 
ATOM   2982 C CG  . ASN C 1 65  ? 3.705   -4.026  0.443   1.000 30.655 0 394 ASN EEE CG  1 ? 11 
ATOM   2983 O OD1 . ASN C 1 65  ? 3.384   -3.866  1.622   1.000 31.059 0 394 ASN EEE OD1 1 ? 11 
ATOM   2984 N ND2 . ASN C 1 65  ? 2.863   -3.840  -0.558  1.000 32.438 0 394 ASN EEE ND2 1 ? 11 
ATOM   2985 N N   . VAL C 1 66  ? 7.855   -4.861  1.415   1.000 25.155 0 395 VAL EEE N   1 ? 11 
ATOM   2986 C CA  . VAL C 1 66  ? 9.004   -5.798  1.389   1.000 25.193 0 395 VAL EEE CA  1 ? 11 
ATOM   2987 C C   . VAL C 1 66  ? 8.415   -7.186  1.646   1.000 24.671 0 395 VAL EEE C   1 ? 11 
ATOM   2988 O O   . VAL C 1 66  ? 7.651   -7.326  2.609   1.000 25.825 0 395 VAL EEE O   1 ? 11 
ATOM   2989 C CB  . VAL C 1 66  ? 10.104  -5.421  2.392   1.000 24.748 0 395 VAL EEE CB  1 ? 11 
ATOM   2990 C CG1 . VAL C 1 66  ? 11.238  -6.436  2.364   1.000 24.967 0 395 VAL EEE CG1 1 ? 11 
ATOM   2991 C CG2 . VAL C 1 66  ? 10.634  -4.019  2.107   1.000 26.887 0 395 VAL EEE CG2 1 ? 11 
ATOM   2992 N N   . TYR C 1 67  ? 8.664   -8.131  0.748   1.000 27.014 0 396 TYR EEE N   1 ? 12 
ATOM   2993 C CA  . TYR C 1 67  ? 8.261   -9.544  0.929   1.000 26.638 0 396 TYR EEE CA  1 ? 12 
ATOM   2994 C C   . TYR C 1 67  ? 9.489   -10.307 1.402   1.000 26.297 0 396 TYR EEE C   1 ? 12 
ATOM   2995 O O   . TYR C 1 67  ? 10.582  -10.132 0.825   1.000 25.932 0 396 TYR EEE O   1 ? 12 
ATOM   2996 C CB  . TYR C 1 67  ? 7.643   -10.104 -0.351  1.000 28.881 0 396 TYR EEE CB  1 ? 12 
ATOM   2997 C CG  . TYR C 1 67  ? 6.455   -9.311  -0.817  1.000 32.139 0 396 TYR EEE CG  1 ? 12 
ATOM   2998 C CD1 . TYR C 1 67  ? 5.188   -9.529  -0.303  1.000 34.722 0 396 TYR EEE CD1 1 ? 12 
ATOM   2999 C CD2 . TYR C 1 67  ? 6.609   -8.302  -1.745  1.000 35.297 0 396 TYR EEE CD2 1 ? 12 
ATOM   3000 C CE1 . TYR C 1 67  ? 4.092   -8.804  -0.742  1.000 38.264 0 396 TYR EEE CE1 1 ? 12 
ATOM   3001 C CE2 . TYR C 1 67  ? 5.530   -7.557  -2.179  1.000 38.266 0 396 TYR EEE CE2 1 ? 12 
ATOM   3002 C CZ  . TYR C 1 67  ? 4.267   -7.797  -1.672  1.000 39.953 0 396 TYR EEE CZ  1 ? 12 
ATOM   3003 O OH  . TYR C 1 67  ? 3.219   -7.044  -2.115  1.000 41.311 0 396 TYR EEE OH  1 ? 12 
ATOM   3004 N N   . ALA C 1 68  ? 9.336   -11.014 2.518   1.000 24.428 0 397 ALA EEE N   1 ? 12 
ATOM   3005 C CA  . ALA C 1 68  ? 10.379  -11.849 3.136   1.000 22.967 0 397 ALA EEE CA  1 ? 12 
ATOM   3006 C C   . ALA C 1 68  ? 9.968   -13.307 2.941   1.000 22.361 0 397 ALA EEE C   1 ? 12 
ATOM   3007 O O   . ALA C 1 68  ? 8.986   -13.752 3.581   1.000 22.203 0 397 ALA EEE O   1 ? 12 
ATOM   3008 C CB  . ALA C 1 68  ? 10.540  -11.506 4.591   1.000 24.172 0 397 ALA EEE CB  1 ? 12 
ATOM   3009 N N   . ASP C 1 69  ? 10.627  -13.969 2.001   1.000 21.449 0 398 ASP EEE N   1 ? 12 
ATOM   3010 C CA  . ASP C 1 69  ? 10.408  -15.394 1.664   1.000 19.766 0 398 ASP EEE CA  1 ? 12 
ATOM   3011 C C   . ASP C 1 69  ? 11.461  -16.202 2.422   1.000 20.474 0 398 ASP EEE C   1 ? 12 
ATOM   3012 O O   . ASP C 1 69  ? 12.635  -15.789 2.458   1.000 21.598 0 398 ASP EEE O   1 ? 12 
ATOM   3013 C CB  . ASP C 1 69  ? 10.469  -15.594 0.152   1.000 20.524 0 398 ASP EEE CB  1 ? 12 
ATOM   3014 C CG  . ASP C 1 69  ? 9.400   -14.821 -0.607  1.000 22.533 0 398 ASP EEE CG  1 ? 12 
ATOM   3015 O OD1 . ASP C 1 69  ? 8.359   -14.473 0.021   1.000 22.721 0 398 ASP EEE OD1 1 ? 12 
ATOM   3016 O OD2 . ASP C 1 69  ? 9.576   -14.601 -1.831  1.000 22.433 0 398 ASP EEE OD2 1 ? 12 
ATOM   3017 N N   . SER C 1 70  ? 11.090  -17.317 3.039   1.000 19.467 0 399 SER EEE N   1 ? 12 
ATOM   3018 C CA  . SER C 1 70  ? 12.092  -18.095 3.815   1.000 18.308 0 399 SER EEE CA  1 ? 12 
ATOM   3019 C C   . SER C 1 70  ? 11.828  -19.592 3.686   1.000 16.868 0 399 SER EEE C   1 ? 12 
ATOM   3020 O O   . SER C 1 70  ? 10.655  -20.012 3.522   1.000 17.834 0 399 SER EEE O   1 ? 12 
ATOM   3021 C CB  . SER C 1 70  ? 12.155  -17.640 5.249   1.000 18.911 0 399 SER EEE CB  1 ? 12 
ATOM   3022 O OG  . SER C 1 70  ? 10.884  -17.746 5.877   1.000 20.129 0 399 SER EEE OG  1 ? 12 
ATOM   3023 N N   . PHE C 1 71  ? 12.898  -20.365 3.771   1.000 16.337 0 400 PHE EEE N   1 ? 12 
ATOM   3024 C CA  . PHE C 1 71  ? 12.888  -21.823 3.540   1.000 16.259 0 400 PHE EEE CA  1 ? 12 
ATOM   3025 C C   . PHE C 1 71  ? 14.288  -22.375 3.799   1.000 16.727 0 400 PHE EEE C   1 ? 12 
ATOM   3026 O O   . PHE C 1 71  ? 15.213  -21.594 3.978   1.000 16.720 0 400 PHE EEE O   1 ? 12 
ATOM   3027 C CB  . PHE C 1 71  ? 12.448  -22.152 2.106   1.000 17.238 0 400 PHE EEE CB  1 ? 12 
ATOM   3028 C CG  . PHE C 1 71  ? 13.182  -21.405 1.023   1.000 18.300 0 400 PHE EEE CG  1 ? 12 
ATOM   3029 C CD1 . PHE C 1 71  ? 14.446  -21.798 0.607   1.000 18.090 0 400 PHE EEE CD1 1 ? 12 
ATOM   3030 C CD2 . PHE C 1 71  ? 12.627  -20.266 0.451   1.000 19.499 0 400 PHE EEE CD2 1 ? 12 
ATOM   3031 C CE1 . PHE C 1 71  ? 15.113  -21.086 -0.374  1.000 17.678 0 400 PHE EEE CE1 1 ? 12 
ATOM   3032 C CE2 . PHE C 1 71  ? 13.294  -19.561 -0.537  1.000 19.523 0 400 PHE EEE CE2 1 ? 12 
ATOM   3033 C CZ  . PHE C 1 71  ? 14.547  -19.966 -0.940  1.000 18.076 0 400 PHE EEE CZ  1 ? 12 
ATOM   3034 N N   . VAL C 1 72  ? 14.387  -23.703 3.802   1.000 16.867 0 401 VAL EEE N   1 ? 12 
ATOM   3035 C CA  . VAL C 1 72  ? 15.665  -24.458 3.951   1.000 17.133 0 401 VAL EEE CA  1 ? 12 
ATOM   3036 C C   . VAL C 1 72  ? 15.941  -25.236 2.669   1.000 15.968 0 401 VAL EEE C   1 ? 12 
ATOM   3037 O O   . VAL C 1 72  ? 15.032  -25.852 2.101   1.000 16.851 0 401 VAL EEE O   1 ? 12 
ATOM   3038 C CB  . VAL C 1 72  ? 15.626  -25.365 5.193   1.000 17.604 0 401 VAL EEE CB  1 ? 12 
ATOM   3039 C CG1 . VAL C 1 72  ? 16.685  -26.468 5.176   1.000 17.351 0 401 VAL EEE CG1 1 ? 12 
ATOM   3040 C CG2 . VAL C 1 72  ? 15.747  -24.525 6.460   1.000 18.067 0 401 VAL EEE CG2 1 ? 12 
ATOM   3041 N N   . ILE C 1 73  ? 17.192  -25.218 2.241   1.000 16.096 0 402 ILE EEE N   1 ? 12 
ATOM   3042 C CA  . ILE C 1 73  ? 17.694  -26.038 1.121   1.000 17.431 0 402 ILE EEE CA  1 ? 12 
ATOM   3043 C C   . ILE C 1 73  ? 19.099  -26.492 1.522   1.000 18.043 0 402 ILE EEE C   1 ? 12 
ATOM   3044 O O   . ILE C 1 73  ? 19.597  -26.073 2.597   1.000 20.703 0 402 ILE EEE O   1 ? 12 
ATOM   3045 C CB  . ILE C 1 73  ? 17.700  -25.214 -0.193  1.000 17.297 0 402 ILE EEE CB  1 ? 12 
ATOM   3046 C CG1 . ILE C 1 73  ? 18.440  -23.883 -0.024  1.000 18.970 0 402 ILE EEE CG1 1 ? 12 
ATOM   3047 C CG2 . ILE C 1 73  ? 16.295  -24.991 -0.716  1.000 18.855 0 402 ILE EEE CG2 1 ? 12 
ATOM   3048 C CD1 . ILE C 1 73  ? 18.613  -23.091 -1.308  1.000 19.422 0 402 ILE EEE CD1 1 ? 12 
ATOM   3049 N N   . ARG C 1 74  ? 19.753  -27.247 0.654   1.000 18.759 0 403 ARG EEE N   1 ? 12 
ATOM   3050 C CA  . ARG C 1 74  ? 21.155  -27.694 0.844   1.000 20.448 0 403 ARG EEE CA  1 ? 12 
ATOM   3051 C C   . ARG C 1 74  ? 22.115  -26.547 0.554   1.000 19.816 0 403 ARG EEE C   1 ? 12 
ATOM   3052 O O   . ARG C 1 74  ? 21.813  -25.732 -0.336  1.000 19.133 0 403 ARG EEE O   1 ? 12 
ATOM   3053 C CB  . ARG C 1 74  ? 21.507  -28.847 -0.094  1.000 24.151 0 403 ARG EEE CB  1 ? 12 
ATOM   3054 C CG  . ARG C 1 74  ? 20.912  -30.180 0.313   1.000 26.851 0 403 ARG EEE CG  1 ? 12 
ATOM   3055 C CD  . ARG C 1 74  ? 20.934  -31.170 -0.844  1.000 26.372 0 403 ARG EEE CD  1 ? 12 
ATOM   3056 N NE  . ARG C 1 74  ? 22.262  -31.416 -1.404  1.000 30.034 0 403 ARG EEE NE  1 ? 12 
ATOM   3057 C CZ  . ARG C 1 74  ? 22.643  -32.546 -2.025  1.000 35.400 0 403 ARG EEE CZ  1 ? 12 
ATOM   3058 N NH1 . ARG C 1 74  ? 21.800  -33.560 -2.150  1.000 35.224 0 403 ARG EEE NH1 1 ? 12 
ATOM   3059 N NH2 . ARG C 1 74  ? 23.873  -32.658 -2.517  1.000 36.443 0 403 ARG EEE NH2 1 ? 12 
ATOM   3060 N N   . GLY C 1 75  ? 23.268  -26.531 1.226   1.000 19.637 0 404 GLY EEE N   1 ? 12 
ATOM   3061 C CA  . GLY C 1 75  ? 24.342  -25.566 0.945   1.000 19.879 0 404 GLY EEE CA  1 ? 12 
ATOM   3062 C C   . GLY C 1 75  ? 24.646  -25.492 -0.546  1.000 20.557 0 404 GLY EEE C   1 ? 12 
ATOM   3063 O O   . GLY C 1 75  ? 24.813  -24.391 -1.063  1.000 20.079 0 404 GLY EEE O   1 ? 12 
ATOM   3064 N N   . ASP C 1 76  ? 24.682  -26.630 -1.238  1.000 20.459 0 405 ASP EEE N   1 ? 12 
ATOM   3065 C CA  . ASP C 1 76  ? 25.118  -26.672 -2.657  1.000 20.959 0 405 ASP EEE CA  1 ? 12 
ATOM   3066 C C   . ASP C 1 76  ? 23.974  -26.215 -3.571  1.000 19.855 0 405 ASP EEE C   1 ? 12 
ATOM   3067 O O   . ASP C 1 76  ? 24.209  -26.128 -4.789  1.000 22.180 0 405 ASP EEE O   1 ? 12 
ATOM   3068 C CB  . ASP C 1 76  ? 25.732  -28.021 -3.041  1.000 24.608 0 405 ASP EEE CB  1 ? 12 
ATOM   3069 C CG  . ASP C 1 76  ? 24.827  -29.243 -3.021  1.000 28.046 0 405 ASP EEE CG  1 ? 12 
ATOM   3070 O OD1 . ASP C 1 76  ? 23.595  -29.089 -2.918  1.000 26.006 0 405 ASP EEE OD1 1 ? 12 
ATOM   3071 O OD2 . ASP C 1 76  ? 25.384  -30.366 -3.096  1.000 28.184 0 405 ASP EEE OD2 1 ? 12 
ATOM   3072 N N   . GLU C 1 77  ? 22.799  -25.898 -3.028  1.000 18.011 0 406 GLU EEE N   1 ? 12 
ATOM   3073 C CA  . GLU C 1 77  ? 21.644  -25.386 -3.815  1.000 19.541 0 406 GLU EEE CA  1 ? 12 
ATOM   3074 C C   . GLU C 1 77  ? 21.464  -23.877 -3.637  1.000 20.534 0 406 GLU EEE C   1 ? 12 
ATOM   3075 O O   . GLU C 1 77  ? 20.641  -23.300 -4.357  1.000 20.818 0 406 GLU EEE O   1 ? 12 
ATOM   3076 C CB  . GLU C 1 77  ? 20.369  -26.080 -3.383  1.000 19.366 0 406 GLU EEE CB  1 ? 12 
ATOM   3077 C CG  . GLU C 1 77  ? 20.366  -27.556 -3.739  1.000 21.331 0 406 GLU EEE CG  1 ? 12 
ATOM   3078 C CD  . GLU C 1 77  ? 19.184  -28.321 -3.176  1.000 22.897 0 406 GLU EEE CD  1 ? 12 
ATOM   3079 O OE1 . GLU C 1 77  ? 18.704  -27.953 -2.079  1.000 21.202 0 406 GLU EEE OE1 1 ? 12 
ATOM   3080 O OE2 . GLU C 1 77  ? 18.761  -29.297 -3.842  1.000 25.223 0 406 GLU EEE OE2 1 ? 12 
ATOM   3081 N N   . VAL C 1 78  ? 22.163  -23.252 -2.687  1.000 20.156 0 407 VAL EEE N   1 ? 12 
ATOM   3082 C CA  . VAL C 1 78  ? 21.960  -21.800 -2.416  1.000 19.645 0 407 VAL EEE CA  1 ? 12 
ATOM   3083 C C   . VAL C 1 78  ? 22.268  -21.014 -3.704  1.000 20.035 0 407 VAL EEE C   1 ? 12 
ATOM   3084 O O   . VAL C 1 78  ? 21.618  -19.995 -3.944  1.000 19.887 0 407 VAL EEE O   1 ? 12 
ATOM   3085 C CB  . VAL C 1 78  ? 22.783  -21.317 -1.212  1.000 21.449 0 407 VAL EEE CB  1 ? 12 
ATOM   3086 C CG1 . VAL C 1 78  ? 22.713  -19.806 -1.074  1.000 22.975 0 407 VAL EEE CG1 1 ? 12 
ATOM   3087 C CG2 . VAL C 1 78  ? 22.328  -22.006 0.074   1.000 20.430 0 407 VAL EEE CG2 1 ? 12 
ATOM   3088 N N   . ARG C 1 79  ? 23.220  -21.475 -4.515  1.000 21.510 0 408 ARG EEE N   1 ? 12 
ATOM   3089 C CA  . ARG C 1 79  ? 23.582  -20.817 -5.796  1.000 23.889 0 408 ARG EEE CA  1 ? 12 
ATOM   3090 C C   . ARG C 1 79  ? 22.362  -20.760 -6.726  1.000 22.911 0 408 ARG EEE C   1 ? 12 
ATOM   3091 O O   . ARG C 1 79  ? 22.364  -19.895 -7.619  1.000 23.796 0 408 ARG EEE O   1 ? 12 
ATOM   3092 C CB  . ARG C 1 79  ? 24.755  -21.526 -6.477  1.000 25.732 0 408 ARG EEE CB  1 ? 12 
ATOM   3093 C CG  . ARG C 1 79  ? 24.489  -23.007 -6.718  1.000 28.010 0 408 ARG EEE CG  1 ? 12 
ATOM   3094 C CD  . ARG C 1 79  ? 25.564  -23.685 -7.535  1.000 33.963 0 408 ARG EEE CD  1 ? 12 
ATOM   3095 N NE  . ARG C 1 79  ? 25.533  -23.239 -8.924  1.000 41.711 0 408 ARG EEE NE  1 ? 12 
ATOM   3096 C CZ  . ARG C 1 79  ? 24.621  -23.593 -9.833  1.000 44.831 0 408 ARG EEE CZ  1 ? 12 
ATOM   3097 N NH1 . ARG C 1 79  ? 23.620  -24.406 -9.523  1.000 43.378 0 408 ARG EEE NH1 1 ? 12 
ATOM   3098 N NH2 . ARG C 1 79  ? 24.725  -23.120 -11.065 1.000 49.193 0 408 ARG EEE NH2 1 ? 12 
ATOM   3099 N N   . GLN C 1 80  ? 21.349  -21.609 -6.524  1.000 22.717 0 409 GLN EEE N   1 ? 12 
ATOM   3100 C CA  . GLN C 1 80  ? 20.136  -21.613 -7.386  1.000 22.261 0 409 GLN EEE CA  1 ? 12 
ATOM   3101 C C   . GLN C 1 80  ? 19.187  -20.478 -6.994  1.000 21.382 0 409 GLN EEE C   1 ? 12 
ATOM   3102 O O   . GLN C 1 80  ? 18.281  -20.172 -7.787  1.000 23.258 0 409 GLN EEE O   1 ? 12 
ATOM   3103 C CB  . GLN C 1 80  ? 19.419  -22.965 -7.330  1.000 22.982 0 409 GLN EEE CB  1 ? 12 
ATOM   3104 C CG  . GLN C 1 80  ? 20.172  -24.067 -8.050  1.000 22.834 0 409 GLN EEE CG  1 ? 12 
ATOM   3105 C CD  . GLN C 1 80  ? 19.421  -25.379 -8.053  1.000 22.779 0 409 GLN EEE CD  1 ? 12 
ATOM   3106 O OE1 . GLN C 1 80  ? 18.221  -25.437 -8.320  1.000 21.011 0 409 GLN EEE OE1 1 ? 12 
ATOM   3107 N NE2 . GLN C 1 80  ? 20.138  -26.453 -7.783  1.000 21.142 0 409 GLN EEE NE2 1 ? 12 
ATOM   3108 N N   . ILE C 1 81  ? 19.362  -19.858 -5.829  1.000 21.728 0 410 ILE EEE N   1 ? 12 
ATOM   3109 C CA  . ILE C 1 81  ? 18.475  -18.751 -5.381  1.000 21.283 0 410 ILE EEE CA  1 ? 12 
ATOM   3110 C C   . ILE C 1 81  ? 19.083  -17.449 -5.918  1.000 22.593 0 410 ILE EEE C   1 ? 12 
ATOM   3111 O O   . ILE C 1 81  ? 19.683  -16.670 -5.156  1.000 23.041 0 410 ILE EEE O   1 ? 12 
ATOM   3112 C CB  . ILE C 1 81  ? 18.266  -18.761 -3.860  1.000 20.700 0 410 ILE EEE CB  1 ? 12 
ATOM   3113 C CG1 . ILE C 1 81  ? 17.920  -20.167 -3.340  1.000 18.800 0 410 ILE EEE CG1 1 ? 12 
ATOM   3114 C CG2 . ILE C 1 81  ? 17.216  -17.725 -3.486  1.000 21.023 0 410 ILE EEE CG2 1 ? 12 
ATOM   3115 C CD1 . ILE C 1 81  ? 16.708  -20.809 -3.993  1.000 18.559 0 410 ILE EEE CD1 1 ? 12 
ATOM   3116 N N   . ALA C 1 82  ? 18.982  -17.268 -7.231  1.000 22.456 0 411 ALA EEE N   1 ? 12 
ATOM   3117 C CA  . ALA C 1 82  ? 19.519  -16.101 -7.961  1.000 24.365 0 411 ALA EEE CA  1 ? 12 
ATOM   3118 C C   . ALA C 1 82  ? 18.774  -16.012 -9.281  1.000 25.513 0 411 ALA EEE C   1 ? 12 
ATOM   3119 O O   . ALA C 1 82  ? 18.319  -17.034 -9.783  1.000 23.708 0 411 ALA EEE O   1 ? 12 
ATOM   3120 C CB  . ALA C 1 82  ? 21.011  -16.242 -8.180  1.000 26.729 0 411 ALA EEE CB  1 ? 12 
ATOM   3121 N N   . PRO C 1 83  ? 18.645  -14.811 -9.875  1.000 27.581 0 412 PRO EEE N   1 ? 12 
ATOM   3122 C CA  . PRO C 1 83  ? 18.065  -14.686 -11.205 1.000 30.787 0 412 PRO EEE CA  1 ? 12 
ATOM   3123 C C   . PRO C 1 83  ? 18.814  -15.560 -12.217 1.000 32.440 0 412 PRO EEE C   1 ? 12 
ATOM   3124 O O   . PRO C 1 83  ? 20.028  -15.621 -12.130 1.000 30.963 0 412 PRO EEE O   1 ? 12 
ATOM   3125 C CB  . PRO C 1 83  ? 18.259  -13.206 -11.577 1.000 32.857 0 412 PRO EEE CB  1 ? 12 
ATOM   3126 C CG  . PRO C 1 83  ? 18.441  -12.503 -10.248 1.000 33.451 0 412 PRO EEE CG  1 ? 12 
ATOM   3127 C CD  . PRO C 1 83  ? 19.054  -13.520 -9.305  1.000 29.828 0 412 PRO EEE CD  1 ? 12 
ATOM   3128 N N   . GLY C 1 84  ? 18.081  -16.172 -13.154 1.000 32.648 0 413 GLY EEE N   1 ? 12 
ATOM   3129 C CA  . GLY C 1 84  ? 18.651  -16.829 -14.345 1.000 33.412 0 413 GLY EEE CA  1 ? 12 
ATOM   3130 C C   . GLY C 1 84  ? 19.192  -18.224 -14.064 1.000 32.094 0 413 GLY EEE C   1 ? 12 
ATOM   3131 O O   . GLY C 1 84  ? 19.854  -18.779 -14.954 1.000 34.501 0 413 GLY EEE O   1 ? 12 
ATOM   3132 N N   . GLN C 1 85  ? 18.952  -18.790 -12.877 1.000 29.290 0 414 GLN EEE N   1 ? 12 
ATOM   3133 C CA  . GLN C 1 85  ? 19.522  -20.111 -12.512 1.000 29.235 0 414 GLN EEE CA  1 ? 12 
ATOM   3134 C C   . GLN C 1 85  ? 18.567  -21.233 -12.928 1.000 27.615 0 414 GLN EEE C   1 ? 12 
ATOM   3135 O O   . GLN C 1 85  ? 17.363  -20.977 -13.159 1.000 28.551 0 414 GLN EEE O   1 ? 12 
ATOM   3136 C CB  . GLN C 1 85  ? 19.836  -20.189 -11.017 1.000 28.880 0 414 GLN EEE CB  1 ? 12 
ATOM   3137 C CG  . GLN C 1 85  ? 20.859  -19.165 -10.561 1.000 30.765 0 414 GLN EEE CG  1 ? 12 
ATOM   3138 C CD  . GLN C 1 85  ? 22.142  -19.218 -11.350 1.000 35.833 0 414 GLN EEE CD  1 ? 12 
ATOM   3139 O OE1 . GLN C 1 85  ? 22.831  -20.232 -11.372 1.000 41.153 0 414 GLN EEE OE1 1 ? 12 
ATOM   3140 N NE2 . GLN C 1 85  ? 22.463  -18.120 -12.014 1.000 39.532 0 414 GLN EEE NE2 1 ? 12 
ATOM   3141 N N   . THR C 1 86  ? 19.118  -22.438 -13.023 1.000 27.846 0 415 THR EEE N   1 ? 12 
ATOM   3142 C CA  . THR C 1 86  ? 18.409  -23.692 -13.357 1.000 29.684 0 415 THR EEE CA  1 ? 12 
ATOM   3143 C C   . THR C 1 86  ? 18.797  -24.757 -12.326 1.000 29.607 0 415 THR EEE C   1 ? 12 
ATOM   3144 O O   . THR C 1 86  ? 19.804  -24.572 -11.629 1.000 29.393 0 415 THR EEE O   1 ? 12 
ATOM   3145 C CB  . THR C 1 86  ? 18.718  -24.096 -14.803 1.000 33.906 0 415 THR EEE CB  1 ? 12 
ATOM   3146 O OG1 . THR C 1 86  ? 17.785  -25.118 -15.144 1.000 40.232 0 415 THR EEE OG1 1 ? 12 
ATOM   3147 C CG2 . THR C 1 86  ? 20.137  -24.581 -15.001 1.000 33.910 0 415 THR EEE CG2 1 ? 12 
ATOM   3148 N N   . GLY C 1 87  ? 18.034  -25.848 -12.260 1.000 27.571 0 416 GLY EEE N   1 ? 12 
ATOM   3149 C CA  . GLY C 1 87  ? 18.211  -26.928 -11.266 1.000 25.694 0 416 GLY EEE CA  1 ? 12 
ATOM   3150 C C   . GLY C 1 87  ? 16.899  -27.224 -10.569 1.000 24.421 0 416 GLY EEE C   1 ? 12 
ATOM   3151 O O   . GLY C 1 87  ? 15.911  -26.482 -10.805 1.000 24.140 0 416 GLY EEE O   1 ? 12 
ATOM   3152 N N   . LYS C 1 88  ? 16.861  -28.276 -9.745  1.000 24.205 0 417 LYS EEE N   1 ? 12 
ATOM   3153 C CA  . LYS C 1 88  ? 15.586  -28.743 -9.146  1.000 23.108 0 417 LYS EEE CA  1 ? 12 
ATOM   3154 C C   . LYS C 1 88  ? 14.977  -27.612 -8.308  1.000 22.083 0 417 LYS EEE C   1 ? 12 
ATOM   3155 O O   . LYS C 1 88  ? 13.740  -27.491 -8.296  1.000 21.241 0 417 LYS EEE O   1 ? 12 
ATOM   3156 C CB  . LYS C 1 88  ? 15.799  -30.017 -8.325  1.000 25.829 0 417 LYS EEE CB  1 ? 12 
ATOM   3157 C CG  . LYS C 1 88  ? 16.433  -31.186 -9.070  1.000 32.413 0 417 LYS EEE CG  1 ? 12 
ATOM   3158 C CD  . LYS C 1 88  ? 15.722  -31.609 -10.346 1.000 34.542 0 417 LYS EEE CD  1 ? 12 
ATOM   3159 C CE  . LYS C 1 88  ? 16.511  -32.665 -11.101 1.000 36.999 0 417 LYS EEE CE  1 ? 12 
ATOM   3160 N NZ  . LYS C 1 88  ? 15.753  -33.248 -12.227 1.000 39.790 0 417 LYS EEE NZ  1 ? 12 
ATOM   3161 N N   . ILE C 1 89  ? 15.778  -26.816 -7.606  1.000 19.579 0 418 ILE EEE N   1 ? 12 
ATOM   3162 C CA  . ILE C 1 89  ? 15.213  -25.765 -6.711  1.000 20.271 0 418 ILE EEE CA  1 ? 12 
ATOM   3163 C C   . ILE C 1 89  ? 14.694  -24.593 -7.550  1.000 20.423 0 418 ILE EEE C   1 ? 12 
ATOM   3164 O O   . ILE C 1 89  ? 13.514  -24.227 -7.414  1.000 19.513 0 418 ILE EEE O   1 ? 12 
ATOM   3165 C CB  . ILE C 1 89  ? 16.213  -25.341 -5.623  1.000 20.350 0 418 ILE EEE CB  1 ? 12 
ATOM   3166 C CG1 . ILE C 1 89  ? 16.682  -26.548 -4.801  1.000 20.762 0 418 ILE EEE CG1 1 ? 12 
ATOM   3167 C CG2 . ILE C 1 89  ? 15.597  -24.264 -4.758  1.000 19.374 0 418 ILE EEE CG2 1 ? 12 
ATOM   3168 C CD1 . ILE C 1 89  ? 15.558  -27.340 -4.166  1.000 21.366 0 418 ILE EEE CD1 1 ? 12 
ATOM   3169 N N   . ALA C 1 90  ? 15.508  -24.038 -8.433  1.000 18.837 0 419 ALA EEE N   1 ? 12 
ATOM   3170 C CA  . ALA C 1 90  ? 15.091  -22.905 -9.290  1.000 20.512 0 419 ALA EEE CA  1 ? 12 
ATOM   3171 C C   . ALA C 1 90  ? 13.901  -23.307 -10.172 1.000 22.114 0 419 ALA EEE C   1 ? 12 
ATOM   3172 O O   . ALA C 1 90  ? 13.008  -22.467 -10.374 1.000 25.695 0 419 ALA EEE O   1 ? 12 
ATOM   3173 C CB  . ALA C 1 90  ? 16.248  -22.425 -10.124 1.000 22.376 0 419 ALA EEE CB  1 ? 12 
ATOM   3174 N N   . ASP C 1 91  ? 13.908  -24.524 -10.715 1.000 22.429 0 420 ASP EEE N   1 ? 12 
ATOM   3175 C CA  . ASP C 1 91  ? 12.922  -24.962 -11.732 1.000 23.146 0 420 ASP EEE CA  1 ? 12 
ATOM   3176 C C   . ASP C 1 91  ? 11.615  -25.357 -11.026 1.000 22.565 0 420 ASP EEE C   1 ? 12 
ATOM   3177 O O   . ASP C 1 91  ? 10.542  -25.044 -11.544 1.000 23.398 0 420 ASP EEE O   1 ? 12 
ATOM   3178 C CB  . ASP C 1 91  ? 13.457  -26.118 -12.588 1.000 24.728 0 420 ASP EEE CB  1 ? 12 
ATOM   3179 C CG  . ASP C 1 91  ? 14.674  -25.812 -13.461 1.000 29.833 0 420 ASP EEE CG  1 ? 12 
ATOM   3180 O OD1 . ASP C 1 91  ? 14.961  -24.622 -13.683 1.000 29.595 0 420 ASP EEE OD1 1 ? 12 
ATOM   3181 O OD2 . ASP C 1 91  ? 15.330  -26.782 -13.904 1.000 31.102 0 420 ASP EEE OD2 1 ? 12 
ATOM   3182 N N   . TYR C 1 92  ? 11.680  -26.082 -9.910  1.000 20.843 0 421 TYR EEE N   1 ? 12 
ATOM   3183 C CA  . TYR C 1 92  ? 10.484  -26.777 -9.372  1.000 19.963 0 421 TYR EEE CA  1 ? 12 
ATOM   3184 C C   . TYR C 1 92  ? 10.069  -26.286 -7.980  1.000 19.853 0 421 TYR EEE C   1 ? 12 
ATOM   3185 O O   . TYR C 1 92  ? 8.975   -26.694 -7.544  1.000 19.773 0 421 TYR EEE O   1 ? 12 
ATOM   3186 C CB  . TYR C 1 92  ? 10.732  -28.290 -9.326  1.000 19.731 0 421 TYR EEE CB  1 ? 12 
ATOM   3187 C CG  . TYR C 1 92  ? 11.008  -28.976 -10.638 1.000 19.948 0 421 TYR EEE CG  1 ? 12 
ATOM   3188 C CD1 . TYR C 1 92  ? 10.619  -28.440 -11.857 1.000 21.343 0 421 TYR EEE CD1 1 ? 12 
ATOM   3189 C CD2 . TYR C 1 92  ? 11.622  -30.220 -10.646 1.000 21.175 0 421 TYR EEE CD2 1 ? 12 
ATOM   3190 C CE1 . TYR C 1 92  ? 10.874  -29.100 -13.050 1.000 22.370 0 421 TYR EEE CE1 1 ? 12 
ATOM   3191 C CE2 . TYR C 1 92  ? 11.862  -30.906 -11.824 1.000 22.591 0 421 TYR EEE CE2 1 ? 12 
ATOM   3192 C CZ  . TYR C 1 92  ? 11.503  -30.336 -13.030 1.000 22.983 0 421 TYR EEE CZ  1 ? 12 
ATOM   3193 O OH  . TYR C 1 92  ? 11.760  -31.021 -14.172 1.000 24.306 0 421 TYR EEE OH  1 ? 12 
ATOM   3194 N N   . ASN C 1 93  ? 10.839  -25.426 -7.310  1.000 20.299 0 422 ASN EEE N   1 ? 12 
ATOM   3195 C CA  . ASN C 1 93  ? 10.565  -25.088 -5.883  1.000 19.067 0 422 ASN EEE CA  1 ? 12 
ATOM   3196 C C   . ASN C 1 93  ? 10.430  -23.579 -5.654  1.000 19.248 0 422 ASN EEE C   1 ? 12 
ATOM   3197 O O   . ASN C 1 93  ? 9.400   -23.163 -5.112  1.000 20.976 0 422 ASN EEE O   1 ? 12 
ATOM   3198 C CB  . ASN C 1 93  ? 11.614  -25.702 -4.971  1.000 18.296 0 422 ASN EEE CB  1 ? 12 
ATOM   3199 C CG  . ASN C 1 93  ? 11.505  -27.211 -4.919  1.000 17.834 0 422 ASN EEE CG  1 ? 12 
ATOM   3200 O OD1 . ASN C 1 93  ? 10.851  -27.749 -4.024  1.000 18.585 0 422 ASN EEE OD1 1 ? 12 
ATOM   3201 N ND2 . ASN C 1 93  ? 12.133  -27.898 -5.862  1.000 18.603 0 422 ASN EEE ND2 1 ? 12 
ATOM   3202 N N   . TYR C 1 94  ? 11.437  -22.800 -6.030  1.000 20.058 0 423 TYR EEE N   1 ? 12 
ATOM   3203 C CA  . TYR C 1 94  ? 11.481  -21.337 -5.788  1.000 19.127 0 423 TYR EEE CA  1 ? 12 
ATOM   3204 C C   . TYR C 1 94  ? 12.282  -20.657 -6.888  1.000 20.551 0 423 TYR EEE C   1 ? 12 
ATOM   3205 O O   . TYR C 1 94  ? 13.501  -20.908 -7.013  1.000 20.736 0 423 TYR EEE O   1 ? 12 
ATOM   3206 C CB  . TYR C 1 94  ? 12.063  -21.047 -4.405  1.000 19.504 0 423 TYR EEE CB  1 ? 12 
ATOM   3207 C CG  . TYR C 1 94  ? 11.988  -19.581 -4.043  1.000 19.255 0 423 TYR EEE CG  1 ? 12 
ATOM   3208 C CD1 . TYR C 1 94  ? 10.849  -19.046 -3.482  1.000 19.768 0 423 TYR EEE CD1 1 ? 12 
ATOM   3209 C CD2 . TYR C 1 94  ? 13.023  -18.715 -4.329  1.000 19.189 0 423 TYR EEE CD2 1 ? 12 
ATOM   3210 C CE1 . TYR C 1 94  ? 10.746  -17.699 -3.162  1.000 19.199 0 423 TYR EEE CE1 1 ? 12 
ATOM   3211 C CE2 . TYR C 1 94  ? 12.944  -17.368 -4.008  1.000 20.308 0 423 TYR EEE CE2 1 ? 12 
ATOM   3212 C CZ  . TYR C 1 94  ? 11.798  -16.848 -3.438  1.000 19.896 0 423 TYR EEE CZ  1 ? 12 
ATOM   3213 O OH  . TYR C 1 94  ? 11.721  -15.523 -3.143  1.000 21.341 0 423 TYR EEE OH  1 ? 12 
ATOM   3214 N N   . LYS C 1 95  ? 11.602  -19.799 -7.645  1.000 20.250 0 424 LYS EEE N   1 ? 12 
ATOM   3215 C CA  . LYS C 1 95  ? 12.141  -19.190 -8.884  1.000 22.631 0 424 LYS EEE CA  1 ? 12 
ATOM   3216 C C   . LYS C 1 95  ? 12.172  -17.670 -8.730  1.000 23.780 0 424 LYS EEE C   1 ? 12 
ATOM   3217 O O   . LYS C 1 95  ? 11.103  -17.080 -8.547  1.000 24.775 0 424 LYS EEE O   1 ? 12 
ATOM   3218 C CB  . LYS C 1 95  ? 11.289  -19.544 -10.104 1.000 23.884 0 424 LYS EEE CB  1 ? 12 
ATOM   3219 C CG  . LYS C 1 95  ? 11.778  -18.945 -11.423 1.000 26.722 0 424 LYS EEE CG  1 ? 12 
ATOM   3220 C CD  . LYS C 1 95  ? 13.226  -19.265 -11.711 1.000 29.318 0 424 LYS EEE CD  1 ? 12 
ATOM   3221 C CE  . LYS C 1 95  ? 13.673  -18.925 -13.122 1.000 32.746 0 424 LYS EEE CE  1 ? 12 
ATOM   3222 N NZ  . LYS C 1 95  ? 15.103  -19.285 -13.314 1.000 32.739 0 424 LYS EEE NZ  1 ? 12 
ATOM   3223 N N   . LEU C 1 96  ? 13.352  -17.073 -8.850  1.000 23.688 0 425 LEU EEE N   1 ? 12 
ATOM   3224 C CA  . LEU C 1 96  ? 13.486  -15.599 -8.914  1.000 24.157 0 425 LEU EEE CA  1 ? 12 
ATOM   3225 C C   . LEU C 1 96  ? 13.343  -15.139 -10.361 1.000 27.127 0 425 LEU EEE C   1 ? 12 
ATOM   3226 O O   . LEU C 1 96  ? 13.780  -15.834 -11.276 1.000 30.222 0 425 LEU EEE O   1 ? 12 
ATOM   3227 C CB  . LEU C 1 96  ? 14.835  -15.182 -8.338  1.000 24.065 0 425 LEU EEE CB  1 ? 12 
ATOM   3228 C CG  . LEU C 1 96  ? 14.935  -15.294 -6.824  1.000 23.146 0 425 LEU EEE CG  1 ? 12 
ATOM   3229 C CD1 . LEU C 1 96  ? 16.318  -14.896 -6.356  1.000 23.886 0 425 LEU EEE CD1 1 ? 12 
ATOM   3230 C CD2 . LEU C 1 96  ? 13.851  -14.450 -6.164  1.000 23.381 0 425 LEU EEE CD2 1 ? 12 
ATOM   3231 N N   . PRO C 1 97  ? 12.761  -13.944 -10.590 1.000 29.157 0 426 PRO EEE N   1 ? 12 
ATOM   3232 C CA  . PRO C 1 97  ? 12.656  -13.370 -11.933 1.000 31.206 0 426 PRO EEE CA  1 ? 12 
ATOM   3233 C C   . PRO C 1 97  ? 13.997  -12.803 -12.418 1.000 32.502 0 426 PRO EEE C   1 ? 12 
ATOM   3234 O O   . PRO C 1 97  ? 14.852  -12.486 -11.604 1.000 32.043 0 426 PRO EEE O   1 ? 12 
ATOM   3235 C CB  . PRO C 1 97  ? 11.648  -12.228 -11.745 1.000 32.288 0 426 PRO EEE CB  1 ? 12 
ATOM   3236 C CG  . PRO C 1 97  ? 11.893  -11.781 -10.326 1.000 31.616 0 426 PRO EEE CG  1 ? 12 
ATOM   3237 C CD  . PRO C 1 97  ? 12.193  -13.057 -9.563  1.000 30.171 0 426 PRO EEE CD  1 ? 12 
ATOM   3238 N N   . ASP C 1 98  ? 14.140  -12.651 -13.730 1.000 36.937 0 427 ASP EEE N   1 ? 12 
ATOM   3239 C CA  . ASP C 1 98  ? 15.333  -12.019 -14.351 1.000 39.242 0 427 ASP EEE CA  1 ? 12 
ATOM   3240 C C   . ASP C 1 98  ? 15.498  -10.590 -13.816 1.000 37.832 0 427 ASP EEE C   1 ? 12 
ATOM   3241 O O   . ASP C 1 98  ? 16.665  -10.187 -13.586 1.000 37.883 0 427 ASP EEE O   1 ? 12 
ATOM   3242 C CB  . ASP C 1 98  ? 15.236  -12.037 -15.877 1.000 43.561 0 427 ASP EEE CB  1 ? 12 
ATOM   3243 C CG  . ASP C 1 98  ? 15.199  -13.426 -16.501 1.000 46.129 0 427 ASP EEE CG  1 ? 12 
ATOM   3244 O OD1 . ASP C 1 98  ? 15.585  -14.406 -15.825 1.000 45.524 0 427 ASP EEE OD1 1 ? 12 
ATOM   3245 O OD2 . ASP C 1 98  ? 14.804  -13.514 -17.681 1.000 56.460 0 427 ASP EEE OD2 1 ? 12 
ATOM   3246 N N   . ASP C 1 99  ? 14.390  -9.862  -13.606 1.000 38.021 0 428 ASP EEE N   1 ? 12 
ATOM   3247 C CA  . ASP C 1 99  ? 14.383  -8.414  -13.249 1.000 41.936 0 428 ASP EEE CA  1 ? 12 
ATOM   3248 C C   . ASP C 1 99  ? 14.282  -8.235  -11.726 1.000 39.031 0 428 ASP EEE C   1 ? 12 
ATOM   3249 O O   . ASP C 1 99  ? 13.837  -7.154  -11.281 1.000 41.593 0 428 ASP EEE O   1 ? 12 
ATOM   3250 C CB  . ASP C 1 99  ? 13.262  -7.658  -13.978 1.000 43.948 0 428 ASP EEE CB  1 ? 12 
ATOM   3251 C CG  . ASP C 1 99  ? 11.847  -8.092  -13.602 1.000 45.143 0 428 ASP EEE CG  1 ? 12 
ATOM   3252 O OD1 . ASP C 1 99  ? 11.706  -9.040  -12.809 1.000 43.913 0 428 ASP EEE OD1 1 ? 12 
ATOM   3253 O OD2 . ASP C 1 99  ? 10.892  -7.471  -14.107 1.000 53.738 0 428 ASP EEE OD2 1 ? 12 
ATOM   3254 N N   . PHE C 1 100 ? 14.716  -9.232  -10.955 1.000 37.277 0 429 PHE EEE N   1 ? 12 
ATOM   3255 C CA  . PHE C 1 100 ? 14.591  -9.280  -9.477  1.000 32.390 0 429 PHE EEE CA  1 ? 12 
ATOM   3256 C C   . PHE C 1 100 ? 15.177  -8.009  -8.856  1.000 33.511 0 429 PHE EEE C   1 ? 12 
ATOM   3257 O O   . PHE C 1 100 ? 16.313  -7.638  -9.204  1.000 31.618 0 429 PHE EEE O   1 ? 12 
ATOM   3258 C CB  . PHE C 1 100 ? 15.304  -10.522 -8.944  1.000 29.882 0 429 PHE EEE CB  1 ? 12 
ATOM   3259 C CG  . PHE C 1 100 ? 15.294  -10.664 -7.448  1.000 26.961 0 429 PHE EEE CG  1 ? 12 
ATOM   3260 C CD1 . PHE C 1 100 ? 14.120  -10.536 -6.727  1.000 26.542 0 429 PHE EEE CD1 1 ? 12 
ATOM   3261 C CD2 . PHE C 1 100 ? 16.462  -10.941 -6.762  1.000 27.261 0 429 PHE EEE CD2 1 ? 12 
ATOM   3262 C CE1 . PHE C 1 100 ? 14.123  -10.677 -5.347  1.000 25.788 0 429 PHE EEE CE1 1 ? 12 
ATOM   3263 C CE2 . PHE C 1 100 ? 16.462  -11.067 -5.385  1.000 24.195 0 429 PHE EEE CE2 1 ? 12 
ATOM   3264 C CZ  . PHE C 1 100 ? 15.290  -10.945 -4.683  1.000 24.542 0 429 PHE EEE CZ  1 ? 12 
ATOM   3265 N N   . THR C 1 101 ? 14.422  -7.375  -7.950  1.000 32.291 0 430 THR EEE N   1 ? 12 
ATOM   3266 C CA  . THR C 1 101 ? 14.911  -6.290  -7.059  1.000 31.460 0 430 THR EEE CA  1 ? 12 
ATOM   3267 C C   . THR C 1 101 ? 14.821  -6.787  -5.612  1.000 28.992 0 430 THR EEE C   1 ? 12 
ATOM   3268 O O   . THR C 1 101 ? 13.694  -6.921  -5.095  1.000 26.993 0 430 THR EEE O   1 ? 12 
ATOM   3269 C CB  . THR C 1 101 ? 14.132  -4.989  -7.273  1.000 33.230 0 430 THR EEE CB  1 ? 12 
ATOM   3270 O OG1 . THR C 1 101 ? 14.282  -4.581  -8.634  1.000 35.475 0 430 THR EEE OG1 1 ? 12 
ATOM   3271 C CG2 . THR C 1 101 ? 14.628  -3.871  -6.385  1.000 35.061 0 430 THR EEE CG2 1 ? 12 
ATOM   3272 N N   . GLY C 1 102 ? 15.959  -7.105  -5.002  1.000 27.524 0 431 GLY EEE N   1 ? 12 
ATOM   3273 C CA  . GLY C 1 102 ? 15.967  -7.728  -3.670  1.000 27.875 0 431 GLY EEE CA  1 ? 12 
ATOM   3274 C C   . GLY C 1 102 ? 17.301  -8.334  -3.308  1.000 26.308 0 431 GLY EEE C   1 ? 12 
ATOM   3275 O O   . GLY C 1 102 ? 18.279  -8.179  -4.054  1.000 26.636 0 431 GLY EEE O   1 ? 12 
ATOM   3276 N N   . CYS C 1 103 ? 17.340  -8.977  -2.151  1.000 25.235 0 432 CYS EEE N   1 ? 12 
ATOM   3277 C CA  . CYS C 1 103 ? 18.571  -9.554  -1.573  1.000 25.013 0 432 CYS EEE CA  1 ? 12 
ATOM   3278 C C   . CYS C 1 103 ? 18.276  -10.998 -1.184  1.000 23.119 0 432 CYS EEE C   1 ? 12 
ATOM   3279 O O   . CYS C 1 103 ? 17.149  -11.286 -0.734  1.000 23.438 0 432 CYS EEE O   1 ? 12 
ATOM   3280 C CB  . CYS C 1 103 ? 19.057  -8.749  -0.375  1.000 26.184 0 432 CYS EEE CB  1 ? 12 
ATOM   3281 S SG  . CYS C 1 103 ? 19.354  -7.003  -0.754  1.000 31.270 0 432 CYS EEE SG  1 ? 12 
ATOM   3282 N N   . VAL C 1 104 ? 19.251  -11.866 -1.413  1.000 21.721 0 433 VAL EEE N   1 ? 12 
ATOM   3283 C CA  . VAL C 1 104 ? 19.227  -13.297 -1.012  1.000 19.899 0 433 VAL EEE CA  1 ? 12 
ATOM   3284 C C   . VAL C 1 104 ? 20.208  -13.442 0.138   1.000 20.595 0 433 VAL EEE C   1 ? 12 
ATOM   3285 O O   . VAL C 1 104 ? 21.391  -13.065 -0.027  1.000 21.124 0 433 VAL EEE O   1 ? 12 
ATOM   3286 C CB  . VAL C 1 104 ? 19.610  -14.209 -2.187  1.000 20.591 0 433 VAL EEE CB  1 ? 12 
ATOM   3287 C CG1 . VAL C 1 104 ? 19.660  -15.668 -1.769  1.000 19.535 0 433 VAL EEE CG1 1 ? 12 
ATOM   3288 C CG2 . VAL C 1 104 ? 18.680  -14.010 -3.356  1.000 21.891 0 433 VAL EEE CG2 1 ? 12 
ATOM   3289 N N   . ILE C 1 105 ? 19.704  -13.915 1.269   1.000 18.447 0 434 ILE EEE N   1 ? 12 
ATOM   3290 C CA  . ILE C 1 105 ? 20.464  -13.981 2.542   1.000 19.524 0 434 ILE EEE CA  1 ? 12 
ATOM   3291 C C   . ILE C 1 105 ? 20.430  -15.439 2.976   1.000 18.707 0 434 ILE EEE C   1 ? 12 
ATOM   3292 O O   . ILE C 1 105 ? 19.333  -16.032 2.987   1.000 18.327 0 434 ILE EEE O   1 ? 12 
ATOM   3293 C CB  . ILE C 1 105 ? 19.857  -13.038 3.595   1.000 19.645 0 434 ILE EEE CB  1 ? 12 
ATOM   3294 C CG1 . ILE C 1 105 ? 19.722  -11.606 3.050   1.000 22.472 0 434 ILE EEE CG1 1 ? 12 
ATOM   3295 C CG2 . ILE C 1 105 ? 20.658  -13.102 4.882   1.000 20.156 0 434 ILE EEE CG2 1 ? 12 
ATOM   3296 C CD1 . ILE C 1 105 ? 18.779  -10.717 3.810   1.000 22.754 0 434 ILE EEE CD1 1 ? 12 
ATOM   3297 N N   . ALA C 1 106 ? 21.584  -16.021 3.266   1.000 17.729 0 435 ALA EEE N   1 ? 12 
ATOM   3298 C CA  . ALA C 1 106 ? 21.622  -17.444 3.676   1.000 18.289 0 435 ALA EEE CA  1 ? 12 
ATOM   3299 C C   . ALA C 1 106 ? 22.659  -17.661 4.772   1.000 18.728 0 435 ALA EEE C   1 ? 12 
ATOM   3300 O O   . ALA C 1 106 ? 23.644  -16.884 4.865   1.000 20.337 0 435 ALA EEE O   1 ? 12 
ATOM   3301 C CB  . ALA C 1 106 ? 21.858  -18.351 2.494   1.000 19.121 0 435 ALA EEE CB  1 ? 12 
ATOM   3302 N N   . TRP C 1 107 ? 22.426  -18.675 5.593   1.000 19.178 0 436 TRP EEE N   1 ? 12 
ATOM   3303 C CA  . TRP C 1 107 ? 23.385  -19.078 6.648   1.000 19.176 0 436 TRP EEE CA  1 ? 12 
ATOM   3304 C C   . TRP C 1 107 ? 23.238  -20.572 6.921   1.000 18.549 0 436 TRP EEE C   1 ? 12 
ATOM   3305 O O   . TRP C 1 107 ? 22.124  -21.134 6.779   1.000 17.970 0 436 TRP EEE O   1 ? 12 
ATOM   3306 C CB  . TRP C 1 107 ? 23.222  -18.236 7.920   1.000 20.177 0 436 TRP EEE CB  1 ? 12 
ATOM   3307 C CG  . TRP C 1 107 ? 21.926  -18.405 8.649   1.000 20.644 0 436 TRP EEE CG  1 ? 12 
ATOM   3308 C CD1 . TRP C 1 107 ? 21.693  -19.178 9.752   1.000 23.446 0 436 TRP EEE CD1 1 ? 12 
ATOM   3309 C CD2 . TRP C 1 107 ? 20.682  -17.765 8.334   1.000 20.578 0 436 TRP EEE CD2 1 ? 12 
ATOM   3310 N NE1 . TRP C 1 107 ? 20.383  -19.067 10.135  1.000 24.138 0 436 TRP EEE NE1 1 ? 12 
ATOM   3311 C CE2 . TRP C 1 107 ? 19.741  -18.194 9.291   1.000 22.953 0 436 TRP EEE CE2 1 ? 12 
ATOM   3312 C CE3 . TRP C 1 107 ? 20.267  -16.870 7.340   1.000 20.148 0 436 TRP EEE CE3 1 ? 12 
ATOM   3313 C CZ2 . TRP C 1 107 ? 18.413  -17.761 9.270   1.000 23.559 0 436 TRP EEE CZ2 1 ? 12 
ATOM   3314 C CZ3 . TRP C 1 107 ? 18.962  -16.434 7.329   1.000 21.465 0 436 TRP EEE CZ3 1 ? 12 
ATOM   3315 C CH2 . TRP C 1 107 ? 18.046  -16.875 8.277   1.000 21.927 0 436 TRP EEE CH2 1 ? 12 
ATOM   3316 N N   . ASN C 1 108 ? 24.358  -21.170 7.293   1.000 19.995 0 437 ASN EEE N   1 ? 12 
ATOM   3317 C CA  . ASN C 1 108 ? 24.450  -22.610 7.635   1.000 18.742 0 437 ASN EEE CA  1 ? 12 
ATOM   3318 C C   . ASN C 1 108 ? 23.565  -22.841 8.857   1.000 20.453 0 437 ASN EEE C   1 ? 12 
ATOM   3319 O O   . ASN C 1 108 ? 23.728  -22.087 9.847   1.000 20.234 0 437 ASN EEE O   1 ? 12 
ATOM   3320 C CB  . ASN C 1 108 ? 25.896  -23.023 7.866   1.000 20.842 0 437 ASN EEE CB  1 ? 12 
ATOM   3321 C CG  . ASN C 1 108 ? 26.013  -24.510 8.108   1.000 22.662 0 437 ASN EEE CG  1 ? 12 
ATOM   3322 O OD1 . ASN C 1 108 ? 25.493  -25.016 9.104   1.000 22.517 0 437 ASN EEE OD1 1 ? 12 
ATOM   3323 N ND2 . ASN C 1 108 ? 26.663  -25.211 7.194   1.000 21.607 0 437 ASN EEE ND2 1 ? 12 
ATOM   3324 N N   . SER C 1 109 ? 22.646  -23.812 8.782   1.000 19.936 0 438 SER EEE N   1 ? 12 
ATOM   3325 C CA  . SER C 1 109 ? 21.717  -24.119 9.899   1.000 19.739 0 438 SER EEE CA  1 ? 12 
ATOM   3326 C C   . SER C 1 109 ? 21.886  -25.572 10.365  1.000 19.908 0 438 SER EEE C   1 ? 12 
ATOM   3327 O O   . SER C 1 109 ? 20.936  -26.120 10.926  1.000 21.290 0 438 SER EEE O   1 ? 12 
ATOM   3328 C CB  . SER C 1 109 ? 20.300  -23.796 9.516   1.000 19.845 0 438 SER EEE CB  1 ? 12 
ATOM   3329 O OG  . SER C 1 109 ? 19.834  -24.638 8.483   1.000 19.785 0 438 SER EEE OG  1 ? 12 
ATOM   3330 N N   . ASN C 1 110 ? 23.069  -26.159 10.162  1.000 20.381 0 439 ASN EEE N   1 ? 12 
ATOM   3331 C CA  . ASN C 1 110 ? 23.330  -27.585 10.493  1.000 21.452 0 439 ASN EEE CA  1 ? 12 
ATOM   3332 C C   . ASN C 1 110 ? 23.028  -27.840 11.976  1.000 23.645 0 439 ASN EEE C   1 ? 12 
ATOM   3333 O O   . ASN C 1 110 ? 22.529  -28.938 12.292  1.000 25.296 0 439 ASN EEE O   1 ? 12 
ATOM   3334 C CB  . ASN C 1 110 ? 24.766  -27.997 10.186  1.000 22.986 0 439 ASN EEE CB  1 ? 12 
ATOM   3335 C CG  . ASN C 1 110 ? 24.903  -29.496 10.072  1.000 22.514 0 439 ASN EEE CG  1 ? 12 
ATOM   3336 O OD1 . ASN C 1 110 ? 24.047  -30.166 9.509   1.000 22.969 0 439 ASN EEE OD1 1 ? 12 
ATOM   3337 N ND2 . ASN C 1 110 ? 25.986  -30.025 10.601  1.000 26.384 0 439 ASN EEE ND2 1 ? 12 
ATOM   3338 N N   . ASN C 1 111 ? 23.294  -26.868 12.844  1.000 23.532 0 440 ASN EEE N   1 ? 12 
ATOM   3339 C CA  . ASN C 1 111 ? 23.164  -27.061 14.316  1.000 28.497 0 440 ASN EEE CA  1 ? 12 
ATOM   3340 C C   . ASN C 1 111 ? 21.671  -27.120 14.681  1.000 28.858 0 440 ASN EEE C   1 ? 12 
ATOM   3341 O O   . ASN C 1 111 ? 21.344  -27.847 15.653  1.000 29.559 0 440 ASN EEE O   1 ? 12 
ATOM   3342 C CB  . ASN C 1 111 ? 23.917  -26.009 15.123  1.000 30.491 0 440 ASN EEE CB  1 ? 12 
ATOM   3343 C CG  . ASN C 1 111 ? 25.426  -26.129 15.022  1.000 32.588 0 440 ASN EEE CG  1 ? 12 
ATOM   3344 O OD1 . ASN C 1 111 ? 25.975  -27.220 14.880  1.000 36.367 0 440 ASN EEE OD1 1 ? 12 
ATOM   3345 N ND2 . ASN C 1 111 ? 26.105  -25.003 15.106  1.000 35.139 0 440 ASN EEE ND2 1 ? 12 
ATOM   3346 N N   . LEU C 1 112 ? 20.803  -26.442 13.912  1.000 28.954 0 441 LEU EEE N   1 ? 12 
ATOM   3347 C CA  . LEU C 1 112 ? 19.337  -26.395 14.173  1.000 31.151 0 441 LEU EEE CA  1 ? 12 
ATOM   3348 C C   . LEU C 1 112 ? 18.591  -27.470 13.382  1.000 30.314 0 441 LEU EEE C   1 ? 12 
ATOM   3349 O O   . LEU C 1 112 ? 17.632  -28.050 13.929  1.000 32.978 0 441 LEU EEE O   1 ? 12 
ATOM   3350 C CB  . LEU C 1 112 ? 18.788  -25.012 13.809  1.000 30.648 0 441 LEU EEE CB  1 ? 12 
ATOM   3351 C CG  . LEU C 1 112 ? 19.361  -23.837 14.596  1.000 35.555 0 441 LEU EEE CG  1 ? 12 
ATOM   3352 C CD1 . LEU C 1 112 ? 18.817  -22.529 14.047  1.000 35.340 0 441 LEU EEE CD1 1 ? 12 
ATOM   3353 C CD2 . LEU C 1 112 ? 19.054  -23.941 16.087  1.000 40.319 0 441 LEU EEE CD2 1 ? 12 
ATOM   3354 N N   . ASP C 1 113 ? 18.972  -27.716 12.131  1.000 26.598 0 442 ASP EEE N   1 ? 12 
ATOM   3355 C CA  . ASP C 1 113 ? 18.077  -28.380 11.152  1.000 25.629 0 442 ASP EEE CA  1 ? 12 
ATOM   3356 C C   . ASP C 1 113 ? 18.512  -29.804 10.802  1.000 28.583 0 442 ASP EEE C   1 ? 12 
ATOM   3357 O O   . ASP C 1 113 ? 17.807  -30.457 10.017  1.000 30.078 0 442 ASP EEE O   1 ? 12 
ATOM   3358 C CB  . ASP C 1 113 ? 17.945  -27.525 9.901   1.000 22.701 0 442 ASP EEE CB  1 ? 12 
ATOM   3359 C CG  . ASP C 1 113 ? 17.091  -26.295 10.154  1.000 22.642 0 442 ASP EEE CG  1 ? 12 
ATOM   3360 O OD1 . ASP C 1 113 ? 16.109  -26.415 10.935  1.000 22.173 0 442 ASP EEE OD1 1 ? 12 
ATOM   3361 O OD2 . ASP C 1 113 ? 17.387  -25.252 9.553   1.000 22.555 0 442 ASP EEE OD2 1 ? 12 
ATOM   3362 N N   A SER C 1 114 ? 19.649  -30.261 11.321  0.500 30.165 0 443 SER EEE N   1 ? 12 
ATOM   3363 N N   B SER C 1 114 ? 19.645  -30.261 11.332  0.500 27.983 0 443 SER EEE N   1 ? 12 
ATOM   3364 C CA  A SER C 1 114 ? 20.027  -31.694 11.277  0.500 31.106 0 443 SER EEE CA  1 ? 12 
ATOM   3365 C CA  B SER C 1 114 ? 20.060  -31.686 11.287  0.500 27.679 0 443 SER EEE CA  1 ? 12 
ATOM   3366 C C   A SER C 1 114 ? 19.918  -32.268 12.687  0.500 31.293 0 443 SER EEE C   1 ? 12 
ATOM   3367 C C   B SER C 1 114 ? 19.878  -32.269 12.690  0.500 29.362 0 443 SER EEE C   1 ? 12 
ATOM   3368 O O   A SER C 1 114 ? 19.958  -31.482 13.652  0.500 30.079 0 443 SER EEE O   1 ? 12 
ATOM   3369 O O   B SER C 1 114 ? 19.814  -31.494 13.654  0.500 28.256 0 443 SER EEE O   1 ? 12 
ATOM   3370 C CB  A SER C 1 114 ? 21.395  -31.900 10.708  0.500 33.678 0 443 SER EEE CB  1 ? 12 
ATOM   3371 C CB  B SER C 1 114 ? 21.481  -31.830 10.806  0.500 27.746 0 443 SER EEE CB  1 ? 12 
ATOM   3372 O OG  A SER C 1 114 ? 21.584  -33.284 10.463  0.500 36.728 0 443 SER EEE OG  1 ? 12 
ATOM   3373 O OG  B SER C 1 114 ? 22.389  -31.552 11.859  0.500 25.958 0 443 SER EEE OG  1 ? 12 
ATOM   3374 N N   . LYS C 1 115 ? 19.761  -33.588 12.798  1.000 30.118 0 444 LYS EEE N   1 ? 12 
ATOM   3375 C CA  . LYS C 1 115 ? 19.706  -34.259 14.117  1.000 33.178 0 444 LYS EEE CA  1 ? 12 
ATOM   3376 C C   . LYS C 1 115 ? 20.203  -35.684 13.935  1.000 32.609 0 444 LYS EEE C   1 ? 12 
ATOM   3377 O O   . LYS C 1 115 ? 20.234  -36.159 12.778  1.000 29.204 0 444 LYS EEE O   1 ? 12 
ATOM   3378 C CB  . LYS C 1 115 ? 18.305  -34.168 14.727  1.000 37.857 0 444 LYS EEE CB  1 ? 12 
ATOM   3379 C CG  . LYS C 1 115 ? 17.199  -34.825 13.923  1.000 40.457 0 444 LYS EEE CG  1 ? 12 
ATOM   3380 C CD  . LYS C 1 115 ? 15.911  -35.002 14.704  1.000 45.348 0 444 LYS EEE CD  1 ? 12 
ATOM   3381 C CE  . LYS C 1 115 ? 14.732  -35.343 13.818  1.000 48.807 0 444 LYS EEE CE  1 ? 12 
ATOM   3382 N NZ  . LYS C 1 115 ? 13.674  -36.068 14.562  1.000 55.246 0 444 LYS EEE NZ  1 ? 12 
ATOM   3383 N N   . VAL C 1 116 ? 20.582  -36.309 15.044  1.000 32.704 0 445 VAL EEE N   1 ? 12 
ATOM   3384 C CA  . VAL C 1 116 ? 21.016  -37.734 15.084  1.000 37.364 0 445 VAL EEE CA  1 ? 12 
ATOM   3385 C C   . VAL C 1 116 ? 19.860  -38.576 14.532  1.000 36.669 0 445 VAL EEE C   1 ? 12 
ATOM   3386 O O   . VAL C 1 116 ? 18.710  -38.330 14.943  1.000 34.764 0 445 VAL EEE O   1 ? 12 
ATOM   3387 C CB  . VAL C 1 116 ? 21.425  -38.149 16.508  1.000 40.731 0 445 VAL EEE CB  1 ? 12 
ATOM   3388 C CG1 . VAL C 1 116 ? 21.765  -39.631 16.590  1.000 42.631 0 445 VAL EEE CG1 1 ? 12 
ATOM   3389 C CG2 . VAL C 1 116 ? 22.581  -37.294 17.004  1.000 43.500 0 445 VAL EEE CG2 1 ? 12 
ATOM   3390 N N   . GLY C 1 117 ? 20.150  -39.461 13.574  1.000 36.179 0 446 GLY EEE N   1 ? 12 
ATOM   3391 C CA  . GLY C 1 117 ? 19.140  -40.270 12.870  1.000 38.786 0 446 GLY EEE CA  1 ? 12 
ATOM   3392 C C   . GLY C 1 117 ? 18.583  -39.539 11.656  1.000 34.292 0 446 GLY EEE C   1 ? 12 
ATOM   3393 O O   . GLY C 1 117 ? 17.792  -40.150 10.907  1.000 36.147 0 446 GLY EEE O   1 ? 12 
ATOM   3394 N N   . GLY C 1 118 ? 18.940  -38.263 11.482  1.000 30.154 0 447 GLY EEE N   1 ? 12 
ATOM   3395 C CA  . GLY C 1 118 ? 18.552  -37.443 10.324  1.000 27.891 0 447 GLY EEE CA  1 ? 12 
ATOM   3396 C C   . GLY C 1 118 ? 17.295  -36.648 10.591  1.000 25.662 0 447 GLY EEE C   1 ? 12 
ATOM   3397 O O   . GLY C 1 118 ? 16.406  -37.172 11.284  1.000 25.466 0 447 GLY EEE O   1 ? 12 
ATOM   3398 N N   . ASN C 1 119 ? 17.223  -35.427 10.066  1.000 24.439 0 448 ASN EEE N   1 ? 12 
ATOM   3399 C CA  . ASN C 1 119 ? 15.989  -34.608 10.101  1.000 22.865 0 448 ASN EEE CA  1 ? 12 
ATOM   3400 C C   . ASN C 1 119 ? 15.285  -34.758 8.756   1.000 21.622 0 448 ASN EEE C   1 ? 12 
ATOM   3401 O O   . ASN C 1 119 ? 15.813  -34.219 7.765   1.000 22.587 0 448 ASN EEE O   1 ? 12 
ATOM   3402 C CB  . ASN C 1 119 ? 16.265  -33.139 10.407  1.000 23.007 0 448 ASN EEE CB  1 ? 12 
ATOM   3403 C CG  . ASN C 1 119 ? 14.998  -32.314 10.429  1.000 25.525 0 448 ASN EEE CG  1 ? 12 
ATOM   3404 O OD1 . ASN C 1 119 ? 13.898  -32.860 10.405  1.000 26.617 0 448 ASN EEE OD1 1 ? 12 
ATOM   3405 N ND2 . ASN C 1 119 ? 15.143  -30.999 10.533  1.000 28.568 0 448 ASN EEE ND2 1 ? 12 
ATOM   3406 N N   . TYR C 1 120 ? 14.152  -35.459 8.733   1.000 21.798 0 449 TYR EEE N   1 ? 12 
ATOM   3407 C CA  . TYR C 1 120 ? 13.407  -35.784 7.489   1.000 21.732 0 449 TYR EEE CA  1 ? 12 
ATOM   3408 C C   . TYR C 1 120 ? 12.260  -34.788 7.263   1.000 22.011 0 449 TYR EEE C   1 ? 12 
ATOM   3409 O O   . TYR C 1 120 ? 11.576  -34.889 6.213   1.000 21.316 0 449 TYR EEE O   1 ? 12 
ATOM   3410 C CB  . TYR C 1 120 ? 12.948  -37.246 7.526   1.000 22.344 0 449 TYR EEE CB  1 ? 12 
ATOM   3411 C CG  . TYR C 1 120 ? 14.066  -38.237 7.355   1.000 21.849 0 449 TYR EEE CG  1 ? 12 
ATOM   3412 C CD1 . TYR C 1 120 ? 14.897  -38.558 8.415   1.000 22.864 0 449 TYR EEE CD1 1 ? 12 
ATOM   3413 C CD2 . TYR C 1 120 ? 14.332  -38.834 6.124   1.000 21.780 0 449 TYR EEE CD2 1 ? 12 
ATOM   3414 C CE1 . TYR C 1 120 ? 15.940  -39.449 8.268   1.000 23.493 0 449 TYR EEE CE1 1 ? 12 
ATOM   3415 C CE2 . TYR C 1 120 ? 15.364  -39.744 5.968   1.000 22.235 0 449 TYR EEE CE2 1 ? 12 
ATOM   3416 C CZ  . TYR C 1 120 ? 16.183  -40.048 7.044   1.000 23.998 0 449 TYR EEE CZ  1 ? 12 
ATOM   3417 O OH  . TYR C 1 120 ? 17.218  -40.935 6.929   1.000 24.813 0 449 TYR EEE OH  1 ? 12 
ATOM   3418 N N   . ASN C 1 121 ? 12.107  -33.794 8.137   1.000 23.439 0 450 ASN EEE N   1 ? 12 
ATOM   3419 C CA  . ASN C 1 121 ? 10.986  -32.818 8.088   1.000 24.412 0 450 ASN EEE CA  1 ? 12 
ATOM   3420 C C   . ASN C 1 121 ? 11.040  -31.928 6.836   1.000 23.692 0 450 ASN EEE C   1 ? 12 
ATOM   3421 O O   . ASN C 1 121 ? 9.951   -31.562 6.368   1.000 21.919 0 450 ASN EEE O   1 ? 12 
ATOM   3422 C CB  . ASN C 1 121 ? 10.943  -31.934 9.333   1.000 28.642 0 450 ASN EEE CB  1 ? 12 
ATOM   3423 C CG  . ASN C 1 121 ? 10.657  -32.710 10.602  1.000 31.895 0 450 ASN EEE CG  1 ? 12 
ATOM   3424 O OD1 . ASN C 1 121 ? 10.033  -33.761 10.577  1.000 35.260 0 450 ASN EEE OD1 1 ? 12 
ATOM   3425 N ND2 . ASN C 1 121 ? 11.099  -32.178 11.726  1.000 39.545 0 450 ASN EEE ND2 1 ? 12 
ATOM   3426 N N   . TYR C 1 122 ? 12.229  -31.572 6.323   1.000 18.892 0 451 TYR EEE N   1 ? 12 
ATOM   3427 C CA  . TYR C 1 122 ? 12.398  -30.627 5.189   1.000 19.418 0 451 TYR EEE CA  1 ? 12 
ATOM   3428 C C   . TYR C 1 122 ? 12.280  -31.397 3.877   1.000 18.175 0 451 TYR EEE C   1 ? 12 
ATOM   3429 O O   . TYR C 1 122 ? 13.008  -32.416 3.705   1.000 18.235 0 451 TYR EEE O   1 ? 12 
ATOM   3430 C CB  . TYR C 1 122 ? 13.739  -29.898 5.297   1.000 18.271 0 451 TYR EEE CB  1 ? 12 
ATOM   3431 C CG  . TYR C 1 122 ? 13.774  -28.891 6.417   1.000 19.216 0 451 TYR EEE CG  1 ? 12 
ATOM   3432 C CD1 . TYR C 1 122 ? 13.071  -27.697 6.317   1.000 20.689 0 451 TYR EEE CD1 1 ? 12 
ATOM   3433 C CD2 . TYR C 1 122 ? 14.510  -29.116 7.568   1.000 21.474 0 451 TYR EEE CD2 1 ? 12 
ATOM   3434 C CE1 . TYR C 1 122 ? 13.112  -26.746 7.322   1.000 21.466 0 451 TYR EEE CE1 1 ? 12 
ATOM   3435 C CE2 . TYR C 1 122 ? 14.539  -28.182 8.600   1.000 22.903 0 451 TYR EEE CE2 1 ? 12 
ATOM   3436 C CZ  . TYR C 1 122 ? 13.840  -26.989 8.476   1.000 23.493 0 451 TYR EEE CZ  1 ? 12 
ATOM   3437 O OH  . TYR C 1 122 ? 13.890  -26.042 9.469   1.000 22.280 0 451 TYR EEE OH  1 ? 12 
ATOM   3438 N N   . LEU C 1 123 ? 11.370  -30.937 3.019   1.000 17.167 0 452 LEU EEE N   1 ? 12 
ATOM   3439 C CA  . LEU C 1 123 ? 11.050  -31.572 1.716   1.000 17.378 0 452 LEU EEE CA  1 ? 12 
ATOM   3440 C C   . LEU C 1 123 ? 11.381  -30.625 0.565   1.000 16.294 0 452 LEU EEE C   1 ? 12 
ATOM   3441 O O   . LEU C 1 123 ? 11.450  -29.409 0.739   1.000 17.039 0 452 LEU EEE O   1 ? 12 
ATOM   3442 C CB  . LEU C 1 123 ? 9.559   -31.935 1.652   1.000 18.282 0 452 LEU EEE CB  1 ? 12 
ATOM   3443 C CG  . LEU C 1 123 ? 8.998   -32.757 2.812   1.000 20.249 0 452 LEU EEE CG  1 ? 12 
ATOM   3444 C CD1 . LEU C 1 123 ? 7.524   -33.103 2.579   1.000 21.771 0 452 LEU EEE CD1 1 ? 12 
ATOM   3445 C CD2 . LEU C 1 123 ? 9.791   -34.024 3.007   1.000 19.342 0 452 LEU EEE CD2 1 ? 12 
ATOM   3446 N N   . TYR C 1 124 ? 11.517  -31.195 -0.608  1.000 15.956 0 453 TYR EEE N   1 ? 12 
ATOM   3447 C CA  . TYR C 1 124 ? 11.686  -30.463 -1.878  1.000 16.252 0 453 TYR EEE CA  1 ? 12 
ATOM   3448 C C   . TYR C 1 124 ? 10.863  -31.191 -2.926  1.000 16.263 0 453 TYR EEE C   1 ? 12 
ATOM   3449 O O   . TYR C 1 124 ? 10.642  -32.440 -2.796  1.000 18.075 0 453 TYR EEE O   1 ? 12 
ATOM   3450 C CB  . TYR C 1 124 ? 13.170  -30.342 -2.256  1.000 17.546 0 453 TYR EEE CB  1 ? 12 
ATOM   3451 C CG  . TYR C 1 124 ? 13.837  -31.667 -2.500  1.000 19.406 0 453 TYR EEE CG  1 ? 12 
ATOM   3452 C CD1 . TYR C 1 124 ? 14.412  -32.378 -1.461  1.000 19.233 0 453 TYR EEE CD1 1 ? 12 
ATOM   3453 C CD2 . TYR C 1 124 ? 13.851  -32.239 -3.760  1.000 19.962 0 453 TYR EEE CD2 1 ? 12 
ATOM   3454 C CE1 . TYR C 1 124 ? 14.979  -33.628 -1.659  1.000 20.797 0 453 TYR EEE CE1 1 ? 12 
ATOM   3455 C CE2 . TYR C 1 124 ? 14.420  -33.481 -3.978  1.000 21.747 0 453 TYR EEE CE2 1 ? 12 
ATOM   3456 C CZ  . TYR C 1 124 ? 14.984  -34.183 -2.929  1.000 22.033 0 453 TYR EEE CZ  1 ? 12 
ATOM   3457 O OH  . TYR C 1 124 ? 15.553  -35.411 -3.133  1.000 24.223 0 453 TYR EEE OH  1 ? 12 
ATOM   3458 N N   . ARG C 1 125 ? 10.472  -30.469 -3.969  1.000 17.501 0 454 ARG EEE N   1 ? 12 
ATOM   3459 C CA  . ARG C 1 125 ? 9.816   -31.065 -5.158  1.000 17.175 0 454 ARG EEE CA  1 ? 12 
ATOM   3460 C C   . ARG C 1 125 ? 10.913  -31.514 -6.119  1.000 17.183 0 454 ARG EEE C   1 ? 12 
ATOM   3461 O O   . ARG C 1 125 ? 11.752  -30.685 -6.468  1.000 17.663 0 454 ARG EEE O   1 ? 12 
ATOM   3462 C CB  . ARG C 1 125 ? 8.843   -30.080 -5.804  1.000 17.997 0 454 ARG EEE CB  1 ? 12 
ATOM   3463 C CG  . ARG C 1 125 ? 8.046   -30.653 -6.964  1.000 18.232 0 454 ARG EEE CG  1 ? 12 
ATOM   3464 C CD  . ARG C 1 125 ? 7.044   -29.679 -7.569  1.000 19.805 0 454 ARG EEE CD  1 ? 12 
ATOM   3465 N NE  . ARG C 1 125 ? 6.160   -29.229 -6.516  1.000 18.729 0 454 ARG EEE NE  1 ? 12 
ATOM   3466 C CZ  . ARG C 1 125 ? 5.061   -29.850 -6.098  1.000 18.866 0 454 ARG EEE CZ  1 ? 12 
ATOM   3467 N NH1 . ARG C 1 125 ? 4.669   -30.998 -6.643  1.000 19.050 0 454 ARG EEE NH1 1 ? 12 
ATOM   3468 N NH2 . ARG C 1 125 ? 4.398   -29.336 -5.067  1.000 19.004 0 454 ARG EEE NH2 1 ? 12 
ATOM   3469 N N   . LEU C 1 126 ? 10.891  -32.787 -6.514  1.000 17.080 0 455 LEU EEE N   1 ? 12 
ATOM   3470 C CA  . LEU C 1 126 ? 11.900  -33.387 -7.424  1.000 19.533 0 455 LEU EEE CA  1 ? 12 
ATOM   3471 C C   . LEU C 1 126 ? 11.363  -33.469 -8.855  1.000 19.834 0 455 LEU EEE C   1 ? 12 
ATOM   3472 O O   . LEU C 1 126 ? 12.184  -33.533 -9.776  1.000 20.536 0 455 LEU EEE O   1 ? 12 
ATOM   3473 C CB  . LEU C 1 126 ? 12.261  -34.778 -6.905  1.000 19.377 0 455 LEU EEE CB  1 ? 12 
ATOM   3474 C CG  . LEU C 1 126 ? 13.357  -35.505 -7.681  1.000 19.761 0 455 LEU EEE CG  1 ? 12 
ATOM   3475 C CD1 . LEU C 1 126 ? 14.612  -34.653 -7.822  1.000 20.933 0 455 LEU EEE CD1 1 ? 12 
ATOM   3476 C CD2 . LEU C 1 126 ? 13.672  -36.849 -7.028  1.000 21.716 0 455 LEU EEE CD2 1 ? 12 
ATOM   3477 N N   . PHE C 1 127 ? 10.044  -33.531 -9.038  1.000 20.022 0 456 PHE EEE N   1 ? 12 
ATOM   3478 C CA  . PHE C 1 127 ? 9.410   -33.750 -10.361 1.000 20.265 0 456 PHE EEE CA  1 ? 12 
ATOM   3479 C C   . PHE C 1 127 ? 8.317   -32.713 -10.610 1.000 20.232 0 456 PHE EEE C   1 ? 12 
ATOM   3480 O O   . PHE C 1 127 ? 7.527   -32.429 -9.698  1.000 19.869 0 456 PHE EEE O   1 ? 12 
ATOM   3481 C CB  . PHE C 1 127 ? 8.813   -35.158 -10.442 1.000 21.091 0 456 PHE EEE CB  1 ? 12 
ATOM   3482 C CG  . PHE C 1 127 ? 9.800   -36.260 -10.168 1.000 22.873 0 456 PHE EEE CG  1 ? 12 
ATOM   3483 C CD1 . PHE C 1 127 ? 10.707  -36.649 -11.139 1.000 24.157 0 456 PHE EEE CD1 1 ? 12 
ATOM   3484 C CD2 . PHE C 1 127 ? 9.847   -36.871 -8.922  1.000 23.179 0 456 PHE EEE CD2 1 ? 12 
ATOM   3485 C CE1 . PHE C 1 127 ? 11.632  -37.652 -10.887 1.000 25.525 0 456 PHE EEE CE1 1 ? 12 
ATOM   3486 C CE2 . PHE C 1 127 ? 10.773  -37.875 -8.671  1.000 24.200 0 456 PHE EEE CE2 1 ? 12 
ATOM   3487 C CZ  . PHE C 1 127 ? 11.647  -38.277 -9.659  1.000 24.440 0 456 PHE EEE CZ  1 ? 12 
ATOM   3488 N N   . ARG C 1 128 ? 8.259   -32.187 -11.840 1.000 21.609 0 457 ARG EEE N   1 ? 12 
ATOM   3489 C CA  . ARG C 1 128 ? 7.182   -31.276 -12.285 1.000 21.558 0 457 ARG EEE CA  1 ? 12 
ATOM   3490 C C   . ARG C 1 128 ? 7.142   -31.302 -13.814 1.000 23.535 0 457 ARG EEE C   1 ? 12 
ATOM   3491 O O   . ARG C 1 128 ? 8.218   -31.466 -14.439 1.000 23.139 0 457 ARG EEE O   1 ? 12 
ATOM   3492 C CB  . ARG C 1 128 ? 7.409   -29.874 -11.714 1.000 21.460 0 457 ARG EEE CB  1 ? 12 
ATOM   3493 C CG  . ARG C 1 128 ? 6.155   -29.017 -11.618 1.000 21.848 0 457 ARG EEE CG  1 ? 12 
ATOM   3494 C CD  . ARG C 1 128 ? 6.407   -27.705 -10.897 1.000 22.974 0 457 ARG EEE CD  1 ? 12 
ATOM   3495 N NE  . ARG C 1 128 ? 5.159   -26.996 -10.671 1.000 24.353 0 457 ARG EEE NE  1 ? 12 
ATOM   3496 C CZ  . ARG C 1 128 ? 4.639   -26.064 -11.470 1.000 28.433 0 457 ARG EEE CZ  1 ? 12 
ATOM   3497 N NH1 . ARG C 1 128 ? 5.271   -25.683 -12.570 1.000 27.029 0 457 ARG EEE NH1 1 ? 12 
ATOM   3498 N NH2 . ARG C 1 128 ? 3.481   -25.507 -11.149 1.000 29.045 0 457 ARG EEE NH2 1 ? 12 
ATOM   3499 N N   . LYS C 1 129 ? 5.957   -31.143 -14.396 1.000 25.033 0 458 LYS EEE N   1 ? 12 
ATOM   3500 C CA  . LYS C 1 129 ? 5.780   -31.187 -15.871 1.000 28.125 0 458 LYS EEE CA  1 ? 12 
ATOM   3501 C C   . LYS C 1 129 ? 6.347   -29.924 -16.531 1.000 28.665 0 458 LYS EEE C   1 ? 12 
ATOM   3502 O O   . LYS C 1 129 ? 6.566   -29.940 -17.756 1.000 28.768 0 458 LYS EEE O   1 ? 12 
ATOM   3503 C CB  . LYS C 1 129 ? 4.297   -31.360 -16.195 1.000 31.211 0 458 LYS EEE CB  1 ? 12 
ATOM   3504 C CG  . LYS C 1 129 ? 3.755   -32.748 -15.885 1.000 33.913 0 458 LYS EEE CG  1 ? 12 
ATOM   3505 C CD  . LYS C 1 129 ? 2.244   -32.770 -15.650 1.000 38.797 0 458 LYS EEE CD  1 ? 12 
ATOM   3506 C CE  . LYS C 1 129 ? 1.431   -32.710 -16.913 1.000 44.125 0 458 LYS EEE CE  1 ? 12 
ATOM   3507 N NZ  . LYS C 1 129 ? -0.016  -32.593 -16.611 1.000 47.884 0 458 LYS EEE NZ  1 ? 12 
ATOM   3508 N N   . SER C 1 130 ? 6.512   -28.847 -15.776 1.000 27.192 0 459 SER EEE N   1 ? 12 
ATOM   3509 C CA  . SER C 1 130 ? 6.989   -27.542 -16.295 1.000 28.613 0 459 SER EEE CA  1 ? 12 
ATOM   3510 C C   . SER C 1 130 ? 7.658   -26.760 -15.168 1.000 27.135 0 459 SER EEE C   1 ? 12 
ATOM   3511 O O   . SER C 1 130 ? 7.439   -27.105 -13.980 1.000 26.305 0 459 SER EEE O   1 ? 12 
ATOM   3512 C CB  . SER C 1 130 ? 5.856   -26.762 -16.916 1.000 31.582 0 459 SER EEE CB  1 ? 12 
ATOM   3513 O OG  . SER C 1 130 ? 4.979   -26.294 -15.906 1.000 32.991 0 459 SER EEE OG  1 ? 12 
ATOM   3514 N N   . ASN C 1 131 ? 8.465   -25.765 -15.524 1.000 26.226 0 460 ASN EEE N   1 ? 12 
ATOM   3515 C CA  . ASN C 1 131 ? 9.179   -24.921 -14.530 1.000 26.554 0 460 ASN EEE CA  1 ? 12 
ATOM   3516 C C   . ASN C 1 131 ? 8.183   -23.949 -13.902 1.000 25.813 0 460 ASN EEE C   1 ? 12 
ATOM   3517 O O   . ASN C 1 131 ? 7.250   -23.531 -14.591 1.000 26.388 0 460 ASN EEE O   1 ? 12 
ATOM   3518 C CB  . ASN C 1 131 ? 10.337  -24.141 -15.146 1.000 27.656 0 460 ASN EEE CB  1 ? 12 
ATOM   3519 C CG  . ASN C 1 131 ? 11.424  -25.042 -15.679 1.000 29.222 0 460 ASN EEE CG  1 ? 12 
ATOM   3520 O OD1 . ASN C 1 131 ? 11.453  -26.230 -15.364 1.000 30.343 0 460 ASN EEE OD1 1 ? 12 
ATOM   3521 N ND2 . ASN C 1 131 ? 12.313  -24.476 -16.481 1.000 31.455 0 460 ASN EEE ND2 1 ? 12 
ATOM   3522 N N   . LEU C 1 132 ? 8.399   -23.611 -12.640 1.000 24.087 0 461 LEU EEE N   1 ? 12 
ATOM   3523 C CA  . LEU C 1 132 ? 7.674   -22.518 -11.949 1.000 25.043 0 461 LEU EEE CA  1 ? 12 
ATOM   3524 C C   . LEU C 1 132 ? 7.880   -21.196 -12.681 1.000 27.554 0 461 LEU EEE C   1 ? 12 
ATOM   3525 O O   . LEU C 1 132 ? 9.001   -20.942 -13.178 1.000 27.461 0 461 LEU EEE O   1 ? 12 
ATOM   3526 C CB  . LEU C 1 132 ? 8.197   -22.383 -10.519 1.000 23.745 0 461 LEU EEE CB  1 ? 12 
ATOM   3527 C CG  . LEU C 1 132 ? 7.893   -23.555 -9.597  1.000 23.614 0 461 LEU EEE CG  1 ? 12 
ATOM   3528 C CD1 . LEU C 1 132 ? 8.490   -23.285 -8.236  1.000 23.249 0 461 LEU EEE CD1 1 ? 12 
ATOM   3529 C CD2 . LEU C 1 132 ? 6.392   -23.787 -9.482  1.000 25.754 0 461 LEU EEE CD2 1 ? 12 
ATOM   3530 N N   . LYS C 1 133 ? 6.856   -20.354 -12.659 1.000 28.704 0 462 LYS EEE N   1 ? 12 
ATOM   3531 C CA  . LYS C 1 133 ? 6.983   -18.904 -12.942 1.000 31.997 0 462 LYS EEE CA  1 ? 12 
ATOM   3532 C C   . LYS C 1 133 ? 7.653   -18.258 -11.734 1.000 30.232 0 462 LYS EEE C   1 ? 12 
ATOM   3533 O O   . LYS C 1 133 ? 7.638   -18.821 -10.635 1.000 26.031 0 462 LYS EEE O   1 ? 12 
ATOM   3534 C CB  . LYS C 1 133 ? 5.612   -18.291 -13.231 1.000 38.157 0 462 LYS EEE CB  1 ? 12 
ATOM   3535 C CG  . LYS C 1 133 ? 4.945   -18.776 -14.509 1.000 44.061 0 462 LYS EEE CG  1 ? 12 
ATOM   3536 C CD  . LYS C 1 133 ? 3.516   -18.272 -14.648 1.000 51.791 0 462 LYS EEE CD  1 ? 12 
ATOM   3537 C CE  . LYS C 1 133 ? 2.980   -18.330 -16.065 1.000 58.891 0 462 LYS EEE CE  1 ? 12 
ATOM   3538 N NZ  . LYS C 1 133 ? 2.461   -19.676 -16.409 1.000 62.914 0 462 LYS EEE NZ  1 ? 12 
ATOM   3539 N N   . PRO C 1 134 ? 8.287   -17.077 -11.901 1.000 29.390 0 463 PRO EEE N   1 ? 12 
ATOM   3540 C CA  . PRO C 1 134 ? 8.886   -16.375 -10.771 1.000 28.552 0 463 PRO EEE CA  1 ? 12 
ATOM   3541 C C   . PRO C 1 134 ? 7.864   -16.177 -9.640  1.000 26.365 0 463 PRO EEE C   1 ? 12 
ATOM   3542 O O   . PRO C 1 134 ? 6.725   -15.793 -9.925  1.000 26.957 0 463 PRO EEE O   1 ? 12 
ATOM   3543 C CB  . PRO C 1 134 ? 9.350   -15.041 -11.365 1.000 31.133 0 463 PRO EEE CB  1 ? 12 
ATOM   3544 C CG  . PRO C 1 134 ? 9.540   -15.337 -12.844 1.000 32.265 0 463 PRO EEE CG  1 ? 12 
ATOM   3545 C CD  . PRO C 1 134 ? 8.474   -16.364 -13.174 1.000 32.672 0 463 PRO EEE CD  1 ? 12 
ATOM   3546 N N   . PHE C 1 135 ? 8.275   -16.510 -8.414  1.000 24.607 0 464 PHE EEE N   1 ? 12 
ATOM   3547 C CA  . PHE C 1 135 ? 7.493   -16.329 -7.163  1.000 26.008 0 464 PHE EEE CA  1 ? 12 
ATOM   3548 C C   . PHE C 1 135 ? 6.229   -17.194 -7.181  1.000 27.108 0 464 PHE EEE C   1 ? 12 
ATOM   3549 O O   . PHE C 1 135 ? 5.337   -16.939 -6.365  1.000 28.369 0 464 PHE EEE O   1 ? 12 
ATOM   3550 C CB  . PHE C 1 135 ? 7.145   -14.848 -6.973  1.000 27.366 0 464 PHE EEE CB  1 ? 12 
ATOM   3551 C CG  . PHE C 1 135 ? 8.336   -13.951 -6.749  1.000 27.553 0 464 PHE EEE CG  1 ? 12 
ATOM   3552 C CD1 . PHE C 1 135 ? 9.249   -14.224 -5.740  1.000 26.123 0 464 PHE EEE CD1 1 ? 12 
ATOM   3553 C CD2 . PHE C 1 135 ? 8.521   -12.816 -7.524  1.000 28.602 0 464 PHE EEE CD2 1 ? 12 
ATOM   3554 C CE1 . PHE C 1 135 ? 10.330  -13.385 -5.518  1.000 26.398 0 464 PHE EEE CE1 1 ? 12 
ATOM   3555 C CE2 . PHE C 1 135 ? 9.610   -11.992 -7.313  1.000 29.362 0 464 PHE EEE CE2 1 ? 12 
ATOM   3556 C CZ  . PHE C 1 135 ? 10.503  -12.270 -6.306  1.000 27.466 0 464 PHE EEE CZ  1 ? 12 
ATOM   3557 N N   . GLU C 1 136 ? 6.173   -18.210 -8.043  1.000 26.932 0 465 GLU EEE N   1 ? 12 
ATOM   3558 C CA  . GLU C 1 136 ? 5.092   -19.230 -8.017  1.000 27.851 0 465 GLU EEE CA  1 ? 12 
ATOM   3559 C C   . GLU C 1 136 ? 5.390   -20.191 -6.865  1.000 25.251 0 465 GLU EEE C   1 ? 12 
ATOM   3560 O O   . GLU C 1 136 ? 6.579   -20.516 -6.622  1.000 22.424 0 465 GLU EEE O   1 ? 12 
ATOM   3561 C CB  . GLU C 1 136 ? 4.986   -19.986 -9.339  1.000 28.855 0 465 GLU EEE CB  1 ? 12 
ATOM   3562 C CG  . GLU C 1 136 ? 3.751   -20.867 -9.430  1.000 30.844 0 465 GLU EEE CG  1 ? 12 
ATOM   3563 C CD  . GLU C 1 136 ? 3.512   -21.516 -10.779 1.000 33.683 0 465 GLU EEE CD  1 ? 12 
ATOM   3564 O OE1 . GLU C 1 136 ? 4.353   -21.339 -11.686 1.000 33.994 0 465 GLU EEE OE1 1 ? 12 
ATOM   3565 O OE2 . GLU C 1 136 ? 2.471   -22.193 -10.916 1.000 36.193 0 465 GLU EEE OE2 1 ? 12 
ATOM   3566 N N   . ARG C 1 137 ? 4.341   -20.592 -6.155  1.000 24.253 0 466 ARG EEE N   1 ? 12 
ATOM   3567 C CA  . ARG C 1 137 ? 4.429   -21.668 -5.149  1.000 23.341 0 466 ARG EEE CA  1 ? 12 
ATOM   3568 C C   . ARG C 1 137 ? 3.545   -22.826 -5.615  1.000 23.719 0 466 ARG EEE C   1 ? 12 
ATOM   3569 O O   . ARG C 1 137 ? 2.373   -22.588 -5.951  1.000 24.054 0 466 ARG EEE O   1 ? 12 
ATOM   3570 C CB  . ARG C 1 137 ? 4.021   -21.183 -3.757  1.000 23.244 0 466 ARG EEE CB  1 ? 12 
ATOM   3571 C CG  . ARG C 1 137 ? 4.299   -22.229 -2.685  1.000 23.377 0 466 ARG EEE CG  1 ? 12 
ATOM   3572 C CD  . ARG C 1 137 ? 3.703   -21.904 -1.339  1.000 26.343 0 466 ARG EEE CD  1 ? 12 
ATOM   3573 N NE  . ARG C 1 137 ? 4.249   -20.690 -0.798  1.000 26.567 0 466 ARG EEE NE  1 ? 12 
ATOM   3574 C CZ  . ARG C 1 137 ? 3.616   -19.519 -0.715  1.000 31.120 0 466 ARG EEE CZ  1 ? 12 
ATOM   3575 N NH1 . ARG C 1 137 ? 2.356   -19.392 -1.112  1.000 32.340 0 466 ARG EEE NH1 1 ? 12 
ATOM   3576 N NH2 . ARG C 1 137 ? 4.245   -18.476 -0.205  1.000 31.428 0 466 ARG EEE NH2 1 ? 12 
ATOM   3577 N N   . ASP C 1 138 ? 4.086   -24.036 -5.604  1.000 23.253 0 467 ASP EEE N   1 ? 12 
ATOM   3578 C CA  . ASP C 1 138 ? 3.323   -25.266 -5.923  1.000 23.849 0 467 ASP EEE CA  1 ? 12 
ATOM   3579 C C   . ASP C 1 138 ? 3.341   -26.155 -4.681  1.000 21.627 0 467 ASP EEE C   1 ? 12 
ATOM   3580 O O   . ASP C 1 138 ? 4.428   -26.625 -4.323  1.000 19.434 0 467 ASP EEE O   1 ? 12 
ATOM   3581 C CB  . ASP C 1 138 ? 3.902   -25.952 -7.166  1.000 24.520 0 467 ASP EEE CB  1 ? 12 
ATOM   3582 C CG  . ASP C 1 138 ? 3.104   -27.165 -7.623  1.000 25.678 0 467 ASP EEE CG  1 ? 12 
ATOM   3583 O OD1 . ASP C 1 138 ? 2.110   -27.506 -6.944  1.000 26.225 0 467 ASP EEE OD1 1 ? 12 
ATOM   3584 O OD2 . ASP C 1 138 ? 3.458   -27.735 -8.663  1.000 26.281 0 467 ASP EEE OD2 1 ? 12 
ATOM   3585 N N   . ILE C 1 139 ? 2.183   -26.360 -4.040  1.000 21.143 0 468 ILE EEE N   1 ? 12 
ATOM   3586 C CA  . ILE C 1 139 ? 2.080   -27.281 -2.865  1.000 21.772 0 468 ILE EEE CA  1 ? 12 
ATOM   3587 C C   . ILE C 1 139 ? 1.219   -28.499 -3.214  1.000 21.354 0 468 ILE EEE C   1 ? 12 
ATOM   3588 O O   . ILE C 1 139 ? 0.819   -29.228 -2.263  1.000 21.243 0 468 ILE EEE O   1 ? 12 
ATOM   3589 C CB  . ILE C 1 139 ? 1.564   -26.568 -1.605  1.000 22.240 0 468 ILE EEE CB  1 ? 12 
ATOM   3590 C CG1 . ILE C 1 139 ? 0.171   -25.965 -1.810  1.000 23.970 0 468 ILE EEE CG1 1 ? 12 
ATOM   3591 C CG2 . ILE C 1 139 ? 2.582   -25.554 -1.117  1.000 22.320 0 468 ILE EEE CG2 1 ? 12 
ATOM   3592 C CD1 . ILE C 1 139 ? -0.439  -25.394 -0.557  1.000 26.905 0 468 ILE EEE CD1 1 ? 12 
ATOM   3593 N N   . SER C 1 140 ? 0.949   -28.741 -4.504  1.000 21.455 0 469 SER EEE N   1 ? 12 
ATOM   3594 C CA  . SER C 1 140 ? 0.178   -29.914 -4.977  1.000 22.671 0 469 SER EEE CA  1 ? 12 
ATOM   3595 C C   . SER C 1 140 ? 1.014   -31.191 -4.797  1.000 21.861 0 469 SER EEE C   1 ? 12 
ATOM   3596 O O   . SER C 1 140 ? 2.270   -31.107 -4.712  1.000 21.159 0 469 SER EEE O   1 ? 12 
ATOM   3597 C CB  . SER C 1 140 ? -0.300  -29.746 -6.421  1.000 23.892 0 469 SER EEE CB  1 ? 12 
ATOM   3598 O OG  . SER C 1 140 ? 0.800   -29.718 -7.314  1.000 25.459 0 469 SER EEE OG  1 ? 12 
ATOM   3599 N N   . THR C 1 141 ? 0.337   -32.338 -4.750  1.000 22.176 0 470 THR EEE N   1 ? 12 
ATOM   3600 C CA  . THR C 1 141 ? 0.976   -33.668 -4.567  1.000 23.100 0 470 THR EEE CA  1 ? 12 
ATOM   3601 C C   . THR C 1 141 ? 0.333   -34.665 -5.534  1.000 23.690 0 470 THR EEE C   1 ? 12 
ATOM   3602 O O   . THR C 1 141 ? 0.052   -35.799 -5.123  1.000 24.688 0 470 THR EEE O   1 ? 12 
ATOM   3603 C CB  . THR C 1 141 ? 0.914   -34.098 -3.100  1.000 25.973 0 470 THR EEE CB  1 ? 12 
ATOM   3604 O OG1 . THR C 1 141 ? -0.448  -33.980 -2.681  1.000 26.789 0 470 THR EEE OG1 1 ? 12 
ATOM   3605 C CG2 . THR C 1 141 ? 1.829   -33.272 -2.222  1.000 26.853 0 470 THR EEE CG2 1 ? 12 
ATOM   3606 N N   . GLU C 1 142 ? 0.132   -34.246 -6.782  1.000 23.657 0 471 GLU EEE N   1 ? 13 
ATOM   3607 C CA  . GLU C 1 142 ? -0.336  -35.094 -7.903  1.000 24.271 0 471 GLU EEE CA  1 ? 13 
ATOM   3608 C C   . GLU C 1 142 ? 0.761   -36.112 -8.200  1.000 21.425 0 471 GLU EEE C   1 ? 13 
ATOM   3609 O O   . GLU C 1 142 ? 1.956   -35.741 -8.195  1.000 19.289 0 471 GLU EEE O   1 ? 13 
ATOM   3610 C CB  . GLU C 1 142 ? -0.641  -34.251 -9.145  1.000 29.677 0 471 GLU EEE CB  1 ? 13 
ATOM   3611 C CG  . GLU C 1 142 ? -0.947  -35.076 -10.380 1.000 35.645 0 471 GLU EEE CG  1 ? 13 
ATOM   3612 C CD  . GLU C 1 142 ? -1.272  -34.306 -11.657 1.000 44.318 0 471 GLU EEE CD  1 ? 13 
ATOM   3613 O OE1 . GLU C 1 142 ? -2.381  -34.531 -12.201 1.000 46.846 0 471 GLU EEE OE1 1 ? 13 
ATOM   3614 O OE2 . GLU C 1 142 ? -0.408  -33.514 -12.140 1.000 42.239 0 471 GLU EEE OE2 1 ? 13 
ATOM   3615 N N   . ILE C 1 143 ? 0.391   -37.363 -8.453  1.000 21.428 0 472 ILE EEE N   1 ? 13 
ATOM   3616 C CA  . ILE C 1 143 ? 1.401   -38.383 -8.852  1.000 21.567 0 472 ILE EEE CA  1 ? 13 
ATOM   3617 C C   . ILE C 1 143 ? 1.963   -37.967 -10.209 1.000 22.189 0 472 ILE EEE C   1 ? 13 
ATOM   3618 O O   . ILE C 1 143 ? 1.174   -37.667 -11.125 1.000 24.743 0 472 ILE EEE O   1 ? 13 
ATOM   3619 C CB  . ILE C 1 143 ? 0.824   -39.810 -8.827  1.000 21.492 0 472 ILE EEE CB  1 ? 13 
ATOM   3620 C CG1 . ILE C 1 143 ? 0.279   -40.154 -7.435  1.000 22.272 0 472 ILE EEE CG1 1 ? 13 
ATOM   3621 C CG2 . ILE C 1 143 ? 1.878   -40.808 -9.285  1.000 22.362 0 472 ILE EEE CG2 1 ? 13 
ATOM   3622 C CD1 . ILE C 1 143 ? 1.267   -39.955 -6.323  1.000 22.413 0 472 ILE EEE CD1 1 ? 13 
ATOM   3623 N N   . TYR C 1 144 ? 3.291   -37.923 -10.310 1.000 19.125 0 473 TYR EEE N   1 ? 13 
ATOM   3624 C CA  . TYR C 1 144 ? 4.024   -37.501 -11.516 1.000 20.658 0 473 TYR EEE CA  1 ? 13 
ATOM   3625 C C   . TYR C 1 144 ? 4.235   -38.714 -12.431 1.000 19.623 0 473 TYR EEE C   1 ? 13 
ATOM   3626 O O   . TYR C 1 144 ? 4.830   -39.730 -12.018 1.000 18.935 0 473 TYR EEE O   1 ? 13 
ATOM   3627 C CB  . TYR C 1 144 ? 5.344   -36.860 -11.110 1.000 19.897 0 473 TYR EEE CB  1 ? 13 
ATOM   3628 C CG  . TYR C 1 144 ? 6.208   -36.514 -12.283 1.000 21.352 0 473 TYR EEE CG  1 ? 13 
ATOM   3629 C CD1 . TYR C 1 144 ? 6.015   -35.322 -12.959 1.000 22.494 0 473 TYR EEE CD1 1 ? 13 
ATOM   3630 C CD2 . TYR C 1 144 ? 7.183   -37.388 -12.745 1.000 21.689 0 473 TYR EEE CD2 1 ? 13 
ATOM   3631 C CE1 . TYR C 1 144 ? 6.794   -34.992 -14.052 1.000 25.142 0 473 TYR EEE CE1 1 ? 13 
ATOM   3632 C CE2 . TYR C 1 144 ? 7.966   -37.067 -13.837 1.000 23.780 0 473 TYR EEE CE2 1 ? 13 
ATOM   3633 C CZ  . TYR C 1 144 ? 7.783   -35.854 -14.477 1.000 25.292 0 473 TYR EEE CZ  1 ? 13 
ATOM   3634 O OH  . TYR C 1 144 ? 8.536   -35.488 -15.551 1.000 29.248 0 473 TYR EEE OH  1 ? 13 
ATOM   3635 N N   . GLN C 1 145 ? 3.755   -38.603 -13.657 1.000 20.243 0 474 GLN EEE N   1 ? 13 
ATOM   3636 C CA  . GLN C 1 145 ? 3.844   -39.696 -14.649 1.000 20.632 0 474 GLN EEE CA  1 ? 13 
ATOM   3637 C C   . GLN C 1 145 ? 5.210   -39.613 -15.330 1.000 22.272 0 474 GLN EEE C   1 ? 13 
ATOM   3638 O O   . GLN C 1 145 ? 5.431   -38.653 -16.093 1.000 23.463 0 474 GLN EEE O   1 ? 13 
ATOM   3639 C CB  . GLN C 1 145 ? 2.687   -39.578 -15.627 1.000 21.224 0 474 GLN EEE CB  1 ? 13 
ATOM   3640 C CG  . GLN C 1 145 ? 2.611   -40.761 -16.587 1.000 21.295 0 474 GLN EEE CG  1 ? 13 
ATOM   3641 C CD  . GLN C 1 145 ? 1.582   -40.551 -17.657 1.000 21.618 0 474 GLN EEE CD  1 ? 13 
ATOM   3642 O OE1 . GLN C 1 145 ? 0.472   -40.100 -17.396 1.000 23.533 0 474 GLN EEE OE1 1 ? 13 
ATOM   3643 N NE2 . GLN C 1 145 ? 1.939   -40.903 -18.881 1.000 23.312 0 474 GLN EEE NE2 1 ? 13 
ATOM   3644 N N   . ALA C 1 146 ? 6.074   -40.597 -15.085 1.000 22.675 0 475 ALA EEE N   1 ? 13 
ATOM   3645 C CA  . ALA C 1 146 ? 7.439   -40.658 -15.667 1.000 23.761 0 475 ALA EEE CA  1 ? 13 
ATOM   3646 C C   . ALA C 1 146 ? 7.507   -41.538 -16.921 1.000 25.994 0 475 ALA EEE C   1 ? 13 
ATOM   3647 O O   . ALA C 1 146 ? 8.509   -41.419 -17.650 1.000 28.066 0 475 ALA EEE O   1 ? 13 
ATOM   3648 C CB  . ALA C 1 146 ? 8.420   -41.115 -14.628 1.000 24.885 0 475 ALA EEE CB  1 ? 13 
ATOM   3649 N N   . GLY C 1 147 ? 6.485   -42.357 -17.205 1.000 23.629 0 476 GLY EEE N   1 ? 13 
ATOM   3650 C CA  . GLY C 1 147 ? 6.442   -43.204 -18.410 1.000 26.923 0 476 GLY EEE CA  1 ? 13 
ATOM   3651 C C   . GLY C 1 147 ? 5.247   -42.864 -19.285 1.000 26.935 0 476 GLY EEE C   1 ? 13 
ATOM   3652 O O   . GLY C 1 147 ? 4.739   -41.740 -19.180 1.000 26.404 0 476 GLY EEE O   1 ? 13 
ATOM   3653 N N   . SER C 1 148 ? 4.814   -43.804 -20.111 1.000 26.770 0 477 SER EEE N   1 ? 13 
ATOM   3654 C CA  . SER C 1 148 ? 3.738   -43.585 -21.108 1.000 27.992 0 477 SER EEE CA  1 ? 13 
ATOM   3655 C C   . SER C 1 148 ? 2.477   -44.336 -20.668 1.000 27.261 0 477 SER EEE C   1 ? 13 
ATOM   3656 O O   . SER C 1 148 ? 1.590   -44.544 -21.506 1.000 28.901 0 477 SER EEE O   1 ? 13 
ATOM   3657 C CB  . SER C 1 148 ? 4.214   -43.927 -22.502 1.000 31.917 0 477 SER EEE CB  1 ? 13 
ATOM   3658 O OG  . SER C 1 148 ? 4.696   -45.256 -22.555 1.000 34.355 0 477 SER EEE OG  1 ? 13 
ATOM   3659 N N   . THR C 1 149 ? 2.409   -44.738 -19.396 1.000 24.980 0 478 THR EEE N   1 ? 13 
ATOM   3660 C CA  A THR C 1 149 ? 1.216   -45.373 -18.772 0.500 24.976 0 478 THR EEE CA  1 ? 13 
ATOM   3661 C CA  B THR C 1 149 ? 1.194   -45.350 -18.807 0.500 25.598 0 478 THR EEE CA  1 ? 13 
ATOM   3662 C C   . THR C 1 149 ? 0.601   -44.386 -17.788 1.000 24.121 0 478 THR EEE C   1 ? 13 
ATOM   3663 O O   . THR C 1 149 ? 1.311   -43.848 -16.935 1.000 23.952 0 478 THR EEE O   1 ? 13 
ATOM   3664 C CB  A THR C 1 149 ? 1.584   -46.665 -18.023 0.500 25.360 0 478 THR EEE CB  1 ? 13 
ATOM   3665 C CB  B THR C 1 149 ? 1.512   -46.722 -18.206 0.500 26.944 0 478 THR EEE CB  1 ? 13 
ATOM   3666 O OG1 A THR C 1 149 ? 2.382   -47.464 -18.896 0.500 26.505 0 478 THR EEE OG1 1 ? 13 
ATOM   3667 O OG1 B THR C 1 149 ? 2.570   -46.534 -17.264 0.500 28.532 0 478 THR EEE OG1 1 ? 13 
ATOM   3668 C CG2 A THR C 1 149 ? 0.370   -47.430 -17.542 0.500 24.699 0 478 THR EEE CG2 1 ? 13 
ATOM   3669 C CG2 B THR C 1 149 ? 1.892   -47.726 -19.274 0.500 27.825 0 478 THR EEE CG2 1 ? 13 
ATOM   3670 N N   . PRO C 1 150 ? -0.722  -44.129 -17.837 1.000 22.693 0 479 PRO EEE N   1 ? 13 
ATOM   3671 C CA  . PRO C 1 150 ? -1.344  -43.274 -16.833 1.000 22.215 0 479 PRO EEE CA  1 ? 13 
ATOM   3672 C C   . PRO C 1 150 ? -1.140  -43.846 -15.422 1.000 22.330 0 479 PRO EEE C   1 ? 13 
ATOM   3673 O O   . PRO C 1 150 ? -1.189  -45.064 -15.248 1.000 21.354 0 479 PRO EEE O   1 ? 13 
ATOM   3674 C CB  . PRO C 1 150 ? -2.826  -43.252 -17.207 1.000 23.124 0 479 PRO EEE CB  1 ? 13 
ATOM   3675 C CG  . PRO C 1 150 ? -2.864  -43.679 -18.666 1.000 24.716 0 479 PRO EEE CG  1 ? 13 
ATOM   3676 C CD  . PRO C 1 150 ? -1.681  -44.614 -18.836 1.000 24.127 0 479 PRO EEE CD  1 ? 13 
ATOM   3677 N N   . CYS C 1 151 ? -0.952  -42.962 -14.452 1.000 21.084 0 480 CYS EEE N   1 ? 13 
ATOM   3678 C CA  . CYS C 1 151 ? -0.804  -43.339 -13.028 1.000 21.633 0 480 CYS EEE CA  1 ? 13 
ATOM   3679 C C   . CYS C 1 151 ? -2.165  -43.492 -12.348 1.000 21.945 0 480 CYS EEE C   1 ? 13 
ATOM   3680 O O   . CYS C 1 151 ? -2.249  -44.306 -11.418 1.000 21.884 0 480 CYS EEE O   1 ? 13 
ATOM   3681 C CB  . CYS C 1 151 ? 0.049   -42.331 -12.297 1.000 22.325 0 480 CYS EEE CB  1 ? 13 
ATOM   3682 S SG  . CYS C 1 151 ? 1.702   -42.250 -13.041 1.000 27.390 0 480 CYS EEE SG  1 ? 13 
ATOM   3683 N N   . ASN C 1 152 ? -3.179  -42.755 -12.792 1.000 25.132 0 481 ASN EEE N   1 ? 13 
ATOM   3684 C CA  . ASN C 1 152 ? -4.553  -42.815 -12.216 1.000 26.943 0 481 ASN EEE CA  1 ? 13 
ATOM   3685 C C   . ASN C 1 152 ? -4.455  -42.507 -10.710 1.000 25.973 0 481 ASN EEE C   1 ? 13 
ATOM   3686 O O   . ASN C 1 152 ? -5.240  -43.083 -9.927  1.000 26.579 0 481 ASN EEE O   1 ? 13 
ATOM   3687 C CB  . ASN C 1 152 ? -5.221  -44.163 -12.498 1.000 29.898 0 481 ASN EEE CB  1 ? 13 
ATOM   3688 C CG  . ASN C 1 152 ? -5.240  -44.539 -13.968 1.000 33.485 0 481 ASN EEE CG  1 ? 13 
ATOM   3689 O OD1 . ASN C 1 152 ? -5.586  -43.734 -14.817 1.000 37.020 0 481 ASN EEE OD1 1 ? 13 
ATOM   3690 N ND2 . ASN C 1 152 ? -4.877  -45.768 -14.272 1.000 38.098 0 481 ASN EEE ND2 1 ? 13 
ATOM   3691 N N   . GLY C 1 153 ? -3.508  -41.658 -10.310 1.000 23.145 0 482 GLY EEE N   1 ? 13 
ATOM   3692 C CA  . GLY C 1 153 ? -3.356  -41.221 -8.912  1.000 23.718 0 482 GLY EEE CA  1 ? 13 
ATOM   3693 C C   . GLY C 1 153 ? -2.673  -42.258 -8.038  1.000 23.947 0 482 GLY EEE C   1 ? 13 
ATOM   3694 O O   . GLY C 1 153 ? -2.641  -42.039 -6.820  1.000 24.898 0 482 GLY EEE O   1 ? 13 
ATOM   3695 N N   . VAL C 1 154 ? -2.101  -43.327 -8.608  1.000 21.935 0 483 VAL EEE N   1 ? 13 
ATOM   3696 C CA  . VAL C 1 154 ? -1.458  -44.406 -7.804  1.000 22.178 0 483 VAL EEE CA  1 ? 13 
ATOM   3697 C C   . VAL C 1 154 ? 0.065   -44.270 -7.848  1.000 20.032 0 483 VAL EEE C   1 ? 13 
ATOM   3698 O O   . VAL C 1 154 ? 0.654   -44.342 -8.933  1.000 20.661 0 483 VAL EEE O   1 ? 13 
ATOM   3699 C CB  . VAL C 1 154 ? -1.898  -45.799 -8.261  1.000 23.608 0 483 VAL EEE CB  1 ? 13 
ATOM   3700 C CG1 . VAL C 1 154 ? -1.287  -46.884 -7.377  1.000 24.629 0 483 VAL EEE CG1 1 ? 13 
ATOM   3701 C CG2 . VAL C 1 154 ? -3.410  -45.932 -8.329  1.000 25.528 0 483 VAL EEE CG2 1 ? 13 
ATOM   3702 N N   . GLU C 1 155 ? 0.679   -44.088 -6.687  1.000 19.086 0 484 GLU EEE N   1 ? 13 
ATOM   3703 C CA  . GLU C 1 155 ? 2.154   -44.087 -6.549  1.000 19.000 0 484 GLU EEE CA  1 ? 13 
ATOM   3704 C C   . GLU C 1 155 ? 2.663   -45.497 -6.848  1.000 19.366 0 484 GLU EEE C   1 ? 13 
ATOM   3705 O O   . GLU C 1 155 ? 2.143   -46.474 -6.274  1.000 20.099 0 484 GLU EEE O   1 ? 13 
ATOM   3706 C CB  . GLU C 1 155 ? 2.519   -43.626 -5.142  1.000 20.297 0 484 GLU EEE CB  1 ? 13 
ATOM   3707 C CG  . GLU C 1 155 ? 3.995   -43.435 -4.924  1.000 20.386 0 484 GLU EEE CG  1 ? 13 
ATOM   3708 C CD  . GLU C 1 155 ? 4.279   -42.886 -3.533  1.000 22.291 0 484 GLU EEE CD  1 ? 13 
ATOM   3709 O OE1 . GLU C 1 155 ? 3.294   -42.610 -2.795  1.000 21.801 0 484 GLU EEE OE1 1 ? 13 
ATOM   3710 O OE2 . GLU C 1 155 ? 5.468   -42.720 -3.205  1.000 21.015 0 484 GLU EEE OE2 1 ? 13 
ATOM   3711 N N   . GLY C 1 156 ? 3.610   -45.620 -7.766  1.000 19.572 0 485 GLY EEE N   1 ? 13 
ATOM   3712 C CA  . GLY C 1 156 ? 4.132   -46.937 -8.164  1.000 20.823 0 485 GLY EEE CA  1 ? 13 
ATOM   3713 C C   . GLY C 1 156 ? 5.207   -46.815 -9.216  1.000 20.574 0 485 GLY EEE C   1 ? 13 
ATOM   3714 O O   . GLY C 1 156 ? 5.817   -45.748 -9.318  1.000 20.431 0 485 GLY EEE O   1 ? 13 
ATOM   3715 N N   . PHE C 1 157 ? 5.455   -47.903 -9.940  1.000 21.403 0 486 PHE EEE N   1 ? 13 
ATOM   3716 C CA  . PHE C 1 157 ? 6.494   -47.944 -10.989 1.000 22.562 0 486 PHE EEE CA  1 ? 13 
ATOM   3717 C C   . PHE C 1 157 ? 6.236   -46.797 -11.978 1.000 22.252 0 486 PHE EEE C   1 ? 13 
ATOM   3718 O O   . PHE C 1 157 ? 5.120   -46.717 -12.523 1.000 21.062 0 486 PHE EEE O   1 ? 13 
ATOM   3719 C CB  . PHE C 1 157 ? 6.507   -49.310 -11.671 1.000 24.015 0 486 PHE EEE CB  1 ? 13 
ATOM   3720 C CG  . PHE C 1 157 ? 7.558   -49.400 -12.741 1.000 26.000 0 486 PHE EEE CG  1 ? 13 
ATOM   3721 C CD1 . PHE C 1 157 ? 8.903   -49.395 -12.411 1.000 27.655 0 486 PHE EEE CD1 1 ? 13 
ATOM   3722 C CD2 . PHE C 1 157 ? 7.194   -49.443 -14.080 1.000 30.547 0 486 PHE EEE CD2 1 ? 13 
ATOM   3723 C CE1 . PHE C 1 157 ? 9.870   -49.450 -13.404 1.000 30.408 0 486 PHE EEE CE1 1 ? 13 
ATOM   3724 C CE2 . PHE C 1 157 ? 8.164   -49.509 -15.070 1.000 30.459 0 486 PHE EEE CE2 1 ? 13 
ATOM   3725 C CZ  . PHE C 1 157 ? 9.496   -49.497 -14.731 1.000 32.022 0 486 PHE EEE CZ  1 ? 13 
ATOM   3726 N N   . ASN C 1 158 ? 7.231   -45.923 -12.162 1.000 21.999 0 487 ASN EEE N   1 ? 13 
ATOM   3727 C CA  . ASN C 1 158 ? 7.198   -44.762 -13.091 1.000 22.818 0 487 ASN EEE CA  1 ? 13 
ATOM   3728 C C   . ASN C 1 158 ? 6.077   -43.788 -12.722 1.000 21.328 0 487 ASN EEE C   1 ? 13 
ATOM   3729 O O   . ASN C 1 158 ? 5.721   -42.990 -13.586 1.000 20.647 0 487 ASN EEE O   1 ? 13 
ATOM   3730 C CB  . ASN C 1 158 ? 7.028   -45.214 -14.545 1.000 25.210 0 487 ASN EEE CB  1 ? 13 
ATOM   3731 C CG  . ASN C 1 158 ? 8.331   -45.675 -15.157 1.000 29.144 0 487 ASN EEE CG  1 ? 13 
ATOM   3732 O OD1 . ASN C 1 158 ? 9.401   -45.383 -14.631 1.000 32.651 0 487 ASN EEE OD1 1 ? 13 
ATOM   3733 N ND2 . ASN C 1 158 ? 8.240   -46.361 -16.276 1.000 30.687 0 487 ASN EEE ND2 1 ? 13 
ATOM   3734 N N   . CYS C 1 159 ? 5.580   -43.831 -11.480 1.000 19.988 0 488 CYS EEE N   1 ? 13 
ATOM   3735 C CA  . CYS C 1 159 ? 4.444   -43.025 -10.987 1.000 19.069 0 488 CYS EEE CA  1 ? 13 
ATOM   3736 C C   . CYS C 1 159 ? 4.876   -42.468 -9.636  1.000 19.102 0 488 CYS EEE C   1 ? 13 
ATOM   3737 O O   . CYS C 1 159 ? 4.681   -43.139 -8.627  1.000 17.885 0 488 CYS EEE O   1 ? 13 
ATOM   3738 C CB  . CYS C 1 159 ? 3.158   -43.854 -10.973 1.000 19.604 0 488 CYS EEE CB  1 ? 13 
ATOM   3739 S SG  . CYS C 1 159 ? 2.544   -44.149 -12.651 1.000 22.774 0 488 CYS EEE SG  1 ? 13 
ATOM   3740 N N   . TYR C 1 160 ? 5.490   -41.284 -9.647  1.000 18.643 0 489 TYR EEE N   1 ? 13 
ATOM   3741 C CA  . TYR C 1 160 ? 6.248   -40.744 -8.493  1.000 20.573 0 489 TYR EEE CA  1 ? 13 
ATOM   3742 C C   . TYR C 1 160 ? 5.428   -39.746 -7.691  1.000 19.547 0 489 TYR EEE C   1 ? 13 
ATOM   3743 O O   . TYR C 1 160 ? 4.877   -38.772 -8.221  1.000 18.701 0 489 TYR EEE O   1 ? 13 
ATOM   3744 C CB  . TYR C 1 160 ? 7.507   -40.032 -8.973  1.000 20.928 0 489 TYR EEE CB  1 ? 13 
ATOM   3745 C CG  . TYR C 1 160 ? 8.424   -40.863 -9.828  1.000 24.882 0 489 TYR EEE CG  1 ? 13 
ATOM   3746 C CD1 . TYR C 1 160 ? 8.633   -42.213 -9.580  1.000 30.994 0 489 TYR EEE CD1 1 ? 13 
ATOM   3747 C CD2 . TYR C 1 160 ? 9.116   -40.276 -10.871 1.000 28.186 0 489 TYR EEE CD2 1 ? 13 
ATOM   3748 C CE1 . TYR C 1 160 ? 9.515   -42.950 -10.355 1.000 34.343 0 489 TYR EEE CE1 1 ? 13 
ATOM   3749 C CE2 . TYR C 1 160 ? 9.991   -41.002 -11.657 1.000 30.154 0 489 TYR EEE CE2 1 ? 13 
ATOM   3750 C CZ  . TYR C 1 160 ? 10.180  -42.345 -11.405 1.000 32.197 0 489 TYR EEE CZ  1 ? 13 
ATOM   3751 O OH  . TYR C 1 160 ? 11.059  -43.022 -12.195 1.000 38.932 0 489 TYR EEE OH  1 ? 13 
ATOM   3752 N N   . PHE C 1 161 ? 5.432   -39.929 -6.383  1.000 18.469 0 490 PHE EEE N   1 ? 13 
ATOM   3753 C CA  . PHE C 1 161 ? 5.073   -38.834 -5.466  1.000 18.191 0 490 PHE EEE CA  1 ? 13 
ATOM   3754 C C   . PHE C 1 161 ? 6.116   -37.749 -5.701  1.000 18.328 0 490 PHE EEE C   1 ? 13 
ATOM   3755 O O   . PHE C 1 161 ? 7.314   -38.032 -5.765  1.000 18.958 0 490 PHE EEE O   1 ? 13 
ATOM   3756 C CB  . PHE C 1 161 ? 5.052   -39.333 -4.030  1.000 18.312 0 490 PHE EEE CB  1 ? 13 
ATOM   3757 C CG  . PHE C 1 161 ? 4.379   -38.389 -3.071  1.000 19.197 0 490 PHE EEE CG  1 ? 13 
ATOM   3758 C CD1 . PHE C 1 161 ? 2.998   -38.352 -2.959  1.000 20.004 0 490 PHE EEE CD1 1 ? 13 
ATOM   3759 C CD2 . PHE C 1 161 ? 5.124   -37.522 -2.288  1.000 19.385 0 490 PHE EEE CD2 1 ? 13 
ATOM   3760 C CE1 . PHE C 1 161 ? 2.379   -37.478 -2.075  1.000 22.911 0 490 PHE EEE CE1 1 ? 13 
ATOM   3761 C CE2 . PHE C 1 161 ? 4.501   -36.634 -1.420  1.000 20.105 0 490 PHE EEE CE2 1 ? 13 
ATOM   3762 C CZ  . PHE C 1 161 ? 3.134   -36.630 -1.292  1.000 21.473 0 490 PHE EEE CZ  1 ? 13 
ATOM   3763 N N   . PRO C 1 162 ? 5.703   -36.483 -5.905  1.000 17.908 0 491 PRO EEE N   1 ? 13 
ATOM   3764 C CA  . PRO C 1 162 ? 6.639   -35.479 -6.396  1.000 18.819 0 491 PRO EEE CA  1 ? 13 
ATOM   3765 C C   . PRO C 1 162 ? 7.552   -34.839 -5.347  1.000 19.375 0 491 PRO EEE C   1 ? 13 
ATOM   3766 O O   . PRO C 1 162 ? 8.489   -34.159 -5.768  1.000 19.007 0 491 PRO EEE O   1 ? 13 
ATOM   3767 C CB  . PRO C 1 162 ? 5.719   -34.438 -7.033  1.000 17.700 0 491 PRO EEE CB  1 ? 13 
ATOM   3768 C CG  . PRO C 1 162 ? 4.438   -34.526 -6.215  1.000 17.662 0 491 PRO EEE CG  1 ? 13 
ATOM   3769 C CD  . PRO C 1 162 ? 4.310   -36.003 -5.906  1.000 17.488 0 491 PRO EEE CD  1 ? 13 
ATOM   3770 N N   . LEU C 1 163 ? 7.290   -35.072 -4.060  1.000 18.536 0 492 LEU EEE N   1 ? 13 
ATOM   3771 C CA  . LEU C 1 163 ? 8.083   -34.477 -2.947  1.000 19.130 0 492 LEU EEE CA  1 ? 13 
ATOM   3772 C C   . LEU C 1 163 ? 8.985   -35.539 -2.338  1.000 19.282 0 492 LEU EEE C   1 ? 13 
ATOM   3773 O O   . LEU C 1 163 ? 8.553   -36.693 -2.172  1.000 18.669 0 492 LEU EEE O   1 ? 13 
ATOM   3774 C CB  . LEU C 1 163 ? 7.183   -33.911 -1.851  1.000 18.864 0 492 LEU EEE CB  1 ? 13 
ATOM   3775 C CG  . LEU C 1 163 ? 6.088   -32.943 -2.276  1.000 19.327 0 492 LEU EEE CG  1 ? 13 
ATOM   3776 C CD1 . LEU C 1 163 ? 5.343   -32.437 -1.049  1.000 20.760 0 492 LEU EEE CD1 1 ? 13 
ATOM   3777 C CD2 . LEU C 1 163 ? 6.646   -31.792 -3.099  1.000 20.513 0 492 LEU EEE CD2 1 ? 13 
ATOM   3778 N N   . GLN C 1 164 ? 10.206  -35.154 -1.991  1.000 18.273 0 493 GLN EEE N   1 ? 13 
ATOM   3779 C CA  . GLN C 1 164 ? 11.124  -36.058 -1.263  1.000 17.158 0 493 GLN EEE CA  1 ? 13 
ATOM   3780 C C   . GLN C 1 164 ? 11.734  -35.312 -0.080  1.000 16.760 0 493 GLN EEE C   1 ? 13 
ATOM   3781 O O   . GLN C 1 164 ? 11.752  -34.050 -0.078  1.000 16.778 0 493 GLN EEE O   1 ? 13 
ATOM   3782 C CB  . GLN C 1 164 ? 12.186  -36.581 -2.214  1.000 17.603 0 493 GLN EEE CB  1 ? 13 
ATOM   3783 C CG  . GLN C 1 164 ? 11.601  -37.283 -3.441  1.000 18.364 0 493 GLN EEE CG  1 ? 13 
ATOM   3784 C CD  . GLN C 1 164 ? 12.504  -38.370 -3.948  1.000 19.407 0 493 GLN EEE CD  1 ? 13 
ATOM   3785 O OE1 . GLN C 1 164 ? 13.720  -38.371 -3.697  1.000 22.925 0 493 GLN EEE OE1 1 ? 13 
ATOM   3786 N NE2 . GLN C 1 164 ? 11.934  -39.261 -4.733  1.000 19.406 0 493 GLN EEE NE2 1 ? 13 
ATOM   3787 N N   . SER C 1 165 ? 12.256  -36.070 0.875   1.000 17.307 0 494 SER EEE N   1 ? 13 
ATOM   3788 C CA  . SER C 1 165 ? 12.905  -35.536 2.089   1.000 16.887 0 494 SER EEE CA  1 ? 13 
ATOM   3789 C C   . SER C 1 165 ? 14.413  -35.405 1.867   1.000 19.187 0 494 SER EEE C   1 ? 13 
ATOM   3790 O O   . SER C 1 165 ? 15.049  -36.348 1.335   1.000 19.914 0 494 SER EEE O   1 ? 13 
ATOM   3791 C CB  . SER C 1 165 ? 12.610  -36.391 3.271   1.000 17.612 0 494 SER EEE CB  1 ? 13 
ATOM   3792 O OG  . SER C 1 165 ? 13.282  -35.881 4.408   1.000 19.045 0 494 SER EEE OG  1 ? 13 
ATOM   3793 N N   . TYR C 1 166 ? 14.992  -34.288 2.310   1.000 17.138 0 495 TYR EEE N   1 ? 13 
ATOM   3794 C CA  . TYR C 1 166 ? 16.465  -34.125 2.389   1.000 17.344 0 495 TYR EEE CA  1 ? 13 
ATOM   3795 C C   . TYR C 1 166 ? 17.119  -35.126 3.354   1.000 20.087 0 495 TYR EEE C   1 ? 13 
ATOM   3796 O O   . TYR C 1 166 ? 18.294  -35.461 3.142   1.000 21.555 0 495 TYR EEE O   1 ? 13 
ATOM   3797 C CB  . TYR C 1 166 ? 16.816  -32.711 2.842   1.000 17.354 0 495 TYR EEE CB  1 ? 13 
ATOM   3798 C CG  . TYR C 1 166 ? 16.674  -31.644 1.795   1.000 16.204 0 495 TYR EEE CG  1 ? 13 
ATOM   3799 C CD1 . TYR C 1 166 ? 17.547  -31.577 0.726   1.000 17.351 0 495 TYR EEE CD1 1 ? 13 
ATOM   3800 C CD2 . TYR C 1 166 ? 15.688  -30.683 1.880   1.000 16.062 0 495 TYR EEE CD2 1 ? 13 
ATOM   3801 C CE1 . TYR C 1 166 ? 17.448  -30.573 -0.228  1.000 17.350 0 495 TYR EEE CE1 1 ? 13 
ATOM   3802 C CE2 . TYR C 1 166 ? 15.577  -29.675 0.941   1.000 16.093 0 495 TYR EEE CE2 1 ? 13 
ATOM   3803 C CZ  . TYR C 1 166 ? 16.461  -29.616 -0.116  1.000 16.991 0 495 TYR EEE CZ  1 ? 13 
ATOM   3804 O OH  . TYR C 1 166 ? 16.370  -28.625 -1.047  1.000 19.048 0 495 TYR EEE OH  1 ? 13 
ATOM   3805 N N   . GLY C 1 167 ? 16.444  -35.535 4.431   1.000 20.125 0 496 GLY EEE N   1 ? 13 
ATOM   3806 C CA  . GLY C 1 167 ? 17.024  -36.416 5.466   1.000 21.605 0 496 GLY EEE CA  1 ? 13 
ATOM   3807 C C   . GLY C 1 167 ? 18.368  -35.902 5.963   1.000 22.156 0 496 GLY EEE C   1 ? 13 
ATOM   3808 O O   . GLY C 1 167 ? 19.349  -36.672 5.926   1.000 22.351 0 496 GLY EEE O   1 ? 13 
ATOM   3809 N N   . PHE C 1 168 ? 18.436  -34.633 6.391   1.000 21.504 0 497 PHE EEE N   1 ? 13 
ATOM   3810 C CA  . PHE C 1 168 ? 19.705  -33.973 6.798   1.000 21.458 0 497 PHE EEE CA  1 ? 13 
ATOM   3811 C C   . PHE C 1 168 ? 20.348  -34.729 7.976   1.000 26.165 0 497 PHE EEE C   1 ? 13 
ATOM   3812 O O   . PHE C 1 168 ? 19.727  -34.826 9.048   1.000 28.336 0 497 PHE EEE O   1 ? 13 
ATOM   3813 C CB  . PHE C 1 168 ? 19.451  -32.516 7.180   1.000 20.434 0 497 PHE EEE CB  1 ? 13 
ATOM   3814 C CG  . PHE C 1 168 ? 19.082  -31.589 6.049   1.000 17.839 0 497 PHE EEE CG  1 ? 13 
ATOM   3815 C CD1 . PHE C 1 168 ? 19.991  -31.279 5.057   1.000 17.921 0 497 PHE EEE CD1 1 ? 13 
ATOM   3816 C CD2 . PHE C 1 168 ? 17.828  -31.002 5.999   1.000 17.465 0 497 PHE EEE CD2 1 ? 13 
ATOM   3817 C CE1 . PHE C 1 168 ? 19.647  -30.410 4.027   1.000 17.274 0 497 PHE EEE CE1 1 ? 13 
ATOM   3818 C CE2 . PHE C 1 168 ? 17.489  -30.114 4.994   1.000 16.203 0 497 PHE EEE CE2 1 ? 13 
ATOM   3819 C CZ  . PHE C 1 168 ? 18.391  -29.823 3.996   1.000 16.706 0 497 PHE EEE CZ  1 ? 13 
ATOM   3820 N N   . GLN C 1 169 ? 21.587  -35.193 7.770   1.000 27.703 0 498 GLN EEE N   1 ? 13 
ATOM   3821 C CA  . GLN C 1 169 ? 22.431  -35.930 8.752   1.000 31.088 0 498 GLN EEE CA  1 ? 13 
ATOM   3822 C C   . GLN C 1 169 ? 23.523  -34.968 9.215   1.000 33.597 0 498 GLN EEE C   1 ? 13 
ATOM   3823 O O   . GLN C 1 169 ? 24.130  -34.290 8.387   1.000 30.158 0 498 GLN EEE O   1 ? 13 
ATOM   3824 C CB  . GLN C 1 169 ? 23.078  -37.159 8.113   1.000 34.536 0 498 GLN EEE CB  1 ? 13 
ATOM   3825 C CG  . GLN C 1 169 ? 22.107  -38.189 7.541   1.000 35.789 0 498 GLN EEE CG  1 ? 13 
ATOM   3826 C CD  . GLN C 1 169 ? 21.485  -39.056 8.607   1.000 38.478 0 498 GLN EEE CD  1 ? 13 
ATOM   3827 O OE1 . GLN C 1 169 ? 21.748  -38.895 9.799   1.000 39.558 0 498 GLN EEE OE1 1 ? 13 
ATOM   3828 N NE2 . GLN C 1 169 ? 20.681  -40.017 8.183   1.000 40.544 0 498 GLN EEE NE2 1 ? 13 
ATOM   3829 N N   . PRO C 1 170 ? 23.798  -34.848 10.537  1.000 35.330 0 499 PRO EEE N   1 ? 13 
ATOM   3830 C CA  . PRO C 1 170 ? 24.706  -33.815 11.037  1.000 37.132 0 499 PRO EEE CA  1 ? 13 
ATOM   3831 C C   . PRO C 1 170 ? 26.130  -33.976 10.488  1.000 37.738 0 499 PRO EEE C   1 ? 13 
ATOM   3832 O O   . PRO C 1 170 ? 26.877  -32.995 10.489  1.000 32.575 0 499 PRO EEE O   1 ? 13 
ATOM   3833 C CB  . PRO C 1 170 ? 24.680  -33.987 12.569  1.000 41.433 0 499 PRO EEE CB  1 ? 13 
ATOM   3834 C CG  . PRO C 1 170 ? 24.152  -35.384 12.793  1.000 43.434 0 499 PRO EEE CG  1 ? 13 
ATOM   3835 C CD  . PRO C 1 170 ? 23.257  -35.689 11.611  1.000 41.009 0 499 PRO EEE CD  1 ? 13 
ATOM   3836 N N   . THR C 1 171 ? 26.458  -35.186 10.019  1.000 37.038 0 500 THR EEE N   1 ? 13 
ATOM   3837 C CA  . THR C 1 171 ? 27.805  -35.587 9.540   1.000 43.669 0 500 THR EEE CA  1 ? 13 
ATOM   3838 C C   . THR C 1 171 ? 27.939  -35.314 8.040   1.000 40.607 0 500 THR EEE C   1 ? 13 
ATOM   3839 O O   . THR C 1 171 ? 29.031  -35.519 7.503   1.000 42.497 0 500 THR EEE O   1 ? 13 
ATOM   3840 C CB  . THR C 1 171 ? 28.052  -37.062 9.891   1.000 47.227 0 500 THR EEE CB  1 ? 13 
ATOM   3841 O OG1 . THR C 1 171 ? 26.856  -37.771 9.556   1.000 49.051 0 500 THR EEE OG1 1 ? 13 
ATOM   3842 C CG2 . THR C 1 171 ? 28.377  -37.260 11.354  1.000 49.465 0 500 THR EEE CG2 1 ? 13 
ATOM   3843 N N   . TYR C 1 172 ? 26.866  -34.876 7.384   1.000 38.747 0 501 TYR EEE N   1 ? 13 
ATOM   3844 C CA  . TYR C 1 172 ? 26.895  -34.420 5.973   1.000 37.661 0 501 TYR EEE CA  1 ? 13 
ATOM   3845 C C   . TYR C 1 172 ? 28.041  -33.391 5.820   1.000 38.697 0 501 TYR EEE C   1 ? 13 
ATOM   3846 O O   . TYR C 1 172 ? 28.301  -32.615 6.759   1.000 35.491 0 501 TYR EEE O   1 ? 13 
ATOM   3847 C CB  . TYR C 1 172 ? 25.521  -33.844 5.622   1.000 36.524 0 501 TYR EEE CB  1 ? 13 
ATOM   3848 C CG  . TYR C 1 172 ? 24.409  -34.754 5.130   1.000 36.044 0 501 TYR EEE CG  1 ? 13 
ATOM   3849 C CD1 . TYR C 1 172 ? 24.466  -36.142 5.080   1.000 37.776 0 501 TYR EEE CD1 1 ? 13 
ATOM   3850 C CD2 . TYR C 1 172 ? 23.234  -34.167 4.693   1.000 34.774 0 501 TYR EEE CD2 1 ? 13 
ATOM   3851 C CE1 . TYR C 1 172 ? 23.391  -36.891 4.595   1.000 37.539 0 501 TYR EEE CE1 1 ? 13 
ATOM   3852 C CE2 . TYR C 1 172 ? 22.166  -34.897 4.205   1.000 32.209 0 501 TYR EEE CE2 1 ? 13 
ATOM   3853 C CZ  . TYR C 1 172 ? 22.229  -36.272 4.152   1.000 36.467 0 501 TYR EEE CZ  1 ? 13 
ATOM   3854 O OH  . TYR C 1 172 ? 21.118  -36.928 3.650   1.000 30.058 0 501 TYR EEE OH  1 ? 13 
ATOM   3855 N N   . GLY C 1 173 ? 28.763  -33.387 4.688   1.000 37.503 0 502 GLY EEE N   1 ? 13 
ATOM   3856 C CA  . GLY C 1 173 ? 29.669  -32.277 4.294   1.000 36.192 0 502 GLY EEE CA  1 ? 13 
ATOM   3857 C C   . GLY C 1 173 ? 28.888  -30.989 4.016   1.000 31.650 0 502 GLY EEE C   1 ? 13 
ATOM   3858 O O   . GLY C 1 173 ? 27.661  -31.075 3.808   1.000 27.643 0 502 GLY EEE O   1 ? 13 
ATOM   3859 N N   . VAL C 1 174 ? 29.561  -29.837 3.978   1.000 31.075 0 503 VAL EEE N   1 ? 13 
ATOM   3860 C CA  . VAL C 1 174 ? 28.910  -28.487 3.938   1.000 29.703 0 503 VAL EEE CA  1 ? 13 
ATOM   3861 C C   . VAL C 1 174 ? 27.900  -28.381 2.774   1.000 25.820 0 503 VAL EEE C   1 ? 13 
ATOM   3862 O O   . VAL C 1 174 ? 26.819  -27.801 2.979   1.000 25.787 0 503 VAL EEE O   1 ? 13 
ATOM   3863 C CB  . VAL C 1 174 ? 29.964  -27.367 3.889   1.000 34.514 0 503 VAL EEE CB  1 ? 13 
ATOM   3864 C CG1 . VAL C 1 174 ? 30.659  -27.264 2.538   1.000 34.685 0 503 VAL EEE CG1 1 ? 13 
ATOM   3865 C CG2 . VAL C 1 174 ? 29.364  -26.034 4.281   1.000 33.293 0 503 VAL EEE CG2 1 ? 13 
ATOM   3866 N N   . GLY C 1 175 ? 28.218  -28.924 1.592   1.000 26.223 0 504 GLY EEE N   1 ? 13 
ATOM   3867 C CA  . GLY C 1 175 ? 27.312  -28.912 0.428   1.000 24.098 0 504 GLY EEE CA  1 ? 13 
ATOM   3868 C C   . GLY C 1 175 ? 25.972  -29.577 0.710   1.000 23.355 0 504 GLY EEE C   1 ? 13 
ATOM   3869 O O   . GLY C 1 175 ? 24.969  -29.218 0.042   1.000 21.908 0 504 GLY EEE O   1 ? 13 
ATOM   3870 N N   . TYR C 1 176 ? 25.932  -30.571 1.598   1.000 24.490 0 505 TYR EEE N   1 ? 13 
ATOM   3871 C CA  . TYR C 1 176 ? 24.693  -31.339 1.877   1.000 24.823 0 505 TYR EEE CA  1 ? 13 
ATOM   3872 C C   . TYR C 1 176 ? 24.001  -30.793 3.124   1.000 21.706 0 505 TYR EEE C   1 ? 13 
ATOM   3873 O O   . TYR C 1 176 ? 22.867  -31.209 3.377   1.000 21.339 0 505 TYR EEE O   1 ? 13 
ATOM   3874 C CB  . TYR C 1 176 ? 24.916  -32.820 2.197   1.000 31.592 0 505 TYR EEE CB  1 ? 13 
ATOM   3875 C CG  . TYR C 1 176 ? 25.913  -33.609 1.400   1.000 38.193 0 505 TYR EEE CG  1 ? 13 
ATOM   3876 C CD1 . TYR C 1 176 ? 25.599  -34.087 0.145   1.000 41.859 0 505 TYR EEE CD1 1 ? 13 
ATOM   3877 C CD2 . TYR C 1 176 ? 27.132  -33.979 1.950   1.000 48.201 0 505 TYR EEE CD2 1 ? 13 
ATOM   3878 C CE1 . TYR C 1 176 ? 26.492  -34.883 -0.558  1.000 42.031 0 505 TYR EEE CE1 1 ? 13 
ATOM   3879 C CE2 . TYR C 1 176 ? 28.046  -34.755 1.258   1.000 47.964 0 505 TYR EEE CE2 1 ? 13 
ATOM   3880 C CZ  . TYR C 1 176 ? 27.722  -35.204 -0.006  1.000 49.268 0 505 TYR EEE CZ  1 ? 13 
ATOM   3881 O OH  . TYR C 1 176 ? 28.629  -35.968 -0.683  1.000 52.019 0 505 TYR EEE OH  1 ? 13 
ATOM   3882 N N   . GLN C 1 177 ? 24.650  -29.910 3.876   1.000 20.574 0 506 GLN EEE N   1 ? 13 
ATOM   3883 C CA  . GLN C 1 177 ? 24.081  -29.396 5.150   1.000 20.612 0 506 GLN EEE CA  1 ? 13 
ATOM   3884 C C   . GLN C 1 177 ? 22.926  -28.442 4.858   1.000 18.959 0 506 GLN EEE C   1 ? 13 
ATOM   3885 O O   . GLN C 1 177 ? 22.869  -27.813 3.806   1.000 19.467 0 506 GLN EEE O   1 ? 13 
ATOM   3886 C CB  . GLN C 1 177 ? 25.156  -28.715 5.981   1.000 21.770 0 506 GLN EEE CB  1 ? 13 
ATOM   3887 C CG  . GLN C 1 177 ? 26.110  -29.721 6.604   1.000 23.839 0 506 GLN EEE CG  1 ? 13 
ATOM   3888 C CD  . GLN C 1 177 ? 27.238  -29.060 7.341   1.000 24.388 0 506 GLN EEE CD  1 ? 13 
ATOM   3889 O OE1 . GLN C 1 177 ? 27.172  -27.881 7.677   1.000 25.331 0 506 GLN EEE OE1 1 ? 13 
ATOM   3890 N NE2 . GLN C 1 177 ? 28.291  -29.816 7.619   1.000 25.480 0 506 GLN EEE NE2 1 ? 13 
ATOM   3891 N N   . PRO C 1 178 ? 21.959  -28.322 5.783   1.000 17.894 0 507 PRO EEE N   1 ? 13 
ATOM   3892 C CA  . PRO C 1 178 ? 20.855  -27.382 5.609   1.000 18.478 0 507 PRO EEE CA  1 ? 13 
ATOM   3893 C C   . PRO C 1 178 ? 21.342  -25.932 5.744   1.000 19.022 0 507 PRO EEE C   1 ? 13 
ATOM   3894 O O   . PRO C 1 178 ? 22.151  -25.638 6.608   1.000 18.333 0 507 PRO EEE O   1 ? 13 
ATOM   3895 C CB  . PRO C 1 178 ? 19.894  -27.759 6.728   1.000 18.204 0 507 PRO EEE CB  1 ? 13 
ATOM   3896 C CG  . PRO C 1 178 ? 20.819  -28.286 7.812   1.000 18.709 0 507 PRO EEE CG  1 ? 13 
ATOM   3897 C CD  . PRO C 1 178 ? 21.906  -29.036 7.067   1.000 18.506 0 507 PRO EEE CD  1 ? 13 
ATOM   3898 N N   . TYR C 1 179 ? 20.834  -25.069 4.876   1.000 16.922 0 508 TYR EEE N   1 ? 13 
ATOM   3899 C CA  . TYR C 1 179 ? 20.986  -23.598 4.950   1.000 17.542 0 508 TYR EEE CA  1 ? 13 
ATOM   3900 C C   . TYR C 1 179 ? 19.588  -22.995 5.074   1.000 17.724 0 508 TYR EEE C   1 ? 13 
ATOM   3901 O O   . TYR C 1 179 ? 18.681  -23.394 4.320   1.000 17.245 0 508 TYR EEE O   1 ? 13 
ATOM   3902 C CB  . TYR C 1 179 ? 21.759  -23.069 3.747   1.000 17.830 0 508 TYR EEE CB  1 ? 13 
ATOM   3903 C CG  . TYR C 1 179 ? 23.251  -23.228 3.909   1.000 18.983 0 508 TYR EEE CG  1 ? 13 
ATOM   3904 C CD1 . TYR C 1 179 ? 23.824  -24.492 3.997   1.000 19.274 0 508 TYR EEE CD1 1 ? 13 
ATOM   3905 C CD2 . TYR C 1 179 ? 24.100  -22.139 3.982   1.000 20.301 0 508 TYR EEE CD2 1 ? 13 
ATOM   3906 C CE1 . TYR C 1 179 ? 25.179  -24.663 4.225   1.000 20.863 0 508 TYR EEE CE1 1 ? 13 
ATOM   3907 C CE2 . TYR C 1 179 ? 25.465  -22.294 4.175   1.000 21.112 0 508 TYR EEE CE2 1 ? 13 
ATOM   3908 C CZ  . TYR C 1 179 ? 26.008  -23.563 4.296   1.000 20.819 0 508 TYR EEE CZ  1 ? 13 
ATOM   3909 O OH  . TYR C 1 179 ? 27.355  -23.711 4.496   1.000 22.374 0 508 TYR EEE OH  1 ? 13 
ATOM   3910 N N   . ARG C 1 180 ? 19.449  -22.049 5.998   1.000 18.827 0 509 ARG EEE N   1 ? 13 
ATOM   3911 C CA  . ARG C 1 180 ? 18.262  -21.178 6.071   1.000 17.234 0 509 ARG EEE CA  1 ? 13 
ATOM   3912 C C   . ARG C 1 180 ? 18.486  -20.018 5.100   1.000 17.560 0 509 ARG EEE C   1 ? 13 
ATOM   3913 O O   . ARG C 1 180 ? 19.611  -19.478 5.041   1.000 16.821 0 509 ARG EEE O   1 ? 13 
ATOM   3914 C CB  . ARG C 1 180 ? 18.000  -20.742 7.511   1.000 19.325 0 509 ARG EEE CB  1 ? 13 
ATOM   3915 C CG  . ARG C 1 180 ? 17.434  -21.875 8.339   1.000 18.307 0 509 ARG EEE CG  1 ? 13 
ATOM   3916 C CD  . ARG C 1 180 ? 17.268  -21.518 9.800   1.000 20.047 0 509 ARG EEE CD  1 ? 13 
ATOM   3917 N NE  . ARG C 1 180 ? 16.688  -22.670 10.448  1.000 20.132 0 509 ARG EEE NE  1 ? 13 
ATOM   3918 C CZ  . ARG C 1 180 ? 15.925  -22.633 11.530  1.000 22.428 0 509 ARG EEE CZ  1 ? 13 
ATOM   3919 N NH1 . ARG C 1 180 ? 15.674  -21.481 12.130  1.000 24.574 0 509 ARG EEE NH1 1 ? 13 
ATOM   3920 N NH2 . ARG C 1 180 ? 15.421  -23.761 12.001  1.000 22.581 0 509 ARG EEE NH2 1 ? 13 
ATOM   3921 N N   . VAL C 1 181 ? 17.448  -19.710 4.341   1.000 20.762 0 510 VAL EEE N   1 ? 14 
ATOM   3922 C CA  . VAL C 1 181 ? 17.460  -18.682 3.274   1.000 20.212 0 510 VAL EEE CA  1 ? 14 
ATOM   3923 C C   . VAL C 1 181 ? 16.322  -17.709 3.563   1.000 19.795 0 510 VAL EEE C   1 ? 14 
ATOM   3924 O O   . VAL C 1 181 ? 15.168  -18.148 3.783   1.000 19.631 0 510 VAL EEE O   1 ? 14 
ATOM   3925 C CB  . VAL C 1 181 ? 17.361  -19.311 1.867   1.000 20.329 0 510 VAL EEE CB  1 ? 14 
ATOM   3926 C CG1 . VAL C 1 181 ? 17.383  -18.252 0.777   1.000 20.941 0 510 VAL EEE CG1 1 ? 14 
ATOM   3927 C CG2 . VAL C 1 181 ? 18.431  -20.370 1.628   1.000 20.882 0 510 VAL EEE CG2 1 ? 14 
ATOM   3928 N N   . VAL C 1 182 ? 16.640  -16.417 3.498   1.000 20.795 0 511 VAL EEE N   1 ? 14 
ATOM   3929 C CA  . VAL C 1 182 ? 15.638  -15.325 3.477   1.000 20.770 0 511 VAL EEE CA  1 ? 14 
ATOM   3930 C C   . VAL C 1 182 ? 15.864  -14.532 2.195   1.000 21.447 0 511 VAL EEE C   1 ? 14 
ATOM   3931 O O   . VAL C 1 182 ? 16.999  -14.102 1.930   1.000 21.468 0 511 VAL EEE O   1 ? 14 
ATOM   3932 C CB  . VAL C 1 182 ? 15.719  -14.432 4.723   1.000 20.993 0 511 VAL EEE CB  1 ? 14 
ATOM   3933 C CG1 . VAL C 1 182 ? 14.764  -13.259 4.598   1.000 21.404 0 511 VAL EEE CG1 1 ? 14 
ATOM   3934 C CG2 . VAL C 1 182 ? 15.461  -15.244 5.990   1.000 21.599 0 511 VAL EEE CG2 1 ? 14 
ATOM   3935 N N   . VAL C 1 183 ? 14.816  -14.412 1.398   1.000 21.222 0 512 VAL EEE N   1 ? 14 
ATOM   3936 C CA  . VAL C 1 183 ? 14.827  -13.575 0.176   1.000 22.316 0 512 VAL EEE CA  1 ? 14 
ATOM   3937 C C   . VAL C 1 183 ? 13.985  -12.343 0.496   1.000 22.435 0 512 VAL EEE C   1 ? 14 
ATOM   3938 O O   . VAL C 1 183 ? 12.788  -12.494 0.798   1.000 22.222 0 512 VAL EEE O   1 ? 14 
ATOM   3939 C CB  . VAL C 1 183 ? 14.307  -14.342 -1.054  1.000 23.526 0 512 VAL EEE CB  1 ? 14 
ATOM   3940 C CG1 . VAL C 1 183 ? 14.315  -13.453 -2.294  1.000 24.773 0 512 VAL EEE CG1 1 ? 14 
ATOM   3941 C CG2 . VAL C 1 183 ? 15.079  -15.626 -1.279  1.000 24.095 0 512 VAL EEE CG2 1 ? 14 
ATOM   3942 N N   . LEU C 1 184 ? 14.592  -11.165 0.453   1.000 22.959 0 513 LEU EEE N   1 ? 14 
ATOM   3943 C CA  . LEU C 1 184 ? 13.850  -9.888  0.574   1.000 23.499 0 513 LEU EEE CA  1 ? 14 
ATOM   3944 C C   . LEU C 1 184 ? 13.571  -9.375  -0.835  1.000 24.385 0 513 LEU EEE C   1 ? 14 
ATOM   3945 O O   . LEU C 1 184 ? 14.539  -9.206  -1.593  1.000 25.618 0 513 LEU EEE O   1 ? 14 
ATOM   3946 C CB  . LEU C 1 184 ? 14.683  -8.903  1.385   1.000 23.918 0 513 LEU EEE CB  1 ? 14 
ATOM   3947 C CG  . LEU C 1 184 ? 15.039  -9.347  2.803   1.000 23.641 0 513 LEU EEE CG  1 ? 14 
ATOM   3948 C CD1 . LEU C 1 184 ? 15.786  -8.245  3.535   1.000 24.801 0 513 LEU EEE CD1 1 ? 14 
ATOM   3949 C CD2 . LEU C 1 184 ? 13.807  -9.773  3.577   1.000 24.859 0 513 LEU EEE CD2 1 ? 14 
ATOM   3950 N N   . SER C 1 185 ? 12.293  -9.246  -1.188  1.000 24.534 0 514 SER EEE N   1 ? 14 
ATOM   3951 C CA  . SER C 1 185 ? 11.815  -8.605  -2.441  1.000 26.728 0 514 SER EEE CA  1 ? 14 
ATOM   3952 C C   . SER C 1 185 ? 11.376  -7.184  -2.110  1.000 26.232 0 514 SER EEE C   1 ? 14 
ATOM   3953 O O   . SER C 1 185 ? 10.543  -7.028  -1.188  1.000 25.284 0 514 SER EEE O   1 ? 14 
ATOM   3954 C CB  . SER C 1 185 ? 10.669  -9.363  -3.060  1.000 28.017 0 514 SER EEE CB  1 ? 14 
ATOM   3955 O OG  . SER C 1 185 ? 11.162  -10.433 -3.806  1.000 34.089 0 514 SER EEE OG  1 ? 14 
ATOM   3956 N N   . PHE C 1 186 ? 11.882  -6.196  -2.848  1.000 27.125 0 515 PHE EEE N   1 ? 14 
ATOM   3957 C CA  . PHE C 1 186 ? 11.529  -4.764  -2.662  1.000 28.260 0 515 PHE EEE CA  1 ? 14 
ATOM   3958 C C   . PHE C 1 186 ? 10.565  -4.333  -3.770  1.000 30.298 0 515 PHE EEE C   1 ? 14 
ATOM   3959 O O   . PHE C 1 186 ? 10.900  -4.434  -4.966  1.000 30.639 0 515 PHE EEE O   1 ? 14 
ATOM   3960 C CB  . PHE C 1 186 ? 12.784  -3.901  -2.631  1.000 29.732 0 515 PHE EEE CB  1 ? 14 
ATOM   3961 C CG  . PHE C 1 186 ? 13.762  -4.289  -1.558  1.000 29.573 0 515 PHE EEE CG  1 ? 14 
ATOM   3962 C CD1 . PHE C 1 186 ? 13.429  -4.149  -0.223  1.000 30.427 0 515 PHE EEE CD1 1 ? 14 
ATOM   3963 C CD2 . PHE C 1 186 ? 15.002  -4.815  -1.877  1.000 30.842 0 515 PHE EEE CD2 1 ? 14 
ATOM   3964 C CE1 . PHE C 1 186 ? 14.326  -4.497  0.771   1.000 30.284 0 515 PHE EEE CE1 1 ? 14 
ATOM   3965 C CE2 . PHE C 1 186 ? 15.887  -5.196  -0.881  1.000 31.549 0 515 PHE EEE CE2 1 ? 14 
ATOM   3966 C CZ  . PHE C 1 186 ? 15.534  -5.062  0.443   1.000 30.292 0 515 PHE EEE CZ  1 ? 14 
ATOM   3967 N N   . GLU C 1 187 ? 9.361   -3.925  -3.369  1.000 30.635 0 516 GLU EEE N   1 ? 14 
ATOM   3968 C CA  . GLU C 1 187 ? 8.271   -3.541  -4.297  1.000 32.388 0 516 GLU EEE CA  1 ? 14 
ATOM   3969 C C   . GLU C 1 187 ? 8.307   -2.017  -4.445  1.000 33.049 0 516 GLU EEE C   1 ? 14 
ATOM   3970 O O   . GLU C 1 187 ? 8.412   -1.339  -3.395  1.000 31.520 0 516 GLU EEE O   1 ? 14 
ATOM   3971 C CB  . GLU C 1 187 ? 6.954   -4.067  -3.736  1.000 33.511 0 516 GLU EEE CB  1 ? 14 
ATOM   3972 C CG  . GLU C 1 187 ? 5.782   -3.878  -4.663  1.000 36.150 0 516 GLU EEE CG  1 ? 14 
ATOM   3973 C CD  . GLU C 1 187 ? 4.465   -4.103  -3.952  1.000 37.609 0 516 GLU EEE CD  1 ? 14 
ATOM   3974 O OE1 . GLU C 1 187 ? 4.051   -3.212  -3.177  1.000 40.571 0 516 GLU EEE OE1 1 ? 14 
ATOM   3975 O OE2 . GLU C 1 187 ? 3.877   -5.155  -4.155  1.000 38.486 0 516 GLU EEE OE2 1 ? 14 
ATOM   3976 N N   . LEU C 1 188 ? 8.223   -1.523  -5.689  1.000 35.241 0 517 LEU EEE N   1 ? 14 
ATOM   3977 C CA  . LEU C 1 188 ? 8.371   -0.090  -6.085  1.000 38.364 0 517 LEU EEE CA  1 ? 14 
ATOM   3978 C C   . LEU C 1 188 ? 7.143   0.371   -6.887  1.000 37.548 0 517 LEU EEE C   1 ? 14 
ATOM   3979 O O   . LEU C 1 188 ? 7.345   0.950   -7.975  1.000 39.723 0 517 LEU EEE O   1 ? 14 
ATOM   3980 C CB  . LEU C 1 188 ? 9.614   0.084   -6.973  1.000 43.360 0 517 LEU EEE CB  1 ? 14 
ATOM   3981 C CG  . LEU C 1 188 ? 10.956  -0.424  -6.446  1.000 46.376 0 517 LEU EEE CG  1 ? 14 
ATOM   3982 C CD1 . LEU C 1 188 ? 11.173  -1.885  -6.806  1.000 49.399 0 517 LEU EEE CD1 1 ? 14 
ATOM   3983 C CD2 . LEU C 1 188 ? 12.097  0.408   -7.022  1.000 52.786 0 517 LEU EEE CD2 1 ? 14 
ATOM   3984 N N   . LEU C 1 189 ? 5.922   0.147   -6.397  1.000 35.089 0 518 LEU EEE N   1 ? 14 
ATOM   3985 C CA  . LEU C 1 189 ? 4.693   0.601   -7.100  1.000 36.318 0 518 LEU EEE CA  1 ? 14 
ATOM   3986 C C   . LEU C 1 189 ? 4.660   2.133   -7.070  1.000 35.361 0 518 LEU EEE C   1 ? 14 
ATOM   3987 O O   . LEU C 1 189 ? 5.298   2.715   -6.163  1.000 31.862 0 518 LEU EEE O   1 ? 14 
ATOM   3988 C CB  . LEU C 1 189 ? 3.445   0.020   -6.428  1.000 37.408 0 518 LEU EEE CB  1 ? 14 
ATOM   3989 C CG  . LEU C 1 189 ? 3.294   -1.499  -6.470  1.000 39.734 0 518 LEU EEE CG  1 ? 14 
ATOM   3990 C CD1 . LEU C 1 189 ? 1.880   -1.903  -6.054  1.000 41.112 0 518 LEU EEE CD1 1 ? 14 
ATOM   3991 C CD2 . LEU C 1 189 ? 3.626   -2.056  -7.850  1.000 41.744 0 518 LEU EEE CD2 1 ? 14 
ATOM   3992 N N   . HIS C 1 190 ? 3.957   2.756   -8.022  1.000 35.586 0 519 HIS EEE N   1 ? 14 
ATOM   3993 C CA  . HIS C 1 190 ? 3.697   4.224   -8.024  1.000 35.100 0 519 HIS EEE CA  1 ? 14 
ATOM   3994 C C   . HIS C 1 190 ? 2.603   4.495   -6.987  1.000 34.465 0 519 HIS EEE C   1 ? 14 
ATOM   3995 O O   . HIS C 1 190 ? 1.438   4.704   -7.377  1.000 36.553 0 519 HIS EEE O   1 ? 14 
ATOM   3996 C CB  . HIS C 1 190 ? 3.374   4.734   -9.436  1.000 38.605 0 519 HIS EEE CB  1 ? 14 
ATOM   3997 C CG  . HIS C 1 190 ? 4.473   4.473   -10.411 1.000 40.847 0 519 HIS EEE CG  1 ? 14 
ATOM   3998 N ND1 . HIS C 1 190 ? 5.769   4.902   -10.194 1.000 40.066 0 519 HIS EEE ND1 1 ? 14 
ATOM   3999 C CD2 . HIS C 1 190 ? 4.483   3.807   -11.588 1.000 45.115 0 519 HIS EEE CD2 1 ? 14 
ATOM   4000 C CE1 . HIS C 1 190 ? 6.535   4.513   -11.194 1.000 43.756 0 519 HIS EEE CE1 1 ? 14 
ATOM   4001 N NE2 . HIS C 1 190 ? 5.767   3.848   -12.072 1.000 46.839 0 519 HIS EEE NE2 1 ? 14 
ATOM   4002 N N   . ALA C 1 191 ? 2.975   4.439   -5.705  1.000 33.148 0 520 ALA EEE N   1 ? 14 
ATOM   4003 C CA  . ALA C 1 191 ? 2.057   4.526   -4.545  1.000 32.837 0 520 ALA EEE CA  1 ? 14 
ATOM   4004 C C   . ALA C 1 191 ? 2.843   5.013   -3.335  1.000 31.061 0 520 ALA EEE C   1 ? 14 
ATOM   4005 O O   . ALA C 1 191 ? 4.073   5.039   -3.382  1.000 27.593 0 520 ALA EEE O   1 ? 14 
ATOM   4006 C CB  . ALA C 1 191 ? 1.424   3.178   -4.286  1.000 34.234 0 520 ALA EEE CB  1 ? 14 
ATOM   4007 N N   . PRO C 1 192 ? 2.172   5.394   -2.222  1.000 30.658 0 521 PRO EEE N   1 ? 14 
ATOM   4008 C CA  . PRO C 1 192 ? 2.889   5.746   -0.999  1.000 30.888 0 521 PRO EEE CA  1 ? 14 
ATOM   4009 C C   . PRO C 1 192 ? 3.797   4.576   -0.584  1.000 30.812 0 521 PRO EEE C   1 ? 14 
ATOM   4010 O O   . PRO C 1 192 ? 3.381   3.422   -0.637  1.000 31.423 0 521 PRO EEE O   1 ? 14 
ATOM   4011 C CB  . PRO C 1 192 ? 1.775   6.062   0.012   1.000 32.401 0 521 PRO EEE CB  1 ? 14 
ATOM   4012 C CG  . PRO C 1 192 ? 0.607   6.461   -0.862  1.000 32.739 0 521 PRO EEE CG  1 ? 14 
ATOM   4013 C CD  . PRO C 1 192 ? 0.715   5.547   -2.072  1.000 33.143 0 521 PRO EEE CD  1 ? 14 
ATOM   4014 N N   . ALA C 1 193 ? 5.038   4.890   -0.234  1.000 29.984 0 522 ALA EEE N   1 ? 14 
ATOM   4015 C CA  . ALA C 1 193 ? 6.050   3.890   0.166   1.000 30.018 0 522 ALA EEE CA  1 ? 14 
ATOM   4016 C C   . ALA C 1 193 ? 6.237   3.976   1.678   1.000 31.912 0 522 ALA EEE C   1 ? 14 
ATOM   4017 O O   . ALA C 1 193 ? 6.821   4.986   2.130   1.000 35.216 0 522 ALA EEE O   1 ? 14 
ATOM   4018 C CB  . ALA C 1 193 ? 7.337   4.142   -0.576  1.000 30.887 0 522 ALA EEE CB  1 ? 14 
ATOM   4019 N N   . THR C 1 194 ? 5.798   2.945   2.408   1.000 31.956 0 523 THR EEE N   1 ? 14 
ATOM   4020 C CA  . THR C 1 194 ? 5.656   2.972   3.887   1.000 34.788 0 523 THR EEE CA  1 ? 14 
ATOM   4021 C C   . THR C 1 194 ? 6.649   2.028   4.570   1.000 33.400 0 523 THR EEE C   1 ? 14 
ATOM   4022 O O   . THR C 1 194 ? 6.595   1.959   5.815   1.000 36.180 0 523 THR EEE O   1 ? 14 
ATOM   4023 C CB  . THR C 1 194 ? 4.219   2.651   4.312   1.000 38.239 0 523 THR EEE CB  1 ? 14 
ATOM   4024 O OG1 . THR C 1 194 ? 3.960   1.294   3.971   1.000 40.444 0 523 THR EEE OG1 1 ? 14 
ATOM   4025 C CG2 . THR C 1 194 ? 3.198   3.573   3.680   1.000 40.764 0 523 THR EEE CG2 1 ? 14 
ATOM   4026 N N   . VAL C 1 195 ? 7.526   1.343   3.829   1.000 30.270 0 524 VAL EEE N   1 ? 14 
ATOM   4027 C CA  . VAL C 1 195 ? 8.685   0.621   4.435   1.000 30.910 0 524 VAL EEE CA  1 ? 14 
ATOM   4028 C C   . VAL C 1 195 ? 9.960   1.398   4.109   1.000 30.636 0 524 VAL EEE C   1 ? 14 
ATOM   4029 O O   . VAL C 1 195 ? 10.354  1.406   2.939   1.000 29.000 0 524 VAL EEE O   1 ? 14 
ATOM   4030 C CB  . VAL C 1 195 ? 8.814   -0.839  3.959   1.000 32.007 0 524 VAL EEE CB  1 ? 14 
ATOM   4031 C CG1 . VAL C 1 195 ? 9.807   -1.593  4.825   1.000 31.511 0 524 VAL EEE CG1 1 ? 14 
ATOM   4032 C CG2 . VAL C 1 195 ? 7.481   -1.531  3.919   1.000 32.597 0 524 VAL EEE CG2 1 ? 14 
ATOM   4033 N N   . CYS C 1 196 ? 10.566  2.021   5.119   1.000 34.314 0 525 CYS EEE N   1 ? 14 
ATOM   4034 C CA  . CYS C 1 196 ? 11.711  2.954   4.965   1.000 35.073 0 525 CYS EEE CA  1 ? 14 
ATOM   4035 C C   . CYS C 1 196 ? 12.840  2.564   5.910   1.000 35.764 0 525 CYS EEE C   1 ? 14 
ATOM   4036 O O   . CYS C 1 196 ? 12.591  1.832   6.893   1.000 36.689 0 525 CYS EEE O   1 ? 14 
ATOM   4037 C CB  . CYS C 1 196 ? 11.296  4.387   5.252   1.000 37.532 0 525 CYS EEE CB  1 ? 14 
ATOM   4038 S SG  . CYS C 1 196 ? 10.026  4.996   4.117   1.000 39.562 0 525 CYS EEE SG  1 ? 14 
ATOM   4039 N N   . GLY C 1 197 ? 14.046  3.023   5.593   1.000 36.534 0 526 GLY EEE N   1 ? 14 
ATOM   4040 C CA  . GLY C 1 197 ? 15.184  2.989   6.523   1.000 38.916 0 526 GLY EEE CA  1 ? 14 
ATOM   4041 C C   . GLY C 1 197 ? 14.965  3.950   7.689   1.000 42.523 0 526 GLY EEE C   1 ? 14 
ATOM   4042 O O   . GLY C 1 197 ? 13.968  4.676   7.721   1.000 45.342 0 526 GLY EEE O   1 ? 14 
ATOM   4043 N N   . PRO C 1 198 ? 15.906  4.004   8.659   1.000 45.298 0 527 PRO EEE N   1 ? 14 
ATOM   4044 C CA  . PRO C 1 198 ? 15.768  4.859   9.845   1.000 48.755 0 527 PRO EEE CA  1 ? 14 
ATOM   4045 C C   . PRO C 1 198 ? 15.698  6.363   9.532   1.000 52.620 0 527 PRO EEE C   1 ? 14 
ATOM   4046 O O   . PRO C 1 198 ? 16.289  6.835   8.569   1.000 55.988 0 527 PRO EEE O   1 ? 14 
ATOM   4047 C CB  . PRO C 1 198 ? 17.041  4.576   10.662  1.000 50.407 0 527 PRO EEE CB  1 ? 14 
ATOM   4048 C CG  . PRO C 1 198 ? 17.560  3.254   10.118  1.000 49.753 0 527 PRO EEE CG  1 ? 14 
ATOM   4049 C CD  . PRO C 1 198 ? 17.170  3.250   8.654   1.000 45.723 0 527 PRO EEE CD  1 ? 14 
ATOM   4050 N N   . GLN D 2 3   ? 18.040  -48.305 -16.156 1.000 54.743 0 1   GLN FFF N   1 ? 15 
ATOM   4051 C CA  . GLN D 2 3   ? 16.942  -48.862 -15.311 1.000 53.320 0 1   GLN FFF CA  1 ? 15 
ATOM   4052 C C   . GLN D 2 3   ? 17.422  -48.847 -13.855 1.000 46.960 0 1   GLN FFF C   1 ? 15 
ATOM   4053 O O   . GLN D 2 3   ? 18.632  -48.679 -13.641 1.000 51.428 0 1   GLN FFF O   1 ? 15 
ATOM   4054 C CB  . GLN D 2 3   ? 16.548  -50.262 -15.801 1.000 59.759 0 1   GLN FFF CB  1 ? 15 
ATOM   4055 C CG  . GLN D 2 3   ? 16.580  -50.404 -17.325 1.000 67.039 0 1   GLN FFF CG  1 ? 15 
ATOM   4056 C CD  . GLN D 2 3   ? 15.407  -51.137 -17.940 1.000 71.525 0 1   GLN FFF CD  1 ? 15 
ATOM   4057 O OE1 . GLN D 2 3   ? 14.245  -50.764 -17.778 1.000 71.003 0 1   GLN FFF OE1 1 ? 15 
ATOM   4058 N NE2 . GLN D 2 3   ? 15.712  -52.169 -18.711 1.000 74.347 0 1   GLN FFF NE2 1 ? 15 
ATOM   4059 N N   . VAL D 2 4   ? 16.518  -48.975 -12.895 1.000 39.243 0 2   VAL FFF N   1 ? 15 
ATOM   4060 C CA  . VAL D 2 4   ? 16.885  -48.943 -11.445 1.000 36.125 0 2   VAL FFF CA  1 ? 15 
ATOM   4061 C C   . VAL D 2 4   ? 17.844  -50.108 -11.159 1.000 34.171 0 2   VAL FFF C   1 ? 15 
ATOM   4062 O O   . VAL D 2 4   ? 17.614  -51.227 -11.663 1.000 33.303 0 2   VAL FFF O   1 ? 15 
ATOM   4063 C CB  . VAL D 2 4   ? 15.644  -48.983 -10.540 1.000 35.757 0 2   VAL FFF CB  1 ? 15 
ATOM   4064 C CG1 . VAL D 2 4   ? 16.029  -49.092 -9.074  1.000 34.556 0 2   VAL FFF CG1 1 ? 15 
ATOM   4065 C CG2 . VAL D 2 4   ? 14.741  -47.782 -10.774 1.000 36.284 0 2   VAL FFF CG2 1 ? 15 
ATOM   4066 N N   . GLN D 2 5   ? 18.925  -49.843 -10.426 1.000 32.572 0 3   GLN FFF N   1 ? 15 
ATOM   4067 C CA  . GLN D 2 5   ? 19.883  -50.871 -9.951  1.000 33.520 0 3   GLN FFF CA  1 ? 15 
ATOM   4068 C C   . GLN D 2 5   ? 20.115  -50.655 -8.461  1.000 29.368 0 3   GLN FFF C   1 ? 15 
ATOM   4069 O O   . GLN D 2 5   ? 20.123  -49.482 -8.028  1.000 28.304 0 3   GLN FFF O   1 ? 15 
ATOM   4070 C CB  . GLN D 2 5   ? 21.232  -50.793 -10.675 1.000 39.182 0 3   GLN FFF CB  1 ? 15 
ATOM   4071 C CG  . GLN D 2 5   ? 21.144  -50.951 -12.182 1.000 47.901 0 3   GLN FFF CG  1 ? 15 
ATOM   4072 C CD  . GLN D 2 5   ? 20.979  -52.385 -12.623 1.000 54.613 0 3   GLN FFF CD  1 ? 15 
ATOM   4073 O OE1 . GLN D 2 5   ? 21.380  -53.326 -11.941 1.000 58.779 0 3   GLN FFF OE1 1 ? 15 
ATOM   4074 N NE2 . GLN D 2 5   ? 20.403  -52.563 -13.800 1.000 62.179 0 3   GLN FFF NE2 1 ? 15 
ATOM   4075 N N   . LEU D 2 6   ? 20.293  -51.745 -7.717  1.000 26.214 0 4   LEU FFF N   1 ? 15 
ATOM   4076 C CA  . LEU D 2 6   ? 20.704  -51.701 -6.295  1.000 25.039 0 4   LEU FFF CA  1 ? 15 
ATOM   4077 C C   . LEU D 2 6   ? 22.102  -52.299 -6.210  1.000 26.388 0 4   LEU FFF C   1 ? 15 
ATOM   4078 O O   . LEU D 2 6   ? 22.238  -53.508 -6.470  1.000 29.185 0 4   LEU FFF O   1 ? 15 
ATOM   4079 C CB  . LEU D 2 6   ? 19.674  -52.449 -5.454  1.000 23.973 0 4   LEU FFF CB  1 ? 15 
ATOM   4080 C CG  . LEU D 2 6   ? 18.265  -51.860 -5.530  1.000 24.907 0 4   LEU FFF CG  1 ? 15 
ATOM   4081 C CD1 . LEU D 2 6   ? 17.255  -52.727 -4.795  1.000 24.221 0 4   LEU FFF CD1 1 ? 15 
ATOM   4082 C CD2 . LEU D 2 6   ? 18.247  -50.432 -4.996  1.000 25.092 0 4   LEU FFF CD2 1 ? 15 
ATOM   4083 N N   . VAL D 2 7   ? 23.102  -51.462 -5.934  1.000 26.734 0 5   VAL FFF N   1 ? 15 
ATOM   4084 C CA  . VAL D 2 7   ? 24.535  -51.868 -5.904  1.000 27.061 0 5   VAL FFF CA  1 ? 15 
ATOM   4085 C C   . VAL D 2 7   ? 24.872  -52.257 -4.461  1.000 27.699 0 5   VAL FFF C   1 ? 15 
ATOM   4086 O O   . VAL D 2 7   ? 24.885  -51.368 -3.606  1.000 27.029 0 5   VAL FFF O   1 ? 15 
ATOM   4087 C CB  . VAL D 2 7   ? 25.445  -50.749 -6.438  1.000 29.003 0 5   VAL FFF CB  1 ? 15 
ATOM   4088 C CG1 . VAL D 2 7   ? 26.917  -51.139 -6.393  1.000 30.195 0 5   VAL FFF CG1 1 ? 15 
ATOM   4089 C CG2 . VAL D 2 7   ? 25.046  -50.355 -7.856  1.000 30.247 0 5   VAL FFF CG2 1 ? 15 
ATOM   4090 N N   . GLU D 2 8   ? 25.095  -53.548 -4.209  1.000 27.914 0 6   GLU FFF N   1 ? 15 
ATOM   4091 C CA  . GLU D 2 8   ? 25.302  -54.087 -2.838  1.000 28.125 0 6   GLU FFF CA  1 ? 15 
ATOM   4092 C C   . GLU D 2 8   ? 26.800  -54.316 -2.619  1.000 28.880 0 6   GLU FFF C   1 ? 15 
ATOM   4093 O O   . GLU D 2 8   ? 27.495  -54.698 -3.577  1.000 28.102 0 6   GLU FFF O   1 ? 15 
ATOM   4094 C CB  . GLU D 2 8   ? 24.562  -55.397 -2.629  1.000 28.200 0 6   GLU FFF CB  1 ? 15 
ATOM   4095 C CG  . GLU D 2 8   ? 23.066  -55.336 -2.888  1.000 29.183 0 6   GLU FFF CG  1 ? 15 
ATOM   4096 C CD  . GLU D 2 8   ? 22.462  -56.721 -3.064  1.000 30.285 0 6   GLU FFF CD  1 ? 15 
ATOM   4097 O OE1 . GLU D 2 8   ? 23.114  -57.537 -3.737  1.000 37.498 0 6   GLU FFF OE1 1 ? 15 
ATOM   4098 O OE2 . GLU D 2 8   ? 21.354  -56.994 -2.538  1.000 28.907 0 6   GLU FFF OE2 1 ? 15 
ATOM   4099 N N   . SER D 2 9   ? 27.278  -54.112 -1.395  1.000 29.580 0 7   SER FFF N   1 ? 15 
ATOM   4100 C CA  . SER D 2 9   ? 28.681  -54.404 -1.019  1.000 30.591 0 7   SER FFF CA  1 ? 15 
ATOM   4101 C C   . SER D 2 9   ? 28.729  -54.782 0.461   1.000 30.663 0 7   SER FFF C   1 ? 15 
ATOM   4102 O O   . SER D 2 9   ? 27.730  -54.556 1.173   1.000 29.301 0 7   SER FFF O   1 ? 15 
ATOM   4103 C CB  . SER D 2 9   ? 29.604  -53.251 -1.350  1.000 32.738 0 7   SER FFF CB  1 ? 15 
ATOM   4104 O OG  . SER D 2 9   ? 30.960  -53.704 -1.465  1.000 36.834 0 7   SER FFF OG  1 ? 15 
ATOM   4105 N N   . GLY D 2 10  ? 29.844  -55.365 0.886   1.000 32.574 0 8   GLY FFF N   1 ? 15 
ATOM   4106 C CA  . GLY D 2 10  ? 30.071  -55.782 2.275   1.000 33.451 0 8   GLY FFF CA  1 ? 15 
ATOM   4107 C C   . GLY D 2 10  ? 29.713  -57.245 2.435   1.000 37.352 0 8   GLY FFF C   1 ? 15 
ATOM   4108 O O   . GLY D 2 10  ? 29.406  -57.910 1.410   1.000 38.355 0 8   GLY FFF O   1 ? 15 
ATOM   4109 N N   . GLY D 2 11  ? 29.707  -57.751 3.662   1.000 39.208 0 9   GLY FFF N   1 ? 15 
ATOM   4110 C CA  . GLY D 2 11  ? 29.358  -59.175 3.872   1.000 43.036 0 9   GLY FFF CA  1 ? 15 
ATOM   4111 C C   . GLY D 2 11  ? 30.500  -60.100 3.469   1.000 43.962 0 9   GLY FFF C   1 ? 15 
ATOM   4112 O O   . GLY D 2 11  ? 31.620  -59.605 3.239   1.000 48.272 0 9   GLY FFF O   1 ? 15 
ATOM   4113 N N   . GLY D 2 12  ? 30.241  -61.401 3.382   1.000 43.255 0 10  GLY FFF N   1 ? 15 
ATOM   4114 C CA  . GLY D 2 12  ? 31.297  -62.424 3.271   1.000 44.147 0 10  GLY FFF CA  1 ? 15 
ATOM   4115 C C   . GLY D 2 12  ? 31.347  -63.250 4.541   1.000 43.652 0 10  GLY FFF C   1 ? 15 
ATOM   4116 O O   . GLY D 2 12  ? 30.296  -63.410 5.180   1.000 40.360 0 10  GLY FFF O   1 ? 15 
ATOM   4117 N N   . SER D 2 13  ? 32.537  -63.690 4.935   1.000 45.854 0 11  SER FFF N   1 ? 15 
ATOM   4118 C CA  . SER D 2 13  ? 32.747  -64.643 6.053   1.000 49.336 0 11  SER FFF CA  1 ? 15 
ATOM   4119 C C   . SER D 2 13  ? 33.181  -63.893 7.314   1.000 52.653 0 11  SER FFF C   1 ? 15 
ATOM   4120 O O   . SER D 2 13  ? 33.936  -62.911 7.192   1.000 54.859 0 11  SER FFF O   1 ? 15 
ATOM   4121 C CB  . SER D 2 13  ? 33.723  -65.689 5.644   1.000 51.417 0 11  SER FFF CB  1 ? 15 
ATOM   4122 O OG  . SER D 2 13  ? 33.176  -66.448 4.575   1.000 49.959 0 11  SER FFF OG  1 ? 15 
ATOM   4123 N N   . VAL D 2 14  ? 32.677  -64.314 8.472   1.000 52.800 0 12  VAL FFF N   1 ? 15 
ATOM   4124 C CA  . VAL D 2 14  ? 33.003  -63.715 9.798   1.000 53.876 0 12  VAL FFF CA  1 ? 15 
ATOM   4125 C C   . VAL D 2 14  ? 32.763  -64.794 10.861  1.000 54.985 0 12  VAL FFF C   1 ? 15 
ATOM   4126 O O   . VAL D 2 14  ? 31.929  -65.688 10.622  1.000 49.687 0 12  VAL FFF O   1 ? 15 
ATOM   4127 C CB  . VAL D 2 14  ? 32.177  -62.438 10.048  1.000 53.480 0 12  VAL FFF CB  1 ? 15 
ATOM   4128 C CG1 . VAL D 2 14  ? 30.697  -62.725 10.233  1.000 52.782 0 12  VAL FFF CG1 1 ? 15 
ATOM   4129 C CG2 . VAL D 2 14  ? 32.710  -61.640 11.226  1.000 57.009 0 12  VAL FFF CG2 1 ? 15 
ATOM   4130 N N   . GLN D 2 15  ? 33.498  -64.758 11.973  1.000 56.107 0 13  GLN FFF N   1 ? 15 
ATOM   4131 C CA  . GLN D 2 15  ? 33.262  -65.727 13.074  1.000 57.874 0 13  GLN FFF CA  1 ? 15 
ATOM   4132 C C   . GLN D 2 15  ? 32.112  -65.184 13.929  1.000 55.238 0 13  GLN FFF C   1 ? 15 
ATOM   4133 O O   . GLN D 2 15  ? 31.866  -63.963 13.876  1.000 50.785 0 13  GLN FFF O   1 ? 15 
ATOM   4134 C CB  . GLN D 2 15  ? 34.550  -66.049 13.840  1.000 64.248 0 13  GLN FFF CB  1 ? 15 
ATOM   4135 C CG  . GLN D 2 15  ? 35.108  -64.929 14.698  1.000 67.996 0 13  GLN FFF CG  1 ? 15 
ATOM   4136 C CD  . GLN D 2 15  ? 36.104  -65.482 15.694  1.000 76.185 0 13  GLN FFF CD  1 ? 15 
ATOM   4137 O OE1 . GLN D 2 15  ? 36.914  -66.360 15.386  1.000 77.887 0 13  GLN FFF OE1 1 ? 15 
ATOM   4138 N NE2 . GLN D 2 15  ? 36.034  -64.990 16.919  1.000 79.808 0 13  GLN FFF NE2 1 ? 15 
ATOM   4139 N N   . ALA D 2 16  ? 31.400  -66.072 14.625  1.000 54.481 0 14  ALA FFF N   1 ? 15 
ATOM   4140 C CA  . ALA D 2 16  ? 30.272  -65.727 15.520  1.000 55.063 0 14  ALA FFF CA  1 ? 15 
ATOM   4141 C C   . ALA D 2 16  ? 30.732  -64.664 16.526  1.000 56.435 0 14  ALA FFF C   1 ? 15 
ATOM   4142 O O   . ALA D 2 16  ? 31.859  -64.785 17.041  1.000 58.527 0 14  ALA FFF O   1 ? 15 
ATOM   4143 C CB  . ALA D 2 16  ? 29.753  -66.964 16.210  1.000 57.128 0 14  ALA FFF CB  1 ? 15 
ATOM   4144 N N   . GLY D 2 17  ? 29.881  -63.663 16.777  1.000 56.225 0 15  GLY FFF N   1 ? 15 
ATOM   4145 C CA  . GLY D 2 17  ? 30.160  -62.506 17.650  1.000 57.413 0 15  GLY FFF CA  1 ? 15 
ATOM   4146 C C   . GLY D 2 17  ? 30.742  -61.338 16.869  1.000 57.093 0 15  GLY FFF C   1 ? 15 
ATOM   4147 O O   . GLY D 2 17  ? 30.831  -60.228 17.440  1.000 57.622 0 15  GLY FFF O   1 ? 15 
ATOM   4148 N N   . GLY D 2 18  ? 31.125  -61.568 15.608  1.000 55.429 0 16  GLY FFF N   1 ? 15 
ATOM   4149 C CA  . GLY D 2 18  ? 31.726  -60.546 14.728  1.000 53.053 0 16  GLY FFF CA  1 ? 15 
ATOM   4150 C C   . GLY D 2 18  ? 30.686  -59.617 14.139  1.000 50.072 0 16  GLY FFF C   1 ? 15 
ATOM   4151 O O   . GLY D 2 18  ? 29.484  -59.806 14.412  1.000 47.464 0 16  GLY FFF O   1 ? 15 
ATOM   4152 N N   . SER D 2 19  ? 31.137  -58.627 13.366  1.000 50.468 0 17  SER FFF N   1 ? 15 
ATOM   4153 C CA  . SER D 2 19  ? 30.282  -57.589 12.743  1.000 47.968 0 17  SER FFF CA  1 ? 15 
ATOM   4154 C C   . SER D 2 19  ? 30.591  -57.498 11.254  1.000 44.841 0 17  SER FFF C   1 ? 15 
ATOM   4155 O O   . SER D 2 19  ? 31.739  -57.778 10.846  1.000 45.106 0 17  SER FFF O   1 ? 15 
ATOM   4156 C CB  . SER D 2 19  ? 30.453  -56.244 13.402  1.000 52.601 0 17  SER FFF CB  1 ? 15 
ATOM   4157 O OG  . SER D 2 19  ? 30.118  -56.318 14.777  1.000 56.418 0 17  SER FFF OG  1 ? 15 
ATOM   4158 N N   . LEU D 2 20  ? 29.574  -57.128 10.489  1.000 41.219 0 18  LEU FFF N   1 ? 15 
ATOM   4159 C CA  . LEU D 2 20  ? 29.674  -56.763 9.062   1.000 40.049 0 18  LEU FFF CA  1 ? 15 
ATOM   4160 C C   . LEU D 2 20  ? 28.841  -55.498 8.872   1.000 38.139 0 18  LEU FFF C   1 ? 15 
ATOM   4161 O O   . LEU D 2 20  ? 27.852  -55.320 9.627   1.000 39.119 0 18  LEU FFF O   1 ? 15 
ATOM   4162 C CB  . LEU D 2 20  ? 29.140  -57.912 8.198   1.000 39.098 0 18  LEU FFF CB  1 ? 15 
ATOM   4163 C CG  . LEU D 2 20  ? 30.072  -59.112 8.045   1.000 41.437 0 18  LEU FFF CG  1 ? 15 
ATOM   4164 C CD1 . LEU D 2 20  ? 29.357  -60.268 7.366   1.000 43.203 0 18  LEU FFF CD1 1 ? 15 
ATOM   4165 C CD2 . LEU D 2 20  ? 31.343  -58.745 7.292   1.000 42.297 0 18  LEU FFF CD2 1 ? 15 
ATOM   4166 N N   . THR D 2 21  ? 29.206  -54.681 7.886   1.000 35.615 0 19  THR FFF N   1 ? 15 
ATOM   4167 C CA  . THR D 2 21  ? 28.351  -53.587 7.379   1.000 33.642 0 19  THR FFF CA  1 ? 15 
ATOM   4168 C C   . THR D 2 21  ? 28.030  -53.864 5.918   1.000 32.432 0 19  THR FFF C   1 ? 15 
ATOM   4169 O O   . THR D 2 21  ? 28.976  -53.948 5.108   1.000 32.796 0 19  THR FFF O   1 ? 15 
ATOM   4170 C CB  . THR D 2 21  ? 29.009  -52.217 7.547   1.000 35.464 0 19  THR FFF CB  1 ? 15 
ATOM   4171 O OG1 . THR D 2 21  ? 29.471  -52.170 8.898   1.000 37.249 0 19  THR FFF OG1 1 ? 15 
ATOM   4172 C CG2 . THR D 2 21  ? 28.058  -51.085 7.229   1.000 34.237 0 19  THR FFF CG2 1 ? 15 
ATOM   4173 N N   . LEU D 2 22  ? 26.743  -54.039 5.625   1.000 30.844 0 20  LEU FFF N   1 ? 15 
ATOM   4174 C CA  . LEU D 2 22  ? 26.237  -54.125 4.242   1.000 30.811 0 20  LEU FFF CA  1 ? 15 
ATOM   4175 C C   . LEU D 2 22  ? 25.912  -52.704 3.802   1.000 28.102 0 20  LEU FFF C   1 ? 15 
ATOM   4176 O O   . LEU D 2 22  ? 25.395  -51.916 4.604   1.000 28.184 0 20  LEU FFF O   1 ? 15 
ATOM   4177 C CB  . LEU D 2 22  ? 25.002  -55.023 4.168   1.000 30.397 0 20  LEU FFF CB  1 ? 15 
ATOM   4178 C CG  . LEU D 2 22  ? 25.166  -56.405 4.786   1.000 32.073 0 20  LEU FFF CG  1 ? 15 
ATOM   4179 C CD1 . LEU D 2 22  ? 23.927  -57.244 4.524   1.000 33.150 0 20  LEU FFF CD1 1 ? 15 
ATOM   4180 C CD2 . LEU D 2 22  ? 26.423  -57.090 4.261   1.000 33.365 0 20  LEU FFF CD2 1 ? 15 
ATOM   4181 N N   . SER D 2 23  ? 26.203  -52.413 2.547   1.000 28.646 0 21  SER FFF N   1 ? 15 
ATOM   4182 C CA  . SER D 2 23  ? 25.844  -51.123 1.919   1.000 28.833 0 21  SER FFF CA  1 ? 15 
ATOM   4183 C C   . SER D 2 23  ? 25.005  -51.442 0.686   1.000 25.960 0 21  SER FFF C   1 ? 15 
ATOM   4184 O O   . SER D 2 23  ? 25.189  -52.509 0.052   1.000 25.456 0 21  SER FFF O   1 ? 15 
ATOM   4185 C CB  . SER D 2 23  ? 27.051  -50.286 1.604   1.000 30.734 0 21  SER FFF CB  1 ? 15 
ATOM   4186 O OG  . SER D 2 23  ? 27.836  -50.894 0.583   1.000 36.067 0 21  SER FFF OG  1 ? 15 
ATOM   4187 N N   . CYS D 2 24  ? 24.028  -50.592 0.452   1.000 24.685 0 22  CYS FFF N   1 ? 15 
ATOM   4188 C CA  . CYS D 2 24  ? 23.197  -50.637 -0.757  1.000 24.070 0 22  CYS FFF CA  1 ? 15 
ATOM   4189 C C   . CYS D 2 24  ? 23.102  -49.230 -1.323  1.000 24.583 0 22  CYS FFF C   1 ? 15 
ATOM   4190 O O   . CYS D 2 24  ? 22.588  -48.335 -0.605  1.000 25.045 0 22  CYS FFF O   1 ? 15 
ATOM   4191 C CB  . CYS D 2 24  ? 21.823  -51.192 -0.435  1.000 24.379 0 22  CYS FFF CB  1 ? 15 
ATOM   4192 S SG  . CYS D 2 24  ? 20.818  -51.329 -1.919  1.000 25.838 0 22  CYS FFF SG  1 ? 15 
ATOM   4193 N N   . VAL D 2 25  ? 23.583  -49.049 -2.552  1.000 23.933 0 23  VAL FFF N   1 ? 15 
ATOM   4194 C CA  . VAL D 2 25  ? 23.449  -47.761 -3.284  1.000 24.136 0 23  VAL FFF CA  1 ? 15 
ATOM   4195 C C   . VAL D 2 25  ? 22.382  -47.946 -4.356  1.000 23.797 0 23  VAL FFF C   1 ? 15 
ATOM   4196 O O   . VAL D 2 25  ? 22.496  -48.874 -5.179  1.000 23.654 0 23  VAL FFF O   1 ? 15 
ATOM   4197 C CB  . VAL D 2 25  ? 24.787  -47.300 -3.888  1.000 25.354 0 23  VAL FFF CB  1 ? 15 
ATOM   4198 C CG1 . VAL D 2 25  ? 24.637  -45.961 -4.587  1.000 26.642 0 23  VAL FFF CG1 1 ? 15 
ATOM   4199 C CG2 . VAL D 2 25  ? 25.862  -47.264 -2.814  1.000 25.612 0 23  VAL FFF CG2 1 ? 15 
ATOM   4200 N N   . ALA D 2 26  ? 21.376  -47.088 -4.327  1.000 23.191 0 24  ALA FFF N   1 ? 15 
ATOM   4201 C CA  . ALA D 2 26  ? 20.309  -47.069 -5.339  1.000 24.087 0 24  ALA FFF CA  1 ? 15 
ATOM   4202 C C   . ALA D 2 26  ? 20.789  -46.217 -6.513  1.000 26.700 0 24  ALA FFF C   1 ? 15 
ATOM   4203 O O   . ALA D 2 26  ? 21.386  -45.126 -6.290  1.000 26.520 0 24  ALA FFF O   1 ? 15 
ATOM   4204 C CB  . ALA D 2 26  ? 19.041  -46.563 -4.722  1.000 24.442 0 24  ALA FFF CB  1 ? 15 
ATOM   4205 N N   . SER D 2 27  ? 20.574  -46.685 -7.735  1.000 26.945 0 25  SER FFF N   1 ? 15 
ATOM   4206 C CA  . SER D 2 27  ? 20.778  -45.839 -8.933  1.000 30.087 0 25  SER FFF CA  1 ? 15 
ATOM   4207 C C   . SER D 2 27  ? 19.531  -45.909 -9.800  1.000 30.648 0 25  SER FFF C   1 ? 15 
ATOM   4208 O O   . SER D 2 27  ? 18.910  -46.986 -9.844  1.000 32.054 0 25  SER FFF O   1 ? 15 
ATOM   4209 C CB  . SER D 2 27  ? 22.012  -46.206 -9.693  1.000 34.545 0 25  SER FFF CB  1 ? 15 
ATOM   4210 O OG  . SER D 2 27  ? 21.945  -47.529 -10.147 1.000 35.269 0 25  SER FFF OG  1 ? 15 
ATOM   4211 N N   . GLY D 2 28  ? 19.199  -44.789 -10.433 1.000 29.913 0 26  GLY FFF N   1 ? 15 
ATOM   4212 C CA  . GLY D 2 28  ? 18.015  -44.640 -11.297 1.000 31.174 0 26  GLY FFF CA  1 ? 15 
ATOM   4213 C C   . GLY D 2 28  ? 16.813  -44.200 -10.491 1.000 29.288 0 26  GLY FFF C   1 ? 15 
ATOM   4214 O O   . GLY D 2 28  ? 15.735  -44.046 -11.067 1.000 30.945 0 26  GLY FFF O   1 ? 15 
ATOM   4215 N N   A VAL D 2 29  ? 17.016  -44.008 -9.188  0.500 28.878 0 27  VAL FFF N   1 ? 15 
ATOM   4216 N N   B VAL D 2 29  ? 17.009  -44.008 -9.179  0.500 29.065 0 27  VAL FFF N   1 ? 15 
ATOM   4217 C CA  A VAL D 2 29  ? 16.021  -43.444 -8.239  0.500 27.649 0 27  VAL FFF CA  1 ? 15 
ATOM   4218 C CA  B VAL D 2 29  ? 16.006  -43.502 -8.197  0.500 27.945 0 27  VAL FFF CA  1 ? 15 
ATOM   4219 C C   A VAL D 2 29  ? 16.804  -42.589 -7.245  0.500 26.711 0 27  VAL FFF C   1 ? 15 
ATOM   4220 C C   B VAL D 2 29  ? 16.761  -42.669 -7.151  0.500 26.973 0 27  VAL FFF C   1 ? 15 
ATOM   4221 O O   A VAL D 2 29  ? 17.989  -42.877 -7.038  0.500 27.271 0 27  VAL FFF O   1 ? 15 
ATOM   4222 O O   B VAL D 2 29  ? 17.880  -43.069 -6.782  0.500 27.824 0 27  VAL FFF O   1 ? 15 
ATOM   4223 C CB  A VAL D 2 29  ? 15.240  -44.571 -7.542  0.500 27.635 0 27  VAL FFF CB  1 ? 15 
ATOM   4224 C CB  B VAL D 2 29  ? 15.236  -44.670 -7.547  0.500 28.071 0 27  VAL FFF CB  1 ? 15 
ATOM   4225 C CG1 A VAL D 2 29  ? 16.165  -45.458 -6.732  0.500 27.035 0 27  VAL FFF CG1 1 ? 15 
ATOM   4226 C CG1 B VAL D 2 29  ? 14.660  -44.285 -6.200  0.500 26.642 0 27  VAL FFF CG1 1 ? 15 
ATOM   4227 C CG2 A VAL D 2 29  ? 14.111  -44.033 -6.686  0.500 26.525 0 27  VAL FFF CG2 1 ? 15 
ATOM   4228 C CG2 B VAL D 2 29  ? 14.146  -45.218 -8.461  0.500 29.061 0 27  VAL FFF CG2 1 ? 15 
ATOM   4229 N N   . THR D 2 30  ? 16.173  -41.563 -6.680  1.000 24.594 0 28  THR FFF N   1 ? 15 
ATOM   4230 C CA  . THR D 2 30  ? 16.782  -40.686 -5.653  1.000 24.175 0 28  THR FFF CA  1 ? 15 
ATOM   4231 C C   . THR D 2 30  ? 16.138  -41.057 -4.322  1.000 21.608 0 28  THR FFF C   1 ? 15 
ATOM   4232 O O   . THR D 2 30  ? 14.902  -41.027 -4.265  1.000 21.473 0 28  THR FFF O   1 ? 15 
ATOM   4233 C CB  . THR D 2 30  ? 16.561  -39.205 -5.996  1.000 24.553 0 28  THR FFF CB  1 ? 15 
ATOM   4234 O OG1 . THR D 2 30  ? 17.161  -38.989 -7.270  1.000 25.551 0 28  THR FFF OG1 1 ? 15 
ATOM   4235 C CG2 . THR D 2 30  ? 17.174  -38.275 -4.982  1.000 25.211 0 28  THR FFF CG2 1 ? 15 
ATOM   4236 N N   . LEU D 2 31  ? 16.914  -41.429 -3.317  1.000 20.033 0 29  LEU FFF N   1 ? 15 
ATOM   4237 C CA  . LEU D 2 31  ? 16.343  -41.729 -1.979  1.000 20.189 0 29  LEU FFF CA  1 ? 15 
ATOM   4238 C C   . LEU D 2 31  ? 15.711  -40.446 -1.418  1.000 18.899 0 29  LEU FFF C   1 ? 15 
ATOM   4239 O O   . LEU D 2 31  ? 16.185  -39.335 -1.746  1.000 20.312 0 29  LEU FFF O   1 ? 15 
ATOM   4240 C CB  . LEU D 2 31  ? 17.429  -42.284 -1.058  1.000 20.415 0 29  LEU FFF CB  1 ? 15 
ATOM   4241 C CG  . LEU D 2 31  ? 17.958  -43.670 -1.430  1.000 21.056 0 29  LEU FFF CG  1 ? 15 
ATOM   4242 C CD1 . LEU D 2 31  ? 18.803  -44.228 -0.303  1.000 21.178 0 29  LEU FFF CD1 1 ? 15 
ATOM   4243 C CD2 . LEU D 2 31  ? 16.832  -44.631 -1.799  1.000 21.940 0 29  LEU FFF CD2 1 ? 15 
ATOM   4244 N N   . GLY D 2 32  ? 14.638  -40.595 -0.635  1.000 18.659 0 30  GLY FFF N   1 ? 15 
ATOM   4245 C CA  . GLY D 2 32  ? 13.905  -39.487 -0.006  1.000 18.401 0 30  GLY FFF CA  1 ? 15 
ATOM   4246 C C   . GLY D 2 32  ? 12.399  -39.631 -0.145  1.000 18.170 0 30  GLY FFF C   1 ? 15 
ATOM   4247 O O   . GLY D 2 32  ? 11.682  -38.812 0.451   1.000 18.086 0 30  GLY FFF O   1 ? 15 
ATOM   4248 N N   . ARG D 2 33  ? 11.910  -40.628 -0.883  1.000 17.755 0 31  ARG FFF N   1 ? 15 
ATOM   4249 C CA  . ARG D 2 33  ? 10.447  -40.918 -0.847  1.000 18.615 0 31  ARG FFF CA  1 ? 15 
ATOM   4250 C C   . ARG D 2 33  ? 10.202  -42.375 -0.459  1.000 19.277 0 31  ARG FFF C   1 ? 15 
ATOM   4251 O O   . ARG D 2 33  ? 9.282   -42.613 0.347   1.000 19.701 0 31  ARG FFF O   1 ? 15 
ATOM   4252 C CB  . ARG D 2 33  ? 9.772   -40.645 -2.189  1.000 19.155 0 31  ARG FFF CB  1 ? 15 
ATOM   4253 C CG  . ARG D 2 33  ? 8.291   -41.004 -2.218  1.000 19.215 0 31  ARG FFF CG  1 ? 15 
ATOM   4254 C CD  . ARG D 2 33  ? 7.466   -40.359 -1.136  1.000 19.080 0 31  ARG FFF CD  1 ? 15 
ATOM   4255 N NE  . ARG D 2 33  ? 6.071   -40.789 -1.227  1.000 19.962 0 31  ARG FFF NE  1 ? 15 
ATOM   4256 C CZ  . ARG D 2 33  ? 5.119   -40.399 -0.401  1.000 20.803 0 31  ARG FFF CZ  1 ? 15 
ATOM   4257 N NH1 . ARG D 2 33  ? 5.407   -39.562 0.582   1.000 20.795 0 31  ARG FFF NH1 1 ? 15 
ATOM   4258 N NH2 . ARG D 2 33  ? 3.878   -40.840 -0.561  1.000 21.419 0 31  ARG FFF NH2 1 ? 15 
ATOM   4259 N N   . HIS D 2 34  ? 10.981  -43.303 -1.000  1.000 19.362 0 32  HIS FFF N   1 ? 15 
ATOM   4260 C CA  . HIS D 2 34  ? 10.622  -44.740 -0.984  1.000 19.843 0 32  HIS FFF CA  1 ? 15 
ATOM   4261 C C   . HIS D 2 34  ? 11.150  -45.457 0.252   1.000 18.758 0 32  HIS FFF C   1 ? 15 
ATOM   4262 O O   . HIS D 2 34  ? 12.197  -45.088 0.817   1.000 18.773 0 32  HIS FFF O   1 ? 15 
ATOM   4263 C CB  . HIS D 2 34  ? 11.052  -45.421 -2.284  1.000 20.366 0 32  HIS FFF CB  1 ? 15 
ATOM   4264 C CG  . HIS D 2 34  ? 10.514  -44.686 -3.457  1.000 21.448 0 32  HIS FFF CG  1 ? 15 
ATOM   4265 N ND1 . HIS D 2 34  ? 11.318  -43.939 -4.290  1.000 21.549 0 32  HIS FFF ND1 1 ? 15 
ATOM   4266 C CD2 . HIS D 2 34  ? 9.241   -44.461 -3.852  1.000 23.543 0 32  HIS FFF CD2 1 ? 15 
ATOM   4267 C CE1 . HIS D 2 34  ? 10.576  -43.346 -5.200  1.000 23.656 0 32  HIS FFF CE1 1 ? 15 
ATOM   4268 N NE2 . HIS D 2 34  ? 9.292   -43.657 -4.963  1.000 24.731 0 32  HIS FFF NE2 1 ? 15 
ATOM   4269 N N   . ALA D 2 35  ? 10.472  -46.551 0.580   1.000 20.585 0 33  ALA FFF N   1 ? 15 
ATOM   4270 C CA  . ALA D 2 35  ? 10.911  -47.546 1.583   1.000 20.620 0 33  ALA FFF CA  1 ? 15 
ATOM   4271 C C   . ALA D 2 35  ? 12.026  -48.387 0.968   1.000 21.167 0 33  ALA FFF C   1 ? 15 
ATOM   4272 O O   . ALA D 2 35  ? 11.903  -48.809 -0.196  1.000 20.884 0 33  ALA FFF O   1 ? 15 
ATOM   4273 C CB  . ALA D 2 35  ? 9.753   -48.407 2.003   1.000 21.945 0 33  ALA FFF CB  1 ? 15 
ATOM   4274 N N   . ILE D 2 36  ? 13.118  -48.546 1.695   1.000 21.074 0 34  ILE FFF N   1 ? 15 
ATOM   4275 C CA  . ILE D 2 36  ? 14.259  -49.374 1.220   1.000 21.884 0 34  ILE FFF CA  1 ? 15 
ATOM   4276 C C   . ILE D 2 36  ? 14.765  -50.157 2.426   1.000 22.223 0 34  ILE FFF C   1 ? 15 
ATOM   4277 O O   . ILE D 2 36  ? 14.684  -49.646 3.555   1.000 22.950 0 34  ILE FFF O   1 ? 15 
ATOM   4278 C CB  . ILE D 2 36  ? 15.359  -48.521 0.565   1.000 21.737 0 34  ILE FFF CB  1 ? 15 
ATOM   4279 C CG1 . ILE D 2 36  ? 16.396  -49.408 -0.139  1.000 21.705 0 34  ILE FFF CG1 1 ? 15 
ATOM   4280 C CG2 . ILE D 2 36  ? 15.985  -47.590 1.573   1.000 22.158 0 34  ILE FFF CG2 1 ? 15 
ATOM   4281 C CD1 . ILE D 2 36  ? 17.397  -48.651 -0.961  1.000 21.752 0 34  ILE FFF CD1 1 ? 15 
ATOM   4282 N N   . GLY D 2 37  ? 15.187  -51.391 2.190   1.000 22.706 0 35  GLY FFF N   1 ? 15 
ATOM   4283 C CA  . GLY D 2 37  ? 15.608  -52.242 3.305   1.000 24.369 0 35  GLY FFF CA  1 ? 15 
ATOM   4284 C C   . GLY D 2 37  ? 16.270  -53.511 2.844   1.000 23.624 0 35  GLY FFF C   1 ? 15 
ATOM   4285 O O   . GLY D 2 37  ? 16.700  -53.626 1.660   1.000 21.149 0 35  GLY FFF O   1 ? 15 
ATOM   4286 N N   . TRP D 2 38  ? 16.372  -54.438 3.782   1.000 24.762 0 36  TRP FFF N   1 ? 15 
ATOM   4287 C CA  A TRP D 2 38  ? 17.048  -55.739 3.576   0.500 24.956 0 36  TRP FFF CA  1 ? 15 
ATOM   4288 C CA  B TRP D 2 38  ? 17.037  -55.739 3.543   0.500 24.711 0 36  TRP FFF CA  1 ? 15 
ATOM   4289 C C   . TRP D 2 38  ? 16.075  -56.884 3.843   1.000 25.722 0 36  TRP FFF C   1 ? 15 
ATOM   4290 O O   . TRP D 2 38  ? 15.260  -56.764 4.786   1.000 24.789 0 36  TRP FFF O   1 ? 15 
ATOM   4291 C CB  A TRP D 2 38  ? 18.278  -55.819 4.476   0.500 26.915 0 36  TRP FFF CB  1 ? 15 
ATOM   4292 C CB  B TRP D 2 38  ? 18.320  -55.869 4.362   0.500 26.343 0 36  TRP FFF CB  1 ? 15 
ATOM   4293 C CG  A TRP D 2 38  ? 19.226  -54.691 4.214   0.500 26.512 0 36  TRP FFF CG  1 ? 15 
ATOM   4294 C CG  B TRP D 2 38  ? 19.527  -55.316 3.674   0.500 25.901 0 36  TRP FFF CG  1 ? 15 
ATOM   4295 C CD1 A TRP D 2 38  ? 19.186  -53.426 4.728   0.500 27.185 0 36  TRP FFF CD1 1 ? 15 
ATOM   4296 C CD1 B TRP D 2 38  ? 20.359  -55.972 2.817   0.500 25.317 0 36  TRP FFF CD1 1 ? 15 
ATOM   4297 C CD2 A TRP D 2 38  ? 20.341  -54.725 3.311   0.500 26.613 0 36  TRP FFF CD2 1 ? 15 
ATOM   4298 C CD2 B TRP D 2 38  ? 20.047  -53.984 3.804   0.500 26.009 0 36  TRP FFF CD2 1 ? 15 
ATOM   4299 N NE1 A TRP D 2 38  ? 20.211  -52.677 4.215   0.500 27.345 0 36  TRP FFF NE1 1 ? 15 
ATOM   4300 N NE1 B TRP D 2 38  ? 21.373  -55.146 2.419   0.500 26.307 0 36  TRP FFF NE1 1 ? 15 
ATOM   4301 C CE2 A TRP D 2 38  ? 20.945  -53.452 3.355   0.500 27.237 0 36  TRP FFF CE2 1 ? 15 
ATOM   4302 C CE2 B TRP D 2 38  ? 21.206  -53.920 3.003   0.500 26.020 0 36  TRP FFF CE2 1 ? 15 
ATOM   4303 C CE3 A TRP D 2 38  ? 20.906  -55.715 2.501   0.500 26.633 0 36  TRP FFF CE3 1 ? 15 
ATOM   4304 C CE3 B TRP D 2 38  ? 19.653  -52.847 4.523   0.500 26.535 0 36  TRP FFF CE3 1 ? 15 
ATOM   4305 C CZ2 A TRP D 2 38  ? 22.078  -53.142 2.603   0.500 27.636 0 36  TRP FFF CZ2 1 ? 15 
ATOM   4306 C CZ2 B TRP D 2 38  ? 21.968  -52.759 2.899   0.500 26.803 0 36  TRP FFF CZ2 1 ? 15 
ATOM   4307 C CZ3 A TRP D 2 38  ? 22.029  -55.405 1.766   0.500 28.185 0 36  TRP FFF CZ3 1 ? 15 
ATOM   4308 C CZ3 B TRP D 2 38  ? 20.408  -51.701 4.419   0.500 26.328 0 36  TRP FFF CZ3 1 ? 15 
ATOM   4309 C CH2 A TRP D 2 38  ? 22.602  -54.133 1.811   0.500 26.848 0 36  TRP FFF CH2 1 ? 15 
ATOM   4310 C CH2 B TRP D 2 38  ? 21.552  -51.665 3.621   0.500 26.197 0 36  TRP FFF CH2 1 ? 15 
ATOM   4311 N N   . PHE D 2 39  ? 16.179  -57.914 3.016   1.000 24.405 0 37  PHE FFF N   1 ? 15 
ATOM   4312 C CA  . PHE D 2 39  ? 15.579  -59.250 3.219   1.000 25.533 0 37  PHE FFF CA  1 ? 15 
ATOM   4313 C C   . PHE D 2 39  ? 16.747  -60.221 3.326   1.000 26.058 0 37  PHE FFF C   1 ? 15 
ATOM   4314 O O   . PHE D 2 39  ? 17.882  -59.857 2.938   1.000 27.269 0 37  PHE FFF O   1 ? 15 
ATOM   4315 C CB  . PHE D 2 39  ? 14.665  -59.610 2.046   1.000 25.416 0 37  PHE FFF CB  1 ? 15 
ATOM   4316 C CG  . PHE D 2 39  ? 13.316  -58.946 2.063   1.000 25.667 0 37  PHE FFF CG  1 ? 15 
ATOM   4317 C CD1 . PHE D 2 39  ? 13.202  -57.575 1.889   1.000 26.120 0 37  PHE FFF CD1 1 ? 15 
ATOM   4318 C CD2 . PHE D 2 39  ? 12.162  -59.687 2.248   1.000 26.300 0 37  PHE FFF CD2 1 ? 15 
ATOM   4319 C CE1 . PHE D 2 39  ? 11.955  -56.965 1.899   1.000 27.093 0 37  PHE FFF CE1 1 ? 15 
ATOM   4320 C CE2 . PHE D 2 39  ? 10.917  -59.082 2.230   1.000 27.867 0 37  PHE FFF CE2 1 ? 15 
ATOM   4321 C CZ  . PHE D 2 39  ? 10.819  -57.720 2.060   1.000 27.760 0 37  PHE FFF CZ  1 ? 15 
ATOM   4322 N N   . ARG D 2 40  ? 16.484  -61.427 3.800   1.000 22.914 0 38  ARG FFF N   1 ? 16 
ATOM   4323 C CA  . ARG D 2 40  ? 17.513  -62.487 3.806   1.000 24.002 0 38  ARG FFF CA  1 ? 16 
ATOM   4324 C C   . ARG D 2 40  ? 16.836  -63.823 3.511   1.000 23.353 0 38  ARG FFF C   1 ? 16 
ATOM   4325 O O   . ARG D 2 40  ? 15.622  -63.975 3.750   1.000 23.271 0 38  ARG FFF O   1 ? 16 
ATOM   4326 C CB  . ARG D 2 40  ? 18.307  -62.529 5.114   1.000 26.040 0 38  ARG FFF CB  1 ? 16 
ATOM   4327 C CG  . ARG D 2 40  ? 17.532  -63.027 6.318   1.000 27.273 0 38  ARG FFF CG  1 ? 16 
ATOM   4328 C CD  . ARG D 2 40  ? 18.441  -63.020 7.530   1.000 31.327 0 38  ARG FFF CD  1 ? 16 
ATOM   4329 N NE  . ARG D 2 40  ? 17.730  -63.223 8.782   1.000 34.116 0 38  ARG FFF NE  1 ? 16 
ATOM   4330 C CZ  . ARG D 2 40  ? 18.304  -63.206 9.987   1.000 37.744 0 38  ARG FFF CZ  1 ? 16 
ATOM   4331 N NH1 . ARG D 2 40  ? 19.605  -62.989 10.117  1.000 36.598 0 38  ARG FFF NH1 1 ? 16 
ATOM   4332 N NH2 . ARG D 2 40  ? 17.569  -63.398 11.067  1.000 41.589 0 38  ARG FFF NH2 1 ? 16 
ATOM   4333 N N   . GLN D 2 41  ? 17.605  -64.736 2.942   1.000 23.939 0 39  GLN FFF N   1 ? 16 
ATOM   4334 C CA  . GLN D 2 41  ? 17.146  -66.119 2.718   1.000 23.608 0 39  GLN FFF CA  1 ? 16 
ATOM   4335 C C   . GLN D 2 41  ? 18.222  -67.058 3.256   1.000 23.020 0 39  GLN FFF C   1 ? 16 
ATOM   4336 O O   . GLN D 2 41  ? 19.309  -67.135 2.644   1.000 23.933 0 39  GLN FFF O   1 ? 16 
ATOM   4337 C CB  . GLN D 2 41  ? 16.840  -66.388 1.256   1.000 25.292 0 39  GLN FFF CB  1 ? 16 
ATOM   4338 C CG  . GLN D 2 41  ? 16.253  -67.782 1.079   1.000 25.498 0 39  GLN FFF CG  1 ? 16 
ATOM   4339 C CD  . GLN D 2 41  ? 15.767  -68.008 -0.327  1.000 29.853 0 39  GLN FFF CD  1 ? 16 
ATOM   4340 O OE1 . GLN D 2 41  ? 16.196  -67.338 -1.261  1.000 35.841 0 39  GLN FFF OE1 1 ? 16 
ATOM   4341 N NE2 . GLN D 2 41  ? 14.858  -68.953 -0.480  1.000 31.776 0 39  GLN FFF NE2 1 ? 16 
ATOM   4342 N N   . ALA D 2 42  ? 17.940  -67.634 4.417   1.000 25.035 0 40  ALA FFF N   1 ? 16 
ATOM   4343 C CA  . ALA D 2 42  ? 18.800  -68.609 5.113   1.000 27.381 0 40  ALA FFF CA  1 ? 16 
ATOM   4344 C C   . ALA D 2 42  ? 18.488  -69.987 4.542   1.000 26.432 0 40  ALA FFF C   1 ? 16 
ATOM   4345 O O   . ALA D 2 42  ? 17.390  -70.218 4.033   1.000 25.422 0 40  ALA FFF O   1 ? 16 
ATOM   4346 C CB  . ALA D 2 42  ? 18.573  -68.547 6.607   1.000 30.095 0 40  ALA FFF CB  1 ? 16 
ATOM   4347 N N   . PRO D 2 43  ? 19.449  -70.933 4.593   1.000 27.418 0 41  PRO FFF N   1 ? 16 
ATOM   4348 C CA  . PRO D 2 43  ? 19.194  -72.293 4.127   1.000 27.397 0 41  PRO FFF CA  1 ? 16 
ATOM   4349 C C   . PRO D 2 43  ? 17.923  -72.876 4.767   1.000 28.333 0 41  PRO FFF C   1 ? 16 
ATOM   4350 O O   . PRO D 2 43  ? 17.770  -72.793 5.978   1.000 27.483 0 41  PRO FFF O   1 ? 16 
ATOM   4351 C CB  . PRO D 2 43  ? 20.460  -73.043 4.547   1.000 29.335 0 41  PRO FFF CB  1 ? 16 
ATOM   4352 C CG  . PRO D 2 43  ? 21.528  -71.984 4.537   1.000 29.532 0 41  PRO FFF CG  1 ? 16 
ATOM   4353 C CD  . PRO D 2 43  ? 20.831  -70.750 5.076   1.000 29.038 0 41  PRO FFF CD  1 ? 16 
ATOM   4354 N N   . GLY D 2 44  ? 17.030  -73.412 3.932   1.000 26.770 0 42  GLY FFF N   1 ? 16 
ATOM   4355 C CA  . GLY D 2 44  ? 15.811  -74.120 4.355   1.000 28.432 0 42  GLY FFF CA  1 ? 16 
ATOM   4356 C C   . GLY D 2 44  ? 14.730  -73.213 4.908   1.000 30.175 0 42  GLY FFF C   1 ? 16 
ATOM   4357 O O   . GLY D 2 44  ? 13.754  -73.748 5.470   1.000 30.855 0 42  GLY FFF O   1 ? 16 
ATOM   4358 N N   . LYS D 2 45  ? 14.867  -71.898 4.733   1.000 28.385 0 43  LYS FFF N   1 ? 16 
ATOM   4359 C CA  . LYS D 2 45  ? 13.880  -70.901 5.207   1.000 30.328 0 43  LYS FFF CA  1 ? 16 
ATOM   4360 C C   . LYS D 2 45  ? 13.423  -70.041 4.025   1.000 27.923 0 43  LYS FFF C   1 ? 16 
ATOM   4361 O O   . LYS D 2 45  ? 14.223  -69.773 3.095   1.000 26.976 0 43  LYS FFF O   1 ? 16 
ATOM   4362 C CB  . LYS D 2 45  ? 14.485  -70.029 6.312   1.000 34.306 0 43  LYS FFF CB  1 ? 16 
ATOM   4363 C CG  . LYS D 2 45  ? 15.057  -70.783 7.503   1.000 39.750 0 43  LYS FFF CG  1 ? 16 
ATOM   4364 C CD  . LYS D 2 45  ? 14.014  -71.502 8.328   1.000 49.943 0 43  LYS FFF CD  1 ? 16 
ATOM   4365 C CE  . LYS D 2 45  ? 14.613  -72.442 9.354   1.000 57.220 0 43  LYS FFF CE  1 ? 16 
ATOM   4366 N NZ  . LYS D 2 45  ? 15.394  -71.702 10.373  1.000 61.525 0 43  LYS FFF NZ  1 ? 16 
ATOM   4367 N N   . GLU D 2 46  ? 12.175  -69.591 4.080   1.000 29.699 0 44  GLU FFF N   1 ? 16 
ATOM   4368 C CA  . GLU D 2 46  ? 11.608  -68.635 3.103   1.000 29.462 0 44  GLU FFF CA  1 ? 16 
ATOM   4369 C C   . GLU D 2 46  ? 12.356  -67.306 3.252   1.000 27.570 0 44  GLU FFF C   1 ? 16 
ATOM   4370 O O   . GLU D 2 46  ? 12.768  -66.968 4.390   1.000 26.741 0 44  GLU FFF O   1 ? 16 
ATOM   4371 C CB  . GLU D 2 46  ? 10.111  -68.442 3.344   1.000 33.082 0 44  GLU FFF CB  1 ? 16 
ATOM   4372 C CG  . GLU D 2 46  ? 9.269   -69.624 2.914   1.000 37.904 0 44  GLU FFF CG  1 ? 16 
ATOM   4373 C CD  . GLU D 2 46  ? 7.783   -69.325 2.837   1.000 43.334 0 44  GLU FFF CD  1 ? 16 
ATOM   4374 O OE1 . GLU D 2 46  ? 7.275   -69.194 1.708   1.000 45.674 0 44  GLU FFF OE1 1 ? 16 
ATOM   4375 O OE2 . GLU D 2 46  ? 7.145   -69.216 3.903   1.000 46.926 0 44  GLU FFF OE2 1 ? 16 
ATOM   4376 N N   . ARG D 2 47  ? 12.478  -66.561 2.159   1.000 26.655 0 45  ARG FFF N   1 ? 16 
ATOM   4377 C CA  . ARG D 2 47  ? 13.010  -65.178 2.200   1.000 26.988 0 45  ARG FFF CA  1 ? 16 
ATOM   4378 C C   . ARG D 2 47  ? 12.175  -64.385 3.207   1.000 27.092 0 45  ARG FFF C   1 ? 16 
ATOM   4379 O O   . ARG D 2 47  ? 10.928  -64.514 3.185   1.000 28.916 0 45  ARG FFF O   1 ? 16 
ATOM   4380 C CB  . ARG D 2 47  ? 12.959  -64.525 0.819   1.000 29.935 0 45  ARG FFF CB  1 ? 16 
ATOM   4381 C CG  . ARG D 2 47  ? 13.791  -63.255 0.711   1.000 30.929 0 45  ARG FFF CG  1 ? 16 
ATOM   4382 C CD  . ARG D 2 47  ? 13.860  -62.735 -0.718  1.000 36.126 0 45  ARG FFF CD  1 ? 16 
ATOM   4383 N NE  . ARG D 2 47  ? 14.481  -63.713 -1.601  1.000 40.823 0 45  ARG FFF NE  1 ? 16 
ATOM   4384 C CZ  . ARG D 2 47  ? 14.863  -63.492 -2.862  1.000 43.765 0 45  ARG FFF CZ  1 ? 16 
ATOM   4385 N NH1 . ARG D 2 47  ? 14.738  -62.295 -3.416  1.000 41.686 0 45  ARG FFF NH1 1 ? 16 
ATOM   4386 N NH2 . ARG D 2 47  ? 15.409  -64.483 -3.547  1.000 43.995 0 45  ARG FFF NH2 1 ? 16 
ATOM   4387 N N   . GLU D 2 48  ? 12.826  -63.604 4.062   1.000 26.544 0 46  GLU FFF N   1 ? 16 
ATOM   4388 C CA  . GLU D 2 48  ? 12.128  -62.857 5.141   1.000 29.780 0 46  GLU FFF CA  1 ? 16 
ATOM   4389 C C   . GLU D 2 48  ? 12.677  -61.430 5.229   1.000 27.226 0 46  GLU FFF C   1 ? 16 
ATOM   4390 O O   . GLU D 2 48  ? 13.869  -61.213 4.948   1.000 25.638 0 46  GLU FFF O   1 ? 16 
ATOM   4391 C CB  . GLU D 2 48  ? 12.272  -63.593 6.477   1.000 33.397 0 46  GLU FFF CB  1 ? 16 
ATOM   4392 C CG  . GLU D 2 48  ? 13.702  -63.655 6.985   1.000 34.986 0 46  GLU FFF CG  1 ? 16 
ATOM   4393 C CD  . GLU D 2 48  ? 13.921  -64.492 8.243   1.000 43.917 0 46  GLU FFF CD  1 ? 16 
ATOM   4394 O OE1 . GLU D 2 48  ? 12.963  -65.156 8.684   1.000 44.829 0 46  GLU FFF OE1 1 ? 16 
ATOM   4395 O OE2 . GLU D 2 48  ? 15.056  -64.477 8.779   1.000 46.283 0 46  GLU FFF OE2 1 ? 16 
ATOM   4396 N N   . ARG D 2 49  ? 11.828  -60.522 5.698   1.000 29.455 0 47  ARG FFF N   1 ? 16 
ATOM   4397 C CA  . ARG D 2 49  ? 12.199  -59.132 6.061   1.000 30.416 0 47  ARG FFF CA  1 ? 16 
ATOM   4398 C C   . ARG D 2 49  ? 13.266  -59.173 7.152   1.000 27.184 0 47  ARG FFF C   1 ? 16 
ATOM   4399 O O   . ARG D 2 49  ? 13.144  -59.998 8.062   1.000 28.681 0 47  ARG FFF O   1 ? 16 
ATOM   4400 C CB  . ARG D 2 49  ? 10.980  -58.380 6.598   1.000 35.272 0 47  ARG FFF CB  1 ? 16 
ATOM   4401 C CG  . ARG D 2 49  ? 9.932   -58.066 5.547   1.000 41.674 0 47  ARG FFF CG  1 ? 16 
ATOM   4402 C CD  . ARG D 2 49  ? 8.736   -57.328 6.135   1.000 47.484 0 47  ARG FFF CD  1 ? 16 
ATOM   4403 N NE  . ARG D 2 49  ? 7.815   -56.957 5.069   1.000 51.929 0 47  ARG FFF NE  1 ? 16 
ATOM   4404 C CZ  . ARG D 2 49  ? 7.979   -55.925 4.245   1.000 54.378 0 47  ARG FFF CZ  1 ? 16 
ATOM   4405 N NH1 . ARG D 2 49  ? 9.028   -55.126 4.366   1.000 53.488 0 47  ARG FFF NH1 1 ? 16 
ATOM   4406 N NH2 . ARG D 2 49  ? 7.094   -55.700 3.286   1.000 56.748 0 47  ARG FFF NH2 1 ? 16 
ATOM   4407 N N   . VAL D 2 50  ? 14.276  -58.313 7.043   1.000 26.486 0 48  VAL FFF N   1 ? 16 
ATOM   4408 C CA  . VAL D 2 50  ? 15.319  -58.096 8.082   1.000 26.146 0 48  VAL FFF CA  1 ? 16 
ATOM   4409 C C   . VAL D 2 50  ? 15.131  -56.703 8.685   1.000 26.764 0 48  VAL FFF C   1 ? 16 
ATOM   4410 O O   . VAL D 2 50  ? 14.935  -56.586 9.899   1.000 27.649 0 48  VAL FFF O   1 ? 16 
ATOM   4411 C CB  . VAL D 2 50  ? 16.719  -58.287 7.473   1.000 27.602 0 48  VAL FFF CB  1 ? 16 
ATOM   4412 C CG1 . VAL D 2 50  ? 17.814  -57.814 8.412   1.000 28.485 0 48  VAL FFF CG1 1 ? 16 
ATOM   4413 C CG2 . VAL D 2 50  ? 16.929  -59.736 7.072   1.000 28.603 0 48  VAL FFF CG2 1 ? 16 
ATOM   4414 N N   . SER D 2 51  ? 15.170  -55.675 7.849   1.000 25.851 0 49  SER FFF N   1 ? 16 
ATOM   4415 C CA  . SER D 2 51  ? 15.056  -54.277 8.319   1.000 26.349 0 49  SER FFF CA  1 ? 16 
ATOM   4416 C C   . SER D 2 51  ? 14.618  -53.395 7.165   1.000 25.573 0 49  SER FFF C   1 ? 16 
ATOM   4417 O O   . SER D 2 51  ? 14.908  -53.726 6.010   1.000 26.223 0 49  SER FFF O   1 ? 16 
ATOM   4418 C CB  . SER D 2 51  ? 16.352  -53.809 8.916   1.000 28.119 0 49  SER FFF CB  1 ? 16 
ATOM   4419 O OG  . SER D 2 51  ? 16.183  -52.522 9.493   1.000 31.912 0 49  SER FFF OG  1 ? 16 
ATOM   4420 N N   . CYS D 2 52  ? 13.940  -52.303 7.478   1.000 27.266 0 50  CYS FFF N   1 ? 17 
ATOM   4421 C CA  . CYS D 2 52  ? 13.465  -51.342 6.460   1.000 25.582 0 50  CYS FFF CA  1 ? 17 
ATOM   4422 C C   . CYS D 2 52  ? 13.540  -49.933 7.032   1.000 23.837 0 50  CYS FFF C   1 ? 17 
ATOM   4423 O O   . CYS D 2 52  ? 13.346  -49.754 8.260   1.000 25.217 0 50  CYS FFF O   1 ? 17 
ATOM   4424 C CB  . CYS D 2 52  ? 12.051  -51.687 6.019   1.000 26.680 0 50  CYS FFF CB  1 ? 17 
ATOM   4425 S SG  . CYS D 2 52  ? 11.473  -50.712 4.611   1.000 29.477 0 50  CYS FFF SG  1 ? 17 
ATOM   4426 N N   . ILE D 2 53  ? 13.818  -48.971 6.166   1.000 23.271 0 51  ILE FFF N   1 ? 17 
ATOM   4427 C CA  . ILE D 2 53  ? 13.708  -47.529 6.527   1.000 22.847 0 51  ILE FFF CA  1 ? 17 
ATOM   4428 C C   . ILE D 2 53  ? 12.834  -46.818 5.486   1.000 22.412 0 51  ILE FFF C   1 ? 17 
ATOM   4429 O O   . ILE D 2 53  ? 12.987  -47.050 4.267   1.000 21.665 0 51  ILE FFF O   1 ? 17 
ATOM   4430 C CB  . ILE D 2 53  ? 15.093  -46.878 6.679   1.000 23.479 0 51  ILE FFF CB  1 ? 17 
ATOM   4431 C CG1 . ILE D 2 53  ? 14.962  -45.457 7.235   1.000 23.924 0 51  ILE FFF CG1 1 ? 17 
ATOM   4432 C CG2 . ILE D 2 53  ? 15.865  -46.873 5.367   1.000 22.418 0 51  ILE FFF CG2 1 ? 17 
ATOM   4433 C CD1 . ILE D 2 53  ? 16.257  -44.889 7.754   1.000 25.163 0 51  ILE FFF CD1 1 ? 17 
ATOM   4434 N N   . ARG D 2 54  ? 11.922  -45.978 5.968   1.000 21.969 0 52  ARG FFF N   1 ? 17 
ATOM   4435 C CA  . ARG D 2 54  ? 11.128  -45.070 5.115   1.000 22.019 0 52  ARG FFF CA  1 ? 17 
ATOM   4436 C C   . ARG D 2 54  ? 12.019  -43.856 4.836   1.000 20.843 0 52  ARG FFF C   1 ? 17 
ATOM   4437 O O   . ARG D 2 54  ? 12.271  -43.097 5.774   1.000 20.299 0 52  ARG FFF O   1 ? 17 
ATOM   4438 C CB  . ARG D 2 54  ? 9.822   -44.730 5.846   1.000 23.650 0 52  ARG FFF CB  1 ? 17 
ATOM   4439 C CG  . ARG D 2 54  ? 8.924   -45.920 6.137   1.000 25.729 0 52  ARG FFF CG  1 ? 17 
ATOM   4440 C CD  . ARG D 2 54  ? 7.921   -45.616 7.247   1.000 29.109 0 52  ARG FFF CD  1 ? 17 
ATOM   4441 N NE  . ARG D 2 54  ? 7.246   -44.361 6.948   1.000 29.874 0 52  ARG FFF NE  1 ? 17 
ATOM   4442 C CZ  . ARG D 2 54  ? 6.099   -44.223 6.284   1.000 34.274 0 52  ARG FFF CZ  1 ? 17 
ATOM   4443 N NH1 . ARG D 2 54  ? 5.392   -45.280 5.915   1.000 36.552 0 52  ARG FFF NH1 1 ? 17 
ATOM   4444 N NH2 . ARG D 2 54  ? 5.634   -43.009 6.032   1.000 36.582 0 52  ARG FFF NH2 1 ? 17 
ATOM   4445 N N   . THR D 2 55  ? 12.522  -43.666 3.611   1.000 19.000 0 53  THR FFF N   1 ? 17 
ATOM   4446 C CA  . THR D 2 55  ? 13.454  -42.540 3.330   1.000 18.630 0 53  THR FFF CA  1 ? 17 
ATOM   4447 C C   . THR D 2 55  ? 12.680  -41.217 3.279   1.000 18.295 0 53  THR FFF C   1 ? 17 
ATOM   4448 O O   . THR D 2 55  ? 13.330  -40.194 3.245   1.000 18.115 0 53  THR FFF O   1 ? 17 
ATOM   4449 C CB  . THR D 2 55  ? 14.338  -42.778 2.101   1.000 18.094 0 53  THR FFF CB  1 ? 17 
ATOM   4450 O OG1 . THR D 2 55  ? 13.546  -42.744 0.907   1.000 17.718 0 53  THR FFF OG1 1 ? 17 
ATOM   4451 C CG2 . THR D 2 55  ? 15.095  -44.083 2.231   1.000 18.764 0 53  THR FFF CG2 1 ? 17 
ATOM   4452 N N   . PHE D 2 56  ? 11.338  -41.242 3.329   1.000 19.072 0 54  PHE FFF N   1 ? 17 
ATOM   4453 C CA  . PHE D 2 56  ? 10.529  -39.994 3.358   1.000 19.057 0 54  PHE FFF CA  1 ? 17 
ATOM   4454 C C   . PHE D 2 56  ? 10.530  -39.394 4.766   1.000 19.995 0 54  PHE FFF C   1 ? 17 
ATOM   4455 O O   . PHE D 2 56  ? 10.499  -38.148 4.885   1.000 20.503 0 54  PHE FFF O   1 ? 17 
ATOM   4456 C CB  . PHE D 2 56  ? 9.086   -40.258 2.922   1.000 19.504 0 54  PHE FFF CB  1 ? 17 
ATOM   4457 C CG  . PHE D 2 56  ? 8.266   -39.007 2.740   1.000 20.181 0 54  PHE FFF CG  1 ? 17 
ATOM   4458 C CD1 . PHE D 2 56  ? 8.510   -38.146 1.681   1.000 20.134 0 54  PHE FFF CD1 1 ? 17 
ATOM   4459 C CD2 . PHE D 2 56  ? 7.204   -38.727 3.584   1.000 22.097 0 54  PHE FFF CD2 1 ? 17 
ATOM   4460 C CE1 . PHE D 2 56  ? 7.754   -36.995 1.506   1.000 20.763 0 54  PHE FFF CE1 1 ? 17 
ATOM   4461 C CE2 . PHE D 2 56  ? 6.436   -37.582 3.399   1.000 21.709 0 54  PHE FFF CE2 1 ? 17 
ATOM   4462 C CZ  . PHE D 2 56  ? 6.697   -36.733 2.354   1.000 20.792 0 54  PHE FFF CZ  1 ? 17 
ATOM   4463 N N   . ASP D 2 57  ? 10.573  -40.217 5.814   1.000 21.526 0 55  ASP FFF N   1 ? 17 
ATOM   4464 C CA  . ASP D 2 57  ? 10.422  -39.696 7.199   1.000 22.393 0 55  ASP FFF CA  1 ? 17 
ATOM   4465 C C   . ASP D 2 57  ? 11.384  -40.363 8.185   1.000 23.330 0 55  ASP FFF C   1 ? 17 
ATOM   4466 O O   . ASP D 2 57  ? 11.332  -39.995 9.378   1.000 23.489 0 55  ASP FFF O   1 ? 17 
ATOM   4467 C CB  . ASP D 2 57  ? 8.948   -39.754 7.627   1.000 24.308 0 55  ASP FFF CB  1 ? 17 
ATOM   4468 C CG  . ASP D 2 57  ? 8.377   -41.155 7.696   1.000 26.100 0 55  ASP FFF CG  1 ? 17 
ATOM   4469 O OD1 . ASP D 2 57  ? 9.169   -42.097 7.729   1.000 25.778 0 55  ASP FFF OD1 1 ? 17 
ATOM   4470 O OD2 . ASP D 2 57  ? 7.128   -41.291 7.790   1.000 29.361 0 55  ASP FFF OD2 1 ? 17 
ATOM   4471 N N   . GLY D 2 58  ? 12.287  -41.240 7.731   1.000 22.686 0 56  GLY FFF N   1 ? 17 
ATOM   4472 C CA  . GLY D 2 58  ? 13.385  -41.757 8.576   1.000 24.046 0 56  GLY FFF CA  1 ? 17 
ATOM   4473 C C   . GLY D 2 58  ? 12.960  -42.857 9.545   1.000 24.666 0 56  GLY FFF C   1 ? 17 
ATOM   4474 O O   . GLY D 2 58  ? 13.802  -43.323 10.310  1.000 25.936 0 56  GLY FFF O   1 ? 17 
ATOM   4475 N N   . ILE D 2 59  ? 11.695  -43.267 9.540   1.000 25.377 0 57  ILE FFF N   1 ? 17 
ATOM   4476 C CA  . ILE D 2 59  ? 11.149  -44.272 10.497  1.000 26.925 0 57  ILE FFF CA  1 ? 17 
ATOM   4477 C C   . ILE D 2 59  ? 11.649  -45.660 10.077  1.000 26.456 0 57  ILE FFF C   1 ? 17 
ATOM   4478 O O   . ILE D 2 59  ? 11.453  -46.050 8.892   1.000 24.656 0 57  ILE FFF O   1 ? 17 
ATOM   4479 C CB  . ILE D 2 59  ? 9.616   -44.176 10.559  1.000 28.503 0 57  ILE FFF CB  1 ? 17 
ATOM   4480 C CG1 . ILE D 2 59  ? 9.196   -42.851 11.207  1.000 30.756 0 57  ILE FFF CG1 1 ? 17 
ATOM   4481 C CG2 . ILE D 2 59  ? 9.023   -45.382 11.278  1.000 30.152 0 57  ILE FFF CG2 1 ? 17 
ATOM   4482 C CD1 . ILE D 2 59  ? 7.703   -42.629 11.258  1.000 32.697 0 57  ILE FFF CD1 1 ? 17 
ATOM   4483 N N   . THR D 2 60  ? 12.265  -46.374 11.019  1.000 27.220 0 58  THR FFF N   1 ? 17 
ATOM   4484 C CA  . THR D 2 60  ? 12.879  -47.706 10.796  1.000 27.567 0 58  THR FFF CA  1 ? 17 
ATOM   4485 C C   . THR D 2 60  ? 11.981  -48.803 11.368  1.000 29.436 0 58  THR FFF C   1 ? 17 
ATOM   4486 O O   . THR D 2 60  ? 11.207  -48.541 12.320  1.000 29.007 0 58  THR FFF O   1 ? 17 
ATOM   4487 C CB  . THR D 2 60  ? 14.286  -47.788 11.393  1.000 28.173 0 58  THR FFF CB  1 ? 17 
ATOM   4488 O OG1 . THR D 2 60  ? 14.150  -47.635 12.806  1.000 30.468 0 58  THR FFF OG1 1 ? 17 
ATOM   4489 C CG2 . THR D 2 60  ? 15.226  -46.736 10.847  1.000 27.995 0 58  THR FFF CG2 1 ? 17 
ATOM   4490 N N   . SER D 2 61  ? 12.149  -50.014 10.841  1.000 29.294 0 59  SER FFF N   1 ? 17 
ATOM   4491 C CA  . SER D 2 61  ? 11.468  -51.244 11.303  1.000 31.934 0 59  SER FFF CA  1 ? 17 
ATOM   4492 C C   . SER D 2 61  ? 12.445  -52.421 11.247  1.000 32.708 0 59  SER FFF C   1 ? 17 
ATOM   4493 O O   . SER D 2 61  ? 13.362  -52.419 10.394  1.000 29.644 0 59  SER FFF O   1 ? 17 
ATOM   4494 C CB  . SER D 2 61  ? 10.218  -51.499 10.512  1.000 32.085 0 59  SER FFF CB  1 ? 17 
ATOM   4495 O OG  . SER D 2 61  ? 10.503  -51.530 9.130   1.000 31.689 0 59  SER FFF OG  1 ? 17 
ATOM   4496 N N   . TYR D 2 62  ? 12.264  -53.357 12.170  1.000 34.257 0 60  TYR FFF N   1 ? 17 
ATOM   4497 C CA  . TYR D 2 62  ? 13.106  -54.557 12.371  1.000 37.306 0 60  TYR FFF CA  1 ? 17 
ATOM   4498 C C   . TYR D 2 62  ? 12.184  -55.741 12.664  1.000 40.149 0 60  TYR FFF C   1 ? 17 
ATOM   4499 O O   . TYR D 2 62  ? 11.032  -55.542 13.066  1.000 43.696 0 60  TYR FFF O   1 ? 17 
ATOM   4500 C CB  . TYR D 2 62  ? 14.075  -54.340 13.537  1.000 38.846 0 60  TYR FFF CB  1 ? 17 
ATOM   4501 C CG  . TYR D 2 62  ? 15.000  -53.168 13.360  1.000 37.498 0 60  TYR FFF CG  1 ? 17 
ATOM   4502 C CD1 . TYR D 2 62  ? 16.229  -53.337 12.750  1.000 37.255 0 60  TYR FFF CD1 1 ? 17 
ATOM   4503 C CD2 . TYR D 2 62  ? 14.647  -51.896 13.782  1.000 37.972 0 60  TYR FFF CD2 1 ? 17 
ATOM   4504 C CE1 . TYR D 2 62  ? 17.095  -52.272 12.566  1.000 38.070 0 60  TYR FFF CE1 1 ? 17 
ATOM   4505 C CE2 . TYR D 2 62  ? 15.506  -50.820 13.614  1.000 38.299 0 60  TYR FFF CE2 1 ? 17 
ATOM   4506 C CZ  . TYR D 2 62  ? 16.735  -51.013 13.005  1.000 37.870 0 60  TYR FFF CZ  1 ? 17 
ATOM   4507 O OH  . TYR D 2 62  ? 17.601  -49.981 12.796  1.000 39.438 0 60  TYR FFF OH  1 ? 17 
ATOM   4508 N N   . VAL D 2 63  ? 12.683  -56.949 12.459  1.000 42.138 0 61  VAL FFF N   1 ? 17 
ATOM   4509 C CA  . VAL D 2 63  ? 11.974  -58.190 12.882  1.000 45.367 0 61  VAL FFF CA  1 ? 17 
ATOM   4510 C C   . VAL D 2 63  ? 12.592  -58.628 14.210  1.000 48.698 0 61  VAL FFF C   1 ? 17 
ATOM   4511 O O   . VAL D 2 63  ? 13.737  -58.189 14.505  1.000 47.371 0 61  VAL FFF O   1 ? 17 
ATOM   4512 C CB  . VAL D 2 63  ? 12.041  -59.277 11.794  1.000 44.586 0 61  VAL FFF CB  1 ? 17 
ATOM   4513 C CG1 . VAL D 2 63  ? 11.242  -58.857 10.564  1.000 43.222 0 61  VAL FFF CG1 1 ? 17 
ATOM   4514 C CG2 . VAL D 2 63  ? 13.475  -59.628 11.412  1.000 42.843 0 61  VAL FFF CG2 1 ? 17 
ATOM   4515 N N   . GLU D 2 64  ? 11.868  -59.449 14.973  1.000 52.609 0 62  GLU FFF N   1 ? 17 
ATOM   4516 C CA  . GLU D 2 64  ? 12.238  -59.848 16.362  1.000 57.083 0 62  GLU FFF CA  1 ? 17 
ATOM   4517 C C   . GLU D 2 64  ? 13.697  -60.326 16.418  1.000 55.713 0 62  GLU FFF C   1 ? 17 
ATOM   4518 O O   . GLU D 2 64  ? 14.383  -59.989 17.394  1.000 59.984 0 62  GLU FFF O   1 ? 17 
ATOM   4519 C CB  . GLU D 2 64  ? 11.298  -60.933 16.896  1.000 63.111 0 62  GLU FFF CB  1 ? 17 
ATOM   4520 C CG  . GLU D 2 64  ? 10.209  -60.413 17.820  1.000 69.101 0 62  GLU FFF CG  1 ? 17 
ATOM   4521 C CD  . GLU D 2 64  ? 9.157   -59.542 17.153  1.000 70.920 0 62  GLU FFF CD  1 ? 17 
ATOM   4522 O OE1 . GLU D 2 64  ? 9.531   -58.531 16.522  1.000 71.127 0 62  GLU FFF OE1 1 ? 17 
ATOM   4523 O OE2 . GLU D 2 64  ? 7.959   -59.876 17.272  1.000 73.186 0 62  GLU FFF OE2 1 ? 17 
ATOM   4524 N N   . SER D 2 65  ? 14.150  -61.092 15.424  1.000 54.797 0 63  SER FFF N   1 ? 17 
ATOM   4525 C CA  . SER D 2 65  ? 15.476  -61.764 15.418  1.000 55.038 0 63  SER FFF CA  1 ? 17 
ATOM   4526 C C   . SER D 2 65  ? 16.607  -60.770 15.109  1.000 54.282 0 63  SER FFF C   1 ? 17 
ATOM   4527 O O   . SER D 2 65  ? 17.774  -61.168 15.286  1.000 58.262 0 63  SER FFF O   1 ? 17 
ATOM   4528 C CB  . SER D 2 65  ? 15.492  -62.930 14.449  1.000 54.278 0 63  SER FFF CB  1 ? 17 
ATOM   4529 O OG  . SER D 2 65  ? 15.243  -62.500 13.113  1.000 50.104 0 63  SER FFF OG  1 ? 17 
ATOM   4530 N N   . THR D 2 66  ? 16.297  -59.543 14.669  1.000 53.152 0 64  THR FFF N   1 ? 17 
ATOM   4531 C CA  . THR D 2 66  ? 17.307  -58.541 14.223  1.000 53.268 0 64  THR FFF CA  1 ? 17 
ATOM   4532 C C   . THR D 2 66  ? 17.344  -57.319 15.155  1.000 57.752 0 64  THR FFF C   1 ? 17 
ATOM   4533 O O   . THR D 2 66  ? 18.408  -56.685 15.203  1.000 59.964 0 64  THR FFF O   1 ? 17 
ATOM   4534 C CB  . THR D 2 66  ? 17.080  -58.144 12.756  1.000 49.888 0 64  THR FFF CB  1 ? 17 
ATOM   4535 O OG1 . THR D 2 66  ? 15.877  -57.387 12.612  1.000 48.861 0 64  THR FFF OG1 1 ? 17 
ATOM   4536 C CG2 . THR D 2 66  ? 17.019  -59.358 11.855  1.000 48.911 0 64  THR FFF CG2 1 ? 17 
ATOM   4537 N N   . LYS D 2 67  ? 16.241  -56.982 15.834  1.000 56.626 0 65  LYS FFF N   1 ? 17 
ATOM   4538 C CA  . LYS D 2 67  ? 16.166  -55.855 16.806  1.000 59.143 0 65  LYS FFF CA  1 ? 17 
ATOM   4539 C C   . LYS D 2 67  ? 17.400  -55.851 17.720  1.000 58.386 0 65  LYS FFF C   1 ? 17 
ATOM   4540 O O   . LYS D 2 67  ? 17.761  -56.920 18.234  1.000 54.999 0 65  LYS FFF O   1 ? 17 
ATOM   4541 C CB  . LYS D 2 67  ? 14.905  -55.953 17.674  1.000 63.873 0 65  LYS FFF CB  1 ? 17 
ATOM   4542 C CG  . LYS D 2 67  ? 13.675  -55.283 17.077  1.000 65.708 0 65  LYS FFF CG  1 ? 17 
ATOM   4543 C CD  . LYS D 2 67  ? 12.357  -55.695 17.700  1.000 71.041 0 65  LYS FFF CD  1 ? 17 
ATOM   4544 C CE  . LYS D 2 67  ? 11.169  -55.266 16.861  1.000 73.218 0 65  LYS FFF CE  1 ? 17 
ATOM   4545 N NZ  . LYS D 2 67  ? 9.903   -55.866 17.346  1.000 78.288 0 65  LYS FFF NZ  1 ? 17 
ATOM   4546 N N   . GLY D 2 68  ? 17.997  -54.673 17.923  1.000 58.075 0 66  GLY FFF N   1 ? 17 
ATOM   4547 C CA  . GLY D 2 68  ? 19.138  -54.446 18.832  1.000 58.376 0 66  GLY FFF CA  1 ? 17 
ATOM   4548 C C   . GLY D 2 68  ? 20.470  -54.688 18.140  1.000 55.831 0 66  GLY FFF C   1 ? 17 
ATOM   4549 O O   . GLY D 2 68  ? 21.309  -53.766 18.136  1.000 58.450 0 66  GLY FFF O   1 ? 17 
ATOM   4550 N N   . ARG D 2 69  ? 20.653  -55.878 17.563  1.000 51.255 0 67  ARG FFF N   1 ? 17 
ATOM   4551 C CA  . ARG D 2 69  ? 21.930  -56.341 16.955  1.000 47.592 0 67  ARG FFF CA  1 ? 17 
ATOM   4552 C C   . ARG D 2 69  ? 22.161  -55.631 15.618  1.000 45.359 0 67  ARG FFF C   1 ? 17 
ATOM   4553 O O   . ARG D 2 69  ? 23.326  -55.306 15.305  1.000 43.145 0 67  ARG FFF O   1 ? 17 
ATOM   4554 C CB  . ARG D 2 69  ? 21.903  -57.854 16.725  1.000 47.776 0 67  ARG FFF CB  1 ? 17 
ATOM   4555 C CG  . ARG D 2 69  ? 21.775  -58.680 17.995  1.000 50.525 0 67  ARG FFF CG  1 ? 17 
ATOM   4556 C CD  . ARG D 2 69  ? 21.988  -60.157 17.728  1.000 51.713 0 67  ARG FFF CD  1 ? 17 
ATOM   4557 N NE  . ARG D 2 69  ? 21.062  -60.688 16.729  1.000 49.885 0 67  ARG FFF NE  1 ? 17 
ATOM   4558 C CZ  . ARG D 2 69  ? 21.405  -61.366 15.627  1.000 46.999 0 67  ARG FFF CZ  1 ? 17 
ATOM   4559 N NH1 . ARG D 2 69  ? 22.674  -61.599 15.329  1.000 45.671 0 67  ARG FFF NH1 1 ? 17 
ATOM   4560 N NH2 . ARG D 2 69  ? 20.462  -61.793 14.809  1.000 45.142 0 67  ARG FFF NH2 1 ? 17 
ATOM   4561 N N   . PHE D 2 70  ? 21.103  -55.454 14.827  1.000 41.972 0 68  PHE FFF N   1 ? 17 
ATOM   4562 C CA  . PHE D 2 70  ? 21.186  -54.811 13.494  1.000 40.778 0 68  PHE FFF CA  1 ? 17 
ATOM   4563 C C   . PHE D 2 70  ? 20.648  -53.385 13.597  1.000 40.968 0 68  PHE FFF C   1 ? 17 
ATOM   4564 O O   . PHE D 2 70  ? 19.652  -53.136 14.310  1.000 41.681 0 68  PHE FFF O   1 ? 17 
ATOM   4565 C CB  . PHE D 2 70  ? 20.427  -55.611 12.433  1.000 39.130 0 68  PHE FFF CB  1 ? 17 
ATOM   4566 C CG  . PHE D 2 70  ? 20.967  -56.983 12.110  1.000 39.153 0 68  PHE FFF CG  1 ? 17 
ATOM   4567 C CD1 . PHE D 2 70  ? 21.968  -57.587 12.861  1.000 41.195 0 68  PHE FFF CD1 1 ? 17 
ATOM   4568 C CD2 . PHE D 2 70  ? 20.415  -57.702 11.065  1.000 39.569 0 68  PHE FFF CD2 1 ? 17 
ATOM   4569 C CE1 . PHE D 2 70  ? 22.408  -58.870 12.566  1.000 41.641 0 68  PHE FFF CE1 1 ? 17 
ATOM   4570 C CE2 . PHE D 2 70  ? 20.854  -58.985 10.772  1.000 39.994 0 68  PHE FFF CE2 1 ? 17 
ATOM   4571 C CZ  . PHE D 2 70  ? 21.855  -59.562 11.516  1.000 39.393 0 68  PHE FFF CZ  1 ? 17 
ATOM   4572 N N   . THR D 2 71  ? 21.298  -52.466 12.883  1.000 39.650 0 69  THR FFF N   1 ? 17 
ATOM   4573 C CA  A THR D 2 71  ? 20.867  -51.048 12.771  0.500 39.234 0 69  THR FFF CA  1 ? 17 
ATOM   4574 C CA  B THR D 2 71  ? 20.862  -51.050 12.767  0.500 38.658 0 69  THR FFF CA  1 ? 17 
ATOM   4575 C C   . THR D 2 71  ? 20.859  -50.661 11.293  1.000 35.674 0 69  THR FFF C   1 ? 17 
ATOM   4576 O O   . THR D 2 71  ? 21.907  -50.840 10.653  1.000 35.505 0 69  THR FFF O   1 ? 17 
ATOM   4577 C CB  A THR D 2 71  ? 21.747  -50.120 13.616  0.500 40.776 0 69  THR FFF CB  1 ? 17 
ATOM   4578 C CB  B THR D 2 71  ? 21.768  -50.103 13.557  0.500 39.381 0 69  THR FFF CB  1 ? 17 
ATOM   4579 O OG1 A THR D 2 71  ? 23.115  -50.362 13.288  0.500 41.807 0 69  THR FFF OG1 1 ? 17 
ATOM   4580 O OG1 B THR D 2 71  ? 21.866  -50.635 14.878  0.500 41.797 0 69  THR FFF OG1 1 ? 17 
ATOM   4581 C CG2 A THR D 2 71  ? 21.542  -50.321 15.101  0.500 43.500 0 69  THR FFF CG2 1 ? 17 
ATOM   4582 C CG2 B THR D 2 71  ? 21.248  -48.682 13.579  0.500 38.980 0 69  THR FFF CG2 1 ? 17 
ATOM   4583 N N   . ILE D 2 72  ? 19.713  -50.190 10.809  1.000 35.101 0 70  ILE FFF N   1 ? 17 
ATOM   4584 C CA  . ILE D 2 72  ? 19.578  -49.650 9.429   1.000 33.026 0 70  ILE FFF CA  1 ? 17 
ATOM   4585 C C   . ILE D 2 72  ? 19.629  -48.125 9.512   1.000 34.627 0 70  ILE FFF C   1 ? 17 
ATOM   4586 O O   . ILE D 2 72  ? 19.100  -47.542 10.479  1.000 36.813 0 70  ILE FFF O   1 ? 17 
ATOM   4587 C CB  . ILE D 2 72  ? 18.296  -50.146 8.742   1.000 31.363 0 70  ILE FFF CB  1 ? 17 
ATOM   4588 C CG1 . ILE D 2 72  ? 18.380  -49.919 7.229   1.000 29.759 0 70  ILE FFF CG1 1 ? 17 
ATOM   4589 C CG2 . ILE D 2 72  ? 17.051  -49.510 9.360   1.000 30.676 0 70  ILE FFF CG2 1 ? 17 
ATOM   4590 C CD1 . ILE D 2 72  ? 17.199  -50.467 6.468   1.000 29.621 0 70  ILE FFF CD1 1 ? 17 
ATOM   4591 N N   . SER D 2 73  ? 20.234  -47.492 8.515   1.000 34.162 0 71  SER FFF N   1 ? 17 
ATOM   4592 C CA  . SER D 2 73  ? 20.338  -46.016 8.422   1.000 33.944 0 71  SER FFF CA  1 ? 17 
ATOM   4593 C C   . SER D 2 73  ? 20.366  -45.643 6.945   1.000 34.074 0 71  SER FFF C   1 ? 17 
ATOM   4594 O O   . SER D 2 73  ? 20.761  -46.501 6.129   1.000 32.644 0 71  SER FFF O   1 ? 17 
ATOM   4595 C CB  . SER D 2 73  ? 21.538  -45.479 9.161   1.000 35.615 0 71  SER FFF CB  1 ? 17 
ATOM   4596 O OG  . SER D 2 73  ? 22.749  -46.092 8.734   1.000 37.093 0 71  SER FFF OG  1 ? 17 
ATOM   4597 N N   . SER D 2 74  ? 19.893  -44.437 6.636   1.000 31.802 0 72  SER FFF N   1 ? 17 
ATOM   4598 C CA  . SER D 2 74  ? 19.896  -43.880 5.264   1.000 31.408 0 72  SER FFF CA  1 ? 17 
ATOM   4599 C C   . SER D 2 74  ? 20.751  -42.620 5.254   1.000 29.750 0 72  SER FFF C   1 ? 17 
ATOM   4600 O O   . SER D 2 74  ? 20.768  -41.890 6.262   1.000 31.579 0 72  SER FFF O   1 ? 17 
ATOM   4601 C CB  . SER D 2 74  ? 18.522  -43.602 4.770   1.000 32.880 0 72  SER FFF CB  1 ? 17 
ATOM   4602 O OG  . SER D 2 74  ? 18.578  -43.126 3.438   1.000 36.041 0 72  SER FFF OG  1 ? 17 
ATOM   4603 N N   . ASN D 2 75  ? 21.501  -42.440 4.176   1.000 27.239 0 73  ASN FFF N   1 ? 17 
ATOM   4604 C CA  . ASN D 2 75  ? 22.099  -41.143 3.796   1.000 27.155 0 73  ASN FFF CA  1 ? 17 
ATOM   4605 C C   . ASN D 2 75  ? 21.411  -40.766 2.495   1.000 24.932 0 73  ASN FFF C   1 ? 17 
ATOM   4606 O O   . ASN D 2 75  ? 21.858  -41.229 1.427   1.000 23.994 0 73  ASN FFF O   1 ? 17 
ATOM   4607 C CB  . ASN D 2 75  ? 23.621  -41.217 3.676   1.000 30.108 0 73  ASN FFF CB  1 ? 17 
ATOM   4608 C CG  . ASN D 2 75  ? 24.249  -39.875 3.373   1.000 33.724 0 73  ASN FFF CG  1 ? 17 
ATOM   4609 O OD1 . ASN D 2 75  ? 23.746  -39.095 2.552   1.000 34.365 0 73  ASN FFF OD1 1 ? 17 
ATOM   4610 N ND2 . ASN D 2 75  ? 25.358  -39.589 4.033   1.000 38.414 0 73  ASN FFF ND2 1 ? 17 
ATOM   4611 N N   . ASN D 2 76  ? 20.315  -40.014 2.578   1.000 23.254 0 74  ASN FFF N   1 ? 17 
ATOM   4612 C CA  . ASN D 2 76  ? 19.506  -39.710 1.379   1.000 21.834 0 74  ASN FFF CA  1 ? 17 
ATOM   4613 C C   . ASN D 2 76  ? 20.402  -39.017 0.345   1.000 22.283 0 74  ASN FFF C   1 ? 17 
ATOM   4614 O O   . ASN D 2 76  ? 20.302  -39.363 -0.828  1.000 22.272 0 74  ASN FFF O   1 ? 17 
ATOM   4615 C CB  . ASN D 2 76  ? 18.284  -38.862 1.724   1.000 21.340 0 74  ASN FFF CB  1 ? 17 
ATOM   4616 C CG  . ASN D 2 76  ? 17.150  -39.659 2.327   1.000 20.859 0 74  ASN FFF CG  1 ? 17 
ATOM   4617 O OD1 . ASN D 2 76  ? 17.243  -40.871 2.551   1.000 20.718 0 74  ASN FFF OD1 1 ? 17 
ATOM   4618 N ND2 . ASN D 2 76  ? 16.068  -38.958 2.636   1.000 20.747 0 74  ASN FFF ND2 1 ? 17 
ATOM   4619 N N   . ALA D 2 77  ? 21.238  -38.065 0.773   1.000 22.595 0 75  ALA FFF N   1 ? 17 
ATOM   4620 C CA  . ALA D 2 77  ? 22.116  -37.263 -0.119  1.000 24.728 0 75  ALA FFF CA  1 ? 17 
ATOM   4621 C C   . ALA D 2 77  ? 23.026  -38.176 -0.947  1.000 25.452 0 75  ALA FFF C   1 ? 17 
ATOM   4622 O O   . ALA D 2 77  ? 23.253  -37.834 -2.126  1.000 26.431 0 75  ALA FFF O   1 ? 17 
ATOM   4623 C CB  . ALA D 2 77  ? 22.939  -36.279 0.682   1.000 25.550 0 75  ALA FFF CB  1 ? 17 
ATOM   4624 N N   . MET D 2 78  ? 23.481  -39.292 -0.370  1.000 27.128 0 76  MET FFF N   1 ? 17 
ATOM   4625 C CA  A MET D 2 78  ? 24.442  -40.220 -1.027  0.500 28.595 0 76  MET FFF CA  1 ? 17 
ATOM   4626 C CA  B MET D 2 78  ? 24.449  -40.233 -1.004  0.500 28.581 0 76  MET FFF CA  1 ? 17 
ATOM   4627 C C   . MET D 2 78  ? 23.691  -41.418 -1.616  1.000 27.205 0 76  MET FFF C   1 ? 17 
ATOM   4628 O O   . MET D 2 78  ? 24.347  -42.301 -2.204  1.000 26.024 0 76  MET FFF O   1 ? 17 
ATOM   4629 C CB  A MET D 2 78  ? 25.498  -40.680 -0.019  0.500 32.170 0 76  MET FFF CB  1 ? 17 
ATOM   4630 C CB  B MET D 2 78  ? 25.485  -40.729 0.017   0.500 32.089 0 76  MET FFF CB  1 ? 17 
ATOM   4631 C CG  A MET D 2 78  ? 26.338  -39.521 0.486   0.500 35.090 0 76  MET FFF CG  1 ? 17 
ATOM   4632 C CG  B MET D 2 78  ? 26.710  -39.830 0.107   0.500 35.517 0 76  MET FFF CG  1 ? 17 
ATOM   4633 S SD  A MET D 2 78  ? 27.478  -38.927 -0.790  0.500 41.132 0 76  MET FFF SD  1 ? 17 
ATOM   4634 S SD  B MET D 2 78  ? 27.611  -39.887 1.693   0.500 39.840 0 76  MET FFF SD  1 ? 17 
ATOM   4635 C CE  A MET D 2 78  ? 28.847  -40.051 -0.515  0.500 40.953 0 76  MET FFF CE  1 ? 17 
ATOM   4636 C CE  B MET D 2 78  ? 27.817  -41.648 1.940   0.500 39.011 0 76  MET FFF CE  1 ? 17 
ATOM   4637 N N   . ASN D 2 79  ? 22.363  -41.432 -1.491  1.000 25.116 0 77  ASN FFF N   1 ? 17 
ATOM   4638 C CA  . ASN D 2 79  ? 21.526  -42.498 -2.093  1.000 25.087 0 77  ASN FFF CA  1 ? 17 
ATOM   4639 C C   . ASN D 2 79  ? 21.924  -43.876 -1.559  1.000 25.493 0 77  ASN FFF C   1 ? 17 
ATOM   4640 O O   . ASN D 2 79  ? 21.795  -44.878 -2.306  1.000 23.785 0 77  ASN FFF O   1 ? 17 
ATOM   4641 C CB  . ASN D 2 79  ? 21.647  -42.474 -3.613  1.000 26.998 0 77  ASN FFF CB  1 ? 17 
ATOM   4642 C CG  . ASN D 2 79  ? 20.334  -42.150 -4.271  1.000 28.602 0 77  ASN FFF CG  1 ? 17 
ATOM   4643 O OD1 . ASN D 2 79  ? 19.651  -41.180 -3.897  1.000 27.557 0 77  ASN FFF OD1 1 ? 17 
ATOM   4644 N ND2 . ASN D 2 79  ? 19.997  -42.958 -5.265  1.000 31.057 0 77  ASN FFF ND2 1 ? 17 
ATOM   4645 N N   . THR D 2 80  ? 22.362  -43.947 -0.301  1.000 25.650 0 78  THR FFF N   1 ? 17 
ATOM   4646 C CA  . THR D 2 80  ? 22.970  -45.160 0.275   1.000 26.717 0 78  THR FFF CA  1 ? 17 
ATOM   4647 C C   . THR D 2 80  ? 22.240  -45.512 1.567   1.000 26.967 0 78  THR FFF C   1 ? 17 
ATOM   4648 O O   . THR D 2 80  ? 21.952  -44.592 2.374   1.000 27.950 0 78  THR FFF O   1 ? 17 
ATOM   4649 C CB  . THR D 2 80  ? 24.475  -44.988 0.514   1.000 28.045 0 78  THR FFF CB  1 ? 17 
ATOM   4650 O OG1 . THR D 2 80  ? 25.095  -44.535 -0.696  1.000 28.984 0 78  THR FFF OG1 1 ? 17 
ATOM   4651 C CG2 . THR D 2 80  ? 25.132  -46.271 0.969   1.000 29.176 0 78  THR FFF CG2 1 ? 17 
ATOM   4652 N N   . VAL D 2 81  ? 21.950  -46.793 1.728   1.000 26.971 0 79  VAL FFF N   1 ? 17 
ATOM   4653 C CA  A VAL D 2 81  ? 21.434  -47.348 3.007   0.500 27.574 0 79  VAL FFF CA  1 ? 17 
ATOM   4654 C CA  B VAL D 2 81  ? 21.408  -47.372 2.992   0.500 27.283 0 79  VAL FFF CA  1 ? 17 
ATOM   4655 C C   . VAL D 2 81  ? 22.460  -48.353 3.528   1.000 30.086 0 79  VAL FFF C   1 ? 17 
ATOM   4656 O O   . VAL D 2 81  ? 23.232  -48.937 2.715   1.000 28.818 0 79  VAL FFF O   1 ? 17 
ATOM   4657 C CB  A VAL D 2 81  ? 20.020  -47.927 2.858   0.500 28.377 0 79  VAL FFF CB  1 ? 17 
ATOM   4658 C CB  B VAL D 2 81  ? 20.009  -47.993 2.789   0.500 27.797 0 79  VAL FFF CB  1 ? 17 
ATOM   4659 C CG1 A VAL D 2 81  ? 19.049  -46.841 2.441   0.500 28.588 0 79  VAL FFF CG1 1 ? 17 
ATOM   4660 C CG1 B VAL D 2 81  ? 20.040  -49.222 1.901   0.500 27.832 0 79  VAL FFF CG1 1 ? 17 
ATOM   4661 C CG2 A VAL D 2 81  ? 19.965  -49.091 1.887   0.500 28.239 0 79  VAL FFF CG2 1 ? 17 
ATOM   4662 C CG2 B VAL D 2 81  ? 19.307  -48.322 4.098   0.500 28.054 0 79  VAL FFF CG2 1 ? 17 
ATOM   4663 N N   . TYR D 2 82  ? 22.534  -48.469 4.845   1.000 30.591 0 80  TYR FFF N   1 ? 17 
ATOM   4664 C CA  . TYR D 2 82  ? 23.554  -49.289 5.525   1.000 33.542 0 80  TYR FFF CA  1 ? 17 
ATOM   4665 C C   . TYR D 2 82  ? 22.833  -50.234 6.465   1.000 32.998 0 80  TYR FFF C   1 ? 17 
ATOM   4666 O O   . TYR D 2 82  ? 21.841  -49.807 7.090   1.000 32.185 0 80  TYR FFF O   1 ? 17 
ATOM   4667 C CB  . TYR D 2 82  ? 24.521  -48.428 6.333   1.000 36.248 0 80  TYR FFF CB  1 ? 17 
ATOM   4668 C CG  . TYR D 2 82  ? 25.136  -47.300 5.554   1.000 37.172 0 80  TYR FFF CG  1 ? 17 
ATOM   4669 C CD1 . TYR D 2 82  ? 24.510  -46.067 5.477   1.000 38.191 0 80  TYR FFF CD1 1 ? 17 
ATOM   4670 C CD2 . TYR D 2 82  ? 26.347  -47.465 4.904   1.000 40.103 0 80  TYR FFF CD2 1 ? 17 
ATOM   4671 C CE1 . TYR D 2 82  ? 25.066  -45.021 4.759   1.000 40.823 0 80  TYR FFF CE1 1 ? 17 
ATOM   4672 C CE2 . TYR D 2 82  ? 26.931  -46.424 4.203   1.000 41.533 0 80  TYR FFF CE2 1 ? 17 
ATOM   4673 C CZ  . TYR D 2 82  ? 26.285  -45.199 4.127   1.000 44.190 0 80  TYR FFF CZ  1 ? 17 
ATOM   4674 O OH  . TYR D 2 82  ? 26.823  -44.167 3.418   1.000 45.985 0 80  TYR FFF OH  1 ? 17 
ATOM   4675 N N   . LEU D 2 83  ? 23.313  -51.473 6.526   1.000 32.274 0 81  LEU FFF N   1 ? 17 
ATOM   4676 C CA  . LEU D 2 83  ? 22.895  -52.417 7.582   1.000 32.374 0 81  LEU FFF CA  1 ? 17 
ATOM   4677 C C   . LEU D 2 83  ? 24.123  -52.778 8.408   1.000 32.366 0 81  LEU FFF C   1 ? 17 
ATOM   4678 O O   . LEU D 2 83  ? 25.009  -53.491 7.888   1.000 30.524 0 81  LEU FFF O   1 ? 17 
ATOM   4679 C CB  . LEU D 2 83  ? 22.249  -53.652 6.968   1.000 32.079 0 81  LEU FFF CB  1 ? 17 
ATOM   4680 C CG  . LEU D 2 83  ? 21.577  -54.551 8.000   1.000 34.118 0 81  LEU FFF CG  1 ? 17 
ATOM   4681 C CD1 . LEU D 2 83  ? 20.442  -53.808 8.695   1.000 34.867 0 81  LEU FFF CD1 1 ? 17 
ATOM   4682 C CD2 . LEU D 2 83  ? 21.084  -55.828 7.363   1.000 33.824 0 81  LEU FFF CD2 1 ? 17 
ATOM   4683 N N   . GLN D 2 84  ? 24.177  -52.253 9.628   1.000 34.572 0 82  GLN FFF N   1 ? 17 
ATOM   4684 C CA  . GLN D 2 84  ? 25.220  -52.604 10.623  1.000 37.032 0 82  GLN FFF CA  1 ? 17 
ATOM   4685 C C   . GLN D 2 84  ? 24.776  -53.891 11.326  1.000 37.997 0 82  GLN FFF C   1 ? 17 
ATOM   4686 O O   . GLN D 2 84  ? 23.733  -53.857 12.029  1.000 36.474 0 82  GLN FFF O   1 ? 17 
ATOM   4687 C CB  . GLN D 2 84  ? 25.440  -51.460 11.610  1.000 40.045 0 82  GLN FFF CB  1 ? 17 
ATOM   4688 C CG  . GLN D 2 84  ? 26.554  -51.735 12.612  1.000 45.103 0 82  GLN FFF CG  1 ? 17 
ATOM   4689 C CD  . GLN D 2 84  ? 27.863  -52.055 11.930  1.000 47.915 0 82  GLN FFF CD  1 ? 17 
ATOM   4690 O OE1 . GLN D 2 84  ? 28.162  -51.544 10.854  1.000 49.427 0 82  GLN FFF OE1 1 ? 17 
ATOM   4691 N NE2 . GLN D 2 84  ? 28.661  -52.907 12.556  1.000 51.032 0 82  GLN FFF NE2 1 ? 17 
ATOM   4692 N N   . MET D 2 85  ? 25.528  -54.977 11.122  1.000 38.131 0 83  MET FFF N   1 ? 17 
ATOM   4693 C CA  A MET D 2 85  ? 25.191  -56.307 11.682  0.500 39.674 0 83  MET FFF CA  1 ? 17 
ATOM   4694 C CA  B MET D 2 85  ? 25.209  -56.327 11.653  0.500 38.770 0 83  MET FFF CA  1 ? 17 
ATOM   4695 C C   . MET D 2 85  ? 26.222  -56.669 12.752  1.000 40.980 0 83  MET FFF C   1 ? 17 
ATOM   4696 O O   . MET D 2 85  ? 27.356  -57.045 12.397  1.000 40.870 0 83  MET FFF O   1 ? 17 
ATOM   4697 C CB  A MET D 2 85  ? 25.158  -57.382 10.596  0.500 40.065 0 83  MET FFF CB  1 ? 17 
ATOM   4698 C CB  B MET D 2 85  ? 25.258  -57.372 10.529  0.500 37.917 0 83  MET FFF CB  1 ? 17 
ATOM   4699 C CG  A MET D 2 85  ? 24.138  -57.093 9.522   0.500 39.531 0 83  MET FFF CG  1 ? 17 
ATOM   4700 C CG  B MET D 2 85  ? 24.396  -56.999 9.326   0.500 36.153 0 83  MET FFF CG  1 ? 17 
ATOM   4701 S SD  A MET D 2 85  ? 23.670  -58.562 8.563   0.500 40.435 0 83  MET FFF SD  1 ? 17 
ATOM   4702 S SD  B MET D 2 85  ? 24.671  -58.034 7.850   0.500 34.763 0 83  MET FFF SD  1 ? 17 
ATOM   4703 C CE  A MET D 2 85  ? 25.253  -58.970 7.831   0.500 39.936 0 83  MET FFF CE  1 ? 17 
ATOM   4704 C CE  B MET D 2 85  ? 24.319  -59.667 8.497   0.500 34.997 0 83  MET FFF CE  1 ? 17 
ATOM   4705 N N   . ASN D 2 86  ? 25.817  -56.532 14.012  1.000 42.448 0 84  ASN FFF N   1 ? 17 
ATOM   4706 C CA  . ASN D 2 86  ? 26.677  -56.817 15.189  1.000 45.714 0 84  ASN FFF CA  1 ? 17 
ATOM   4707 C C   . ASN D 2 86  ? 26.256  -58.153 15.800  1.000 45.842 0 84  ASN FFF C   1 ? 17 
ATOM   4708 O O   . ASN D 2 86  ? 25.113  -58.584 15.574  1.000 43.710 0 84  ASN FFF O   1 ? 17 
ATOM   4709 C CB  . ASN D 2 86  ? 26.600  -55.700 16.228  1.000 49.163 0 84  ASN FFF CB  1 ? 17 
ATOM   4710 C CG  . ASN D 2 86  ? 27.201  -54.399 15.743  1.000 52.450 0 84  ASN FFF CG  1 ? 17 
ATOM   4711 O OD1 . ASN D 2 86  ? 28.067  -54.392 14.866  1.000 53.907 0 84  ASN FFF OD1 1 ? 17 
ATOM   4712 N ND2 . ASN D 2 86  ? 26.768  -53.298 16.331  1.000 53.079 0 84  ASN FFF ND2 1 ? 17 
ATOM   4713 N N   . SER D 2 87  ? 27.162  -58.778 16.544  1.000 47.297 0 85  SER FFF N   1 ? 17 
ATOM   4714 C CA  . SER D 2 87  ? 26.865  -59.955 17.397  1.000 50.108 0 85  SER FFF CA  1 ? 17 
ATOM   4715 C C   . SER D 2 87  ? 26.258  -61.056 16.523  1.000 48.447 0 85  SER FFF C   1 ? 17 
ATOM   4716 O O   . SER D 2 87  ? 25.218  -61.640 16.909  1.000 47.469 0 85  SER FFF O   1 ? 17 
ATOM   4717 C CB  . SER D 2 87  ? 25.961  -59.543 18.518  1.000 52.344 0 85  SER FFF CB  1 ? 17 
ATOM   4718 O OG  . SER D 2 87  ? 26.574  -58.504 19.273  1.000 53.054 0 85  SER FFF OG  1 ? 17 
ATOM   4719 N N   . LEU D 2 88  ? 26.881  -61.291 15.366  1.000 46.468 0 86  LEU FFF N   1 ? 17 
ATOM   4720 C CA  . LEU D 2 88  ? 26.397  -62.253 14.346  1.000 44.502 0 86  LEU FFF CA  1 ? 17 
ATOM   4721 C C   . LEU D 2 88  ? 26.458  -63.675 14.912  1.000 44.934 0 86  LEU FFF C   1 ? 17 
ATOM   4722 O O   . LEU D 2 88  ? 27.379  -63.983 15.715  1.000 46.816 0 86  LEU FFF O   1 ? 17 
ATOM   4723 C CB  . LEU D 2 88  ? 27.226  -62.101 13.067  1.000 43.043 0 86  LEU FFF CB  1 ? 17 
ATOM   4724 C CG  . LEU D 2 88  ? 26.827  -60.906 12.196  1.000 41.450 0 86  LEU FFF CG  1 ? 17 
ATOM   4725 C CD1 . LEU D 2 88  ? 27.894  -60.602 11.149  1.000 40.624 0 86  LEU FFF CD1 1 ? 17 
ATOM   4726 C CD2 . LEU D 2 88  ? 25.474  -61.151 11.542  1.000 39.980 0 86  LEU FFF CD2 1 ? 17 
ATOM   4727 N N   . LYS D 2 89  ? 25.484  -64.490 14.514  1.000 44.775 0 87  LYS FFF N   1 ? 17 
ATOM   4728 C CA  . LYS D 2 89  ? 25.292  -65.894 14.954  1.000 47.852 0 87  LYS FFF CA  1 ? 17 
ATOM   4729 C C   . LYS D 2 89  ? 25.329  -66.777 13.710  1.000 44.924 0 87  LYS FFF C   1 ? 17 
ATOM   4730 O O   . LYS D 2 89  ? 25.062  -66.306 12.607  1.000 42.498 0 87  LYS FFF O   1 ? 17 
ATOM   4731 C CB  . LYS D 2 89  ? 23.976  -66.001 15.731  1.000 50.919 0 87  LYS FFF CB  1 ? 17 
ATOM   4732 C CG  . LYS D 2 89  ? 23.802  -64.950 16.819  1.000 55.453 0 87  LYS FFF CG  1 ? 17 
ATOM   4733 C CD  . LYS D 2 89  ? 22.415  -64.870 17.425  1.000 58.553 0 87  LYS FFF CD  1 ? 17 
ATOM   4734 C CE  . LYS D 2 89  ? 22.400  -65.235 18.895  1.000 65.365 0 87  LYS FFF CE  1 ? 17 
ATOM   4735 N NZ  . LYS D 2 89  ? 21.243  -64.640 19.607  1.000 67.498 0 87  LYS FFF NZ  1 ? 17 
ATOM   4736 N N   . PRO D 2 90  ? 25.686  -68.073 13.832  1.000 45.132 0 88  PRO FFF N   1 ? 17 
ATOM   4737 C CA  . PRO D 2 90  ? 25.666  -68.983 12.683  1.000 42.922 0 88  PRO FFF CA  1 ? 17 
ATOM   4738 C C   . PRO D 2 90  ? 24.317  -68.945 11.948  1.000 40.835 0 88  PRO FFF C   1 ? 17 
ATOM   4739 O O   . PRO D 2 90  ? 24.316  -68.975 10.719  1.000 38.489 0 88  PRO FFF O   1 ? 17 
ATOM   4740 C CB  . PRO D 2 90  ? 25.932  -70.349 13.330  1.000 44.748 0 88  PRO FFF CB  1 ? 17 
ATOM   4741 C CG  . PRO D 2 90  ? 26.750  -70.018 14.558  1.000 46.276 0 88  PRO FFF CG  1 ? 17 
ATOM   4742 C CD  . PRO D 2 90  ? 26.152  -68.727 15.068  1.000 46.662 0 88  PRO FFF CD  1 ? 17 
ATOM   4743 N N   . GLU D 2 91  ? 23.222  -68.809 12.705  1.000 41.439 0 89  GLU FFF N   1 ? 17 
ATOM   4744 C CA  . GLU D 2 91  ? 21.825  -68.753 12.190  1.000 42.664 0 89  GLU FFF CA  1 ? 17 
ATOM   4745 C C   . GLU D 2 91  ? 21.587  -67.495 11.334  1.000 39.848 0 89  GLU FFF C   1 ? 17 
ATOM   4746 O O   . GLU D 2 91  ? 20.560  -67.467 10.642  1.000 38.397 0 89  GLU FFF O   1 ? 17 
ATOM   4747 C CB  . GLU D 2 91  ? 20.825  -68.815 13.351  1.000 45.999 0 89  GLU FFF CB  1 ? 17 
ATOM   4748 C CG  . GLU D 2 91  ? 20.916  -70.094 14.163  1.000 52.385 0 89  GLU FFF CG  1 ? 17 
ATOM   4749 C CD  . GLU D 2 91  ? 21.816  -70.058 15.391  1.000 55.480 0 89  GLU FFF CD  1 ? 17 
ATOM   4750 O OE1 . GLU D 2 91  ? 22.720  -69.203 15.452  1.000 55.370 0 89  GLU FFF OE1 1 ? 17 
ATOM   4751 O OE2 . GLU D 2 91  ? 21.623  -70.900 16.269  1.000 61.287 0 89  GLU FFF OE2 1 ? 17 
ATOM   4752 N N   . ASP D 2 92  ? 22.489  -66.506 11.365  1.000 38.875 0 90  ASP FFF N   1 ? 17 
ATOM   4753 C CA  . ASP D 2 92  ? 22.413  -65.286 10.518  1.000 37.126 0 90  ASP FFF CA  1 ? 17 
ATOM   4754 C C   . ASP D 2 92  ? 22.994  -65.578 9.135   1.000 35.063 0 90  ASP FFF C   1 ? 17 
ATOM   4755 O O   . ASP D 2 92  ? 22.888  -64.692 8.272   1.000 35.020 0 90  ASP FFF O   1 ? 17 
ATOM   4756 C CB  . ASP D 2 92  ? 23.135  -64.093 11.144  1.000 38.120 0 90  ASP FFF CB  1 ? 17 
ATOM   4757 C CG  . ASP D 2 92  ? 22.470  -63.579 12.403  1.000 39.879 0 90  ASP FFF CG  1 ? 17 
ATOM   4758 O OD1 . ASP D 2 92  ? 21.221  -63.490 12.425  1.000 40.363 0 90  ASP FFF OD1 1 ? 17 
ATOM   4759 O OD2 . ASP D 2 92  ? 23.208  -63.282 13.356  1.000 43.816 0 90  ASP FFF OD2 1 ? 17 
ATOM   4760 N N   . THR D 2 93  ? 23.587  -66.758 8.929   1.000 33.372 0 91  THR FFF N   1 ? 17 
ATOM   4761 C CA  . THR D 2 93  ? 24.115  -67.187 7.608   1.000 32.381 0 91  THR FFF CA  1 ? 17 
ATOM   4762 C C   . THR D 2 93  ? 22.957  -67.201 6.614   1.000 30.668 0 91  THR FFF C   1 ? 17 
ATOM   4763 O O   . THR D 2 93  ? 21.967  -67.884 6.883   1.000 30.677 0 91  THR FFF O   1 ? 17 
ATOM   4764 C CB  . THR D 2 93  ? 24.801  -68.556 7.658   1.000 32.665 0 91  THR FFF CB  1 ? 17 
ATOM   4765 O OG1 . THR D 2 93  ? 25.914  -68.443 8.543   1.000 34.204 0 91  THR FFF OG1 1 ? 17 
ATOM   4766 C CG2 . THR D 2 93  ? 25.252  -69.017 6.287   1.000 31.747 0 91  THR FFF CG2 1 ? 17 
ATOM   4767 N N   . ALA D 2 94  ? 23.086  -66.450 5.521   1.000 29.362 0 92  ALA FFF N   1 ? 17 
ATOM   4768 C CA  . ALA D 2 94  ? 22.006  -66.230 4.538   1.000 28.732 0 92  ALA FFF CA  1 ? 17 
ATOM   4769 C C   . ALA D 2 94  ? 22.535  -65.398 3.378   1.000 27.443 0 92  ALA FFF C   1 ? 17 
ATOM   4770 O O   . ALA D 2 94  ? 23.602  -64.756 3.516   1.000 27.852 0 92  ALA FFF O   1 ? 17 
ATOM   4771 C CB  . ALA D 2 94  ? 20.832  -65.536 5.195   1.000 28.483 0 92  ALA FFF CB  1 ? 17 
ATOM   4772 N N   . VAL D 2 95  ? 21.789  -65.381 2.279   1.000 26.891 0 93  VAL FFF N   1 ? 17 
ATOM   4773 C CA  . VAL D 2 95  ? 21.952  -64.338 1.238   1.000 27.343 0 93  VAL FFF CA  1 ? 17 
ATOM   4774 C C   . VAL D 2 95  ? 21.121  -63.142 1.706   1.000 26.858 0 93  VAL FFF C   1 ? 17 
ATOM   4775 O O   . VAL D 2 95  ? 19.926  -63.339 2.010   1.000 26.252 0 93  VAL FFF O   1 ? 17 
ATOM   4776 C CB  . VAL D 2 95  ? 21.530  -64.818 -0.158  1.000 27.926 0 93  VAL FFF CB  1 ? 17 
ATOM   4777 C CG1 . VAL D 2 95  ? 21.727  -63.720 -1.188  1.000 28.138 0 93  VAL FFF CG1 1 ? 17 
ATOM   4778 C CG2 . VAL D 2 95  ? 22.260  -66.083 -0.575  1.000 29.460 0 93  VAL FFF CG2 1 ? 17 
ATOM   4779 N N   . TYR D 2 96  ? 21.749  -61.975 1.782   1.000 25.662 0 94  TYR FFF N   1 ? 17 
ATOM   4780 C CA  . TYR D 2 96  ? 21.089  -60.696 2.148   1.000 26.213 0 94  TYR FFF CA  1 ? 17 
ATOM   4781 C C   . TYR D 2 96  ? 20.834  -59.926 0.859   1.000 26.524 0 94  TYR FFF C   1 ? 17 
ATOM   4782 O O   . TYR D 2 96  ? 21.762  -59.811 0.046   1.000 27.904 0 94  TYR FFF O   1 ? 17 
ATOM   4783 C CB  . TYR D 2 96  ? 21.917  -59.938 3.180   1.000 25.221 0 94  TYR FFF CB  1 ? 17 
ATOM   4784 C CG  . TYR D 2 96  ? 21.875  -60.562 4.547   1.000 26.319 0 94  TYR FFF CG  1 ? 17 
ATOM   4785 C CD1 . TYR D 2 96  ? 22.537  -61.753 4.808   1.000 26.323 0 94  TYR FFF CD1 1 ? 17 
ATOM   4786 C CD2 . TYR D 2 96  ? 21.177  -59.963 5.582   1.000 26.245 0 94  TYR FFF CD2 1 ? 17 
ATOM   4787 C CE1 . TYR D 2 96  ? 22.488  -62.335 6.060   1.000 27.523 0 94  TYR FFF CE1 1 ? 17 
ATOM   4788 C CE2 . TYR D 2 96  ? 21.130  -60.525 6.842   1.000 27.291 0 94  TYR FFF CE2 1 ? 17 
ATOM   4789 C CZ  . TYR D 2 96  ? 21.777  -61.726 7.078   1.000 27.913 0 94  TYR FFF CZ  1 ? 17 
ATOM   4790 O OH  . TYR D 2 96  ? 21.735  -62.303 8.313   1.000 29.756 0 94  TYR FFF OH  1 ? 17 
ATOM   4791 N N   . PHE D 2 97  ? 19.590  -59.480 0.659   1.000 26.222 0 95  PHE FFF N   1 ? 17 
ATOM   4792 C CA  . PHE D 2 97  ? 19.137  -58.737 -0.533  1.000 25.450 0 95  PHE FFF CA  1 ? 17 
ATOM   4793 C C   . PHE D 2 97  ? 18.717  -57.330 -0.109  1.000 25.240 0 95  PHE FFF C   1 ? 17 
ATOM   4794 O O   . PHE D 2 97  ? 17.888  -57.203 0.803   1.000 25.194 0 95  PHE FFF O   1 ? 17 
ATOM   4795 C CB  . PHE D 2 97  ? 17.943  -59.410 -1.202  1.000 25.445 0 95  PHE FFF CB  1 ? 17 
ATOM   4796 C CG  . PHE D 2 97  ? 18.151  -60.851 -1.594  1.000 26.339 0 95  PHE FFF CG  1 ? 17 
ATOM   4797 C CD1 . PHE D 2 97  ? 17.884  -61.863 -0.687  1.000 27.554 0 95  PHE FFF CD1 1 ? 17 
ATOM   4798 C CD2 . PHE D 2 97  ? 18.582  -61.188 -2.870  1.000 27.711 0 95  PHE FFF CD2 1 ? 17 
ATOM   4799 C CE1 . PHE D 2 97  ? 18.074  -63.189 -1.040  1.000 28.116 0 95  PHE FFF CE1 1 ? 17 
ATOM   4800 C CE2 . PHE D 2 97  ? 18.756  -62.521 -3.226  1.000 28.126 0 95  PHE FFF CE2 1 ? 17 
ATOM   4801 C CZ  . PHE D 2 97  ? 18.493  -63.511 -2.312  1.000 28.714 0 95  PHE FFF CZ  1 ? 17 
ATOM   4802 N N   . CYS D 2 98  ? 19.289  -56.320 -0.755  1.000 24.287 0 96  CYS FFF N   1 ? 17 
ATOM   4803 C CA  . CYS D 2 98  ? 18.744  -54.947 -0.738  1.000 24.345 0 96  CYS FFF CA  1 ? 17 
ATOM   4804 C C   . CYS D 2 98  ? 17.451  -54.988 -1.537  1.000 24.003 0 96  CYS FFF C   1 ? 17 
ATOM   4805 O O   . CYS D 2 98  ? 17.416  -55.693 -2.554  1.000 24.161 0 96  CYS FFF O   1 ? 17 
ATOM   4806 C CB  . CYS D 2 98  ? 19.723  -53.949 -1.338  1.000 24.774 0 96  CYS FFF CB  1 ? 17 
ATOM   4807 S SG  . CYS D 2 98  ? 19.147  -52.241 -1.206  1.000 28.298 0 96  CYS FFF SG  1 ? 17 
ATOM   4808 N N   . ALA D 2 99  ? 16.416  -54.292 -1.070  1.000 23.184 0 97  ALA FFF N   1 ? 17 
ATOM   4809 C CA  . ALA D 2 99  ? 15.100  -54.259 -1.738  1.000 23.176 0 97  ALA FFF CA  1 ? 17 
ATOM   4810 C C   . ALA D 2 99  ? 14.497  -52.864 -1.589  1.000 22.009 0 97  ALA FFF C   1 ? 17 
ATOM   4811 O O   . ALA D 2 99  ? 14.521  -52.318 -0.483  1.000 22.857 0 97  ALA FFF O   1 ? 17 
ATOM   4812 C CB  . ALA D 2 99  ? 14.189  -55.307 -1.185  1.000 24.474 0 97  ALA FFF CB  1 ? 17 
ATOM   4813 N N   . LEU D 2 100 ? 14.012  -52.335 -2.696  1.000 21.646 0 98  LEU FFF N   1 ? 17 
ATOM   4814 C CA  . LEU D 2 100 ? 13.481  -50.960 -2.802  1.000 21.326 0 98  LEU FFF CA  1 ? 17 
ATOM   4815 C C   . LEU D 2 100 ? 12.012  -51.049 -3.216  1.000 21.340 0 98  LEU FFF C   1 ? 17 
ATOM   4816 O O   . LEU D 2 100 ? 11.698  -51.729 -4.213  1.000 21.666 0 98  LEU FFF O   1 ? 17 
ATOM   4817 C CB  . LEU D 2 100 ? 14.305  -50.199 -3.840  1.000 21.872 0 98  LEU FFF CB  1 ? 17 
ATOM   4818 C CG  . LEU D 2 100 ? 13.796  -48.809 -4.211  1.000 21.786 0 98  LEU FFF CG  1 ? 17 
ATOM   4819 C CD1 . LEU D 2 100 ? 13.851  -47.877 -3.023  1.000 21.833 0 98  LEU FFF CD1 1 ? 17 
ATOM   4820 C CD2 . LEU D 2 100 ? 14.603  -48.250 -5.376  1.000 22.925 0 98  LEU FFF CD2 1 ? 17 
ATOM   4821 N N   . GLY D 2 101 ? 11.145  -50.349 -2.487  1.000 20.625 0 99  GLY FFF N   1 ? 17 
ATOM   4822 C CA  . GLY D 2 101 ? 9.723   -50.220 -2.839  1.000 21.082 0 99  GLY FFF CA  1 ? 17 
ATOM   4823 C C   . GLY D 2 101 ? 9.507   -49.152 -3.900  1.000 21.198 0 99  GLY FFF C   1 ? 17 
ATOM   4824 O O   . GLY D 2 101 ? 10.449  -48.359 -4.169  1.000 21.655 0 99  GLY FFF O   1 ? 17 
ATOM   4825 N N   . VAL D 2 102 ? 8.302   -49.120 -4.456  1.000 22.069 0 100 VAL FFF N   1 ? 17 
ATOM   4826 C CA  . VAL D 2 102 ? 7.802   -48.016 -5.320  1.000 22.449 0 100 VAL FFF CA  1 ? 17 
ATOM   4827 C C   . VAL D 2 102 ? 6.776   -47.191 -4.526  1.000 22.859 0 100 VAL FFF C   1 ? 17 
ATOM   4828 O O   . VAL D 2 102 ? 6.147   -46.321 -5.127  1.000 21.307 0 100 VAL FFF O   1 ? 17 
ATOM   4829 C CB  . VAL D 2 102 ? 7.236   -48.547 -6.648  1.000 23.786 0 100 VAL FFF CB  1 ? 17 
ATOM   4830 C CG1 . VAL D 2 102 ? 8.351   -49.098 -7.513  1.000 23.978 0 100 VAL FFF CG1 1 ? 17 
ATOM   4831 C CG2 . VAL D 2 102 ? 6.130   -49.578 -6.480  1.000 24.519 0 100 VAL FFF CG2 1 ? 17 
ATOM   4832 N N   . THR D 2 103 ? 6.665   -47.409 -3.208  1.000 22.398 0 101 THR FFF N   1 ? 17 
ATOM   4833 C CA  . THR D 2 103 ? 5.863   -46.554 -2.298  1.000 23.613 0 101 THR FFF CA  1 ? 17 
ATOM   4834 C C   . THR D 2 103 ? 6.713   -46.122 -1.101  1.000 22.959 0 101 THR FFF C   1 ? 17 
ATOM   4835 O O   . THR D 2 103 ? 7.873   -46.562 -0.982  1.000 22.798 0 101 THR FFF O   1 ? 17 
ATOM   4836 C CB  . THR D 2 103 ? 4.582   -47.263 -1.833  1.000 24.847 0 101 THR FFF CB  1 ? 17 
ATOM   4837 O OG1 . THR D 2 103 ? 4.913   -48.177 -0.792  1.000 25.643 0 101 THR FFF OG1 1 ? 17 
ATOM   4838 C CG2 . THR D 2 103 ? 3.876   -47.994 -2.955  1.000 26.476 0 101 THR FFF CG2 1 ? 17 
ATOM   4839 N N   . ALA D 2 104 ? 6.148   -45.263 -0.251  1.000 22.220 0 102 ALA FFF N   1 ? 17 
ATOM   4840 C CA  . ALA D 2 104 ? 6.811   -44.777 0.973   1.000 22.441 0 102 ALA FFF CA  1 ? 17 
ATOM   4841 C C   . ALA D 2 104 ? 6.729   -45.816 2.095   1.000 22.925 0 102 ALA FFF C   1 ? 17 
ATOM   4842 O O   . ALA D 2 104 ? 7.469   -45.643 3.087   1.000 23.703 0 102 ALA FFF O   1 ? 17 
ATOM   4843 C CB  . ALA D 2 104 ? 6.189   -43.468 1.379   1.000 21.913 0 102 ALA FFF CB  1 ? 17 
ATOM   4844 N N   . ALA D 2 105 ? 5.870   -46.834 1.993   1.000 23.854 0 103 ALA FFF N   1 ? 17 
ATOM   4845 C CA  . ALA D 2 105 ? 5.543   -47.728 3.129   1.000 25.043 0 103 ALA FFF CA  1 ? 17 
ATOM   4846 C C   . ALA D 2 105 ? 6.469   -48.946 3.158   1.000 25.315 0 103 ALA FFF C   1 ? 17 
ATOM   4847 O O   . ALA D 2 105 ? 6.564   -49.661 2.143   1.000 24.619 0 103 ALA FFF O   1 ? 17 
ATOM   4848 C CB  . ALA D 2 105 ? 4.094   -48.133 3.077   1.000 26.793 0 103 ALA FFF CB  1 ? 17 
ATOM   4849 N N   . CYS D 2 106 ? 7.116   -49.177 4.306   1.000 26.838 0 104 CYS FFF N   1 ? 17 
ATOM   4850 C CA  . CYS D 2 106 ? 7.963   -50.368 4.573   1.000 27.775 0 104 CYS FFF CA  1 ? 17 
ATOM   4851 C C   . CYS D 2 106 ? 7.084   -51.623 4.625   1.000 29.140 0 104 CYS FFF C   1 ? 17 
ATOM   4852 O O   . CYS D 2 106 ? 7.593   -52.703 4.347   1.000 31.280 0 104 CYS FFF O   1 ? 17 
ATOM   4853 C CB  . CYS D 2 106 ? 8.773   -50.196 5.858   1.000 29.207 0 104 CYS FFF CB  1 ? 17 
ATOM   4854 S SG  . CYS D 2 106 ? 10.322  -49.288 5.599   1.000 30.725 0 104 CYS FFF SG  1 ? 17 
ATOM   4855 N N   . SER D 2 107 ? 5.799   -51.478 4.933   1.000 29.559 0 105 SER FFF N   1 ? 17 
ATOM   4856 C CA  . SER D 2 107 ? 4.829   -52.592 5.027   1.000 31.140 0 105 SER FFF CA  1 ? 17 
ATOM   4857 C C   . SER D 2 107 ? 4.432   -53.088 3.627   1.000 31.524 0 105 SER FFF C   1 ? 17 
ATOM   4858 O O   . SER D 2 107 ? 3.885   -54.198 3.536   1.000 31.576 0 105 SER FFF O   1 ? 17 
ATOM   4859 C CB  . SER D 2 107 ? 3.636   -52.179 5.840   1.000 32.358 0 105 SER FFF CB  1 ? 17 
ATOM   4860 O OG  . SER D 2 107 ? 3.050   -51.000 5.314   1.000 32.410 0 105 SER FFF OG  1 ? 17 
ATOM   4861 N N   . ASP D 2 108 ? 4.696   -52.318 2.567   1.000 30.295 0 106 ASP FFF N   1 ? 17 
ATOM   4862 C CA  . ASP D 2 108 ? 4.399   -52.756 1.175   1.000 31.596 0 106 ASP FFF CA  1 ? 17 
ATOM   4863 C C   . ASP D 2 108 ? 5.468   -53.740 0.686   1.000 32.593 0 106 ASP FFF C   1 ? 17 
ATOM   4864 O O   . ASP D 2 108 ? 6.594   -53.713 1.216   1.000 33.269 0 106 ASP FFF O   1 ? 17 
ATOM   4865 C CB  . ASP D 2 108 ? 4.267   -51.563 0.233   1.000 30.782 0 106 ASP FFF CB  1 ? 17 
ATOM   4866 C CG  . ASP D 2 108 ? 2.969   -50.798 0.428   1.000 31.950 0 106 ASP FFF CG  1 ? 17 
ATOM   4867 O OD1 . ASP D 2 108 ? 2.051   -51.343 1.091   1.000 33.309 0 106 ASP FFF OD1 1 ? 17 
ATOM   4868 O OD2 . ASP D 2 108 ? 2.883   -49.680 -0.082  1.000 31.300 0 106 ASP FFF OD2 1 ? 17 
ATOM   4869 N N   . ASN D 2 109 ? 5.140   -54.562 -0.317  1.000 34.894 0 107 ASN FFF N   1 ? 17 
ATOM   4870 C CA  . ASN D 2 109 ? 6.092   -55.543 -0.901  1.000 36.391 0 107 ASN FFF CA  1 ? 17 
ATOM   4871 C C   . ASN D 2 109 ? 7.131   -54.767 -1.713  1.000 32.965 0 107 ASN FFF C   1 ? 17 
ATOM   4872 O O   . ASN D 2 109 ? 6.779   -53.828 -2.419  1.000 32.381 0 107 ASN FFF O   1 ? 17 
ATOM   4873 C CB  . ASN D 2 109 ? 5.397   -56.591 -1.770  1.000 40.872 0 107 ASN FFF CB  1 ? 17 
ATOM   4874 C CG  . ASN D 2 109 ? 4.143   -57.148 -1.126  1.000 46.412 0 107 ASN FFF CG  1 ? 17 
ATOM   4875 O OD1 . ASN D 2 109 ? 4.151   -57.554 0.034   1.000 51.562 0 107 ASN FFF OD1 1 ? 17 
ATOM   4876 N ND2 . ASN D 2 109 ? 3.060   -57.177 -1.880  1.000 50.388 0 107 ASN FFF ND2 1 ? 17 
ATOM   4877 N N   . PRO D 2 110 ? 8.432   -55.128 -1.657  1.000 30.784 0 108 PRO FFF N   1 ? 17 
ATOM   4878 C CA  . PRO D 2 110 ? 9.429   -54.448 -2.469  1.000 29.385 0 108 PRO FFF CA  1 ? 17 
ATOM   4879 C C   . PRO D 2 110 ? 9.198   -54.721 -3.958  1.000 27.930 0 108 PRO FFF C   1 ? 17 
ATOM   4880 O O   . PRO D 2 110 ? 8.561   -55.707 -4.327  1.000 28.702 0 108 PRO FFF O   1 ? 17 
ATOM   4881 C CB  . PRO D 2 110 ? 10.787  -55.007 -2.021  1.000 31.558 0 108 PRO FFF CB  1 ? 17 
ATOM   4882 C CG  . PRO D 2 110 ? 10.478  -56.217 -1.185  1.000 33.471 0 108 PRO FFF CG  1 ? 17 
ATOM   4883 C CD  . PRO D 2 110 ? 9.005   -56.201 -0.835  1.000 33.977 0 108 PRO FFF CD  1 ? 17 
ATOM   4884 N N   . TYR D 2 111 ? 9.713   -53.825 -4.785  1.000 26.523 0 109 TYR FFF N   1 ? 17 
ATOM   4885 C CA  . TYR D 2 111 ? 9.568   -53.881 -6.257  1.000 26.073 0 109 TYR FFF CA  1 ? 17 
ATOM   4886 C C   . TYR D 2 111 ? 10.903  -54.259 -6.892  1.000 25.856 0 109 TYR FFF C   1 ? 17 
ATOM   4887 O O   . TYR D 2 111 ? 10.887  -55.103 -7.815  1.000 27.437 0 109 TYR FFF O   1 ? 17 
ATOM   4888 C CB  . TYR D 2 111 ? 9.074   -52.545 -6.796  1.000 26.730 0 109 TYR FFF CB  1 ? 17 
ATOM   4889 C CG  . TYR D 2 111 ? 8.626   -52.611 -8.232  1.000 28.335 0 109 TYR FFF CG  1 ? 17 
ATOM   4890 C CD1 . TYR D 2 111 ? 9.535   -52.488 -9.268  1.000 28.803 0 109 TYR FFF CD1 1 ? 17 
ATOM   4891 C CD2 . TYR D 2 111 ? 7.290   -52.786 -8.556  1.000 29.978 0 109 TYR FFF CD2 1 ? 17 
ATOM   4892 C CE1 . TYR D 2 111 ? 9.128   -52.562 -10.593 1.000 31.437 0 109 TYR FFF CE1 1 ? 17 
ATOM   4893 C CE2 . TYR D 2 111 ? 6.865   -52.829 -9.870  1.000 31.791 0 109 TYR FFF CE2 1 ? 17 
ATOM   4894 C CZ  . TYR D 2 111 ? 7.789   -52.729 -10.893 1.000 32.970 0 109 TYR FFF CZ  1 ? 17 
ATOM   4895 O OH  . TYR D 2 111 ? 7.381   -52.765 -12.194 1.000 35.407 0 109 TYR FFF OH  1 ? 17 
ATOM   4896 N N   . PHE D 2 112 ? 11.987  -53.617 -6.455  1.000 24.831 0 110 PHE FFF N   1 ? 17 
ATOM   4897 C CA  . PHE D 2 112 ? 13.350  -53.806 -7.009  1.000 25.502 0 110 PHE FFF CA  1 ? 17 
ATOM   4898 C C   . PHE D 2 112 ? 14.192  -54.600 -6.017  1.000 25.550 0 110 PHE FFF C   1 ? 17 
ATOM   4899 O O   . PHE D 2 112 ? 14.133  -54.334 -4.800  1.000 24.897 0 110 PHE FFF O   1 ? 17 
ATOM   4900 C CB  . PHE D 2 112 ? 14.019  -52.464 -7.305  1.000 25.363 0 110 PHE FFF CB  1 ? 17 
ATOM   4901 C CG  . PHE D 2 112 ? 13.252  -51.544 -8.209  1.000 25.754 0 110 PHE FFF CG  1 ? 17 
ATOM   4902 C CD1 . PHE D 2 112 ? 13.239  -51.742 -9.582  1.000 28.150 0 110 PHE FFF CD1 1 ? 17 
ATOM   4903 C CD2 . PHE D 2 112 ? 12.567  -50.456 -7.690  1.000 26.233 0 110 PHE FFF CD2 1 ? 17 
ATOM   4904 C CE1 . PHE D 2 112 ? 12.545  -50.875 -10.414 1.000 28.674 0 110 PHE FFF CE1 1 ? 17 
ATOM   4905 C CE2 . PHE D 2 112 ? 11.890  -49.584 -8.525  1.000 26.211 0 110 PHE FFF CE2 1 ? 17 
ATOM   4906 C CZ  . PHE D 2 112 ? 11.869  -49.802 -9.884  1.000 27.434 0 110 PHE FFF CZ  1 ? 17 
ATOM   4907 N N   . TRP D 2 113 ? 14.958  -55.565 -6.531  1.000 26.109 0 111 TRP FFF N   1 ? 17 
ATOM   4908 C CA  . TRP D 2 113 ? 15.796  -56.472 -5.706  1.000 27.075 0 111 TRP FFF CA  1 ? 17 
ATOM   4909 C C   . TRP D 2 113 ? 17.264  -56.380 -6.130  1.000 26.238 0 111 TRP FFF C   1 ? 17 
ATOM   4910 O O   . TRP D 2 113 ? 17.514  -56.449 -7.361  1.000 26.202 0 111 TRP FFF O   1 ? 17 
ATOM   4911 C CB  . TRP D 2 113 ? 15.283  -57.903 -5.856  1.000 28.498 0 111 TRP FFF CB  1 ? 17 
ATOM   4912 C CG  . TRP D 2 113 ? 13.930  -58.134 -5.267  1.000 29.772 0 111 TRP FFF CG  1 ? 17 
ATOM   4913 C CD1 . TRP D 2 113 ? 12.718  -58.050 -5.901  1.000 32.660 0 111 TRP FFF CD1 1 ? 17 
ATOM   4914 C CD2 . TRP D 2 113 ? 13.653  -58.539 -3.920  1.000 29.504 0 111 TRP FFF CD2 1 ? 17 
ATOM   4915 N NE1 . TRP D 2 113 ? 11.711  -58.370 -5.032  1.000 32.181 0 111 TRP FFF NE1 1 ? 17 
ATOM   4916 C CE2 . TRP D 2 113 ? 12.255  -58.662 -3.808  1.000 31.678 0 111 TRP FFF CE2 1 ? 17 
ATOM   4917 C CE3 . TRP D 2 113 ? 14.446  -58.799 -2.798  1.000 29.967 0 111 TRP FFF CE3 1 ? 17 
ATOM   4918 C CZ2 . TRP D 2 113 ? 11.640  -59.043 -2.617  1.000 32.233 0 111 TRP FFF CZ2 1 ? 17 
ATOM   4919 C CZ3 . TRP D 2 113 ? 13.836  -59.180 -1.625  1.000 31.170 0 111 TRP FFF CZ3 1 ? 17 
ATOM   4920 C CH2 . TRP D 2 113 ? 12.451  -59.294 -1.537  1.000 31.667 0 111 TRP FFF CH2 1 ? 17 
ATOM   4921 N N   . GLY D 2 114 ? 18.181  -56.358 -5.156  1.000 26.618 0 112 GLY FFF N   1 ? 18 
ATOM   4922 C CA  . GLY D 2 114 ? 19.613  -56.561 -5.422  1.000 28.575 0 112 GLY FFF CA  1 ? 18 
ATOM   4923 C C   . GLY D 2 114 ? 19.878  -58.023 -5.773  1.000 30.519 0 112 GLY FFF C   1 ? 18 
ATOM   4924 O O   . GLY D 2 114 ? 18.988  -58.850 -5.544  1.000 28.732 0 112 GLY FFF O   1 ? 18 
ATOM   4925 N N   . GLN D 2 115 ? 21.063  -58.325 -6.292  1.000 34.104 0 113 GLN FFF N   1 ? 18 
ATOM   4926 C CA  . GLN D 2 115 ? 21.471  -59.694 -6.705  1.000 38.555 0 113 GLN FFF CA  1 ? 18 
ATOM   4927 C C   . GLN D 2 115 ? 21.621  -60.566 -5.460  1.000 35.193 0 113 GLN FFF C   1 ? 18 
ATOM   4928 O O   . GLN D 2 115 ? 21.518  -61.795 -5.585  1.000 36.452 0 113 GLN FFF O   1 ? 18 
ATOM   4929 C CB  . GLN D 2 115 ? 22.783  -59.651 -7.490  1.000 45.231 0 113 GLN FFF CB  1 ? 18 
ATOM   4930 C CG  . GLN D 2 115 ? 22.616  -59.105 -8.894  1.000 53.394 0 113 GLN FFF CG  1 ? 18 
ATOM   4931 C CD  . GLN D 2 115 ? 23.866  -59.247 -9.728  1.000 61.840 0 113 GLN FFF CD  1 ? 18 
ATOM   4932 O OE1 . GLN D 2 115 ? 24.873  -59.819 -9.309  1.000 65.591 0 113 GLN FFF OE1 1 ? 18 
ATOM   4933 N NE2 . GLN D 2 115 ? 23.809  -58.713 -10.935 1.000 70.719 0 113 GLN FFF NE2 1 ? 18 
ATOM   4934 N N   . GLY D 2 116 ? 21.900  -59.941 -4.313  1.000 31.711 0 114 GLY FFF N   1 ? 18 
ATOM   4935 C CA  . GLY D 2 116 ? 22.095  -60.630 -3.030  1.000 29.323 0 114 GLY FFF CA  1 ? 18 
ATOM   4936 C C   . GLY D 2 116 ? 23.560  -60.786 -2.682  1.000 30.447 0 114 GLY FFF C   1 ? 18 
ATOM   4937 O O   . GLY D 2 116 ? 24.388  -60.978 -3.595  1.000 33.750 0 114 GLY FFF O   1 ? 18 
ATOM   4938 N N   . THR D 2 117 ? 23.881  -60.707 -1.393  1.000 28.889 0 115 THR FFF N   1 ? 18 
ATOM   4939 C CA  A THR D 2 117 ? 25.266  -60.841 -0.880  0.500 29.924 0 115 THR FFF CA  1 ? 18 
ATOM   4940 C CA  B THR D 2 117 ? 25.274  -60.862 -0.900  0.500 30.647 0 115 THR FFF CA  1 ? 18 
ATOM   4941 C C   . THR D 2 117 ? 25.299  -61.956 0.169   1.000 28.383 0 115 THR FFF C   1 ? 18 
ATOM   4942 O O   . THR D 2 117 ? 24.480  -61.917 1.107   1.000 27.323 0 115 THR FFF O   1 ? 18 
ATOM   4943 C CB  A THR D 2 117 ? 25.802  -59.501 -0.360  0.500 31.120 0 115 THR FFF CB  1 ? 18 
ATOM   4944 C CB  B THR D 2 117 ? 25.893  -59.542 -0.414  0.500 32.808 0 115 THR FFF CB  1 ? 18 
ATOM   4945 O OG1 A THR D 2 117 ? 27.146  -59.726 0.071   0.500 32.200 0 115 THR FFF OG1 1 ? 18 
ATOM   4946 O OG1 B THR D 2 117 ? 25.501  -59.299 0.936   0.500 33.179 0 115 THR FFF OG1 1 ? 18 
ATOM   4947 C CG2 A THR D 2 117 ? 25.007  -58.911 0.783   0.500 29.562 0 115 THR FFF CG2 1 ? 18 
ATOM   4948 C CG2 B THR D 2 117 ? 25.536  -58.361 -1.287  0.500 33.533 0 115 THR FFF CG2 1 ? 18 
ATOM   4949 N N   . GLN D 2 118 ? 26.192  -62.921 -0.014  1.000 30.561 0 116 GLN FFF N   1 ? 18 
ATOM   4950 C CA  . GLN D 2 118 ? 26.339  -64.045 0.933   1.000 29.628 0 116 GLN FFF CA  1 ? 18 
ATOM   4951 C C   . GLN D 2 118 ? 26.994  -63.502 2.203   1.000 29.281 0 116 GLN FFF C   1 ? 18 
ATOM   4952 O O   . GLN D 2 118 ? 28.048  -62.836 2.094   1.000 31.244 0 116 GLN FFF O   1 ? 18 
ATOM   4953 C CB  . GLN D 2 118 ? 27.198  -65.152 0.319   1.000 32.325 0 116 GLN FFF CB  1 ? 18 
ATOM   4954 C CG  . GLN D 2 118 ? 27.349  -66.376 1.207   1.000 32.383 0 116 GLN FFF CG  1 ? 18 
ATOM   4955 C CD  . GLN D 2 118 ? 26.044  -67.120 1.371   1.000 31.260 0 116 GLN FFF CD  1 ? 18 
ATOM   4956 O OE1 . GLN D 2 118 ? 25.337  -67.395 0.404   1.000 33.412 0 116 GLN FFF OE1 1 ? 18 
ATOM   4957 N NE2 . GLN D 2 118 ? 25.703  -67.433 2.607   1.000 29.659 0 116 GLN FFF NE2 1 ? 18 
ATOM   4958 N N   . VAL D 2 119 ? 26.384  -63.802 3.339   1.000 28.747 0 117 VAL FFF N   1 ? 18 
ATOM   4959 C CA  . VAL D 2 119 ? 26.970  -63.675 4.698   1.000 30.137 0 117 VAL FFF CA  1 ? 18 
ATOM   4960 C C   . VAL D 2 119 ? 27.079  -65.085 5.285   1.000 31.677 0 117 VAL FFF C   1 ? 18 
ATOM   4961 O O   . VAL D 2 119 ? 26.053  -65.773 5.378   1.000 30.648 0 117 VAL FFF O   1 ? 18 
ATOM   4962 C CB  . VAL D 2 119 ? 26.126  -62.731 5.571   1.000 30.743 0 117 VAL FFF CB  1 ? 18 
ATOM   4963 C CG1 . VAL D 2 119 ? 26.606  -62.720 7.012   1.000 33.250 0 117 VAL FFF CG1 1 ? 18 
ATOM   4964 C CG2 . VAL D 2 119 ? 26.110  -61.323 4.991   1.000 30.888 0 117 VAL FFF CG2 1 ? 18 
ATOM   4965 N N   . THR D 2 120 ? 28.284  -65.497 5.664   1.000 33.654 0 118 THR FFF N   1 ? 18 
ATOM   4966 C CA  . THR D 2 120 ? 28.523  -66.817 6.299   1.000 35.748 0 118 THR FFF CA  1 ? 18 
ATOM   4967 C C   . THR D 2 120 ? 29.165  -66.587 7.666   1.000 38.556 0 118 THR FFF C   1 ? 18 
ATOM   4968 O O   . THR D 2 120 ? 30.299  -66.071 7.713   1.000 41.299 0 118 THR FFF O   1 ? 18 
ATOM   4969 C CB  . THR D 2 120 ? 29.339  -67.726 5.372   1.000 37.680 0 118 THR FFF CB  1 ? 18 
ATOM   4970 O OG1 . THR D 2 120 ? 28.655  -67.787 4.117   1.000 37.168 0 118 THR FFF OG1 1 ? 18 
ATOM   4971 C CG2 . THR D 2 120 ? 29.531  -69.118 5.937   1.000 39.298 0 118 THR FFF CG2 1 ? 18 
ATOM   4972 N N   . VAL D 2 121 ? 28.457  -66.956 8.731   1.000 40.110 0 119 VAL FFF N   1 ? 18 
ATOM   4973 C CA  . VAL D 2 121 ? 28.924  -66.828 10.139  1.000 43.204 0 119 VAL FFF CA  1 ? 18 
ATOM   4974 C C   . VAL D 2 121 ? 29.340  -68.216 10.651  1.000 46.561 0 119 VAL FFF C   1 ? 18 
ATOM   4975 O O   . VAL D 2 121 ? 28.460  -69.096 10.762  1.000 44.098 0 119 VAL FFF O   1 ? 18 
ATOM   4976 C CB  . VAL D 2 121 ? 27.827  -66.204 11.017  1.000 44.543 0 119 VAL FFF CB  1 ? 18 
ATOM   4977 C CG1 . VAL D 2 121 ? 28.331  -65.942 12.425  1.000 49.636 0 119 VAL FFF CG1 1 ? 18 
ATOM   4978 C CG2 . VAL D 2 121 ? 27.273  -64.931 10.389  1.000 43.999 0 119 VAL FFF CG2 1 ? 18 
ATOM   4979 N N   . SER D 2 122 ? 30.628  -68.405 10.952  1.000 49.805 0 120 SER FFF N   1 ? 18 
ATOM   4980 C CA  . SER D 2 122 ? 31.193  -69.689 11.446  1.000 54.137 0 120 SER FFF CA  1 ? 18 
ATOM   4981 C C   . SER D 2 122 ? 31.036  -69.783 12.969  1.000 59.581 0 120 SER FFF C   1 ? 18 
ATOM   4982 O O   . SER D 2 122 ? 31.175  -68.748 13.650  1.000 59.897 0 120 SER FFF O   1 ? 18 
ATOM   4983 C CB  . SER D 2 122 ? 32.633  -69.848 11.040  1.000 57.134 0 120 SER FFF CB  1 ? 18 
ATOM   4984 O OG  . SER D 2 122 ? 33.405  -68.743 11.481  1.000 61.879 0 120 SER FFF OG  1 ? 18 
ATOM   4985 N N   . SER D 2 123 ? 30.814  -70.998 13.482  1.000 63.977 0 121 SER FFF N   1 ? 18 
ATOM   4986 C CA  . SER D 2 123 ? 30.614  -71.300 14.924  1.000 69.960 0 121 SER FFF CA  1 ? 18 
ATOM   4987 C C   . SER D 2 123 ? 31.909  -71.856 15.527  1.000 74.125 0 121 SER FFF C   1 ? 18 
ATOM   4988 O O   . SER D 2 123 ? 32.991  -71.619 14.991  1.000 73.710 0 121 SER FFF O   1 ? 18 
ATOM   4989 C CB  . SER D 2 123 ? 29.464  -72.256 15.110  1.000 73.072 0 121 SER FFF CB  1 ? 18 
ATOM   4990 O OG  . SER D 2 123 ? 28.988  -72.219 16.446  1.000 79.573 0 121 SER FFF OG  1 ? 18 
HETATM 4991 C C1  . NAG E 3 .   ? 3.786   5.938   -21.689 1.000 50.959 0 601 NAG AAA C1  1 ? ?  
HETATM 4992 C C2  . NAG E 3 .   ? 3.707   4.438   -21.960 1.000 51.802 0 601 NAG AAA C2  1 ? ?  
HETATM 4993 C C3  . NAG E 3 .   ? 2.388   3.806   -21.499 1.000 56.089 0 601 NAG AAA C3  1 ? ?  
HETATM 4994 C C4  . NAG E 3 .   ? 1.769   4.420   -20.243 1.000 58.206 0 601 NAG AAA C4  1 ? ?  
HETATM 4995 C C5  . NAG E 3 .   ? 1.963   5.928   -20.172 1.000 60.317 0 601 NAG AAA C5  1 ? ?  
HETATM 4996 C C6  . NAG E 3 .   ? 1.527   6.492   -18.823 1.000 61.603 0 601 NAG AAA C6  1 ? ?  
HETATM 4997 C C7  . NAG E 3 .   ? 4.738   3.413   -23.942 1.000 45.747 0 601 NAG AAA C7  1 ? ?  
HETATM 4998 C C8  . NAG E 3 .   ? 4.703   3.299   -25.440 1.000 43.555 0 601 NAG AAA C8  1 ? ?  
HETATM 4999 N N2  . NAG E 3 .   ? 3.820   4.211   -23.394 1.000 48.604 0 601 NAG AAA N2  1 ? ?  
HETATM 5000 O O3  . NAG E 3 .   ? 2.620   2.415   -21.247 1.000 61.399 0 601 NAG AAA O3  1 ? ?  
HETATM 5001 O O4  . NAG E 3 .   ? 0.363   4.141   -20.237 1.000 57.735 0 601 NAG AAA O4  1 ? ?  
HETATM 5002 O O5  . NAG E 3 .   ? 3.342   6.214   -20.366 1.000 54.740 0 601 NAG AAA O5  1 ? ?  
HETATM 5003 O O6  . NAG E 3 .   ? 2.506   6.158   -17.833 1.000 60.859 0 601 NAG AAA O6  1 ? ?  
HETATM 5004 O O7  . NAG E 3 .   ? 5.567   2.810   -23.284 1.000 47.048 0 601 NAG AAA O7  1 ? ?  
HETATM 5005 C C1  . GOL F 4 .   ? 11.089  47.016  -34.428 1.000 46.687 0 201 GOL BBB C1  1 ? ?  
HETATM 5006 O O1  . GOL F 4 .   ? 9.711   47.224  -34.129 1.000 41.527 0 201 GOL BBB O1  1 ? ?  
HETATM 5007 C C2  . GOL F 4 .   ? 11.265  45.962  -35.500 1.000 43.121 0 201 GOL BBB C2  1 ? ?  
HETATM 5008 O O2  . GOL F 4 .   ? 10.200  46.067  -36.441 1.000 52.547 0 201 GOL BBB O2  1 ? ?  
HETATM 5009 C C3  . GOL F 4 .   ? 12.593  46.051  -36.223 1.000 38.674 0 201 GOL BBB C3  1 ? ?  
HETATM 5010 O O3  . GOL F 4 .   ? 13.564  45.182  -35.649 1.000 36.101 0 201 GOL BBB O3  1 ? ?  
HETATM 5011 C C1  . NAG G 3 .   ? 18.085  -12.631 15.991  1.000 36.753 0 601 NAG EEE C1  1 ? ?  
HETATM 5012 C C2  . NAG G 3 .   ? 18.137  -11.123 15.752  1.000 38.543 0 601 NAG EEE C2  1 ? ?  
HETATM 5013 C C3  . NAG G 3 .   ? 19.509  -10.585 16.165  1.000 44.385 0 601 NAG EEE C3  1 ? ?  
HETATM 5014 C C4  . NAG G 3 .   ? 19.869  -11.006 17.586  1.000 48.073 0 601 NAG EEE C4  1 ? ?  
HETATM 5015 C C5  . NAG G 3 .   ? 19.823  -12.524 17.656  1.000 49.226 0 601 NAG EEE C5  1 ? ?  
HETATM 5016 C C6  . NAG G 3 .   ? 20.234  -13.080 19.020  1.000 51.416 0 601 NAG EEE C6  1 ? ?  
HETATM 5017 C C7  . NAG G 3 .   ? 16.975  -9.984  13.898  1.000 36.461 0 601 NAG EEE C7  1 ? ?  
HETATM 5018 C C8  . NAG G 3 .   ? 16.948  -9.770  12.415  1.000 40.290 0 601 NAG EEE C8  1 ? ?  
HETATM 5019 N N2  . NAG G 3 .   ? 17.920  -10.817 14.346  1.000 38.595 0 601 NAG EEE N2  1 ? ?  
HETATM 5020 O O3  . NAG G 3 .   ? 19.547  -9.159  16.082  1.000 42.358 0 601 NAG EEE O3  1 ? ?  
HETATM 5021 O O4  . NAG G 3 .   ? 21.176  -10.525 17.917  1.000 52.375 0 601 NAG EEE O4  1 ? ?  
HETATM 5022 O O5  . NAG G 3 .   ? 18.484  -12.906 17.343  1.000 41.496 0 601 NAG EEE O5  1 ? ?  
HETATM 5023 O O6  . NAG G 3 .   ? 19.190  -12.870 19.978  1.000 51.722 0 601 NAG EEE O6  1 ? ?  
HETATM 5024 O O7  . NAG G 3 .   ? 16.176  -9.410  14.616  1.000 39.196 0 601 NAG EEE O7  1 ? ?  
HETATM 5025 O O   . HOH H 5 .   ? 16.521  41.026  -53.562 1.000 41.208 0 701 HOH AAA O   1 ? ?  
HETATM 5026 O O   . HOH H 5 .   ? 23.093  34.268  -56.052 1.000 47.563 0 702 HOH AAA O   1 ? ?  
HETATM 5027 O O   . HOH H 5 .   ? -3.541  23.321  -22.125 1.000 61.037 0 703 HOH AAA O   1 ? ?  
HETATM 5028 O O   . HOH H 5 .   ? 0.040   32.932  -24.582 1.000 42.487 0 704 HOH AAA O   1 ? ?  
HETATM 5029 O O   . HOH H 5 .   ? 22.249  27.642  -49.490 1.000 36.347 0 705 HOH AAA O   1 ? ?  
HETATM 5030 O O   . HOH H 5 .   ? 7.388   26.556  -31.288 1.000 37.692 0 706 HOH AAA O   1 ? ?  
HETATM 5031 O O   . HOH H 5 .   ? 22.100  32.589  -50.110 1.000 38.856 0 707 HOH AAA O   1 ? ?  
HETATM 5032 O O   . HOH H 5 .   ? -0.544  8.872   -48.828 1.000 48.044 0 708 HOH AAA O   1 ? ?  
HETATM 5033 O O   . HOH H 5 .   ? 19.966  -8.773  -39.129 1.000 36.075 0 709 HOH AAA O   1 ? ?  
HETATM 5034 O O   . HOH H 5 .   ? 13.084  20.276  -29.191 1.000 41.207 0 710 HOH AAA O   1 ? ?  
HETATM 5035 O O   . HOH H 5 .   ? 7.033   5.446   -20.418 1.000 48.307 0 711 HOH AAA O   1 ? ?  
HETATM 5036 O O   . HOH H 5 .   ? 17.002  25.962  -46.476 1.000 19.291 0 712 HOH AAA O   1 ? ?  
HETATM 5037 O O   . HOH H 5 .   ? 8.304   28.799  -48.628 1.000 26.569 0 713 HOH AAA O   1 ? ?  
HETATM 5038 O O   . HOH H 5 .   ? -3.825  13.346  -35.612 1.000 36.884 0 714 HOH AAA O   1 ? ?  
HETATM 5039 O O   . HOH H 5 .   ? 14.839  25.575  -30.815 1.000 40.003 0 715 HOH AAA O   1 ? ?  
HETATM 5040 O O   . HOH H 5 .   ? 5.720   12.315  -48.101 1.000 39.063 0 716 HOH AAA O   1 ? ?  
HETATM 5041 O O   . HOH H 5 .   ? 13.685  22.049  -30.891 1.000 39.763 0 717 HOH AAA O   1 ? ?  
HETATM 5042 O O   . HOH H 5 .   ? -0.643  25.555  -29.038 1.000 44.870 0 718 HOH AAA O   1 ? ?  
HETATM 5043 O O   . HOH H 5 .   ? 11.902  13.987  -52.906 1.000 45.005 0 719 HOH AAA O   1 ? ?  
HETATM 5044 O O   . HOH H 5 .   ? 7.691   16.382  -51.386 1.000 38.162 0 720 HOH AAA O   1 ? ?  
HETATM 5045 O O   . HOH H 5 .   ? 15.176  36.038  -42.174 1.000 23.435 0 721 HOH AAA O   1 ? ?  
HETATM 5046 O O   . HOH H 5 .   ? 2.390   28.426  -35.806 1.000 38.889 0 722 HOH AAA O   1 ? ?  
HETATM 5047 O O   . HOH H 5 .   ? 5.632   30.620  -37.760 1.000 29.775 0 723 HOH AAA O   1 ? ?  
HETATM 5048 O O   . HOH H 5 .   ? 16.911  17.244  -32.748 1.000 39.140 0 724 HOH AAA O   1 ? ?  
HETATM 5049 O O   . HOH H 5 .   ? 5.886   23.450  -50.130 1.000 43.242 0 725 HOH AAA O   1 ? ?  
HETATM 5050 O O   . HOH H 5 .   ? 8.155   -11.997 -39.789 1.000 26.349 0 726 HOH AAA O   1 ? ?  
HETATM 5051 O O   . HOH H 5 .   ? 18.909  24.002  -47.203 1.000 25.914 0 727 HOH AAA O   1 ? ?  
HETATM 5052 O O   . HOH H 5 .   ? 22.571  34.392  -52.223 1.000 28.591 0 728 HOH AAA O   1 ? ?  
HETATM 5053 O O   . HOH H 5 .   ? 13.041  -3.034  -45.950 1.000 41.960 0 729 HOH AAA O   1 ? ?  
HETATM 5054 O O   . HOH H 5 .   ? 6.251   10.347  -51.126 1.000 37.516 0 730 HOH AAA O   1 ? ?  
HETATM 5055 O O   . HOH H 5 .   ? 10.858  5.824   -39.454 1.000 28.423 0 731 HOH AAA O   1 ? ?  
HETATM 5056 O O   . HOH H 5 .   ? 21.629  17.390  -44.813 1.000 45.016 0 732 HOH AAA O   1 ? ?  
HETATM 5057 O O   . HOH H 5 .   ? -1.041  20.532  -44.302 1.000 27.684 0 733 HOH AAA O   1 ? ?  
HETATM 5058 O O   . HOH H 5 .   ? -4.568  20.756  -43.237 1.000 29.481 0 734 HOH AAA O   1 ? ?  
HETATM 5059 O O   . HOH H 5 .   ? -0.085  9.146   -42.445 1.000 30.318 0 735 HOH AAA O   1 ? ?  
HETATM 5060 O O   . HOH H 5 .   ? -6.999  15.462  -32.739 1.000 44.513 0 736 HOH AAA O   1 ? ?  
HETATM 5061 O O   . HOH H 5 .   ? 12.754  9.214   -32.271 1.000 19.260 0 737 HOH AAA O   1 ? ?  
HETATM 5062 O O   . HOH H 5 .   ? 17.491  30.522  -53.497 1.000 22.049 0 738 HOH AAA O   1 ? ?  
HETATM 5063 O O   . HOH H 5 .   ? 14.909  23.078  -57.314 1.000 54.892 0 739 HOH AAA O   1 ? ?  
HETATM 5064 O O   . HOH H 5 .   ? 19.423  41.802  -48.980 1.000 30.078 0 740 HOH AAA O   1 ? ?  
HETATM 5065 O O   . HOH H 5 .   ? 15.017  18.115  -42.201 1.000 19.083 0 741 HOH AAA O   1 ? ?  
HETATM 5066 O O   . HOH H 5 .   ? 3.840   3.120   -49.108 1.000 39.234 0 742 HOH AAA O   1 ? ?  
HETATM 5067 O O   . HOH H 5 .   ? 11.717  24.594  -53.535 1.000 39.182 0 743 HOH AAA O   1 ? ?  
HETATM 5068 O O   . HOH H 5 .   ? -4.310  25.814  -42.116 1.000 26.000 0 744 HOH AAA O   1 ? ?  
HETATM 5069 O O   . HOH H 5 .   ? 18.829  28.042  -46.909 1.000 20.355 0 745 HOH AAA O   1 ? ?  
HETATM 5070 O O   . HOH H 5 .   ? 6.991   25.316  -51.124 1.000 44.284 0 746 HOH AAA O   1 ? ?  
HETATM 5071 O O   . HOH H 5 .   ? 14.684  20.764  -42.786 1.000 19.818 0 747 HOH AAA O   1 ? ?  
HETATM 5072 O O   . HOH H 5 .   ? 12.834  13.122  -44.189 1.000 26.562 0 748 HOH AAA O   1 ? ?  
HETATM 5073 O O   . HOH H 5 .   ? 10.711  37.022  -52.187 1.000 44.583 0 749 HOH AAA O   1 ? ?  
HETATM 5074 O O   . HOH H 5 .   ? 15.543  -13.961 -41.589 1.000 26.554 0 750 HOH AAA O   1 ? ?  
HETATM 5075 O O   . HOH H 5 .   ? 10.959  10.524  -29.031 1.000 29.393 0 751 HOH AAA O   1 ? ?  
HETATM 5076 O O   . HOH H 5 .   ? 29.928  36.525  -46.773 1.000 36.427 0 752 HOH AAA O   1 ? ?  
HETATM 5077 O O   . HOH H 5 .   ? 21.494  36.116  -39.426 1.000 30.970 0 753 HOH AAA O   1 ? ?  
HETATM 5078 O O   . HOH H 5 .   ? 14.044  -10.583 -30.860 1.000 52.742 0 754 HOH AAA O   1 ? ?  
HETATM 5079 O O   . HOH H 5 .   ? 17.674  38.159  -52.622 1.000 25.783 0 755 HOH AAA O   1 ? ?  
HETATM 5080 O O   . HOH H 5 .   ? 20.082  26.198  -44.910 1.000 25.095 0 756 HOH AAA O   1 ? ?  
HETATM 5081 O O   . HOH H 5 .   ? 24.171  33.667  -48.704 1.000 40.674 0 757 HOH AAA O   1 ? ?  
HETATM 5082 O O   . HOH H 5 .   ? 4.833   25.506  -40.614 1.000 36.401 0 758 HOH AAA O   1 ? ?  
HETATM 5083 O O   . HOH H 5 .   ? 12.007  13.597  -30.721 1.000 23.305 0 759 HOH AAA O   1 ? ?  
HETATM 5084 O O   . HOH H 5 .   ? -5.857  25.025  -39.028 1.000 25.358 0 760 HOH AAA O   1 ? ?  
HETATM 5085 O O   . HOH H 5 .   ? -4.832  13.513  -30.383 1.000 40.599 0 761 HOH AAA O   1 ? ?  
HETATM 5086 O O   . HOH H 5 .   ? 3.791   -15.295 -37.752 1.000 31.218 0 762 HOH AAA O   1 ? ?  
HETATM 5087 O O   . HOH H 5 .   ? -2.464  12.244  -45.769 1.000 33.833 0 763 HOH AAA O   1 ? ?  
HETATM 5088 O O   . HOH H 5 .   ? 2.113   5.558   -25.114 1.000 55.144 0 764 HOH AAA O   1 ? ?  
HETATM 5089 O O   . HOH H 5 .   ? 12.837  33.872  -42.358 1.000 23.118 0 765 HOH AAA O   1 ? ?  
HETATM 5090 O O   . HOH H 5 .   ? -3.574  17.228  -40.694 1.000 26.684 0 766 HOH AAA O   1 ? ?  
HETATM 5091 O O   . HOH H 5 .   ? 6.172   13.479  -45.556 1.000 26.995 0 767 HOH AAA O   1 ? ?  
HETATM 5092 O O   . HOH H 5 .   ? -3.609  13.673  -26.989 1.000 36.253 0 768 HOH AAA O   1 ? ?  
HETATM 5093 O O   . HOH H 5 .   ? -3.481  1.516   -40.995 1.000 41.305 0 769 HOH AAA O   1 ? ?  
HETATM 5094 O O   . HOH H 5 .   ? 12.267  12.771  -28.186 1.000 29.374 0 770 HOH AAA O   1 ? ?  
HETATM 5095 O O   . HOH H 5 .   ? 9.032   21.425  -34.776 1.000 19.139 0 771 HOH AAA O   1 ? ?  
HETATM 5096 O O   . HOH H 5 .   ? 21.682  40.350  -40.666 1.000 25.987 0 772 HOH AAA O   1 ? ?  
HETATM 5097 O O   . HOH H 5 .   ? 22.952  37.799  -41.103 1.000 25.478 0 773 HOH AAA O   1 ? ?  
HETATM 5098 O O   . HOH H 5 .   ? 20.495  43.145  -43.187 1.000 31.676 0 774 HOH AAA O   1 ? ?  
HETATM 5099 O O   . HOH H 5 .   ? 9.416   29.749  -25.873 1.000 33.470 0 775 HOH AAA O   1 ? ?  
HETATM 5100 O O   . HOH H 5 .   ? 17.503  17.334  -51.308 1.000 33.306 0 776 HOH AAA O   1 ? ?  
HETATM 5101 O O   . HOH H 5 .   ? 20.660  40.994  -51.313 1.000 40.779 0 777 HOH AAA O   1 ? ?  
HETATM 5102 O O   . HOH H 5 .   ? 18.766  38.086  -37.252 1.000 26.811 0 778 HOH AAA O   1 ? ?  
HETATM 5103 O O   . HOH H 5 .   ? 7.890   21.068  -24.673 1.000 40.622 0 779 HOH AAA O   1 ? ?  
HETATM 5104 O O   . HOH H 5 .   ? 15.507  5.323   -43.626 1.000 40.877 0 780 HOH AAA O   1 ? ?  
HETATM 5105 O O   . HOH H 5 .   ? 10.170  16.242  -50.278 1.000 31.417 0 781 HOH AAA O   1 ? ?  
HETATM 5106 O O   . HOH H 5 .   ? 2.766   23.239  -43.760 1.000 44.623 0 782 HOH AAA O   1 ? ?  
HETATM 5107 O O   . HOH H 5 .   ? 21.012  40.838  -46.971 1.000 23.846 0 783 HOH AAA O   1 ? ?  
HETATM 5108 O O   . HOH H 5 .   ? 25.056  33.542  -42.229 1.000 36.335 0 784 HOH AAA O   1 ? ?  
HETATM 5109 O O   . HOH H 5 .   ? 19.939  13.057  -44.267 1.000 29.473 0 785 HOH AAA O   1 ? ?  
HETATM 5110 O O   . HOH H 5 .   ? 25.291  34.906  -51.867 1.000 31.017 0 786 HOH AAA O   1 ? ?  
HETATM 5111 O O   . HOH H 5 .   ? -0.196  16.824  -50.579 1.000 42.095 0 787 HOH AAA O   1 ? ?  
HETATM 5112 O O   . HOH H 5 .   ? 24.484  31.780  -45.216 1.000 29.355 0 788 HOH AAA O   1 ? ?  
HETATM 5113 O O   . HOH H 5 .   ? 18.708  22.241  -51.747 1.000 39.450 0 789 HOH AAA O   1 ? ?  
HETATM 5114 O O   . HOH H 5 .   ? 18.434  -7.817  -48.390 1.000 38.600 0 790 HOH AAA O   1 ? ?  
HETATM 5115 O O   . HOH H 5 .   ? 12.356  40.608  -47.088 1.000 23.395 0 791 HOH AAA O   1 ? ?  
HETATM 5116 O O   . HOH H 5 .   ? -5.527  7.176   -38.144 1.000 45.100 0 792 HOH AAA O   1 ? ?  
HETATM 5117 O O   . HOH H 5 .   ? 19.259  4.915   -32.166 1.000 35.415 0 793 HOH AAA O   1 ? ?  
HETATM 5118 O O   . HOH H 5 .   ? 12.928  19.696  -55.709 1.000 38.914 0 794 HOH AAA O   1 ? ?  
HETATM 5119 O O   . HOH H 5 .   ? 11.649  27.809  -50.917 1.000 22.484 0 795 HOH AAA O   1 ? ?  
HETATM 5120 O O   . HOH H 5 .   ? 15.198  19.628  -32.056 1.000 30.775 0 796 HOH AAA O   1 ? ?  
HETATM 5121 O O   . HOH H 5 .   ? 12.797  29.647  -28.040 1.000 39.745 0 797 HOH AAA O   1 ? ?  
HETATM 5122 O O   . HOH H 5 .   ? 9.731   7.964   -53.092 1.000 38.585 0 798 HOH AAA O   1 ? ?  
HETATM 5123 O O   . HOH H 5 .   ? 18.445  44.261  -45.915 1.000 24.312 0 799 HOH AAA O   1 ? ?  
HETATM 5124 O O   . HOH H 5 .   ? 22.107  19.151  -42.898 1.000 26.758 0 800 HOH AAA O   1 ? ?  
HETATM 5125 O O   . HOH H 5 .   ? 15.368  28.674  -54.437 1.000 27.145 0 801 HOH AAA O   1 ? ?  
HETATM 5126 O O   . HOH H 5 .   ? 18.308  25.384  -49.643 1.000 28.833 0 802 HOH AAA O   1 ? ?  
HETATM 5127 O O   . HOH H 5 .   ? 10.422  41.066  -49.132 1.000 36.486 0 803 HOH AAA O   1 ? ?  
HETATM 5128 O O   . HOH H 5 .   ? 19.287  30.174  -51.465 1.000 20.976 0 804 HOH AAA O   1 ? ?  
HETATM 5129 O O   . HOH H 5 .   ? -8.495  23.917  -36.828 1.000 33.790 0 805 HOH AAA O   1 ? ?  
HETATM 5130 O O   . HOH H 5 .   ? -2.987  18.158  -25.207 1.000 39.645 0 806 HOH AAA O   1 ? ?  
HETATM 5131 O O   . HOH H 5 .   ? -1.305  11.481  -41.687 1.000 41.367 0 807 HOH AAA O   1 ? ?  
HETATM 5132 O O   . HOH H 5 .   ? 2.479   23.915  -46.895 1.000 44.997 0 808 HOH AAA O   1 ? ?  
HETATM 5133 O O   . HOH H 5 .   ? -3.482  11.880  -41.061 1.000 47.163 0 809 HOH AAA O   1 ? ?  
HETATM 5134 O O   . HOH H 5 .   ? 18.567  11.339  -34.299 1.000 34.685 0 810 HOH AAA O   1 ? ?  
HETATM 5135 O O   . HOH H 5 .   ? 19.326  2.946   -30.015 1.000 49.148 0 811 HOH AAA O   1 ? ?  
HETATM 5136 O O   . HOH H 5 .   ? -0.244  4.632   -25.420 1.000 58.027 0 812 HOH AAA O   1 ? ?  
HETATM 5137 O O   . HOH H 5 .   ? 3.297   27.304  -39.069 1.000 42.789 0 813 HOH AAA O   1 ? ?  
HETATM 5138 O O   . HOH H 5 .   ? 3.586   36.267  -27.940 1.000 32.965 0 814 HOH AAA O   1 ? ?  
HETATM 5139 O O   . HOH H 5 .   ? 10.911  1.004   -44.080 1.000 54.105 0 815 HOH AAA O   1 ? ?  
HETATM 5140 O O   . HOH H 5 .   ? -5.305  21.881  -24.272 1.000 42.604 0 816 HOH AAA O   1 ? ?  
HETATM 5141 O O   . HOH H 5 .   ? 10.818  2.152   -22.771 1.000 52.890 0 817 HOH AAA O   1 ? ?  
HETATM 5142 O O   . HOH H 5 .   ? 9.991   2.408   -45.718 1.000 39.100 0 818 HOH AAA O   1 ? ?  
HETATM 5143 O O   . HOH H 5 .   ? 21.438  19.541  -46.204 1.000 52.252 0 819 HOH AAA O   1 ? ?  
HETATM 5144 O O   . HOH H 5 .   ? 2.507   8.326   -25.449 1.000 49.586 0 820 HOH AAA O   1 ? ?  
HETATM 5145 O O   . HOH H 5 .   ? 12.937  -13.885 -37.563 1.000 38.871 0 821 HOH AAA O   1 ? ?  
HETATM 5146 O O   . HOH H 5 .   ? -0.619  24.006  -42.686 1.000 45.651 0 822 HOH AAA O   1 ? ?  
HETATM 5147 O O   . HOH H 5 .   ? 4.252   -15.580 -27.738 1.000 49.606 0 823 HOH AAA O   1 ? ?  
HETATM 5148 O O   . HOH H 5 .   ? 9.722   22.623  -25.942 1.000 42.805 0 824 HOH AAA O   1 ? ?  
HETATM 5149 O O   . HOH H 5 .   ? 25.776  25.035  -44.363 1.000 46.740 0 825 HOH AAA O   1 ? ?  
HETATM 5150 O O   . HOH H 5 .   ? -3.616  28.587  -41.286 1.000 49.010 0 826 HOH AAA O   1 ? ?  
HETATM 5151 O O   . HOH H 5 .   ? 19.159  5.045   -39.952 1.000 41.516 0 827 HOH AAA O   1 ? ?  
HETATM 5152 O O   . HOH H 5 .   ? -0.571  17.003  -24.050 1.000 56.548 0 828 HOH AAA O   1 ? ?  
HETATM 5153 O O   . HOH H 5 .   ? -6.493  16.499  -35.585 1.000 49.934 0 829 HOH AAA O   1 ? ?  
HETATM 5154 O O   . HOH H 5 .   ? -5.766  30.404  -32.996 1.000 47.083 0 830 HOH AAA O   1 ? ?  
HETATM 5155 O O   . HOH H 5 .   ? 21.481  15.170  -40.202 1.000 40.286 0 831 HOH AAA O   1 ? ?  
HETATM 5156 O O   . HOH H 5 .   ? 24.049  41.628  -48.743 1.000 48.086 0 832 HOH AAA O   1 ? ?  
HETATM 5157 O O   . HOH H 5 .   ? 10.808  35.111  -44.189 1.000 37.959 0 833 HOH AAA O   1 ? ?  
HETATM 5158 O O   . HOH H 5 .   ? -8.629  11.199  -41.760 1.000 49.062 0 834 HOH AAA O   1 ? ?  
HETATM 5159 O O   . HOH H 5 .   ? 14.429  14.391  -30.247 1.000 58.782 0 835 HOH AAA O   1 ? ?  
HETATM 5160 O O   . HOH H 5 .   ? 19.712  13.089  -35.323 1.000 51.003 0 836 HOH AAA O   1 ? ?  
HETATM 5161 O O   . HOH H 5 .   ? 21.068  15.789  -37.565 1.000 57.250 0 837 HOH AAA O   1 ? ?  
HETATM 5162 O O   . HOH H 5 .   ? 0.587   9.905   -25.346 1.000 54.491 0 838 HOH AAA O   1 ? ?  
HETATM 5163 O O   . HOH H 5 .   ? 11.669  21.807  -27.714 1.000 48.660 0 839 HOH AAA O   1 ? ?  
HETATM 5164 O O   . HOH H 5 .   ? 11.103  40.373  -55.812 1.000 36.428 0 840 HOH AAA O   1 ? ?  
HETATM 5165 O O   . HOH H 5 .   ? -5.815  14.491  -36.705 1.000 53.845 0 841 HOH AAA O   1 ? ?  
HETATM 5166 O O   . HOH H 5 .   ? 15.103  15.662  -28.329 1.000 48.660 0 842 HOH AAA O   1 ? ?  
HETATM 5167 O O   . HOH H 5 .   ? 19.611  28.085  -49.423 1.000 22.317 0 843 HOH AAA O   1 ? ?  
HETATM 5168 O O   . HOH H 5 .   ? 21.149  43.308  -45.667 1.000 33.797 0 844 HOH AAA O   1 ? ?  
HETATM 5169 O O   . HOH H 5 .   ? 20.991  39.702  -38.145 1.000 28.975 0 845 HOH AAA O   1 ? ?  
HETATM 5170 O O   . HOH H 5 .   ? 6.636   31.181  -47.903 1.000 31.028 0 846 HOH AAA O   1 ? ?  
HETATM 5171 O O   . HOH H 5 .   ? 19.041  30.565  -55.686 1.000 36.958 0 847 HOH AAA O   1 ? ?  
HETATM 5172 O O   . HOH H 5 .   ? 15.479  28.247  -31.266 1.000 36.181 0 848 HOH AAA O   1 ? ?  
HETATM 5173 O O   . HOH H 5 .   ? 18.325  46.472  -44.368 1.000 42.089 0 849 HOH AAA O   1 ? ?  
HETATM 5174 O O   . HOH I 5 .   ? -6.599  38.125  -34.561 1.000 46.398 0 301 HOH BBB O   1 ? ?  
HETATM 5175 O O   . HOH I 5 .   ? 5.334   41.351  -22.814 1.000 27.624 0 302 HOH BBB O   1 ? ?  
HETATM 5176 O O   . HOH I 5 .   ? 9.611   48.759  -32.168 1.000 49.644 0 303 HOH BBB O   1 ? ?  
HETATM 5177 O O   . HOH I 5 .   ? -0.839  29.557  -40.468 1.000 33.494 0 304 HOH BBB O   1 ? ?  
HETATM 5178 O O   . HOH I 5 .   ? -8.782  61.452  -33.596 1.000 35.601 0 305 HOH BBB O   1 ? ?  
HETATM 5179 O O   . HOH I 5 .   ? -7.800  55.781  -35.977 1.000 35.982 0 306 HOH BBB O   1 ? ?  
HETATM 5180 O O   . HOH I 5 .   ? 18.944  42.676  -29.611 1.000 36.095 0 307 HOH BBB O   1 ? ?  
HETATM 5181 O O   . HOH I 5 .   ? -6.380  42.499  -26.027 1.000 50.656 0 308 HOH BBB O   1 ? ?  
HETATM 5182 O O   . HOH I 5 .   ? -7.916  53.414  -15.843 1.000 43.223 0 309 HOH BBB O   1 ? ?  
HETATM 5183 O O   . HOH I 5 .   ? 10.303  61.323  -29.975 1.000 36.651 0 310 HOH BBB O   1 ? ?  
HETATM 5184 O O   . HOH I 5 .   ? 3.392   39.574  -24.054 1.000 34.042 0 311 HOH BBB O   1 ? ?  
HETATM 5185 O O   . HOH I 5 .   ? 6.867   39.007  -50.245 1.000 44.485 0 312 HOH BBB O   1 ? ?  
HETATM 5186 O O   . HOH I 5 .   ? -3.430  36.537  -41.192 1.000 35.593 0 313 HOH BBB O   1 ? ?  
HETATM 5187 O O   . HOH I 5 .   ? -0.600  49.816  -43.670 1.000 36.080 0 314 HOH BBB O   1 ? ?  
HETATM 5188 O O   . HOH I 5 .   ? 12.574  37.384  -34.033 1.000 20.397 0 315 HOH BBB O   1 ? ?  
HETATM 5189 O O   . HOH I 5 .   ? -1.290  45.907  -21.328 1.000 38.807 0 316 HOH BBB O   1 ? ?  
HETATM 5190 O O   . HOH I 5 .   ? 21.043  45.414  -32.809 1.000 28.701 0 317 HOH BBB O   1 ? ?  
HETATM 5191 O O   . HOH I 5 .   ? -1.994  62.689  -36.535 1.000 31.776 0 318 HOH BBB O   1 ? ?  
HETATM 5192 O O   . HOH I 5 .   ? 15.026  38.701  -43.626 1.000 21.573 0 319 HOH BBB O   1 ? ?  
HETATM 5193 O O   . HOH I 5 .   ? 5.837   36.161  -26.102 1.000 30.826 0 320 HOH BBB O   1 ? ?  
HETATM 5194 O O   . HOH I 5 .   ? 1.390   32.601  -40.253 1.000 35.351 0 321 HOH BBB O   1 ? ?  
HETATM 5195 O O   . HOH I 5 .   ? -7.386  50.921  -18.978 1.000 35.090 0 322 HOH BBB O   1 ? ?  
HETATM 5196 O O   . HOH I 5 .   ? 5.241   40.334  -52.136 1.000 47.237 0 323 HOH BBB O   1 ? ?  
HETATM 5197 O O   . HOH I 5 .   ? 5.658   52.946  -18.178 1.000 30.842 0 324 HOH BBB O   1 ? ?  
HETATM 5198 O O   . HOH I 5 .   ? -8.333  47.162  -25.157 1.000 48.492 0 325 HOH BBB O   1 ? ?  
HETATM 5199 O O   . HOH I 5 .   ? -1.081  41.936  -26.552 1.000 28.225 0 326 HOH BBB O   1 ? ?  
HETATM 5200 O O   . HOH I 5 .   ? 3.198   58.148  -23.016 1.000 34.588 0 327 HOH BBB O   1 ? ?  
HETATM 5201 O O   . HOH I 5 .   ? 15.606  45.055  -39.541 1.000 26.889 0 328 HOH BBB O   1 ? ?  
HETATM 5202 O O   . HOH I 5 .   ? 14.896  43.579  -37.354 1.000 27.879 0 329 HOH BBB O   1 ? ?  
HETATM 5203 O O   . HOH I 5 .   ? 0.307   63.417  -27.636 1.000 27.379 0 330 HOH BBB O   1 ? ?  
HETATM 5204 O O   . HOH I 5 .   ? -0.940  36.884  -43.628 1.000 32.974 0 331 HOH BBB O   1 ? ?  
HETATM 5205 O O   . HOH I 5 .   ? 16.638  33.068  -30.181 1.000 45.840 0 332 HOH BBB O   1 ? ?  
HETATM 5206 O O   . HOH I 5 .   ? 13.439  42.334  -23.366 1.000 44.937 0 333 HOH BBB O   1 ? ?  
HETATM 5207 O O   . HOH I 5 .   ? 6.555   33.296  -46.293 1.000 36.578 0 334 HOH BBB O   1 ? ?  
HETATM 5208 O O   . HOH I 5 .   ? -6.932  64.782  -26.295 1.000 37.729 0 335 HOH BBB O   1 ? ?  
HETATM 5209 O O   . HOH I 5 .   ? 9.028   36.312  -39.638 1.000 20.111 0 336 HOH BBB O   1 ? ?  
HETATM 5210 O O   . HOH I 5 .   ? 11.652  31.241  -26.293 1.000 40.843 0 337 HOH BBB O   1 ? ?  
HETATM 5211 O O   . HOH I 5 .   ? 0.823   62.911  -34.438 1.000 30.165 0 338 HOH BBB O   1 ? ?  
HETATM 5212 O O   . HOH I 5 .   ? 10.493  55.610  -27.279 1.000 37.846 0 339 HOH BBB O   1 ? ?  
HETATM 5213 O O   . HOH I 5 .   ? -11.565 51.845  -22.591 1.000 45.208 0 340 HOH BBB O   1 ? ?  
HETATM 5214 O O   . HOH I 5 .   ? 12.087  42.098  -27.844 1.000 28.151 0 341 HOH BBB O   1 ? ?  
HETATM 5215 O O   . HOH I 5 .   ? -5.798  37.967  -37.378 1.000 30.900 0 342 HOH BBB O   1 ? ?  
HETATM 5216 O O   . HOH I 5 .   ? 4.847   45.911  -20.491 1.000 32.759 0 343 HOH BBB O   1 ? ?  
HETATM 5217 O O   . HOH I 5 .   ? -4.981  44.242  -38.654 1.000 26.836 0 344 HOH BBB O   1 ? ?  
HETATM 5218 O O   . HOH I 5 .   ? -7.564  63.660  -17.913 1.000 54.833 0 345 HOH BBB O   1 ? ?  
HETATM 5219 O O   . HOH I 5 .   ? 1.444   40.975  -49.632 1.000 35.313 0 346 HOH BBB O   1 ? ?  
HETATM 5220 O O   . HOH I 5 .   ? 13.231  29.871  -30.760 1.000 29.180 0 347 HOH BBB O   1 ? ?  
HETATM 5221 O O   . HOH I 5 .   ? 2.891   32.951  -31.746 1.000 25.491 0 348 HOH BBB O   1 ? ?  
HETATM 5222 O O   . HOH I 5 .   ? 9.942   49.767  -46.765 1.000 48.151 0 349 HOH BBB O   1 ? ?  
HETATM 5223 O O   . HOH I 5 .   ? 3.712   54.876  -18.219 1.000 51.462 0 350 HOH BBB O   1 ? ?  
HETATM 5224 O O   . HOH I 5 .   ? 4.276   54.878  -43.061 1.000 40.406 0 351 HOH BBB O   1 ? ?  
HETATM 5225 O O   . HOH I 5 .   ? 8.623   34.641  -43.586 1.000 39.108 0 352 HOH BBB O   1 ? ?  
HETATM 5226 O O   . HOH I 5 .   ? 6.268   60.488  -30.821 1.000 25.540 0 353 HOH BBB O   1 ? ?  
HETATM 5227 O O   . HOH I 5 .   ? 10.686  40.478  -42.690 1.000 23.898 0 354 HOH BBB O   1 ? ?  
HETATM 5228 O O   . HOH I 5 .   ? 2.506   61.284  -37.741 1.000 41.113 0 355 HOH BBB O   1 ? ?  
HETATM 5229 O O   . HOH I 5 .   ? 8.427   36.071  -47.645 1.000 42.571 0 356 HOH BBB O   1 ? ?  
HETATM 5230 O O   . HOH I 5 .   ? 2.584   48.116  -45.407 1.000 35.635 0 357 HOH BBB O   1 ? ?  
HETATM 5231 O O   . HOH I 5 .   ? -6.356  56.168  -38.348 1.000 35.084 0 358 HOH BBB O   1 ? ?  
HETATM 5232 O O   . HOH I 5 .   ? 19.091  32.574  -34.799 1.000 31.089 0 359 HOH BBB O   1 ? ?  
HETATM 5233 O O   . HOH I 5 .   ? 9.636   42.017  -21.605 1.000 33.333 0 360 HOH BBB O   1 ? ?  
HETATM 5234 O O   . HOH I 5 .   ? 16.442  41.943  -29.867 1.000 27.632 0 361 HOH BBB O   1 ? ?  
HETATM 5235 O O   . HOH I 5 .   ? 12.975  53.877  -22.991 1.000 41.268 0 362 HOH BBB O   1 ? ?  
HETATM 5236 O O   . HOH I 5 .   ? -9.167  49.469  -30.821 1.000 39.785 0 363 HOH BBB O   1 ? ?  
HETATM 5237 O O   . HOH I 5 .   ? 10.233  56.062  -22.804 1.000 35.672 0 364 HOH BBB O   1 ? ?  
HETATM 5238 O O   . HOH I 5 .   ? 7.250   50.045  -45.921 1.000 34.976 0 365 HOH BBB O   1 ? ?  
HETATM 5239 O O   . HOH I 5 .   ? 12.902  55.262  -30.588 1.000 37.032 0 366 HOH BBB O   1 ? ?  
HETATM 5240 O O   . HOH I 5 .   ? 11.722  46.130  -22.167 1.000 41.657 0 367 HOH BBB O   1 ? ?  
HETATM 5241 O O   . HOH I 5 .   ? -13.160 56.822  -32.655 1.000 43.888 0 368 HOH BBB O   1 ? ?  
HETATM 5242 O O   . HOH I 5 .   ? 3.105   44.164  -19.976 1.000 45.462 0 369 HOH BBB O   1 ? ?  
HETATM 5243 O O   . HOH I 5 .   ? -9.974  48.446  -28.667 1.000 34.300 0 370 HOH BBB O   1 ? ?  
HETATM 5244 O O   . HOH I 5 .   ? 9.654   38.545  -23.045 1.000 32.733 0 371 HOH BBB O   1 ? ?  
HETATM 5245 O O   . HOH I 5 .   ? 2.714   63.692  -26.356 1.000 43.486 0 372 HOH BBB O   1 ? ?  
HETATM 5246 O O   . HOH I 5 .   ? 0.235   48.983  -46.043 1.000 58.699 0 373 HOH BBB O   1 ? ?  
HETATM 5247 O O   . HOH I 5 .   ? -0.760  39.026  -23.392 1.000 51.595 0 374 HOH BBB O   1 ? ?  
HETATM 5248 O O   . HOH I 5 .   ? -10.567 45.713  -40.052 1.000 37.234 0 375 HOH BBB O   1 ? ?  
HETATM 5249 O O   . HOH I 5 .   ? -12.732 54.940  -20.436 1.000 46.547 0 376 HOH BBB O   1 ? ?  
HETATM 5250 O O   . HOH I 5 .   ? 8.349   34.815  -45.460 1.000 38.126 0 377 HOH BBB O   1 ? ?  
HETATM 5251 O O   . HOH I 5 .   ? 5.525   47.661  -46.492 1.000 55.567 0 378 HOH BBB O   1 ? ?  
HETATM 5252 O O   . HOH I 5 .   ? -11.452 68.580  -19.369 1.000 51.380 0 379 HOH BBB O   1 ? ?  
HETATM 5253 O O   . HOH I 5 .   ? 10.909  48.252  -28.476 1.000 40.674 0 380 HOH BBB O   1 ? ?  
HETATM 5254 O O   . HOH I 5 .   ? 4.362   60.417  -23.913 1.000 46.555 0 381 HOH BBB O   1 ? ?  
HETATM 5255 O O   . HOH I 5 .   ? 12.486  39.955  -44.550 1.000 32.111 0 382 HOH BBB O   1 ? ?  
HETATM 5256 O O   . HOH I 5 .   ? -0.039  34.447  -44.234 1.000 45.044 0 383 HOH BBB O   1 ? ?  
HETATM 5257 O O   . HOH I 5 .   ? 19.737  37.079  -34.836 1.000 36.958 0 384 HOH BBB O   1 ? ?  
HETATM 5258 O O   . HOH I 5 .   ? 13.202  49.075  -27.006 1.000 50.972 0 385 HOH BBB O   1 ? ?  
HETATM 5259 O O   . HOH I 5 .   ? 1.580   38.819  -22.325 1.000 42.402 0 386 HOH BBB O   1 ? ?  
HETATM 5260 O O   . HOH I 5 .   ? -6.822  42.909  -39.897 1.000 36.979 0 387 HOH BBB O   1 ? ?  
HETATM 5261 O O   . HOH I 5 .   ? -9.502  58.055  -35.423 1.000 48.501 0 388 HOH BBB O   1 ? ?  
HETATM 5262 O O   . HOH I 5 .   ? -8.347  44.819  -41.255 1.000 35.011 0 389 HOH BBB O   1 ? ?  
HETATM 5263 O O   . HOH I 5 .   ? 5.133   41.362  -20.266 1.000 47.126 0 390 HOH BBB O   1 ? ?  
HETATM 5264 O O   . HOH I 5 .   ? 14.904  51.148  -27.351 1.000 52.571 0 391 HOH BBB O   1 ? ?  
HETATM 5265 O O   . HOH I 5 .   ? 14.765  42.171  -27.488 1.000 44.125 0 392 HOH BBB O   1 ? ?  
HETATM 5266 O O   . HOH I 5 .   ? 9.966   44.821  -20.269 1.000 41.814 0 393 HOH BBB O   1 ? ?  
HETATM 5267 O O   . HOH J 5 .   ? 3.611   1.174   1.573   1.000 38.405 0 701 HOH EEE O   1 ? ?  
HETATM 5268 O O   . HOH J 5 .   ? 8.918   -21.350 14.183  1.000 38.911 0 702 HOH EEE O   1 ? ?  
HETATM 5269 O O   . HOH J 5 .   ? 10.899  -45.411 -12.705 1.000 45.024 0 703 HOH EEE O   1 ? ?  
HETATM 5270 O O   . HOH J 5 .   ? 16.399  -18.259 -10.888 1.000 44.147 0 704 HOH EEE O   1 ? ?  
HETATM 5271 O O   . HOH J 5 .   ? 15.527  -39.674 11.940  1.000 54.408 0 705 HOH EEE O   1 ? ?  
HETATM 5272 O O   . HOH J 5 .   ? 27.633  -36.925 -2.810  1.000 48.367 0 706 HOH EEE O   1 ? ?  
HETATM 5273 O O   . HOH J 5 .   ? 13.901  -34.806 -11.431 1.000 30.790 0 707 HOH EEE O   1 ? ?  
HETATM 5274 O O   . HOH J 5 .   ? 25.758  -19.221 2.085   1.000 32.109 0 708 HOH EEE O   1 ? ?  
HETATM 5275 O O   . HOH J 5 .   ? 14.778  -32.955 5.787   1.000 28.459 0 709 HOH EEE O   1 ? ?  
HETATM 5276 O O   . HOH J 5 .   ? 14.203  -22.170 -13.837 1.000 33.906 0 710 HOH EEE O   1 ? ?  
HETATM 5277 O O   . HOH J 5 .   ? 17.928  -8.331  -11.121 1.000 47.580 0 711 HOH EEE O   1 ? ?  
HETATM 5278 O O   . HOH J 5 .   ? -0.236  -38.189 -13.257 1.000 30.835 0 712 HOH EEE O   1 ? ?  
HETATM 5279 O O   . HOH J 5 .   ? 9.985   -37.231 -16.847 1.000 46.993 0 713 HOH EEE O   1 ? ?  
HETATM 5280 O O   . HOH J 5 .   ? 22.988  -31.151 14.371  1.000 49.371 0 714 HOH EEE O   1 ? ?  
HETATM 5281 O O   . HOH J 5 .   ? 24.762  -14.311 -8.157  1.000 47.868 0 715 HOH EEE O   1 ? ?  
HETATM 5282 O O   . HOH J 5 .   ? 15.763  -29.206 -13.019 1.000 36.076 0 716 HOH EEE O   1 ? ?  
HETATM 5283 O O   . HOH J 5 .   ? -0.883  -40.059 -15.156 1.000 21.141 0 717 HOH EEE O   1 ? ?  
HETATM 5284 O O   . HOH J 5 .   ? 25.489  -20.323 10.649  1.000 29.785 0 718 HOH EEE O   1 ? ?  
HETATM 5285 O O   . HOH J 5 .   ? 4.967   -31.966 -9.390  1.000 20.861 0 719 HOH EEE O   1 ? ?  
HETATM 5286 O O   . HOH J 5 .   ? 1.133   2.104   -0.316  1.000 36.240 0 720 HOH EEE O   1 ? ?  
HETATM 5287 O O   . HOH J 5 .   ? 2.734   -47.706 -12.050 1.000 31.376 0 721 HOH EEE O   1 ? ?  
HETATM 5288 O O   . HOH J 5 .   ? 7.365   -32.057 6.353   1.000 30.720 0 722 HOH EEE O   1 ? ?  
HETATM 5289 O O   . HOH J 5 .   ? 22.518  -39.842 12.152  1.000 41.576 0 723 HOH EEE O   1 ? ?  
HETATM 5290 O O   . HOH J 5 .   ? 28.999  -3.199  0.005   1.000 42.746 0 724 HOH EEE O   1 ? ?  
HETATM 5291 O O   . HOH J 5 .   ? 23.068  -32.085 7.344   1.000 29.831 0 725 HOH EEE O   1 ? ?  
HETATM 5292 O O   . HOH J 5 .   ? 4.141   -47.620 -23.654 1.000 38.602 0 726 HOH EEE O   1 ? ?  
HETATM 5293 O O   . HOH J 5 .   ? 24.885  -17.864 11.475  1.000 34.967 0 727 HOH EEE O   1 ? ?  
HETATM 5294 O O   . HOH J 5 .   ? 26.526  -26.750 -5.956  1.000 28.776 0 728 HOH EEE O   1 ? ?  
HETATM 5295 O O   . HOH J 5 .   ? 16.400  -18.790 12.429  1.000 32.709 0 729 HOH EEE O   1 ? ?  
HETATM 5296 O O   . HOH J 5 .   ? 1.022   -23.445 -8.090  1.000 45.000 0 730 HOH EEE O   1 ? ?  
HETATM 5297 O O   . HOH J 5 .   ? 19.725  -30.025 -6.226  1.000 43.287 0 731 HOH EEE O   1 ? ?  
HETATM 5298 O O   . HOH J 5 .   ? 4.276   -22.961 -13.809 1.000 35.473 0 732 HOH EEE O   1 ? ?  
HETATM 5299 O O   . HOH J 5 .   ? 19.767  -34.680 1.051   1.000 27.573 0 733 HOH EEE O   1 ? ?  
HETATM 5300 O O   . HOH J 5 .   ? 15.429  -16.034 -13.495 1.000 37.659 0 734 HOH EEE O   1 ? ?  
HETATM 5301 O O   . HOH J 5 .   ? 25.452  -23.073 -3.306  1.000 24.886 0 735 HOH EEE O   1 ? ?  
HETATM 5302 O O   . HOH J 5 .   ? 7.221   -26.916 -5.523  1.000 20.552 0 736 HOH EEE O   1 ? ?  
HETATM 5303 O O   . HOH J 5 .   ? 3.960   -43.882 -16.472 1.000 23.317 0 737 HOH EEE O   1 ? ?  
HETATM 5304 O O   . HOH J 5 .   ? 9.041   -15.825 5.476   1.000 19.747 0 738 HOH EEE O   1 ? ?  
HETATM 5305 O O   . HOH J 5 .   ? 14.564  0.599   2.223   1.000 43.848 0 739 HOH EEE O   1 ? ?  
HETATM 5306 O O   . HOH J 5 .   ? -2.369  -39.527 -11.512 1.000 33.338 0 740 HOH EEE O   1 ? ?  
HETATM 5307 O O   . HOH J 5 .   ? 24.279  -18.089 -8.217  1.000 28.250 0 741 HOH EEE O   1 ? ?  
HETATM 5308 O O   . HOH J 5 .   ? 14.874  -11.852 17.167  1.000 38.554 0 742 HOH EEE O   1 ? ?  
HETATM 5309 O O   . HOH J 5 .   ? 2.870   -9.288  8.006   1.000 48.062 0 743 HOH EEE O   1 ? ?  
HETATM 5310 O O   . HOH J 5 .   ? 0.622   -42.256 -2.554  1.000 31.922 0 744 HOH EEE O   1 ? ?  
HETATM 5311 O O   . HOH J 5 .   ? 6.864   -24.214 -4.746  1.000 19.441 0 745 HOH EEE O   1 ? ?  
HETATM 5312 O O   . HOH J 5 .   ? 17.053  -31.389 -3.600  1.000 33.597 0 746 HOH EEE O   1 ? ?  
HETATM 5313 O O   . HOH J 5 .   ? 7.137   -29.774 4.819   1.000 33.268 0 747 HOH EEE O   1 ? ?  
HETATM 5314 O O   . HOH J 5 .   ? 3.234   -34.051 -9.907  1.000 23.282 0 748 HOH EEE O   1 ? ?  
HETATM 5315 O O   . HOH J 5 .   ? 26.339  -32.074 -4.994  1.000 26.777 0 749 HOH EEE O   1 ? ?  
HETATM 5316 O O   . HOH J 5 .   ? 27.644  -31.315 -1.898  1.000 30.332 0 750 HOH EEE O   1 ? ?  
HETATM 5317 O O   . HOH J 5 .   ? 0.457   -46.657 -4.136  1.000 25.056 0 751 HOH EEE O   1 ? ?  
HETATM 5318 O O   . HOH J 5 .   ? 4.514   -36.139 -16.657 1.000 25.145 0 752 HOH EEE O   1 ? ?  
HETATM 5319 O O   . HOH J 5 .   ? 2.980   -30.080 -9.989  1.000 25.418 0 753 HOH EEE O   1 ? ?  
HETATM 5320 O O   . HOH J 5 .   ? 19.243  -39.252 5.020   1.000 22.573 0 754 HOH EEE O   1 ? ?  
HETATM 5321 O O   . HOH J 5 .   ? 14.433  -27.828 12.586  1.000 34.297 0 755 HOH EEE O   1 ? ?  
HETATM 5322 O O   . HOH J 5 .   ? 8.960   -19.169 -6.391  1.000 27.173 0 756 HOH EEE O   1 ? ?  
HETATM 5323 O O   . HOH J 5 .   ? 18.610  -42.527 8.684   1.000 33.147 0 757 HOH EEE O   1 ? ?  
HETATM 5324 O O   . HOH J 5 .   ? 22.058  -22.319 -12.985 1.000 39.655 0 758 HOH EEE O   1 ? ?  
HETATM 5325 O O   . HOH J 5 .   ? 15.627  -19.393 -7.874  1.000 24.473 0 759 HOH EEE O   1 ? ?  
HETATM 5326 O O   . HOH J 5 .   ? 1.897   -32.207 -7.722  1.000 23.339 0 760 HOH EEE O   1 ? ?  
HETATM 5327 O O   . HOH J 5 .   ? 2.484   1.255   -9.802  1.000 39.270 0 761 HOH EEE O   1 ? ?  
HETATM 5328 O O   . HOH J 5 .   ? 11.015  -17.268 8.606   1.000 22.588 0 762 HOH EEE O   1 ? ?  
HETATM 5329 O O   . HOH J 5 .   ? 5.539   -46.409 -19.538 1.000 47.014 0 763 HOH EEE O   1 ? ?  
HETATM 5330 O O   . HOH J 5 .   ? 6.965   -42.235 -5.481  1.000 22.987 0 764 HOH EEE O   1 ? ?  
HETATM 5331 O O   . HOH J 5 .   ? 3.371   -28.138 -14.610 1.000 38.030 0 765 HOH EEE O   1 ? ?  
HETATM 5332 O O   . HOH J 5 .   ? -0.790  -44.069 -4.337  1.000 26.638 0 766 HOH EEE O   1 ? ?  
HETATM 5333 O O   . HOH J 5 .   ? 21.962  -15.144 -4.689  1.000 24.232 0 767 HOH EEE O   1 ? ?  
HETATM 5334 O O   . HOH J 5 .   ? 22.942  -26.498 -7.243  1.000 24.415 0 768 HOH EEE O   1 ? ?  
HETATM 5335 O O   . HOH J 5 .   ? 24.980  -7.359  -3.005  1.000 39.285 0 769 HOH EEE O   1 ? ?  
HETATM 5336 O O   . HOH J 5 .   ? 1.684   -49.216 -6.520  1.000 37.922 0 770 HOH EEE O   1 ? ?  
HETATM 5337 O O   . HOH J 5 .   ? 9.132   -27.232 8.261   1.000 40.154 0 771 HOH EEE O   1 ? ?  
HETATM 5338 O O   . HOH J 5 .   ? 9.953   -20.196 6.849   1.000 20.897 0 772 HOH EEE O   1 ? ?  
HETATM 5339 O O   . HOH J 5 .   ? 7.921   -3.336  -7.797  1.000 39.046 0 773 HOH EEE O   1 ? ?  
HETATM 5340 O O   . HOH J 5 .   ? 10.887  -12.145 -1.537  1.000 23.924 0 774 HOH EEE O   1 ? ?  
HETATM 5341 O O   . HOH J 5 .   ? 5.806   -39.148 -19.163 1.000 47.196 0 775 HOH EEE O   1 ? ?  
HETATM 5342 O O   . HOH J 5 .   ? 1.095   -46.703 -10.381 1.000 27.257 0 776 HOH EEE O   1 ? ?  
HETATM 5343 O O   . HOH J 5 .   ? 9.352   -39.972 -5.578  1.000 21.231 0 777 HOH EEE O   1 ? ?  
HETATM 5344 O O   . HOH J 5 .   ? 1.569   -30.225 0.255   1.000 24.687 0 778 HOH EEE O   1 ? ?  
HETATM 5345 O O   . HOH J 5 .   ? 13.174  -40.663 -6.831  1.000 33.789 0 779 HOH EEE O   1 ? ?  
HETATM 5346 O O   . HOH J 5 .   ? 13.039  -27.777 2.592   1.000 17.336 0 780 HOH EEE O   1 ? ?  
HETATM 5347 O O   . HOH J 5 .   ? 11.586  -22.019 -12.761 1.000 28.603 0 781 HOH EEE O   1 ? ?  
HETATM 5348 O O   . HOH J 5 .   ? -2.374  -37.890 -8.375  1.000 37.749 0 782 HOH EEE O   1 ? ?  
HETATM 5349 O O   . HOH J 5 .   ? 5.352   7.539   -3.067  1.000 25.156 0 783 HOH EEE O   1 ? ?  
HETATM 5350 O O   . HOH J 5 .   ? 26.864  -19.855 7.183   1.000 31.011 0 784 HOH EEE O   1 ? ?  
HETATM 5351 O O   . HOH J 5 .   ? 16.010  -18.356 -15.837 1.000 44.901 0 785 HOH EEE O   1 ? ?  
HETATM 5352 O O   . HOH J 5 .   ? 6.862   -26.134 5.064   1.000 34.126 0 786 HOH EEE O   1 ? ?  
HETATM 5353 O O   . HOH J 5 .   ? 3.258   -44.373 -0.566  1.000 23.945 0 787 HOH EEE O   1 ? ?  
HETATM 5354 O O   . HOH J 5 .   ? 12.900  -36.373 11.119  1.000 26.307 0 788 HOH EEE O   1 ? ?  
HETATM 5355 O O   . HOH J 5 .   ? 21.763  0.666   3.813   1.000 38.199 0 789 HOH EEE O   1 ? ?  
HETATM 5356 O O   . HOH J 5 .   ? 10.038  -9.517  14.675  1.000 44.882 0 790 HOH EEE O   1 ? ?  
HETATM 5357 O O   . HOH J 5 .   ? 26.105  -10.139 5.890   1.000 31.282 0 791 HOH EEE O   1 ? ?  
HETATM 5358 O O   . HOH J 5 .   ? 10.483  -33.536 -13.647 1.000 23.429 0 792 HOH EEE O   1 ? ?  
HETATM 5359 O O   . HOH J 5 .   ? 14.958  -31.160 -14.031 1.000 46.350 0 793 HOH EEE O   1 ? ?  
HETATM 5360 O O   . HOH J 5 .   ? 25.195  -24.595 11.929  1.000 31.939 0 794 HOH EEE O   1 ? ?  
HETATM 5361 O O   . HOH J 5 .   ? 2.762   -36.042 -14.497 1.000 22.385 0 795 HOH EEE O   1 ? ?  
HETATM 5362 O O   . HOH J 5 .   ? 3.708   -31.369 -12.618 1.000 30.545 0 796 HOH EEE O   1 ? ?  
HETATM 5363 O O   . HOH J 5 .   ? 2.415   -34.008 -12.404 1.000 24.799 0 797 HOH EEE O   1 ? ?  
HETATM 5364 O O   . HOH J 5 .   ? 8.927   -25.401 -18.343 1.000 39.360 0 798 HOH EEE O   1 ? ?  
HETATM 5365 O O   . HOH J 5 .   ? 21.827  -6.270  -9.950  1.000 38.295 0 799 HOH EEE O   1 ? ?  
HETATM 5366 O O   . HOH J 5 .   ? 21.900  -10.811 12.322  1.000 43.367 0 800 HOH EEE O   1 ? ?  
HETATM 5367 O O   . HOH J 5 .   ? -3.497  -40.672 -14.775 1.000 24.993 0 801 HOH EEE O   1 ? ?  
HETATM 5368 O O   . HOH J 5 .   ? 6.602   -34.624 -17.527 1.000 37.492 0 802 HOH EEE O   1 ? ?  
HETATM 5369 O O   . HOH J 5 .   ? 27.399  -12.923 -0.215  1.000 32.723 0 803 HOH EEE O   1 ? ?  
HETATM 5370 O O   . HOH J 5 .   ? 10.374  -29.877 -16.451 1.000 44.357 0 804 HOH EEE O   1 ? ?  
HETATM 5371 O O   . HOH J 5 .   ? 12.136  -13.835 -15.470 1.000 43.790 0 805 HOH EEE O   1 ? ?  
HETATM 5372 O O   . HOH J 5 .   ? 3.692   -50.179 -9.540  1.000 27.529 0 806 HOH EEE O   1 ? ?  
HETATM 5373 O O   . HOH J 5 .   ? 1.809   -19.259 -6.669  1.000 29.663 0 807 HOH EEE O   1 ? ?  
HETATM 5374 O O   . HOH J 5 .   ? 28.528  -26.653 9.939   1.000 44.834 0 808 HOH EEE O   1 ? ?  
HETATM 5375 O O   . HOH J 5 .   ? 2.643   -11.752 -2.292  1.000 38.092 0 809 HOH EEE O   1 ? ?  
HETATM 5376 O O   . HOH J 5 .   ? -8.039  -42.337 -9.618  1.000 40.020 0 810 HOH EEE O   1 ? ?  
HETATM 5377 O O   . HOH J 5 .   ? 19.658  -12.064 12.354  1.000 56.281 0 811 HOH EEE O   1 ? ?  
HETATM 5378 O O   . HOH J 5 .   ? 7.914   7.420   0.925   1.000 34.929 0 812 HOH EEE O   1 ? ?  
HETATM 5379 O O   . HOH J 5 .   ? 2.354   -11.530 5.726   1.000 44.180 0 813 HOH EEE O   1 ? ?  
HETATM 5380 O O   . HOH J 5 .   ? 5.978   -11.446 -5.825  1.000 41.955 0 814 HOH EEE O   1 ? ?  
HETATM 5381 O O   . HOH J 5 .   ? 9.680   -46.379 -10.603 1.000 25.533 0 815 HOH EEE O   1 ? ?  
HETATM 5382 O O   . HOH J 5 .   ? 0.208   -37.202 -17.823 1.000 31.727 0 816 HOH EEE O   1 ? ?  
HETATM 5383 O O   . HOH J 5 .   ? 5.147   -5.264  8.650   1.000 40.605 0 817 HOH EEE O   1 ? ?  
HETATM 5384 O O   . HOH J 5 .   ? -0.196  -25.413 -5.494  1.000 26.261 0 818 HOH EEE O   1 ? ?  
HETATM 5385 O O   . HOH J 5 .   ? -2.897  -39.491 -5.357  1.000 39.416 0 819 HOH EEE O   1 ? ?  
HETATM 5386 O O   . HOH J 5 .   ? 12.712  -29.553 11.387  1.000 33.313 0 820 HOH EEE O   1 ? ?  
HETATM 5387 O O   . HOH J 5 .   ? 9.564   -19.482 9.438   1.000 26.464 0 821 HOH EEE O   1 ? ?  
HETATM 5388 O O   . HOH J 5 .   ? 5.520   -47.330 -17.024 1.000 33.359 0 822 HOH EEE O   1 ? ?  
HETATM 5389 O O   . HOH J 5 .   ? 18.833  -33.360 -2.420  1.000 42.303 0 823 HOH EEE O   1 ? ?  
HETATM 5390 O O   . HOH J 5 .   ? 11.571  -8.301  -7.751  1.000 33.071 0 824 HOH EEE O   1 ? ?  
HETATM 5391 O O   . HOH J 5 .   ? 3.314   -18.033 3.409   1.000 33.107 0 825 HOH EEE O   1 ? ?  
HETATM 5392 O O   . HOH J 5 .   ? 9.297   -18.934 15.755  1.000 31.268 0 826 HOH EEE O   1 ? ?  
HETATM 5393 O O   . HOH J 5 .   ? 22.314  -30.474 -5.301  1.000 40.639 0 827 HOH EEE O   1 ? ?  
HETATM 5394 O O   . HOH J 5 .   ? 16.681  9.366   10.208  1.000 47.191 0 828 HOH EEE O   1 ? ?  
HETATM 5395 O O   . HOH J 5 .   ? 28.961  -27.802 14.978  1.000 48.726 0 829 HOH EEE O   1 ? ?  
HETATM 5396 O O   . HOH J 5 .   ? 23.111  -17.335 -4.168  1.000 44.168 0 830 HOH EEE O   1 ? ?  
HETATM 5397 O O   . HOH J 5 .   ? 9.139   -36.124 8.809   1.000 38.182 0 831 HOH EEE O   1 ? ?  
HETATM 5398 O O   . HOH J 5 .   ? 25.131  -17.583 -3.308  1.000 48.375 0 832 HOH EEE O   1 ? ?  
HETATM 5399 O O   . HOH J 5 .   ? 0.303   -21.443 -2.339  1.000 40.179 0 833 HOH EEE O   1 ? ?  
HETATM 5400 O O   . HOH J 5 .   ? 16.694  -31.054 13.759  1.000 40.490 0 834 HOH EEE O   1 ? ?  
HETATM 5401 O O   . HOH J 5 .   ? 10.166  -43.929 -18.624 1.000 48.563 0 835 HOH EEE O   1 ? ?  
HETATM 5402 O O   . HOH J 5 .   ? -1.181  -47.276 -11.888 1.000 51.270 0 836 HOH EEE O   1 ? ?  
HETATM 5403 O O   . HOH J 5 .   ? 0.786   -25.642 -9.276  1.000 52.993 0 837 HOH EEE O   1 ? ?  
HETATM 5404 O O   . HOH J 5 .   ? 17.837  -34.669 -5.349  1.000 43.484 0 838 HOH EEE O   1 ? ?  
HETATM 5405 O O   . HOH J 5 .   ? 22.923  -23.549 13.030  1.000 35.959 0 839 HOH EEE O   1 ? ?  
HETATM 5406 O O   . HOH J 5 .   ? -3.276  -35.124 -4.098  1.000 45.700 0 840 HOH EEE O   1 ? ?  
HETATM 5407 O O   . HOH J 5 .   ? 5.276   -48.410 -21.430 1.000 39.471 0 841 HOH EEE O   1 ? ?  
HETATM 5408 O O   . HOH J 5 .   ? 2.371   -5.747  7.741   1.000 65.041 0 842 HOH EEE O   1 ? ?  
HETATM 5409 O O   . HOH J 5 .   ? 19.586  -14.940 11.926  1.000 44.410 0 843 HOH EEE O   1 ? ?  
HETATM 5410 O O   . HOH J 5 .   ? 12.513  -46.875 -13.916 1.000 45.848 0 844 HOH EEE O   1 ? ?  
HETATM 5411 O O   . HOH J 5 .   ? -0.799  -22.885 -4.411  1.000 34.354 0 845 HOH EEE O   1 ? ?  
HETATM 5412 O O   . HOH J 5 .   ? 2.271   -16.390 -4.553  1.000 50.403 0 846 HOH EEE O   1 ? ?  
HETATM 5413 O O   . HOH J 5 .   ? 14.794  7.192   11.829  1.000 60.416 0 847 HOH EEE O   1 ? ?  
HETATM 5414 O O   . HOH J 5 .   ? 22.237  -34.394 -5.734  1.000 44.149 0 848 HOH EEE O   1 ? ?  
HETATM 5415 O O   . HOH J 5 .   ? 0.330   -36.163 -15.287 1.000 34.646 0 849 HOH EEE O   1 ? ?  
HETATM 5416 O O   . HOH J 5 .   ? 26.404  -20.567 -2.542  1.000 38.432 0 850 HOH EEE O   1 ? ?  
HETATM 5417 O O   . HOH J 5 .   ? 3.833   -37.955 -20.542 1.000 46.221 0 851 HOH EEE O   1 ? ?  
HETATM 5418 O O   . HOH J 5 .   ? 11.017  -41.339 -7.894  1.000 44.735 0 852 HOH EEE O   1 ? ?  
HETATM 5419 O O   . HOH J 5 .   ? 12.616  -35.090 -13.805 1.000 34.976 0 853 HOH EEE O   1 ? ?  
HETATM 5420 O O   . HOH J 5 .   ? 23.373  -33.345 15.760  1.000 53.241 0 854 HOH EEE O   1 ? ?  
HETATM 5421 O O   . HOH J 5 .   ? 15.277  -37.174 -11.017 1.000 34.729 0 855 HOH EEE O   1 ? ?  
HETATM 5422 O O   . HOH J 5 .   ? 3.995   7.681   3.505   1.000 52.047 0 856 HOH EEE O   1 ? ?  
HETATM 5423 O O   . HOH J 5 .   ? 1.094   -45.951 -1.463  1.000 33.717 0 857 HOH EEE O   1 ? ?  
HETATM 5424 O O   . HOH J 5 .   ? 0.869   -49.366 -9.088  1.000 35.463 0 858 HOH EEE O   1 ? ?  
HETATM 5425 O O   . HOH J 5 .   ? 1.848   -17.537 -8.692  1.000 51.481 0 859 HOH EEE O   1 ? ?  
HETATM 5426 O O   . HOH J 5 .   ? 27.139  -21.249 0.963   1.000 49.847 0 860 HOH EEE O   1 ? ?  
HETATM 5427 O O   . HOH J 5 .   ? 33.182  -34.057 4.396   1.000 34.712 0 861 HOH EEE O   1 ? ?  
HETATM 5428 O O   . HOH K 5 .   ? 28.624  -44.496 1.786   1.000 48.694 0 201 HOH FFF O   1 ? ?  
HETATM 5429 O O   . HOH K 5 .   ? 5.184   -52.526 -13.375 1.000 47.180 0 202 HOH FFF O   1 ? ?  
HETATM 5430 O O   . HOH K 5 .   ? 16.233  -42.710 10.670  1.000 33.182 0 203 HOH FFF O   1 ? ?  
HETATM 5431 O O   . HOH K 5 .   ? 19.743  -62.686 -7.180  1.000 45.049 0 204 HOH FFF O   1 ? ?  
HETATM 5432 O O   . HOH K 5 .   ? 16.838  -47.766 13.826  1.000 37.140 0 205 HOH FFF O   1 ? ?  
HETATM 5433 O O   . HOH K 5 .   ? 22.499  -57.342 -0.235  1.000 51.365 0 206 HOH FFF O   1 ? ?  
HETATM 5434 O O   . HOH K 5 .   ? 10.255  -37.916 10.528  1.000 36.827 0 207 HOH FFF O   1 ? ?  
HETATM 5435 O O   . HOH K 5 .   ? 15.403  -39.224 -9.207  1.000 31.644 0 208 HOH FFF O   1 ? ?  
HETATM 5436 O O   . HOH K 5 .   ? 22.674  -56.064 -6.894  1.000 41.148 0 209 HOH FFF O   1 ? ?  
HETATM 5437 O O   . HOH K 5 .   ? 20.600  -47.116 -12.824 1.000 35.902 0 210 HOH FFF O   1 ? ?  
HETATM 5438 O O   . HOH K 5 .   ? 16.381  -36.807 -0.992  1.000 28.875 0 211 HOH FFF O   1 ? ?  
HETATM 5439 O O   . HOH K 5 .   ? 3.115   -48.948 6.994   1.000 38.479 0 212 HOH FFF O   1 ? ?  
HETATM 5440 O O   . HOH K 5 .   ? 30.402  -68.158 2.149   1.000 42.325 0 213 HOH FFF O   1 ? ?  
HETATM 5441 O O   . HOH K 5 .   ? 22.970  -35.620 -3.581  1.000 33.927 0 214 HOH FFF O   1 ? ?  
HETATM 5442 O O   . HOH K 5 .   ? 13.154  -42.442 -2.833  1.000 19.624 0 215 HOH FFF O   1 ? ?  
HETATM 5443 O O   . HOH K 5 .   ? 16.004  -71.117 1.620   1.000 25.579 0 216 HOH FFF O   1 ? ?  
HETATM 5444 O O   . HOH K 5 .   ? 15.377  -61.774 -5.961  1.000 42.383 0 217 HOH FFF O   1 ? ?  
HETATM 5445 O O   . HOH K 5 .   ? 22.991  -43.062 -6.863  1.000 32.995 0 218 HOH FFF O   1 ? ?  
HETATM 5446 O O   . HOH K 5 .   ? 19.015  -64.731 13.298  1.000 44.871 0 219 HOH FFF O   1 ? ?  
HETATM 5447 O O   . HOH K 5 .   ? 23.275  -48.456 9.898   1.000 39.146 0 220 HOH FFF O   1 ? ?  
HETATM 5448 O O   . HOH K 5 .   ? 20.841  -69.190 1.835   1.000 32.855 0 221 HOH FFF O   1 ? ?  
HETATM 5449 O O   . HOH K 5 .   ? 20.698  -38.725 -3.540  1.000 34.809 0 222 HOH FFF O   1 ? ?  
HETATM 5450 O O   . HOH K 5 .   ? 7.053   -44.667 -7.063  1.000 21.296 0 223 HOH FFF O   1 ? ?  
HETATM 5451 O O   . HOH K 5 .   ? 9.479   -43.709 2.810   1.000 19.549 0 224 HOH FFF O   1 ? ?  
HETATM 5452 O O   . HOH K 5 .   ? 23.359  -69.136 -0.253  1.000 31.113 0 225 HOH FFF O   1 ? ?  
HETATM 5453 O O   . HOH K 5 .   ? 27.780  -44.127 -0.689  1.000 38.714 0 226 HOH FFF O   1 ? ?  
HETATM 5454 O O   . HOH K 5 .   ? 17.530  -60.767 -6.803  1.000 44.564 0 227 HOH FFF O   1 ? ?  
HETATM 5455 O O   . HOH K 5 .   ? 7.127   -49.750 -0.919  1.000 27.241 0 228 HOH FFF O   1 ? ?  
HETATM 5456 O O   . HOH K 5 .   ? 15.316  -44.901 -13.614 1.000 50.713 0 229 HOH FFF O   1 ? ?  
HETATM 5457 O O   . HOH K 5 .   ? 1.028   -51.746 3.584   1.000 30.705 0 230 HOH FFF O   1 ? ?  
HETATM 5458 O O   . HOH K 5 .   ? 21.409  -69.995 8.544   1.000 33.516 0 231 HOH FFF O   1 ? ?  
HETATM 5459 O O   . HOH K 5 .   ? 27.097  -50.709 -2.091  1.000 26.645 0 232 HOH FFF O   1 ? ?  
HETATM 5460 O O   . HOH K 5 .   ? 11.530  -67.679 -0.181  1.000 35.059 0 233 HOH FFF O   1 ? ?  
HETATM 5461 O O   . HOH K 5 .   ? 6.432   -51.181 -3.134  1.000 25.982 0 234 HOH FFF O   1 ? ?  
HETATM 5462 O O   . HOH K 5 .   ? 8.932   -36.270 6.207   1.000 27.762 0 235 HOH FFF O   1 ? ?  
HETATM 5463 O O   . HOH K 5 .   ? 3.111   -39.048 2.096   1.000 28.185 0 236 HOH FFF O   1 ? ?  
HETATM 5464 O O   . HOH K 5 .   ? 11.388  -46.564 -6.115  1.000 24.803 0 237 HOH FFF O   1 ? ?  
HETATM 5465 O O   . HOH K 5 .   ? 9.112   -61.259 5.911   1.000 41.545 0 238 HOH FFF O   1 ? ?  
HETATM 5466 O O   . HOH K 5 .   ? 19.688  -54.203 -8.971  1.000 30.825 0 239 HOH FFF O   1 ? ?  
HETATM 5467 O O   . HOH K 5 .   ? 9.121   -65.064 1.079   1.000 42.521 0 240 HOH FFF O   1 ? ?  
HETATM 5468 O O   . HOH K 5 .   ? 27.871  -62.714 -2.296  1.000 39.472 0 241 HOH FFF O   1 ? ?  
HETATM 5469 O O   . HOH K 5 .   ? 5.731   -48.295 6.637   1.000 27.696 0 242 HOH FFF O   1 ? ?  
HETATM 5470 O O   . HOH K 5 .   ? 10.570  -70.598 6.212   1.000 41.024 0 243 HOH FFF O   1 ? ?  
HETATM 5471 O O   . HOH K 5 .   ? 8.401   -48.697 12.810  1.000 43.369 0 244 HOH FFF O   1 ? ?  
HETATM 5472 O O   . HOH K 5 .   ? 14.713  -55.951 -9.350  1.000 38.629 0 245 HOH FFF O   1 ? ?  
HETATM 5473 O O   . HOH K 5 .   ? 12.067  -55.542 -10.395 1.000 51.327 0 246 HOH FFF O   1 ? ?  
HETATM 5474 O O   . HOH K 5 .   ? 25.230  -55.519 -6.318  1.000 40.156 0 247 HOH FFF O   1 ? ?  
HETATM 5475 O O   . HOH K 5 .   ? 10.355  -52.697 14.241  1.000 38.669 0 248 HOH FFF O   1 ? ?  
HETATM 5476 O O   . HOH K 5 .   ? 10.065  -48.589 8.801   1.000 33.883 0 249 HOH FFF O   1 ? ?  
HETATM 5477 O O   . HOH K 5 .   ? 15.406  -66.782 5.584   1.000 26.570 0 250 HOH FFF O   1 ? ?  
HETATM 5478 O O   . HOH K 5 .   ? 8.615   -51.686 0.725   1.000 33.284 0 251 HOH FFF O   1 ? ?  
HETATM 5479 O O   . HOH K 5 .   ? 13.799  -41.868 -11.057 1.000 49.316 0 252 HOH FFF O   1 ? ?  
HETATM 5480 O O   . HOH K 5 .   ? 31.270  -55.752 5.688   1.000 36.141 0 253 HOH FFF O   1 ? ?  
HETATM 5481 O O   . HOH K 5 .   ? 14.221  -69.152 -3.401  1.000 39.908 0 254 HOH FFF O   1 ? ?  
HETATM 5482 O O   . HOH K 5 .   ? 19.124  -67.124 -1.937  1.000 39.421 0 255 HOH FFF O   1 ? ?  
HETATM 5483 O O   . HOH K 5 .   ? 12.277  -44.945 13.700  1.000 35.635 0 256 HOH FFF O   1 ? ?  
HETATM 5484 O O   . HOH K 5 .   ? 14.160  -40.605 -8.754  1.000 46.396 0 257 HOH FFF O   1 ? ?  
HETATM 5485 O O   . HOH K 5 .   ? 22.806  -64.372 -4.511  1.000 48.474 0 258 HOH FFF O   1 ? ?  
HETATM 5486 O O   . HOH K 5 .   ? 0.422   -47.862 0.662   1.000 46.093 0 259 HOH FFF O   1 ? ?  
HETATM 5487 O O   . HOH K 5 .   ? 12.637  -54.527 3.941   1.000 41.726 0 260 HOH FFF O   1 ? ?  
HETATM 5488 O O   . HOH K 5 .   ? 5.591   -54.561 -5.278  1.000 47.483 0 261 HOH FFF O   1 ? ?  
HETATM 5489 O O   . HOH K 5 .   ? 8.969   -67.229 -0.496  1.000 44.993 0 262 HOH FFF O   1 ? ?  
HETATM 5490 O O   . HOH K 5 .   ? 12.481  -66.616 -2.389  1.000 51.535 0 263 HOH FFF O   1 ? ?  
HETATM 5491 O O   . HOH K 5 .   ? 19.961  -45.057 -13.957 1.000 51.133 0 264 HOH FFF O   1 ? ?  
HETATM 5492 O O   . HOH K 5 .   ? 9.635   -45.509 -8.073  1.000 28.548 0 265 HOH FFF O   1 ? ?  
HETATM 5493 O O   . HOH K 5 .   ? 12.785  -61.446 -6.705  1.000 49.089 0 266 HOH FFF O   1 ? ?  
HETATM 5494 O O   . HOH K 5 .   ? 25.281  -64.589 -3.682  1.000 52.629 0 267 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   ? 0.866 0.662 0.697 0.023  -0.089 0.009  334 ASN AAA N   
2    C CA  . ASN A 5   ? 0.853 0.674 0.727 0.027  -0.096 0.002  334 ASN AAA CA  
3    C C   . ASN A 5   ? 0.742 0.607 0.628 0.020  -0.057 0.008  334 ASN AAA C   
4    O O   . ASN A 5   ? 0.665 0.568 0.588 0.018  -0.039 0.007  334 ASN AAA O   
5    C CB  . ASN A 5   ? 0.868 0.721 0.834 0.036  -0.113 -0.014 334 ASN AAA CB  
6    C CG  . ASN A 5   ? 0.909 0.770 0.930 0.039  -0.130 -0.025 334 ASN AAA CG  
7    O OD1 . ASN A 5   ? 0.956 0.830 0.963 0.034  -0.109 -0.018 334 ASN AAA OD1 
8    N ND2 . ASN A 5   ? 0.916 0.767 1.011 0.050  -0.172 -0.044 334 ASN AAA ND2 
9    N N   . LEU A 6   ? 0.727 0.570 0.573 0.016  -0.047 0.014  335 LEU AAA N   
10   C CA  . LEU A 6   ? 0.683 0.557 0.542 0.010  -0.018 0.017  335 LEU AAA CA  
11   C C   . LEU A 6   ? 0.602 0.509 0.498 0.013  -0.018 0.014  335 LEU AAA C   
12   O O   . LEU A 6   ? 0.640 0.538 0.545 0.016  -0.034 0.010  335 LEU AAA O   
13   C CB  . LEU A 6   ? 0.747 0.580 0.557 0.006  0.000  0.019  335 LEU AAA CB  
14   C CG  . LEU A 6   ? 0.838 0.616 0.594 -0.002 0.020  0.022  335 LEU AAA CG  
15   C CD1 . LEU A 6   ? 0.928 0.654 0.633 -0.009 0.057  0.021  335 LEU AAA CD1 
16   C CD2 . LEU A 6   ? 0.811 0.625 0.616 -0.008 0.037  0.021  335 LEU AAA CD2 
17   N N   . CYS A 7   ? 0.530 0.459 0.443 0.011  -0.006 0.014  336 CYS AAA N   
18   C CA  . CYS A 7   ? 0.512 0.446 0.432 0.010  -0.000 0.013  336 CYS AAA CA  
19   C C   . CYS A 7   ? 0.502 0.434 0.417 0.010  -0.004 0.014  336 CYS AAA C   
20   O O   . CYS A 7   ? 0.544 0.471 0.449 0.011  -0.001 0.015  336 CYS AAA O   
21   C CB  . CYS A 7   ? 0.514 0.435 0.415 0.009  0.002  0.014  336 CYS AAA CB  
22   S SG  . CYS A 7   ? 0.516 0.420 0.402 0.010  0.008  0.012  336 CYS AAA SG  
23   N N   . PRO A 8   ? 0.509 0.440 0.437 0.008  -0.005 0.012  337 PRO AAA N   
24   C CA  . PRO A 8   ? 0.524 0.448 0.443 0.010  -0.012 0.012  337 PRO AAA CA  
25   C C   . PRO A 8   ? 0.525 0.447 0.431 0.009  -0.007 0.014  337 PRO AAA C   
26   O O   . PRO A 8   ? 0.546 0.461 0.451 0.007  -0.008 0.013  337 PRO AAA O   
27   C CB  . PRO A 8   ? 0.526 0.451 0.485 0.008  -0.020 0.006  337 PRO AAA CB  
28   C CG  . PRO A 8   ? 0.523 0.457 0.507 0.001  0.006  0.003  337 PRO AAA CG  
29   C CD  . PRO A 8   ? 0.511 0.446 0.473 0.004  0.008  0.006  337 PRO AAA CD  
30   N N   . PHE A 9   ? 0.528 0.451 0.432 0.012  -0.007 0.013  338 PHE AAA N   
31   C CA  . PHE A 9   ? 0.531 0.445 0.438 0.016  -0.017 0.009  338 PHE AAA CA  
32   C C   . PHE A 9   ? 0.530 0.446 0.445 0.019  -0.015 0.005  338 PHE AAA C   
33   O O   . PHE A 9   ? 0.516 0.420 0.429 0.022  -0.028 0.003  338 PHE AAA O   
34   C CB  . PHE A 9   ? 0.554 0.470 0.488 0.019  -0.028 0.003  338 PHE AAA CB  
35   C CG  . PHE A 9   ? 0.606 0.495 0.508 0.019  -0.041 0.006  338 PHE AAA CG  
36   C CD1 . PHE A 9   ? 0.690 0.535 0.533 0.016  -0.043 0.011  338 PHE AAA CD1 
37   C CD2 . PHE A 9   ? 0.662 0.556 0.584 0.020  -0.046 0.004  338 PHE AAA CD2 
38   C CE1 . PHE A 9   ? 0.768 0.563 0.557 0.015  -0.046 0.012  338 PHE AAA CE1 
39   C CE2 . PHE A 9   ? 0.702 0.557 0.579 0.021  -0.059 0.006  338 PHE AAA CE2 
40   C CZ  . PHE A 9   ? 0.771 0.571 0.574 0.019  -0.057 0.010  338 PHE AAA CZ  
41   N N   . GLY A 10  ? 0.539 0.452 0.447 0.019  0.001  0.004  339 GLY AAA N   
42   C CA  . GLY A 10  ? 0.559 0.453 0.451 0.022  0.008  -0.000 339 GLY AAA CA  
43   C C   . GLY A 10  ? 0.570 0.459 0.449 0.023  -0.011 0.003  339 GLY AAA C   
44   O O   . GLY A 10  ? 0.567 0.450 0.451 0.027  -0.014 -0.002 339 GLY AAA O   
45   N N   . GLU A 11  ? 0.579 0.468 0.454 0.018  -0.022 0.009  340 GLU AAA N   
46   C CA  . GLU A 11  ? 0.599 0.482 0.480 0.015  -0.035 0.010  340 GLU AAA CA  
47   C C   . GLU A 11  ? 0.576 0.456 0.454 0.011  -0.032 0.011  340 GLU AAA C   
48   O O   . GLU A 11  ? 0.594 0.459 0.465 0.010  -0.039 0.012  340 GLU AAA O   
49   C CB  . GLU A 11  ? 0.644 0.535 0.559 0.009  -0.038 0.009  340 GLU AAA CB  
50   C CG  . GLU A 11  ? 0.730 0.603 0.644 0.015  -0.061 0.005  340 GLU AAA CG  
51   C CD  . GLU A 11  ? 0.746 0.634 0.724 0.012  -0.070 -0.002 340 GLU AAA CD  
52   O OE1 . GLU A 11  ? 0.776 0.685 0.807 0.002  -0.048 -0.005 340 GLU AAA OE1 
53   O OE2 . GLU A 11  ? 0.801 0.668 0.773 0.019  -0.095 -0.006 340 GLU AAA OE2 
54   N N   . VAL A 12  ? 0.589 0.402 0.352 -0.000 -0.037 0.021  341 VAL AAA N   
55   C CA  . VAL A 12  ? 0.523 0.367 0.321 0.003  -0.024 0.014  341 VAL AAA CA  
56   C C   . VAL A 12  ? 0.518 0.358 0.303 0.002  -0.002 0.013  341 VAL AAA C   
57   O O   . VAL A 12  ? 0.494 0.339 0.282 0.003  0.003  0.008  341 VAL AAA O   
58   C CB  . VAL A 12  ? 0.514 0.379 0.346 0.005  -0.022 0.015  341 VAL AAA CB  
59   C CG1 . VAL A 12  ? 0.502 0.390 0.359 0.006  -0.012 0.010  341 VAL AAA CG1 
60   C CG2 . VAL A 12  ? 0.512 0.378 0.362 0.009  -0.037 0.017  341 VAL AAA CG2 
61   N N   . PHE A 13  ? 0.512 0.345 0.289 -0.000 0.013  0.019  342 PHE AAA N   
62   C CA  . PHE A 13  ? 0.510 0.347 0.294 0.000  0.039  0.023  342 PHE AAA CA  
63   C C   . PHE A 13  ? 0.594 0.397 0.334 0.001  0.054  0.021  342 PHE AAA C   
64   O O   . PHE A 13  ? 0.574 0.381 0.325 0.005  0.076  0.021  342 PHE AAA O   
65   C CB  . PHE A 13  ? 0.521 0.361 0.317 -0.003 0.050  0.033  342 PHE AAA CB  
66   C CG  . PHE A 13  ? 0.488 0.358 0.326 -0.007 0.040  0.036  342 PHE AAA CG  
67   C CD1 . PHE A 13  ? 0.507 0.373 0.341 -0.008 0.022  0.034  342 PHE AAA CD1 
68   C CD2 . PHE A 13  ? 0.459 0.353 0.335 -0.009 0.048  0.041  342 PHE AAA CD2 
69   C CE1 . PHE A 13  ? 0.480 0.360 0.339 -0.012 0.014  0.034  342 PHE AAA CE1 
70   C CE2 . PHE A 13  ? 0.451 0.361 0.353 -0.016 0.035  0.044  342 PHE AAA CE2 
71   C CZ  . PHE A 13  ? 0.464 0.363 0.351 -0.018 0.019  0.039  342 PHE AAA CZ  
72   N N   . ASN A 14  ? 0.619 0.384 0.308 -0.002 0.042  0.019  343 ASN AAA N   
73   C CA  . ASN A 14  ? 0.722 0.436 0.347 -0.004 0.056  0.017  343 ASN AAA CA  
74   C C   . ASN A 14  ? 0.735 0.427 0.328 -0.008 0.033  0.010  343 ASN AAA C   
75   O O   . ASN A 14  ? 0.782 0.420 0.308 -0.013 0.037  0.008  343 ASN AAA O   
76   C CB  . ASN A 14  ? 0.802 0.476 0.378 -0.009 0.061  0.024  343 ASN AAA CB  
77   C CG  . ASN A 14  ? 0.845 0.528 0.442 -0.007 0.094  0.033  343 ASN AAA CG  
78   O OD1 . ASN A 14  ? 0.808 0.516 0.445 -0.001 0.119  0.035  343 ASN AAA OD1 
79   N ND2 . ASN A 14  ? 0.974 0.638 0.548 -0.011 0.094  0.041  343 ASN AAA ND2 
80   N N   . ALA A 15  ? 0.660 0.388 0.297 -0.007 0.011  0.007  344 ALA AAA N   
81   C CA  . ALA A 15  ? 0.680 0.396 0.302 -0.011 -0.012 0.001  344 ALA AAA CA  
82   C C   . ALA A 15  ? 0.714 0.398 0.298 -0.010 0.010  -0.005 344 ALA AAA C   
83   O O   . ALA A 15  ? 0.687 0.391 0.299 -0.003 0.040  -0.006 344 ALA AAA O   
84   C CB  . ALA A 15  ? 0.626 0.391 0.312 -0.007 -0.027 0.000  344 ALA AAA CB  
85   N N   . THR A 16  ? 0.778 0.410 0.298 -0.019 -0.003 -0.008 345 THR AAA N   
86   C CA  . THR A 16  ? 0.846 0.435 0.319 -0.019 0.019  -0.016 345 THR AAA CA  
87   C C   . THR A 16  ? 0.793 0.425 0.322 -0.013 0.022  -0.021 345 THR AAA C   
88   O O   . THR A 16  ? 0.782 0.413 0.317 -0.005 0.056  -0.024 345 THR AAA O   
89   C CB  . THR A 16  ? 0.951 0.468 0.336 -0.034 -0.004 -0.018 345 THR AAA CB  
90   O OG1 . THR A 16  ? 1.036 0.511 0.366 -0.039 0.002  -0.013 345 THR AAA OG1 
91   C CG2 . THR A 16  ? 1.027 0.494 0.358 -0.035 0.016  -0.028 345 THR AAA CG2 
92   N N   . ARG A 17  ? 0.747 0.414 0.318 -0.016 -0.010 -0.020 346 ARG AAA N   
93   C CA  . ARG A 17  ? 0.742 0.447 0.363 -0.011 -0.011 -0.025 346 ARG AAA CA  
94   C C   . ARG A 17  ? 0.601 0.369 0.297 -0.004 -0.014 -0.021 346 ARG AAA C   
95   O O   . ARG A 17  ? 0.601 0.381 0.311 -0.006 -0.032 -0.015 346 ARG AAA O   
96   C CB  . ARG A 17  ? 0.854 0.538 0.456 -0.022 -0.044 -0.026 346 ARG AAA CB  
97   C CG  . ARG A 17  ? 0.999 0.609 0.512 -0.035 -0.055 -0.027 346 ARG AAA CG  
98   C CD  . ARG A 17  ? 1.115 0.707 0.616 -0.049 -0.099 -0.024 346 ARG AAA CD  
99   N NE  . ARG A 17  ? 1.266 0.785 0.681 -0.066 -0.122 -0.021 346 ARG AAA NE  
100  C CZ  . ARG A 17  ? 1.404 0.894 0.796 -0.083 -0.167 -0.014 346 ARG AAA CZ  
101  N NH1 . ARG A 17  ? 1.421 0.954 0.878 -0.085 -0.190 -0.010 346 ARG AAA NH1 
102  N NH2 . ARG A 17  ? 1.505 0.922 0.810 -0.101 -0.189 -0.011 346 ARG AAA NH2 
103  N N   . PHE A 18  ? 0.535 0.335 0.271 0.003  0.004  -0.023 347 PHE AAA N   
104  C CA  . PHE A 18  ? 0.444 0.295 0.242 0.007  0.001  -0.020 347 PHE AAA CA  
105  C C   . PHE A 18  ? 0.412 0.280 0.235 0.006  -0.012 -0.023 347 PHE AAA C   
106  O O   . PHE A 18  ? 0.427 0.274 0.228 0.004  -0.012 -0.028 347 PHE AAA O   
107  C CB  . PHE A 18  ? 0.423 0.294 0.246 0.012  0.025  -0.016 347 PHE AAA CB  
108  C CG  . PHE A 18  ? 0.416 0.291 0.243 0.012  0.030  -0.010 347 PHE AAA CG  
109  C CD1 . PHE A 18  ? 0.449 0.293 0.235 0.009  0.029  -0.008 347 PHE AAA CD1 
110  C CD2 . PHE A 18  ? 0.376 0.283 0.244 0.013  0.034  -0.005 347 PHE AAA CD2 
111  C CE1 . PHE A 18  ? 0.448 0.296 0.239 0.009  0.034  -0.002 347 PHE AAA CE1 
112  C CE2 . PHE A 18  ? 0.380 0.288 0.250 0.011  0.036  0.002  347 PHE AAA CE2 
113  C CZ  . PHE A 18  ? 0.418 0.299 0.252 0.009  0.038  0.003  347 PHE AAA CZ  
114  N N   . ALA A 19  ? 0.374 0.276 0.240 0.008  -0.019 -0.021 348 ALA AAA N   
115  C CA  . ALA A 19  ? 0.351 0.274 0.248 0.008  -0.026 -0.023 348 ALA AAA CA  
116  C C   . ALA A 19  ? 0.334 0.268 0.243 0.011  -0.011 -0.026 348 ALA AAA C   
117  O O   . ALA A 19  ? 0.315 0.256 0.230 0.013  0.005  -0.023 348 ALA AAA O   
118  C CB  . ALA A 19  ? 0.331 0.278 0.262 0.010  -0.030 -0.020 348 ALA AAA CB  
119  N N   . SER A 20  ? 0.318 0.257 0.238 0.009  -0.016 -0.028 349 SER AAA N   
120  C CA  . SER A 20  ? 0.304 0.261 0.247 0.011  -0.006 -0.029 349 SER AAA CA  
121  C C   . SER A 20  ? 0.270 0.250 0.239 0.012  -0.005 -0.025 349 SER AAA C   
122  O O   . SER A 20  ? 0.275 0.259 0.252 0.011  -0.012 -0.024 349 SER AAA O   
123  C CB  . SER A 20  ? 0.283 0.239 0.232 0.009  -0.013 -0.031 349 SER AAA CB  
124  O OG  . SER A 20  ? 0.313 0.240 0.231 0.008  -0.011 -0.035 349 SER AAA OG  
125  N N   . VAL A 21  ? 0.256 0.246 0.236 0.011  0.004  -0.022 350 VAL AAA N   
126  C CA  . VAL A 21  ? 0.250 0.250 0.240 0.008  0.004  -0.019 350 VAL AAA CA  
127  C C   . VAL A 21  ? 0.235 0.239 0.234 0.008  0.001  -0.022 350 VAL AAA C   
128  O O   . VAL A 21  ? 0.235 0.236 0.232 0.007  0.002  -0.021 350 VAL AAA O   
129  C CB  . VAL A 21  ? 0.218 0.225 0.220 0.005  0.007  -0.012 350 VAL AAA CB  
130  C CG1 . VAL A 21  ? 0.202 0.214 0.216 0.005  0.009  -0.011 350 VAL AAA CG1 
131  C CG2 . VAL A 21  ? 0.227 0.233 0.226 -0.002 0.003  -0.008 350 VAL AAA CG2 
132  N N   . TYR A 22  ? 0.241 0.248 0.248 0.008  -0.000 -0.024 351 TYR AAA N   
133  C CA  . TYR A 22  ? 0.250 0.261 0.270 0.007  0.001  -0.024 351 TYR AAA CA  
134  C C   . TYR A 22  ? 0.237 0.247 0.267 0.011  -0.002 -0.023 351 TYR AAA C   
135  O O   . TYR A 22  ? 0.242 0.253 0.284 0.012  0.006  -0.022 351 TYR AAA O   
136  C CB  . TYR A 22  ? 0.231 0.246 0.261 0.006  -0.001 -0.025 351 TYR AAA CB  
137  C CG  . TYR A 22  ? 0.234 0.248 0.272 0.006  -0.010 -0.026 351 TYR AAA CG  
138  C CD1 . TYR A 22  ? 0.249 0.250 0.268 0.006  -0.017 -0.028 351 TYR AAA CD1 
139  C CD2 . TYR A 22  ? 0.234 0.255 0.297 0.006  -0.013 -0.022 351 TYR AAA CD2 
140  C CE1 . TYR A 22  ? 0.263 0.253 0.279 0.002  -0.031 -0.028 351 TYR AAA CE1 
141  C CE2 . TYR A 22  ? 0.260 0.279 0.333 0.003  -0.029 -0.019 351 TYR AAA CE2 
142  C CZ  . TYR A 22  ? 0.272 0.273 0.317 0.000  -0.040 -0.023 351 TYR AAA CZ  
143  O OH  . TYR A 22  ? 0.315 0.306 0.362 -0.006 -0.060 -0.019 351 TYR AAA OH  
144  N N   . ALA A 23  ? 0.253 0.260 0.279 0.011  -0.012 -0.023 352 ALA AAA N   
145  C CA  . ALA A 23  ? 0.258 0.264 0.297 0.013  -0.021 -0.019 352 ALA AAA CA  
146  C C   . ALA A 23  ? 0.266 0.264 0.288 0.015  -0.021 -0.018 352 ALA AAA C   
147  O O   . ALA A 23  ? 0.303 0.292 0.319 0.014  -0.034 -0.015 352 ALA AAA O   
148  C CB  . ALA A 23  ? 0.280 0.281 0.320 0.009  -0.039 -0.016 352 ALA AAA CB  
149  N N   . TRP A 24  ? 0.246 0.242 0.257 0.015  -0.010 -0.020 353 TRP AAA N   
150  C CA  . TRP A 24  ? 0.272 0.259 0.265 0.015  -0.009 -0.019 353 TRP AAA CA  
151  C C   . TRP A 24  ? 0.289 0.271 0.290 0.019  -0.015 -0.015 353 TRP AAA C   
152  O O   . TRP A 24  ? 0.274 0.260 0.300 0.023  -0.013 -0.012 353 TRP AAA O   
153  C CB  . TRP A 24  ? 0.279 0.262 0.263 0.012  -0.000 -0.020 353 TRP AAA CB  
154  C CG  . TRP A 24  ? 0.259 0.237 0.247 0.013  0.009  -0.021 353 TRP AAA CG  
155  C CD1 . TRP A 24  ? 0.276 0.254 0.265 0.010  0.015  -0.022 353 TRP AAA CD1 
156  C CD2 . TRP A 24  ? 0.273 0.236 0.257 0.016  0.017  -0.020 353 TRP AAA CD2 
157  N NE1 . TRP A 24  ? 0.270 0.231 0.251 0.011  0.027  -0.023 353 TRP AAA NE1 
158  C CE2 . TRP A 24  ? 0.291 0.242 0.270 0.015  0.030  -0.022 353 TRP AAA CE2 
159  C CE3 . TRP A 24  ? 0.289 0.244 0.271 0.019  0.015  -0.018 353 TRP AAA CE3 
160  C CZ2 . TRP A 24  ? 0.323 0.251 0.293 0.018  0.045  -0.023 353 TRP AAA CZ2 
161  C CZ3 . TRP A 24  ? 0.311 0.247 0.289 0.023  0.028  -0.018 353 TRP AAA CZ3 
162  C CH2 . TRP A 24  ? 0.325 0.245 0.295 0.023  0.045  -0.021 353 TRP AAA CH2 
163  N N   . ASN A 25  ? 0.292 0.264 0.274 0.018  -0.022 -0.013 354 ASN AAA N   
164  C CA  . ASN A 25  ? 0.317 0.281 0.304 0.020  -0.032 -0.007 354 ASN AAA CA  
165  C C   . ASN A 25  ? 0.314 0.274 0.302 0.023  -0.022 -0.007 354 ASN AAA C   
166  O O   . ASN A 25  ? 0.305 0.260 0.273 0.020  -0.014 -0.010 354 ASN AAA O   
167  C CB  . ASN A 25  ? 0.360 0.308 0.317 0.016  -0.044 -0.006 354 ASN AAA CB  
168  C CG  . ASN A 25  ? 0.463 0.402 0.427 0.017  -0.060 0.003  354 ASN AAA CG  
169  O OD1 . ASN A 25  ? 0.540 0.482 0.524 0.015  -0.077 0.009  354 ASN AAA OD1 
170  N ND2 . ASN A 25  ? 0.466 0.396 0.419 0.018  -0.059 0.006  354 ASN AAA ND2 
171  N N   . ARG A 26  ? 0.328 0.286 0.338 0.029  -0.022 -0.001 355 ARG AAA N   
172  C CA  . ARG A 26  ? 0.350 0.295 0.355 0.033  -0.013 -0.000 355 ARG AAA CA  
173  C C   . ARG A 26  ? 0.376 0.315 0.390 0.036  -0.026 0.009  355 ARG AAA C   
174  O O   . ARG A 26  ? 0.383 0.330 0.430 0.039  -0.037 0.017  355 ARG AAA O   
175  C CB  . ARG A 26  ? 0.360 0.301 0.384 0.039  0.006  -0.001 355 ARG AAA CB  
176  C CG  . ARG A 26  ? 0.377 0.296 0.393 0.044  0.018  0.000  355 ARG AAA CG  
177  C CD  . ARG A 26  ? 0.413 0.313 0.423 0.047  0.042  -0.005 355 ARG AAA CD  
178  N NE  . ARG A 26  ? 0.408 0.293 0.374 0.036  0.044  -0.013 355 ARG AAA NE  
179  C CZ  . ARG A 26  ? 0.450 0.304 0.386 0.033  0.061  -0.018 355 ARG AAA CZ  
180  N NH1 . ARG A 26  ? 0.506 0.339 0.450 0.043  0.085  -0.018 355 ARG AAA NH1 
181  N NH2 . ARG A 26  ? 0.470 0.311 0.369 0.019  0.055  -0.023 355 ARG AAA NH2 
182  N N   . LYS A 27  ? 0.392 0.317 0.380 0.033  -0.027 0.009  356 LYS AAA N   
183  C CA  . LYS A 27  ? 0.420 0.333 0.413 0.036  -0.038 0.018  356 LYS AAA CA  
184  C C   . LYS A 27  ? 0.411 0.309 0.402 0.041  -0.023 0.018  356 LYS AAA C   
185  O O   . LYS A 27  ? 0.423 0.312 0.385 0.036  -0.013 0.011  356 LYS AAA O   
186  C CB  . LYS A 27  ? 0.470 0.373 0.427 0.029  -0.052 0.020  356 LYS AAA CB  
187  C CG  . LYS A 27  ? 0.514 0.402 0.471 0.030  -0.066 0.031  356 LYS AAA CG  
188  C CD  . LYS A 27  ? 0.583 0.453 0.503 0.022  -0.084 0.035  356 LYS AAA CD  
189  C CE  . LYS A 27  ? 0.636 0.490 0.558 0.022  -0.102 0.048  356 LYS AAA CE  
190  N NZ  . LYS A 27  ? 0.671 0.533 0.635 0.024  -0.124 0.061  356 LYS AAA NZ  
191  N N   . ARG A 28  ? 0.418 0.312 0.442 0.051  -0.021 0.026  357 ARG AAA N   
192  C CA  . ARG A 28  ? 0.444 0.316 0.463 0.057  -0.005 0.026  357 ARG AAA CA  
193  C C   . ARG A 28  ? 0.467 0.327 0.469 0.053  -0.020 0.033  357 ARG AAA C   
194  O O   . ARG A 28  ? 0.471 0.337 0.489 0.054  -0.040 0.044  357 ARG AAA O   
195  C CB  . ARG A 28  ? 0.466 0.337 0.534 0.071  0.010  0.034  357 ARG AAA CB  
196  C CG  . ARG A 28  ? 0.517 0.355 0.574 0.078  0.033  0.032  357 ARG AAA CG  
197  C CD  . ARG A 28  ? 0.538 0.372 0.647 0.095  0.056  0.041  357 ARG AAA CD  
198  N NE  . ARG A 28  ? 0.545 0.404 0.713 0.101  0.034  0.060  357 ARG AAA NE  
199  C CZ  . ARG A 28  ? 0.606 0.456 0.785 0.105  0.021  0.072  357 ARG AAA CZ  
200  N NH1 . ARG A 28  ? 0.669 0.487 0.806 0.104  0.031  0.065  357 ARG AAA NH1 
201  N NH2 . ARG A 28  ? 0.614 0.485 0.847 0.108  -0.003 0.092  357 ARG AAA NH2 
202  N N   . ILE A 29  ? 0.475 0.314 0.440 0.048  -0.012 0.027  358 ILE AAA N   
203  C CA  . ILE A 29  ? 0.509 0.332 0.453 0.044  -0.022 0.032  358 ILE AAA CA  
204  C C   . ILE A 29  ? 0.515 0.312 0.464 0.052  -0.009 0.035  358 ILE AAA C   
205  O O   . ILE A 29  ? 0.510 0.288 0.443 0.052  0.011  0.026  358 ILE AAA O   
206  C CB  . ILE A 29  ? 0.535 0.356 0.440 0.031  -0.022 0.026  358 ILE AAA CB  
207  C CG1 . ILE A 29  ? 0.561 0.403 0.461 0.025  -0.028 0.023  358 ILE AAA CG1 
208  C CG2 . ILE A 29  ? 0.568 0.371 0.452 0.026  -0.029 0.033  358 ILE AAA CG2 
209  C CD1 . ILE A 29  ? 0.582 0.423 0.473 0.023  -0.044 0.030  358 ILE AAA CD1 
210  N N   . SER A 30  ? 0.539 0.330 0.508 0.059  -0.018 0.047  359 SER AAA N   
211  C CA  . SER A 30  ? 0.572 0.335 0.550 0.069  -0.004 0.051  359 SER AAA CA  
212  C C   . SER A 30  ? 0.580 0.333 0.562 0.069  -0.022 0.065  359 SER AAA C   
213  O O   . SER A 30  ? 0.562 0.330 0.544 0.064  -0.047 0.073  359 SER AAA O   
214  C CB  . SER A 30  ? 0.612 0.377 0.637 0.084  0.015  0.054  359 SER AAA CB  
215  O OG  . SER A 30  ? 0.671 0.456 0.751 0.093  -0.002 0.072  359 SER AAA OG  
216  N N   . ASN A 31  ? 0.599 0.323 0.577 0.075  -0.010 0.067  360 ASN AAA N   
217  C CA  . ASN A 31  ? 0.637 0.347 0.624 0.079  -0.025 0.082  360 ASN AAA CA  
218  C C   . ASN A 31  ? 0.622 0.334 0.569 0.063  -0.048 0.084  360 ASN AAA C   
219  O O   . ASN A 31  ? 0.631 0.350 0.589 0.062  -0.072 0.097  360 ASN AAA O   
220  C CB  . ASN A 31  ? 0.660 0.387 0.712 0.092  -0.036 0.100  360 ASN AAA CB  
221  C CG  . ASN A 31  ? 0.696 0.417 0.795 0.111  -0.006 0.102  360 ASN AAA CG  
222  O OD1 . ASN A 31  ? 0.802 0.493 0.908 0.121  0.012  0.105  360 ASN AAA OD1 
223  N ND2 . ASN A 31  ? 0.705 0.451 0.836 0.115  0.001  0.100  360 ASN AAA ND2 
224  N N   . CYS A 32  ? 0.608 0.313 0.510 0.050  -0.041 0.072  361 CYS AAA N   
225  C CA  . CYS A 32  ? 0.613 0.321 0.479 0.036  -0.055 0.074  361 CYS AAA CA  
226  C C   . CYS A 32  ? 0.625 0.319 0.456 0.024  -0.044 0.066  361 CYS AAA C   
227  O O   . CYS A 32  ? 0.634 0.318 0.461 0.024  -0.029 0.057  361 CYS AAA O   
228  C CB  . CYS A 32  ? 0.599 0.333 0.465 0.032  -0.063 0.071  361 CYS AAA CB  
229  S SG  . CYS A 32  ? 0.562 0.318 0.435 0.031  -0.046 0.055  361 CYS AAA SG  
230  N N   . VAL A 33  ? 0.654 0.343 0.458 0.013  -0.051 0.071  362 VAL AAA N   
231  C CA  . VAL A 33  ? 0.686 0.367 0.465 -0.001 -0.044 0.070  362 VAL AAA CA  
232  C C   . VAL A 33  ? 0.667 0.374 0.442 -0.008 -0.040 0.066  362 VAL AAA C   
233  O O   . VAL A 33  ? 0.662 0.376 0.429 -0.007 -0.045 0.069  362 VAL AAA O   
234  C CB  . VAL A 33  ? 0.756 0.414 0.514 -0.006 -0.050 0.081  362 VAL AAA CB  
235  C CG1 . VAL A 33  ? 0.800 0.455 0.548 -0.004 -0.063 0.090  362 VAL AAA CG1 
236  C CG2 . VAL A 33  ? 0.775 0.430 0.515 -0.021 -0.043 0.083  362 VAL AAA CG2 
237  N N   . ALA A 34  ? 0.701 0.450 0.526 0.032  0.046  0.026  363 ALA AAA N   
238  C CA  . ALA A 34  ? 0.714 0.475 0.547 0.024  0.048  0.020  363 ALA AAA CA  
239  C C   . ALA A 34  ? 0.714 0.465 0.554 0.017  0.077  0.023  363 ALA AAA C   
240  O O   . ALA A 34  ? 0.651 0.411 0.520 0.007  0.087  0.022  363 ALA AAA O   
241  C CB  . ALA A 34  ? 0.687 0.483 0.561 0.012  0.034  0.012  363 ALA AAA CB  
242  N N   . ASP A 35  ? 0.754 0.487 0.571 0.022  0.090  0.025  364 ASP AAA N   
243  C CA  . ASP A 35  ? 0.748 0.477 0.585 0.014  0.118  0.027  364 ASP AAA CA  
244  C C   . ASP A 35  ? 0.689 0.448 0.560 0.003  0.111  0.018  364 ASP AAA C   
245  O O   . ASP A 35  ? 0.716 0.468 0.572 0.008  0.115  0.018  364 ASP AAA O   
246  C CB  . ASP A 35  ? 0.803 0.492 0.597 0.028  0.143  0.037  364 ASP AAA CB  
247  C CG  . ASP A 35  ? 0.823 0.506 0.646 0.020  0.176  0.041  364 ASP AAA CG  
248  O OD1 . ASP A 35  ? 0.781 0.495 0.659 0.004  0.175  0.034  364 ASP AAA OD1 
249  O OD2 . ASP A 35  ? 0.935 0.581 0.727 0.031  0.203  0.051  364 ASP AAA OD2 
250  N N   . TYR A 36  ? 0.618 0.408 0.533 -0.011 0.102  0.012  365 TYR AAA N   
251  C CA  . TYR A 36  ? 0.573 0.394 0.523 -0.021 0.094  0.005  365 TYR AAA CA  
252  C C   . TYR A 36  ? 0.584 0.403 0.557 -0.026 0.116  0.006  365 TYR AAA C   
253  O O   . TYR A 36  ? 0.557 0.389 0.544 -0.028 0.113  0.003  365 TYR AAA O   
254  C CB  . TYR A 36  ? 0.527 0.374 0.508 -0.031 0.081  -0.001 365 TYR AAA CB  
255  C CG  . TYR A 36  ? 0.528 0.380 0.496 -0.027 0.063  -0.001 365 TYR AAA CG  
256  C CD1 . TYR A 36  ? 0.512 0.379 0.481 -0.025 0.046  -0.004 365 TYR AAA CD1 
257  C CD2 . TYR A 36  ? 0.549 0.391 0.511 -0.025 0.065  0.001  365 TYR AAA CD2 
258  C CE1 . TYR A 36  ? 0.511 0.383 0.477 -0.021 0.031  -0.003 365 TYR AAA CE1 
259  C CE2 . TYR A 36  ? 0.561 0.408 0.517 -0.021 0.050  0.001  365 TYR AAA CE2 
260  C CZ  . TYR A 36  ? 0.560 0.422 0.520 -0.019 0.034  -0.001 365 TYR AAA CZ  
261  O OH  . TYR A 36  ? 0.595 0.463 0.558 -0.015 0.022  -0.000 365 TYR AAA OH  
262  N N   . SER A 37  ? 0.600 0.401 0.580 -0.027 0.138  0.011  366 SER AAA N   
263  C CA  . SER A 37  ? 0.621 0.421 0.636 -0.033 0.162  0.012  366 SER AAA CA  
264  C C   . SER A 37  ? 0.637 0.419 0.627 -0.023 0.177  0.017  366 SER AAA C   
265  O O   . SER A 37  ? 0.626 0.421 0.652 -0.029 0.186  0.015  366 SER AAA O   
266  C CB  . SER A 37  ? 0.652 0.432 0.680 -0.035 0.187  0.017  366 SER AAA CB  
267  O OG  . SER A 37  ? 0.660 0.460 0.722 -0.047 0.174  0.009  366 SER AAA OG  
268  N N   . VAL A 38  ? 0.682 0.434 0.613 -0.008 0.177  0.022  367 VAL AAA N   
269  C CA  . VAL A 38  ? 0.725 0.452 0.619 0.004  0.191  0.025  367 VAL AAA CA  
270  C C   . VAL A 38  ? 0.682 0.435 0.590 0.000  0.169  0.017  367 VAL AAA C   
271  O O   . VAL A 38  ? 0.669 0.416 0.582 0.002  0.185  0.017  367 VAL AAA O   
272  C CB  . VAL A 38  ? 0.813 0.500 0.635 0.022  0.191  0.031  367 VAL AAA CB  
273  C CG1 . VAL A 38  ? 0.828 0.523 0.623 0.027  0.154  0.024  367 VAL AAA CG1 
274  C CG2 . VAL A 38  ? 0.897 0.546 0.677 0.037  0.217  0.037  367 VAL AAA CG2 
275  N N   . LEU A 39  ? 0.617 0.396 0.534 -0.005 0.139  0.010  368 LEU AAA N   
276  C CA  . LEU A 39  ? 0.587 0.393 0.525 -0.010 0.120  0.003  368 LEU AAA CA  
277  C C   . LEU A 39  ? 0.545 0.378 0.541 -0.022 0.128  0.002  368 LEU AAA C   
278  O O   . LEU A 39  ? 0.524 0.363 0.535 -0.022 0.133  0.001  368 LEU AAA O   
279  C CB  . LEU A 39  ? 0.567 0.393 0.507 -0.013 0.090  -0.002 368 LEU AAA CB  
280  C CG  . LEU A 39  ? 0.614 0.420 0.509 -0.001 0.076  -0.003 368 LEU AAA CG  
281  C CD1 . LEU A 39  ? 0.597 0.426 0.508 -0.005 0.052  -0.006 368 LEU AAA CD1 
282  C CD2 . LEU A 39  ? 0.653 0.441 0.518 0.008  0.072  -0.007 368 LEU AAA CD2 
283  N N   . TYR A 40  ? 0.535 0.384 0.563 -0.032 0.127  0.001  369 TYR AAA N   
284  C CA  . TYR A 40  ? 0.523 0.401 0.608 -0.043 0.125  -0.002 369 TYR AAA CA  
285  C C   . TYR A 40  ? 0.554 0.424 0.666 -0.043 0.152  0.001  369 TYR AAA C   
286  O O   . TYR A 40  ? 0.532 0.424 0.687 -0.049 0.149  -0.001 369 TYR AAA O   
287  C CB  . TYR A 40  ? 0.538 0.428 0.645 -0.052 0.117  -0.006 369 TYR AAA CB  
288  C CG  . TYR A 40  ? 0.521 0.440 0.682 -0.063 0.108  -0.012 369 TYR AAA CG  
289  C CD1 . TYR A 40  ? 0.499 0.443 0.676 -0.064 0.090  -0.015 369 TYR AAA CD1 
290  C CD2 . TYR A 40  ? 0.548 0.468 0.746 -0.071 0.117  -0.016 369 TYR AAA CD2 
291  C CE1 . TYR A 40  ? 0.496 0.464 0.718 -0.071 0.079  -0.020 369 TYR AAA CE1 
292  C CE2 . TYR A 40  ? 0.560 0.506 0.808 -0.080 0.104  -0.023 369 TYR AAA CE2 
293  C CZ  . TYR A 40  ? 0.550 0.521 0.809 -0.079 0.084  -0.026 369 TYR AAA CZ  
294  O OH  . TYR A 40  ? 0.616 0.611 0.921 -0.086 0.067  -0.033 369 TYR AAA OH  
295  N N   . ASN A 41  ? 0.598 0.435 0.688 -0.037 0.179  0.008  370 ASN AAA N   
296  C CA  . ASN A 41  ? 0.652 0.476 0.770 -0.036 0.212  0.014  370 ASN AAA CA  
297  C C   . ASN A 41  ? 0.700 0.501 0.780 -0.023 0.227  0.017  370 ASN AAA C   
298  O O   . ASN A 41  ? 0.779 0.563 0.874 -0.020 0.259  0.023  370 ASN AAA O   
299  C CB  . ASN A 41  ? 0.693 0.493 0.814 -0.036 0.239  0.020  370 ASN AAA CB  
300  C CG  . ASN A 41  ? 0.678 0.502 0.845 -0.050 0.226  0.014  370 ASN AAA CG  
301  O OD1 . ASN A 41  ? 0.644 0.502 0.860 -0.060 0.206  0.005  370 ASN AAA OD1 
302  N ND2 . ASN A 41  ? 0.728 0.531 0.877 -0.048 0.235  0.017  370 ASN AAA ND2 
303  N N   . SER A 42  ? 0.720 0.519 0.756 -0.017 0.205  0.013  371 SER AAA N   
304  C CA  . SER A 42  ? 0.747 0.524 0.746 -0.005 0.211  0.012  371 SER AAA CA  
305  C C   . SER A 42  ? 0.736 0.538 0.788 -0.011 0.215  0.011  371 SER AAA C   
306  O O   . SER A 42  ? 0.781 0.621 0.877 -0.022 0.192  0.007  371 SER AAA O   
307  C CB  . SER A 42  ? 0.735 0.510 0.689 0.000  0.181  0.006  371 SER AAA CB  
308  O OG  . SER A 42  ? 0.801 0.551 0.716 0.012  0.187  0.003  371 SER AAA OG  
309  N N   . ALA A 43  ? 0.719 0.497 0.761 -0.002 0.242  0.014  372 ALA AAA N   
310  C CA  . ALA A 43  ? 0.690 0.485 0.774 -0.004 0.247  0.012  372 ALA AAA CA  
311  C C   . ALA A 43  ? 0.661 0.457 0.714 0.000  0.223  0.004  372 ALA AAA C   
312  O O   . ALA A 43  ? 0.625 0.434 0.708 -0.001 0.224  0.003  372 ALA AAA O   
313  C CB  . ALA A 43  ? 0.732 0.498 0.818 0.004  0.290  0.019  372 ALA AAA CB  
314  N N   . SER A 44  ? 0.675 0.459 0.674 0.005  0.202  -0.000 373 SER AAA N   
315  C CA  . SER A 44  ? 0.680 0.460 0.650 0.009  0.179  -0.009 373 SER AAA CA  
316  C C   . SER A 44  ? 0.584 0.407 0.603 -0.001 0.153  -0.012 373 SER AAA C   
317  O O   . SER A 44  ? 0.592 0.415 0.605 0.001  0.141  -0.017 373 SER AAA O   
318  C CB  . SER A 44  ? 0.735 0.491 0.644 0.017  0.162  -0.014 373 SER AAA CB  
319  O OG  . SER A 44  ? 0.844 0.553 0.695 0.031  0.185  -0.012 373 SER AAA OG  
320  N N   . PHE A 45  ? 0.530 0.384 0.590 -0.012 0.144  -0.008 374 PHE AAA N   
321  C CA  . PHE A 45  ? 0.466 0.356 0.557 -0.019 0.117  -0.009 374 PHE AAA CA  
322  C C   . PHE A 45  ? 0.453 0.371 0.603 -0.025 0.120  -0.005 374 PHE AAA C   
323  O O   . PHE A 45  ? 0.446 0.370 0.626 -0.029 0.133  -0.002 374 PHE AAA O   
324  C CB  . PHE A 45  ? 0.441 0.341 0.526 -0.025 0.101  -0.009 374 PHE AAA CB  
325  C CG  . PHE A 45  ? 0.445 0.319 0.478 -0.018 0.096  -0.012 374 PHE AAA CG  
326  C CD1 . PHE A 45  ? 0.442 0.306 0.448 -0.012 0.083  -0.017 374 PHE AAA CD1 
327  C CD2 . PHE A 45  ? 0.439 0.299 0.452 -0.017 0.104  -0.009 374 PHE AAA CD2 
328  C CE1 . PHE A 45  ? 0.460 0.301 0.422 -0.005 0.073  -0.021 374 PHE AAA CE1 
329  C CE2 . PHE A 45  ? 0.467 0.302 0.431 -0.009 0.097  -0.011 374 PHE AAA CE2 
330  C CZ  . PHE A 45  ? 0.481 0.308 0.420 -0.003 0.080  -0.017 374 PHE AAA CZ  
331  N N   . SER A 46  ? 0.428 0.363 0.596 -0.025 0.108  -0.005 375 SER AAA N   
332  C CA  . SER A 46  ? 0.405 0.368 0.627 -0.028 0.106  -0.000 375 SER AAA CA  
333  C C   . SER A 46  ? 0.381 0.372 0.619 -0.034 0.081  0.001  375 SER AAA C   
334  O O   . SER A 46  ? 0.362 0.376 0.643 -0.037 0.076  0.004  375 SER AAA O   
335  C CB  . SER A 46  ? 0.407 0.371 0.640 -0.023 0.107  0.000  375 SER AAA CB  
336  O OG  . SER A 46  ? 0.406 0.364 0.611 -0.021 0.092  -0.003 375 SER AAA OG  
337  N N   . THR A 47  ? 0.371 0.359 0.577 -0.035 0.067  -0.001 376 THR AAA N   
338  C CA  . THR A 47  ? 0.352 0.359 0.562 -0.039 0.048  -0.000 376 THR AAA CA  
339  C C   . THR A 47  ? 0.358 0.352 0.538 -0.041 0.047  -0.004 376 THR AAA C   
340  O O   . THR A 47  ? 0.353 0.327 0.501 -0.038 0.051  -0.006 376 THR AAA O   
341  C CB  . THR A 47  ? 0.341 0.358 0.547 -0.035 0.033  0.003  376 THR AAA CB  
342  O OG1 . THR A 47  ? 0.320 0.349 0.555 -0.032 0.033  0.008  376 THR AAA OG1 
343  C CG2 . THR A 47  ? 0.325 0.354 0.524 -0.037 0.017  0.004  376 THR AAA CG2 
344  N N   . PHE A 48  ? 0.363 0.367 0.555 -0.046 0.042  -0.006 377 PHE AAA N   
345  C CA  . PHE A 48  ? 0.381 0.374 0.548 -0.049 0.040  -0.009 377 PHE AAA CA  
346  C C   . PHE A 48  ? 0.381 0.393 0.565 -0.054 0.025  -0.011 377 PHE AAA C   
347  O O   . PHE A 48  ? 0.352 0.369 0.562 -0.059 0.029  -0.015 377 PHE AAA O   
348  C CB  . PHE A 48  ? 0.403 0.375 0.563 -0.049 0.060  -0.009 377 PHE AAA CB  
349  C CG  . PHE A 48  ? 0.425 0.379 0.549 -0.048 0.060  -0.010 377 PHE AAA CG  
350  C CD1 . PHE A 48  ? 0.418 0.380 0.540 -0.052 0.049  -0.013 377 PHE AAA CD1 
351  C CD2 . PHE A 48  ? 0.445 0.373 0.534 -0.041 0.071  -0.009 377 PHE AAA CD2 
352  C CE1 . PHE A 48  ? 0.423 0.370 0.516 -0.050 0.049  -0.013 377 PHE AAA CE1 
353  C CE2 . PHE A 48  ? 0.468 0.380 0.526 -0.038 0.069  -0.009 377 PHE AAA CE2 
354  C CZ  . PHE A 48  ? 0.447 0.369 0.510 -0.043 0.059  -0.010 377 PHE AAA CZ  
355  N N   . LYS A 49  ? 0.369 0.390 0.541 -0.051 0.010  -0.010 378 LYS AAA N   
356  C CA  . LYS A 49  ? 0.395 0.430 0.572 -0.052 -0.006 -0.012 378 LYS AAA CA  
357  C C   . LYS A 49  ? 0.385 0.411 0.531 -0.052 -0.010 -0.014 378 LYS AAA C   
358  O O   . LYS A 49  ? 0.352 0.373 0.479 -0.047 -0.009 -0.009 378 LYS AAA O   
359  C CB  . LYS A 49  ? 0.453 0.504 0.640 -0.047 -0.017 -0.007 378 LYS AAA CB  
360  C CG  . LYS A 49  ? 0.526 0.587 0.750 -0.047 -0.014 -0.005 378 LYS AAA CG  
361  C CD  . LYS A 49  ? 0.579 0.653 0.813 -0.040 -0.025 0.003  378 LYS AAA CD  
362  C CE  . LYS A 49  ? 0.595 0.683 0.873 -0.040 -0.023 0.004  378 LYS AAA CE  
363  N NZ  . LYS A 49  ? 0.635 0.734 0.923 -0.031 -0.033 0.013  378 LYS AAA NZ  
364  N N   . CYS A 50  ? 0.362 0.387 0.508 -0.056 -0.014 -0.021 379 CYS AAA N   
365  C CA  . CYS A 50  ? 0.378 0.392 0.496 -0.055 -0.015 -0.023 379 CYS AAA CA  
366  C C   . CYS A 50  ? 0.381 0.401 0.488 -0.053 -0.031 -0.027 379 CYS AAA C   
367  O O   . CYS A 50  ? 0.371 0.403 0.497 -0.054 -0.043 -0.032 379 CYS AAA O   
368  C CB  . CYS A 50  ? 0.417 0.417 0.534 -0.061 -0.005 -0.029 379 CYS AAA CB  
369  S SG  . CYS A 50  ? 0.471 0.455 0.585 -0.060 0.014  -0.023 379 CYS AAA SG  
370  N N   . TYR A 51  ? 0.381 0.393 0.460 -0.048 -0.030 -0.024 380 TYR AAA N   
371  C CA  . TYR A 51  ? 0.414 0.424 0.468 -0.042 -0.040 -0.026 380 TYR AAA CA  
372  C C   . TYR A 51  ? 0.434 0.429 0.467 -0.043 -0.035 -0.032 380 TYR AAA C   
373  O O   . TYR A 51  ? 0.436 0.423 0.466 -0.042 -0.022 -0.027 380 TYR AAA O   
374  C CB  . TYR A 51  ? 0.411 0.424 0.455 -0.033 -0.039 -0.014 380 TYR AAA CB  
375  C CG  . TYR A 51  ? 0.397 0.424 0.464 -0.031 -0.042 -0.008 380 TYR AAA CG  
376  C CD1 . TYR A 51  ? 0.407 0.444 0.476 -0.027 -0.057 -0.008 380 TYR AAA CD1 
377  C CD2 . TYR A 51  ? 0.376 0.405 0.461 -0.034 -0.032 -0.003 380 TYR AAA CD2 
378  C CE1 . TYR A 51  ? 0.397 0.446 0.490 -0.025 -0.060 -0.001 380 TYR AAA CE1 
379  C CE2 . TYR A 51  ? 0.363 0.403 0.470 -0.032 -0.034 0.002  380 TYR AAA CE2 
380  C CZ  . TYR A 51  ? 0.376 0.426 0.489 -0.028 -0.046 0.004  380 TYR AAA CZ  
381  O OH  . TYR A 51  ? 0.398 0.458 0.535 -0.026 -0.047 0.010  380 TYR AAA OH  
382  N N   . GLY A 52  ? 0.483 0.472 0.503 -0.044 -0.045 -0.043 381 GLY AAA N   
383  C CA  . GLY A 52  ? 0.516 0.488 0.513 -0.043 -0.039 -0.049 381 GLY AAA CA  
384  C C   . GLY A 52  ? 0.535 0.500 0.551 -0.052 -0.030 -0.055 381 GLY AAA C   
385  O O   . GLY A 52  ? 0.536 0.486 0.537 -0.052 -0.025 -0.061 381 GLY AAA O   
386  N N   . VAL A 53  ? 0.537 0.510 0.582 -0.059 -0.026 -0.053 382 VAL AAA N   
387  C CA  . VAL A 53  ? 0.567 0.530 0.629 -0.066 -0.014 -0.056 382 VAL AAA CA  
388  C C   . VAL A 53  ? 0.544 0.517 0.641 -0.073 -0.015 -0.058 382 VAL AAA C   
389  O O   . VAL A 53  ? 0.537 0.524 0.644 -0.070 -0.020 -0.053 382 VAL AAA O   
390  C CB  . VAL A 53  ? 0.600 0.554 0.651 -0.062 0.000  -0.045 382 VAL AAA CB  
391  C CG1 . VAL A 53  ? 0.675 0.618 0.702 -0.056 0.004  -0.043 382 VAL AAA CG1 
392  C CG2 . VAL A 53  ? 0.587 0.551 0.642 -0.058 0.001  -0.035 382 VAL AAA CG2 
393  N N   . SER A 54  ? 0.558 0.524 0.678 -0.080 -0.007 -0.065 383 SER AAA N   
394  C CA  . SER A 54  ? 0.552 0.524 0.712 -0.087 0.001  -0.065 383 SER AAA CA  
395  C C   . SER A 54  ? 0.519 0.478 0.670 -0.083 0.022  -0.052 383 SER AAA C   
396  O O   . SER A 54  ? 0.482 0.423 0.614 -0.081 0.034  -0.049 383 SER AAA O   
397  C CB  . SER A 54  ? 0.593 0.561 0.786 -0.096 0.001  -0.077 383 SER AAA CB  
398  O OG  . SER A 54  ? 0.608 0.582 0.845 -0.102 0.012  -0.075 383 SER AAA OG  
399  N N   . PRO A 55  ? 0.473 0.439 0.636 -0.081 0.028  -0.045 384 PRO AAA N   
400  C CA  . PRO A 55  ? 0.472 0.421 0.620 -0.076 0.047  -0.035 384 PRO AAA CA  
401  C C   . PRO A 55  ? 0.478 0.407 0.638 -0.079 0.069  -0.034 384 PRO AAA C   
402  O O   . PRO A 55  ? 0.493 0.402 0.625 -0.073 0.082  -0.026 384 PRO AAA O   
403  C CB  . PRO A 55  ? 0.471 0.432 0.636 -0.074 0.049  -0.031 384 PRO AAA CB  
404  C CG  . PRO A 55  ? 0.481 0.464 0.687 -0.081 0.035  -0.039 384 PRO AAA CG  
405  C CD  . PRO A 55  ? 0.483 0.470 0.673 -0.082 0.016  -0.047 384 PRO AAA CD  
406  N N   . THR A 56  ? 0.477 0.412 0.678 -0.089 0.070  -0.043 385 THR AAA N   
407  C CA  . THR A 56  ? 0.484 0.399 0.705 -0.093 0.094  -0.042 385 THR AAA CA  
408  C C   . THR A 56  ? 0.481 0.377 0.675 -0.091 0.097  -0.042 385 THR AAA C   
409  O O   . THR A 56  ? 0.498 0.371 0.695 -0.091 0.121  -0.037 385 THR AAA O   
410  C CB  . THR A 56  ? 0.497 0.425 0.781 -0.105 0.093  -0.052 385 THR AAA CB  
411  O OG1 . THR A 56  ? 0.505 0.446 0.795 -0.110 0.067  -0.067 385 THR AAA OG1 
412  C CG2 . THR A 56  ? 0.494 0.442 0.813 -0.105 0.091  -0.051 385 THR AAA CG2 
413  N N   . LYS A 57  ? 0.465 0.367 0.633 -0.089 0.077  -0.047 386 LYS AAA N   
414  C CA  . LYS A 57  ? 0.497 0.383 0.643 -0.088 0.080  -0.049 386 LYS AAA CA  
415  C C   . LYS A 57  ? 0.476 0.349 0.577 -0.075 0.083  -0.036 386 LYS AAA C   
416  O O   . LYS A 57  ? 0.495 0.351 0.579 -0.072 0.088  -0.034 386 LYS AAA O   
417  C CB  . LYS A 57  ? 0.531 0.427 0.674 -0.091 0.059  -0.062 386 LYS AAA CB  
418  C CG  . LYS A 57  ? 0.577 0.484 0.762 -0.103 0.048  -0.078 386 LYS AAA CG  
419  C CD  . LYS A 57  ? 0.644 0.535 0.863 -0.111 0.066  -0.083 386 LYS AAA CD  
420  C CE  . LYS A 57  ? 0.679 0.579 0.937 -0.122 0.049  -0.104 386 LYS AAA CE  
421  N NZ  . LYS A 57  ? 0.737 0.623 1.044 -0.131 0.068  -0.108 386 LYS AAA NZ  
422  N N   . LEU A 58  ? 0.449 0.330 0.535 -0.069 0.078  -0.029 387 LEU AAA N   
423  C CA  . LEU A 58  ? 0.457 0.332 0.506 -0.059 0.073  -0.022 387 LEU AAA CA  
424  C C   . LEU A 58  ? 0.476 0.324 0.503 -0.051 0.088  -0.013 387 LEU AAA C   
425  O O   . LEU A 58  ? 0.496 0.337 0.502 -0.044 0.081  -0.010 387 LEU AAA O   
426  C CB  . LEU A 58  ? 0.447 0.332 0.489 -0.054 0.066  -0.017 387 LEU AAA CB  
427  C CG  . LEU A 58  ? 0.428 0.339 0.483 -0.058 0.049  -0.023 387 LEU AAA CG  
428  C CD1 . LEU A 58  ? 0.423 0.340 0.475 -0.053 0.046  -0.018 387 LEU AAA CD1 
429  C CD2 . LEU A 58  ? 0.435 0.351 0.477 -0.055 0.037  -0.024 387 LEU AAA CD2 
430  N N   . ASN A 59  ? 0.492 0.322 0.524 -0.051 0.108  -0.008 388 ASN AAA N   
431  C CA  . ASN A 59  ? 0.538 0.337 0.542 -0.040 0.124  0.003  388 ASN AAA CA  
432  C C   . ASN A 59  ? 0.529 0.319 0.540 -0.043 0.128  0.000  388 ASN AAA C   
433  O O   . ASN A 59  ? 0.566 0.331 0.551 -0.033 0.136  0.010  388 ASN AAA O   
434  C CB  . ASN A 59  ? 0.578 0.355 0.582 -0.038 0.150  0.010  388 ASN AAA CB  
435  C CG  . ASN A 59  ? 0.612 0.383 0.586 -0.028 0.149  0.016  388 ASN AAA CG  
436  O OD1 . ASN A 59  ? 0.612 0.401 0.577 -0.026 0.128  0.012  388 ASN AAA OD1 
437  N ND2 . ASN A 59  ? 0.657 0.399 0.614 -0.020 0.174  0.026  388 ASN AAA ND2 
438  N N   . ASP A 60  ? 0.508 0.314 0.549 -0.055 0.120  -0.012 389 ASP AAA N   
439  C CA  . ASP A 60  ? 0.521 0.315 0.569 -0.058 0.125  -0.017 389 ASP AAA CA  
440  C C   . ASP A 60  ? 0.491 0.298 0.526 -0.055 0.106  -0.022 389 ASP AAA C   
441  O O   . ASP A 60  ? 0.499 0.298 0.540 -0.058 0.108  -0.028 389 ASP AAA O   
442  C CB  . ASP A 60  ? 0.546 0.346 0.638 -0.072 0.130  -0.030 389 ASP AAA CB  
443  C CG  . ASP A 60  ? 0.591 0.378 0.706 -0.075 0.154  -0.024 389 ASP AAA CG  
444  O OD1 . ASP A 60  ? 0.610 0.369 0.705 -0.066 0.175  -0.010 389 ASP AAA OD1 
445  O OD2 . ASP A 60  ? 0.603 0.405 0.756 -0.085 0.152  -0.032 389 ASP AAA OD2 
446  N N   . LEU A 61  ? 0.467 0.289 0.487 -0.050 0.091  -0.019 390 LEU AAA N   
447  C CA  . LEU A 61  ? 0.445 0.279 0.457 -0.047 0.077  -0.022 390 LEU AAA CA  
448  C C   . LEU A 61  ? 0.448 0.277 0.440 -0.035 0.073  -0.011 390 LEU AAA C   
449  O O   . LEU A 61  ? 0.455 0.277 0.433 -0.028 0.073  -0.003 390 LEU AAA O   
450  C CB  . LEU A 61  ? 0.429 0.287 0.449 -0.052 0.063  -0.029 390 LEU AAA CB  
451  C CG  . LEU A 61  ? 0.429 0.295 0.471 -0.064 0.061  -0.042 390 LEU AAA CG  
452  C CD1 . LEU A 61  ? 0.421 0.310 0.465 -0.065 0.045  -0.046 390 LEU AAA CD1 
453  C CD2 . LEU A 61  ? 0.440 0.295 0.487 -0.068 0.063  -0.053 390 LEU AAA CD2 
454  N N   . CYS A 62  ? 0.444 0.275 0.435 -0.031 0.069  -0.012 391 CYS AAA N   
455  C CA  . CYS A 62  ? 0.452 0.284 0.436 -0.020 0.061  -0.004 391 CYS AAA CA  
456  C C   . CYS A 62  ? 0.422 0.274 0.415 -0.021 0.052  -0.007 391 CYS AAA C   
457  O O   . CYS A 62  ? 0.418 0.272 0.414 -0.026 0.055  -0.015 391 CYS AAA O   
458  C CB  . CYS A 62  ? 0.495 0.308 0.476 -0.013 0.069  0.001  391 CYS AAA CB  
459  S SG  . CYS A 62  ? 0.548 0.333 0.513 -0.007 0.082  0.010  391 CYS AAA SG  
460  N N   . PHE A 63  ? 0.405 0.267 0.401 -0.015 0.041  -0.002 392 PHE AAA N   
461  C CA  . PHE A 63  ? 0.393 0.272 0.402 -0.014 0.035  -0.002 392 PHE AAA CA  
462  C C   . PHE A 63  ? 0.396 0.276 0.419 -0.005 0.030  0.005  392 PHE AAA C   
463  O O   . PHE A 63  ? 0.405 0.275 0.423 0.002  0.025  0.010  392 PHE AAA O   
464  C CB  . PHE A 63  ? 0.383 0.276 0.394 -0.018 0.027  -0.003 392 PHE AAA CB  
465  C CG  . PHE A 63  ? 0.387 0.283 0.392 -0.027 0.030  -0.010 392 PHE AAA CG  
466  C CD1 . PHE A 63  ? 0.398 0.299 0.403 -0.031 0.032  -0.016 392 PHE AAA CD1 
467  C CD2 . PHE A 63  ? 0.419 0.310 0.420 -0.030 0.031  -0.011 392 PHE AAA CD2 
468  C CE1 . PHE A 63  ? 0.403 0.309 0.408 -0.039 0.030  -0.024 392 PHE AAA CE1 
469  C CE2 . PHE A 63  ? 0.419 0.316 0.426 -0.039 0.034  -0.017 392 PHE AAA CE2 
470  C CZ  . PHE A 63  ? 0.401 0.305 0.411 -0.043 0.031  -0.024 392 PHE AAA CZ  
471  N N   . THR A 64  ? 0.394 0.284 0.433 -0.003 0.033  0.006  393 THR AAA N   
472  C CA  . THR A 64  ? 0.419 0.313 0.484 0.006  0.030  0.013  393 THR AAA CA  
473  C C   . THR A 64  ? 0.433 0.338 0.513 0.008  0.012  0.014  393 THR AAA C   
474  O O   . THR A 64  ? 0.478 0.383 0.574 0.016  0.001  0.018  393 THR AAA O   
475  C CB  . THR A 64  ? 0.430 0.325 0.508 0.007  0.045  0.014  393 THR AAA CB  
476  O OG1 . THR A 64  ? 0.424 0.327 0.494 0.002  0.048  0.011  393 THR AAA OG1 
477  C CG2 . THR A 64  ? 0.449 0.327 0.510 0.008  0.059  0.010  393 THR AAA CG2 
478  N N   . ASN A 65  ? 0.434 0.348 0.509 0.002  0.009  0.011  394 ASN AAA N   
479  C CA  . ASN A 65  ? 0.443 0.365 0.527 0.003  -0.008 0.010  394 ASN AAA CA  
480  C C   . ASN A 65  ? 0.417 0.342 0.483 -0.004 -0.007 0.006  394 ASN AAA C   
481  O O   . ASN A 65  ? 0.378 0.305 0.435 -0.010 0.004  0.005  394 ASN AAA O   
482  C CB  . ASN A 65  ? 0.463 0.400 0.587 0.005  -0.012 0.013  394 ASN AAA CB  
483  C CG  . ASN A 65  ? 0.502 0.440 0.656 0.013  -0.019 0.016  394 ASN AAA CG  
484  O OD1 . ASN A 65  ? 0.484 0.415 0.634 0.019  -0.037 0.015  394 ASN AAA OD1 
485  N ND2 . ASN A 65  ? 0.521 0.464 0.703 0.015  -0.005 0.021  394 ASN AAA ND2 
486  N N   . VAL A 66  ? 0.415 0.339 0.475 -0.003 -0.019 0.004  395 VAL AAA N   
487  C CA  . VAL A 66  ? 0.400 0.329 0.453 -0.009 -0.019 0.001  395 VAL AAA CA  
488  C C   . VAL A 66  ? 0.396 0.335 0.474 -0.007 -0.031 -0.001 395 VAL AAA C   
489  O O   . VAL A 66  ? 0.417 0.351 0.499 -0.001 -0.046 -0.003 395 VAL AAA O   
490  C CB  . VAL A 66  ? 0.436 0.351 0.459 -0.009 -0.017 -0.002 395 VAL AAA CB  
491  C CG1 . VAL A 66  ? 0.439 0.360 0.461 -0.015 -0.016 -0.004 395 VAL AAA CG1 
492  C CG2 . VAL A 66  ? 0.454 0.359 0.463 -0.012 -0.004 -0.001 395 VAL AAA CG2 
493  N N   . TYR A 67  ? 0.394 0.261 0.529 0.025  0.079  0.027  396 TYR AAA N   
494  C CA  . TYR A 67  ? 0.383 0.275 0.515 0.027  0.069  0.031  396 TYR AAA CA  
495  C C   . TYR A 67  ? 0.368 0.274 0.479 0.018  0.056  0.028  396 TYR AAA C   
496  O O   . TYR A 67  ? 0.384 0.283 0.479 0.010  0.058  0.016  396 TYR AAA O   
497  C CB  . TYR A 67  ? 0.413 0.302 0.541 0.030  0.077  0.019  396 TYR AAA CB  
498  C CG  . TYR A 67  ? 0.461 0.334 0.612 0.039  0.094  0.021  396 TYR AAA CG  
499  C CD1 . TYR A 67  ? 0.496 0.381 0.678 0.049  0.094  0.037  396 TYR AAA CD1 
500  C CD2 . TYR A 67  ? 0.545 0.388 0.689 0.037  0.110  0.009  396 TYR AAA CD2 
501  C CE1 . TYR A 67  ? 0.505 0.375 0.714 0.059  0.112  0.041  396 TYR AAA CE1 
502  C CE2 . TYR A 67  ? 0.546 0.371 0.712 0.046  0.130  0.010  396 TYR AAA CE2 
503  C CZ  . TYR A 67  ? 0.535 0.374 0.735 0.058  0.131  0.027  396 TYR AAA CZ  
504  O OH  . TYR A 67  ? 0.570 0.390 0.796 0.068  0.153  0.029  396 TYR AAA OH  
505  N N   . ALA A 68  ? 0.341 0.265 0.453 0.019  0.045  0.040  397 ALA AAA N   
506  C CA  . ALA A 68  ? 0.314 0.250 0.407 0.012  0.036  0.039  397 ALA AAA CA  
507  C C   . ALA A 68  ? 0.304 0.256 0.390 0.014  0.030  0.036  397 ALA AAA C   
508  O O   . ALA A 68  ? 0.312 0.272 0.405 0.017  0.024  0.047  397 ALA AAA O   
509  C CB  . ALA A 68  ? 0.323 0.261 0.416 0.010  0.030  0.053  397 ALA AAA CB  
510  N N   . ASP A 69  ? 0.294 0.248 0.367 0.010  0.032  0.023  398 ASP AAA N   
511  C CA  . ASP A 69  ? 0.279 0.245 0.343 0.011  0.027  0.019  398 ASP AAA CA  
512  C C   . ASP A 69  ? 0.289 0.265 0.339 0.006  0.021  0.020  398 ASP AAA C   
513  O O   . ASP A 69  ? 0.297 0.270 0.344 0.001  0.023  0.017  398 ASP AAA O   
514  C CB  . ASP A 69  ? 0.292 0.253 0.351 0.011  0.032  0.006  398 ASP AAA CB  
515  C CG  . ASP A 69  ? 0.302 0.250 0.372 0.016  0.042  0.005  398 ASP AAA CG  
516  O OD1 . ASP A 69  ? 0.330 0.280 0.418 0.022  0.043  0.015  398 ASP AAA OD1 
517  O OD2 . ASP A 69  ? 0.323 0.259 0.383 0.013  0.049  -0.007 398 ASP AAA OD2 
518  N N   . SER A 70  ? 0.257 0.242 0.300 0.007  0.015  0.024  399 SER AAA N   
519  C CA  . SER A 70  ? 0.257 0.246 0.285 0.003  0.014  0.024  399 SER AAA CA  
520  C C   . SER A 70  ? 0.256 0.253 0.275 0.003  0.010  0.020  399 SER AAA C   
521  O O   . SER A 70  ? 0.252 0.252 0.274 0.006  0.006  0.022  399 SER AAA O   
522  C CB  . SER A 70  ? 0.281 0.267 0.304 -0.000 0.012  0.034  399 SER AAA CB  
523  O OG  . SER A 70  ? 0.305 0.293 0.330 0.001  0.005  0.044  399 SER AAA OG  
524  N N   . PHE A 71  ? 0.245 0.245 0.255 0.001  0.013  0.015  400 PHE AAA N   
525  C CA  . PHE A 71  ? 0.252 0.257 0.253 0.002  0.011  0.011  400 PHE AAA CA  
526  C C   . PHE A 71  ? 0.260 0.266 0.257 -0.000 0.017  0.008  400 PHE AAA C   
527  O O   . PHE A 71  ? 0.263 0.269 0.267 -0.002 0.021  0.010  400 PHE AAA O   
528  C CB  . PHE A 71  ? 0.236 0.246 0.244 0.004  0.010  0.005  400 PHE AAA CB  
529  C CG  . PHE A 71  ? 0.229 0.237 0.245 0.003  0.013  -0.001 400 PHE AAA CG  
530  C CD1 . PHE A 71  ? 0.235 0.248 0.252 0.001  0.013  -0.004 400 PHE AAA CD1 
531  C CD2 . PHE A 71  ? 0.239 0.240 0.261 0.004  0.014  -0.002 400 PHE AAA CD2 
532  C CE1 . PHE A 71  ? 0.252 0.263 0.274 -0.003 0.013  -0.008 400 PHE AAA CE1 
533  C CE2 . PHE A 71  ? 0.257 0.253 0.281 0.000  0.016  -0.008 400 PHE AAA CE2 
534  C CZ  . PHE A 71  ? 0.264 0.265 0.287 -0.004 0.014  -0.010 400 PHE AAA CZ  
535  N N   . VAL A 72  ? 0.270 0.279 0.259 0.001  0.018  0.005  401 VAL AAA N   
536  C CA  . VAL A 72  ? 0.257 0.267 0.246 0.001  0.026  0.003  401 VAL AAA CA  
537  C C   . VAL A 72  ? 0.232 0.250 0.231 0.003  0.024  -0.001 401 VAL AAA C   
538  O O   . VAL A 72  ? 0.228 0.247 0.223 0.005  0.019  -0.004 401 VAL AAA O   
539  C CB  . VAL A 72  ? 0.280 0.281 0.249 -0.001 0.031  0.004  401 VAL AAA CB  
540  C CG1 . VAL A 72  ? 0.297 0.298 0.268 0.001  0.041  0.001  401 VAL AAA CG1 
541  C CG2 . VAL A 72  ? 0.308 0.300 0.264 -0.006 0.034  0.010  401 VAL AAA CG2 
542  N N   . ILE A 73  ? 0.226 0.250 0.239 0.003  0.027  -0.001 402 ILE AAA N   
543  C CA  . ILE A 73  ? 0.232 0.265 0.257 0.005  0.024  -0.003 402 ILE AAA CA  
544  C C   . ILE A 73  ? 0.235 0.273 0.275 0.006  0.033  0.001  402 ILE AAA C   
545  O O   . ILE A 73  ? 0.259 0.293 0.298 0.005  0.042  0.003  402 ILE AAA O   
546  C CB  . ILE A 73  ? 0.221 0.259 0.254 0.002  0.016  -0.004 402 ILE AAA CB  
547  C CG1 . ILE A 73  ? 0.251 0.289 0.293 -0.003 0.016  -0.002 402 ILE AAA CG1 
548  C CG2 . ILE A 73  ? 0.228 0.260 0.249 0.002  0.011  -0.008 402 ILE AAA CG2 
549  C CD1 . ILE A 73  ? 0.246 0.285 0.292 -0.008 0.008  -0.004 402 ILE AAA CD1 
550  N N   . ARG A 74  ? 0.222 0.270 0.278 0.008  0.031  0.003  403 ARG AAA N   
551  C CA  . ARG A 74  ? 0.237 0.293 0.316 0.010  0.039  0.009  403 ARG AAA CA  
552  C C   . ARG A 74  ? 0.236 0.302 0.335 0.005  0.035  0.014  403 ARG AAA C   
553  O O   . ARG A 74  ? 0.235 0.303 0.332 -0.000 0.023  0.012  403 ARG AAA O   
554  C CB  . ARG A 74  ? 0.252 0.316 0.346 0.014  0.036  0.011  403 ARG AAA CB  
555  C CG  . ARG A 74  ? 0.281 0.334 0.360 0.019  0.043  0.008  403 ARG AAA CG  
556  C CD  . ARG A 74  ? 0.294 0.354 0.384 0.021  0.036  0.010  403 ARG AAA CD  
557  N NE  . ARG A 74  ? 0.289 0.364 0.412 0.023  0.034  0.020  403 ARG AAA NE  
558  C CZ  . ARG A 74  ? 0.311 0.392 0.450 0.027  0.032  0.026  403 ARG AAA CZ  
559  N NH1 . ARG A 74  ? 0.309 0.378 0.431 0.030  0.034  0.021  403 ARG AAA NH1 
560  N NH2 . ARG A 74  ? 0.301 0.398 0.475 0.027  0.028  0.038  403 ARG AAA NH2 
561  N N   . GLY A 75  ? 0.221 0.292 0.340 0.006  0.047  0.020  404 GLY AAA N   
562  C CA  . GLY A 75  ? 0.218 0.302 0.363 0.001  0.043  0.026  404 GLY AAA CA  
563  C C   . GLY A 75  ? 0.209 0.305 0.369 -0.005 0.026  0.030  404 GLY AAA C   
564  O O   . GLY A 75  ? 0.203 0.300 0.363 -0.013 0.016  0.030  404 GLY AAA O   
565  N N   . ASP A 76  ? 0.221 0.322 0.388 -0.001 0.022  0.032  405 ASP AAA N   
566  C CA  . ASP A 76  ? 0.225 0.339 0.406 -0.007 0.004  0.038  405 ASP AAA CA  
567  C C   . ASP A 76  ? 0.218 0.321 0.367 -0.013 -0.009 0.029  405 ASP AAA C   
568  O O   . ASP A 76  ? 0.243 0.351 0.393 -0.020 -0.024 0.032  405 ASP AAA O   
569  C CB  . ASP A 76  ? 0.242 0.367 0.448 -0.001 0.005  0.047  405 ASP AAA CB  
570  C CG  . ASP A 76  ? 0.256 0.371 0.443 0.007  0.010  0.041  405 ASP AAA CG  
571  O OD1 . ASP A 76  ? 0.245 0.346 0.398 0.007  0.010  0.031  405 ASP AAA OD1 
572  O OD2 . ASP A 76  ? 0.264 0.386 0.473 0.014  0.015  0.049  405 ASP AAA OD2 
573  N N   . GLU A 77  ? 0.213 0.300 0.334 -0.010 -0.003 0.019  406 GLU AAA N   
574  C CA  . GLU A 77  ? 0.222 0.298 0.317 -0.014 -0.011 0.011  406 GLU AAA CA  
575  C C   . GLU A 77  ? 0.237 0.304 0.323 -0.021 -0.011 0.007  406 GLU AAA C   
576  O O   . GLU A 77  ? 0.248 0.304 0.314 -0.025 -0.016 0.000  406 GLU AAA O   
577  C CB  . GLU A 77  ? 0.219 0.285 0.293 -0.007 -0.004 0.005  406 GLU AAA CB  
578  C CG  . GLU A 77  ? 0.232 0.303 0.310 -0.002 -0.005 0.007  406 GLU AAA CG  
579  C CD  . GLU A 77  ? 0.263 0.325 0.323 0.004  0.002  0.002  406 GLU AAA CD  
580  O OE1 . GLU A 77  ? 0.261 0.315 0.312 0.006  0.009  -0.001 406 GLU AAA OE1 
581  O OE2 . GLU A 77  ? 0.298 0.359 0.354 0.006  -0.001 0.002  406 GLU AAA OE2 
582  N N   . VAL A 78  ? 0.239 0.309 0.338 -0.021 -0.005 0.010  407 VAL AAA N   
583  C CA  . VAL A 78  ? 0.248 0.307 0.340 -0.027 -0.004 0.007  407 VAL AAA CA  
584  C C   . VAL A 78  ? 0.268 0.324 0.356 -0.038 -0.017 0.005  407 VAL AAA C   
585  O O   . VAL A 78  ? 0.265 0.307 0.338 -0.042 -0.017 -0.001 407 VAL AAA O   
586  C CB  . VAL A 78  ? 0.268 0.332 0.376 -0.026 0.005  0.013  407 VAL AAA CB  
587  C CG1 . VAL A 78  ? 0.298 0.351 0.402 -0.033 0.004  0.011  407 VAL AAA CG1 
588  C CG2 . VAL A 78  ? 0.261 0.321 0.361 -0.017 0.018  0.013  407 VAL AAA CG2 
589  N N   . ARG A 79  ? 0.280 0.349 0.384 -0.044 -0.027 0.012  408 ARG AAA N   
590  C CA  . ARG A 79  ? 0.301 0.367 0.398 -0.058 -0.042 0.011  408 ARG AAA CA  
591  C C   . ARG A 79  ? 0.311 0.358 0.374 -0.060 -0.044 0.000  408 ARG AAA C   
592  O O   . ARG A 79  ? 0.312 0.346 0.357 -0.072 -0.052 -0.005 408 ARG AAA O   
593  C CB  . ARG A 79  ? 0.343 0.428 0.463 -0.064 -0.055 0.022  408 ARG AAA CB  
594  C CG  . ARG A 79  ? 0.364 0.456 0.485 -0.054 -0.055 0.025  408 ARG AAA CG  
595  C CD  . ARG A 79  ? 0.427 0.537 0.571 -0.061 -0.070 0.038  408 ARG AAA CD  
596  N NE  . ARG A 79  ? 0.495 0.596 0.616 -0.076 -0.088 0.036  408 ARG AAA NE  
597  C CZ  . ARG A 79  ? 0.531 0.619 0.620 -0.078 -0.092 0.030  408 ARG AAA CZ  
598  N NH1 . ARG A 79  ? 0.550 0.634 0.629 -0.065 -0.081 0.024  408 ARG AAA NH1 
599  N NH2 . ARG A 79  ? 0.627 0.704 0.692 -0.094 -0.108 0.028  408 ARG AAA NH2 
600  N N   . GLN A 80  ? 0.288 0.332 0.340 -0.049 -0.037 -0.004 409 GLN AAA N   
601  C CA  . GLN A 80  ? 0.310 0.338 0.333 -0.050 -0.036 -0.013 409 GLN AAA CA  
602  C C   . GLN A 80  ? 0.310 0.320 0.320 -0.048 -0.026 -0.021 409 GLN AAA C   
603  O O   . GLN A 80  ? 0.340 0.333 0.327 -0.051 -0.024 -0.029 409 GLN AAA O   
604  C CB  . GLN A 80  ? 0.284 0.318 0.305 -0.039 -0.033 -0.012 409 GLN AAA CB  
605  C CG  . GLN A 80  ? 0.292 0.340 0.322 -0.042 -0.043 -0.004 409 GLN AAA CG  
606  C CD  . GLN A 80  ? 0.283 0.333 0.309 -0.033 -0.039 -0.004 409 GLN AAA CD  
607  O OE1 . GLN A 80  ? 0.283 0.321 0.289 -0.030 -0.034 -0.011 409 GLN AAA OE1 
608  N NE2 . GLN A 80  ? 0.290 0.354 0.336 -0.027 -0.041 0.004  409 GLN AAA NE2 
609  N N   . ILE A 81  ? 0.309 0.321 0.332 -0.044 -0.019 -0.019 410 ILE AAA N   
610  C CA  . ILE A 81  ? 0.311 0.306 0.326 -0.042 -0.010 -0.024 410 ILE AAA CA  
611  C C   . ILE A 81  ? 0.328 0.310 0.339 -0.055 -0.014 -0.027 410 ILE AAA C   
612  O O   . ILE A 81  ? 0.322 0.305 0.345 -0.057 -0.012 -0.024 410 ILE AAA O   
613  C CB  . ILE A 81  ? 0.289 0.291 0.318 -0.033 -0.002 -0.019 410 ILE AAA CB  
614  C CG1 . ILE A 81  ? 0.277 0.291 0.308 -0.023 -0.001 -0.015 410 ILE AAA CG1 
615  C CG2 . ILE A 81  ? 0.295 0.281 0.318 -0.029 0.006  -0.021 410 ILE AAA CG2 
616  C CD1 . ILE A 81  ? 0.279 0.287 0.296 -0.019 0.000  -0.020 410 ILE AAA CD1 
617  N N   . ALA A 82  ? 0.349 0.317 0.339 -0.064 -0.019 -0.034 411 ALA AAA N   
618  C CA  . ALA A 82  ? 0.396 0.347 0.374 -0.080 -0.024 -0.039 411 ALA AAA CA  
619  C C   . ALA A 82  ? 0.426 0.354 0.371 -0.086 -0.022 -0.049 411 ALA AAA C   
620  O O   . ALA A 82  ? 0.399 0.333 0.336 -0.082 -0.023 -0.050 411 ALA AAA O   
621  C CB  . ALA A 82  ? 0.402 0.368 0.393 -0.092 -0.039 -0.031 411 ALA AAA CB  
622  N N   . PRO A 83  ? 0.454 0.353 0.377 -0.097 -0.018 -0.059 412 PRO AAA N   
623  C CA  . PRO A 83  ? 0.506 0.380 0.393 -0.106 -0.016 -0.070 412 PRO AAA CA  
624  C C   . PRO A 83  ? 0.513 0.395 0.385 -0.118 -0.034 -0.066 412 PRO AAA C   
625  O O   . PRO A 83  ? 0.504 0.403 0.391 -0.127 -0.050 -0.058 412 PRO AAA O   
626  C CB  . PRO A 83  ? 0.546 0.388 0.414 -0.119 -0.011 -0.079 412 PRO AAA CB  
627  C CG  . PRO A 83  ? 0.536 0.386 0.434 -0.111 -0.006 -0.073 412 PRO AAA CG  
628  C CD  . PRO A 83  ? 0.474 0.362 0.405 -0.102 -0.015 -0.060 412 PRO AAA CD  
629  N N   . GLY A 84  ? 0.523 0.394 0.369 -0.119 -0.031 -0.072 413 GLY AAA N   
630  C CA  . GLY A 84  ? 0.571 0.443 0.394 -0.134 -0.048 -0.069 413 GLY AAA CA  
631  C C   . GLY A 84  ? 0.548 0.456 0.399 -0.126 -0.061 -0.055 413 GLY AAA C   
632  O O   . GLY A 84  ? 0.576 0.488 0.415 -0.139 -0.078 -0.049 413 GLY AAA O   
633  N N   . GLN A 85  ? 0.478 0.408 0.362 -0.108 -0.053 -0.049 414 GLN AAA N   
634  C CA  . GLN A 85  ? 0.461 0.421 0.372 -0.100 -0.063 -0.036 414 GLN AAA CA  
635  C C   . GLN A 85  ? 0.456 0.417 0.356 -0.091 -0.057 -0.037 414 GLN AAA C   
636  O O   . GLN A 85  ? 0.464 0.406 0.344 -0.087 -0.043 -0.047 414 GLN AAA O   
637  C CB  . GLN A 85  ? 0.425 0.407 0.375 -0.087 -0.057 -0.029 414 GLN AAA CB  
638  C CG  . GLN A 85  ? 0.460 0.444 0.425 -0.095 -0.062 -0.026 414 GLN AAA CG  
639  C CD  . GLN A 85  ? 0.533 0.525 0.501 -0.111 -0.082 -0.018 414 GLN AAA CD  
640  O OE1 . GLN A 85  ? 0.586 0.601 0.576 -0.109 -0.091 -0.006 414 GLN AAA OE1 
641  N NE2 . GLN A 85  ? 0.595 0.568 0.543 -0.129 -0.089 -0.023 414 GLN AAA NE2 
642  N N   . THR A 86  ? 0.438 0.420 0.354 -0.089 -0.068 -0.026 415 THR AAA N   
643  C CA  . THR A 86  ? 0.452 0.439 0.363 -0.081 -0.065 -0.024 415 THR AAA CA  
644  C C   . THR A 86  ? 0.400 0.412 0.346 -0.067 -0.065 -0.014 415 THR AAA C   
645  O O   . THR A 86  ? 0.386 0.413 0.359 -0.067 -0.069 -0.007 415 THR AAA O   
646  C CB  . THR A 86  ? 0.499 0.479 0.384 -0.095 -0.079 -0.021 415 THR AAA CB  
647  O OG1 . THR A 86  ? 0.633 0.611 0.507 -0.087 -0.072 -0.022 415 THR AAA OG1 
648  C CG2 . THR A 86  ? 0.490 0.491 0.396 -0.102 -0.100 -0.006 415 THR AAA CG2 
649  N N   . GLY A 87  ? 0.398 0.414 0.344 -0.057 -0.059 -0.014 416 GLY AAA N   
650  C CA  . GLY A 87  ? 0.332 0.366 0.306 -0.044 -0.055 -0.007 416 GLY AAA CA  
651  C C   . GLY A 87  ? 0.321 0.349 0.291 -0.033 -0.041 -0.013 416 GLY AAA C   
652  O O   . GLY A 87  ? 0.286 0.300 0.239 -0.034 -0.033 -0.022 416 GLY AAA O   
653  N N   . LYS A 88  ? 0.312 0.351 0.299 -0.023 -0.037 -0.009 417 LYS AAA N   
654  C CA  . LYS A 88  ? 0.303 0.338 0.286 -0.014 -0.027 -0.013 417 LYS AAA CA  
655  C C   . LYS A 88  ? 0.277 0.306 0.259 -0.012 -0.018 -0.019 417 LYS AAA C   
656  O O   . LYS A 88  ? 0.267 0.288 0.240 -0.009 -0.012 -0.023 417 LYS AAA O   
657  C CB  . LYS A 88  ? 0.344 0.389 0.343 -0.006 -0.024 -0.008 417 LYS AAA CB  
658  C CG  . LYS A 88  ? 0.413 0.464 0.418 -0.006 -0.031 -0.000 417 LYS AAA CG  
659  C CD  . LYS A 88  ? 0.486 0.530 0.471 -0.011 -0.035 -0.001 417 LYS AAA CD  
660  C CE  . LYS A 88  ? 0.513 0.565 0.507 -0.012 -0.045 0.009  417 LYS AAA CE  
661  N NZ  . LYS A 88  ? 0.520 0.563 0.490 -0.018 -0.048 0.008  417 LYS AAA NZ  
662  N N   . ILE A 89  ? 0.252 0.284 0.245 -0.013 -0.018 -0.017 418 ILE AAA N   
663  C CA  . ILE A 89  ? 0.259 0.285 0.253 -0.010 -0.011 -0.021 418 ILE AAA CA  
664  C C   . ILE A 89  ? 0.263 0.274 0.242 -0.016 -0.009 -0.027 418 ILE AAA C   
665  O O   . ILE A 89  ? 0.270 0.273 0.245 -0.012 -0.001 -0.031 418 ILE AAA O   
666  C CB  . ILE A 89  ? 0.247 0.279 0.256 -0.010 -0.010 -0.017 418 ILE AAA CB  
667  C CG1 . ILE A 89  ? 0.249 0.291 0.270 -0.004 -0.008 -0.012 418 ILE AAA CG1 
668  C CG2 . ILE A 89  ? 0.256 0.281 0.265 -0.008 -0.004 -0.019 418 ILE AAA CG2 
669  C CD1 . ILE A 89  ? 0.241 0.280 0.254 0.002  -0.003 -0.013 418 ILE AAA CD1 
670  N N   . ALA A 90  ? 0.265 0.271 0.237 -0.026 -0.016 -0.029 419 ALA AAA N   
671  C CA  . ALA A 90  ? 0.297 0.284 0.250 -0.033 -0.012 -0.036 419 ALA AAA CA  
672  C C   . ALA A 90  ? 0.316 0.293 0.251 -0.032 -0.006 -0.042 419 ALA AAA C   
673  O O   . ALA A 90  ? 0.352 0.313 0.278 -0.031 0.005  -0.048 419 ALA AAA O   
674  C CB  . ALA A 90  ? 0.327 0.310 0.271 -0.047 -0.023 -0.036 419 ALA AAA CB  
675  N N   . ASP A 91  ? 0.304 0.288 0.234 -0.032 -0.011 -0.038 420 ASP AAA N   
676  C CA  . ASP A 91  ? 0.333 0.306 0.244 -0.033 -0.005 -0.042 420 ASP AAA CA  
677  C C   . ASP A 91  ? 0.300 0.278 0.224 -0.021 0.006  -0.042 420 ASP AAA C   
678  O O   . ASP A 91  ? 0.332 0.296 0.246 -0.020 0.017  -0.047 420 ASP AAA O   
679  C CB  . ASP A 91  ? 0.352 0.331 0.254 -0.038 -0.016 -0.037 420 ASP AAA CB  
680  C CG  . ASP A 91  ? 0.421 0.397 0.310 -0.051 -0.030 -0.035 420 ASP AAA CG  
681  O OD1 . ASP A 91  ? 0.482 0.444 0.360 -0.060 -0.030 -0.041 420 ASP AAA OD1 
682  O OD2 . ASP A 91  ? 0.447 0.434 0.339 -0.054 -0.042 -0.027 420 ASP AAA OD2 
683  N N   . TYR A 92  ? 0.278 0.271 0.221 -0.013 0.003  -0.036 421 TYR AAA N   
684  C CA  . TYR A 92  ? 0.273 0.272 0.226 -0.005 0.009  -0.034 421 TYR AAA CA  
685  C C   . TYR A 92  ? 0.253 0.256 0.223 0.001  0.012  -0.031 421 TYR AAA C   
686  O O   . TYR A 92  ? 0.256 0.262 0.233 0.006  0.015  -0.028 421 TYR AAA O   
687  C CB  . TYR A 92  ? 0.247 0.256 0.203 -0.004 0.002  -0.029 421 TYR AAA CB  
688  C CG  . TYR A 92  ? 0.280 0.285 0.220 -0.009 -0.002 -0.028 421 TYR AAA CG  
689  C CD1 . TYR A 92  ? 0.303 0.295 0.223 -0.015 0.002  -0.033 421 TYR AAA CD1 
690  C CD2 . TYR A 92  ? 0.283 0.298 0.228 -0.008 -0.010 -0.023 421 TYR AAA CD2 
691  C CE1 . TYR A 92  ? 0.341 0.328 0.243 -0.022 -0.003 -0.032 421 TYR AAA CE1 
692  C CE2 . TYR A 92  ? 0.301 0.313 0.233 -0.013 -0.015 -0.020 421 TYR AAA CE2 
693  C CZ  . TYR A 92  ? 0.364 0.362 0.273 -0.021 -0.012 -0.024 421 TYR AAA CZ  
694  O OH  . TYR A 92  ? 0.366 0.361 0.259 -0.027 -0.019 -0.021 421 TYR AAA OH  
695  N N   . ASN A 93  ? 0.264 0.267 0.240 -0.000 0.010  -0.031 422 ASN AAA N   
696  C CA  . ASN A 93  ? 0.251 0.259 0.240 0.005  0.011  -0.026 422 ASN AAA CA  
697  C C   . ASN A 93  ? 0.257 0.256 0.251 0.004  0.016  -0.027 422 ASN AAA C   
698  O O   . ASN A 93  ? 0.272 0.270 0.276 0.009  0.021  -0.024 422 ASN AAA O   
699  C CB  . ASN A 93  ? 0.234 0.251 0.227 0.005  0.005  -0.022 422 ASN AAA CB  
700  C CG  . ASN A 93  ? 0.231 0.254 0.223 0.007  0.003  -0.020 422 ASN AAA CG  
701  O OD1 . ASN A 93  ? 0.244 0.270 0.238 0.009  0.003  -0.018 422 ASN AAA OD1 
702  N ND2 . ASN A 93  ? 0.230 0.256 0.218 0.004  -0.001 -0.021 422 ASN AAA ND2 
703  N N   . TYR A 94  ? 0.252 0.244 0.239 -0.001 0.015  -0.031 423 TYR AAA N   
704  C CA  . TYR A 94  ? 0.269 0.250 0.260 -0.003 0.020  -0.032 423 TYR AAA CA  
705  C C   . TYR A 94  ? 0.285 0.254 0.261 -0.012 0.019  -0.039 423 TYR AAA C   
706  O O   . TYR A 94  ? 0.284 0.260 0.259 -0.018 0.010  -0.038 423 TYR AAA O   
707  C CB  . TYR A 94  ? 0.260 0.249 0.263 -0.001 0.017  -0.026 423 TYR AAA CB  
708  C CG  . TYR A 94  ? 0.262 0.239 0.270 -0.002 0.022  -0.026 423 TYR AAA CG  
709  C CD1 . TYR A 94  ? 0.275 0.249 0.294 0.005  0.028  -0.021 423 TYR AAA CD1 
710  C CD2 . TYR A 94  ? 0.283 0.253 0.288 -0.009 0.021  -0.029 423 TYR AAA CD2 
711  C CE1 . TYR A 94  ? 0.277 0.240 0.304 0.005  0.033  -0.020 423 TYR AAA CE1 
712  C CE2 . TYR A 94  ? 0.285 0.242 0.294 -0.010 0.027  -0.029 423 TYR AAA CE2 
713  C CZ  . TYR A 94  ? 0.284 0.238 0.305 -0.002 0.033  -0.024 423 TYR AAA CZ  
714  O OH  . TYR A 94  ? 0.296 0.236 0.324 -0.002 0.039  -0.023 423 TYR AAA OH  
715  N N   . LYS A 95  ? 0.297 0.247 0.264 -0.014 0.028  -0.046 424 LYS AAA N   
716  C CA  . LYS A 95  ? 0.333 0.265 0.277 -0.025 0.028  -0.054 424 LYS AAA CA  
717  C C   . LYS A 95  ? 0.353 0.266 0.298 -0.028 0.036  -0.058 424 LYS AAA C   
718  O O   . LYS A 95  ? 0.354 0.257 0.306 -0.020 0.049  -0.059 424 LYS AAA O   
719  C CB  . LYS A 95  ? 0.349 0.269 0.275 -0.026 0.036  -0.060 424 LYS AAA CB  
720  C CG  . LYS A 95  ? 0.403 0.299 0.297 -0.040 0.036  -0.070 424 LYS AAA CG  
721  C CD  . LYS A 95  ? 0.438 0.343 0.324 -0.052 0.018  -0.067 424 LYS AAA CD  
722  C CE  . LYS A 95  ? 0.495 0.378 0.346 -0.069 0.014  -0.075 424 LYS AAA CE  
723  N NZ  . LYS A 95  ? 0.494 0.391 0.346 -0.080 -0.007 -0.068 424 LYS AAA NZ  
724  N N   . LEU A 96  ? 0.370 0.278 0.308 -0.038 0.028  -0.060 425 LEU AAA N   
725  C CA  . LEU A 96  ? 0.395 0.280 0.328 -0.044 0.036  -0.066 425 LEU AAA CA  
726  C C   . LEU A 96  ? 0.462 0.319 0.362 -0.055 0.041  -0.078 425 LEU AAA C   
727  O O   . LEU A 96  ? 0.503 0.362 0.384 -0.064 0.032  -0.080 425 LEU AAA O   
728  C CB  . LEU A 96  ? 0.398 0.292 0.340 -0.052 0.024  -0.061 425 LEU AAA CB  
729  C CG  . LEU A 96  ? 0.377 0.291 0.347 -0.042 0.023  -0.051 425 LEU AAA CG  
730  C CD1 . LEU A 96  ? 0.375 0.297 0.354 -0.050 0.014  -0.046 425 LEU AAA CD1 
731  C CD2 . LEU A 96  ? 0.406 0.309 0.387 -0.032 0.036  -0.049 425 LEU AAA CD2 
732  N N   . PRO A 97  ? 0.475 0.304 0.367 -0.056 0.057  -0.085 426 PRO AAA N   
733  C CA  . PRO A 97  ? 0.541 0.336 0.397 -0.069 0.065  -0.099 426 PRO AAA CA  
734  C C   . PRO A 97  ? 0.600 0.382 0.434 -0.088 0.051  -0.103 426 PRO AAA C   
735  O O   . PRO A 97  ? 0.566 0.364 0.421 -0.090 0.040  -0.096 426 PRO AAA O   
736  C CB  . PRO A 97  ? 0.556 0.325 0.419 -0.060 0.088  -0.104 426 PRO AAA CB  
737  C CG  . PRO A 97  ? 0.519 0.306 0.418 -0.052 0.084  -0.093 426 PRO AAA CG  
738  C CD  . PRO A 97  ? 0.475 0.301 0.393 -0.045 0.068  -0.081 426 PRO AAA CD  
739  N N   . ASP A 98  ? 0.662 0.417 0.455 -0.104 0.051  -0.114 427 ASP AAA N   
740  C CA  . ASP A 98  ? 0.703 0.442 0.470 -0.127 0.037  -0.119 427 ASP AAA CA  
741  C C   . ASP A 98  ? 0.695 0.415 0.471 -0.129 0.046  -0.122 427 ASP AAA C   
742  O O   . ASP A 98  ? 0.719 0.444 0.499 -0.141 0.029  -0.119 427 ASP AAA O   
743  C CB  . ASP A 98  ? 0.767 0.473 0.481 -0.144 0.039  -0.131 427 ASP AAA CB  
744  C CG  . ASP A 98  ? 0.814 0.539 0.518 -0.146 0.027  -0.125 427 ASP AAA CG  
745  O OD1 . ASP A 98  ? 0.786 0.551 0.523 -0.136 0.013  -0.112 427 ASP AAA OD1 
746  O OD2 . ASP A 98  ? 0.921 0.619 0.582 -0.156 0.033  -0.135 427 ASP AAA OD2 
747  N N   . ASP A 99  ? 0.703 0.400 0.482 -0.117 0.070  -0.129 428 ASP AAA N   
748  C CA  . ASP A 99  ? 0.752 0.421 0.536 -0.119 0.083  -0.134 428 ASP AAA CA  
749  C C   . ASP A 99  ? 0.681 0.378 0.514 -0.101 0.083  -0.120 428 ASP AAA C   
750  O O   . ASP A 99  ? 0.723 0.401 0.569 -0.095 0.099  -0.122 428 ASP AAA O   
751  C CB  . ASP A 99  ? 0.807 0.432 0.567 -0.117 0.112  -0.148 428 ASP AAA CB  
752  C CG  . ASP A 99  ? 0.817 0.453 0.604 -0.094 0.131  -0.143 428 ASP AAA CG  
753  O OD1 . ASP A 99  ? 0.750 0.426 0.567 -0.081 0.120  -0.130 428 ASP AAA OD1 
754  O OD2 . ASP A 99  ? 0.874 0.476 0.650 -0.089 0.158  -0.153 428 ASP AAA OD2 
755  N N   . PHE A 100 ? 0.616 0.354 0.474 -0.095 0.067  -0.107 429 PHE AAA N   
756  C CA  . PHE A 100 ? 0.562 0.328 0.461 -0.080 0.066  -0.093 429 PHE AAA CA  
757  C C   . PHE A 100 ? 0.572 0.325 0.481 -0.085 0.066  -0.092 429 PHE AAA C   
758  O O   . PHE A 100 ? 0.577 0.324 0.473 -0.103 0.054  -0.095 429 PHE AAA O   
759  C CB  . PHE A 100 ? 0.513 0.319 0.428 -0.077 0.047  -0.082 429 PHE AAA CB  
760  C CG  . PHE A 100 ? 0.486 0.317 0.436 -0.065 0.045  -0.069 429 PHE AAA CG  
761  C CD1 . PHE A 100 ? 0.464 0.296 0.431 -0.049 0.058  -0.064 429 PHE AAA CD1 
762  C CD2 . PHE A 100 ? 0.474 0.327 0.438 -0.069 0.032  -0.061 429 PHE AAA CD2 
763  C CE1 . PHE A 100 ? 0.441 0.293 0.434 -0.040 0.055  -0.051 429 PHE AAA CE1 
764  C CE2 . PHE A 100 ? 0.431 0.303 0.421 -0.059 0.032  -0.049 429 PHE AAA CE2 
765  C CZ  . PHE A 100 ? 0.441 0.312 0.442 -0.045 0.042  -0.045 429 PHE AAA CZ  
766  N N   . THR A 101 ? 0.556 0.306 0.490 -0.072 0.079  -0.086 430 THR AAA N   
767  C CA  . THR A 101 ? 0.566 0.309 0.516 -0.074 0.080  -0.081 430 THR AAA CA  
768  C C   . THR A 101 ? 0.513 0.290 0.497 -0.060 0.075  -0.064 430 THR AAA C   
769  O O   . THR A 101 ? 0.484 0.264 0.485 -0.044 0.084  -0.058 430 THR AAA O   
770  C CB  . THR A 101 ? 0.611 0.314 0.558 -0.072 0.100  -0.088 430 THR AAA CB  
771  O OG1 . THR A 101 ? 0.683 0.352 0.592 -0.087 0.106  -0.105 430 THR AAA OG1 
772  C CG2 . THR A 101 ? 0.627 0.324 0.591 -0.075 0.100  -0.081 430 THR AAA CG2 
773  N N   . GLY A 102 ? 0.480 0.279 0.472 -0.065 0.060  -0.056 431 GLY AAA N   
774  C CA  . GLY A 102 ? 0.447 0.276 0.464 -0.054 0.055  -0.042 431 GLY AAA CA  
775  C C   . GLY A 102 ? 0.430 0.283 0.452 -0.062 0.041  -0.036 431 GLY AAA C   
776  O O   . GLY A 102 ? 0.455 0.304 0.467 -0.077 0.033  -0.042 431 GLY AAA O   
777  N N   . CYS A 103 ? 0.395 0.271 0.432 -0.053 0.038  -0.025 432 CYS AAA N   
778  C CA  . CYS A 103 ? 0.397 0.297 0.444 -0.058 0.029  -0.018 432 CYS AAA CA  
779  C C   . CYS A 103 ? 0.353 0.276 0.402 -0.049 0.026  -0.014 432 CYS AAA C   
780  O O   . CYS A 103 ? 0.353 0.276 0.402 -0.038 0.031  -0.011 432 CYS AAA O   
781  C CB  . CYS A 103 ? 0.415 0.316 0.477 -0.059 0.032  -0.008 432 CYS AAA CB  
782  S SG  . CYS A 103 ? 0.484 0.355 0.545 -0.070 0.037  -0.013 432 CYS AAA SG  
783  N N   . VAL A 104 ? 0.340 0.280 0.391 -0.053 0.018  -0.013 433 VAL AAA N   
784  C CA  . VAL A 104 ? 0.312 0.274 0.367 -0.046 0.016  -0.009 433 VAL AAA CA  
785  C C   . VAL A 104 ? 0.302 0.278 0.371 -0.046 0.018  0.001  433 VAL AAA C   
786  O O   . VAL A 104 ? 0.313 0.293 0.393 -0.055 0.015  0.003  433 VAL AAA O   
787  C CB  . VAL A 104 ? 0.306 0.275 0.354 -0.050 0.008  -0.014 433 VAL AAA CB  
788  C CG1 . VAL A 104 ? 0.299 0.288 0.352 -0.042 0.007  -0.009 433 VAL AAA CG1 
789  C CG2 . VAL A 104 ? 0.332 0.284 0.361 -0.051 0.009  -0.024 433 VAL AAA CG2 
790  N N   . ILE A 105 ? 0.289 0.269 0.357 -0.037 0.023  0.006  434 ILE AAA N   
791  C CA  . ILE A 105 ? 0.304 0.292 0.380 -0.037 0.029  0.015  434 ILE AAA CA  
792  C C   . ILE A 105 ? 0.284 0.284 0.356 -0.030 0.031  0.016  434 ILE AAA C   
793  O O   . ILE A 105 ? 0.281 0.279 0.341 -0.024 0.029  0.014  434 ILE AAA O   
794  C CB  . ILE A 105 ? 0.309 0.285 0.382 -0.035 0.034  0.021  434 ILE AAA CB  
795  C CG1 . ILE A 105 ? 0.356 0.316 0.433 -0.040 0.034  0.019  434 ILE AAA CG1 
796  C CG2 . ILE A 105 ? 0.329 0.310 0.406 -0.036 0.041  0.030  434 ILE AAA CG2 
797  C CD1 . ILE A 105 ? 0.357 0.303 0.432 -0.036 0.038  0.025  434 ILE AAA CD1 
798  N N   . ALA A 106 ? 0.294 0.307 0.378 -0.032 0.034  0.020  435 ALA AAA N   
799  C CA  . ALA A 106 ? 0.300 0.321 0.380 -0.026 0.038  0.021  435 ALA AAA CA  
800  C C   . ALA A 106 ? 0.318 0.344 0.406 -0.026 0.050  0.028  435 ALA AAA C   
801  O O   . ALA A 106 ? 0.322 0.353 0.428 -0.032 0.053  0.032  435 ALA AAA O   
802  C CB  . ALA A 106 ? 0.301 0.333 0.388 -0.025 0.032  0.017  435 ALA AAA CB  
803  N N   . TRP A 107 ? 0.305 0.329 0.379 -0.021 0.058  0.028  436 TRP AAA N   
804  C CA  . TRP A 107 ? 0.316 0.341 0.394 -0.020 0.074  0.033  436 TRP AAA CA  
805  C C   . TRP A 107 ? 0.307 0.331 0.373 -0.015 0.080  0.030  436 TRP AAA C   
806  O O   . TRP A 107 ? 0.296 0.313 0.343 -0.012 0.073  0.025  436 TRP AAA O   
807  C CB  . TRP A 107 ? 0.344 0.355 0.406 -0.024 0.081  0.038  436 TRP AAA CB  
808  C CG  . TRP A 107 ? 0.348 0.345 0.377 -0.023 0.078  0.038  436 TRP AAA CG  
809  C CD1 . TRP A 107 ? 0.367 0.353 0.370 -0.022 0.086  0.038  436 TRP AAA CD1 
810  C CD2 . TRP A 107 ? 0.349 0.341 0.371 -0.022 0.064  0.037  436 TRP AAA CD2 
811  N NE1 . TRP A 107 ? 0.390 0.366 0.370 -0.023 0.076  0.039  436 TRP AAA NE1 
812  C CE2 . TRP A 107 ? 0.368 0.349 0.362 -0.022 0.063  0.039  436 TRP AAA CE2 
813  C CE3 . TRP A 107 ? 0.347 0.341 0.382 -0.023 0.054  0.035  436 TRP AAA CE3 
814  C CZ2 . TRP A 107 ? 0.371 0.347 0.357 -0.022 0.052  0.042  436 TRP AAA CZ2 
815  C CZ3 . TRP A 107 ? 0.347 0.333 0.372 -0.021 0.046  0.036  436 TRP AAA CZ3 
816  C CH2 . TRP A 107 ? 0.361 0.340 0.365 -0.020 0.045  0.040  436 TRP AAA CH2 
817  N N   . ASN A 108 ? 0.317 0.346 0.398 -0.013 0.095  0.033  437 ASN AAA N   
818  C CA  . ASN A 108 ? 0.322 0.346 0.394 -0.007 0.106  0.030  437 ASN AAA CA  
819  C C   . ASN A 108 ? 0.357 0.360 0.388 -0.009 0.112  0.027  437 ASN AAA C   
820  O O   . ASN A 108 ? 0.360 0.354 0.379 -0.013 0.119  0.032  437 ASN AAA O   
821  C CB  . ASN A 108 ? 0.340 0.373 0.441 -0.005 0.124  0.035  437 ASN AAA CB  
822  C CG  . ASN A 108 ? 0.354 0.380 0.449 0.002  0.137  0.032  437 ASN AAA CG  
823  O OD1 . ASN A 108 ? 0.382 0.388 0.441 0.002  0.147  0.027  437 ASN AAA OD1 
824  N ND2 . ASN A 108 ? 0.347 0.390 0.475 0.007  0.135  0.035  437 ASN AAA ND2 
825  N N   . SER A 109 ? 0.350 0.345 0.359 -0.007 0.107  0.022  438 SER AAA N   
826  C CA  . SER A 109 ? 0.381 0.355 0.348 -0.011 0.109  0.020  438 SER AAA CA  
827  C C   . SER A 109 ? 0.412 0.373 0.361 -0.009 0.123  0.014  438 SER AAA C   
828  O O   . SER A 109 ? 0.413 0.358 0.327 -0.013 0.119  0.011  438 SER AAA O   
829  C CB  . SER A 109 ? 0.369 0.344 0.325 -0.012 0.089  0.019  438 SER AAA CB  
830  O OG  . SER A 109 ? 0.368 0.350 0.332 -0.008 0.081  0.013  438 SER AAA OG  
831  N N   . ASN A 110 ? 0.410 0.376 0.382 -0.004 0.139  0.014  439 ASN AAA N   
832  C CA  . ASN A 110 ? 0.446 0.398 0.407 -0.000 0.155  0.009  439 ASN AAA CA  
833  C C   . ASN A 110 ? 0.514 0.436 0.426 -0.007 0.169  0.005  439 ASN AAA C   
834  O O   . ASN A 110 ? 0.545 0.449 0.429 -0.009 0.173  -0.002 439 ASN AAA O   
835  C CB  . ASN A 110 ? 0.442 0.406 0.443 0.007  0.173  0.012  439 ASN AAA CB  
836  C CG  . ASN A 110 ? 0.431 0.385 0.432 0.014  0.187  0.007  439 ASN AAA CG  
837  O OD1 . ASN A 110 ? 0.434 0.386 0.424 0.014  0.174  0.002  439 ASN AAA OD1 
838  N ND2 . ASN A 110 ? 0.483 0.430 0.496 0.018  0.213  0.009  439 ASN AAA ND2 
839  N N   . ASN A 111 ? 0.553 0.469 0.452 -0.013 0.174  0.010  440 ASN AAA N   
840  C CA  . ASN A 111 ? 0.658 0.542 0.506 -0.022 0.188  0.008  440 ASN AAA CA  
841  C C   . ASN A 111 ? 0.669 0.541 0.476 -0.031 0.166  0.007  440 ASN AAA C   
842  O O   . ASN A 111 ? 0.727 0.571 0.486 -0.040 0.174  0.003  440 ASN AAA O   
843  C CB  . ASN A 111 ? 0.691 0.573 0.541 -0.026 0.202  0.016  440 ASN AAA CB  
844  C CG  . ASN A 111 ? 0.763 0.649 0.644 -0.019 0.230  0.016  440 ASN AAA CG  
845  O OD1 . ASN A 111 ? 0.763 0.639 0.643 -0.014 0.247  0.010  440 ASN AAA OD1 
846  N ND2 . ASN A 111 ? 0.752 0.651 0.662 -0.019 0.237  0.025  440 ASN AAA ND2 
847  N N   . LEU A 112 ? 0.628 0.519 0.453 -0.030 0.141  0.011  441 LEU AAA N   
848  C CA  . LEU A 112 ? 0.628 0.513 0.425 -0.037 0.119  0.013  441 LEU AAA CA  
849  C C   . LEU A 112 ? 0.616 0.505 0.415 -0.034 0.110  0.006  441 LEU AAA C   
850  O O   . LEU A 112 ? 0.631 0.504 0.396 -0.042 0.101  0.004  441 LEU AAA O   
851  C CB  . LEU A 112 ? 0.631 0.534 0.451 -0.037 0.100  0.021  441 LEU AAA CB  
852  C CG  . LEU A 112 ? 0.690 0.594 0.516 -0.039 0.108  0.029  441 LEU AAA CG  
853  C CD1 . LEU A 112 ? 0.643 0.567 0.503 -0.035 0.092  0.035  441 LEU AAA CD1 
854  C CD2 . LEU A 112 ? 0.733 0.613 0.512 -0.051 0.109  0.035  441 LEU AAA CD2 
855  N N   . ASP A 113 ? 0.518 0.426 0.356 -0.024 0.110  0.003  442 ASP AAA N   
856  C CA  . ASP A 113 ? 0.477 0.395 0.325 -0.021 0.095  -0.001 442 ASP AAA CA  
857  C C   . ASP A 113 ? 0.490 0.401 0.338 -0.016 0.107  -0.009 442 ASP AAA C   
858  O O   . ASP A 113 ? 0.492 0.408 0.345 -0.014 0.097  -0.012 442 ASP AAA O   
859  C CB  . ASP A 113 ? 0.442 0.385 0.328 -0.014 0.082  0.002  442 ASP AAA CB  
860  C CG  . ASP A 113 ? 0.425 0.372 0.308 -0.018 0.067  0.009  442 ASP AAA CG  
861  O OD1 . ASP A 113 ? 0.418 0.354 0.274 -0.025 0.058  0.012  442 ASP AAA OD1 
862  O OD2 . ASP A 113 ? 0.402 0.362 0.310 -0.015 0.063  0.013  442 ASP AAA OD2 
863  N N   . SER A 114 ? 0.514 0.413 0.360 -0.014 0.131  -0.011 443 SER AAA N   
864  C CA  A SER A 114 ? 0.554 0.439 0.396 -0.010 0.146  -0.018 443 SER AAA CA  
865  C CA  B SER A 114 ? 0.537 0.423 0.379 -0.010 0.146  -0.018 443 SER AAA CA  
866  C C   . SER A 114 ? 0.610 0.459 0.400 -0.020 0.161  -0.024 443 SER AAA C   
867  O O   . SER A 114 ? 0.614 0.454 0.381 -0.028 0.164  -0.021 443 SER AAA O   
868  C CB  A SER A 114 ? 0.548 0.447 0.432 0.001  0.163  -0.016 443 SER AAA CB  
869  C CB  B SER A 114 ? 0.513 0.412 0.398 0.001  0.163  -0.016 443 SER AAA CB  
870  O OG  A SER A 114 ? 0.559 0.447 0.445 0.006  0.174  -0.021 443 SER AAA OG  
871  O OG  B SER A 114 ? 0.499 0.388 0.381 0.000  0.186  -0.014 443 SER AAA OG  
872  N N   . LYS A 115 ? 0.660 0.489 0.431 -0.020 0.170  -0.032 444 LYS AAA N   
873  C CA  . LYS A 115 ? 0.741 0.530 0.458 -0.031 0.187  -0.040 444 LYS AAA CA  
874  C C   . LYS A 115 ? 0.752 0.524 0.472 -0.025 0.208  -0.048 444 LYS AAA C   
875  O O   . LYS A 115 ? 0.667 0.460 0.426 -0.014 0.201  -0.047 444 LYS AAA O   
876  C CB  . LYS A 115 ? 0.827 0.602 0.497 -0.047 0.165  -0.040 444 LYS AAA CB  
877  C CG  . LYS A 115 ? 0.809 0.593 0.486 -0.047 0.143  -0.042 444 LYS AAA CG  
878  C CD  . LYS A 115 ? 0.898 0.663 0.526 -0.064 0.125  -0.042 444 LYS AAA CD  
879  C CE  . LYS A 115 ? 0.938 0.721 0.584 -0.064 0.100  -0.040 444 LYS AAA CE  
880  N NZ  . LYS A 115 ? 1.046 0.807 0.646 -0.082 0.085  -0.041 444 LYS AAA NZ  
881  N N   . VAL A 116 ? 0.792 0.526 0.470 -0.031 0.234  -0.056 445 VAL AAA N   
882  C CA  . VAL A 116 ? 0.851 0.558 0.522 -0.027 0.258  -0.066 445 VAL AAA CA  
883  C C   . VAL A 116 ? 0.822 0.528 0.484 -0.031 0.236  -0.070 445 VAL AAA C   
884  O O   . VAL A 116 ? 0.853 0.552 0.477 -0.045 0.213  -0.071 445 VAL AAA O   
885  C CB  . VAL A 116 ? 0.940 0.599 0.553 -0.038 0.287  -0.075 445 VAL AAA CB  
886  C CG1 . VAL A 116 ? 0.985 0.610 0.585 -0.035 0.313  -0.087 445 VAL AAA CG1 
887  C CG2 . VAL A 116 ? 0.991 0.653 0.617 -0.033 0.310  -0.070 445 VAL AAA CG2 
888  N N   . GLY A 117 ? 0.778 0.494 0.478 -0.018 0.241  -0.071 446 GLY AAA N   
889  C CA  . GLY A 117 ? 0.762 0.479 0.460 -0.020 0.222  -0.074 446 GLY AAA CA  
890  C C   . GLY A 117 ? 0.682 0.444 0.421 -0.015 0.192  -0.064 446 GLY AAA C   
891  O O   . GLY A 117 ? 0.668 0.435 0.412 -0.015 0.177  -0.065 446 GLY AAA O   
892  N N   . GLY A 118 ? 0.636 0.425 0.400 -0.011 0.185  -0.055 447 GLY AAA N   
893  C CA  . GLY A 118 ? 0.572 0.399 0.374 -0.006 0.160  -0.047 447 GLY AAA CA  
894  C C   . GLY A 118 ? 0.542 0.373 0.319 -0.017 0.136  -0.044 447 GLY AAA C   
895  O O   . GLY A 118 ? 0.557 0.365 0.292 -0.030 0.130  -0.049 447 GLY AAA O   
896  N N   . ASN A 119 ? 0.490 0.348 0.292 -0.014 0.121  -0.036 448 ASN AAA N   
897  C CA  . ASN A 119 ? 0.479 0.347 0.271 -0.022 0.097  -0.032 448 ASN AAA CA  
898  C C   . ASN A 119 ? 0.438 0.329 0.259 -0.017 0.080  -0.030 448 ASN AAA C   
899  O O   . ASN A 119 ? 0.404 0.318 0.261 -0.007 0.079  -0.026 448 ASN AAA O   
900  C CB  . ASN A 119 ? 0.474 0.355 0.274 -0.023 0.093  -0.025 448 ASN AAA CB  
901  C CG  . ASN A 119 ? 0.498 0.389 0.293 -0.029 0.070  -0.018 448 ASN AAA CG  
902  O OD1 . ASN A 119 ? 0.535 0.423 0.318 -0.035 0.056  -0.019 448 ASN AAA OD1 
903  N ND2 . ASN A 119 ? 0.527 0.429 0.333 -0.029 0.066  -0.011 448 ASN AAA ND2 
904  N N   . TYR A 120 ? 0.454 0.337 0.257 -0.023 0.069  -0.032 449 TYR AAA N   
905  C CA  . TYR A 120 ? 0.404 0.305 0.231 -0.019 0.056  -0.030 449 TYR AAA CA  
906  C C   . TYR A 120 ? 0.402 0.320 0.236 -0.022 0.035  -0.023 449 TYR AAA C   
907  O O   . TYR A 120 ? 0.400 0.334 0.254 -0.019 0.025  -0.022 449 TYR AAA O   
908  C CB  . TYR A 120 ? 0.428 0.311 0.237 -0.023 0.058  -0.036 449 TYR AAA CB  
909  C CG  . TYR A 120 ? 0.422 0.293 0.237 -0.015 0.078  -0.042 449 TYR AAA CG  
910  C CD1 . TYR A 120 ? 0.445 0.291 0.238 -0.017 0.098  -0.047 449 TYR AAA CD1 
911  C CD2 . TYR A 120 ? 0.406 0.291 0.252 -0.006 0.078  -0.041 449 TYR AAA CD2 
912  C CE1 . TYR A 120 ? 0.469 0.306 0.275 -0.009 0.120  -0.050 449 TYR AAA CE1 
913  C CE2 . TYR A 120 ? 0.402 0.277 0.260 0.002  0.097  -0.043 449 TYR AAA CE2 
914  C CZ  . TYR A 120 ? 0.433 0.285 0.274 0.002  0.118  -0.048 449 TYR AAA CZ  
915  O OH  . TYR A 120 ? 0.466 0.308 0.324 0.011  0.139  -0.049 449 TYR AAA OH  
916  N N   . ASN A 121 ? 0.415 0.332 0.238 -0.028 0.031  -0.019 450 ASN AAA N   
917  C CA  . ASN A 121 ? 0.410 0.341 0.241 -0.031 0.013  -0.010 450 ASN AAA CA  
918  C C   . ASN A 121 ? 0.370 0.325 0.238 -0.021 0.010  -0.007 450 ASN AAA C   
919  O O   . ASN A 121 ? 0.360 0.326 0.241 -0.021 -0.002 -0.002 450 ASN AAA O   
920  C CB  . ASN A 121 ? 0.486 0.407 0.295 -0.040 0.010  -0.004 450 ASN AAA CB  
921  C CG  . ASN A 121 ? 0.572 0.467 0.337 -0.053 0.010  -0.007 450 ASN AAA CG  
922  O OD1 . ASN A 121 ? 0.640 0.527 0.392 -0.059 0.005  -0.010 450 ASN AAA OD1 
923  N ND2 . ASN A 121 ? 0.673 0.552 0.410 -0.060 0.015  -0.005 450 ASN AAA ND2 
924  N N   . TYR A 122 ? 0.323 0.284 0.208 -0.013 0.021  -0.010 451 TYR AAA N   
925  C CA  . TYR A 122 ? 0.314 0.294 0.228 -0.006 0.018  -0.008 451 TYR AAA CA  
926  C C   . TYR A 122 ? 0.272 0.260 0.201 -0.001 0.016  -0.011 451 TYR AAA C   
927  O O   . TYR A 122 ? 0.280 0.263 0.208 0.001  0.024  -0.015 451 TYR AAA O   
928  C CB  . TYR A 122 ? 0.315 0.297 0.239 -0.003 0.028  -0.007 451 TYR AAA CB  
929  C CG  . TYR A 122 ? 0.313 0.288 0.225 -0.008 0.028  -0.003 451 TYR AAA CG  
930  C CD1 . TYR A 122 ? 0.335 0.317 0.256 -0.008 0.018  0.003  451 TYR AAA CD1 
931  C CD2 . TYR A 122 ? 0.356 0.317 0.248 -0.011 0.039  -0.003 451 TYR AAA CD2 
932  C CE1 . TYR A 122 ? 0.348 0.325 0.260 -0.012 0.018  0.009  451 TYR AAA CE1 
933  C CE2 . TYR A 122 ? 0.362 0.316 0.241 -0.017 0.039  0.002  451 TYR AAA CE2 
934  C CZ  . TYR A 122 ? 0.380 0.343 0.271 -0.017 0.028  0.009  451 TYR AAA CZ  
935  O OH  . TYR A 122 ? 0.411 0.367 0.290 -0.022 0.027  0.016  451 TYR AAA OH  
936  N N   . LEU A 123 ? 0.247 0.246 0.189 0.000  0.008  -0.009 452 LEU AAA N   
937  C CA  . LEU A 123 ? 0.235 0.240 0.188 0.004  0.005  -0.011 452 LEU AAA CA  
938  C C   . LEU A 123 ? 0.236 0.252 0.206 0.008  0.005  -0.011 452 LEU AAA C   
939  O O   . LEU A 123 ? 0.234 0.252 0.209 0.008  0.005  -0.009 452 LEU AAA O   
940  C CB  . LEU A 123 ? 0.252 0.258 0.202 0.001  -0.003 -0.009 452 LEU AAA CB  
941  C CG  . LEU A 123 ? 0.287 0.282 0.217 -0.007 -0.006 -0.008 452 LEU AAA CG  
942  C CD1 . LEU A 123 ? 0.286 0.285 0.220 -0.010 -0.016 -0.004 452 LEU AAA CD1 
943  C CD2 . LEU A 123 ? 0.304 0.286 0.221 -0.007 0.002  -0.014 452 LEU AAA CD2 
944  N N   . TYR A 124 ? 0.214 0.234 0.190 0.010  0.005  -0.013 453 TYR AAA N   
945  C CA  . TYR A 124 ? 0.211 0.238 0.197 0.011  0.003  -0.014 453 TYR AAA CA  
946  C C   . TYR A 124 ? 0.217 0.245 0.202 0.012  0.000  -0.015 453 TYR AAA C   
947  O O   . TYR A 124 ? 0.240 0.265 0.221 0.012  0.000  -0.015 453 TYR AAA O   
948  C CB  . TYR A 124 ? 0.216 0.246 0.210 0.012  0.005  -0.014 453 TYR AAA CB  
949  C CG  . TYR A 124 ? 0.243 0.274 0.239 0.014  0.006  -0.013 453 TYR AAA CG  
950  C CD1 . TYR A 124 ? 0.252 0.278 0.247 0.016  0.013  -0.012 453 TYR AAA CD1 
951  C CD2 . TYR A 124 ? 0.247 0.282 0.247 0.014  0.002  -0.012 453 TYR AAA CD2 
952  C CE1 . TYR A 124 ? 0.262 0.287 0.263 0.018  0.017  -0.011 453 TYR AAA CE1 
953  C CE2 . TYR A 124 ? 0.253 0.288 0.258 0.016  0.003  -0.009 453 TYR AAA CE2 
954  C CZ  . TYR A 124 ? 0.273 0.303 0.280 0.019  0.011  -0.009 453 TYR AAA CZ  
955  O OH  . TYR A 124 ? 0.303 0.331 0.318 0.023  0.015  -0.006 453 TYR AAA OH  
956  N N   . ARG A 125 ? 0.214 0.244 0.202 0.011  0.000  -0.016 454 ARG AAA N   
957  C CA  . ARG A 125 ? 0.222 0.252 0.207 0.011  -0.000 -0.017 454 ARG AAA CA  
958  C C   . ARG A 125 ? 0.223 0.254 0.206 0.009  -0.003 -0.017 454 ARG AAA C   
959  O O   . ARG A 125 ? 0.232 0.263 0.216 0.007  -0.004 -0.018 454 ARG AAA O   
960  C CB  . ARG A 125 ? 0.229 0.256 0.215 0.011  0.003  -0.018 454 ARG AAA CB  
961  C CG  . ARG A 125 ? 0.238 0.263 0.220 0.010  0.006  -0.019 454 ARG AAA CG  
962  C CD  . ARG A 125 ? 0.254 0.274 0.238 0.011  0.014  -0.021 454 ARG AAA CD  
963  N NE  . ARG A 125 ? 0.237 0.261 0.236 0.014  0.015  -0.016 454 ARG AAA NE  
964  C CZ  . ARG A 125 ? 0.241 0.272 0.251 0.015  0.013  -0.011 454 ARG AAA CZ  
965  N NH1 . ARG A 125 ? 0.251 0.284 0.258 0.013  0.013  -0.010 454 ARG AAA NH1 
966  N NH2 . ARG A 125 ? 0.256 0.291 0.280 0.016  0.011  -0.005 454 ARG AAA NH2 
967  N N   . LEU A 126 ? 0.234 0.265 0.215 0.010  -0.004 -0.015 455 LEU AAA N   
968  C CA  . LEU A 126 ? 0.225 0.258 0.206 0.009  -0.008 -0.012 455 LEU AAA CA  
969  C C   . LEU A 126 ? 0.233 0.263 0.203 0.005  -0.010 -0.013 455 LEU AAA C   
970  O O   . LEU A 126 ? 0.240 0.271 0.208 0.002  -0.016 -0.010 455 LEU AAA O   
971  C CB  . LEU A 126 ? 0.247 0.280 0.234 0.012  -0.007 -0.009 455 LEU AAA CB  
972  C CG  . LEU A 126 ? 0.265 0.302 0.260 0.013  -0.012 -0.003 455 LEU AAA CG  
973  C CD1 . LEU A 126 ? 0.283 0.327 0.288 0.011  -0.016 -0.000 455 LEU AAA CD1 
974  C CD2 . LEU A 126 ? 0.304 0.338 0.306 0.017  -0.007 -0.001 455 LEU AAA CD2 
975  N N   . PHE A 127 ? 0.236 0.263 0.201 0.005  -0.006 -0.015 456 PHE AAA N   
976  C CA  . PHE A 127 ? 0.249 0.271 0.202 0.002  -0.004 -0.015 456 PHE AAA CA  
977  C C   . PHE A 127 ? 0.264 0.280 0.214 0.002  0.004  -0.019 456 PHE AAA C   
978  O O   . PHE A 127 ? 0.237 0.257 0.198 0.005  0.008  -0.019 456 PHE AAA O   
979  C CB  . PHE A 127 ? 0.263 0.285 0.218 0.004  -0.004 -0.011 456 PHE AAA CB  
980  C CG  . PHE A 127 ? 0.271 0.296 0.232 0.005  -0.009 -0.007 456 PHE AAA CG  
981  C CD1 . PHE A 127 ? 0.302 0.328 0.260 0.003  -0.015 -0.002 456 PHE AAA CD1 
982  C CD2 . PHE A 127 ? 0.291 0.317 0.261 0.009  -0.008 -0.007 456 PHE AAA CD2 
983  C CE1 . PHE A 127 ? 0.298 0.327 0.267 0.006  -0.019 0.004  456 PHE AAA CE1 
984  C CE2 . PHE A 127 ? 0.287 0.312 0.264 0.012  -0.009 -0.003 456 PHE AAA CE2 
985  C CZ  . PHE A 127 ? 0.291 0.319 0.270 0.011  -0.014 0.003  456 PHE AAA CZ  
986  N N   . ARG A 128 ? 0.255 0.262 0.188 -0.003 0.007  -0.022 457 ARG AAA N   
987  C CA  . ARG A 128 ? 0.273 0.272 0.203 -0.003 0.020  -0.027 457 ARG AAA CA  
988  C C   . ARG A 128 ? 0.306 0.292 0.211 -0.010 0.024  -0.029 457 ARG AAA C   
989  O O   . ARG A 128 ? 0.322 0.304 0.211 -0.017 0.014  -0.029 457 ARG AAA O   
990  C CB  . ARG A 128 ? 0.269 0.265 0.204 -0.002 0.022  -0.031 457 ARG AAA CB  
991  C CG  . ARG A 128 ? 0.265 0.256 0.209 0.002  0.036  -0.033 457 ARG AAA CG  
992  C CD  . ARG A 128 ? 0.287 0.275 0.239 0.003  0.038  -0.035 457 ARG AAA CD  
993  N NE  . ARG A 128 ? 0.288 0.273 0.256 0.009  0.050  -0.034 457 ARG AAA NE  
994  C CZ  . ARG A 128 ? 0.321 0.290 0.283 0.009  0.065  -0.039 457 ARG AAA CZ  
995  N NH1 . ARG A 128 ? 0.358 0.309 0.291 0.001  0.068  -0.047 457 ARG AAA NH1 
996  N NH2 . ARG A 128 ? 0.353 0.322 0.337 0.015  0.077  -0.036 457 ARG AAA NH2 
997  N N   . LYS A 129 ? 0.332 0.309 0.232 -0.010 0.037  -0.032 458 LYS AAA N   
998  C CA  . LYS A 129 ? 0.367 0.328 0.238 -0.017 0.045  -0.035 458 LYS AAA CA  
999  C C   . LYS A 129 ? 0.386 0.329 0.233 -0.025 0.048  -0.043 458 LYS AAA C   
1000 O O   . LYS A 129 ? 0.417 0.344 0.231 -0.035 0.049  -0.045 458 LYS AAA O   
1001 C CB  . LYS A 129 ? 0.397 0.356 0.276 -0.013 0.062  -0.034 458 LYS AAA CB  
1002 C CG  . LYS A 129 ? 0.418 0.391 0.315 -0.010 0.058  -0.026 458 LYS AAA CG  
1003 C CD  . LYS A 129 ? 0.474 0.449 0.388 -0.005 0.074  -0.024 458 LYS AAA CD  
1004 C CE  . LYS A 129 ? 0.616 0.576 0.508 -0.010 0.089  -0.026 458 LYS AAA CE  
1005 N NZ  . LYS A 129 ? 0.682 0.648 0.599 -0.005 0.105  -0.022 458 LYS AAA NZ  
1006 N N   . SER A 130 ? 0.377 0.319 0.236 -0.022 0.050  -0.046 459 SER AAA N   
1007 C CA  . SER A 130 ? 0.410 0.333 0.247 -0.029 0.053  -0.055 459 SER AAA CA  
1008 C C   . SER A 130 ? 0.398 0.330 0.254 -0.026 0.046  -0.054 459 SER AAA C   
1009 O O   . SER A 130 ? 0.343 0.293 0.229 -0.017 0.043  -0.049 459 SER AAA O   
1010 C CB  . SER A 130 ? 0.465 0.367 0.291 -0.029 0.077  -0.062 459 SER AAA CB  
1011 O OG  . SER A 130 ? 0.457 0.368 0.318 -0.017 0.087  -0.060 459 SER AAA OG  
1012 N N   . ASN A 131 ? 0.417 0.334 0.255 -0.035 0.043  -0.060 460 ASN AAA N   
1013 C CA  . ASN A 131 ? 0.431 0.354 0.286 -0.033 0.037  -0.060 460 ASN AAA CA  
1014 C C   . ASN A 131 ? 0.420 0.336 0.291 -0.024 0.053  -0.063 460 ASN AAA C   
1015 O O   . ASN A 131 ? 0.438 0.337 0.300 -0.024 0.071  -0.069 460 ASN AAA O   
1016 C CB  . ASN A 131 ? 0.447 0.356 0.277 -0.047 0.028  -0.065 460 ASN AAA CB  
1017 C CG  . ASN A 131 ? 0.485 0.404 0.306 -0.055 0.009  -0.058 460 ASN AAA CG  
1018 O OD1 . ASN A 131 ? 0.448 0.386 0.285 -0.049 0.002  -0.050 460 ASN AAA OD1 
1019 N ND2 . ASN A 131 ? 0.539 0.445 0.335 -0.070 -0.001 -0.060 460 ASN AAA ND2 
1020 N N   . LEU A 132 ? 0.385 0.315 0.283 -0.018 0.049  -0.059 461 LEU AAA N   
1021 C CA  . LEU A 132 ? 0.392 0.316 0.308 -0.011 0.061  -0.059 461 LEU AAA CA  
1022 C C   . LEU A 132 ? 0.437 0.335 0.333 -0.018 0.071  -0.069 461 LEU AAA C   
1023 O O   . LEU A 132 ? 0.457 0.346 0.330 -0.030 0.061  -0.073 461 LEU AAA O   
1024 C CB  . LEU A 132 ? 0.356 0.297 0.296 -0.006 0.050  -0.052 461 LEU AAA CB  
1025 C CG  . LEU A 132 ? 0.338 0.302 0.297 0.001  0.043  -0.044 461 LEU AAA CG  
1026 C CD1 . LEU A 132 ? 0.319 0.294 0.294 0.004  0.035  -0.038 461 LEU AAA CD1 
1027 C CD2 . LEU A 132 ? 0.334 0.302 0.310 0.009  0.053  -0.040 461 LEU AAA CD2 
1028 N N   . LYS A 133 ? 0.430 0.314 0.335 -0.012 0.089  -0.072 462 LYS AAA N   
1029 C CA  . LYS A 133 ? 0.476 0.332 0.369 -0.016 0.101  -0.081 462 LYS AAA CA  
1030 C C   . LYS A 133 ? 0.445 0.311 0.359 -0.014 0.091  -0.075 462 LYS AAA C   
1031 O O   . LYS A 133 ? 0.372 0.264 0.312 -0.006 0.081  -0.065 462 LYS AAA O   
1032 C CB  . LYS A 133 ? 0.532 0.370 0.433 -0.008 0.127  -0.084 462 LYS AAA CB  
1033 C CG  . LYS A 133 ? 0.605 0.429 0.482 -0.012 0.140  -0.090 462 LYS AAA CG  
1034 C CD  . LYS A 133 ? 0.707 0.516 0.599 -0.002 0.169  -0.091 462 LYS AAA CD  
1035 C CE  . LYS A 133 ? 0.751 0.586 0.695 0.013  0.171  -0.077 462 LYS AAA CE  
1036 N NZ  . LYS A 133 ? 0.823 0.649 0.785 0.022  0.198  -0.076 462 LYS AAA NZ  
1037 N N   . PRO A 134 ? 0.462 0.308 0.363 -0.021 0.094  -0.082 463 PRO AAA N   
1038 C CA  . PRO A 134 ? 0.449 0.303 0.371 -0.019 0.086  -0.077 463 PRO AAA CA  
1039 C C   . PRO A 134 ? 0.430 0.296 0.389 -0.004 0.094  -0.067 463 PRO AAA C   
1040 O O   . PRO A 134 ? 0.421 0.275 0.389 0.003  0.111  -0.068 463 PRO AAA O   
1041 C CB  . PRO A 134 ? 0.493 0.316 0.394 -0.029 0.094  -0.087 463 PRO AAA CB  
1042 C CG  . PRO A 134 ? 0.539 0.342 0.398 -0.042 0.095  -0.098 463 PRO AAA CG  
1043 C CD  . PRO A 134 ? 0.527 0.339 0.391 -0.034 0.104  -0.095 463 PRO AAA CD  
1044 N N   . PHE A 135 ? 0.394 0.283 0.373 -0.000 0.080  -0.056 464 PHE AAA N   
1045 C CA  . PHE A 135 ? 0.383 0.286 0.395 0.011  0.081  -0.044 464 PHE AAA CA  
1046 C C   . PHE A 135 ? 0.391 0.307 0.418 0.019  0.085  -0.038 464 PHE AAA C   
1047 O O   . PHE A 135 ? 0.357 0.281 0.413 0.028  0.089  -0.028 464 PHE AAA O   
1048 C CB  . PHE A 135 ? 0.410 0.294 0.435 0.014  0.094  -0.044 464 PHE AAA CB  
1049 C CG  . PHE A 135 ? 0.412 0.285 0.425 0.006  0.089  -0.048 464 PHE AAA CG  
1050 C CD1 . PHE A 135 ? 0.389 0.280 0.407 0.003  0.073  -0.041 464 PHE AAA CD1 
1051 C CD2 . PHE A 135 ? 0.445 0.288 0.444 0.000  0.101  -0.058 464 PHE AAA CD2 
1052 C CE1 . PHE A 135 ? 0.411 0.293 0.423 -0.005 0.069  -0.043 464 PHE AAA CE1 
1053 C CE2 . PHE A 135 ? 0.461 0.295 0.452 -0.009 0.095  -0.061 464 PHE AAA CE2 
1054 C CZ  . PHE A 135 ? 0.434 0.288 0.433 -0.011 0.079  -0.053 464 PHE AAA CZ  
1055 N N   . GLU A 136 ? 0.361 0.280 0.372 0.016  0.084  -0.043 465 GLU AAA N   
1056 C CA  . GLU A 136 ? 0.365 0.299 0.390 0.023  0.085  -0.037 465 GLU AAA CA  
1057 C C   . GLU A 136 ? 0.330 0.289 0.365 0.024  0.067  -0.027 465 GLU AAA C   
1058 O O   . GLU A 136 ? 0.306 0.268 0.326 0.018  0.056  -0.029 465 GLU AAA O   
1059 C CB  . GLU A 136 ? 0.396 0.322 0.397 0.018  0.091  -0.045 465 GLU AAA CB  
1060 C CG  . GLU A 136 ? 0.421 0.360 0.440 0.024  0.096  -0.038 465 GLU AAA CG  
1061 C CD  . GLU A 136 ? 0.464 0.392 0.460 0.020  0.105  -0.046 465 GLU AAA CD  
1062 O OE1 . GLU A 136 ? 0.453 0.364 0.415 0.011  0.104  -0.056 465 GLU AAA OE1 
1063 O OE2 . GLU A 136 ? 0.495 0.432 0.506 0.025  0.111  -0.041 465 GLU AAA OE2 
1064 N N   . ARG A 137 ? 0.300 0.273 0.359 0.030  0.066  -0.016 466 ARG AAA N   
1065 C CA  . ARG A 137 ? 0.281 0.273 0.345 0.029  0.050  -0.008 466 ARG AAA CA  
1066 C C   . ARG A 137 ? 0.267 0.269 0.336 0.031  0.051  -0.006 466 ARG AAA C   
1067 O O   . ARG A 137 ? 0.287 0.288 0.375 0.036  0.061  -0.002 466 ARG AAA O   
1068 C CB  . ARG A 137 ? 0.291 0.291 0.377 0.033  0.044  0.004  466 ARG AAA CB  
1069 C CG  . ARG A 137 ? 0.296 0.311 0.377 0.029  0.028  0.010  466 ARG AAA CG  
1070 C CD  . ARG A 137 ? 0.346 0.368 0.443 0.030  0.020  0.025  466 ARG AAA CD  
1071 N NE  . ARG A 137 ? 0.342 0.356 0.441 0.030  0.021  0.026  466 ARG AAA NE  
1072 C CZ  . ARG A 137 ? 0.439 0.448 0.561 0.036  0.028  0.033  466 ARG AAA CZ  
1073 N NH1 . ARG A 137 ? 0.444 0.457 0.592 0.042  0.035  0.040  466 ARG AAA NH1 
1074 N NH2 . ARG A 137 ? 0.417 0.418 0.538 0.035  0.029  0.035  466 ARG AAA NH2 
1075 N N   . ASP A 138 ? 0.244 0.253 0.298 0.026  0.041  -0.008 467 ASP AAA N   
1076 C CA  . ASP A 138 ? 0.234 0.252 0.290 0.026  0.039  -0.005 467 ASP AAA CA  
1077 C C   . ASP A 138 ? 0.206 0.236 0.264 0.024  0.025  0.002  467 ASP AAA C   
1078 O O   . ASP A 138 ? 0.218 0.248 0.260 0.021  0.018  -0.002 467 ASP AAA O   
1079 C CB  . ASP A 138 ? 0.274 0.285 0.307 0.022  0.042  -0.015 467 ASP AAA CB  
1080 C CG  . ASP A 138 ? 0.292 0.309 0.327 0.022  0.043  -0.012 467 ASP AAA CG  
1081 O OD1 . ASP A 138 ? 0.293 0.322 0.349 0.024  0.040  -0.003 467 ASP AAA OD1 
1082 O OD2 . ASP A 138 ? 0.315 0.326 0.331 0.019  0.045  -0.018 467 ASP AAA OD2 
1083 N N   . ILE A 139 ? 0.221 0.262 0.301 0.025  0.021  0.012  468 ILE AAA N   
1084 C CA  . ILE A 139 ? 0.220 0.269 0.297 0.020  0.006  0.019  468 ILE AAA CA  
1085 C C   . ILE A 139 ? 0.215 0.271 0.297 0.018  0.004  0.022  468 ILE AAA C   
1086 O O   . ILE A 139 ? 0.211 0.273 0.294 0.013  -0.008 0.029  468 ILE AAA O   
1087 C CB  . ILE A 139 ? 0.224 0.278 0.317 0.020  -0.002 0.031  468 ILE AAA CB  
1088 C CG1 . ILE A 139 ? 0.230 0.293 0.358 0.025  0.003  0.042  468 ILE AAA CG1 
1089 C CG2 . ILE A 139 ? 0.238 0.284 0.322 0.021  -0.001 0.028  468 ILE AAA CG2 
1090 C CD1 . ILE A 139 ? 0.246 0.317 0.393 0.023  -0.009 0.058  468 ILE AAA CD1 
1091 N N   . SER A 140 ? 0.211 0.264 0.292 0.020  0.015  0.016  469 SER AAA N   
1092 C CA  . SER A 140 ? 0.221 0.280 0.307 0.018  0.015  0.019  469 SER AAA CA  
1093 C C   . SER A 140 ? 0.219 0.275 0.281 0.013  0.006  0.014  469 SER AAA C   
1094 O O   . SER A 140 ? 0.229 0.277 0.271 0.013  0.004  0.006  469 SER AAA O   
1095 C CB  . SER A 140 ? 0.235 0.290 0.324 0.022  0.031  0.014  469 SER AAA CB  
1096 O OG  . SER A 140 ? 0.249 0.291 0.310 0.021  0.035  0.003  469 SER AAA OG  
1097 N N   . THR A 141 ? 0.236 0.297 0.301 0.009  0.001  0.018  470 THR AAA N   
1098 C CA  . THR A 141 ? 0.239 0.295 0.284 0.004  -0.006 0.013  470 THR AAA CA  
1099 C C   . THR A 141 ? 0.261 0.317 0.308 0.002  -0.002 0.014  470 THR AAA C   
1100 O O   . THR A 141 ? 0.257 0.313 0.300 -0.003 -0.010 0.016  470 THR AAA O   
1101 C CB  . THR A 141 ? 0.262 0.317 0.301 -0.003 -0.019 0.017  470 THR AAA CB  
1102 O OG1 . THR A 141 ? 0.256 0.321 0.317 -0.006 -0.025 0.029  470 THR AAA OG1 
1103 C CG2 . THR A 141 ? 0.277 0.327 0.306 -0.002 -0.021 0.015  470 THR AAA CG2 
1104 N N   . GLU A 142 ? 0.235 0.291 0.287 0.006  0.010  0.012  471 GLU AAA N   
1105 C CA  . GLU A 142 ? 0.255 0.310 0.306 0.005  0.016  0.012  471 GLU AAA CA  
1106 C C   . GLU A 142 ? 0.212 0.259 0.239 0.003  0.012  0.006  471 GLU AAA C   
1107 O O   . GLU A 142 ? 0.233 0.274 0.245 0.005  0.011  0.001  471 GLU AAA O   
1108 C CB  . GLU A 142 ? 0.312 0.365 0.368 0.009  0.032  0.011  471 GLU AAA CB  
1109 C CG  . GLU A 142 ? 0.384 0.446 0.471 0.013  0.038  0.018  471 GLU AAA CG  
1110 C CD  . GLU A 142 ? 0.486 0.546 0.584 0.016  0.058  0.019  471 GLU AAA CD  
1111 O OE1 . GLU A 142 ? 0.586 0.632 0.659 0.016  0.068  0.010  471 GLU AAA OE1 
1112 O OE2 . GLU A 142 ? 0.587 0.658 0.718 0.018  0.062  0.029  471 GLU AAA OE2 
1113 N N   . ILE A 143 ? 0.242 0.288 0.267 -0.001 0.010  0.009  472 ILE AAA N   
1114 C CA  . ILE A 143 ? 0.248 0.284 0.253 -0.002 0.008  0.005  472 ILE AAA CA  
1115 C C   . ILE A 143 ? 0.238 0.269 0.231 0.000  0.015  0.002  472 ILE AAA C   
1116 O O   . ILE A 143 ? 0.261 0.293 0.258 0.000  0.025  0.003  472 ILE AAA O   
1117 C CB  . ILE A 143 ? 0.251 0.286 0.258 -0.007 0.005  0.008  472 ILE AAA CB  
1118 C CG1 . ILE A 143 ? 0.281 0.318 0.295 -0.012 -0.005 0.011  472 ILE AAA CG1 
1119 C CG2 . ILE A 143 ? 0.270 0.294 0.260 -0.006 0.003  0.006  472 ILE AAA CG2 
1120 C CD1 . ILE A 143 ? 0.287 0.318 0.289 -0.011 -0.010 0.007  472 ILE AAA CD1 
1121 N N   . TYR A 144 ? 0.230 0.257 0.209 0.002  0.012  -0.002 473 TYR AAA N   
1122 C CA  . TYR A 144 ? 0.244 0.265 0.208 0.001  0.015  -0.004 473 TYR AAA CA  
1123 C C   . TYR A 144 ? 0.248 0.264 0.202 -0.001 0.013  -0.001 473 TYR AAA C   
1124 O O   . TYR A 144 ? 0.233 0.248 0.188 -0.001 0.007  0.002  473 TYR AAA O   
1125 C CB  . TYR A 144 ? 0.246 0.266 0.205 0.003  0.009  -0.007 473 TYR AAA CB  
1126 C CG  . TYR A 144 ? 0.255 0.270 0.198 -0.000 0.008  -0.008 473 TYR AAA CG  
1127 C CD1 . TYR A 144 ? 0.272 0.281 0.205 -0.003 0.014  -0.013 473 TYR AAA CD1 
1128 C CD2 . TYR A 144 ? 0.273 0.287 0.211 -0.002 0.001  -0.004 473 TYR AAA CD2 
1129 C CE1 . TYR A 144 ? 0.314 0.315 0.226 -0.008 0.012  -0.014 473 TYR AAA CE1 
1130 C CE2 . TYR A 144 ? 0.279 0.289 0.201 -0.006 -0.003 -0.003 473 TYR AAA CE2 
1131 C CZ  . TYR A 144 ? 0.295 0.297 0.202 -0.011 0.001  -0.008 473 TYR AAA CZ  
1132 O OH  . TYR A 144 ? 0.333 0.328 0.220 -0.018 -0.004 -0.007 473 TYR AAA OH  
1133 N N   . GLN A 145 ? 0.256 0.268 0.199 -0.004 0.020  0.000  474 GLN AAA N   
1134 C CA  . GLN A 145 ? 0.270 0.275 0.200 -0.008 0.018  0.005  474 GLN AAA CA  
1135 C C   . GLN A 145 ? 0.271 0.273 0.186 -0.010 0.010  0.006  474 GLN AAA C   
1136 O O   . GLN A 145 ? 0.271 0.267 0.169 -0.013 0.012  0.003  474 GLN AAA O   
1137 C CB  . GLN A 145 ? 0.299 0.299 0.220 -0.011 0.030  0.006  474 GLN AAA CB  
1138 C CG  . GLN A 145 ? 0.304 0.299 0.214 -0.015 0.029  0.012  474 GLN AAA CG  
1139 C CD  . GLN A 145 ? 0.346 0.332 0.241 -0.020 0.043  0.013  474 GLN AAA CD  
1140 O OE1 . GLN A 145 ? 0.345 0.334 0.254 -0.018 0.055  0.011  474 GLN AAA OE1 
1141 N NE2 . GLN A 145 ? 0.375 0.351 0.246 -0.026 0.041  0.017  474 GLN AAA NE2 
1142 N N   . ALA A 146 ? 0.272 0.276 0.194 -0.008 0.001  0.011  475 ALA AAA N   
1143 C CA  . ALA A 146 ? 0.303 0.307 0.219 -0.009 -0.009 0.015  475 ALA AAA CA  
1144 C C   . ALA A 146 ? 0.330 0.329 0.237 -0.013 -0.014 0.024  475 ALA AAA C   
1145 O O   . ALA A 146 ? 0.361 0.361 0.269 -0.014 -0.024 0.031  475 ALA AAA O   
1146 C CB  . ALA A 146 ? 0.310 0.319 0.245 -0.003 -0.013 0.015  475 ALA AAA CB  
1147 N N   . GLY A 147 ? 0.309 0.302 0.210 -0.015 -0.007 0.026  476 GLY AAA N   
1148 C CA  . GLY A 147 ? 0.354 0.342 0.247 -0.018 -0.011 0.036  476 GLY AAA CA  
1149 C C   . GLY A 147 ? 0.355 0.335 0.227 -0.025 -0.002 0.035  476 GLY AAA C   
1150 O O   . GLY A 147 ? 0.360 0.339 0.226 -0.026 0.008  0.027  476 GLY AAA O   
1151 N N   . SER A 148 ? 0.387 0.360 0.249 -0.029 -0.002 0.044  477 SER AAA N   
1152 C CA  . SER A 148 ? 0.409 0.373 0.249 -0.036 0.008  0.045  477 SER AAA CA  
1153 C C   . SER A 148 ? 0.414 0.380 0.269 -0.033 0.021  0.042  477 SER AAA C   
1154 O O   . SER A 148 ? 0.475 0.435 0.317 -0.038 0.033  0.042  477 SER AAA O   
1155 C CB  . SER A 148 ? 0.447 0.402 0.269 -0.042 0.000  0.057  477 SER AAA CB  
1156 O OG  . SER A 148 ? 0.435 0.393 0.279 -0.037 -0.003 0.064  477 SER AAA OG  
1157 N N   . THR A 149 ? 0.413 0.387 0.296 -0.027 0.019  0.041  478 THR AAA N   
1158 C CA  A THR A 149 ? 0.417 0.395 0.318 -0.026 0.027  0.040  478 THR AAA CA  
1159 C CA  B THR A 149 ? 0.410 0.388 0.311 -0.027 0.027  0.040  478 THR AAA CA  
1160 C C   . THR A 149 ? 0.384 0.371 0.301 -0.023 0.033  0.032  478 THR AAA C   
1161 O O   . THR A 149 ? 0.344 0.336 0.268 -0.019 0.027  0.027  478 THR AAA O   
1162 C CB  A THR A 149 ? 0.423 0.401 0.341 -0.024 0.019  0.045  478 THR AAA CB  
1163 C CB  B THR A 149 ? 0.409 0.387 0.326 -0.025 0.020  0.045  478 THR AAA CB  
1164 O OG1 A THR A 149 ? 0.481 0.450 0.386 -0.026 0.013  0.053  478 THR AAA OG1 
1165 O OG1 B THR A 149 ? 0.400 0.380 0.325 -0.019 0.011  0.042  478 THR AAA OG1 
1166 C CG2 A THR A 149 ? 0.433 0.413 0.366 -0.027 0.025  0.046  478 THR AAA CG2 
1167 C CG2 B THR A 149 ? 0.448 0.416 0.354 -0.028 0.017  0.055  478 THR AAA CG2 
1168 N N   . PRO A 150 ? 0.380 0.371 0.307 -0.025 0.046  0.032  479 PRO AAA N   
1169 C CA  . PRO A 150 ? 0.366 0.367 0.313 -0.021 0.050  0.028  479 PRO AAA CA  
1170 C C   . PRO A 150 ? 0.321 0.330 0.289 -0.020 0.039  0.028  479 PRO AAA C   
1171 O O   . PRO A 150 ? 0.328 0.333 0.299 -0.023 0.033  0.032  479 PRO AAA O   
1172 C CB  . PRO A 150 ? 0.404 0.408 0.364 -0.024 0.066  0.032  479 PRO AAA CB  
1173 C CG  . PRO A 150 ? 0.442 0.438 0.389 -0.029 0.068  0.038  479 PRO AAA CG  
1174 C CD  . PRO A 150 ? 0.441 0.426 0.360 -0.030 0.057  0.038  479 PRO AAA CD  
1175 N N   . CYS A 151 ? 0.310 0.326 0.288 -0.016 0.036  0.023  480 CYS AAA N   
1176 C CA  . CYS A 151 ? 0.299 0.318 0.289 -0.016 0.025  0.022  480 CYS AAA CA  
1177 C C   . CYS A 151 ? 0.322 0.351 0.337 -0.020 0.025  0.027  480 CYS AAA C   
1178 O O   . CYS A 151 ? 0.307 0.335 0.327 -0.024 0.016  0.028  480 CYS AAA O   
1179 C CB  . CYS A 151 ? 0.303 0.325 0.291 -0.012 0.020  0.017  480 CYS AAA CB  
1180 S SG  . CYS A 151 ? 0.365 0.378 0.331 -0.009 0.017  0.013  480 CYS AAA SG  
1181 N N   . ASN A 152 ? 0.326 0.363 0.355 -0.019 0.036  0.030  481 ASN AAA N   
1182 C CA  . ASN A 152 ? 0.330 0.381 0.390 -0.023 0.036  0.038  481 ASN AAA CA  
1183 C C   . ASN A 152 ? 0.304 0.360 0.374 -0.024 0.022  0.038  481 ASN AAA C   
1184 O O   . ASN A 152 ? 0.322 0.385 0.409 -0.031 0.014  0.044  481 ASN AAA O   
1185 C CB  . ASN A 152 ? 0.352 0.401 0.417 -0.030 0.036  0.044  481 ASN AAA CB  
1186 C CG  . ASN A 152 ? 0.392 0.434 0.445 -0.029 0.050  0.045  481 ASN AAA CG  
1187 O OD1 . ASN A 152 ? 0.422 0.466 0.478 -0.025 0.065  0.045  481 ASN AAA OD1 
1188 N ND2 . ASN A 152 ? 0.420 0.451 0.457 -0.033 0.047  0.046  481 ASN AAA ND2 
1189 N N   . GLY A 153 ? 0.285 0.339 0.343 -0.019 0.020  0.031  482 GLY AAA N   
1190 C CA  . GLY A 153 ? 0.300 0.358 0.364 -0.020 0.008  0.031  482 GLY AAA CA  
1191 C C   . GLY A 153 ? 0.290 0.337 0.336 -0.026 -0.004 0.028  482 GLY AAA C   
1192 O O   . GLY A 153 ? 0.297 0.345 0.344 -0.029 -0.014 0.028  482 GLY AAA O   
1193 N N   . VAL A 154 ? 0.278 0.313 0.308 -0.026 -0.002 0.024  483 VAL AAA N   
1194 C CA  . VAL A 154 ? 0.281 0.302 0.295 -0.031 -0.011 0.021  483 VAL AAA CA  
1195 C C   . VAL A 154 ? 0.279 0.290 0.274 -0.025 -0.009 0.014  483 VAL AAA C   
1196 O O   . VAL A 154 ? 0.263 0.272 0.253 -0.020 -0.003 0.013  483 VAL AAA O   
1197 C CB  . VAL A 154 ? 0.300 0.313 0.313 -0.037 -0.010 0.024  483 VAL AAA CB  
1198 C CG1 . VAL A 154 ? 0.319 0.314 0.315 -0.042 -0.016 0.019  483 VAL AAA CG1 
1199 C CG2 . VAL A 154 ? 0.293 0.319 0.329 -0.045 -0.012 0.033  483 VAL AAA CG2 
1200 N N   . GLU A 155 ? 0.259 0.264 0.246 -0.025 -0.014 0.009  484 GLU AAA N   
1201 C CA  . GLU A 155 ? 0.274 0.270 0.247 -0.020 -0.011 0.004  484 GLU AAA CA  
1202 C C   . GLU A 155 ? 0.266 0.246 0.231 -0.020 -0.009 0.003  484 GLU AAA C   
1203 O O   . GLU A 155 ? 0.276 0.246 0.236 -0.028 -0.011 0.003  484 GLU AAA O   
1204 C CB  . GLU A 155 ? 0.282 0.273 0.247 -0.022 -0.015 -0.001 484 GLU AAA CB  
1205 C CG  . GLU A 155 ? 0.284 0.268 0.240 -0.015 -0.010 -0.006 484 GLU AAA CG  
1206 C CD  . GLU A 155 ? 0.309 0.287 0.255 -0.017 -0.013 -0.009 484 GLU AAA CD  
1207 O OE1 . GLU A 155 ? 0.311 0.291 0.256 -0.025 -0.020 -0.007 484 GLU AAA OE1 
1208 O OE2 . GLU A 155 ? 0.303 0.276 0.243 -0.012 -0.007 -0.013 484 GLU AAA OE2 
1209 N N   . GLY A 156 ? 0.265 0.245 0.229 -0.013 -0.005 0.004  485 GLY AAA N   
1210 C CA  . GLY A 156 ? 0.278 0.245 0.239 -0.012 -0.002 0.006  485 GLY AAA CA  
1211 C C   . GLY A 156 ? 0.268 0.238 0.231 -0.005 -0.000 0.009  485 GLY AAA C   
1212 O O   . GLY A 156 ? 0.263 0.242 0.228 -0.001 -0.001 0.008  485 GLY AAA O   
1213 N N   . PHE A 157 ? 0.296 0.258 0.260 -0.004 0.001  0.015  486 PHE AAA N   
1214 C CA  . PHE A 157 ? 0.285 0.250 0.253 0.001  0.000  0.022  486 PHE AAA CA  
1215 C C   . PHE A 157 ? 0.284 0.263 0.248 0.000  -0.002 0.023  486 PHE AAA C   
1216 O O   . PHE A 157 ? 0.260 0.242 0.219 -0.004 -0.001 0.024  486 PHE AAA O   
1217 C CB  . PHE A 157 ? 0.314 0.269 0.283 0.001  0.001  0.029  486 PHE AAA CB  
1218 C CG  . PHE A 157 ? 0.310 0.269 0.284 0.005  -0.002 0.039  486 PHE AAA CG  
1219 C CD1 . PHE A 157 ? 0.334 0.292 0.320 0.012  -0.003 0.042  486 PHE AAA CD1 
1220 C CD2 . PHE A 157 ? 0.348 0.311 0.314 0.001  -0.006 0.047  486 PHE AAA CD2 
1221 C CE1 . PHE A 157 ? 0.369 0.332 0.362 0.015  -0.009 0.054  486 PHE AAA CE1 
1222 C CE2 . PHE A 157 ? 0.372 0.338 0.340 0.003  -0.012 0.057  486 PHE AAA CE2 
1223 C CZ  . PHE A 157 ? 0.384 0.352 0.367 0.009  -0.015 0.062  486 PHE AAA CZ  
1224 N N   . ASN A 158 ? 0.280 0.266 0.244 0.004  -0.005 0.023  487 ASN AAA N   
1225 C CA  . ASN A 158 ? 0.287 0.281 0.243 0.002  -0.008 0.024  487 ASN AAA CA  
1226 C C   . ASN A 158 ? 0.294 0.293 0.247 -0.001 -0.004 0.017  487 ASN AAA C   
1227 O O   . ASN A 158 ? 0.292 0.294 0.237 -0.004 -0.002 0.017  487 ASN AAA O   
1228 C CB  . ASN A 158 ? 0.311 0.304 0.258 -0.002 -0.010 0.032  487 ASN AAA CB  
1229 C CG  . ASN A 158 ? 0.356 0.348 0.308 0.000  -0.018 0.041  487 ASN AAA CG  
1230 O OD1 . ASN A 158 ? 0.379 0.375 0.343 0.005  -0.020 0.042  487 ASN AAA OD1 
1231 N ND2 . ASN A 158 ? 0.394 0.382 0.338 -0.003 -0.021 0.051  487 ASN AAA ND2 
1232 N N   . CYS A 159 ? 0.264 0.263 0.224 -0.001 -0.002 0.012  488 CYS AAA N   
1233 C CA  . CYS A 159 ? 0.262 0.267 0.226 -0.003 0.001  0.009  488 CYS AAA CA  
1234 C C   . CYS A 159 ? 0.247 0.253 0.214 -0.001 -0.001 0.004  488 CYS AAA C   
1235 O O   . CYS A 159 ? 0.237 0.237 0.205 -0.003 -0.003 0.002  488 CYS AAA O   
1236 C CB  . CYS A 159 ? 0.261 0.264 0.229 -0.008 0.003  0.011  488 CYS AAA CB  
1237 S SG  . CYS A 159 ? 0.296 0.299 0.259 -0.010 0.008  0.017  488 CYS AAA SG  
1238 N N   . TYR A 160 ? 0.248 0.259 0.214 0.002  -0.002 0.001  489 TYR AAA N   
1239 C CA  . TYR A 160 ? 0.250 0.262 0.219 0.004  -0.003 -0.002 489 TYR AAA CA  
1240 C C   . TYR A 160 ? 0.257 0.274 0.230 0.002  -0.003 -0.004 489 TYR AAA C   
1241 O O   . TYR A 160 ? 0.232 0.255 0.208 0.003  -0.001 -0.004 489 TYR AAA O   
1242 C CB  . TYR A 160 ? 0.270 0.285 0.238 0.007  -0.004 -0.003 489 TYR AAA CB  
1243 C CG  . TYR A 160 ? 0.307 0.319 0.275 0.009  -0.006 0.002  489 TYR AAA CG  
1244 C CD1 . TYR A 160 ? 0.377 0.381 0.348 0.010  -0.005 0.004  489 TYR AAA CD1 
1245 C CD2 . TYR A 160 ? 0.320 0.335 0.286 0.008  -0.010 0.006  489 TYR AAA CD2 
1246 C CE1 . TYR A 160 ? 0.401 0.402 0.377 0.012  -0.006 0.011  489 TYR AAA CE1 
1247 C CE2 . TYR A 160 ? 0.389 0.404 0.359 0.009  -0.014 0.013  489 TYR AAA CE2 
1248 C CZ  . TYR A 160 ? 0.389 0.398 0.367 0.012  -0.012 0.016  489 TYR AAA CZ  
1249 O OH  . TYR A 160 ? 0.534 0.542 0.519 0.014  -0.015 0.025  489 TYR AAA OH  
1250 N N   . PHE A 161 ? 0.236 0.249 0.207 0.001  -0.006 -0.006 490 PHE AAA N   
1251 C CA  . PHE A 161 ? 0.241 0.259 0.216 -0.000 -0.008 -0.006 490 PHE AAA CA  
1252 C C   . PHE A 161 ? 0.232 0.253 0.207 0.004  -0.005 -0.009 490 PHE AAA C   
1253 O O   . PHE A 161 ? 0.243 0.260 0.214 0.007  -0.004 -0.010 490 PHE AAA O   
1254 C CB  . PHE A 161 ? 0.246 0.255 0.212 -0.005 -0.011 -0.008 490 PHE AAA CB  
1255 C CG  . PHE A 161 ? 0.250 0.264 0.219 -0.008 -0.016 -0.005 490 PHE AAA CG  
1256 C CD1 . PHE A 161 ? 0.266 0.287 0.245 -0.013 -0.022 0.001  490 PHE AAA CD1 
1257 C CD2 . PHE A 161 ? 0.257 0.268 0.220 -0.006 -0.015 -0.007 490 PHE AAA CD2 
1258 C CE1 . PHE A 161 ? 0.293 0.319 0.278 -0.016 -0.028 0.005  490 PHE AAA CE1 
1259 C CE2 . PHE A 161 ? 0.282 0.297 0.248 -0.009 -0.021 -0.003 490 PHE AAA CE2 
1260 C CZ  . PHE A 161 ? 0.274 0.297 0.251 -0.014 -0.028 0.004  490 PHE AAA CZ  
1261 N N   . PRO A 162 ? 0.233 0.259 0.213 0.006  -0.004 -0.008 491 PRO AAA N   
1262 C CA  . PRO A 162 ? 0.252 0.280 0.231 0.008  -0.002 -0.011 491 PRO AAA CA  
1263 C C   . PRO A 162 ? 0.220 0.247 0.199 0.009  -0.003 -0.012 491 PRO AAA C   
1264 O O   . PRO A 162 ? 0.236 0.264 0.214 0.010  -0.002 -0.014 491 PRO AAA O   
1265 C CB  . PRO A 162 ? 0.232 0.263 0.218 0.009  0.002  -0.011 491 PRO AAA CB  
1266 C CG  . PRO A 162 ? 0.237 0.273 0.234 0.007  0.001  -0.006 491 PRO AAA CG  
1267 C CD  . PRO A 162 ? 0.236 0.269 0.228 0.004  -0.004 -0.005 491 PRO AAA CD  
1268 N N   . LEU A 163 ? 0.216 0.241 0.193 0.007  -0.005 -0.011 492 LEU AAA N   
1269 C CA  . LEU A 163 ? 0.246 0.268 0.219 0.008  -0.005 -0.012 492 LEU AAA CA  
1270 C C   . LEU A 163 ? 0.243 0.257 0.208 0.007  -0.002 -0.014 492 LEU AAA C   
1271 O O   . LEU A 163 ? 0.260 0.267 0.219 0.005  -0.002 -0.015 492 LEU AAA O   
1272 C CB  . LEU A 163 ? 0.244 0.266 0.217 0.004  -0.008 -0.009 492 LEU AAA CB  
1273 C CG  . LEU A 163 ? 0.245 0.274 0.231 0.005  -0.010 -0.005 492 LEU AAA CG  
1274 C CD1 . LEU A 163 ? 0.278 0.309 0.267 0.002  -0.016 0.001  492 LEU AAA CD1 
1275 C CD2 . LEU A 163 ? 0.256 0.288 0.249 0.009  -0.005 -0.008 492 LEU AAA CD2 
1276 N N   . GLN A 164 ? 0.246 0.259 0.213 0.010  0.002  -0.015 493 GLN AAA N   
1277 C CA  . GLN A 164 ? 0.250 0.253 0.211 0.011  0.009  -0.017 493 GLN AAA CA  
1278 C C   . GLN A 164 ? 0.244 0.243 0.200 0.010  0.013  -0.018 493 GLN AAA C   
1279 O O   . GLN A 164 ? 0.223 0.229 0.184 0.010  0.011  -0.016 493 GLN AAA O   
1280 C CB  . GLN A 164 ? 0.261 0.268 0.234 0.016  0.011  -0.015 493 GLN AAA CB  
1281 C CG  . GLN A 164 ? 0.254 0.265 0.231 0.016  0.007  -0.014 493 GLN AAA CG  
1282 C CD  . GLN A 164 ? 0.267 0.276 0.252 0.020  0.010  -0.010 493 GLN AAA CD  
1283 O OE1 . GLN A 164 ? 0.309 0.320 0.306 0.023  0.014  -0.008 493 GLN AAA OE1 
1284 N NE2 . GLN A 164 ? 0.263 0.270 0.246 0.019  0.007  -0.009 493 GLN AAA NE2 
1285 N N   . SER A 165 ? 0.239 0.224 0.184 0.009  0.021  -0.020 494 SER AAA N   
1286 C CA  . SER A 165 ? 0.268 0.245 0.202 0.007  0.028  -0.021 494 SER AAA CA  
1287 C C   . SER A 165 ? 0.267 0.249 0.219 0.014  0.038  -0.020 494 SER AAA C   
1288 O O   . SER A 165 ? 0.279 0.260 0.242 0.018  0.044  -0.019 494 SER AAA O   
1289 C CB  . SER A 165 ? 0.296 0.252 0.204 0.001  0.034  -0.025 494 SER AAA CB  
1290 O OG  . SER A 165 ? 0.318 0.264 0.213 -0.001 0.042  -0.026 494 SER AAA OG  
1291 N N   . TYR A 166 ? 0.264 0.250 0.220 0.013  0.041  -0.018 495 TYR AAA N   
1292 C CA  . TYR A 166 ? 0.268 0.258 0.242 0.018  0.051  -0.015 495 TYR AAA CA  
1293 C C   . TYR A 166 ? 0.300 0.272 0.263 0.019  0.068  -0.018 495 TYR AAA C   
1294 O O   . TYR A 166 ? 0.298 0.274 0.284 0.025  0.079  -0.015 495 TYR AAA O   
1295 C CB  . TYR A 166 ? 0.275 0.271 0.252 0.016  0.051  -0.013 495 TYR AAA CB  
1296 C CG  . TYR A 166 ? 0.242 0.254 0.234 0.015  0.039  -0.010 495 TYR AAA CG  
1297 C CD1 . TYR A 166 ? 0.236 0.261 0.252 0.018  0.036  -0.007 495 TYR AAA CD1 
1298 C CD2 . TYR A 166 ? 0.260 0.272 0.243 0.012  0.030  -0.011 495 TYR AAA CD2 
1299 C CE1 . TYR A 166 ? 0.239 0.274 0.263 0.016  0.026  -0.006 495 TYR AAA CE1 
1300 C CE2 . TYR A 166 ? 0.251 0.273 0.246 0.011  0.023  -0.010 495 TYR AAA CE2 
1301 C CZ  . TYR A 166 ? 0.232 0.264 0.245 0.013  0.021  -0.008 495 TYR AAA CZ  
1302 O OH  . TYR A 166 ? 0.255 0.292 0.272 0.010  0.013  -0.008 495 TYR AAA OH  
1303 N N   . GLY A 167 ? 0.323 0.276 0.255 0.013  0.072  -0.023 496 GLY AAA N   
1304 C CA  . GLY A 167 ? 0.347 0.276 0.261 0.012  0.091  -0.028 496 GLY AAA CA  
1305 C C   . GLY A 167 ? 0.369 0.299 0.297 0.016  0.107  -0.025 496 GLY AAA C   
1306 O O   . GLY A 167 ? 0.362 0.287 0.306 0.023  0.124  -0.025 496 GLY AAA O   
1307 N N   . PHE A 168 ? 0.368 0.304 0.294 0.013  0.103  -0.022 497 PHE AAA N   
1308 C CA  . PHE A 168 ? 0.396 0.337 0.338 0.016  0.117  -0.018 497 PHE AAA CA  
1309 C C   . PHE A 168 ? 0.462 0.377 0.384 0.015  0.142  -0.023 497 PHE AAA C   
1310 O O   . PHE A 168 ? 0.495 0.386 0.375 0.006  0.145  -0.028 497 PHE AAA O   
1311 C CB  . PHE A 168 ? 0.359 0.307 0.295 0.010  0.108  -0.015 497 PHE AAA CB  
1312 C CG  . PHE A 168 ? 0.318 0.289 0.277 0.012  0.089  -0.011 497 PHE AAA CG  
1313 C CD1 . PHE A 168 ? 0.314 0.305 0.310 0.017  0.087  -0.006 497 PHE AAA CD1 
1314 C CD2 . PHE A 168 ? 0.307 0.279 0.251 0.007  0.073  -0.011 497 PHE AAA CD2 
1315 C CE1 . PHE A 168 ? 0.279 0.286 0.289 0.016  0.071  -0.004 497 PHE AAA CE1 
1316 C CE2 . PHE A 168 ? 0.288 0.277 0.250 0.008  0.059  -0.008 497 PHE AAA CE2 
1317 C CZ  . PHE A 168 ? 0.281 0.286 0.273 0.012  0.058  -0.006 497 PHE AAA CZ  
1318 N N   . GLN A 169 ? 0.499 0.417 0.451 0.024  0.160  -0.020 498 GLN AAA N   
1319 C CA  . GLN A 169 ? 0.566 0.460 0.509 0.026  0.190  -0.024 498 GLN AAA CA  
1320 C C   . GLN A 169 ? 0.589 0.492 0.551 0.028  0.203  -0.017 498 GLN AAA C   
1321 O O   . GLN A 169 ? 0.504 0.436 0.509 0.033  0.194  -0.009 498 GLN AAA O   
1322 C CB  . GLN A 169 ? 0.571 0.466 0.545 0.037  0.203  -0.022 498 GLN AAA CB  
1323 C CG  . GLN A 169 ? 0.581 0.468 0.542 0.036  0.191  -0.027 498 GLN AAA CG  
1324 C CD  . GLN A 169 ? 0.643 0.491 0.553 0.029  0.204  -0.039 498 GLN AAA CD  
1325 O OE1 . GLN A 169 ? 0.734 0.559 0.614 0.023  0.221  -0.044 498 GLN AAA OE1 
1326 N NE2 . GLN A 169 ? 0.671 0.510 0.569 0.027  0.196  -0.043 498 GLN AAA NE2 
1327 N N   . PRO A 170 ? 0.674 0.552 0.604 0.023  0.224  -0.022 499 PRO AAA N   
1328 C CA  . PRO A 170 ? 0.681 0.567 0.627 0.023  0.235  -0.015 499 PRO AAA CA  
1329 C C   . PRO A 170 ? 0.664 0.569 0.669 0.035  0.252  -0.006 499 PRO AAA C   
1330 O O   . PRO A 170 ? 0.607 0.531 0.640 0.035  0.253  0.002  499 PRO AAA O   
1331 C CB  . PRO A 170 ? 0.777 0.625 0.670 0.014  0.257  -0.022 499 PRO AAA CB  
1332 C CG  . PRO A 170 ? 0.796 0.615 0.657 0.013  0.266  -0.033 499 PRO AAA CG  
1333 C CD  . PRO A 170 ? 0.743 0.581 0.619 0.015  0.237  -0.032 499 PRO AAA CD  
1334 N N   . THR A 171 ? 0.644 0.546 0.668 0.043  0.262  -0.007 500 THR AAA N   
1335 C CA  . THR A 171 ? 0.701 0.619 0.785 0.056  0.279  0.003  500 THR AAA CA  
1336 C C   . THR A 171 ? 0.617 0.573 0.748 0.060  0.252  0.014  500 THR AAA C   
1337 O O   . THR A 171 ? 0.632 0.609 0.819 0.069  0.259  0.026  500 THR AAA O   
1338 C CB  . THR A 171 ? 0.758 0.649 0.836 0.063  0.307  -0.003 500 THR AAA CB  
1339 O OG1 . THR A 171 ? 0.805 0.681 0.847 0.058  0.291  -0.012 500 THR AAA OG1 
1340 C CG2 . THR A 171 ? 0.814 0.668 0.855 0.059  0.342  -0.011 500 THR AAA CG2 
1341 N N   . TYR A 172 ? 0.575 0.541 0.688 0.053  0.222  0.011  501 TYR AAA N   
1342 C CA  . TYR A 172 ? 0.511 0.509 0.658 0.054  0.194  0.020  501 TYR AAA CA  
1343 C C   . TYR A 172 ? 0.516 0.539 0.707 0.055  0.195  0.032  501 TYR AAA C   
1344 O O   . TYR A 172 ? 0.505 0.521 0.685 0.051  0.207  0.031  501 TYR AAA O   
1345 C CB  . TYR A 172 ? 0.493 0.491 0.605 0.045  0.168  0.013  501 TYR AAA CB  
1346 C CG  . TYR A 172 ? 0.472 0.461 0.561 0.045  0.155  0.006  501 TYR AAA CG  
1347 C CD1 . TYR A 172 ? 0.523 0.499 0.614 0.051  0.167  0.004  501 TYR AAA CD1 
1348 C CD2 . TYR A 172 ? 0.446 0.439 0.513 0.038  0.132  0.003  501 TYR AAA CD2 
1349 C CE1 . TYR A 172 ? 0.488 0.456 0.558 0.049  0.154  -0.001 501 TYR AAA CE1 
1350 C CE2 . TYR A 172 ? 0.417 0.405 0.466 0.037  0.121  -0.002 501 TYR AAA CE2 
1351 C CZ  . TYR A 172 ? 0.486 0.461 0.536 0.042  0.131  -0.004 501 TYR AAA CZ  
1352 O OH  . TYR A 172 ? 0.407 0.377 0.439 0.040  0.119  -0.009 501 TYR AAA OH  
1353 N N   . GLY A 173 ? 0.490 0.541 0.730 0.058  0.182  0.044  502 GLY AAA N   
1354 C CA  . GLY A 173 ? 0.491 0.570 0.772 0.055  0.173  0.056  502 GLY AAA CA  
1355 C C   . GLY A 173 ? 0.428 0.510 0.682 0.044  0.150  0.052  502 GLY AAA C   
1356 O O   . GLY A 173 ? 0.394 0.465 0.609 0.040  0.137  0.042  502 GLY AAA O   
1357 N N   . VAL A 174 ? 0.422 0.520 0.699 0.039  0.146  0.059  503 VAL AAA N   
1358 C CA  . VAL A 174 ? 0.439 0.536 0.691 0.028  0.130  0.054  503 VAL AAA CA  
1359 C C   . VAL A 174 ? 0.390 0.491 0.625 0.024  0.103  0.050  503 VAL AAA C   
1360 O O   . VAL A 174 ? 0.376 0.464 0.573 0.019  0.095  0.041  503 VAL AAA O   
1361 C CB  . VAL A 174 ? 0.481 0.597 0.769 0.023  0.129  0.065  503 VAL AAA CB  
1362 C CG1 . VAL A 174 ? 0.473 0.616 0.805 0.020  0.109  0.077  503 VAL AAA CG1 
1363 C CG2 . VAL A 174 ? 0.500 0.608 0.760 0.014  0.122  0.060  503 VAL AAA CG2 
1364 N N   . GLY A 175 ? 0.350 0.467 0.611 0.025  0.089  0.057  504 GLY AAA N   
1365 C CA  . GLY A 175 ? 0.286 0.405 0.528 0.020  0.066  0.052  504 GLY AAA CA  
1366 C C   . GLY A 175 ? 0.291 0.389 0.491 0.023  0.067  0.040  504 GLY AAA C   
1367 O O   . GLY A 175 ? 0.290 0.385 0.467 0.018  0.052  0.034  504 GLY AAA O   
1368 N N   . TYR A 176 ? 0.306 0.390 0.497 0.030  0.086  0.037  505 TYR AAA N   
1369 C CA  . TYR A 176 ? 0.302 0.367 0.455 0.032  0.087  0.026  505 TYR AAA CA  
1370 C C   . TYR A 176 ? 0.285 0.332 0.403 0.028  0.095  0.018  505 TYR AAA C   
1371 O O   . TYR A 176 ? 0.296 0.328 0.381 0.027  0.093  0.010  505 TYR AAA O   
1372 C CB  . TYR A 176 ? 0.407 0.461 0.563 0.040  0.103  0.026  505 TYR AAA CB  
1373 C CG  . TYR A 176 ? 0.425 0.496 0.625 0.046  0.103  0.037  505 TYR AAA CG  
1374 C CD1 . TYR A 176 ? 0.461 0.544 0.671 0.045  0.083  0.042  505 TYR AAA CD1 
1375 C CD2 . TYR A 176 ? 0.564 0.636 0.795 0.054  0.124  0.044  505 TYR AAA CD2 
1376 C CE1 . TYR A 176 ? 0.472 0.570 0.723 0.051  0.082  0.055  505 TYR AAA CE1 
1377 C CE2 . TYR A 176 ? 0.573 0.661 0.850 0.060  0.125  0.057  505 TYR AAA CE2 
1378 C CZ  . TYR A 176 ? 0.534 0.635 0.820 0.059  0.102  0.063  505 TYR AAA CZ  
1379 O OH  . TYR A 176 ? 0.559 0.677 0.891 0.064  0.100  0.078  505 TYR AAA OH  
1380 N N   . GLN A 177 ? 0.275 0.322 0.399 0.026  0.105  0.021  506 GLN AAA N   
1381 C CA  . GLN A 177 ? 0.289 0.317 0.378 0.022  0.114  0.015  506 GLN AAA CA  
1382 C C   . GLN A 177 ? 0.271 0.299 0.339 0.016  0.095  0.012  506 GLN AAA C   
1383 O O   . GLN A 177 ? 0.253 0.295 0.336 0.014  0.079  0.014  506 GLN AAA O   
1384 C CB  . GLN A 177 ? 0.319 0.348 0.422 0.021  0.130  0.020  506 GLN AAA CB  
1385 C CG  . GLN A 177 ? 0.344 0.365 0.459 0.028  0.155  0.022  506 GLN AAA CG  
1386 C CD  . GLN A 177 ? 0.359 0.383 0.494 0.027  0.173  0.029  506 GLN AAA CD  
1387 O OE1 . GLN A 177 ? 0.345 0.372 0.474 0.021  0.168  0.031  506 GLN AAA OE1 
1388 N NE2 . GLN A 177 ? 0.393 0.417 0.554 0.035  0.196  0.033  506 GLN AAA NE2 
1389 N N   . PRO A 178 ? 0.276 0.287 0.308 0.012  0.096  0.007  507 PRO AAA N   
1390 C CA  . PRO A 178 ? 0.270 0.280 0.287 0.008  0.080  0.005  507 PRO AAA CA  
1391 C C   . PRO A 178 ? 0.275 0.291 0.304 0.004  0.078  0.010  507 PRO AAA C   
1392 O O   . PRO A 178 ? 0.295 0.308 0.326 0.003  0.092  0.014  507 PRO AAA O   
1393 C CB  . PRO A 178 ? 0.296 0.286 0.275 0.004  0.083  0.002  507 PRO AAA CB  
1394 C CG  . PRO A 178 ? 0.329 0.306 0.300 0.004  0.104  0.002  507 PRO AAA CG  
1395 C CD  . PRO A 178 ? 0.315 0.303 0.318 0.012  0.112  0.003  507 PRO AAA CD  
1396 N N   . TYR A 179 ? 0.276 0.300 0.312 0.002  0.064  0.010  508 TYR AAA N   
1397 C CA  . TYR A 179 ? 0.267 0.293 0.310 -0.003 0.060  0.013  508 TYR AAA CA  
1398 C C   . TYR A 179 ? 0.280 0.298 0.304 -0.004 0.050  0.012  508 TYR AAA C   
1399 O O   . TYR A 179 ? 0.256 0.274 0.274 -0.002 0.042  0.008  508 TYR AAA O   
1400 C CB  . TYR A 179 ? 0.266 0.306 0.336 -0.005 0.052  0.015  508 TYR AAA CB  
1401 C CG  . TYR A 179 ? 0.266 0.317 0.363 -0.005 0.062  0.021  508 TYR AAA CG  
1402 C CD1 . TYR A 179 ? 0.278 0.332 0.384 0.001  0.071  0.023  508 TYR AAA CD1 
1403 C CD2 . TYR A 179 ? 0.288 0.344 0.403 -0.010 0.063  0.027  508 TYR AAA CD2 
1404 C CE1 . TYR A 179 ? 0.282 0.347 0.417 0.002  0.083  0.030  508 TYR AAA CE1 
1405 C CE2 . TYR A 179 ? 0.281 0.349 0.425 -0.010 0.072  0.034  508 TYR AAA CE2 
1406 C CZ  . TYR A 179 ? 0.290 0.363 0.446 -0.003 0.083  0.036  508 TYR AAA CZ  
1407 O OH  . TYR A 179 ? 0.324 0.410 0.515 -0.002 0.094  0.045  508 TYR AAA OH  
1408 N N   . ARG A 180 ? 0.291 0.301 0.306 -0.008 0.053  0.016  509 ARG AAA N   
1409 C CA  . ARG A 180 ? 0.290 0.294 0.296 -0.009 0.044  0.017  509 ARG AAA CA  
1410 C C   . ARG A 180 ? 0.286 0.293 0.310 -0.010 0.038  0.017  509 ARG AAA C   
1411 O O   . ARG A 180 ? 0.318 0.330 0.357 -0.013 0.043  0.019  509 ARG AAA O   
1412 C CB  . ARG A 180 ? 0.321 0.313 0.308 -0.012 0.047  0.024  509 ARG AAA CB  
1413 C CG  . ARG A 180 ? 0.332 0.315 0.293 -0.013 0.048  0.023  509 ARG AAA CG  
1414 C CD  . ARG A 180 ? 0.371 0.340 0.308 -0.019 0.051  0.030  509 ARG AAA CD  
1415 N NE  . ARG A 180 ? 0.387 0.347 0.297 -0.022 0.050  0.028  509 ARG AAA NE  
1416 C CZ  . ARG A 180 ? 0.424 0.371 0.306 -0.029 0.044  0.034  509 ARG AAA CZ  
1417 N NH1 . ARG A 180 ? 0.474 0.417 0.353 -0.032 0.040  0.044  509 ARG AAA NH1 
1418 N NH2 . ARG A 180 ? 0.439 0.377 0.295 -0.033 0.042  0.031  509 ARG AAA NH2 
1419 N N   . VAL A 181 ? 0.278 0.284 0.301 -0.009 0.030  0.014  510 VAL AAA N   
1420 C CA  . VAL A 181 ? 0.278 0.283 0.313 -0.011 0.026  0.011  510 VAL AAA CA  
1421 C C   . VAL A 181 ? 0.282 0.276 0.314 -0.010 0.025  0.014  510 VAL AAA C   
1422 O O   . VAL A 181 ? 0.272 0.266 0.297 -0.006 0.022  0.015  510 VAL AAA O   
1423 C CB  . VAL A 181 ? 0.273 0.282 0.310 -0.010 0.021  0.004  510 VAL AAA CB  
1424 C CG1 . VAL A 181 ? 0.289 0.292 0.330 -0.015 0.018  -0.001 510 VAL AAA CG1 
1425 C CG2 . VAL A 181 ? 0.272 0.294 0.316 -0.011 0.022  0.004  510 VAL AAA CG2 
1426 N N   . VAL A 182 ? 0.291 0.278 0.330 -0.013 0.026  0.015  511 VAL AAA N   
1427 C CA  . VAL A 182 ? 0.293 0.269 0.336 -0.011 0.026  0.018  511 VAL AAA CA  
1428 C C   . VAL A 182 ? 0.276 0.244 0.325 -0.014 0.027  0.010  511 VAL AAA C   
1429 O O   . VAL A 182 ? 0.287 0.254 0.340 -0.021 0.027  0.008  511 VAL AAA O   
1430 C CB  . VAL A 182 ? 0.313 0.282 0.357 -0.012 0.029  0.028  511 VAL AAA CB  
1431 C CG1 . VAL A 182 ? 0.328 0.285 0.381 -0.010 0.029  0.032  511 VAL AAA CG1 
1432 C CG2 . VAL A 182 ? 0.321 0.294 0.352 -0.011 0.027  0.036  511 VAL AAA CG2 
1433 N N   . VAL A 183 ? 0.269 0.231 0.317 -0.011 0.028  0.006  512 VAL AAA N   
1434 C CA  . VAL A 183 ? 0.306 0.253 0.353 -0.015 0.031  -0.003 512 VAL AAA CA  
1435 C C   . VAL A 183 ? 0.321 0.252 0.376 -0.011 0.037  0.001  512 VAL AAA C   
1436 O O   . VAL A 183 ? 0.315 0.247 0.376 -0.003 0.039  0.006  512 VAL AAA O   
1437 C CB  . VAL A 183 ? 0.312 0.259 0.350 -0.014 0.030  -0.012 512 VAL AAA CB  
1438 C CG1 . VAL A 183 ? 0.342 0.269 0.372 -0.020 0.034  -0.022 512 VAL AAA CG1 
1439 C CG2 . VAL A 183 ? 0.302 0.265 0.335 -0.016 0.023  -0.013 512 VAL AAA CG2 
1440 N N   . LEU A 184 ? 0.341 0.258 0.399 -0.017 0.041  -0.000 513 LEU AAA N   
1441 C CA  . LEU A 184 ? 0.348 0.246 0.415 -0.014 0.049  0.003  513 LEU AAA CA  
1442 C C   . LEU A 184 ? 0.356 0.234 0.416 -0.017 0.056  -0.010 513 LEU AAA C   
1443 O O   . LEU A 184 ? 0.378 0.249 0.425 -0.027 0.054  -0.019 513 LEU AAA O   
1444 C CB  . LEU A 184 ? 0.371 0.264 0.445 -0.019 0.049  0.009  513 LEU AAA CB  
1445 C CG  . LEU A 184 ? 0.372 0.280 0.448 -0.018 0.044  0.022  513 LEU AAA CG  
1446 C CD1 . LEU A 184 ? 0.393 0.293 0.476 -0.024 0.047  0.028  513 LEU AAA CD1 
1447 C CD2 . LEU A 184 ? 0.374 0.290 0.455 -0.009 0.042  0.032  513 LEU AAA CD2 
1448 N N   . SER A 185 ? 0.440 0.265 0.396 0.051  -0.020 -0.009 514 SER AAA N   
1449 C CA  . SER A 185 ? 0.470 0.288 0.416 0.056  -0.013 -0.001 514 SER AAA CA  
1450 C C   . SER A 185 ? 0.410 0.270 0.392 0.035  -0.025 -0.007 514 SER AAA C   
1451 O O   . SER A 185 ? 0.385 0.252 0.396 0.015  -0.026 -0.011 514 SER AAA O   
1452 C CB  . SER A 185 ? 0.511 0.274 0.449 0.051  0.018  0.008  514 SER AAA CB  
1453 O OG  . SER A 185 ? 0.627 0.334 0.513 0.079  0.039  0.018  514 SER AAA OG  
1454 N N   . PHE A 186 ? 0.410 0.294 0.386 0.044  -0.035 -0.009 515 PHE AAA N   
1455 C CA  . PHE A 186 ? 0.385 0.296 0.387 0.026  -0.040 -0.014 515 PHE AAA CA  
1456 C C   . PHE A 186 ? 0.406 0.297 0.397 0.028  -0.030 -0.005 515 PHE AAA C   
1457 O O   . PHE A 186 ? 0.440 0.322 0.401 0.050  -0.030 -0.004 515 PHE AAA O   
1458 C CB  . PHE A 186 ? 0.395 0.346 0.409 0.029  -0.052 -0.030 515 PHE AAA CB  
1459 C CG  . PHE A 186 ? 0.398 0.367 0.424 0.029  -0.056 -0.038 515 PHE AAA CG  
1460 C CD1 . PHE A 186 ? 0.436 0.401 0.474 0.014  -0.051 -0.034 515 PHE AAA CD1 
1461 C CD2 . PHE A 186 ? 0.441 0.434 0.462 0.049  -0.066 -0.051 515 PHE AAA CD2 
1462 C CE1 . PHE A 186 ? 0.436 0.412 0.478 0.017  -0.051 -0.039 515 PHE AAA CE1 
1463 C CE2 . PHE A 186 ? 0.443 0.453 0.477 0.049  -0.067 -0.058 515 PHE AAA CE2 
1464 C CZ  . PHE A 186 ? 0.421 0.420 0.465 0.032  -0.057 -0.051 515 PHE AAA CZ  
1465 N N   . GLU A 187 ? 0.400 0.288 0.414 0.010  -0.022 -0.000 516 GLU AAA N   
1466 C CA  . GLU A 187 ? 0.452 0.323 0.462 0.009  -0.009 0.008  516 GLU AAA CA  
1467 C C   . GLU A 187 ? 0.434 0.326 0.449 0.004  -0.017 0.004  516 GLU AAA C   
1468 O O   . GLU A 187 ? 0.417 0.328 0.450 -0.007 -0.022 -0.001 516 GLU AAA O   
1469 C CB  . GLU A 187 ? 0.485 0.350 0.528 -0.007 0.003  0.009  516 GLU AAA CB  
1470 C CG  . GLU A 187 ? 0.543 0.389 0.590 -0.009 0.024  0.016  516 GLU AAA CG  
1471 C CD  . GLU A 187 ? 0.566 0.429 0.665 -0.028 0.031  0.006  516 GLU AAA CD  
1472 O OE1 . GLU A 187 ? 0.552 0.451 0.672 -0.031 0.015  -0.001 516 GLU AAA OE1 
1473 O OE2 . GLU A 187 ? 0.570 0.412 0.689 -0.036 0.054  0.002  516 GLU AAA OE2 
1474 N N   . LEU A 188 ? 0.477 0.358 0.470 0.016  -0.013 0.006  517 LEU AAA N   
1475 C CA  . LEU A 188 ? 0.507 0.401 0.499 0.012  -0.017 -0.002 517 LEU AAA CA  
1476 C C   . LEU A 188 ? 0.521 0.393 0.503 0.015  -0.003 0.010  517 LEU AAA C   
1477 O O   . LEU A 188 ? 0.557 0.422 0.514 0.028  -0.005 0.004  517 LEU AAA O   
1478 C CB  . LEU A 188 ? 0.580 0.490 0.555 0.029  -0.032 -0.021 517 LEU AAA CB  
1479 C CG  . LEU A 188 ? 0.628 0.568 0.616 0.032  -0.046 -0.037 517 LEU AAA CG  
1480 C CD1 . LEU A 188 ? 0.658 0.580 0.615 0.057  -0.048 -0.028 517 LEU AAA CD1 
1481 C CD2 . LEU A 188 ? 0.680 0.658 0.680 0.037  -0.061 -0.069 517 LEU AAA CD2 
1482 N N   . LEU A 189 ? 0.488 0.352 0.490 0.005  0.010  0.021  518 LEU AAA N   
1483 C CA  . LEU A 189 ? 0.476 0.326 0.477 0.007  0.026  0.031  518 LEU AAA CA  
1484 C C   . LEU A 189 ? 0.465 0.322 0.462 0.004  0.021  0.027  518 LEU AAA C   
1485 O O   . LEU A 189 ? 0.420 0.293 0.426 -0.004 0.012  0.018  518 LEU AAA O   
1486 C CB  . LEU A 189 ? 0.497 0.355 0.538 -0.004 0.038  0.033  518 LEU AAA CB  
1487 C CG  . LEU A 189 ? 0.544 0.387 0.600 -0.008 0.052  0.033  518 LEU AAA CG  
1488 C CD1 . LEU A 189 ? 0.546 0.407 0.657 -0.023 0.067  0.025  518 LEU AAA CD1 
1489 C CD2 . LEU A 189 ? 0.623 0.418 0.633 0.010  0.073  0.046  518 LEU AAA CD2 
1490 N N   . HIS A 190 ? 0.447 0.286 0.427 0.012  0.033  0.033  519 HIS AAA N   
1491 C CA  . HIS A 190 ? 0.462 0.299 0.437 0.009  0.036  0.031  519 HIS AAA CA  
1492 C C   . HIS A 190 ? 0.432 0.282 0.433 0.006  0.041  0.038  519 HIS AAA C   
1493 O O   . HIS A 190 ? 0.458 0.305 0.464 0.013  0.054  0.047  519 HIS AAA O   
1494 C CB  . HIS A 190 ? 0.508 0.320 0.450 0.023  0.044  0.033  519 HIS AAA CB  
1495 C CG  . HIS A 190 ? 0.540 0.348 0.451 0.036  0.032  0.019  519 HIS AAA CG  
1496 N ND1 . HIS A 190 ? 0.556 0.386 0.475 0.029  0.014  -0.005 519 HIS AAA ND1 
1497 C CD2 . HIS A 190 ? 0.599 0.384 0.471 0.061  0.035  0.023  519 HIS AAA CD2 
1498 C CE1 . HIS A 190 ? 0.593 0.426 0.483 0.050  0.000  -0.020 519 HIS AAA CE1 
1499 N NE2 . HIS A 190 ? 0.620 0.421 0.473 0.074  0.012  -0.001 519 HIS AAA NE2 
1500 N N   . ALA A 191 ? 0.398 0.265 0.413 0.001  0.032  0.034  520 ALA AAA N   
1501 C CA  . ALA A 191 ? 0.400 0.288 0.435 0.008  0.029  0.035  520 ALA AAA CA  
1502 C C   . ALA A 191 ? 0.389 0.273 0.408 0.011  0.024  0.032  520 ALA AAA C   
1503 O O   . ALA A 191 ? 0.392 0.266 0.402 0.000  0.024  0.027  520 ALA AAA O   
1504 C CB  . ALA A 191 ? 0.375 0.288 0.448 0.004  0.024  0.029  520 ALA AAA CB  
1505 N N   . PRO A 192 ? 0.412 0.305 0.425 0.029  0.021  0.033  521 PRO AAA N   
1506 C CA  . PRO A 192 ? 0.443 0.324 0.431 0.039  0.021  0.033  521 PRO AAA CA  
1507 C C   . PRO A 192 ? 0.421 0.316 0.426 0.026  0.009  0.025  521 PRO AAA C   
1508 O O   . PRO A 192 ? 0.420 0.344 0.457 0.020  -0.005 0.017  521 PRO AAA O   
1509 C CB  . PRO A 192 ? 0.465 0.363 0.443 0.072  0.013  0.033  521 PRO AAA CB  
1510 C CG  . PRO A 192 ? 0.457 0.365 0.449 0.077  0.017  0.035  521 PRO AAA CG  
1511 C CD  . PRO A 192 ? 0.425 0.342 0.454 0.047  0.018  0.032  521 PRO AAA CD  
1512 N N   . ALA A 193 ? 0.426 0.300 0.413 0.019  0.019  0.025  522 ALA AAA N   
1513 C CA  . ALA A 193 ? 0.421 0.307 0.421 0.008  0.010  0.017  522 ALA AAA CA  
1514 C C   . ALA A 193 ? 0.455 0.333 0.430 0.027  0.011  0.019  522 ALA AAA C   
1515 O O   . ALA A 193 ? 0.510 0.352 0.454 0.033  0.036  0.025  522 ALA AAA O   
1516 C CB  . ALA A 193 ? 0.433 0.313 0.441 -0.011 0.019  0.009  522 ALA AAA CB  
1517 N N   . THR A 194 ? 0.442 0.347 0.429 0.037  -0.011 0.011  523 THR AAA N   
1518 C CA  . THR A 194 ? 0.531 0.435 0.488 0.067  -0.019 0.009  523 THR AAA CA  
1519 C C   . THR A 194 ? 0.501 0.403 0.455 0.064  -0.022 0.004  523 THR AAA C   
1520 O O   . THR A 194 ? 0.539 0.433 0.457 0.093  -0.026 0.003  523 THR AAA O   
1521 C CB  . THR A 194 ? 0.571 0.518 0.552 0.083  -0.045 -0.006 523 THR AAA CB  
1522 O OG1 . THR A 194 ? 0.710 0.659 0.654 0.121  -0.058 -0.013 523 THR AAA OG1 
1523 C CG2 . THR A 194 ? 0.566 0.546 0.603 0.058  -0.060 -0.022 523 THR AAA CG2 
1524 N N   . VAL A 195 ? 0.450 0.359 0.432 0.036  -0.021 0.001  524 VAL AAA N   
1525 C CA  . VAL A 195 ? 0.446 0.352 0.424 0.033  -0.020 -0.003 524 VAL AAA CA  
1526 C C   . VAL A 195 ? 0.448 0.336 0.427 0.018  0.007  0.001  524 VAL AAA C   
1527 O O   . VAL A 195 ? 0.427 0.328 0.434 -0.002 0.006  -0.005 524 VAL AAA O   
1528 C CB  . VAL A 195 ? 0.425 0.354 0.435 0.020  -0.038 -0.013 524 VAL AAA CB  
1529 C CG1 . VAL A 195 ? 0.424 0.351 0.424 0.025  -0.040 -0.017 524 VAL AAA CG1 
1530 C CG2 . VAL A 195 ? 0.429 0.379 0.460 0.023  -0.057 -0.023 524 VAL AAA CG2 
1531 N N   . CYS A 196 ? 0.498 0.356 0.446 0.030  0.031  0.007  525 CYS AAA N   
1532 C CA  . CYS A 196 ? 0.531 0.367 0.488 0.012  0.068  0.005  525 CYS AAA CA  
1533 C C   . CYS A 196 ? 0.551 0.379 0.503 0.015  0.085  0.002  525 CYS AAA C   
1534 O O   . CYS A 196 ? 0.589 0.413 0.511 0.039  0.072  0.008  525 CYS AAA O   
1535 C CB  . CYS A 196 ? 0.582 0.368 0.502 0.022  0.103  0.017  525 CYS AAA CB  
1536 S SG  . CYS A 196 ? 0.601 0.395 0.525 0.021  0.087  0.020  525 CYS AAA SG  
1537 N N   . GLY A 197 ? 0.562 0.393 0.550 -0.009 0.113  -0.011 526 GLY AAA N   
1538 C CA  . GLY A 197 ? 0.602 0.418 0.590 -0.009 0.146  -0.014 526 GLY AAA CA  
1539 C C   . GLY A 197 ? 0.690 0.432 0.616 0.013  0.192  0.006  526 GLY AAA C   
1540 O O   . GLY A 197 ? 0.755 0.464 0.640 0.030  0.196  0.021  526 GLY AAA O   
1541 N N   . PRO A 198 ? 0.746 0.458 0.659 0.019  0.232  0.009  527 PRO AAA N   
1542 C CA  . PRO A 198 ? 0.848 0.474 0.684 0.050  0.284  0.032  527 PRO AAA CA  
1543 C C   . PRO A 198 ? 0.911 0.479 0.737 0.037  0.338  0.037  527 PRO AAA C   
1544 O O   . PRO A 198 ? 0.898 0.492 0.798 -0.007 0.353  0.013  527 PRO AAA O   
1545 C CB  . PRO A 198 ? 0.867 0.478 0.711 0.047  0.323  0.029  527 PRO AAA CB  
1546 C CG  . PRO A 198 ? 0.788 0.483 0.694 0.030  0.272  0.008  527 PRO AAA CG  
1547 C CD  . PRO A 198 ? 0.716 0.470 0.681 0.001  0.232  -0.009 527 PRO AAA CD  
1548 N N   . GLN B 3   ? 0.723 0.837 0.529 0.093  0.015  0.005  1   GLN BBB N   
1549 C CA  . GLN B 3   ? 0.698 0.801 0.517 0.083  0.025  0.014  1   GLN BBB CA  
1550 C C   . GLN B 3   ? 0.618 0.705 0.458 0.073  0.020  0.007  1   GLN BBB C   
1551 O O   . GLN B 3   ? 0.655 0.738 0.499 0.073  0.011  -0.000 1   GLN BBB O   
1552 C CB  . GLN B 3   ? 0.747 0.850 0.564 0.082  0.034  0.035  1   GLN BBB CB  
1553 C CG  . GLN B 3   ? 0.774 0.865 0.609 0.072  0.042  0.044  1   GLN BBB CG  
1554 C CD  . GLN B 3   ? 0.786 0.881 0.625 0.070  0.050  0.041  1   GLN BBB CD  
1555 O OE1 . GLN B 3   ? 0.707 0.801 0.548 0.069  0.045  0.026  1   GLN BBB OE1 
1556 N NE2 . GLN B 3   ? 0.729 0.826 0.571 0.069  0.061  0.056  1   GLN BBB NE2 
1557 N N   . VAL B 4   ? 0.519 0.596 0.370 0.064  0.026  0.010  2   VAL BBB N   
1558 C CA  . VAL B 4   ? 0.459 0.520 0.327 0.054  0.023  0.007  2   VAL BBB CA  
1559 C C   . VAL B 4   ? 0.432 0.486 0.303 0.053  0.023  0.016  2   VAL BBB C   
1560 O O   . VAL B 4   ? 0.449 0.506 0.315 0.055  0.028  0.029  2   VAL BBB O   
1561 C CB  . VAL B 4   ? 0.455 0.508 0.332 0.047  0.030  0.011  2   VAL BBB CB  
1562 C CG1 . VAL B 4   ? 0.448 0.486 0.338 0.038  0.028  0.010  2   VAL BBB CG1 
1563 C CG2 . VAL B 4   ? 0.458 0.516 0.335 0.048  0.029  0.001  2   VAL BBB CG2 
1564 N N   . GLN B 5   ? 0.401 0.447 0.281 0.049  0.017  0.009  3   GLN BBB N   
1565 C CA  . GLN B 5   ? 0.418 0.456 0.305 0.046  0.016  0.015  3   GLN BBB CA  
1566 C C   . GLN B 5   ? 0.384 0.408 0.284 0.038  0.017  0.010  3   GLN BBB C   
1567 O O   . GLN B 5   ? 0.349 0.372 0.252 0.036  0.014  0.000  3   GLN BBB O   
1568 C CB  . GLN B 5   ? 0.476 0.519 0.362 0.053  0.008  0.011  3   GLN BBB CB  
1569 C CG  . GLN B 5   ? 0.567 0.625 0.435 0.063  0.006  0.014  3   GLN BBB CG  
1570 C CD  . GLN B 5   ? 0.684 0.743 0.549 0.065  0.011  0.031  3   GLN BBB CD  
1571 O OE1 . GLN B 5   ? 0.764 0.814 0.641 0.059  0.012  0.038  3   GLN BBB OE1 
1572 N NE2 . GLN B 5   ? 0.747 0.818 0.595 0.072  0.013  0.039  3   GLN BBB NE2 
1573 N N   . LEU B 6   ? 0.355 0.371 0.262 0.033  0.021  0.017  4   LEU BBB N   
1574 C CA  . LEU B 6   ? 0.346 0.350 0.264 0.026  0.022  0.013  4   LEU BBB CA  
1575 C C   . LEU B 6   ? 0.358 0.359 0.283 0.027  0.019  0.013  4   LEU BBB C   
1576 O O   . LEU B 6   ? 0.422 0.424 0.350 0.028  0.021  0.021  4   LEU BBB O   
1577 C CB  . LEU B 6   ? 0.339 0.335 0.259 0.021  0.027  0.019  4   LEU BBB CB  
1578 C CG  . LEU B 6   ? 0.353 0.352 0.268 0.021  0.029  0.019  4   LEU BBB CG  
1579 C CD1 . LEU B 6   ? 0.351 0.343 0.273 0.016  0.033  0.024  4   LEU BBB CD1 
1580 C CD2 . LEU B 6   ? 0.350 0.347 0.265 0.019  0.026  0.009  4   LEU BBB CD2 
1581 N N   . VAL B 7   ? 0.333 0.333 0.265 0.026  0.016  0.004  5   VAL BBB N   
1582 C CA  . VAL B 7   ? 0.334 0.332 0.276 0.027  0.014  0.003  5   VAL BBB CA  
1583 C C   . VAL B 7   ? 0.334 0.322 0.285 0.020  0.020  0.002  5   VAL BBB C   
1584 O O   . VAL B 7   ? 0.329 0.313 0.281 0.016  0.022  -0.003 5   VAL BBB O   
1585 C CB  . VAL B 7   ? 0.356 0.360 0.305 0.030  0.007  -0.007 5   VAL BBB CB  
1586 C CG1 . VAL B 7   ? 0.365 0.367 0.327 0.031  0.004  -0.009 5   VAL BBB CG1 
1587 C CG2 . VAL B 7   ? 0.381 0.396 0.318 0.038  0.001  -0.008 5   VAL BBB CG2 
1588 N N   . GLU B 8   ? 0.328 0.312 0.284 0.019  0.022  0.007  6   GLU BBB N   
1589 C CA  . GLU B 8   ? 0.357 0.332 0.320 0.014  0.028  0.005  6   GLU BBB CA  
1590 C C   . GLU B 8   ? 0.359 0.333 0.336 0.014  0.028  0.001  6   GLU BBB C   
1591 O O   . GLU B 8   ? 0.341 0.320 0.324 0.018  0.023  0.002  6   GLU BBB O   
1592 C CB  . GLU B 8   ? 0.385 0.357 0.349 0.012  0.031  0.011  6   GLU BBB CB  
1593 C CG  . GLU B 8   ? 0.426 0.399 0.382 0.012  0.031  0.015  6   GLU BBB CG  
1594 C CD  . GLU B 8   ? 0.449 0.421 0.410 0.013  0.032  0.023  6   GLU BBB CD  
1595 O OE1 . GLU B 8   ? 0.525 0.500 0.494 0.016  0.030  0.028  6   GLU BBB OE1 
1596 O OE2 . GLU B 8   ? 0.387 0.356 0.348 0.010  0.034  0.025  6   GLU BBB OE2 
1597 N N   . SER B 9   ? 0.347 0.316 0.329 0.010  0.034  -0.004 7   SER BBB N   
1598 C CA  A SER B 9   ? 0.348 0.315 0.345 0.010  0.036  -0.008 7   SER BBB CA  
1599 C CA  B SER B 9   ? 0.352 0.320 0.350 0.010  0.036  -0.008 7   SER BBB CA  
1600 C C   . SER B 9   ? 0.356 0.317 0.354 0.005  0.045  -0.011 7   SER BBB C   
1601 O O   . SER B 9   ? 0.340 0.297 0.324 0.003  0.047  -0.010 7   SER BBB O   
1602 C CB  A SER B 9   ? 0.353 0.325 0.359 0.010  0.034  -0.013 7   SER BBB CB  
1603 C CB  B SER B 9   ? 0.364 0.335 0.371 0.011  0.033  -0.013 7   SER BBB CB  
1604 O OG  A SER B 9   ? 0.342 0.311 0.341 0.007  0.037  -0.014 7   SER BBB OG  
1605 O OG  B SER B 9   ? 0.363 0.335 0.388 0.012  0.033  -0.016 7   SER BBB OG  
1606 N N   . GLY B 10  ? 0.368 0.328 0.380 0.005  0.048  -0.014 8   GLY BBB N   
1607 C CA  . GLY B 10  ? 0.377 0.333 0.389 0.003  0.057  -0.018 8   GLY BBB CA  
1608 C C   . GLY B 10  ? 0.396 0.350 0.412 0.003  0.056  -0.018 8   GLY BBB C   
1609 O O   . GLY B 10  ? 0.418 0.374 0.439 0.006  0.050  -0.014 8   GLY BBB O   
1610 N N   . GLY B 11  ? 0.429 0.379 0.442 0.002  0.063  -0.023 9   GLY BBB N   
1611 C CA  . GLY B 11  ? 0.455 0.403 0.475 0.003  0.062  -0.025 9   GLY BBB CA  
1612 C C   . GLY B 11  ? 0.470 0.420 0.513 0.005  0.062  -0.028 9   GLY BBB C   
1613 O O   . GLY B 11  ? 0.496 0.448 0.548 0.005  0.065  -0.030 9   GLY BBB O   
1614 N N   . GLY B 12  ? 0.404 0.352 0.459 0.006  0.059  -0.029 10  GLY BBB N   
1615 C CA  . GLY B 12  ? 0.405 0.354 0.484 0.007  0.060  -0.034 10  GLY BBB CA  
1616 C C   . GLY B 12  ? 0.401 0.347 0.483 0.007  0.066  -0.045 10  GLY BBB C   
1617 O O   . GLY B 12  ? 0.371 0.314 0.441 0.007  0.065  -0.046 10  GLY BBB O   
1618 N N   . SER B 13  ? 0.417 0.365 0.515 0.008  0.071  -0.053 11  SER BBB N   
1619 C CA  . SER B 13  ? 0.442 0.389 0.546 0.010  0.077  -0.065 11  SER BBB CA  
1620 C C   . SER B 13  ? 0.458 0.406 0.543 0.009  0.089  -0.072 11  SER BBB C   
1621 O O   . SER B 13  ? 0.473 0.424 0.555 0.008  0.094  -0.068 11  SER BBB O   
1622 C CB  . SER B 13  ? 0.474 0.423 0.610 0.011  0.076  -0.070 11  SER BBB CB  
1623 O OG  . SER B 13  ? 0.516 0.463 0.667 0.012  0.065  -0.062 11  SER BBB OG  
1624 N N   . VAL B 14  ? 0.448 0.395 0.522 0.011  0.092  -0.081 12  VAL BBB N   
1625 C CA  . VAL B 14  ? 0.477 0.426 0.531 0.012  0.104  -0.088 12  VAL BBB CA  
1626 C C   . VAL B 14  ? 0.466 0.415 0.521 0.016  0.105  -0.103 12  VAL BBB C   
1627 O O   . VAL B 14  ? 0.444 0.389 0.508 0.016  0.095  -0.105 12  VAL BBB O   
1628 C CB  . VAL B 14  ? 0.511 0.458 0.535 0.010  0.105  -0.080 12  VAL BBB CB  
1629 C CG1 . VAL B 14  ? 0.537 0.478 0.546 0.010  0.096  -0.081 12  VAL BBB CG1 
1630 C CG2 . VAL B 14  ? 0.561 0.510 0.566 0.011  0.119  -0.083 12  VAL BBB CG2 
1631 N N   . GLN B 15  ? 0.475 0.428 0.522 0.018  0.117  -0.112 13  GLN BBB N   
1632 C CA  . GLN B 15  ? 0.494 0.448 0.538 0.023  0.119  -0.129 13  GLN BBB CA  
1633 C C   . GLN B 15  ? 0.467 0.418 0.477 0.025  0.116  -0.130 13  GLN BBB C   
1634 O O   . GLN B 15  ? 0.446 0.394 0.433 0.022  0.118  -0.118 13  GLN BBB O   
1635 C CB  . GLN B 15  ? 0.552 0.512 0.603 0.026  0.133  -0.140 13  GLN BBB CB  
1636 C CG  . GLN B 15  ? 0.623 0.587 0.648 0.026  0.148  -0.135 13  GLN BBB CG  
1637 C CD  . GLN B 15  ? 0.673 0.645 0.714 0.028  0.163  -0.142 13  GLN BBB CD  
1638 O OE1 . GLN B 15  ? 0.769 0.745 0.819 0.033  0.167  -0.158 13  GLN BBB OE1 
1639 N NE2 . GLN B 15  ? 0.685 0.660 0.732 0.025  0.172  -0.132 13  GLN BBB NE2 
1640 N N   . ALA B 16  ? 0.451 0.400 0.459 0.029  0.110  -0.143 14  ALA BBB N   
1641 C CA  . ALA B 16  ? 0.468 0.414 0.445 0.032  0.105  -0.147 14  ALA BBB CA  
1642 C C   . ALA B 16  ? 0.484 0.434 0.426 0.034  0.119  -0.146 14  ALA BBB C   
1643 O O   . ALA B 16  ? 0.493 0.449 0.438 0.036  0.132  -0.152 14  ALA BBB O   
1644 C CB  . ALA B 16  ? 0.469 0.415 0.454 0.037  0.097  -0.166 14  ALA BBB CB  
1645 N N   . GLY B 17  ? 0.489 0.435 0.402 0.033  0.116  -0.137 15  GLY BBB N   
1646 C CA  . GLY B 17  ? 0.514 0.462 0.393 0.034  0.127  -0.131 15  GLY BBB CA  
1647 C C   . GLY B 17  ? 0.506 0.454 0.389 0.028  0.135  -0.113 15  GLY BBB C   
1648 O O   . GLY B 17  ? 0.534 0.484 0.393 0.028  0.143  -0.104 15  GLY BBB O   
1649 N N   . GLY B 18  ? 0.478 0.426 0.393 0.023  0.132  -0.108 16  GLY BBB N   
1650 C CA  . GLY B 18  ? 0.468 0.417 0.392 0.018  0.136  -0.093 16  GLY BBB CA  
1651 C C   . GLY B 18  ? 0.463 0.406 0.376 0.015  0.126  -0.081 16  GLY BBB C   
1652 O O   . GLY B 18  ? 0.446 0.385 0.345 0.016  0.116  -0.083 16  GLY BBB O   
1653 N N   . SER B 19  ? 0.460 0.404 0.383 0.010  0.129  -0.069 17  SER BBB N   
1654 C CA  . SER B 19  ? 0.470 0.410 0.385 0.007  0.121  -0.058 17  SER BBB CA  
1655 C C   . SER B 19  ? 0.436 0.377 0.377 0.004  0.115  -0.052 17  SER BBB C   
1656 O O   . SER B 19  ? 0.406 0.351 0.369 0.004  0.120  -0.054 17  SER BBB O   
1657 C CB  . SER B 19  ? 0.512 0.453 0.410 0.006  0.129  -0.049 17  SER BBB CB  
1658 O OG  . SER B 19  ? 0.553 0.493 0.424 0.010  0.134  -0.052 17  SER BBB OG  
1659 N N   . LEU B 20  ? 0.409 0.347 0.348 0.002  0.104  -0.046 18  LEU BBB N   
1660 C CA  . LEU B 20  ? 0.422 0.361 0.377 -0.000 0.097  -0.040 18  LEU BBB CA  
1661 C C   . LEU B 20  ? 0.434 0.372 0.377 -0.002 0.093  -0.032 18  LEU BBB C   
1662 O O   . LEU B 20  ? 0.432 0.365 0.354 -0.002 0.091  -0.032 18  LEU BBB O   
1663 C CB  . LEU B 20  ? 0.445 0.384 0.413 0.001  0.088  -0.042 18  LEU BBB CB  
1664 C CG  . LEU B 20  ? 0.485 0.426 0.475 0.003  0.090  -0.049 18  LEU BBB CG  
1665 C CD1 . LEU B 20  ? 0.489 0.429 0.491 0.004  0.080  -0.049 18  LEU BBB CD1 
1666 C CD2 . LEU B 20  ? 0.497 0.443 0.506 0.002  0.093  -0.046 18  LEU BBB CD2 
1667 N N   . THR B 21  ? 0.409 0.349 0.363 -0.004 0.090  -0.027 19  THR BBB N   
1668 C CA  . THR B 21  ? 0.393 0.332 0.340 -0.005 0.084  -0.020 19  THR BBB CA  
1669 C C   . THR B 21  ? 0.365 0.307 0.323 -0.004 0.075  -0.019 19  THR BBB C   
1670 O O   . THR B 21  ? 0.386 0.332 0.361 -0.003 0.074  -0.019 19  THR BBB O   
1671 C CB  . THR B 21  ? 0.410 0.351 0.361 -0.007 0.090  -0.016 19  THR BBB CB  
1672 O OG1 . THR B 21  ? 0.447 0.386 0.388 -0.007 0.101  -0.016 19  THR BBB OG1 
1673 C CG2 . THR B 21  ? 0.417 0.357 0.362 -0.008 0.084  -0.011 19  THR BBB CG2 
1674 N N   . LEU B 22  ? 0.347 0.287 0.295 -0.004 0.068  -0.017 20  LEU BBB N   
1675 C CA  . LEU B 22  ? 0.340 0.284 0.295 -0.003 0.059  -0.013 20  LEU BBB CA  
1676 C C   . LEU B 22  ? 0.331 0.276 0.281 -0.004 0.057  -0.010 20  LEU BBB C   
1677 O O   . LEU B 22  ? 0.334 0.276 0.273 -0.005 0.059  -0.009 20  LEU BBB O   
1678 C CB  . LEU B 22  ? 0.343 0.284 0.292 -0.002 0.055  -0.012 20  LEU BBB CB  
1679 C CG  . LEU B 22  ? 0.369 0.308 0.324 -0.002 0.057  -0.017 20  LEU BBB CG  
1680 C CD1 . LEU B 22  ? 0.382 0.319 0.338 -0.001 0.051  -0.015 20  LEU BBB CD1 
1681 C CD2 . LEU B 22  ? 0.397 0.339 0.370 -0.000 0.058  -0.018 20  LEU BBB CD2 
1682 N N   . SER B 23  ? 0.320 0.271 0.278 -0.002 0.051  -0.009 21  SER BBB N   
1683 C CA  . SER B 23  ? 0.329 0.283 0.285 -0.001 0.047  -0.008 21  SER BBB CA  
1684 C C   . SER B 23  ? 0.310 0.269 0.264 0.002  0.040  -0.006 21  SER BBB C   
1685 O O   . SER B 23  ? 0.296 0.257 0.253 0.004  0.039  -0.004 21  SER BBB O   
1686 C CB  . SER B 23  ? 0.377 0.335 0.348 -0.001 0.047  -0.011 21  SER BBB CB  
1687 O OG  . SER B 23  ? 0.439 0.402 0.422 0.003  0.043  -0.012 21  SER BBB OG  
1688 N N   . CYS B 24  ? 0.304 0.264 0.250 0.002  0.037  -0.006 22  CYS BBB N   
1689 C CA  . CYS B 24  ? 0.301 0.267 0.243 0.005  0.032  -0.004 22  CYS BBB CA  
1690 C C   . CYS B 24  ? 0.298 0.269 0.241 0.007  0.028  -0.007 22  CYS BBB C   
1691 O O   . CYS B 24  ? 0.311 0.279 0.252 0.004  0.028  -0.008 22  CYS BBB O   
1692 C CB  . CYS B 24  ? 0.306 0.270 0.240 0.004  0.033  -0.000 22  CYS BBB CB  
1693 S SG  . CYS B 24  ? 0.340 0.313 0.270 0.008  0.029  0.004  22  CYS BBB SG  
1694 N N   . VAL B 25  ? 0.293 0.272 0.239 0.011  0.023  -0.010 23  VAL BBB N   
1695 C CA  . VAL B 25  ? 0.301 0.287 0.250 0.015  0.017  -0.015 23  VAL BBB CA  
1696 C C   . VAL B 25  ? 0.297 0.291 0.235 0.019  0.014  -0.014 23  VAL BBB C   
1697 O O   . VAL B 25  ? 0.317 0.316 0.250 0.023  0.014  -0.009 23  VAL BBB O   
1698 C CB  . VAL B 25  ? 0.320 0.311 0.282 0.018  0.012  -0.021 23  VAL BBB CB  
1699 C CG1 . VAL B 25  ? 0.343 0.340 0.310 0.022  0.005  -0.029 23  VAL BBB CG1 
1700 C CG2 . VAL B 25  ? 0.343 0.326 0.318 0.013  0.016  -0.022 23  VAL BBB CG2 
1701 N N   . ALA B 26  ? 0.306 0.301 0.241 0.019  0.013  -0.016 24  ALA BBB N   
1702 C CA  . ALA B 26  ? 0.312 0.316 0.237 0.023  0.012  -0.016 24  ALA BBB CA  
1703 C C   . ALA B 26  ? 0.326 0.341 0.253 0.030  0.005  -0.024 24  ALA BBB C   
1704 O O   . ALA B 26  ? 0.324 0.337 0.262 0.029  0.001  -0.032 24  ALA BBB O   
1705 C CB  . ALA B 26  ? 0.319 0.319 0.243 0.020  0.014  -0.015 24  ALA BBB CB  
1706 N N   . SER B 27  ? 0.344 0.369 0.260 0.037  0.004  -0.022 25  SER BBB N   
1707 C CA  . SER B 27  ? 0.360 0.397 0.273 0.045  -0.003 -0.032 25  SER BBB CA  
1708 C C   . SER B 27  ? 0.355 0.401 0.253 0.049  0.000  -0.030 25  SER BBB C   
1709 O O   . SER B 27  ? 0.355 0.401 0.246 0.048  0.007  -0.018 25  SER BBB O   
1710 C CB  . SER B 27  ? 0.411 0.454 0.323 0.051  -0.009 -0.034 25  SER BBB CB  
1711 O OG  . SER B 27  ? 0.456 0.501 0.357 0.053  -0.005 -0.023 25  SER BBB OG  
1712 N N   . GLY B 28  ? 0.351 0.407 0.249 0.055  -0.004 -0.041 26  GLY BBB N   
1713 C CA  . GLY B 28  ? 0.354 0.422 0.240 0.060  -0.001 -0.041 26  GLY BBB CA  
1714 C C   . GLY B 28  ? 0.347 0.409 0.240 0.054  0.004  -0.040 26  GLY BBB C   
1715 O O   . GLY B 28  ? 0.366 0.436 0.252 0.057  0.008  -0.040 26  GLY BBB O   
1716 N N   . VAL B 29  ? 0.356 0.405 0.262 0.045  0.003  -0.040 27  VAL BBB N   
1717 C CA  . VAL B 29  ? 0.370 0.410 0.285 0.039  0.006  -0.039 27  VAL BBB CA  
1718 C C   . VAL B 29  ? 0.359 0.388 0.288 0.034  0.001  -0.044 27  VAL BBB C   
1719 O O   . VAL B 29  ? 0.366 0.391 0.298 0.033  -0.001 -0.043 27  VAL BBB O   
1720 C CB  . VAL B 29  ? 0.382 0.415 0.293 0.034  0.013  -0.027 27  VAL BBB CB  
1721 C CG1 . VAL B 29  ? 0.420 0.443 0.332 0.029  0.015  -0.020 27  VAL BBB CG1 
1722 C CG2 . VAL B 29  ? 0.389 0.415 0.308 0.028  0.014  -0.027 27  VAL BBB CG2 
1723 N N   . THR B 30  ? 0.318 0.344 0.258 0.031  -0.002 -0.049 28  THR BBB N   
1724 C CA  . THR B 30  ? 0.310 0.326 0.265 0.026  -0.005 -0.051 28  THR BBB CA  
1725 C C   . THR B 30  ? 0.288 0.291 0.242 0.018  -0.001 -0.042 28  THR BBB C   
1726 O O   . THR B 30  ? 0.289 0.293 0.241 0.018  0.000  -0.041 28  THR BBB O   
1727 C CB  . THR B 30  ? 0.314 0.335 0.285 0.029  -0.012 -0.063 28  THR BBB CB  
1728 O OG1 . THR B 30  ? 0.332 0.366 0.302 0.037  -0.018 -0.074 28  THR BBB OG1 
1729 C CG2 . THR B 30  ? 0.321 0.332 0.311 0.024  -0.016 -0.064 28  THR BBB CG2 
1730 N N   . LEU B 31  ? 0.287 0.281 0.241 0.014  0.001  -0.036 29  LEU BBB N   
1731 C CA  . LEU B 31  ? 0.282 0.263 0.232 0.008  0.005  -0.028 29  LEU BBB CA  
1732 C C   . LEU B 31  ? 0.270 0.247 0.231 0.005  0.000  -0.030 29  LEU BBB C   
1733 O O   . LEU B 31  ? 0.270 0.251 0.246 0.007  -0.004 -0.037 29  LEU BBB O   
1734 C CB  . LEU B 31  ? 0.296 0.270 0.245 0.004  0.008  -0.022 29  LEU BBB CB  
1735 C CG  . LEU B 31  ? 0.321 0.296 0.261 0.005  0.012  -0.019 29  LEU BBB CG  
1736 C CD1 . LEU B 31  ? 0.330 0.297 0.268 0.002  0.017  -0.014 29  LEU BBB CD1 
1737 C CD2 . LEU B 31  ? 0.318 0.296 0.248 0.006  0.014  -0.016 29  LEU BBB CD2 
1738 N N   . GLY B 32  ? 0.259 0.230 0.216 0.002  0.001  -0.026 30  GLY BBB N   
1739 C CA  . GLY B 32  ? 0.260 0.225 0.227 0.000  -0.004 -0.026 30  GLY BBB CA  
1740 C C   . GLY B 32  ? 0.251 0.218 0.216 0.001  -0.005 -0.027 30  GLY BBB C   
1741 O O   . GLY B 32  ? 0.262 0.224 0.236 -0.001 -0.010 -0.027 30  GLY BBB O   
1742 N N   . ARG B 33  ? 0.253 0.226 0.210 0.003  -0.001 -0.027 31  ARG BBB N   
1743 C CA  . ARG B 33  ? 0.259 0.233 0.218 0.003  -0.001 -0.026 31  ARG BBB CA  
1744 C C   . ARG B 33  ? 0.275 0.244 0.223 0.001  0.003  -0.020 31  ARG BBB C   
1745 O O   . ARG B 33  ? 0.302 0.265 0.252 -0.002 0.001  -0.017 31  ARG BBB O   
1746 C CB  . ARG B 33  ? 0.259 0.246 0.223 0.008  -0.000 -0.033 31  ARG BBB CB  
1747 C CG  . ARG B 33  ? 0.255 0.244 0.224 0.007  0.001  -0.032 31  ARG BBB CG  
1748 C CD  . ARG B 33  ? 0.257 0.235 0.235 0.003  -0.005 -0.032 31  ARG BBB CD  
1749 N NE  . ARG B 33  ? 0.265 0.245 0.250 0.003  -0.004 -0.031 31  ARG BBB NE  
1750 C CZ  . ARG B 33  ? 0.276 0.248 0.270 0.001  -0.010 -0.031 31  ARG BBB CZ  
1751 N NH1 . ARG B 33  ? 0.282 0.244 0.278 -0.002 -0.017 -0.031 31  ARG BBB NH1 
1752 N NH2 . ARG B 33  ? 0.264 0.238 0.268 0.001  -0.009 -0.031 31  ARG BBB NH2 
1753 N N   . HIS B 34  ? 0.276 0.250 0.217 0.003  0.008  -0.017 32  HIS BBB N   
1754 C CA  . HIS B 34  ? 0.276 0.248 0.212 0.002  0.012  -0.011 32  HIS BBB CA  
1755 C C   . HIS B 34  ? 0.267 0.228 0.197 -0.002 0.012  -0.007 32  HIS BBB C   
1756 O O   . HIS B 34  ? 0.270 0.226 0.196 -0.003 0.011  -0.008 32  HIS BBB O   
1757 C CB  . HIS B 34  ? 0.285 0.268 0.218 0.006  0.017  -0.010 32  HIS BBB CB  
1758 C CG  . HIS B 34  ? 0.289 0.284 0.225 0.011  0.018  -0.014 32  HIS BBB CG  
1759 N ND1 . HIS B 34  ? 0.302 0.307 0.237 0.015  0.016  -0.020 32  HIS BBB ND1 
1760 C CD2 . HIS B 34  ? 0.320 0.321 0.263 0.012  0.020  -0.015 32  HIS BBB CD2 
1761 C CE1 . HIS B 34  ? 0.318 0.334 0.256 0.019  0.017  -0.025 32  HIS BBB CE1 
1762 N NE2 . HIS B 34  ? 0.340 0.354 0.283 0.017  0.020  -0.022 32  HIS BBB NE2 
1763 N N   . ALA B 35  ? 0.280 0.237 0.211 -0.003 0.013  -0.004 33  ALA BBB N   
1764 C CA  . ALA B 35  ? 0.298 0.247 0.224 -0.005 0.013  -0.002 33  ALA BBB CA  
1765 C C   . ALA B 35  ? 0.287 0.241 0.211 -0.003 0.018  0.001  33  ALA BBB C   
1766 O O   . ALA B 35  ? 0.300 0.263 0.228 -0.001 0.022  0.003  33  ALA BBB O   
1767 C CB  . ALA B 35  ? 0.303 0.248 0.235 -0.006 0.012  -0.001 33  ALA BBB CB  
1768 N N   . ILE B 36  ? 0.287 0.235 0.204 -0.004 0.019  0.000  34  ILE BBB N   
1769 C CA  . ILE B 36  ? 0.300 0.251 0.217 -0.003 0.023  0.002  34  ILE BBB CA  
1770 C C   . ILE B 36  ? 0.317 0.259 0.229 -0.005 0.024  0.001  34  ILE BBB C   
1771 O O   . ILE B 36  ? 0.318 0.254 0.224 -0.007 0.022  -0.001 34  ILE BBB O   
1772 C CB  . ILE B 36  ? 0.318 0.275 0.234 -0.001 0.024  0.000  34  ILE BBB CB  
1773 C CG1 . ILE B 36  ? 0.327 0.288 0.244 0.001  0.027  0.002  34  ILE BBB CG1 
1774 C CG2 . ILE B 36  ? 0.323 0.274 0.236 -0.004 0.023  -0.002 34  ILE BBB CG2 
1775 C CD1 . ILE B 36  ? 0.332 0.300 0.250 0.003  0.025  -0.001 34  ILE BBB CD1 
1776 N N   . GLY B 37  ? 0.330 0.274 0.247 -0.004 0.026  0.003  35  GLY BBB N   
1777 C CA  . GLY B 37  ? 0.327 0.263 0.242 -0.005 0.027  0.001  35  GLY BBB CA  
1778 C C   . GLY B 37  ? 0.334 0.273 0.258 -0.004 0.030  0.002  35  GLY BBB C   
1779 O O   . GLY B 37  ? 0.301 0.247 0.229 -0.002 0.032  0.006  35  GLY BBB O   
1780 N N   . TRP B 38  ? 0.325 0.258 0.250 -0.005 0.029  -0.001 36  TRP BBB N   
1781 C CA  A TRP B 38  ? 0.322 0.256 0.258 -0.004 0.032  -0.001 36  TRP BBB CA  
1782 C CA  B TRP B 38  ? 0.319 0.253 0.255 -0.004 0.032  -0.001 36  TRP BBB CA  
1783 C C   . TRP B 38  ? 0.314 0.245 0.263 -0.004 0.029  -0.002 36  TRP BBB C   
1784 O O   . TRP B 38  ? 0.313 0.238 0.258 -0.004 0.025  -0.007 36  TRP BBB O   
1785 C CB  A TRP B 38  ? 0.337 0.268 0.267 -0.004 0.034  -0.006 36  TRP BBB CB  
1786 C CB  B TRP B 38  ? 0.329 0.260 0.260 -0.004 0.035  -0.006 36  TRP BBB CB  
1787 C CG  A TRP B 38  ? 0.336 0.270 0.259 -0.004 0.037  -0.005 36  TRP BBB CG  
1788 C CG  B TRP B 38  ? 0.324 0.260 0.255 -0.003 0.038  -0.004 36  TRP BBB CG  
1789 C CD1 A TRP B 38  ? 0.338 0.270 0.250 -0.005 0.038  -0.006 36  TRP BBB CD1 
1790 C CD1 B TRP B 38  ? 0.318 0.258 0.261 -0.002 0.039  -0.001 36  TRP BBB CD1 
1791 C CD2 A TRP B 38  ? 0.338 0.277 0.268 -0.003 0.040  -0.003 36  TRP BBB CD2 
1792 C CD2 B TRP B 38  ? 0.318 0.255 0.241 -0.004 0.040  -0.004 36  TRP BBB CD2 
1793 N NE1 A TRP B 38  ? 0.345 0.281 0.258 -0.005 0.040  -0.005 36  TRP BBB NE1 
1794 N NE1 B TRP B 38  ? 0.322 0.266 0.264 -0.001 0.041  -0.001 36  TRP BBB NE1 
1795 C CE2 A TRP B 38  ? 0.344 0.284 0.268 -0.004 0.041  -0.004 36  TRP BBB CE2 
1796 C CE2 B TRP B 38  ? 0.314 0.256 0.245 -0.002 0.041  -0.003 36  TRP BBB CE2 
1797 C CE3 A TRP B 38  ? 0.337 0.280 0.279 -0.001 0.040  -0.000 36  TRP BBB CE3 
1798 C CE3 B TRP B 38  ? 0.319 0.253 0.231 -0.005 0.039  -0.005 36  TRP BBB CE3 
1799 C CZ2 A TRP B 38  ? 0.351 0.296 0.281 -0.002 0.042  -0.003 36  TRP BBB CZ2 
1800 C CZ2 B TRP B 38  ? 0.323 0.268 0.253 -0.003 0.043  -0.003 36  TRP BBB CZ2 
1801 C CZ3 A TRP B 38  ? 0.340 0.288 0.286 0.000  0.041  0.001  36  TRP BBB CZ3 
1802 C CZ3 B TRP B 38  ? 0.317 0.254 0.229 -0.006 0.041  -0.004 36  TRP BBB CZ3 
1803 C CH2 A TRP B 38  ? 0.334 0.282 0.275 -0.000 0.042  -0.002 36  TRP BBB CH2 
1804 C CH2 B TRP B 38  ? 0.310 0.252 0.232 -0.004 0.043  -0.004 36  TRP BBB CH2 
1805 N N   . PHE B 39  ? 0.296 0.250 0.233 -0.004 0.018  -0.015 37  PHE BBB N   
1806 C CA  . PHE B 39  ? 0.293 0.252 0.236 -0.004 0.023  -0.016 37  PHE BBB CA  
1807 C C   . PHE B 39  ? 0.290 0.249 0.244 -0.005 0.018  -0.015 37  PHE BBB C   
1808 O O   . PHE B 39  ? 0.300 0.253 0.262 -0.005 0.010  -0.013 37  PHE BBB O   
1809 C CB  . PHE B 39  ? 0.321 0.263 0.250 -0.003 0.031  -0.013 37  PHE BBB CB  
1810 C CG  . PHE B 39  ? 0.340 0.285 0.276 -0.002 0.043  -0.012 37  PHE BBB CG  
1811 C CD1 . PHE B 39  ? 0.365 0.305 0.291 0.000  0.044  -0.011 37  PHE BBB CD1 
1812 C CD2 . PHE B 39  ? 0.340 0.291 0.303 -0.002 0.052  -0.010 37  PHE BBB CD2 
1813 C CE1 . PHE B 39  ? 0.382 0.323 0.323 0.002  0.056  -0.009 37  PHE BBB CE1 
1814 C CE2 . PHE B 39  ? 0.357 0.311 0.344 -0.001 0.062  -0.007 37  PHE BBB CE2 
1815 C CZ  . PHE B 39  ? 0.361 0.311 0.338 0.002  0.065  -0.007 37  PHE BBB CZ  
1816 N N   . ARG B 40  ? 0.294 0.257 0.254 -0.006 0.022  -0.017 38  ARG BBB N   
1817 C CA  . ARG B 40  ? 0.305 0.267 0.278 -0.006 0.019  -0.016 38  ARG BBB CA  
1818 C C   . ARG B 40  ? 0.304 0.265 0.276 -0.007 0.021  -0.017 38  ARG BBB C   
1819 O O   . ARG B 40  ? 0.311 0.274 0.281 -0.008 0.024  -0.019 38  ARG BBB O   
1820 C CB  . ARG B 40  ? 0.291 0.257 0.276 -0.004 0.028  -0.017 38  ARG BBB CB  
1821 C CG  . ARG B 40  ? 0.330 0.290 0.297 -0.002 0.033  -0.022 38  ARG BBB CG  
1822 C CD  . ARG B 40  ? 0.366 0.312 0.327 0.004  0.047  -0.022 38  ARG BBB CD  
1823 N NE  . ARG B 40  ? 0.418 0.342 0.343 0.008  0.047  -0.027 38  ARG BBB NE  
1824 C CZ  . ARG B 40  ? 0.465 0.359 0.362 0.016  0.063  -0.027 38  ARG BBB CZ  
1825 N NH1 . ARG B 40  ? 0.424 0.315 0.339 0.020  0.086  -0.021 38  ARG BBB NH1 
1826 N NH2 . ARG B 40  ? 0.543 0.403 0.393 0.021  0.055  -0.033 38  ARG BBB NH2 
1827 N N   . GLN B 41  ? 0.298 0.253 0.276 -0.008 0.016  -0.016 39  GLN BBB N   
1828 C CA  . GLN B 41  ? 0.304 0.256 0.283 -0.009 0.017  -0.016 39  GLN BBB CA  
1829 C C   . GLN B 41  ? 0.297 0.253 0.296 -0.008 0.016  -0.017 39  GLN BBB C   
1830 O O   . GLN B 41  ? 0.301 0.250 0.313 -0.008 0.007  -0.014 39  GLN BBB O   
1831 C CB  . GLN B 41  ? 0.353 0.284 0.312 -0.008 0.014  -0.012 39  GLN BBB CB  
1832 C CG  . GLN B 41  ? 0.387 0.315 0.350 -0.009 0.019  -0.011 39  GLN BBB CG  
1833 C CD  . GLN B 41  ? 0.456 0.355 0.389 -0.007 0.025  -0.005 39  GLN BBB CD  
1834 O OE1 . GLN B 41  ? 0.550 0.421 0.450 -0.004 0.019  -0.003 39  GLN BBB OE1 
1835 N NE2 . GLN B 41  ? 0.475 0.371 0.416 -0.007 0.037  -0.002 39  GLN BBB NE2 
1836 N N   . ALA B 42  ? 0.306 0.264 0.305 -0.007 0.023  -0.021 40  ALA BBB N   
1837 C CA  . ALA B 42  ? 0.318 0.271 0.328 -0.004 0.029  -0.023 40  ALA BBB CA  
1838 C C   . ALA B 42  ? 0.328 0.280 0.343 -0.006 0.023  -0.023 40  ALA BBB C   
1839 O O   . ALA B 42  ? 0.316 0.269 0.324 -0.009 0.019  -0.022 40  ALA BBB O   
1840 C CB  . ALA B 42  ? 0.346 0.288 0.336 0.001  0.038  -0.028 40  ALA BBB CB  
1841 N N   . PRO B 43  ? 0.342 0.291 0.375 -0.005 0.025  -0.022 41  PRO BBB N   
1842 C CA  . PRO B 43  ? 0.352 0.299 0.389 -0.007 0.019  -0.022 41  PRO BBB CA  
1843 C C   . PRO B 43  ? 0.368 0.311 0.391 -0.007 0.019  -0.027 41  PRO BBB C   
1844 O O   . PRO B 43  ? 0.341 0.276 0.350 -0.003 0.022  -0.032 41  PRO BBB O   
1845 C CB  . PRO B 43  ? 0.362 0.305 0.424 -0.003 0.026  -0.022 41  PRO BBB CB  
1846 C CG  . PRO B 43  ? 0.353 0.300 0.439 -0.002 0.030  -0.017 41  PRO BBB CG  
1847 C CD  . PRO B 43  ? 0.341 0.289 0.400 -0.001 0.035  -0.020 41  PRO BBB CD  
1848 N N   . GLY B 44  ? 0.349 0.294 0.375 -0.011 0.014  -0.024 42  GLY BBB N   
1849 C CA  . GLY B 44  ? 0.394 0.337 0.427 -0.012 0.010  -0.027 42  GLY BBB CA  
1850 C C   . GLY B 44  ? 0.380 0.324 0.414 -0.012 0.007  -0.028 42  GLY BBB C   
1851 O O   . GLY B 44  ? 0.369 0.309 0.419 -0.013 -0.003 -0.031 42  GLY BBB O   
1852 N N   . LYS B 45  ? 0.378 0.328 0.402 -0.012 0.011  -0.027 43  LYS BBB N   
1853 C CA  . LYS B 45  ? 0.408 0.359 0.435 -0.012 0.007  -0.028 43  LYS BBB CA  
1854 C C   . LYS B 45  ? 0.376 0.333 0.407 -0.013 0.019  -0.020 43  LYS BBB C   
1855 O O   . LYS B 45  ? 0.365 0.318 0.379 -0.013 0.025  -0.017 43  LYS BBB O   
1856 C CB  . LYS B 45  ? 0.447 0.390 0.448 -0.008 0.004  -0.033 43  LYS BBB CB  
1857 C CG  . LYS B 45  ? 0.526 0.447 0.505 -0.003 -0.001 -0.040 43  LYS BBB CG  
1858 C CD  . LYS B 45  ? 0.607 0.507 0.550 0.003  0.001  -0.044 43  LYS BBB CD  
1859 C CE  . LYS B 45  ? 0.664 0.553 0.599 0.003  -0.016 -0.047 43  LYS BBB CE  
1860 N NZ  . LYS B 45  ? 0.720 0.569 0.601 0.011  -0.018 -0.052 43  LYS BBB NZ  
1861 N N   . GLU B 46  ? 0.371 0.332 0.427 -0.014 0.020  -0.018 44  GLU BBB N   
1862 C CA  . GLU B 46  ? 0.383 0.342 0.440 -0.013 0.036  -0.011 44  GLU BBB CA  
1863 C C   . GLU B 46  ? 0.350 0.311 0.378 -0.012 0.033  -0.014 44  GLU BBB C   
1864 O O   . GLU B 46  ? 0.345 0.310 0.367 -0.011 0.021  -0.020 44  GLU BBB O   
1865 C CB  . GLU B 46  ? 0.413 0.377 0.519 -0.014 0.038  -0.007 44  GLU BBB CB  
1866 C CG  . GLU B 46  ? 0.450 0.412 0.597 -0.016 0.048  -0.001 44  GLU BBB CG  
1867 C CD  . GLU B 46  ? 0.494 0.460 0.709 -0.016 0.056  0.007  44  GLU BBB CD  
1868 O OE1 . GLU B 46  ? 0.554 0.510 0.779 -0.013 0.089  0.018  44  GLU BBB OE1 
1869 O OE2 . GLU B 46  ? 0.541 0.513 0.796 -0.019 0.029  0.002  44  GLU BBB OE2 
1870 N N   . ARG B 47  ? 0.356 0.307 0.364 -0.010 0.045  -0.009 45  ARG BBB N   
1871 C CA  . ARG B 47  ? 0.360 0.311 0.347 -0.008 0.043  -0.011 45  ARG BBB CA  
1872 C C   . ARG B 47  ? 0.340 0.303 0.348 -0.009 0.039  -0.013 45  ARG BBB C   
1873 O O   . ARG B 47  ? 0.331 0.297 0.373 -0.009 0.044  -0.010 45  ARG BBB O   
1874 C CB  . ARG B 47  ? 0.416 0.343 0.373 -0.005 0.055  -0.005 45  ARG BBB CB  
1875 C CG  . ARG B 47  ? 0.444 0.366 0.377 -0.003 0.046  -0.007 45  ARG BBB CG  
1876 C CD  . ARG B 47  ? 0.530 0.413 0.417 0.002  0.052  -0.003 45  ARG BBB CD  
1877 N NE  . ARG B 47  ? 0.637 0.490 0.496 0.003  0.047  -0.000 45  ARG BBB NE  
1878 C CZ  . ARG B 47  ? 0.688 0.491 0.491 0.009  0.042  0.002  45  ARG BBB CZ  
1879 N NH1 . ARG B 47  ? 0.674 0.449 0.441 0.014  0.044  0.003  45  ARG BBB NH1 
1880 N NH2 . ARG B 47  ? 0.723 0.497 0.501 0.010  0.033  0.004  45  ARG BBB NH2 
1881 N N   . GLU B 48  ? 0.325 0.294 0.321 -0.008 0.029  -0.018 46  GLU BBB N   
1882 C CA  . GLU B 48  ? 0.325 0.296 0.331 -0.008 0.020  -0.021 46  GLU BBB CA  
1883 C C   . GLU B 48  ? 0.305 0.277 0.291 -0.006 0.021  -0.021 46  GLU BBB C   
1884 O O   . GLU B 48  ? 0.289 0.260 0.257 -0.006 0.024  -0.021 46  GLU BBB O   
1885 C CB  . GLU B 48  ? 0.370 0.333 0.369 -0.007 0.004  -0.027 46  GLU BBB CB  
1886 C CG  . GLU B 48  ? 0.418 0.373 0.386 -0.005 0.009  -0.029 46  GLU BBB CG  
1887 C CD  . GLU B 48  ? 0.535 0.467 0.480 -0.001 0.000  -0.035 46  GLU BBB CD  
1888 O OE1 . GLU B 48  ? 0.592 0.513 0.544 -0.001 -0.017 -0.039 46  GLU BBB OE1 
1889 O OE2 . GLU B 48  ? 0.565 0.487 0.488 0.003  0.011  -0.036 46  GLU BBB OE2 
1890 N N   . ARG B 49  ? 0.306 0.280 0.303 -0.006 0.016  -0.022 47  ARG BBB N   
1891 C CA  . ARG B 49  ? 0.328 0.301 0.308 -0.004 0.015  -0.022 47  ARG BBB CA  
1892 C C   . ARG B 49  ? 0.322 0.285 0.274 -0.002 0.012  -0.026 47  ARG BBB C   
1893 O O   . ARG B 49  ? 0.325 0.274 0.267 -0.001 0.004  -0.029 47  ARG BBB O   
1894 C CB  . ARG B 49  ? 0.360 0.333 0.359 -0.004 0.006  -0.023 47  ARG BBB CB  
1895 C CG  . ARG B 49  ? 0.406 0.385 0.441 -0.004 0.019  -0.017 47  ARG BBB CG  
1896 C CD  . ARG B 49  ? 0.456 0.437 0.528 -0.004 0.008  -0.016 47  ARG BBB CD  
1897 N NE  . ARG B 49  ? 0.490 0.475 0.597 -0.003 0.030  -0.009 47  ARG BBB NE  
1898 C CZ  . ARG B 49  ? 0.503 0.484 0.588 0.000  0.047  -0.007 47  ARG BBB CZ  
1899 N NH1 . ARG B 49  ? 0.529 0.508 0.567 0.000  0.040  -0.011 47  ARG BBB NH1 
1900 N NH2 . ARG B 49  ? 0.493 0.469 0.605 0.004  0.072  0.000  47  ARG BBB NH2 
1901 N N   . VAL B 50  ? 0.310 0.274 0.252 -0.001 0.019  -0.023 48  VAL BBB N   
1902 C CA  . VAL B 50  ? 0.320 0.272 0.243 0.002  0.025  -0.023 48  VAL BBB CA  
1903 C C   . VAL B 50  ? 0.348 0.294 0.259 0.004  0.024  -0.023 48  VAL BBB C   
1904 O O   . VAL B 50  ? 0.364 0.286 0.246 0.009  0.021  -0.025 48  VAL BBB O   
1905 C CB  . VAL B 50  ? 0.314 0.272 0.252 0.002  0.035  -0.019 48  VAL BBB CB  
1906 C CG1 . VAL B 50  ? 0.343 0.290 0.278 0.006  0.049  -0.016 48  VAL BBB CG1 
1907 C CG2 . VAL B 50  ? 0.315 0.276 0.263 0.000  0.034  -0.020 48  VAL BBB CG2 
1908 N N   . SER B 51  ? 0.315 0.275 0.239 0.002  0.024  -0.020 49  SER BBB N   
1909 C CA  . SER B 51  ? 0.333 0.289 0.249 0.003  0.024  -0.019 49  SER BBB CA  
1910 C C   . SER B 51  ? 0.330 0.298 0.260 0.001  0.022  -0.017 49  SER BBB C   
1911 O O   . SER B 51  ? 0.320 0.292 0.257 -0.001 0.023  -0.016 49  SER BBB O   
1912 C CB  . SER B 51  ? 0.354 0.301 0.266 0.006  0.037  -0.015 49  SER BBB CB  
1913 O OG  . SER B 51  ? 0.416 0.356 0.316 0.008  0.038  -0.013 49  SER BBB OG  
1914 N N   . CYS B 52  ? 0.310 0.277 0.237 0.002  0.018  -0.018 50  CYS BBB N   
1915 C CA  . CYS B 52  ? 0.296 0.269 0.231 0.001  0.019  -0.016 50  CYS BBB CA  
1916 C C   . CYS B 52  ? 0.290 0.260 0.220 0.003  0.017  -0.015 50  CYS BBB C   
1917 O O   . CYS B 52  ? 0.297 0.259 0.216 0.004  0.013  -0.016 50  CYS BBB O   
1918 C CB  . CYS B 52  ? 0.311 0.285 0.262 0.002  0.020  -0.017 50  CYS BBB CB  
1919 S SG  . CYS B 52  ? 0.370 0.338 0.322 0.004  0.032  -0.014 50  CYS BBB SG  
1920 N N   . ILE B 53  ? 0.284 0.253 0.214 0.003  0.018  -0.014 51  ILE BBB N   
1921 C CA  . ILE B 53  ? 0.281 0.249 0.210 0.004  0.016  -0.013 51  ILE BBB CA  
1922 C C   . ILE B 53  ? 0.289 0.253 0.217 0.005  0.018  -0.014 51  ILE BBB C   
1923 O O   . ILE B 53  ? 0.302 0.254 0.219 0.007  0.021  -0.014 51  ILE BBB O   
1924 C CB  . ILE B 53  ? 0.291 0.257 0.223 0.003  0.016  -0.009 51  ILE BBB CB  
1925 C CG1 . ILE B 53  ? 0.300 0.264 0.232 0.004  0.015  -0.007 51  ILE BBB CG1 
1926 C CG2 . ILE B 53  ? 0.294 0.254 0.231 0.002  0.008  -0.009 51  ILE BBB CG2 
1927 C CD1 . ILE B 53  ? 0.312 0.273 0.258 0.004  0.020  -0.002 51  ILE BBB CD1 
1928 N N   . ARG B 54  ? 0.276 0.242 0.213 0.007  0.017  -0.013 52  ARG BBB N   
1929 C CA  . ARG B 54  ? 0.282 0.242 0.222 0.010  0.024  -0.013 52  ARG BBB CA  
1930 C C   . ARG B 54  ? 0.287 0.238 0.210 0.010  0.019  -0.013 52  ARG BBB C   
1931 O O   . ARG B 54  ? 0.273 0.231 0.202 0.009  0.012  -0.012 52  ARG BBB O   
1932 C CB  . ARG B 54  ? 0.292 0.259 0.261 0.010  0.021  -0.013 52  ARG BBB CB  
1933 C CG  . ARG B 54  ? 0.303 0.276 0.300 0.009  0.020  -0.012 52  ARG BBB CG  
1934 C CD  . ARG B 54  ? 0.345 0.321 0.372 0.009  0.001  -0.012 52  ARG BBB CD  
1935 N NE  . ARG B 54  ? 0.348 0.323 0.395 0.011  0.006  -0.010 52  ARG BBB NE  
1936 C CZ  . ARG B 54  ? 0.392 0.370 0.487 0.014  0.019  -0.007 52  ARG BBB CZ  
1937 N NH1 . ARG B 54  ? 0.400 0.381 0.533 0.014  0.028  -0.004 52  ARG BBB NH1 
1938 N NH2 . ARG B 54  ? 0.442 0.418 0.552 0.017  0.025  -0.005 52  ARG BBB NH2 
1939 N N   . THR B 55  ? 0.267 0.225 0.164 -0.021 0.008  -0.015 53  THR BBB N   
1940 C CA  . THR B 55  ? 0.274 0.232 0.173 -0.020 0.009  -0.013 53  THR BBB CA  
1941 C C   . THR B 55  ? 0.270 0.229 0.171 -0.019 0.005  -0.012 53  THR BBB C   
1942 O O   . THR B 55  ? 0.281 0.239 0.185 -0.019 0.006  -0.010 53  THR BBB O   
1943 C CB  . THR B 55  ? 0.271 0.232 0.177 -0.018 0.011  -0.014 53  THR BBB CB  
1944 O OG1 . THR B 55  ? 0.272 0.236 0.180 -0.016 0.009  -0.014 53  THR BBB OG1 
1945 C CG2 . THR B 55  ? 0.283 0.242 0.186 -0.018 0.015  -0.015 53  THR BBB CG2 
1946 N N   . PHE B 56  ? 0.263 0.224 0.165 -0.019 0.000  -0.013 54  PHE BBB N   
1947 C CA  . PHE B 56  ? 0.271 0.232 0.174 -0.018 -0.005 -0.013 54  PHE BBB CA  
1948 C C   . PHE B 56  ? 0.294 0.247 0.185 -0.017 -0.007 -0.011 54  PHE BBB C   
1949 O O   . PHE B 56  ? 0.294 0.245 0.185 -0.016 -0.008 -0.009 54  PHE BBB O   
1950 C CB  . PHE B 56  ? 0.268 0.234 0.180 -0.018 -0.008 -0.016 54  PHE BBB CB  
1951 C CG  . PHE B 56  ? 0.277 0.245 0.192 -0.016 -0.013 -0.016 54  PHE BBB CG  
1952 C CD1 . PHE B 56  ? 0.282 0.252 0.202 -0.015 -0.012 -0.014 54  PHE BBB CD1 
1953 C CD2 . PHE B 56  ? 0.311 0.277 0.225 -0.015 -0.020 -0.019 54  PHE BBB CD2 
1954 C CE1 . PHE B 56  ? 0.286 0.259 0.210 -0.014 -0.017 -0.015 54  PHE BBB CE1 
1955 C CE2 . PHE B 56  ? 0.322 0.289 0.240 -0.013 -0.025 -0.019 54  PHE BBB CE2 
1956 C CZ  . PHE B 56  ? 0.305 0.276 0.229 -0.013 -0.023 -0.017 54  PHE BBB CZ  
1957 N N   . ASP B 57  ? 0.307 0.254 0.188 -0.016 -0.007 -0.012 55  ASP BBB N   
1958 C CA  . ASP B 57  ? 0.343 0.280 0.207 -0.013 -0.010 -0.011 55  ASP BBB CA  
1959 C C   . ASP B 57  ? 0.344 0.272 0.194 -0.012 -0.004 -0.009 55  ASP BBB C   
1960 O O   . ASP B 57  ? 0.355 0.271 0.186 -0.007 -0.005 -0.008 55  ASP BBB O   
1961 C CB  . ASP B 57  ? 0.367 0.304 0.230 -0.010 -0.020 -0.016 55  ASP BBB CB  
1962 C CG  . ASP B 57  ? 0.383 0.324 0.253 -0.011 -0.023 -0.022 55  ASP BBB CG  
1963 O OD1 . ASP B 57  ? 0.365 0.306 0.233 -0.013 -0.017 -0.022 55  ASP BBB OD1 
1964 O OD2 . ASP B 57  ? 0.438 0.383 0.316 -0.009 -0.032 -0.028 55  ASP BBB OD2 
1965 N N   . GLY B 58  ? 0.320 0.252 0.177 -0.015 0.003  -0.009 56  GLY BBB N   
1966 C CA  . GLY B 58  ? 0.355 0.279 0.200 -0.014 0.010  -0.007 56  GLY BBB CA  
1967 C C   . GLY B 58  ? 0.371 0.290 0.204 -0.012 0.006  -0.011 56  GLY BBB C   
1968 O O   . GLY B 58  ? 0.380 0.292 0.202 -0.010 0.013  -0.010 56  GLY BBB O   
1969 N N   . ILE B 59  ? 0.379 0.302 0.215 -0.010 -0.003 -0.017 57  ILE BBB N   
1970 C CA  . ILE B 59  ? 0.404 0.322 0.230 -0.007 -0.010 -0.022 57  ILE BBB CA  
1971 C C   . ILE B 59  ? 0.379 0.302 0.214 -0.010 -0.006 -0.025 57  ILE BBB C   
1972 O O   . ILE B 59  ? 0.348 0.281 0.202 -0.015 -0.004 -0.026 57  ILE BBB O   
1973 C CB  . ILE B 59  ? 0.427 0.348 0.259 -0.004 -0.022 -0.029 57  ILE BBB CB  
1974 C CG1 . ILE B 59  ? 0.477 0.389 0.295 0.002  -0.028 -0.027 57  ILE BBB CG1 
1975 C CG2 . ILE B 59  ? 0.441 0.359 0.271 -0.001 -0.030 -0.038 57  ILE BBB CG2 
1976 C CD1 . ILE B 59  ? 0.520 0.436 0.346 0.005  -0.041 -0.034 57  ILE BBB CD1 
1977 N N   . THR B 60  ? 0.393 0.308 0.214 -0.008 -0.003 -0.026 58  THR BBB N   
1978 C CA  . THR B 60  ? 0.378 0.296 0.205 -0.011 0.002  -0.028 58  THR BBB CA  
1979 C C   . THR B 60  ? 0.413 0.330 0.240 -0.008 -0.007 -0.036 58  THR BBB C   
1980 O O   . THR B 60  ? 0.433 0.343 0.248 -0.002 -0.017 -0.041 58  THR BBB O   
1981 C CB  . THR B 60  ? 0.392 0.302 0.205 -0.009 0.012  -0.023 58  THR BBB CB  
1982 O OG1 . THR B 60  ? 0.423 0.320 0.212 -0.002 0.009  -0.024 58  THR BBB OG1 
1983 C CG2 . THR B 60  ? 0.398 0.310 0.217 -0.012 0.020  -0.017 58  THR BBB CG2 
1984 N N   . SER B 61  ? 0.413 0.336 0.254 -0.012 -0.005 -0.039 59  SER BBB N   
1985 C CA  . SER B 61  ? 0.431 0.354 0.278 -0.011 -0.012 -0.048 59  SER BBB CA  
1986 C C   . SER B 61  ? 0.417 0.339 0.265 -0.013 -0.005 -0.048 59  SER BBB C   
1987 O O   . SER B 61  ? 0.369 0.294 0.220 -0.017 0.004  -0.042 59  SER BBB O   
1988 C CB  . SER B 61  ? 0.453 0.384 0.324 -0.014 -0.017 -0.052 59  SER BBB CB  
1989 O OG  . SER B 61  ? 0.477 0.415 0.363 -0.020 -0.007 -0.047 59  SER BBB OG  
1990 N N   . TYR B 62  ? 0.408 0.325 0.250 -0.009 -0.011 -0.055 60  TYR BBB N   
1991 C CA  . TYR B 62  ? 0.422 0.337 0.262 -0.010 -0.006 -0.056 60  TYR BBB CA  
1992 C C   . TYR B 62  ? 0.445 0.361 0.300 -0.010 -0.014 -0.067 60  TYR BBB C   
1993 O O   . TYR B 62  ? 0.482 0.399 0.344 -0.007 -0.025 -0.074 60  TYR BBB O   
1994 C CB  . TYR B 62  ? 0.442 0.345 0.254 -0.004 -0.003 -0.054 60  TYR BBB CB  
1995 C CG  . TYR B 62  ? 0.429 0.331 0.232 -0.005 0.007  -0.045 60  TYR BBB CG  
1996 C CD1 . TYR B 62  ? 0.426 0.331 0.234 -0.009 0.018  -0.040 60  TYR BBB CD1 
1997 C CD2 . TYR B 62  ? 0.443 0.340 0.233 -0.001 0.004  -0.042 60  TYR BBB CD2 
1998 C CE1 . TYR B 62  ? 0.433 0.337 0.237 -0.009 0.026  -0.033 60  TYR BBB CE1 
1999 C CE2 . TYR B 62  ? 0.449 0.343 0.233 -0.002 0.014  -0.033 60  TYR BBB CE2 
2000 C CZ  . TYR B 62  ? 0.420 0.318 0.213 -0.006 0.025  -0.029 60  TYR BBB CZ  
2001 O OH  . TYR B 62  ? 0.401 0.299 0.195 -0.008 0.034  -0.023 60  TYR BBB OH  
2002 N N   . VAL B 63  ? 0.431 0.348 0.293 -0.012 -0.009 -0.068 61  VAL BBB N   
2003 C CA  . VAL B 63  ? 0.441 0.357 0.317 -0.012 -0.017 -0.079 61  VAL BBB CA  
2004 C C   . VAL B 63  ? 0.473 0.379 0.325 -0.004 -0.021 -0.084 61  VAL BBB C   
2005 O O   . VAL B 63  ? 0.504 0.405 0.334 -0.002 -0.014 -0.077 61  VAL BBB O   
2006 C CB  . VAL B 63  ? 0.435 0.355 0.332 -0.018 -0.008 -0.078 61  VAL BBB CB  
2007 C CG1 . VAL B 63  ? 0.446 0.373 0.364 -0.023 -0.003 -0.074 61  VAL BBB CG1 
2008 C CG2 . VAL B 63  ? 0.430 0.348 0.315 -0.019 0.003  -0.070 61  VAL BBB CG2 
2009 N N   . GLU B 64  ? 0.495 0.399 0.354 -0.001 -0.032 -0.096 62  GLU BBB N   
2010 C CA  . GLU B 64  ? 0.528 0.421 0.362 0.009  -0.039 -0.103 62  GLU BBB CA  
2011 C C   . GLU B 64  ? 0.529 0.418 0.347 0.008  -0.027 -0.096 62  GLU BBB C   
2012 O O   . GLU B 64  ? 0.578 0.456 0.367 0.016  -0.026 -0.095 62  GLU BBB O   
2013 C CB  . GLU B 64  ? 0.574 0.468 0.426 0.012  -0.053 -0.118 62  GLU BBB CB  
2014 C CG  . GLU B 64  ? 0.614 0.511 0.483 0.014  -0.067 -0.127 62  GLU BBB CG  
2015 C CD  . GLU B 64  ? 0.667 0.555 0.506 0.025  -0.077 -0.129 62  GLU BBB CD  
2016 O OE1 . GLU B 64  ? 0.784 0.660 0.595 0.036  -0.085 -0.135 62  GLU BBB OE1 
2017 O OE2 . GLU B 64  ? 0.723 0.615 0.566 0.023  -0.077 -0.124 62  GLU BBB OE2 
2018 N N   . SER B 65  ? 0.493 0.389 0.331 0.000  -0.017 -0.092 63  SER BBB N   
2019 C CA  . SER B 65  ? 0.497 0.390 0.325 -0.000 -0.007 -0.088 63  SER BBB CA  
2020 C C   . SER B 65  ? 0.496 0.388 0.309 -0.001 0.004  -0.076 63  SER BBB C   
2021 O O   . SER B 65  ? 0.552 0.441 0.356 -0.000 0.013  -0.074 63  SER BBB O   
2022 C CB  . SER B 65  ? 0.498 0.396 0.350 -0.007 -0.002 -0.088 63  SER BBB CB  
2023 O OG  . SER B 65  ? 0.474 0.379 0.343 -0.014 0.004  -0.081 63  SER BBB OG  
2024 N N   . THR B 66  ? 0.493 0.388 0.306 -0.003 0.005  -0.071 64  THR BBB N   
2025 C CA  . THR B 66  ? 0.498 0.394 0.304 -0.005 0.016  -0.061 64  THR BBB CA  
2026 C C   . THR B 66  ? 0.521 0.409 0.305 0.001  0.015  -0.058 64  THR BBB C   
2027 O O   . THR B 66  ? 0.533 0.419 0.308 0.001  0.026  -0.051 64  THR BBB O   
2028 C CB  . THR B 66  ? 0.462 0.369 0.290 -0.012 0.019  -0.056 64  THR BBB CB  
2029 O OG1 . THR B 66  ? 0.462 0.372 0.296 -0.012 0.012  -0.057 64  THR BBB OG1 
2030 C CG2 . THR B 66  ? 0.470 0.381 0.316 -0.016 0.021  -0.057 64  THR BBB CG2 
2031 N N   . LYS B 67  ? 0.530 0.414 0.306 0.006  0.003  -0.063 65  LYS BBB N   
2032 C CA  . LYS B 67  ? 0.562 0.434 0.311 0.014  0.002  -0.061 65  LYS BBB CA  
2033 C C   . LYS B 67  ? 0.541 0.400 0.264 0.020  0.013  -0.056 65  LYS BBB C   
2034 O O   . LYS B 67  ? 0.550 0.406 0.268 0.023  0.012  -0.061 65  LYS BBB O   
2035 C CB  . LYS B 67  ? 0.644 0.510 0.384 0.023  -0.015 -0.071 65  LYS BBB CB  
2036 C CG  . LYS B 67  ? 0.681 0.555 0.439 0.020  -0.025 -0.073 65  LYS BBB CG  
2037 C CD  . LYS B 67  ? 0.748 0.618 0.504 0.029  -0.043 -0.087 65  LYS BBB CD  
2038 C CE  . LYS B 67  ? 0.791 0.670 0.570 0.025  -0.053 -0.091 65  LYS BBB CE  
2039 N NZ  . LYS B 67  ? 0.794 0.671 0.578 0.034  -0.072 -0.106 65  LYS BBB NZ  
2040 N N   . GLY B 68  ? 0.568 0.421 0.278 0.022  0.022  -0.047 66  GLY BBB N   
2041 C CA  . GLY B 68  ? 0.588 0.425 0.271 0.028  0.036  -0.042 66  GLY BBB CA  
2042 C C   . GLY B 68  ? 0.598 0.442 0.297 0.021  0.051  -0.037 66  GLY BBB C   
2043 O O   . GLY B 68  ? 0.639 0.479 0.336 0.020  0.065  -0.029 66  GLY BBB O   
2044 N N   . ARG B 69  ? 0.547 0.402 0.265 0.016  0.049  -0.042 67  ARG BBB N   
2045 C CA  . ARG B 69  ? 0.549 0.410 0.283 0.010  0.061  -0.040 67  ARG BBB CA  
2046 C C   . ARG B 69  ? 0.498 0.372 0.258 0.002  0.064  -0.035 67  ARG BBB C   
2047 O O   . ARG B 69  ? 0.501 0.377 0.271 -0.000 0.076  -0.032 67  ARG BBB O   
2048 C CB  . ARG B 69  ? 0.546 0.413 0.291 0.009  0.055  -0.047 67  ARG BBB CB  
2049 C CG  . ARG B 69  ? 0.588 0.443 0.310 0.017  0.052  -0.054 67  ARG BBB CG  
2050 C CD  . ARG B 69  ? 0.588 0.449 0.323 0.015  0.049  -0.060 67  ARG BBB CD  
2051 N NE  . ARG B 69  ? 0.548 0.420 0.307 0.008  0.039  -0.064 67  ARG BBB NE  
2052 C CZ  . ARG B 69  ? 0.546 0.428 0.328 0.001  0.042  -0.063 67  ARG BBB CZ  
2053 N NH1 . ARG B 69  ? 0.534 0.418 0.320 -0.000 0.052  -0.060 67  ARG BBB NH1 
2054 N NH2 . ARG B 69  ? 0.519 0.408 0.319 -0.003 0.034  -0.066 67  ARG BBB NH2 
2055 N N   . PHE B 70  ? 0.497 0.380 0.270 -0.001 0.054  -0.037 68  PHE BBB N   
2056 C CA  . PHE B 70  ? 0.462 0.357 0.258 -0.008 0.055  -0.033 68  PHE BBB CA  
2057 C C   . PHE B 70  ? 0.465 0.357 0.256 -0.007 0.054  -0.028 68  PHE BBB C   
2058 O O   . PHE B 70  ? 0.502 0.388 0.278 -0.003 0.047  -0.030 68  PHE BBB O   
2059 C CB  . PHE B 70  ? 0.457 0.361 0.270 -0.012 0.047  -0.037 68  PHE BBB CB  
2060 C CG  . PHE B 70  ? 0.457 0.364 0.278 -0.013 0.048  -0.041 68  PHE BBB CG  
2061 C CD1 . PHE B 70  ? 0.477 0.378 0.289 -0.010 0.055  -0.042 68  PHE BBB CD1 
2062 C CD2 . PHE B 70  ? 0.473 0.386 0.309 -0.016 0.043  -0.042 68  PHE BBB CD2 
2063 C CE1 . PHE B 70  ? 0.480 0.383 0.300 -0.011 0.055  -0.046 68  PHE BBB CE1 
2064 C CE2 . PHE B 70  ? 0.464 0.377 0.305 -0.016 0.045  -0.046 68  PHE BBB CE2 
2065 C CZ  . PHE B 70  ? 0.468 0.378 0.303 -0.014 0.050  -0.047 68  PHE BBB CZ  
2066 N N   . THR B 71  ? 0.451 0.349 0.257 -0.011 0.061  -0.024 69  THR BBB N   
2067 C CA  . THR B 71  ? 0.443 0.340 0.248 -0.011 0.060  -0.020 69  THR BBB CA  
2068 C C   . THR B 71  ? 0.415 0.324 0.243 -0.016 0.057  -0.020 69  THR BBB C   
2069 O O   . THR B 71  ? 0.414 0.330 0.259 -0.018 0.063  -0.020 69  THR BBB O   
2070 C CB  . THR B 71  ? 0.482 0.368 0.278 -0.009 0.074  -0.014 69  THR BBB CB  
2071 O OG1 . THR B 71  ? 0.517 0.389 0.286 -0.002 0.077  -0.014 69  THR BBB OG1 
2072 C CG2 . THR B 71  ? 0.485 0.368 0.280 -0.009 0.075  -0.009 69  THR BBB CG2 
2073 N N   . ILE B 72  ? 0.402 0.316 0.233 -0.017 0.048  -0.020 70  ILE BBB N   
2074 C CA  . ILE B 72  ? 0.379 0.303 0.228 -0.020 0.046  -0.019 70  ILE BBB CA  
2075 C C   . ILE B 72  ? 0.416 0.338 0.266 -0.020 0.048  -0.015 70  ILE BBB C   
2076 O O   . ILE B 72  ? 0.431 0.344 0.265 -0.017 0.048  -0.012 70  ILE BBB O   
2077 C CB  . ILE B 72  ? 0.378 0.307 0.231 -0.021 0.036  -0.022 70  ILE BBB CB  
2078 C CG1 . ILE B 72  ? 0.356 0.293 0.225 -0.022 0.035  -0.021 70  ILE BBB CG1 
2079 C CG2 . ILE B 72  ? 0.397 0.322 0.241 -0.019 0.030  -0.022 70  ILE BBB CG2 
2080 C CD1 . ILE B 72  ? 0.367 0.307 0.240 -0.023 0.030  -0.023 70  ILE BBB CD1 
2081 N N   . SER B 73  ? 0.395 0.324 0.262 -0.022 0.050  -0.014 71  SER BBB N   
2082 C CA  A SER B 73  ? 0.397 0.325 0.270 -0.022 0.052  -0.011 71  SER BBB CA  
2083 C CA  B SER B 73  ? 0.423 0.351 0.297 -0.022 0.052  -0.011 71  SER BBB CA  
2084 C C   . SER B 73  ? 0.411 0.349 0.303 -0.023 0.047  -0.014 71  SER BBB C   
2085 O O   . SER B 73  ? 0.372 0.316 0.271 -0.023 0.044  -0.017 71  SER BBB O   
2086 C CB  A SER B 73  ? 0.388 0.309 0.264 -0.022 0.064  -0.009 71  SER BBB CB  
2087 C CB  B SER B 73  ? 0.440 0.361 0.317 -0.022 0.064  -0.009 71  SER BBB CB  
2088 O OG  A SER B 73  ? 0.358 0.284 0.250 -0.023 0.069  -0.012 71  SER BBB OG  
2089 O OG  B SER B 73  ? 0.511 0.420 0.365 -0.019 0.070  -0.006 71  SER BBB OG  
2090 N N   . SER B 74  ? 0.426 0.366 0.323 -0.023 0.044  -0.012 72  SER BBB N   
2091 C CA  . SER B 74  ? 0.401 0.349 0.313 -0.023 0.038  -0.014 72  SER BBB CA  
2092 C C   . SER B 74  ? 0.402 0.350 0.331 -0.023 0.043  -0.014 72  SER BBB C   
2093 O O   . SER B 74  ? 0.427 0.367 0.350 -0.024 0.050  -0.010 72  SER BBB O   
2094 C CB  . SER B 74  ? 0.446 0.396 0.352 -0.022 0.031  -0.013 72  SER BBB CB  
2095 O OG  . SER B 74  ? 0.493 0.450 0.411 -0.020 0.026  -0.016 72  SER BBB OG  
2096 N N   . ASN B 75  ? 0.348 0.303 0.295 -0.022 0.039  -0.020 73  ASN BBB N   
2097 C CA  . ASN B 75  ? 0.353 0.311 0.321 -0.022 0.040  -0.022 73  ASN BBB CA  
2098 C C   . ASN B 75  ? 0.305 0.268 0.274 -0.019 0.028  -0.025 73  ASN BBB C   
2099 O O   . ASN B 75  ? 0.305 0.273 0.281 -0.014 0.022  -0.031 73  ASN BBB O   
2100 C CB  . ASN B 75  ? 0.365 0.326 0.356 -0.022 0.044  -0.028 73  ASN BBB CB  
2101 C CG  . ASN B 75  ? 0.392 0.355 0.410 -0.023 0.045  -0.031 73  ASN BBB CG  
2102 O OD1 . ASN B 75  ? 0.382 0.349 0.403 -0.020 0.037  -0.033 73  ASN BBB OD1 
2103 N ND2 . ASN B 75  ? 0.424 0.384 0.460 -0.026 0.057  -0.032 73  ASN BBB ND2 
2104 N N   . ASN B 76  ? 0.308 0.270 0.267 -0.019 0.026  -0.021 74  ASN BBB N   
2105 C CA  . ASN B 76  ? 0.299 0.266 0.258 -0.015 0.016  -0.023 74  ASN BBB CA  
2106 C C   . ASN B 76  ? 0.293 0.265 0.272 -0.012 0.011  -0.030 74  ASN BBB C   
2107 O O   . ASN B 76  ? 0.298 0.272 0.275 -0.006 0.003  -0.034 74  ASN BBB O   
2108 C CB  . ASN B 76  ? 0.324 0.288 0.274 -0.017 0.015  -0.018 74  ASN BBB CB  
2109 C CG  . ASN B 76  ? 0.305 0.266 0.236 -0.018 0.015  -0.014 74  ASN BBB CG  
2110 O OD1 . ASN B 76  ? 0.301 0.261 0.225 -0.019 0.017  -0.014 74  ASN BBB OD1 
2111 N ND2 . ASN B 76  ? 0.306 0.265 0.230 -0.018 0.012  -0.012 74  ASN BBB ND2 
2112 N N   . ALA B 77  ? 0.291 0.262 0.289 -0.014 0.015  -0.031 75  ALA BBB N   
2113 C CA  . ALA B 77  ? 0.301 0.278 0.325 -0.010 0.009  -0.040 75  ALA BBB CA  
2114 C C   . ALA B 77  ? 0.305 0.286 0.336 -0.005 0.003  -0.049 75  ALA BBB C   
2115 O O   . ALA B 77  ? 0.328 0.313 0.368 0.002  -0.008 -0.057 75  ALA BBB O   
2116 C CB  . ALA B 77  ? 0.310 0.285 0.357 -0.015 0.018  -0.040 75  ALA BBB CB  
2117 N N   . MET B 78  ? 0.311 0.290 0.337 -0.007 0.009  -0.047 76  MET BBB N   
2118 C CA  A MET B 78  ? 0.333 0.316 0.368 -0.001 0.004  -0.056 76  MET BBB CA  
2119 C CA  B MET B 78  ? 0.322 0.304 0.356 -0.001 0.004  -0.056 76  MET BBB CA  
2120 C C   . MET B 78  ? 0.318 0.297 0.325 0.003  0.000  -0.053 76  MET BBB C   
2121 O O   . MET B 78  ? 0.321 0.301 0.328 0.009  -0.004 -0.058 76  MET BBB O   
2122 C CB  A MET B 78  ? 0.382 0.364 0.430 -0.007 0.015  -0.056 76  MET BBB CB  
2123 C CB  B MET B 78  ? 0.350 0.332 0.398 -0.006 0.015  -0.056 76  MET BBB CB  
2124 C CG  A MET B 78  ? 0.440 0.423 0.518 -0.011 0.022  -0.059 76  MET BBB CG  
2125 C CG  B MET B 78  ? 0.383 0.367 0.462 -0.011 0.022  -0.059 76  MET BBB CG  
2126 S SD  A MET B 78  ? 0.531 0.523 0.647 -0.004 0.010  -0.075 76  MET BBB SD  
2127 S SD  B MET B 78  ? 0.425 0.407 0.521 -0.016 0.038  -0.059 76  MET BBB SD  
2128 C CE  A MET B 78  ? 0.507 0.502 0.631 -0.001 0.009  -0.082 76  MET BBB CE  
2129 C CE  B MET B 78  ? 0.424 0.410 0.515 -0.010 0.029  -0.066 76  MET BBB CE  
2130 N N   . ASN B 79  ? 0.298 0.275 0.284 0.001  0.002  -0.045 77  ASN BBB N   
2131 C CA  . ASN B 79  ? 0.316 0.288 0.279 0.005  -0.000 -0.042 77  ASN BBB CA  
2132 C C   . ASN B 79  ? 0.304 0.274 0.260 0.003  0.005  -0.041 77  ASN BBB C   
2133 O O   . ASN B 79  ? 0.304 0.271 0.249 0.009  0.002  -0.042 77  ASN BBB O   
2134 C CB  . ASN B 79  ? 0.318 0.289 0.278 0.016  -0.010 -0.048 77  ASN BBB CB  
2135 C CG  . ASN B 79  ? 0.384 0.353 0.328 0.019  -0.012 -0.044 77  ASN BBB CG  
2136 O OD1 . ASN B 79  ? 0.332 0.303 0.279 0.014  -0.011 -0.040 77  ASN BBB OD1 
2137 N ND2 . ASN B 79  ? 0.427 0.389 0.354 0.027  -0.014 -0.044 77  ASN BBB ND2 
2138 N N   . THR B 80  ? 0.309 0.279 0.271 -0.004 0.013  -0.039 78  THR BBB N   
2139 C CA  . THR B 80  ? 0.308 0.276 0.268 -0.005 0.018  -0.039 78  THR BBB CA  
2140 C C   . THR B 80  ? 0.336 0.300 0.282 -0.012 0.025  -0.032 78  THR BBB C   
2141 O O   . THR B 80  ? 0.349 0.312 0.296 -0.016 0.029  -0.028 78  THR BBB O   
2142 C CB  . THR B 80  ? 0.334 0.306 0.317 -0.005 0.020  -0.045 78  THR BBB CB  
2143 O OG1 . THR B 80  ? 0.337 0.313 0.335 0.002  0.011  -0.054 78  THR BBB OG1 
2144 C CG2 . THR B 80  ? 0.349 0.319 0.329 -0.006 0.025  -0.046 78  THR BBB CG2 
2145 N N   . VAL B 81  ? 0.327 0.288 0.261 -0.012 0.027  -0.030 79  VAL BBB N   
2146 C CA  . VAL B 81  ? 0.358 0.315 0.280 -0.016 0.032  -0.026 79  VAL BBB CA  
2147 C C   . VAL B 81  ? 0.364 0.319 0.288 -0.017 0.037  -0.029 79  VAL BBB C   
2148 O O   . VAL B 81  ? 0.351 0.308 0.282 -0.013 0.035  -0.033 79  VAL BBB O   
2149 C CB  . VAL B 81  ? 0.387 0.342 0.296 -0.017 0.030  -0.023 79  VAL BBB CB  
2150 C CG1 . VAL B 81  ? 0.453 0.410 0.362 -0.016 0.026  -0.021 79  VAL BBB CG1 
2151 C CG2 . VAL B 81  ? 0.411 0.364 0.316 -0.013 0.028  -0.025 79  VAL BBB CG2 
2152 N N   . TYR B 82  ? 0.363 0.314 0.280 -0.020 0.044  -0.026 80  TYR BBB N   
2153 C CA  . TYR B 82  ? 0.379 0.328 0.298 -0.020 0.051  -0.028 80  TYR BBB CA  
2154 C C   . TYR B 82  ? 0.397 0.340 0.297 -0.021 0.052  -0.026 80  TYR BBB C   
2155 O O   . TYR B 82  ? 0.410 0.349 0.298 -0.022 0.050  -0.023 80  TYR BBB O   
2156 C CB  . TYR B 82  ? 0.404 0.350 0.332 -0.022 0.060  -0.027 80  TYR BBB CB  
2157 C CG  . TYR B 82  ? 0.422 0.374 0.372 -0.022 0.059  -0.030 80  TYR BBB CG  
2158 C CD1 . TYR B 82  ? 0.442 0.394 0.393 -0.023 0.057  -0.027 80  TYR BBB CD1 
2159 C CD2 . TYR B 82  ? 0.416 0.375 0.389 -0.020 0.058  -0.037 80  TYR BBB CD2 
2160 C CE1 . TYR B 82  ? 0.469 0.426 0.442 -0.022 0.055  -0.031 80  TYR BBB CE1 
2161 C CE2 . TYR B 82  ? 0.418 0.382 0.415 -0.019 0.055  -0.042 80  TYR BBB CE2 
2162 C CZ  . TYR B 82  ? 0.465 0.428 0.462 -0.020 0.054  -0.039 80  TYR BBB CZ  
2163 O OH  . TYR B 82  ? 0.489 0.458 0.510 -0.019 0.050  -0.044 80  TYR BBB OH  
2164 N N   . LEU B 83  ? 0.374 0.316 0.273 -0.020 0.053  -0.029 81  LEU BBB N   
2165 C CA  . LEU B 83  ? 0.375 0.311 0.259 -0.021 0.055  -0.028 81  LEU BBB CA  
2166 C C   . LEU B 83  ? 0.382 0.315 0.267 -0.020 0.064  -0.029 81  LEU BBB C   
2167 O O   . LEU B 83  ? 0.369 0.305 0.265 -0.019 0.065  -0.033 81  LEU BBB O   
2168 C CB  . LEU B 83  ? 0.379 0.316 0.261 -0.020 0.050  -0.030 81  LEU BBB CB  
2169 C CG  . LEU B 83  ? 0.407 0.338 0.275 -0.020 0.049  -0.031 81  LEU BBB CG  
2170 C CD1 . LEU B 83  ? 0.428 0.356 0.286 -0.021 0.045  -0.029 81  LEU BBB CD1 
2171 C CD2 . LEU B 83  ? 0.403 0.335 0.274 -0.020 0.046  -0.033 81  LEU BBB CD2 
2172 N N   . GLN B 84  ? 0.390 0.315 0.263 -0.020 0.071  -0.026 82  GLN BBB N   
2173 C CA  A GLN B 84  ? 0.416 0.335 0.286 -0.019 0.082  -0.027 82  GLN BBB CA  
2174 C CA  B GLN B 84  ? 0.418 0.337 0.287 -0.019 0.082  -0.027 82  GLN BBB CA  
2175 C C   . GLN B 84  ? 0.436 0.349 0.288 -0.017 0.079  -0.029 82  GLN BBB C   
2176 O O   . GLN B 84  ? 0.460 0.366 0.293 -0.015 0.075  -0.027 82  GLN BBB O   
2177 C CB  A GLN B 84  ? 0.436 0.346 0.298 -0.018 0.092  -0.022 82  GLN BBB CB  
2178 C CB  B GLN B 84  ? 0.438 0.348 0.300 -0.018 0.092  -0.022 82  GLN BBB CB  
2179 C CG  A GLN B 84  ? 0.461 0.362 0.318 -0.016 0.107  -0.021 82  GLN BBB CG  
2180 C CG  B GLN B 84  ? 0.466 0.367 0.324 -0.016 0.107  -0.021 82  GLN BBB CG  
2181 C CD  A GLN B 84  ? 0.463 0.373 0.349 -0.018 0.112  -0.026 82  GLN BBB CD  
2182 C CD  B GLN B 84  ? 0.497 0.384 0.337 -0.013 0.118  -0.014 82  GLN BBB CD  
2183 O OE1 A GLN B 84  ? 0.451 0.371 0.360 -0.021 0.107  -0.028 82  GLN BBB OE1 
2184 O OE1 B GLN B 84  ? 0.533 0.408 0.344 -0.008 0.118  -0.012 82  GLN BBB OE1 
2185 N NE2 A GLN B 84  ? 0.468 0.374 0.350 -0.017 0.120  -0.028 82  GLN BBB NE2 
2186 N NE2 B GLN B 84  ? 0.516 0.403 0.373 -0.016 0.127  -0.011 82  GLN BBB NE2 
2187 N N   . MET B 85  ? 0.432 0.347 0.290 -0.016 0.081  -0.033 83  MET BBB N   
2188 C CA  A MET B 85  ? 0.428 0.339 0.272 -0.014 0.078  -0.036 83  MET BBB CA  
2189 C CA  B MET B 85  ? 0.441 0.352 0.286 -0.014 0.078  -0.036 83  MET BBB CA  
2190 C C   . MET B 85  ? 0.467 0.371 0.304 -0.012 0.089  -0.036 83  MET BBB C   
2191 O O   . MET B 85  ? 0.499 0.407 0.352 -0.013 0.095  -0.039 83  MET BBB O   
2192 C CB  A MET B 85  ? 0.419 0.337 0.275 -0.016 0.071  -0.040 83  MET BBB CB  
2193 C CB  B MET B 85  ? 0.452 0.370 0.309 -0.016 0.071  -0.040 83  MET BBB CB  
2194 C CG  A MET B 85  ? 0.406 0.329 0.269 -0.017 0.062  -0.039 83  MET BBB CG  
2195 C CG  B MET B 85  ? 0.457 0.380 0.320 -0.017 0.062  -0.039 83  MET BBB CG  
2196 S SD  A MET B 85  ? 0.389 0.313 0.256 -0.017 0.056  -0.042 83  MET BBB SD  
2197 S SD  B MET B 85  ? 0.465 0.394 0.342 -0.016 0.059  -0.041 83  MET BBB SD  
2198 C CE  A MET B 85  ? 0.382 0.311 0.264 -0.015 0.060  -0.044 83  MET BBB CE  
2199 C CE  B MET B 85  ? 0.478 0.401 0.348 -0.016 0.058  -0.045 83  MET BBB CE  
2200 N N   . ASN B 86  ? 0.483 0.375 0.296 -0.008 0.091  -0.035 84  ASN BBB N   
2201 C CA  . ASN B 86  ? 0.512 0.392 0.310 -0.003 0.103  -0.034 84  ASN BBB CA  
2202 C C   . ASN B 86  ? 0.512 0.388 0.295 0.001  0.097  -0.040 84  ASN BBB C   
2203 O O   . ASN B 86  ? 0.496 0.374 0.275 0.000  0.083  -0.043 84  ASN BBB O   
2204 C CB  . ASN B 86  ? 0.577 0.444 0.355 0.001  0.112  -0.028 84  ASN BBB CB  
2205 C CG  . ASN B 86  ? 0.597 0.467 0.392 -0.003 0.121  -0.023 84  ASN BBB CG  
2206 O OD1 . ASN B 86  ? 0.566 0.448 0.390 -0.008 0.125  -0.025 84  ASN BBB OD1 
2207 N ND2 . ASN B 86  ? 0.670 0.531 0.451 -0.000 0.124  -0.018 84  ASN BBB ND2 
2208 N N   . SER B 87  ? 0.528 0.396 0.302 0.004  0.107  -0.041 85  SER BBB N   
2209 C CA  . SER B 87  ? 0.557 0.418 0.312 0.010  0.101  -0.047 85  SER BBB CA  
2210 C C   . SER B 87  ? 0.551 0.424 0.324 0.005  0.088  -0.053 85  SER BBB C   
2211 O O   . SER B 87  ? 0.528 0.397 0.290 0.008  0.077  -0.057 85  SER BBB O   
2212 C CB  . SER B 87  ? 0.602 0.450 0.327 0.017  0.096  -0.047 85  SER BBB CB  
2213 O OG  . SER B 87  ? 0.610 0.445 0.317 0.022  0.110  -0.040 85  SER BBB OG  
2214 N N   . LEU B 88  ? 0.505 0.389 0.303 -0.000 0.090  -0.053 86  LEU BBB N   
2215 C CA  . LEU B 88  ? 0.491 0.383 0.304 -0.003 0.080  -0.057 86  LEU BBB CA  
2216 C C   . LEU B 88  ? 0.484 0.372 0.291 -0.001 0.077  -0.063 86  LEU BBB C   
2217 O O   . LEU B 88  ? 0.479 0.361 0.277 0.003  0.086  -0.064 86  LEU BBB O   
2218 C CB  . LEU B 88  ? 0.466 0.368 0.303 -0.007 0.082  -0.055 86  LEU BBB CB  
2219 C CG  . LEU B 88  ? 0.453 0.360 0.298 -0.010 0.080  -0.051 86  LEU BBB CG  
2220 C CD1 . LEU B 88  ? 0.443 0.358 0.310 -0.011 0.083  -0.052 86  LEU BBB CD1 
2221 C CD2 . LEU B 88  ? 0.454 0.364 0.300 -0.012 0.069  -0.051 86  LEU BBB CD2 
2222 N N   . LYS B 89  ? 0.470 0.359 0.281 -0.002 0.067  -0.066 87  LYS BBB N   
2223 C CA  . LYS B 89  ? 0.504 0.389 0.313 0.000  0.063  -0.073 87  LYS BBB CA  
2224 C C   . LYS B 89  ? 0.464 0.356 0.293 -0.004 0.061  -0.073 87  LYS BBB C   
2225 O O   . LYS B 89  ? 0.446 0.343 0.286 -0.007 0.059  -0.069 87  LYS BBB O   
2226 C CB  . LYS B 89  ? 0.559 0.439 0.357 0.003  0.053  -0.078 87  LYS BBB CB  
2227 C CG  . LYS B 89  ? 0.642 0.514 0.417 0.008  0.053  -0.076 87  LYS BBB CG  
2228 C CD  . LYS B 89  ? 0.693 0.562 0.462 0.011  0.040  -0.081 87  LYS BBB CD  
2229 C CE  . LYS B 89  ? 0.789 0.648 0.542 0.019  0.033  -0.090 87  LYS BBB CE  
2230 N NZ  . LYS B 89  ? 0.836 0.682 0.557 0.028  0.040  -0.088 87  LYS BBB NZ  
2231 N N   . PRO B 90  ? 0.458 0.347 0.290 -0.002 0.060  -0.078 88  PRO BBB N   
2232 C CA  . PRO B 90  ? 0.447 0.338 0.294 -0.004 0.059  -0.078 88  PRO BBB CA  
2233 C C   . PRO B 90  ? 0.448 0.339 0.302 -0.008 0.053  -0.077 88  PRO BBB C   
2234 O O   . PRO B 90  ? 0.438 0.331 0.302 -0.009 0.054  -0.073 88  PRO BBB O   
2235 C CB  . PRO B 90  ? 0.467 0.352 0.311 -0.002 0.058  -0.085 88  PRO BBB CB  
2236 C CG  . PRO B 90  ? 0.479 0.362 0.309 0.002  0.064  -0.087 88  PRO BBB CG  
2237 C CD  . PRO B 90  ? 0.486 0.368 0.304 0.002  0.062  -0.084 88  PRO BBB CD  
2238 N N   . GLU B 91  ? 0.472 0.361 0.323 -0.008 0.047  -0.080 89  GLU BBB N   
2239 C CA  . GLU B 91  ? 0.481 0.371 0.343 -0.011 0.042  -0.080 89  GLU BBB CA  
2240 C C   . GLU B 91  ? 0.452 0.347 0.316 -0.013 0.043  -0.073 89  GLU BBB C   
2241 O O   . GLU B 91  ? 0.447 0.342 0.322 -0.016 0.042  -0.071 89  GLU BBB O   
2242 C CB  . GLU B 91  ? 0.524 0.411 0.384 -0.010 0.033  -0.088 89  GLU BBB CB  
2243 C CG  . GLU B 91  ? 0.577 0.462 0.417 -0.005 0.031  -0.089 89  GLU BBB CG  
2244 C CD  . GLU B 91  ? 0.637 0.515 0.461 0.000  0.031  -0.095 89  GLU BBB CD  
2245 O OE1 . GLU B 91  ? 0.577 0.455 0.401 0.001  0.038  -0.093 89  GLU BBB OE1 
2246 O OE2 . GLU B 91  ? 0.749 0.622 0.559 0.006  0.023  -0.101 89  GLU BBB OE2 
2247 N N   . ASP B 92  ? 0.431 0.329 0.286 -0.012 0.047  -0.069 90  ASP BBB N   
2248 C CA  . ASP B 92  ? 0.416 0.319 0.275 -0.014 0.049  -0.062 90  ASP BBB CA  
2249 C C   . ASP B 92  ? 0.396 0.301 0.264 -0.014 0.052  -0.059 90  ASP BBB C   
2250 O O   . ASP B 92  ? 0.397 0.306 0.268 -0.014 0.052  -0.055 90  ASP BBB O   
2251 C CB  . ASP B 92  ? 0.416 0.321 0.265 -0.013 0.052  -0.060 90  ASP BBB CB  
2252 C CG  . ASP B 92  ? 0.451 0.352 0.286 -0.011 0.048  -0.062 90  ASP BBB CG  
2253 O OD1 . ASP B 92  ? 0.457 0.358 0.295 -0.012 0.041  -0.064 90  ASP BBB OD1 
2254 O OD2 . ASP B 92  ? 0.476 0.372 0.298 -0.008 0.053  -0.062 90  ASP BBB OD2 
2255 N N   . THR B 93  ? 0.402 0.303 0.272 -0.012 0.053  -0.061 91  THR BBB N   
2256 C CA  . THR B 93  ? 0.384 0.284 0.260 -0.009 0.055  -0.059 91  THR BBB CA  
2257 C C   . THR B 93  ? 0.389 0.285 0.268 -0.010 0.055  -0.055 91  THR BBB C   
2258 O O   . THR B 93  ? 0.388 0.280 0.271 -0.013 0.055  -0.056 91  THR BBB O   
2259 C CB  . THR B 93  ? 0.400 0.294 0.276 -0.007 0.057  -0.063 91  THR BBB CB  
2260 O OG1 . THR B 93  ? 0.385 0.283 0.259 -0.006 0.058  -0.066 91  THR BBB OG1 
2261 C CG2 . THR B 93  ? 0.409 0.299 0.287 -0.002 0.057  -0.060 91  THR BBB CG2 
2262 N N   . ALA B 94  ? 0.386 0.284 0.265 -0.008 0.055  -0.051 92  ALA BBB N   
2263 C CA  . ALA B 94  ? 0.380 0.274 0.260 -0.008 0.056  -0.046 92  ALA BBB CA  
2264 C C   . ALA B 94  ? 0.365 0.260 0.241 -0.003 0.055  -0.042 92  ALA BBB C   
2265 O O   . ALA B 94  ? 0.348 0.249 0.224 -0.001 0.053  -0.044 92  ALA BBB O   
2266 C CB  . ALA B 94  ? 0.373 0.271 0.257 -0.014 0.054  -0.046 92  ALA BBB CB  
2267 N N   . VAL B 95  ? 0.359 0.247 0.233 -0.001 0.058  -0.037 93  VAL BBB N   
2268 C CA  . VAL B 95  ? 0.368 0.256 0.236 0.004  0.056  -0.034 93  VAL BBB CA  
2269 C C   . VAL B 95  ? 0.363 0.260 0.236 -0.002 0.055  -0.033 93  VAL BBB C   
2270 O O   . VAL B 95  ? 0.357 0.253 0.235 -0.006 0.058  -0.032 93  VAL BBB O   
2271 C CB  . VAL B 95  ? 0.387 0.261 0.245 0.012  0.060  -0.029 93  VAL BBB CB  
2272 C CG1 . VAL B 95  ? 0.411 0.285 0.262 0.018  0.057  -0.027 93  VAL BBB CG1 
2273 C CG2 . VAL B 95  ? 0.416 0.280 0.267 0.019  0.061  -0.030 93  VAL BBB CG2 
2274 N N   . TYR B 96  ? 0.343 0.248 0.217 -0.001 0.050  -0.034 94  TYR BBB N   
2275 C CA  . TYR B 96  ? 0.346 0.258 0.223 -0.005 0.049  -0.033 94  TYR BBB CA  
2276 C C   . TYR B 96  ? 0.345 0.255 0.219 -0.001 0.048  -0.030 94  TYR BBB C   
2277 O O   . TYR B 96  ? 0.365 0.273 0.235 0.007  0.045  -0.031 94  TYR BBB O   
2278 C CB  . TYR B 96  ? 0.333 0.253 0.213 -0.008 0.046  -0.036 94  TYR BBB CB  
2279 C CG  . TYR B 96  ? 0.329 0.249 0.208 -0.012 0.048  -0.039 94  TYR BBB CG  
2280 C CD1 . TYR B 96  ? 0.355 0.272 0.234 -0.011 0.050  -0.042 94  TYR BBB CD1 
2281 C CD2 . TYR B 96  ? 0.335 0.258 0.213 -0.016 0.047  -0.039 94  TYR BBB CD2 
2282 C CE1 . TYR B 96  ? 0.340 0.256 0.217 -0.014 0.050  -0.045 94  TYR BBB CE1 
2283 C CE2 . TYR B 96  ? 0.344 0.265 0.218 -0.018 0.047  -0.042 94  TYR BBB CE2 
2284 C CZ  . TYR B 96  ? 0.352 0.269 0.225 -0.017 0.049  -0.045 94  TYR BBB CZ  
2285 O OH  . TYR B 96  ? 0.350 0.265 0.219 -0.017 0.048  -0.049 94  TYR BBB OH  
2286 N N   . PHE B 97  ? 0.341 0.251 0.215 -0.003 0.049  -0.026 95  PHE BBB N   
2287 C CA  . PHE B 97  ? 0.357 0.264 0.227 0.002  0.050  -0.023 95  PHE BBB CA  
2288 C C   . PHE B 97  ? 0.342 0.259 0.218 -0.003 0.046  -0.023 95  PHE BBB C   
2289 O O   . PHE B 97  ? 0.355 0.275 0.237 -0.009 0.046  -0.023 95  PHE BBB O   
2290 C CB  . PHE B 97  ? 0.372 0.269 0.240 0.002  0.058  -0.018 95  PHE BBB CB  
2291 C CG  . PHE B 97  ? 0.382 0.267 0.245 0.006  0.063  -0.017 95  PHE BBB CG  
2292 C CD1 . PHE B 97  ? 0.416 0.300 0.287 0.000  0.066  -0.020 95  PHE BBB CD1 
2293 C CD2 . PHE B 97  ? 0.404 0.276 0.252 0.017  0.066  -0.014 95  PHE BBB CD2 
2294 C CE1 . PHE B 97  ? 0.425 0.298 0.292 0.004  0.072  -0.018 95  PHE BBB CE1 
2295 C CE2 . PHE B 97  ? 0.438 0.297 0.279 0.021  0.072  -0.012 95  PHE BBB CE2 
2296 C CZ  . PHE B 97  ? 0.455 0.315 0.307 0.014  0.075  -0.014 95  PHE BBB CZ  
2297 N N   . CYS B 98  ? 0.357 0.276 0.230 0.002  0.042  -0.023 96  CYS BBB N   
2298 C CA  . CYS B 98  ? 0.359 0.284 0.236 -0.000 0.039  -0.022 96  CYS BBB CA  
2299 C C   . CYS B 98  ? 0.349 0.269 0.223 0.001  0.043  -0.018 96  CYS BBB C   
2300 O O   . CYS B 98  ? 0.364 0.274 0.229 0.008  0.048  -0.016 96  CYS BBB O   
2301 C CB  . CYS B 98  ? 0.356 0.285 0.234 0.005  0.033  -0.025 96  CYS BBB CB  
2302 S SG  . CYS B 98  ? 0.402 0.339 0.286 0.002  0.029  -0.024 96  CYS BBB SG  
2303 N N   . ALA B 99  ? 0.344 0.269 0.224 -0.004 0.043  -0.017 97  ALA BBB N   
2304 C CA  . ALA B 99  ? 0.332 0.253 0.214 -0.004 0.049  -0.014 97  ALA BBB CA  
2305 C C   . ALA B 99  ? 0.321 0.250 0.208 -0.006 0.044  -0.014 97  ALA BBB C   
2306 O O   . ALA B 99  ? 0.318 0.254 0.211 -0.012 0.039  -0.016 97  ALA BBB O   
2307 C CB  . ALA B 99  ? 0.360 0.278 0.251 -0.010 0.054  -0.014 97  ALA BBB CB  
2308 N N   . LEU B 100 ? 0.331 0.256 0.215 -0.002 0.047  -0.011 98  LEU BBB N   
2309 C CA  . LEU B 100 ? 0.325 0.257 0.213 -0.002 0.043  -0.011 98  LEU BBB CA  
2310 C C   . LEU B 100 ? 0.329 0.259 0.224 -0.004 0.050  -0.009 98  LEU BBB C   
2311 O O   . LEU B 100 ? 0.331 0.250 0.220 0.001  0.059  -0.006 98  LEU BBB O   
2312 C CB  . LEU B 100 ? 0.332 0.261 0.209 0.006  0.039  -0.011 98  LEU BBB CB  
2313 C CG  . LEU B 100 ? 0.317 0.252 0.197 0.007  0.035  -0.011 98  LEU BBB CG  
2314 C CD1 . LEU B 100 ? 0.323 0.268 0.213 0.000  0.029  -0.013 98  LEU BBB CD1 
2315 C CD2 . LEU B 100 ? 0.345 0.275 0.213 0.018  0.031  -0.012 98  LEU BBB CD2 
2316 N N   . GLY B 101 ? 0.314 0.252 0.220 -0.009 0.046  -0.011 99  GLY BBB N   
2317 C CA  . GLY B 101 ? 0.311 0.248 0.229 -0.011 0.052  -0.010 99  GLY BBB CA  
2318 C C   . GLY B 101 ? 0.328 0.264 0.240 -0.006 0.052  -0.008 99  GLY BBB C   
2319 O O   . GLY B 101 ? 0.344 0.282 0.245 -0.001 0.046  -0.008 99  GLY BBB O   
2320 N N   . VAL B 102 ? 0.321 0.255 0.243 -0.006 0.060  -0.007 100 VAL BBB N   
2321 C CA  . VAL B 102 ? 0.341 0.275 0.260 -0.001 0.061  -0.005 100 VAL BBB CA  
2322 C C   . VAL B 102 ? 0.315 0.261 0.252 -0.008 0.055  -0.009 100 VAL BBB C   
2323 O O   . VAL B 102 ? 0.312 0.259 0.251 -0.005 0.056  -0.008 100 VAL BBB O   
2324 C CB  . VAL B 102 ? 0.368 0.290 0.283 0.005  0.076  -0.000 100 VAL BBB CB  
2325 C CG1 . VAL B 102 ? 0.396 0.305 0.285 0.014  0.080  0.004  100 VAL BBB CG1 
2326 C CG2 . VAL B 102 ? 0.379 0.298 0.314 -0.001 0.088  -0.000 100 VAL BBB CG2 
2327 N N   . THR B 103 ? 0.312 0.264 0.259 -0.014 0.047  -0.013 101 THR BBB N   
2328 C CA  . THR B 103 ? 0.308 0.270 0.268 -0.018 0.038  -0.018 101 THR BBB CA  
2329 C C   . THR B 103 ? 0.302 0.267 0.253 -0.020 0.027  -0.020 101 THR BBB C   
2330 O O   . THR B 103 ? 0.310 0.272 0.249 -0.019 0.027  -0.018 101 THR BBB O   
2331 C CB  . THR B 103 ? 0.325 0.290 0.309 -0.023 0.041  -0.023 101 THR BBB CB  
2332 O OG1 . THR B 103 ? 0.316 0.281 0.302 -0.026 0.036  -0.027 101 THR BBB OG1 
2333 C CG2 . THR B 103 ? 0.338 0.297 0.334 -0.022 0.056  -0.021 101 THR BBB CG2 
2334 N N   . ALA B 104 ? 0.294 0.265 0.250 -0.022 0.018  -0.023 102 ALA BBB N   
2335 C CA  . ALA B 104 ? 0.301 0.272 0.246 -0.022 0.008  -0.024 102 ALA BBB CA  
2336 C C   . ALA B 104 ? 0.306 0.275 0.253 -0.025 0.006  -0.028 102 ALA BBB C   
2337 O O   . ALA B 104 ? 0.322 0.288 0.256 -0.024 0.001  -0.028 102 ALA BBB O   
2338 C CB  . ALA B 104 ? 0.311 0.286 0.258 -0.021 0.000  -0.025 102 ALA BBB CB  
2339 N N   . ALA B 105 ? 0.319 0.289 0.283 -0.027 0.009  -0.032 103 ALA BBB N   
2340 C CA  . ALA B 105 ? 0.346 0.316 0.316 -0.028 0.003  -0.039 103 ALA BBB CA  
2341 C C   . ALA B 105 ? 0.340 0.305 0.303 -0.029 0.009  -0.037 103 ALA BBB C   
2342 O O   . ALA B 105 ? 0.339 0.302 0.307 -0.030 0.019  -0.034 103 ALA BBB O   
2343 C CB  . ALA B 105 ? 0.356 0.329 0.352 -0.030 0.002  -0.046 103 ALA BBB CB  
2344 N N   . CYS B 106 ? 0.359 0.321 0.309 -0.028 0.003  -0.039 104 CYS BBB N   
2345 C CA  . CYS B 106 ? 0.375 0.333 0.319 -0.029 0.007  -0.039 104 CYS BBB CA  
2346 C C   . CYS B 106 ? 0.373 0.331 0.336 -0.031 0.008  -0.046 104 CYS BBB C   
2347 O O   . CYS B 106 ? 0.428 0.382 0.392 -0.032 0.015  -0.045 104 CYS BBB O   
2348 C CB  . CYS B 106 ? 0.400 0.354 0.325 -0.027 0.001  -0.040 104 CYS BBB CB  
2349 S SG  . CYS B 106 ? 0.413 0.365 0.320 -0.025 0.006  -0.032 104 CYS BBB SG  
2350 N N   . SER B 107 ? 0.354 0.315 0.336 -0.032 0.002  -0.053 105 SER BBB N   
2351 C CA  . SER B 107 ? 0.362 0.325 0.371 -0.034 0.003  -0.061 105 SER BBB CA  
2352 C C   . SER B 107 ? 0.351 0.313 0.377 -0.037 0.018  -0.057 105 SER BBB C   
2353 O O   . SER B 107 ? 0.355 0.316 0.403 -0.040 0.024  -0.061 105 SER BBB O   
2354 C CB  . SER B 107 ? 0.372 0.340 0.397 -0.033 -0.010 -0.072 105 SER BBB CB  
2355 O OG  . SER B 107 ? 0.379 0.351 0.409 -0.032 -0.010 -0.070 105 SER BBB OG  
2356 N N   . ASP B 108 ? 0.368 0.330 0.385 -0.036 0.026  -0.048 106 ASP BBB N   
2357 C CA  . ASP B 108 ? 0.394 0.351 0.420 -0.037 0.042  -0.042 106 ASP BBB CA  
2358 C C   . ASP B 108 ? 0.410 0.358 0.421 -0.035 0.051  -0.036 106 ASP BBB C   
2359 O O   . ASP B 108 ? 0.378 0.326 0.369 -0.034 0.045  -0.035 106 ASP BBB O   
2360 C CB  . ASP B 108 ? 0.405 0.363 0.424 -0.034 0.045  -0.037 106 ASP BBB CB  
2361 C CG  . ASP B 108 ? 0.423 0.389 0.464 -0.035 0.040  -0.043 106 ASP BBB CG  
2362 O OD1 . ASP B 108 ? 0.410 0.380 0.477 -0.038 0.037  -0.052 106 ASP BBB OD1 
2363 O OD2 . ASP B 108 ? 0.440 0.408 0.473 -0.033 0.039  -0.039 106 ASP BBB OD2 
2364 N N   . ASN B 109 ? 0.380 0.548 0.448 0.030  0.030  -0.064 107 ASN BBB N   
2365 C CA  . ASN B 109 ? 0.391 0.517 0.467 0.004  0.041  -0.061 107 ASN BBB CA  
2366 C C   . ASN B 109 ? 0.355 0.425 0.390 0.004  0.048  -0.028 107 ASN BBB C   
2367 O O   . ASN B 109 ? 0.342 0.397 0.363 0.012  0.053  -0.013 107 ASN BBB O   
2368 C CB  . ASN B 109 ? 0.429 0.551 0.551 -0.018 0.060  -0.077 107 ASN BBB CB  
2369 C CG  . ASN B 109 ? 0.472 0.657 0.652 -0.021 0.056  -0.119 107 ASN BBB CG  
2370 O OD1 . ASN B 109 ? 0.532 0.760 0.726 -0.016 0.041  -0.146 107 ASN BBB OD1 
2371 N ND2 . ASN B 109 ? 0.512 0.710 0.728 -0.027 0.069  -0.128 107 ASN BBB ND2 
2372 N N   . PRO B 110 ? 0.368 0.410 0.389 -0.003 0.049  -0.022 108 PRO BBB N   
2373 C CA  . PRO B 110 ? 0.369 0.370 0.364 -0.004 0.054  -0.002 108 PRO BBB CA  
2374 C C   . PRO B 110 ? 0.363 0.340 0.360 -0.010 0.066  0.003  108 PRO BBB C   
2375 O O   . PRO B 110 ? 0.379 0.358 0.399 -0.019 0.077  -0.005 108 PRO BBB O   
2376 C CB  . PRO B 110 ? 0.419 0.407 0.405 -0.009 0.051  -0.002 108 PRO BBB CB  
2377 C CG  . PRO B 110 ? 0.431 0.444 0.441 -0.016 0.049  -0.021 108 PRO BBB CG  
2378 C CD  . PRO B 110 ? 0.416 0.471 0.449 -0.010 0.045  -0.037 108 PRO BBB CD  
2379 N N   . TYR B 111 ? 0.337 0.292 0.313 -0.005 0.068  0.015  109 TYR BBB N   
2380 C CA  . TYR B 111 ? 0.345 0.279 0.311 -0.001 0.077  0.021  109 TYR BBB CA  
2381 C C   . TYR B 111 ? 0.345 0.262 0.291 0.003  0.075  0.022  109 TYR BBB C   
2382 O O   . TYR B 111 ? 0.405 0.306 0.340 0.010  0.086  0.027  109 TYR BBB O   
2383 C CB  . TYR B 111 ? 0.356 0.290 0.315 0.006  0.078  0.025  109 TYR BBB CB  
2384 C CG  . TYR B 111 ? 0.379 0.298 0.327 0.013  0.089  0.030  109 TYR BBB CG  
2385 C CD1 . TYR B 111 ? 0.396 0.301 0.320 0.024  0.087  0.030  109 TYR BBB CD1 
2386 C CD2 . TYR B 111 ? 0.397 0.321 0.361 0.012  0.101  0.032  109 TYR BBB CD2 
2387 C CE1 . TYR B 111 ? 0.429 0.322 0.334 0.038  0.098  0.036  109 TYR BBB CE1 
2388 C CE2 . TYR B 111 ? 0.420 0.326 0.371 0.022  0.116  0.040  109 TYR BBB CE2 
2389 C CZ  . TYR B 111 ? 0.452 0.341 0.368 0.037  0.115  0.044  109 TYR BBB CZ  
2390 O OH  . TYR B 111 ? 0.471 0.344 0.366 0.054  0.130  0.053  109 TYR BBB OH  
2391 N N   . PHE B 112 ? 0.332 0.251 0.274 0.003  0.065  0.017  110 PHE BBB N   
2392 C CA  . PHE B 112 ? 0.335 0.249 0.265 0.009  0.059  0.010  110 PHE BBB CA  
2393 C C   . PHE B 112 ? 0.354 0.272 0.291 0.002  0.054  0.007  110 PHE BBB C   
2394 O O   . PHE B 112 ? 0.318 0.242 0.267 -0.006 0.054  0.007  110 PHE BBB O   
2395 C CB  . PHE B 112 ? 0.330 0.249 0.266 0.011  0.054  -0.003 110 PHE BBB CB  
2396 C CG  . PHE B 112 ? 0.337 0.253 0.269 0.017  0.059  -0.003 110 PHE BBB CG  
2397 C CD1 . PHE B 112 ? 0.360 0.277 0.271 0.033  0.057  -0.008 110 PHE BBB CD1 
2398 C CD2 . PHE B 112 ? 0.334 0.245 0.277 0.012  0.066  0.002  110 PHE BBB CD2 
2399 C CE1 . PHE B 112 ? 0.383 0.298 0.288 0.040  0.061  -0.009 110 PHE BBB CE1 
2400 C CE2 . PHE B 112 ? 0.350 0.257 0.289 0.018  0.071  0.001  110 PHE BBB CE2 
2401 C CZ  . PHE B 112 ? 0.377 0.287 0.299 0.030  0.068  -0.006 110 PHE BBB CZ  
2402 N N   . TRP B 113 ? 0.366 0.280 0.291 0.011  0.053  0.005  111 TRP BBB N   
2403 C CA  . TRP B 113 ? 0.380 0.295 0.310 0.006  0.050  0.003  111 TRP BBB CA  
2404 C C   . TRP B 113 ? 0.388 0.312 0.312 0.016  0.040  -0.010 111 TRP BBB C   
2405 O O   . TRP B 113 ? 0.397 0.327 0.303 0.035  0.037  -0.014 111 TRP BBB O   
2406 C CB  . TRP B 113 ? 0.393 0.293 0.317 0.008  0.063  0.012  111 TRP BBB CB  
2407 C CG  . TRP B 113 ? 0.386 0.286 0.331 -0.005 0.073  0.013  111 TRP BBB CG  
2408 C CD1 . TRP B 113 ? 0.418 0.312 0.368 -0.004 0.087  0.018  111 TRP BBB CD1 
2409 C CD2 . TRP B 113 ? 0.381 0.296 0.348 -0.019 0.071  0.004  111 TRP BBB CD2 
2410 N NE1 . TRP B 113 ? 0.421 0.329 0.402 -0.019 0.092  0.009  111 TRP BBB NE1 
2411 C CE2 . TRP B 113 ? 0.391 0.315 0.382 -0.026 0.080  -0.001 111 TRP BBB CE2 
2412 C CE3 . TRP B 113 ? 0.394 0.319 0.365 -0.024 0.061  -0.003 111 TRP BBB CE3 
2413 C CZ2 . TRP B 113 ? 0.404 0.354 0.423 -0.036 0.077  -0.019 111 TRP BBB CZ2 
2414 C CZ3 . TRP B 113 ? 0.383 0.328 0.374 -0.032 0.059  -0.015 111 TRP BBB CZ3 
2415 C CH2 . TRP B 113 ? 0.383 0.345 0.399 -0.037 0.065  -0.026 111 TRP BBB CH2 
2416 N N   . GLY B 114 ? 0.355 0.287 0.295 0.007  0.036  -0.017 112 GLY BBB N   
2417 C CA  . GLY B 114 ? 0.351 0.298 0.294 0.015  0.027  -0.033 112 GLY BBB CA  
2418 C C   . GLY B 114 ? 0.369 0.309 0.289 0.030  0.028  -0.024 112 GLY BBB C   
2419 O O   . GLY B 114 ? 0.377 0.296 0.289 0.028  0.041  -0.007 112 GLY BBB O   
2420 N N   . GLN B 115 ? 0.393 0.351 0.308 0.048  0.019  -0.037 113 GLN BBB N   
2421 C CA  . GLN B 115 ? 0.447 0.398 0.334 0.072  0.023  -0.026 113 GLN BBB CA  
2422 C C   . GLN B 115 ? 0.411 0.347 0.311 0.055  0.031  -0.018 113 GLN BBB C   
2423 O O   . GLN B 115 ? 0.465 0.379 0.346 0.067  0.044  -0.004 113 GLN BBB O   
2424 C CB  . GLN B 115 ? 0.492 0.479 0.369 0.103  0.007  -0.046 113 GLN BBB CB  
2425 C CG  . GLN B 115 ? 0.610 0.613 0.462 0.131  0.000  -0.053 113 GLN BBB CG  
2426 C CD  . GLN B 115 ? 0.695 0.739 0.524 0.175  -0.016 -0.073 113 GLN BBB CD  
2427 O OE1 . GLN B 115 ? 0.783 0.856 0.630 0.178  -0.029 -0.093 113 GLN BBB OE1 
2428 N NE2 . GLN B 115 ? 0.812 0.864 0.599 0.214  -0.018 -0.070 113 GLN BBB NE2 
2429 N N   . GLY B 116 ? 0.354 0.298 0.282 0.031  0.026  -0.028 114 GLY BBB N   
2430 C CA  . GLY B 116 ? 0.347 0.282 0.286 0.016  0.031  -0.024 114 GLY BBB CA  
2431 C C   . GLY B 116 ? 0.363 0.316 0.313 0.020  0.024  -0.037 114 GLY BBB C   
2432 O O   . GLY B 116 ? 0.359 0.331 0.302 0.041  0.016  -0.048 114 GLY BBB O   
2433 N N   . THR B 117 ? 0.325 0.277 0.291 0.004  0.028  -0.038 115 THR BBB N   
2434 C CA  A THR B 117 ? 0.344 0.310 0.327 0.004  0.026  -0.051 115 THR BBB CA  
2435 C CA  B THR B 117 ? 0.332 0.298 0.315 0.004  0.026  -0.051 115 THR BBB CA  
2436 C C   . THR B 117 ? 0.332 0.284 0.308 0.000  0.032  -0.041 115 THR BBB C   
2437 O O   . THR B 117 ? 0.310 0.252 0.284 -0.011 0.038  -0.034 115 THR BBB O   
2438 C CB  A THR B 117 ? 0.349 0.327 0.365 -0.009 0.031  -0.064 115 THR BBB CB  
2439 C CB  B THR B 117 ? 0.322 0.298 0.337 -0.010 0.031  -0.062 115 THR BBB CB  
2440 O OG1 A THR B 117 ? 0.387 0.380 0.425 -0.009 0.032  -0.078 115 THR BBB OG1 
2441 O OG1 B THR B 117 ? 0.315 0.303 0.342 -0.008 0.027  -0.074 115 THR BBB OG1 
2442 C CG2 A THR B 117 ? 0.358 0.317 0.372 -0.021 0.044  -0.049 115 THR BBB CG2 
2443 C CG2 B THR B 117 ? 0.335 0.328 0.379 -0.012 0.034  -0.079 115 THR BBB CG2 
2444 N N   . GLN B 118 ? 0.343 0.299 0.315 0.012  0.030  -0.045 116 GLN BBB N   
2445 C CA  . GLN B 118 ? 0.338 0.280 0.305 0.009  0.038  -0.040 116 GLN BBB CA  
2446 C C   . GLN B 118 ? 0.336 0.287 0.321 -0.004 0.040  -0.045 116 GLN BBB C   
2447 O O   . GLN B 118 ? 0.331 0.299 0.337 -0.003 0.039  -0.057 116 GLN BBB O   
2448 C CB  . GLN B 118 ? 0.366 0.309 0.322 0.030  0.038  -0.040 116 GLN BBB CB  
2449 C CG  . GLN B 118 ? 0.374 0.298 0.326 0.028  0.048  -0.035 116 GLN BBB CG  
2450 C CD  . GLN B 118 ? 0.392 0.286 0.338 0.020  0.063  -0.027 116 GLN BBB CD  
2451 O OE1 . GLN B 118 ? 0.423 0.299 0.356 0.030  0.072  -0.018 116 GLN BBB OE1 
2452 N NE2 . GLN B 118 ? 0.392 0.283 0.348 0.003  0.067  -0.035 116 GLN BBB NE2 
2453 N N   . VAL B 119 ? 0.341 0.282 0.319 -0.012 0.046  -0.040 117 VAL BBB N   
2454 C CA  . VAL B 119 ? 0.335 0.278 0.316 -0.015 0.053  -0.042 117 VAL BBB CA  
2455 C C   . VAL B 119 ? 0.342 0.279 0.316 -0.013 0.054  -0.045 117 VAL BBB C   
2456 O O   . VAL B 119 ? 0.333 0.263 0.300 -0.016 0.054  -0.047 117 VAL BBB O   
2457 C CB  . VAL B 119 ? 0.335 0.279 0.309 -0.016 0.058  -0.035 117 VAL BBB CB  
2458 C CG1 . VAL B 119 ? 0.380 0.326 0.345 -0.010 0.067  -0.033 117 VAL BBB CG1 
2459 C CG2 . VAL B 119 ? 0.339 0.283 0.325 -0.019 0.063  -0.032 117 VAL BBB CG2 
2460 N N   . THR B 120 ? 0.348 0.289 0.328 -0.009 0.058  -0.048 118 THR BBB N   
2461 C CA  . THR B 120 ? 0.382 0.315 0.355 -0.006 0.061  -0.052 118 THR BBB CA  
2462 C C   . THR B 120 ? 0.376 0.316 0.348 -0.005 0.068  -0.054 118 THR BBB C   
2463 O O   . THR B 120 ? 0.385 0.332 0.371 -0.003 0.074  -0.053 118 THR BBB O   
2464 C CB  . THR B 120 ? 0.416 0.344 0.392 0.005  0.062  -0.052 118 THR BBB CB  
2465 O OG1 . THR B 120 ? 0.406 0.325 0.374 0.011  0.060  -0.046 118 THR BBB OG1 
2466 C CG2 . THR B 120 ? 0.441 0.354 0.411 0.008  0.070  -0.055 118 THR BBB CG2 
2467 N N   . VAL B 121 ? 0.375 0.317 0.333 -0.004 0.068  -0.059 119 VAL BBB N   
2468 C CA  . VAL B 121 ? 0.400 0.350 0.345 0.005  0.075  -0.060 119 VAL BBB CA  
2469 C C   . VAL B 121 ? 0.400 0.347 0.345 0.007  0.076  -0.072 119 VAL BBB C   
2470 O O   . VAL B 121 ? 0.408 0.356 0.355 0.002  0.071  -0.088 119 VAL BBB O   
2471 C CB  . VAL B 121 ? 0.397 0.362 0.320 0.015  0.072  -0.061 119 VAL BBB CB  
2472 C CG1 . VAL B 121 ? 0.413 0.385 0.312 0.035  0.082  -0.057 119 VAL BBB CG1 
2473 C CG2 . VAL B 121 ? 0.393 0.355 0.317 0.014  0.072  -0.048 119 VAL BBB CG2 
2474 N N   . SER B 122 ? 0.434 0.378 0.383 0.011  0.085  -0.068 120 SER BBB N   
2475 C CA  . SER B 122 ? 0.457 0.396 0.406 0.014  0.088  -0.079 120 SER BBB CA  
2476 C C   . SER B 122 ? 0.495 0.446 0.422 0.025  0.090  -0.088 120 SER BBB C   
2477 O O   . SER B 122 ? 0.529 0.488 0.439 0.037  0.097  -0.077 120 SER BBB O   
2478 C CB  . SER B 122 ? 0.482 0.418 0.446 0.017  0.095  -0.073 120 SER BBB CB  
2479 O OG  . SER B 122 ? 0.527 0.471 0.497 0.020  0.106  -0.065 120 SER BBB OG  
2480 N N   . SER B 123 ? 0.515 0.468 0.443 0.024  0.088  -0.109 121 SER BBB N   
2481 C CA  . SER B 123 ? 0.530 0.503 0.437 0.039  0.087  -0.126 121 SER BBB CA  
2482 C C   . SER B 123 ? 0.554 0.520 0.452 0.050  0.100  -0.116 121 SER BBB C   
2483 O O   . SER B 123 ? 0.515 0.463 0.431 0.042  0.108  -0.104 121 SER BBB O   
2484 C CB  . SER B 123 ? 0.564 0.543 0.487 0.031  0.082  -0.161 121 SER BBB CB  
2485 O OG  . SER B 123 ? 0.611 0.616 0.516 0.047  0.079  -0.183 121 SER BBB OG  
2486 N N   . HIS B 124 ? 0.580 0.563 0.448 0.071  0.104  -0.120 122 HIS BBB N   
2487 C CA  . HIS B 124 ? 0.629 0.606 0.484 0.085  0.119  -0.114 122 HIS BBB CA  
2488 C C   . HIS B 124 ? 0.620 0.601 0.483 0.082  0.114  -0.143 122 HIS BBB C   
2489 O O   . HIS B 124 ? 0.659 0.632 0.518 0.090  0.126  -0.139 122 HIS BBB O   
2490 C CB  . HIS B 124 ? 0.662 0.653 0.474 0.117  0.130  -0.101 122 HIS BBB CB  
2491 C CG  . HIS B 124 ? 0.669 0.645 0.478 0.121  0.147  -0.070 122 HIS BBB CG  
2492 N ND1 . HIS B 124 ? 0.678 0.632 0.523 0.104  0.164  -0.052 122 HIS BBB ND1 
2493 C CD2 . HIS B 124 ? 0.686 0.669 0.466 0.140  0.150  -0.056 122 HIS BBB CD2 
2494 C CE1 . HIS B 124 ? 0.674 0.617 0.517 0.108  0.180  -0.031 122 HIS BBB CE1 
2495 N NE2 . HIS B 124 ? 0.681 0.638 0.482 0.132  0.174  -0.030 122 HIS BBB NE2 
2496 N N   . ASN C 5   ? 0.854 0.507 0.730 0.150  -0.015 -0.106 334 ASN EEE N   
2497 C CA  . ASN C 5   ? 0.811 0.528 0.720 0.151  0.018  -0.095 334 ASN EEE CA  
2498 C C   . ASN C 5   ? 0.700 0.457 0.650 0.115  0.013  -0.086 334 ASN EEE C   
2499 O O   . ASN C 5   ? 0.631 0.409 0.615 0.099  0.009  -0.076 334 ASN EEE O   
2500 C CB  . ASN C 5   ? 0.823 0.574 0.768 0.168  0.038  -0.086 334 ASN EEE CB  
2501 C CG  . ASN C 5   ? 0.839 0.645 0.824 0.176  0.071  -0.075 334 ASN EEE CG  
2502 O OD1 . ASN C 5   ? 0.827 0.663 0.831 0.156  0.076  -0.070 334 ASN EEE OD1 
2503 N ND2 . ASN C 5   ? 0.883 0.703 0.889 0.206  0.096  -0.070 334 ASN EEE ND2 
2504 N N   . LEU C 6   ? 0.673 0.433 0.612 0.108  0.013  -0.088 335 LEU EEE N   
2505 C CA  . LEU C 6   ? 0.629 0.416 0.601 0.077  0.004  -0.082 335 LEU EEE CA  
2506 C C   . LEU C 6   ? 0.532 0.375 0.541 0.068  0.026  -0.069 335 LEU EEE C   
2507 O O   . LEU C 6   ? 0.500 0.363 0.510 0.082  0.047  -0.067 335 LEU EEE O   
2508 C CB  . LEU C 6   ? 0.701 0.465 0.644 0.078  -0.009 -0.092 335 LEU EEE CB  
2509 C CG  . LEU C 6   ? 0.812 0.508 0.713 0.088  -0.044 -0.109 335 LEU EEE CG  
2510 C CD1 . LEU C 6   ? 0.860 0.530 0.729 0.092  -0.065 -0.120 335 LEU EEE CD1 
2511 C CD2 . LEU C 6   ? 0.841 0.525 0.786 0.063  -0.070 -0.105 335 LEU EEE CD2 
2512 N N   . CYS C 7   ? 0.472 0.333 0.509 0.048  0.022  -0.059 336 CYS EEE N   
2513 C CA  . CYS C 7   ? 0.417 0.315 0.478 0.042  0.032  -0.050 336 CYS EEE CA  
2514 C C   . CYS C 7   ? 0.406 0.325 0.468 0.038  0.041  -0.051 336 CYS EEE C   
2515 O O   . CYS C 7   ? 0.406 0.313 0.456 0.031  0.035  -0.055 336 CYS EEE O   
2516 C CB  . CYS C 7   ? 0.415 0.310 0.480 0.029  0.029  -0.039 336 CYS EEE CB  
2517 S SG  . CYS C 7   ? 0.444 0.307 0.498 0.038  0.022  -0.034 336 CYS EEE SG  
2518 N N   . PRO C 8   ? 0.390 0.337 0.472 0.042  0.053  -0.046 337 PRO EEE N   
2519 C CA  . PRO C 8   ? 0.391 0.352 0.473 0.039  0.064  -0.045 337 PRO EEE CA  
2520 C C   . PRO C 8   ? 0.380 0.351 0.466 0.022  0.057  -0.041 337 PRO EEE C   
2521 O O   . PRO C 8   ? 0.387 0.376 0.490 0.018  0.061  -0.037 337 PRO EEE O   
2522 C CB  . PRO C 8   ? 0.392 0.378 0.510 0.047  0.080  -0.037 337 PRO EEE CB  
2523 C CG  . PRO C 8   ? 0.389 0.383 0.537 0.046  0.063  -0.036 337 PRO EEE CG  
2524 C CD  . PRO C 8   ? 0.393 0.358 0.507 0.049  0.052  -0.042 337 PRO EEE CD  
2525 N N   . PHE C 9   ? 0.373 0.332 0.449 0.014  0.048  -0.042 338 PHE EEE N   
2526 C CA  . PHE C 9   ? 0.367 0.334 0.447 0.004  0.047  -0.037 338 PHE EEE CA  
2527 C C   . PHE C 9   ? 0.351 0.325 0.425 0.003  0.049  -0.040 338 PHE EEE C   
2528 O O   . PHE C 9   ? 0.361 0.346 0.437 -0.001 0.052  -0.036 338 PHE EEE O   
2529 C CB  . PHE C 9   ? 0.379 0.336 0.470 -0.003 0.045  -0.031 338 PHE EEE CB  
2530 C CG  . PHE C 9   ? 0.431 0.375 0.517 -0.000 0.049  -0.022 338 PHE EEE CG  
2531 C CD1 . PHE C 9   ? 0.442 0.384 0.510 0.008  0.050  -0.019 338 PHE EEE CD1 
2532 C CD2 . PHE C 9   ? 0.488 0.414 0.584 -0.004 0.048  -0.017 338 PHE EEE CD2 
2533 C CE1 . PHE C 9   ? 0.501 0.418 0.547 0.016  0.050  -0.012 338 PHE EEE CE1 
2534 C CE2 . PHE C 9   ? 0.523 0.428 0.604 0.002  0.054  -0.006 338 PHE EEE CE2 
2535 C CZ  . PHE C 9   ? 0.523 0.421 0.572 0.015  0.055  -0.004 338 PHE EEE CZ  
2536 N N   . GLY C 10  ? 0.371 0.329 0.425 0.011  0.047  -0.047 339 GLY EEE N   
2537 C CA  . GLY C 10  ? 0.386 0.339 0.419 0.016  0.050  -0.050 339 GLY EEE CA  
2538 C C   . GLY C 10  ? 0.349 0.320 0.391 0.014  0.066  -0.041 339 GLY EEE C   
2539 O O   . GLY C 10  ? 0.335 0.309 0.373 0.010  0.065  -0.039 339 GLY EEE O   
2540 N N   . GLU C 11  ? 0.355 0.337 0.418 0.017  0.079  -0.036 340 GLU EEE N   
2541 C CA  . GLU C 11  ? 0.368 0.369 0.462 0.013  0.090  -0.026 340 GLU EEE CA  
2542 C C   . GLU C 11  ? 0.334 0.341 0.439 0.001  0.072  -0.026 340 GLU EEE C   
2543 O O   . GLU C 11  ? 0.345 0.355 0.462 -0.004 0.073  -0.021 340 GLU EEE O   
2544 C CB  . GLU C 11  ? 0.389 0.405 0.525 0.018  0.099  -0.020 340 GLU EEE CB  
2545 C CG  . GLU C 11  ? 0.483 0.490 0.607 0.037  0.127  -0.014 340 GLU EEE CG  
2546 C CD  . GLU C 11  ? 0.519 0.544 0.690 0.046  0.137  -0.009 340 GLU EEE CD  
2547 O OE1 . GLU C 11  ? 0.483 0.533 0.712 0.035  0.120  -0.006 340 GLU EEE OE1 
2548 O OE2 . GLU C 11  ? 0.583 0.590 0.726 0.068  0.156  -0.009 340 GLU EEE OE2 
2549 N N   . VAL C 12  ? 0.317 0.320 0.413 -0.001 0.059  -0.030 341 VAL EEE N   
2550 C CA  . VAL C 12  ? 0.316 0.311 0.403 -0.003 0.047  -0.029 341 VAL EEE CA  
2551 C C   . VAL C 12  ? 0.301 0.292 0.367 -0.004 0.051  -0.029 341 VAL EEE C   
2552 O O   . VAL C 12  ? 0.322 0.308 0.380 -0.004 0.047  -0.029 341 VAL EEE O   
2553 C CB  . VAL C 12  ? 0.340 0.321 0.414 0.003  0.040  -0.029 341 VAL EEE CB  
2554 C CG1 . VAL C 12  ? 0.379 0.338 0.421 0.010  0.033  -0.027 341 VAL EEE CG1 
2555 C CG2 . VAL C 12  ? 0.368 0.351 0.464 0.006  0.029  -0.031 341 VAL EEE CG2 
2556 N N   . PHE C 13  ? 0.281 0.274 0.346 -0.003 0.054  -0.030 342 PHE EEE N   
2557 C CA  . PHE C 13  ? 0.283 0.279 0.348 -0.003 0.056  -0.028 342 PHE EEE CA  
2558 C C   . PHE C 13  ? 0.293 0.287 0.348 -0.002 0.052  -0.032 342 PHE EEE C   
2559 O O   . PHE C 13  ? 0.293 0.288 0.346 0.001  0.051  -0.031 342 PHE EEE O   
2560 C CB  . PHE C 13  ? 0.272 0.272 0.362 -0.006 0.055  -0.026 342 PHE EEE CB  
2561 C CG  . PHE C 13  ? 0.272 0.268 0.368 -0.004 0.066  -0.015 342 PHE EEE CG  
2562 C CD1 . PHE C 13  ? 0.291 0.277 0.380 -0.004 0.065  -0.015 342 PHE EEE CD1 
2563 C CD2 . PHE C 13  ? 0.285 0.283 0.386 0.003  0.082  -0.003 342 PHE EEE CD2 
2564 C CE1 . PHE C 13  ? 0.301 0.272 0.382 0.002  0.077  -0.003 342 PHE EEE CE1 
2565 C CE2 . PHE C 13  ? 0.302 0.286 0.396 0.010  0.101  0.012  342 PHE EEE CE2 
2566 C CZ  . PHE C 13  ? 0.313 0.281 0.394 0.009  0.097  0.011  342 PHE EEE CZ  
2567 N N   . ASN C 14  ? 0.316 0.303 0.360 -0.000 0.054  -0.036 343 ASN EEE N   
2568 C CA  . ASN C 14  ? 0.349 0.320 0.366 0.007  0.053  -0.038 343 ASN EEE CA  
2569 C C   . ASN C 14  ? 0.361 0.327 0.373 0.007  0.069  -0.030 343 ASN EEE C   
2570 O O   . ASN C 14  ? 0.398 0.343 0.379 0.016  0.077  -0.028 343 ASN EEE O   
2571 C CB  . ASN C 14  ? 0.401 0.349 0.395 0.016  0.045  -0.046 343 ASN EEE CB  
2572 C CG  . ASN C 14  ? 0.442 0.389 0.453 0.015  0.019  -0.053 343 ASN EEE CG  
2573 O OD1 . ASN C 14  ? 0.414 0.377 0.450 0.010  0.015  -0.050 343 ASN EEE OD1 
2574 N ND2 . ASN C 14  ? 0.510 0.437 0.515 0.019  0.003  -0.062 343 ASN EEE ND2 
2575 N N   . ALA C 15  ? 0.325 0.305 0.366 -0.002 0.071  -0.025 344 ALA EEE N   
2576 C CA  . ALA C 15  ? 0.319 0.298 0.379 -0.007 0.080  -0.015 344 ALA EEE CA  
2577 C C   . ALA C 15  ? 0.322 0.283 0.356 -0.006 0.080  -0.013 344 ALA EEE C   
2578 O O   . ALA C 15  ? 0.313 0.269 0.329 -0.003 0.066  -0.020 344 ALA EEE O   
2579 C CB  . ALA C 15  ? 0.312 0.299 0.408 -0.015 0.065  -0.015 344 ALA EEE CB  
2580 N N   . THR C 16  ? 0.344 0.292 0.377 -0.004 0.099  -0.001 345 THR EEE N   
2581 C CA  A THR C 16  ? 0.369 0.292 0.372 -0.001 0.100  0.004  345 THR EEE CA  
2582 C CA  B THR C 16  ? 0.382 0.305 0.385 -0.001 0.100  0.004  345 THR EEE CA  
2583 C C   . THR C 16  ? 0.371 0.292 0.393 -0.012 0.080  0.002  345 THR EEE C   
2584 O O   . THR C 16  ? 0.382 0.288 0.371 -0.006 0.067  -0.005 345 THR EEE O   
2585 C CB  A THR C 16  ? 0.402 0.305 0.400 0.004  0.133  0.023  345 THR EEE CB  
2586 C CB  B THR C 16  ? 0.430 0.334 0.429 0.004  0.133  0.023  345 THR EEE CB  
2587 O OG1 A THR C 16  ? 0.420 0.310 0.376 0.023  0.149  0.021  345 THR EEE OG1 
2588 O OG1 B THR C 16  ? 0.438 0.364 0.511 -0.011 0.143  0.036  345 THR EEE OG1 
2589 C CG2 A THR C 16  ? 0.431 0.302 0.396 0.007  0.136  0.031  345 THR EEE CG2 
2590 C CG2 B THR C 16  ? 0.465 0.350 0.416 0.025  0.154  0.024  345 THR EEE CG2 
2591 N N   . ARG C 17  ? 0.373 0.305 0.447 -0.025 0.073  0.006  346 ARG EEE N   
2592 C CA  . ARG C 17  ? 0.420 0.335 0.504 -0.032 0.043  0.002  346 ARG EEE CA  
2593 C C   . ARG C 17  ? 0.381 0.304 0.473 -0.031 0.020  -0.010 346 ARG EEE C   
2594 O O   . ARG C 17  ? 0.340 0.286 0.463 -0.033 0.027  -0.008 346 ARG EEE O   
2595 C CB  . ARG C 17  ? 0.475 0.380 0.615 -0.048 0.043  0.017  346 ARG EEE CB  
2596 C CG  . ARG C 17  ? 0.554 0.427 0.666 -0.048 0.047  0.024  346 ARG EEE CG  
2597 C CD  . ARG C 17  ? 0.622 0.480 0.801 -0.067 0.039  0.040  346 ARG EEE CD  
2598 N NE  . ARG C 17  ? 0.668 0.555 0.925 -0.077 0.071  0.062  346 ARG EEE NE  
2599 C CZ  . ARG C 17  ? 0.729 0.617 0.976 -0.070 0.121  0.083  346 ARG EEE CZ  
2600 N NH1 . ARG C 17  ? 0.769 0.630 0.929 -0.053 0.137  0.081  346 ARG EEE NH1 
2601 N NH2 . ARG C 17  ? 0.737 0.651 1.060 -0.075 0.156  0.107  346 ARG EEE NH2 
2602 N N   . PHE C 18  ? 0.348 0.271 0.256 0.000  0.052  -0.010 347 PHE EEE N   
2603 C CA  . PHE C 18  ? 0.302 0.248 0.241 0.001  0.047  -0.008 347 PHE EEE CA  
2604 C C   . PHE C 18  ? 0.288 0.246 0.245 0.003  0.052  -0.007 347 PHE EEE C   
2605 O O   . PHE C 18  ? 0.308 0.259 0.257 0.002  0.055  -0.006 347 PHE EEE O   
2606 C CB  . PHE C 18  ? 0.291 0.248 0.233 0.002  0.033  -0.006 347 PHE EEE CB  
2607 C CG  . PHE C 18  ? 0.299 0.252 0.240 0.001  0.028  -0.007 347 PHE EEE CG  
2608 C CD1 . PHE C 18  ? 0.323 0.256 0.244 -0.000 0.031  -0.011 347 PHE EEE CD1 
2609 C CD2 . PHE C 18  ? 0.298 0.266 0.256 0.001  0.022  -0.005 347 PHE EEE CD2 
2610 C CE1 . PHE C 18  ? 0.327 0.256 0.248 -0.001 0.025  -0.012 347 PHE EEE CE1 
2611 C CE2 . PHE C 18  ? 0.303 0.268 0.263 -0.000 0.017  -0.005 347 PHE EEE CE2 
2612 C CZ  . PHE C 18  ? 0.310 0.256 0.253 -0.002 0.018  -0.009 347 PHE EEE CZ  
2613 N N   . ALA C 19  ? 0.287 0.259 0.268 0.004  0.050  -0.006 348 ALA EEE N   
2614 C CA  . ALA C 19  ? 0.272 0.255 0.273 0.005  0.049  -0.005 348 ALA EEE CA  
2615 C C   . ALA C 19  ? 0.263 0.253 0.260 0.006  0.040  -0.002 348 ALA EEE C   
2616 O O   . ALA C 19  ? 0.238 0.232 0.228 0.007  0.033  -0.000 348 ALA EEE O   
2617 C CB  . ALA C 19  ? 0.277 0.268 0.300 0.006  0.047  -0.006 348 ALA EEE CB  
2618 N N   . SER C 20  ? 0.245 0.239 0.251 0.007  0.040  -0.002 349 SER EEE N   
2619 C CA  . SER C 20  ? 0.230 0.232 0.237 0.010  0.031  0.000  349 SER EEE CA  
2620 C C   . SER C 20  ? 0.220 0.228 0.236 0.011  0.024  0.001  349 SER EEE C   
2621 O O   . SER C 20  ? 0.231 0.240 0.261 0.011  0.026  0.000  349 SER EEE O   
2622 C CB  . SER C 20  ? 0.248 0.250 0.263 0.010  0.031  0.000  349 SER EEE CB  
2623 O OG  . SER C 20  ? 0.256 0.249 0.257 0.008  0.036  0.000  349 SER EEE OG  
2624 N N   . VAL C 21  ? 0.205 0.217 0.213 0.013  0.019  0.004  350 VAL EEE N   
2625 C CA  . VAL C 21  ? 0.209 0.223 0.219 0.015  0.014  0.006  350 VAL EEE CA  
2626 C C   . VAL C 21  ? 0.206 0.219 0.227 0.017  0.008  0.005  350 VAL EEE C   
2627 O O   . VAL C 21  ? 0.217 0.229 0.244 0.017  0.005  0.006  350 VAL EEE O   
2628 C CB  . VAL C 21  ? 0.203 0.220 0.203 0.017  0.012  0.008  350 VAL EEE CB  
2629 C CG1 . VAL C 21  ? 0.200 0.216 0.194 0.019  0.009  0.008  350 VAL EEE CG1 
2630 C CG2 . VAL C 21  ? 0.216 0.233 0.215 0.017  0.010  0.011  350 VAL EEE CG2 
2631 N N   . TYR C 22  ? 0.220 0.232 0.244 0.018  0.006  0.004  351 TYR EEE N   
2632 C CA  . TYR C 22  ? 0.208 0.217 0.245 0.019  -0.002 0.003  351 TYR EEE CA  
2633 C C   . TYR C 22  ? 0.225 0.235 0.285 0.018  -0.000 0.001  351 TYR EEE C   
2634 O O   . TYR C 22  ? 0.227 0.234 0.298 0.019  -0.009 0.000  351 TYR EEE O   
2635 C CB  . TYR C 22  ? 0.224 0.230 0.262 0.020  -0.006 0.001  351 TYR EEE CB  
2636 C CG  . TYR C 22  ? 0.224 0.233 0.281 0.017  0.000  -0.001 351 TYR EEE CG  
2637 C CD1 . TYR C 22  ? 0.223 0.231 0.273 0.015  0.011  -0.001 351 TYR EEE CD1 
2638 C CD2 . TYR C 22  ? 0.219 0.227 0.302 0.017  -0.005 -0.003 351 TYR EEE CD2 
2639 C CE1 . TYR C 22  ? 0.235 0.242 0.300 0.012  0.019  -0.003 351 TYR EEE CE1 
2640 C CE2 . TYR C 22  ? 0.220 0.229 0.324 0.014  0.004  -0.005 351 TYR EEE CE2 
2641 C CZ  . TYR C 22  ? 0.228 0.236 0.322 0.012  0.017  -0.005 351 TYR EEE CZ  
2642 O OH  . TYR C 22  ? 0.247 0.254 0.361 0.009  0.027  -0.006 351 TYR EEE OH  
2643 N N   . ALA C 23  ? 0.215 0.227 0.280 0.015  0.012  -0.001 352 ALA EEE N   
2644 C CA  . ALA C 23  ? 0.208 0.219 0.294 0.013  0.018  -0.003 352 ALA EEE CA  
2645 C C   . ALA C 23  ? 0.206 0.217 0.284 0.013  0.024  -0.003 352 ALA EEE C   
2646 O O   . ALA C 23  ? 0.214 0.221 0.296 0.011  0.036  -0.006 352 ALA EEE O   
2647 C CB  . ALA C 23  ? 0.222 0.231 0.318 0.011  0.029  -0.005 352 ALA EEE CB  
2648 N N   . TRP C 24  ? 0.200 0.211 0.266 0.014  0.017  -0.001 353 TRP EEE N   
2649 C CA  . TRP C 24  ? 0.218 0.228 0.274 0.012  0.021  0.000  353 TRP EEE CA  
2650 C C   . TRP C 24  ? 0.217 0.224 0.290 0.012  0.027  -0.003 353 TRP EEE C   
2651 O O   . TRP C 24  ? 0.228 0.236 0.322 0.014  0.023  -0.004 353 TRP EEE O   
2652 C CB  . TRP C 24  ? 0.216 0.226 0.262 0.014  0.013  0.004  353 TRP EEE CB  
2653 C CG  . TRP C 24  ? 0.210 0.218 0.263 0.016  0.003  0.005  353 TRP EEE CG  
2654 C CD1 . TRP C 24  ? 0.223 0.228 0.270 0.019  -0.005 0.007  353 TRP EEE CD1 
2655 C CD2 . TRP C 24  ? 0.229 0.234 0.293 0.017  -0.001 0.006  353 TRP EEE CD2 
2656 N NE1 . TRP C 24  ? 0.246 0.244 0.297 0.021  -0.015 0.008  353 TRP EEE NE1 
2657 C CE2 . TRP C 24  ? 0.246 0.244 0.308 0.020  -0.013 0.008  353 TRP EEE CE2 
2658 C CE3 . TRP C 24  ? 0.243 0.247 0.316 0.016  0.003  0.005  353 TRP EEE CE3 
2659 C CZ2 . TRP C 24  ? 0.260 0.251 0.330 0.022  -0.022 0.009  353 TRP EEE CZ2 
2660 C CZ3 . TRP C 24  ? 0.261 0.260 0.344 0.018  -0.004 0.006  353 TRP EEE CZ3 
2661 C CH2 . TRP C 24  ? 0.278 0.271 0.360 0.020  -0.017 0.008  353 TRP EEE CH2 
2662 N N   . ASN C 25  ? 0.243 0.245 0.305 0.010  0.035  -0.005 354 ASN EEE N   
2663 C CA  . ASN C 25  ? 0.263 0.260 0.336 0.010  0.043  -0.009 354 ASN EEE CA  
2664 C C   . ASN C 25  ? 0.246 0.244 0.325 0.010  0.036  -0.007 354 ASN EEE C   
2665 O O   . ASN C 25  ? 0.252 0.250 0.315 0.010  0.030  -0.004 354 ASN EEE O   
2666 C CB  . ASN C 25  ? 0.293 0.279 0.347 0.007  0.054  -0.011 354 ASN EEE CB  
2667 C CG  . ASN C 25  ? 0.374 0.352 0.439 0.008  0.066  -0.016 354 ASN EEE CG  
2668 O OD1 . ASN C 25  ? 0.473 0.450 0.553 0.008  0.076  -0.018 354 ASN EEE OD1 
2669 N ND2 . ASN C 25  ? 0.392 0.364 0.451 0.008  0.066  -0.018 354 ASN EEE ND2 
2670 N N   . ARG C 26  ? 0.256 0.252 0.356 0.012  0.038  -0.010 355 ARG EEE N   
2671 C CA  . ARG C 26  ? 0.247 0.241 0.352 0.013  0.033  -0.009 355 ARG EEE CA  
2672 C C   . ARG C 26  ? 0.291 0.278 0.404 0.013  0.045  -0.014 355 ARG EEE C   
2673 O O   . ARG C 26  ? 0.296 0.282 0.430 0.014  0.054  -0.018 355 ARG EEE O   
2674 C CB  . ARG C 26  ? 0.271 0.268 0.396 0.016  0.021  -0.007 355 ARG EEE CB  
2675 C CG  . ARG C 26  ? 0.273 0.266 0.406 0.017  0.017  -0.006 355 ARG EEE CG  
2676 C CD  . ARG C 26  ? 0.283 0.274 0.422 0.019  0.001  -0.002 355 ARG EEE CD  
2677 N NE  . ARG C 26  ? 0.280 0.269 0.392 0.018  -0.005 0.004  355 ARG EEE NE  
2678 C CZ  . ARG C 26  ? 0.315 0.297 0.419 0.020  -0.017 0.009  355 ARG EEE CZ  
2679 N NH1 . ARG C 26  ? 0.339 0.315 0.460 0.023  -0.027 0.009  355 ARG EEE NH1 
2680 N NH2 . ARG C 26  ? 0.323 0.303 0.403 0.018  -0.018 0.014  355 ARG EEE NH2 
2681 N N   . LYS C 27  ? 0.286 0.266 0.385 0.012  0.045  -0.015 356 LYS EEE N   
2682 C CA  . LYS C 27  ? 0.304 0.275 0.408 0.012  0.055  -0.020 356 LYS EEE CA  
2683 C C   . LYS C 27  ? 0.297 0.267 0.411 0.013  0.046  -0.019 356 LYS EEE C   
2684 O O   . LYS C 27  ? 0.277 0.247 0.377 0.011  0.036  -0.014 356 LYS EEE O   
2685 C CB  . LYS C 27  ? 0.344 0.301 0.419 0.010  0.063  -0.024 356 LYS EEE CB  
2686 C CG  . LYS C 27  ? 0.386 0.329 0.461 0.011  0.073  -0.030 356 LYS EEE CG  
2687 C CD  . LYS C 27  ? 0.457 0.382 0.502 0.009  0.085  -0.035 356 LYS EEE CD  
2688 C CE  . LYS C 27  ? 0.476 0.383 0.518 0.011  0.097  -0.041 356 LYS EEE CE  
2689 N NZ  . LYS C 27  ? 0.509 0.417 0.576 0.013  0.114  -0.045 356 LYS EEE NZ  
2690 N N   . ARG C 28  ? 0.315 0.283 0.455 0.016  0.048  -0.022 357 ARG EEE N   
2691 C CA  . ARG C 28  ? 0.313 0.278 0.464 0.018  0.040  -0.021 357 ARG EEE CA  
2692 C C   . ARG C 28  ? 0.319 0.272 0.457 0.017  0.049  -0.026 357 ARG EEE C   
2693 O O   . ARG C 28  ? 0.347 0.292 0.486 0.017  0.064  -0.033 357 ARG EEE O   
2694 C CB  . ARG C 28  ? 0.306 0.274 0.494 0.022  0.038  -0.023 357 ARG EEE CB  
2695 C CG  . ARG C 28  ? 0.323 0.287 0.521 0.024  0.026  -0.021 357 ARG EEE CG  
2696 C CD  . ARG C 28  ? 0.334 0.300 0.572 0.028  0.021  -0.022 357 ARG EEE CD  
2697 N NE  . ARG C 28  ? 0.337 0.302 0.598 0.030  0.038  -0.030 357 ARG EEE NE  
2698 C CZ  . ARG C 28  ? 0.394 0.350 0.658 0.031  0.048  -0.035 357 ARG EEE CZ  
2699 N NH1 . ARG C 28  ? 0.434 0.382 0.683 0.031  0.040  -0.033 357 ARG EEE NH1 
2700 N NH2 . ARG C 28  ? 0.421 0.375 0.705 0.033  0.066  -0.043 357 ARG EEE NH2 
2701 N N   . ILE C 29  ? 0.318 0.267 0.443 0.015  0.040  -0.023 358 ILE EEE N   
2702 C CA  . ILE C 29  ? 0.353 0.288 0.463 0.013  0.044  -0.027 358 ILE EEE CA  
2703 C C   . ILE C 29  ? 0.354 0.285 0.483 0.015  0.039  -0.027 358 ILE EEE C   
2704 O O   . ILE C 29  ? 0.327 0.264 0.463 0.015  0.026  -0.020 358 ILE EEE O   
2705 C CB  . ILE C 29  ? 0.370 0.303 0.454 0.009  0.037  -0.024 358 ILE EEE CB  
2706 C CG1 . ILE C 29  ? 0.415 0.352 0.482 0.007  0.040  -0.023 358 ILE EEE CG1 
2707 C CG2 . ILE C 29  ? 0.409 0.327 0.481 0.007  0.037  -0.028 358 ILE EEE CG2 
2708 C CD1 . ILE C 29  ? 0.445 0.367 0.493 0.007  0.051  -0.031 358 ILE EEE CD1 
2709 N N   . SER C 30  ? 0.365 0.285 0.502 0.018  0.048  -0.035 359 SER EEE N   
2710 C CA  . SER C 30  ? 0.369 0.284 0.526 0.020  0.043  -0.035 359 SER EEE CA  
2711 C C   . SER C 30  ? 0.392 0.290 0.543 0.022  0.054  -0.044 359 SER EEE C   
2712 O O   . SER C 30  ? 0.394 0.283 0.526 0.021  0.067  -0.050 359 SER EEE O   
2713 C CB  . SER C 30  ? 0.394 0.318 0.586 0.025  0.040  -0.034 359 SER EEE CB  
2714 O OG  . SER C 30  ? 0.455 0.376 0.666 0.028  0.056  -0.042 359 SER EEE OG  
2715 N N   . ASN C 31  ? 0.384 0.276 0.547 0.023  0.048  -0.045 360 ASN EEE N   
2716 C CA  . ASN C 31  ? 0.430 0.303 0.591 0.025  0.058  -0.054 360 ASN EEE CA  
2717 C C   . ASN C 31  ? 0.436 0.294 0.558 0.022  0.062  -0.058 360 ASN EEE C   
2718 O O   . ASN C 31  ? 0.474 0.317 0.583 0.024  0.078  -0.067 360 ASN EEE O   
2719 C CB  . ASN C 31  ? 0.460 0.332 0.646 0.031  0.075  -0.061 360 ASN EEE CB  
2720 C CG  . ASN C 31  ? 0.492 0.377 0.720 0.035  0.067  -0.058 360 ASN EEE CG  
2721 O OD1 . ASN C 31  ? 0.547 0.446 0.791 0.036  0.066  -0.055 360 ASN EEE OD1 
2722 N ND2 . ASN C 31  ? 0.557 0.437 0.802 0.037  0.058  -0.057 360 ASN EEE ND2 
2723 N N   . CYS C 32  ? 0.403 0.262 0.506 0.017  0.049  -0.052 361 CYS EEE N   
2724 C CA  . CYS C 32  ? 0.424 0.269 0.492 0.013  0.048  -0.056 361 CYS EEE CA  
2725 C C   . CYS C 32  ? 0.426 0.273 0.488 0.007  0.031  -0.050 361 CYS EEE C   
2726 O O   . CYS C 32  ? 0.395 0.256 0.475 0.006  0.022  -0.041 361 CYS EEE O   
2727 C CB  . CYS C 32  ? 0.407 0.257 0.459 0.012  0.055  -0.055 361 CYS EEE CB  
2728 S SG  . CYS C 32  ? 0.382 0.260 0.448 0.010  0.045  -0.044 361 CYS EEE SG  
2729 N N   . VAL C 33  ? 0.468 0.298 0.503 0.004  0.027  -0.054 362 VAL EEE N   
2730 C CA  . VAL C 33  ? 0.490 0.319 0.521 -0.001 0.011  -0.049 362 VAL EEE CA  
2731 C C   . VAL C 33  ? 0.502 0.340 0.519 -0.005 0.007  -0.046 362 VAL EEE C   
2732 O O   . VAL C 33  ? 0.485 0.311 0.478 -0.003 0.013  -0.051 362 VAL EEE O   
2733 C CB  . VAL C 33  ? 0.539 0.343 0.554 -0.002 0.006  -0.057 362 VAL EEE CB  
2734 C CG1 . VAL C 33  ? 0.588 0.368 0.572 0.001  0.017  -0.068 362 VAL EEE CG1 
2735 C CG2 . VAL C 33  ? 0.562 0.364 0.573 -0.009 -0.010 -0.054 362 VAL EEE CG2 
2736 N N   . ALA C 34  ? 0.485 0.340 0.516 -0.008 -0.002 -0.037 363 ALA EEE N   
2737 C CA  . ALA C 34  ? 0.525 0.391 0.549 -0.011 -0.007 -0.032 363 ALA EEE CA  
2738 C C   . ALA C 34  ? 0.511 0.374 0.539 -0.017 -0.021 -0.029 363 ALA EEE C   
2739 O O   . ALA C 34  ? 0.475 0.345 0.524 -0.019 -0.025 -0.024 363 ALA EEE O   
2740 C CB  . ALA C 34  ? 0.516 0.404 0.556 -0.010 -0.003 -0.024 363 ALA EEE CB  
2741 N N   . ASP C 35  ? 0.523 0.378 0.535 -0.019 -0.029 -0.033 364 ASP EEE N   
2742 C CA  . ASP C 35  ? 0.521 0.378 0.545 -0.025 -0.044 -0.029 364 ASP EEE CA  
2743 C C   . ASP C 35  ? 0.512 0.392 0.548 -0.026 -0.043 -0.022 364 ASP EEE C   
2744 O O   . ASP C 35  ? 0.514 0.391 0.537 -0.026 -0.048 -0.024 364 ASP EEE O   
2745 C CB  . ASP C 35  ? 0.578 0.410 0.580 -0.026 -0.056 -0.038 364 ASP EEE CB  
2746 C CG  . ASP C 35  ? 0.612 0.445 0.633 -0.033 -0.073 -0.035 364 ASP EEE CG  
2747 O OD1 . ASP C 35  ? 0.566 0.422 0.617 -0.036 -0.073 -0.026 364 ASP EEE OD1 
2748 O OD2 . ASP C 35  ? 0.721 0.531 0.729 -0.034 -0.086 -0.042 364 ASP EEE OD2 
2749 N N   . TYR C 36  ? 0.437 0.335 0.495 -0.027 -0.038 -0.013 365 TYR EEE N   
2750 C CA  . TYR C 36  ? 0.423 0.342 0.494 -0.028 -0.035 -0.005 365 TYR EEE CA  
2751 C C   . TYR C 36  ? 0.429 0.350 0.514 -0.033 -0.046 -0.004 365 TYR EEE C   
2752 O O   . TYR C 36  ? 0.404 0.336 0.491 -0.033 -0.046 -0.001 365 TYR EEE O   
2753 C CB  . TYR C 36  ? 0.412 0.342 0.498 -0.028 -0.027 0.003  365 TYR EEE CB  
2754 C CG  . TYR C 36  ? 0.408 0.336 0.485 -0.023 -0.019 0.002  365 TYR EEE CG  
2755 C CD1 . TYR C 36  ? 0.404 0.341 0.473 -0.019 -0.013 0.002  365 TYR EEE CD1 
2756 C CD2 . TYR C 36  ? 0.432 0.352 0.514 -0.022 -0.019 0.001  365 TYR EEE CD2 
2757 C CE1 . TYR C 36  ? 0.441 0.377 0.508 -0.015 -0.007 0.001  365 TYR EEE CE1 
2758 C CE2 . TYR C 36  ? 0.438 0.356 0.517 -0.017 -0.013 -0.000 365 TYR EEE CE2 
2759 C CZ  . TYR C 36  ? 0.455 0.383 0.529 -0.014 -0.007 -0.000 365 TYR EEE CZ  
2760 O OH  . TYR C 36  ? 0.522 0.449 0.600 -0.009 -0.003 -0.002 365 TYR EEE OH  
2761 N N   . SER C 37  ? 0.428 0.340 0.524 -0.037 -0.056 -0.005 366 SER EEE N   
2762 C CA  . SER C 37  ? 0.463 0.377 0.581 -0.043 -0.068 -0.003 366 SER EEE CA  
2763 C C   . SER C 37  ? 0.499 0.406 0.602 -0.041 -0.079 -0.009 366 SER EEE C   
2764 O O   . SER C 37  ? 0.492 0.411 0.615 -0.044 -0.084 -0.006 366 SER EEE O   
2765 C CB  . SER C 37  ? 0.506 0.408 0.638 -0.047 -0.077 -0.005 366 SER EEE CB  
2766 O OG  . SER C 37  ? 0.568 0.480 0.719 -0.049 -0.067 0.003  366 SER EEE OG  
2767 N N   . VAL C 38  ? 0.522 0.409 0.591 -0.038 -0.081 -0.017 367 VAL EEE N   
2768 C CA  . VAL C 38  ? 0.532 0.406 0.578 -0.036 -0.092 -0.023 367 VAL EEE CA  
2769 C C   . VAL C 38  ? 0.522 0.413 0.567 -0.034 -0.083 -0.019 367 VAL EEE C   
2770 O O   . VAL C 38  ? 0.567 0.457 0.613 -0.034 -0.095 -0.019 367 VAL EEE O   
2771 C CB  . VAL C 38  ? 0.610 0.454 0.614 -0.033 -0.092 -0.033 367 VAL EEE CB  
2772 C CG1 . VAL C 38  ? 0.648 0.475 0.620 -0.031 -0.099 -0.038 367 VAL EEE CG1 
2773 C CG2 . VAL C 38  ? 0.637 0.461 0.641 -0.036 -0.104 -0.038 367 VAL EEE CG2 
2774 N N   . LEU C 39  ? 0.453 0.358 0.497 -0.031 -0.066 -0.015 368 LEU EEE N   
2775 C CA  . LEU C 39  ? 0.434 0.357 0.481 -0.028 -0.058 -0.010 368 LEU EEE CA  
2776 C C   . LEU C 39  ? 0.386 0.328 0.467 -0.031 -0.060 -0.003 368 LEU EEE C   
2777 O O   . LEU C 39  ? 0.370 0.319 0.456 -0.031 -0.065 -0.002 368 LEU EEE O   
2778 C CB  . LEU C 39  ? 0.437 0.369 0.479 -0.025 -0.041 -0.008 368 LEU EEE CB  
2779 C CG  . LEU C 39  ? 0.474 0.390 0.489 -0.021 -0.035 -0.015 368 LEU EEE CG  
2780 C CD1 . LEU C 39  ? 0.461 0.388 0.481 -0.018 -0.021 -0.012 368 LEU EEE CD1 
2781 C CD2 . LEU C 39  ? 0.500 0.406 0.490 -0.019 -0.037 -0.019 368 LEU EEE CD2 
2782 N N   . TYR C 40  ? 0.369 0.319 0.473 -0.034 -0.056 0.002  369 TYR EEE N   
2783 C CA  . TYR C 40  ? 0.367 0.336 0.504 -0.037 -0.052 0.010  369 TYR EEE CA  
2784 C C   . TYR C 40  ? 0.370 0.339 0.529 -0.041 -0.067 0.008  369 TYR EEE C   
2785 O O   . TYR C 40  ? 0.396 0.380 0.578 -0.041 -0.064 0.013  369 TYR EEE O   
2786 C CB  . TYR C 40  ? 0.367 0.338 0.520 -0.040 -0.044 0.015  369 TYR EEE CB  
2787 C CG  . TYR C 40  ? 0.378 0.365 0.561 -0.043 -0.036 0.024  369 TYR EEE CG  
2788 C CD1 . TYR C 40  ? 0.357 0.356 0.540 -0.041 -0.025 0.028  369 TYR EEE CD1 
2789 C CD2 . TYR C 40  ? 0.379 0.365 0.589 -0.049 -0.037 0.028  369 TYR EEE CD2 
2790 C CE1 . TYR C 40  ? 0.371 0.382 0.581 -0.043 -0.015 0.036  369 TYR EEE CE1 
2791 C CE2 . TYR C 40  ? 0.402 0.400 0.641 -0.052 -0.026 0.036  369 TYR EEE CE2 
2792 C CZ  . TYR C 40  ? 0.396 0.407 0.634 -0.049 -0.014 0.040  369 TYR EEE CZ  
2793 O OH  . TYR C 40  ? 0.441 0.462 0.705 -0.051 -0.000 0.048  369 TYR EEE OH  
2794 N N   . ASN C 41  ? 0.411 0.362 0.564 -0.043 -0.083 0.002  370 ASN EEE N   
2795 C CA  . ASN C 41  ? 0.453 0.401 0.630 -0.046 -0.103 -0.000 370 ASN EEE CA  
2796 C C   . ASN C 41  ? 0.450 0.386 0.604 -0.043 -0.116 -0.006 370 ASN EEE C   
2797 O O   . ASN C 41  ? 0.475 0.404 0.644 -0.045 -0.136 -0.009 370 ASN EEE O   
2798 C CB  . ASN C 41  ? 0.492 0.424 0.677 -0.051 -0.115 -0.004 370 ASN EEE CB  
2799 C CG  . ASN C 41  ? 0.532 0.476 0.746 -0.055 -0.102 0.004  370 ASN EEE CG  
2800 O OD1 . ASN C 41  ? 0.494 0.459 0.735 -0.056 -0.089 0.012  370 ASN EEE OD1 
2801 N ND2 . ASN C 41  ? 0.563 0.493 0.769 -0.057 -0.105 0.001  370 ASN EEE ND2 
2802 N N   . SER C 42  ? 0.455 0.388 0.574 -0.038 -0.106 -0.008 371 SER EEE N   
2803 C CA  . SER C 42  ? 0.466 0.388 0.559 -0.035 -0.115 -0.012 371 SER EEE CA  
2804 C C   . SER C 42  ? 0.465 0.405 0.589 -0.035 -0.118 -0.007 371 SER EEE C   
2805 O O   . SER C 42  ? 0.510 0.473 0.656 -0.034 -0.102 -0.001 371 SER EEE O   
2806 C CB  . SER C 42  ? 0.449 0.366 0.506 -0.030 -0.100 -0.013 371 SER EEE CB  
2807 O OG  . SER C 42  ? 0.478 0.380 0.506 -0.027 -0.108 -0.017 371 SER EEE OG  
2808 N N   . ALA C 43  ? 0.437 0.365 0.557 -0.034 -0.138 -0.011 372 ALA EEE N   
2809 C CA  . ALA C 43  ? 0.430 0.373 0.575 -0.033 -0.143 -0.008 372 ALA EEE CA  
2810 C C   . ALA C 43  ? 0.417 0.362 0.533 -0.028 -0.132 -0.008 372 ALA EEE C   
2811 O O   . ALA C 43  ? 0.406 0.362 0.539 -0.026 -0.133 -0.005 372 ALA EEE O   
2812 C CB  . ALA C 43  ? 0.481 0.407 0.633 -0.034 -0.172 -0.013 372 ALA EEE CB  
2813 N N   . SER C 44  ? 0.421 0.354 0.496 -0.025 -0.120 -0.010 373 SER EEE N   
2814 C CA  . SER C 44  ? 0.436 0.366 0.481 -0.021 -0.110 -0.010 373 SER EEE CA  
2815 C C   . SER C 44  ? 0.372 0.329 0.437 -0.019 -0.092 -0.004 373 SER EEE C   
2816 O O   . SER C 44  ? 0.379 0.338 0.429 -0.016 -0.087 -0.004 373 SER EEE O   
2817 C CB  . SER C 44  ? 0.490 0.400 0.493 -0.020 -0.102 -0.014 373 SER EEE CB  
2818 O OG  . SER C 44  ? 0.581 0.460 0.554 -0.020 -0.118 -0.020 373 SER EEE OG  
2819 N N   . PHE C 45  ? 0.343 0.318 0.437 -0.021 -0.081 0.000  374 PHE EEE N   
2820 C CA  . PHE C 45  ? 0.301 0.296 0.403 -0.019 -0.062 0.006  374 PHE EEE CA  
2821 C C   . PHE C 45  ? 0.306 0.320 0.446 -0.020 -0.059 0.011  374 PHE EEE C   
2822 O O   . PHE C 45  ? 0.326 0.344 0.495 -0.024 -0.063 0.012  374 PHE EEE O   
2823 C CB  . PHE C 45  ? 0.292 0.288 0.390 -0.021 -0.050 0.007  374 PHE EEE CB  
2824 C CG  . PHE C 45  ? 0.292 0.269 0.358 -0.020 -0.051 0.002  374 PHE EEE CG  
2825 C CD1 . PHE C 45  ? 0.295 0.265 0.333 -0.016 -0.047 -0.000 374 PHE EEE CD1 
2826 C CD2 . PHE C 45  ? 0.305 0.272 0.370 -0.023 -0.054 0.000  374 PHE EEE CD2 
2827 C CE1 . PHE C 45  ? 0.301 0.253 0.312 -0.016 -0.044 -0.005 374 PHE EEE CE1 
2828 C CE2 . PHE C 45  ? 0.311 0.260 0.347 -0.021 -0.052 -0.005 374 PHE EEE CE2 
2829 C CZ  . PHE C 45  ? 0.313 0.255 0.323 -0.018 -0.047 -0.008 374 PHE EEE CZ  
2830 N N   . SER C 46  ? 0.303 0.328 0.443 -0.016 -0.050 0.013  375 SER EEE N   
2831 C CA  . SER C 46  ? 0.296 0.338 0.470 -0.016 -0.043 0.017  375 SER EEE CA  
2832 C C   . SER C 46  ? 0.276 0.328 0.455 -0.016 -0.023 0.023  375 SER EEE C   
2833 O O   . SER C 46  ? 0.269 0.332 0.478 -0.017 -0.014 0.027  375 SER EEE O   
2834 C CB  . SER C 46  ? 0.298 0.344 0.469 -0.011 -0.044 0.016  375 SER EEE CB  
2835 O OG  . SER C 46  ? 0.315 0.356 0.452 -0.008 -0.036 0.016  375 SER EEE OG  
2836 N N   . THR C 47  ? 0.243 0.288 0.393 -0.015 -0.015 0.023  376 THR EEE N   
2837 C CA  . THR C 47  ? 0.247 0.295 0.394 -0.015 -0.000 0.028  376 THR EEE CA  
2838 C C   . THR C 47  ? 0.253 0.291 0.389 -0.018 -0.003 0.027  376 THR EEE C   
2839 O O   . THR C 47  ? 0.251 0.280 0.365 -0.017 -0.010 0.022  376 THR EEE O   
2840 C CB  . THR C 47  ? 0.252 0.301 0.377 -0.010 0.010  0.029  376 THR EEE CB  
2841 O OG1 . THR C 47  ? 0.266 0.324 0.404 -0.008 0.014  0.030  376 THR EEE OG1 
2842 C CG2 . THR C 47  ? 0.262 0.308 0.378 -0.010 0.022  0.034  376 THR EEE CG2 
2843 N N   . PHE C 48  ? 0.255 0.294 0.406 -0.021 0.002  0.031  377 PHE EEE N   
2844 C CA  . PHE C 48  ? 0.273 0.302 0.412 -0.023 0.002  0.031  377 PHE EEE CA  
2845 C C   . PHE C 48  ? 0.297 0.328 0.444 -0.025 0.015  0.039  377 PHE EEE C   
2846 O O   . PHE C 48  ? 0.288 0.321 0.460 -0.029 0.016  0.042  377 PHE EEE O   
2847 C CB  . PHE C 48  ? 0.285 0.306 0.431 -0.027 -0.012 0.027  377 PHE EEE CB  
2848 C CG  . PHE C 48  ? 0.282 0.291 0.410 -0.027 -0.014 0.023  377 PHE EEE CG  
2849 C CD1 . PHE C 48  ? 0.290 0.297 0.416 -0.027 -0.006 0.028  377 PHE EEE CD1 
2850 C CD2 . PHE C 48  ? 0.301 0.297 0.411 -0.026 -0.025 0.016  377 PHE EEE CD2 
2851 C CE1 . PHE C 48  ? 0.319 0.315 0.432 -0.027 -0.009 0.025  377 PHE EEE CE1 
2852 C CE2 . PHE C 48  ? 0.322 0.307 0.417 -0.025 -0.025 0.013  377 PHE EEE CE2 
2853 C CZ  . PHE C 48  ? 0.315 0.300 0.414 -0.026 -0.017 0.017  377 PHE EEE CZ  
2854 N N   . LYS C 49  ? 0.304 0.332 0.431 -0.021 0.025  0.042  378 LYS EEE N   
2855 C CA  . LYS C 49  ? 0.324 0.348 0.449 -0.021 0.038  0.050  378 LYS EEE CA  
2856 C C   . LYS C 49  ? 0.313 0.325 0.417 -0.020 0.037  0.051  378 LYS EEE C   
2857 O O   . LYS C 49  ? 0.294 0.303 0.378 -0.016 0.033  0.047  378 LYS EEE O   
2858 C CB  . LYS C 49  ? 0.362 0.391 0.480 -0.018 0.049  0.052  378 LYS EEE CB  
2859 C CG  . LYS C 49  ? 0.453 0.494 0.598 -0.018 0.052  0.051  378 LYS EEE CG  
2860 C CD  . LYS C 49  ? 0.515 0.558 0.652 -0.014 0.064  0.053  378 LYS EEE CD  
2861 C CE  . LYS C 49  ? 0.555 0.611 0.724 -0.014 0.066  0.052  378 LYS EEE CE  
2862 N NZ  . LYS C 49  ? 0.617 0.674 0.780 -0.010 0.082  0.055  378 LYS EEE NZ  
2863 N N   . CYS C 50  ? 0.314 0.319 0.424 -0.024 0.040  0.056  379 CYS EEE N   
2864 C CA  . CYS C 50  ? 0.341 0.332 0.432 -0.023 0.038  0.057  379 CYS EEE CA  
2865 C C   . CYS C 50  ? 0.357 0.337 0.432 -0.022 0.049  0.066  379 CYS EEE C   
2866 O O   . CYS C 50  ? 0.378 0.360 0.464 -0.024 0.061  0.071  379 CYS EEE O   
2867 C CB  . CYS C 50  ? 0.364 0.352 0.469 -0.027 0.030  0.056  379 CYS EEE CB  
2868 S SG  . CYS C 50  ? 0.362 0.355 0.474 -0.027 0.017  0.045  379 CYS EEE SG  
2869 N N   . TYR C 51  ? 0.358 0.326 0.410 -0.018 0.045  0.067  380 TYR EEE N   
2870 C CA  . TYR C 51  ? 0.395 0.346 0.423 -0.016 0.052  0.074  380 TYR EEE CA  
2871 C C   . TYR C 51  ? 0.385 0.321 0.405 -0.016 0.043  0.076  380 TYR EEE C   
2872 O O   . TYR C 51  ? 0.386 0.324 0.409 -0.014 0.031  0.070  380 TYR EEE O   
2873 C CB  . TYR C 51  ? 0.394 0.343 0.399 -0.010 0.051  0.072  380 TYR EEE CB  
2874 C CG  . TYR C 51  ? 0.380 0.343 0.394 -0.010 0.058  0.069  380 TYR EEE CG  
2875 C CD1 . TYR C 51  ? 0.413 0.371 0.420 -0.010 0.073  0.075  380 TYR EEE CD1 
2876 C CD2 . TYR C 51  ? 0.366 0.344 0.393 -0.009 0.050  0.061  380 TYR EEE CD2 
2877 C CE1 . TYR C 51  ? 0.410 0.381 0.428 -0.009 0.080  0.072  380 TYR EEE CE1 
2878 C CE2 . TYR C 51  ? 0.365 0.356 0.401 -0.008 0.055  0.059  380 TYR EEE CE2 
2879 C CZ  . TYR C 51  ? 0.374 0.362 0.407 -0.008 0.070  0.064  380 TYR EEE CZ  
2880 O OH  . TYR C 51  ? 0.383 0.382 0.427 -0.006 0.075  0.062  380 TYR EEE OH  
2881 N N   . GLY C 52  ? 0.437 0.357 0.448 -0.019 0.050  0.085  381 GLY EEE N   
2882 C CA  . GLY C 52  ? 0.443 0.345 0.444 -0.018 0.042  0.088  381 GLY EEE CA  
2883 C C   . GLY C 52  ? 0.462 0.370 0.489 -0.022 0.035  0.085  381 GLY EEE C   
2884 O O   . GLY C 52  ? 0.475 0.368 0.496 -0.022 0.029  0.088  381 GLY EEE O   
2885 N N   . VAL C 53  ? 0.446 0.372 0.498 -0.025 0.036  0.079  382 VAL EEE N   
2886 C CA  . VAL C 53  ? 0.465 0.396 0.541 -0.030 0.029  0.075  382 VAL EEE CA  
2887 C C   . VAL C 53  ? 0.412 0.357 0.512 -0.035 0.034  0.074  382 VAL EEE C   
2888 O O   . VAL C 53  ? 0.407 0.363 0.507 -0.033 0.038  0.072  382 VAL EEE O   
2889 C CB  . VAL C 53  ? 0.507 0.441 0.584 -0.026 0.017  0.065  382 VAL EEE CB  
2890 C CG1 . VAL C 53  ? 0.611 0.531 0.674 -0.021 0.010  0.066  382 VAL EEE CG1 
2891 C CG2 . VAL C 53  ? 0.482 0.431 0.557 -0.023 0.016  0.058  382 VAL EEE CG2 
2892 N N   . SER C 54  ? 0.417 0.361 0.539 -0.040 0.032  0.074  383 SER EEE N   
2893 C CA  . SER C 54  ? 0.419 0.375 0.569 -0.045 0.032  0.072  383 SER EEE CA  
2894 C C   . SER C 54  ? 0.382 0.344 0.536 -0.044 0.017  0.061  383 SER EEE C   
2895 O O   . SER C 54  ? 0.362 0.315 0.509 -0.042 0.009  0.056  383 SER EEE O   
2896 C CB  . SER C 54  ? 0.462 0.414 0.636 -0.052 0.035  0.077  383 SER EEE CB  
2897 O OG  . SER C 54  ? 0.514 0.478 0.720 -0.057 0.031  0.074  383 SER EEE OG  
2898 N N   . PRO C 55  ? 0.353 0.327 0.515 -0.043 0.015  0.056  384 PRO EEE N   
2899 C CA  . PRO C 55  ? 0.351 0.326 0.512 -0.042 0.001  0.045  384 PRO EEE CA  
2900 C C   . PRO C 55  ? 0.346 0.313 0.522 -0.047 -0.009 0.042  384 PRO EEE C   
2901 O O   . PRO C 55  ? 0.373 0.332 0.536 -0.045 -0.018 0.034  384 PRO EEE O   
2902 C CB  . PRO C 55  ? 0.352 0.340 0.522 -0.042 0.001  0.043  384 PRO EEE CB  
2903 C CG  . PRO C 55  ? 0.365 0.361 0.556 -0.045 0.013  0.052  384 PRO EEE CG  
2904 C CD  . PRO C 55  ? 0.369 0.355 0.542 -0.044 0.024  0.060  384 PRO EEE CD  
2905 N N   . THR C 56  ? 0.331 0.298 0.531 -0.053 -0.006 0.048  385 THR EEE N   
2906 C CA  . THR C 56  ? 0.351 0.310 0.569 -0.058 -0.018 0.045  385 THR EEE CA  
2907 C C   . THR C 56  ? 0.369 0.313 0.574 -0.057 -0.019 0.045  385 THR EEE C   
2908 O O   . THR C 56  ? 0.380 0.314 0.592 -0.060 -0.031 0.039  385 THR EEE O   
2909 C CB  . THR C 56  ? 0.357 0.322 0.612 -0.065 -0.013 0.052  385 THR EEE CB  
2910 O OG1 . THR C 56  ? 0.368 0.330 0.620 -0.066 0.003  0.063  385 THR EEE OG1 
2911 C CG2 . THR C 56  ? 0.374 0.354 0.649 -0.066 -0.012 0.052  385 THR EEE CG2 
2912 N N   . LYS C 57  ? 0.351 0.291 0.536 -0.053 -0.010 0.049  386 LYS EEE N   
2913 C CA  . LYS C 57  ? 0.385 0.311 0.559 -0.051 -0.012 0.050  386 LYS EEE CA  
2914 C C   . LYS C 57  ? 0.379 0.301 0.533 -0.044 -0.017 0.041  386 LYS EEE C   
2915 O O   . LYS C 57  ? 0.388 0.298 0.537 -0.043 -0.021 0.039  386 LYS EEE O   
2916 C CB  . LYS C 57  ? 0.424 0.345 0.590 -0.051 -0.001 0.061  386 LYS EEE CB  
2917 C CG  . LYS C 57  ? 0.480 0.401 0.667 -0.058 0.008  0.071  386 LYS EEE CG  
2918 C CD  . LYS C 57  ? 0.534 0.443 0.706 -0.058 0.019  0.082  386 LYS EEE CD  
2919 C CE  . LYS C 57  ? 0.597 0.505 0.788 -0.065 0.032  0.092  386 LYS EEE CE  
2920 N NZ  . LYS C 57  ? 0.650 0.538 0.822 -0.065 0.041  0.103  386 LYS EEE NZ  
2921 N N   . LEU C 58  ? 0.354 0.285 0.497 -0.041 -0.017 0.036  387 LEU EEE N   
2922 C CA  . LEU C 58  ? 0.347 0.276 0.472 -0.034 -0.017 0.029  387 LEU EEE CA  
2923 C C   . LEU C 58  ? 0.362 0.278 0.484 -0.033 -0.024 0.020  387 LEU EEE C   
2924 O O   . LEU C 58  ? 0.340 0.250 0.454 -0.029 -0.023 0.017  387 LEU EEE O   
2925 C CB  . LEU C 58  ? 0.343 0.282 0.458 -0.032 -0.016 0.025  387 LEU EEE CB  
2926 C CG  . LEU C 58  ? 0.341 0.292 0.454 -0.030 -0.008 0.032  387 LEU EEE CG  
2927 C CD1 . LEU C 58  ? 0.349 0.309 0.454 -0.028 -0.007 0.028  387 LEU EEE CD1 
2928 C CD2 . LEU C 58  ? 0.347 0.293 0.448 -0.025 -0.004 0.035  387 LEU EEE CD2 
2929 N N   . ASN C 59  ? 0.346 0.255 0.474 -0.038 -0.032 0.015  388 ASN EEE N   
2930 C CA  . ASN C 59  ? 0.383 0.276 0.504 -0.037 -0.039 0.006  388 ASN EEE CA  
2931 C C   . ASN C 59  ? 0.393 0.276 0.522 -0.037 -0.039 0.008  388 ASN EEE C   
2932 O O   . ASN C 59  ? 0.417 0.285 0.538 -0.034 -0.042 0.000  388 ASN EEE O   
2933 C CB  . ASN C 59  ? 0.413 0.298 0.538 -0.041 -0.051 0.001  388 ASN EEE CB  
2934 C CG  . ASN C 59  ? 0.421 0.305 0.527 -0.039 -0.053 -0.006 388 ASN EEE CG  
2935 O OD1 . ASN C 59  ? 0.433 0.327 0.529 -0.035 -0.045 -0.005 388 ASN EEE OD1 
2936 N ND2 . ASN C 59  ? 0.463 0.334 0.564 -0.041 -0.066 -0.013 388 ASN EEE ND2 
2937 N N   . ASP C 60  ? 0.374 0.262 0.515 -0.039 -0.035 0.019  389 ASP EEE N   
2938 C CA  . ASP C 60  ? 0.401 0.277 0.549 -0.040 -0.037 0.023  389 ASP EEE CA  
2939 C C   . ASP C 60  ? 0.386 0.262 0.525 -0.034 -0.031 0.027  389 ASP EEE C   
2940 O O   . ASP C 60  ? 0.389 0.255 0.533 -0.034 -0.033 0.032  389 ASP EEE O   
2941 C CB  . ASP C 60  ? 0.434 0.310 0.599 -0.048 -0.037 0.032  389 ASP EEE CB  
2942 C CG  . ASP C 60  ? 0.482 0.357 0.662 -0.053 -0.045 0.028  389 ASP EEE CG  
2943 O OD1 . ASP C 60  ? 0.528 0.390 0.702 -0.052 -0.054 0.018  389 ASP EEE OD1 
2944 O OD2 . ASP C 60  ? 0.542 0.427 0.739 -0.059 -0.043 0.034  389 ASP EEE OD2 
2945 N N   . LEU C 61  ? 0.362 0.248 0.491 -0.029 -0.027 0.025  390 LEU EEE N   
2946 C CA  . LEU C 61  ? 0.356 0.242 0.479 -0.024 -0.025 0.029  390 LEU EEE CA  
2947 C C   . LEU C 61  ? 0.365 0.251 0.486 -0.017 -0.024 0.019  390 LEU EEE C   
2948 O O   . LEU C 61  ? 0.372 0.260 0.488 -0.017 -0.022 0.011  390 LEU EEE O   
2949 C CB  . LEU C 61  ? 0.363 0.261 0.479 -0.024 -0.019 0.037  390 LEU EEE CB  
2950 C CG  . LEU C 61  ? 0.359 0.257 0.479 -0.031 -0.015 0.047  390 LEU EEE CG  
2951 C CD1 . LEU C 61  ? 0.370 0.277 0.479 -0.030 -0.008 0.052  390 LEU EEE CD1 
2952 C CD2 . LEU C 61  ? 0.388 0.271 0.509 -0.032 -0.017 0.055  390 LEU EEE CD2 
2953 N N   . CYS C 62  ? 0.355 0.237 0.479 -0.012 -0.026 0.021  391 CYS EEE N   
2954 C CA  . CYS C 62  ? 0.374 0.257 0.502 -0.006 -0.024 0.013  391 CYS EEE CA  
2955 C C   . CYS C 62  ? 0.357 0.247 0.483 -0.002 -0.025 0.018  391 CYS EEE C   
2956 O O   . CYS C 62  ? 0.381 0.265 0.503 -0.003 -0.030 0.028  391 CYS EEE O   
2957 C CB  . CYS C 62  ? 0.409 0.279 0.549 -0.002 -0.027 0.009  391 CYS EEE CB  
2958 S SG  . CYS C 62  ? 0.467 0.325 0.607 -0.005 -0.026 -0.000 391 CYS EEE SG  
2959 N N   . PHE C 63  ? 0.326 0.224 0.453 0.002  -0.021 0.013  392 PHE EEE N   
2960 C CA  . PHE C 63  ? 0.330 0.234 0.456 0.005  -0.023 0.016  392 PHE EEE CA  
2961 C C   . PHE C 63  ? 0.315 0.220 0.460 0.011  -0.023 0.009  392 PHE EEE C   
2962 O O   . PHE C 63  ? 0.302 0.205 0.455 0.012  -0.016 0.000  392 PHE EEE O   
2963 C CB  . PHE C 63  ? 0.318 0.235 0.431 0.003  -0.018 0.017  392 PHE EEE CB  
2964 C CG  . PHE C 63  ? 0.336 0.252 0.437 -0.003 -0.017 0.025  392 PHE EEE CG  
2965 C CD1 . PHE C 63  ? 0.357 0.268 0.450 -0.003 -0.021 0.035  392 PHE EEE CD1 
2966 C CD2 . PHE C 63  ? 0.374 0.295 0.473 -0.007 -0.013 0.023  392 PHE EEE CD2 
2967 C CE1 . PHE C 63  ? 0.379 0.289 0.462 -0.008 -0.017 0.042  392 PHE EEE CE1 
2968 C CE2 . PHE C 63  ? 0.367 0.289 0.461 -0.012 -0.012 0.030  392 PHE EEE CE2 
2969 C CZ  . PHE C 63  ? 0.381 0.299 0.469 -0.013 -0.012 0.040  392 PHE EEE CZ  
2970 N N   . THR C 64  ? 0.318 0.224 0.469 0.015  -0.030 0.012  393 THR EEE N   
2971 C CA  . THR C 64  ? 0.337 0.244 0.513 0.021  -0.031 0.006  393 THR EEE CA  
2972 C C   . THR C 64  ? 0.333 0.253 0.511 0.021  -0.020 -0.001 393 THR EEE C   
2973 O O   . THR C 64  ? 0.352 0.274 0.550 0.024  -0.012 -0.009 393 THR EEE O   
2974 C CB  . THR C 64  ? 0.374 0.274 0.557 0.025  -0.046 0.012  393 THR EEE CB  
2975 O OG1 . THR C 64  ? 0.410 0.311 0.570 0.023  -0.051 0.020  393 THR EEE OG1 
2976 C CG2 . THR C 64  ? 0.397 0.282 0.583 0.026  -0.056 0.017  393 THR EEE CG2 
2977 N N   . ASN C 65  ? 0.346 0.274 0.505 0.018  -0.018 0.003  394 ASN EEE N   
2978 C CA  . ASN C 65  ? 0.325 0.262 0.480 0.018  -0.007 -0.002 394 ASN EEE CA  
2979 C C   . ASN C 65  ? 0.312 0.254 0.441 0.013  -0.006 0.002  394 ASN EEE C   
2980 O O   . ASN C 65  ? 0.306 0.245 0.424 0.011  -0.012 0.010  394 ASN EEE O   
2981 C CB  . ASN C 65  ? 0.338 0.282 0.508 0.021  -0.009 -0.003 394 ASN EEE CB  
2982 C CG  . ASN C 65  ? 0.340 0.283 0.542 0.026  -0.007 -0.010 394 ASN EEE CG  
2983 O OD1 . ASN C 65  ? 0.342 0.285 0.552 0.026  0.007  -0.017 394 ASN EEE OD1 
2984 N ND2 . ASN C 65  ? 0.356 0.298 0.578 0.030  -0.020 -0.007 394 ASN EEE ND2 
2985 N N   . VAL C 66  ? 0.296 0.243 0.417 0.011  0.004  -0.002 395 VAL EEE N   
2986 C CA  . VAL C 66  ? 0.301 0.254 0.403 0.008  0.005  0.001  395 VAL EEE CA  
2987 C C   . VAL C 66  ? 0.291 0.252 0.394 0.010  0.010  -0.002 395 VAL EEE C   
2988 O O   . VAL C 66  ? 0.304 0.263 0.414 0.011  0.018  -0.009 395 VAL EEE O   
2989 C CB  . VAL C 66  ? 0.301 0.250 0.390 0.004  0.008  -0.001 395 VAL EEE CB  
2990 C CG1 . VAL C 66  ? 0.306 0.262 0.381 0.001  0.008  0.002  395 VAL EEE CG1 
2991 C CG2 . VAL C 66  ? 0.329 0.271 0.422 0.001  0.002  0.002  395 VAL EEE CG2 
2992 N N   . TYR C 67  ? 0.303 0.223 0.501 0.024  -0.060 -0.012 396 TYR EEE N   
2993 C CA  . TYR C 67  ? 0.293 0.233 0.486 0.024  -0.049 -0.016 396 TYR EEE CA  
2994 C C   . TYR C 67  ? 0.296 0.244 0.458 0.017  -0.034 -0.013 396 TYR EEE C   
2995 O O   . TYR C 67  ? 0.302 0.241 0.442 0.010  -0.037 -0.002 396 TYR EEE O   
2996 C CB  . TYR C 67  ? 0.324 0.261 0.513 0.025  -0.061 -0.005 396 TYR EEE CB  
2997 C CG  . TYR C 67  ? 0.357 0.285 0.579 0.032  -0.078 -0.008 396 TYR EEE CG  
2998 C CD1 . TYR C 67  ? 0.374 0.316 0.630 0.040  -0.076 -0.023 396 TYR EEE CD1 
2999 C CD2 . TYR C 67  ? 0.406 0.310 0.625 0.031  -0.098 0.005  396 TYR EEE CD2 
3000 C CE1 . TYR C 67  ? 0.410 0.344 0.700 0.048  -0.094 -0.026 396 TYR EEE CE1 
3001 C CE2 . TYR C 67  ? 0.437 0.330 0.686 0.039  -0.117 0.003  396 TYR EEE CE2 
3002 C CZ  . TYR C 67  ? 0.440 0.350 0.728 0.049  -0.116 -0.013 396 TYR EEE CZ  
3003 O OH  . TYR C 67  ? 0.449 0.348 0.772 0.058  -0.137 -0.016 396 TYR EEE OH  
3004 N N   . ALA C 68  ? 0.268 0.230 0.430 0.017  -0.020 -0.025 397 ALA EEE N   
3005 C CA  . ALA C 68  ? 0.255 0.225 0.392 0.011  -0.008 -0.024 397 ALA EEE CA  
3006 C C   . ALA C 68  ? 0.247 0.228 0.375 0.011  -0.003 -0.022 397 ALA EEE C   
3007 O O   . ALA C 68  ? 0.237 0.228 0.379 0.013  0.004  -0.033 397 ALA EEE O   
3008 C CB  . ALA C 68  ? 0.268 0.242 0.408 0.011  0.003  -0.037 397 ALA EEE CB  
3009 N N   . ASP C 69  ? 0.242 0.222 0.351 0.008  -0.006 -0.011 398 ASP EEE N   
3010 C CA  . ASP C 69  ? 0.222 0.210 0.320 0.007  -0.003 -0.008 398 ASP EEE CA  
3011 C C   . ASP C 69  ? 0.236 0.229 0.313 0.004  0.006  -0.009 398 ASP EEE C   
3012 O O   . ASP C 69  ? 0.254 0.245 0.322 0.001  0.006  -0.006 398 ASP EEE O   
3013 C CB  . ASP C 69  ? 0.236 0.219 0.325 0.006  -0.013 0.003  398 ASP EEE CB  
3014 C CG  . ASP C 69  ? 0.258 0.233 0.366 0.010  -0.026 0.005  398 ASP EEE CG  
3015 O OD1 . ASP C 69  ? 0.250 0.229 0.384 0.015  -0.026 -0.005 398 ASP EEE OD1 
3016 O OD2 . ASP C 69  ? 0.263 0.229 0.360 0.007  -0.037 0.016  398 ASP EEE OD2 
3017 N N   . SER C 70  ? 0.222 0.222 0.295 0.003  0.014  -0.013 399 SER EEE N   
3018 C CA  . SER C 70  ? 0.213 0.215 0.267 -0.000 0.019  -0.014 399 SER EEE CA  
3019 C C   . SER C 70  ? 0.197 0.202 0.241 -0.001 0.021  -0.012 399 SER EEE C   
3020 O O   . SER C 70  ? 0.205 0.213 0.259 -0.000 0.023  -0.014 399 SER EEE O   
3021 C CB  . SER C 70  ? 0.221 0.223 0.275 -0.002 0.026  -0.022 399 SER EEE CB  
3022 O OG  . SER C 70  ? 0.232 0.237 0.296 -0.003 0.033  -0.031 399 SER EEE OG  
3023 N N   . PHE C 71  ? 0.196 0.201 0.224 -0.002 0.021  -0.008 400 PHE EEE N   
3024 C CA  . PHE C 71  ? 0.198 0.203 0.216 -0.002 0.021  -0.006 400 PHE EEE CA  
3025 C C   . PHE C 71  ? 0.209 0.213 0.214 -0.002 0.019  -0.004 400 PHE EEE C   
3026 O O   . PHE C 71  ? 0.209 0.213 0.214 -0.002 0.018  -0.004 400 PHE EEE O   
3027 C CB  . PHE C 71  ? 0.209 0.215 0.231 -0.000 0.016  -0.002 400 PHE EEE CB  
3028 C CG  . PHE C 71  ? 0.222 0.229 0.244 0.000  0.012  0.003  400 PHE EEE CG  
3029 C CD1 . PHE C 71  ? 0.222 0.231 0.234 -0.000 0.011  0.005  400 PHE EEE CD1 
3030 C CD2 . PHE C 71  ? 0.235 0.239 0.267 0.000  0.007  0.005  400 PHE EEE CD2 
3031 C CE1 . PHE C 71  ? 0.218 0.227 0.228 -0.003 0.009  0.009  400 PHE EEE CE1 
3032 C CE2 . PHE C 71  ? 0.238 0.239 0.265 -0.002 0.003  0.011  400 PHE EEE CE2 
3033 C CZ  . PHE C 71  ? 0.223 0.226 0.238 -0.004 0.005  0.013  400 PHE EEE CZ  
3034 N N   . VAL C 72  ? 0.215 0.216 0.210 -0.002 0.018  -0.003 401 VAL EEE N   
3035 C CA  . VAL C 72  ? 0.221 0.221 0.209 -0.000 0.014  -0.002 401 VAL EEE CA  
3036 C C   . VAL C 72  ? 0.205 0.208 0.194 0.003  0.011  -0.001 401 VAL EEE C   
3037 O O   . VAL C 72  ? 0.216 0.218 0.206 0.003  0.012  0.000  401 VAL EEE O   
3038 C CB  . VAL C 72  ? 0.235 0.226 0.209 -0.002 0.013  -0.002 401 VAL EEE CB  
3039 C CG1 . VAL C 72  ? 0.234 0.222 0.203 0.001  0.005  -0.001 401 VAL EEE CG1 
3040 C CG2 . VAL C 72  ? 0.243 0.231 0.212 -0.006 0.015  -0.005 401 VAL EEE CG2 
3041 N N   . ILE C 73  ? 0.204 0.213 0.195 0.005  0.009  -0.002 402 ILE EEE N   
3042 C CA  . ILE C 73  ? 0.219 0.232 0.212 0.007  0.008  -0.003 402 ILE EEE CA  
3043 C C   . ILE C 73  ? 0.224 0.241 0.221 0.011  0.004  -0.007 402 ILE EEE C   
3044 O O   . ILE C 73  ? 0.258 0.273 0.255 0.010  0.002  -0.007 402 ILE EEE O   
3045 C CB  . ILE C 73  ? 0.214 0.234 0.209 0.005  0.011  -0.002 402 ILE EEE CB  
3046 C CG1 . ILE C 73  ? 0.232 0.257 0.232 0.002  0.013  -0.001 402 ILE EEE CG1 
3047 C CG2 . ILE C 73  ? 0.235 0.251 0.230 0.003  0.011  0.002  402 ILE EEE CG2 
3048 C CD1 . ILE C 73  ? 0.237 0.266 0.235 -0.003 0.015  0.001  402 ILE EEE CD1 
3049 N N   . ARG C 74  ? 0.229 0.252 0.231 0.013  0.004  -0.012 403 ARG EEE N   
3050 C CA  . ARG C 74  ? 0.245 0.275 0.257 0.018  0.000  -0.018 403 ARG EEE CA  
3051 C C   . ARG C 74  ? 0.230 0.273 0.251 0.015  0.005  -0.020 403 ARG EEE C   
3052 O O   . ARG C 74  ? 0.221 0.268 0.239 0.009  0.012  -0.018 403 ARG EEE O   
3053 C CB  . ARG C 74  ? 0.289 0.323 0.306 0.022  0.000  -0.025 403 ARG EEE CB  
3054 C CG  . ARG C 74  ? 0.329 0.349 0.342 0.026  -0.007 -0.024 403 ARG EEE CG  
3055 C CD  . ARG C 74  ? 0.321 0.344 0.337 0.029  -0.005 -0.030 403 ARG EEE CD  
3056 N NE  . ARG C 74  ? 0.357 0.394 0.390 0.033  -0.004 -0.042 403 ARG EEE NE  
3057 C CZ  . ARG C 74  ? 0.421 0.460 0.464 0.038  -0.006 -0.051 403 ARG EEE CZ  
3058 N NH1 . ARG C 74  ? 0.426 0.451 0.461 0.040  -0.010 -0.050 403 ARG EEE NH1 
3059 N NH2 . ARG C 74  ? 0.423 0.478 0.484 0.042  -0.003 -0.063 403 ARG EEE NH2 
3060 N N   . GLY C 75  ? 0.222 0.270 0.254 0.017  0.000  -0.025 404 GLY EEE N   
3061 C CA  . GLY C 75  ? 0.216 0.279 0.260 0.014  0.005  -0.029 404 GLY EEE CA  
3062 C C   . GLY C 75  ? 0.219 0.295 0.267 0.010  0.014  -0.033 404 GLY EEE C   
3063 O O   . GLY C 75  ? 0.211 0.293 0.258 0.002  0.021  -0.031 404 GLY EEE O   
3064 N N   . ASP C 76  ? 0.216 0.295 0.267 0.014  0.015  -0.039 405 ASP EEE N   
3065 C CA  . ASP C 76  ? 0.217 0.309 0.271 0.009  0.026  -0.046 405 ASP EEE CA  
3066 C C   . ASP C 76  ? 0.212 0.297 0.245 0.002  0.031  -0.038 405 ASP EEE C   
3067 O O   . ASP C 76  ? 0.241 0.333 0.269 -0.004 0.039  -0.041 405 ASP EEE O   
3068 C CB  . ASP C 76  ? 0.255 0.356 0.324 0.016  0.025  -0.058 405 ASP EEE CB  
3069 C CG  . ASP C 76  ? 0.307 0.392 0.366 0.023  0.018  -0.057 405 ASP EEE CG  
3070 O OD1 . ASP C 76  ? 0.292 0.363 0.333 0.020  0.017  -0.047 405 ASP EEE OD1 
3071 O OD2 . ASP C 76  ? 0.302 0.392 0.377 0.030  0.015  -0.068 405 ASP EEE OD2 
3072 N N   . GLU C 77  ? 0.198 0.267 0.219 0.003  0.025  -0.028 406 GLU EEE N   
3073 C CA  . GLU C 77  ? 0.226 0.286 0.230 -0.003 0.027  -0.019 406 GLU EEE CA  
3074 C C   . GLU C 77  ? 0.241 0.298 0.242 -0.009 0.027  -0.012 406 GLU EEE C   
3075 O O   . GLU C 77  ? 0.251 0.300 0.240 -0.014 0.027  -0.005 406 GLU EEE O   
3076 C CB  . GLU C 77  ? 0.230 0.278 0.228 0.002  0.021  -0.015 406 GLU EEE CB  
3077 C CG  . GLU C 77  ? 0.254 0.302 0.254 0.007  0.019  -0.022 406 GLU EEE CG  
3078 C CD  . GLU C 77  ? 0.280 0.315 0.275 0.010  0.013  -0.018 406 GLU EEE CD  
3079 O OE1 . GLU C 77  ? 0.261 0.289 0.256 0.011  0.010  -0.013 406 GLU EEE OE1 
3080 O OE2 . GLU C 77  ? 0.312 0.344 0.303 0.012  0.012  -0.022 406 GLU EEE OE2 
3081 N N   . VAL C 78  ? 0.232 0.292 0.242 -0.009 0.026  -0.012 407 VAL EEE N   
3082 C CA  . VAL C 78  ? 0.228 0.282 0.237 -0.015 0.026  -0.005 407 VAL EEE CA  
3083 C C   . VAL C 78  ? 0.235 0.291 0.235 -0.025 0.032  -0.002 407 VAL EEE C   
3084 O O   . VAL C 78  ? 0.239 0.285 0.232 -0.030 0.029  0.006  407 VAL EEE O   
3085 C CB  . VAL C 78  ? 0.246 0.303 0.266 -0.013 0.024  -0.008 407 VAL EEE CB  
3086 C CG1 . VAL C 78  ? 0.267 0.319 0.287 -0.020 0.024  -0.003 407 VAL EEE CG1 
3087 C CG2 . VAL C 78  ? 0.235 0.285 0.256 -0.005 0.018  -0.009 407 VAL EEE CG2 
3088 N N   . ARG C 79  ? 0.249 0.318 0.250 -0.029 0.039  -0.009 408 ARG EEE N   
3089 C CA  . ARG C 79  ? 0.282 0.354 0.271 -0.041 0.046  -0.007 408 ARG EEE CA  
3090 C C   . ARG C 79  ? 0.282 0.339 0.250 -0.045 0.042  0.002  408 ARG EEE C   
3091 O O   . ARG C 79  ? 0.300 0.351 0.253 -0.056 0.044  0.009  408 ARG EEE O   
3092 C CB  . ARG C 79  ? 0.297 0.388 0.293 -0.045 0.057  -0.019 408 ARG EEE CB  
3093 C CG  . ARG C 79  ? 0.324 0.419 0.321 -0.036 0.056  -0.027 408 ARG EEE CG  
3094 C CD  . ARG C 79  ? 0.391 0.504 0.395 -0.040 0.068  -0.041 408 ARG EEE CD  
3095 N NE  . ARG C 79  ? 0.496 0.610 0.478 -0.054 0.077  -0.038 408 ARG EEE NE  
3096 C CZ  . ARG C 79  ? 0.547 0.650 0.506 -0.057 0.075  -0.034 408 ARG EEE CZ  
3097 N NH1 . ARG C 79  ? 0.533 0.625 0.490 -0.046 0.066  -0.033 408 ARG EEE NH1 
3098 N NH2 . ARG C 79  ? 0.611 0.712 0.546 -0.072 0.083  -0.032 408 ARG EEE NH2 
3099 N N   . GLN C 80  ? 0.282 0.333 0.249 -0.036 0.036  0.002  409 GLN EEE N   
3100 C CA  . GLN C 80  ? 0.286 0.324 0.236 -0.038 0.030  0.010  409 GLN EEE CA  
3101 C C   . GLN C 80  ? 0.280 0.303 0.230 -0.038 0.021  0.020  409 GLN EEE C   
3102 O O   . GLN C 80  ? 0.312 0.323 0.249 -0.042 0.014  0.028  409 GLN EEE O   
3103 C CB  . GLN C 80  ? 0.295 0.332 0.246 -0.030 0.027  0.005  409 GLN EEE CB  
3104 C CG  . GLN C 80  ? 0.290 0.339 0.239 -0.030 0.035  -0.006 409 GLN EEE CG  
3105 C CD  . GLN C 80  ? 0.290 0.336 0.239 -0.023 0.031  -0.010 409 GLN EEE CD  
3106 O OE1 . GLN C 80  ? 0.274 0.309 0.215 -0.022 0.023  -0.004 409 GLN EEE OE1 
3107 N NE2 . GLN C 80  ? 0.262 0.318 0.223 -0.017 0.034  -0.021 409 GLN EEE NE2 
3108 N N   . ILE C 81  ? 0.279 0.302 0.244 -0.034 0.020  0.020  410 ILE EEE N   
3109 C CA  . ILE C 81  ? 0.277 0.286 0.246 -0.034 0.012  0.027  410 ILE EEE CA  
3110 C C   . ILE C 81  ? 0.298 0.301 0.260 -0.044 0.012  0.034  410 ILE EEE C   
3111 O O   . ILE C 81  ? 0.300 0.304 0.271 -0.045 0.013  0.033  410 ILE EEE O   
3112 C CB  . ILE C 81  ? 0.263 0.274 0.249 -0.025 0.011  0.023  410 ILE EEE CB  
3113 C CG1 . ILE C 81  ? 0.236 0.253 0.225 -0.017 0.012  0.016  410 ILE EEE CG1 
3114 C CG2 . ILE C 81  ? 0.269 0.268 0.262 -0.023 0.004  0.027  410 ILE EEE CG2 
3115 C CD1 . ILE C 81  ? 0.236 0.248 0.221 -0.015 0.008  0.019  410 ILE EEE CD1 
3116 N N   . ALA C 82  ? 0.305 0.301 0.247 -0.053 0.010  0.040  411 ALA EEE N   
3117 C CA  . ALA C 82  ? 0.337 0.323 0.265 -0.067 0.010  0.049  411 ALA EEE CA  
3118 C C   . ALA C 82  ? 0.364 0.336 0.269 -0.074 0.002  0.058  411 ALA EEE C   
3119 O O   . ALA C 82  ? 0.343 0.318 0.240 -0.071 0.002  0.055  411 ALA EEE O   
3120 C CB  . ALA C 82  ? 0.362 0.365 0.289 -0.076 0.024  0.043  411 ALA EEE CB  
3121 N N   . PRO C 83  ? 0.402 0.354 0.292 -0.084 -0.006 0.070  412 PRO EEE N   
3122 C CA  . PRO C 83  ? 0.457 0.393 0.320 -0.093 -0.015 0.080  412 PRO EEE CA  
3123 C C   . PRO C 83  ? 0.482 0.429 0.321 -0.104 -0.002 0.076  412 PRO EEE C   
3124 O O   . PRO C 83  ? 0.458 0.420 0.298 -0.111 0.013  0.069  412 PRO EEE O   
3125 C CB  . PRO C 83  ? 0.495 0.409 0.345 -0.106 -0.023 0.094  412 PRO EEE CB  
3126 C CG  . PRO C 83  ? 0.492 0.408 0.371 -0.097 -0.023 0.090  412 PRO EEE CG  
3127 C CD  . PRO C 83  ? 0.430 0.374 0.330 -0.088 -0.008 0.075  412 PRO EEE CD  
3128 N N   . GLY C 84  ? 0.494 0.434 0.313 -0.106 -0.008 0.078  413 GLY EEE N   
3129 C CA  . GLY C 84  ? 0.512 0.457 0.301 -0.119 0.002  0.075  413 GLY EEE CA  
3130 C C   . GLY C 84  ? 0.482 0.453 0.285 -0.111 0.017  0.058  413 GLY EEE C   
3131 O O   . GLY C 84  ? 0.516 0.496 0.299 -0.121 0.029  0.051  413 GLY EEE O   
3132 N N   . GLN C 85  ? 0.432 0.414 0.267 -0.094 0.016  0.050  414 GLN EEE N   
3133 C CA  . GLN C 85  ? 0.419 0.423 0.269 -0.086 0.028  0.034  414 GLN EEE CA  
3134 C C   . GLN C 85  ? 0.401 0.403 0.246 -0.079 0.022  0.031  414 GLN EEE C   
3135 O O   . GLN C 85  ? 0.420 0.406 0.258 -0.077 0.008  0.040  414 GLN EEE O   
3136 C CB  . GLN C 85  ? 0.400 0.415 0.283 -0.073 0.030  0.028  414 GLN EEE CB  
3137 C CG  . GLN C 85  ? 0.419 0.439 0.310 -0.079 0.036  0.029  414 GLN EEE CG  
3138 C CD  . GLN C 85  ? 0.482 0.516 0.363 -0.092 0.051  0.023  414 GLN EEE CD  
3139 O OE1 . GLN C 85  ? 0.540 0.592 0.431 -0.089 0.062  0.009  414 GLN EEE OE1 
3140 N NE2 . GLN C 85  ? 0.539 0.562 0.401 -0.108 0.053  0.032  414 GLN EEE NE2 
3141 N N   . THR C 86  ? 0.397 0.415 0.247 -0.075 0.032  0.017  415 THR EEE N   
3142 C CA  . THR C 86  ? 0.421 0.439 0.268 -0.069 0.029  0.010  415 THR EEE CA  
3143 C C   . THR C 86  ? 0.406 0.438 0.281 -0.055 0.034  -0.002 415 THR EEE C   
3144 O O   . THR C 86  ? 0.394 0.437 0.286 -0.053 0.042  -0.007 415 THR EEE O   
3145 C CB  . THR C 86  ? 0.484 0.502 0.302 -0.081 0.036  0.006  415 THR EEE CB  
3146 O OG1 . THR C 86  ? 0.567 0.581 0.380 -0.076 0.028  0.002  415 THR EEE OG1 
3147 C CG2 . THR C 86  ? 0.476 0.514 0.298 -0.086 0.054  -0.010 415 THR EEE CG2 
3148 N N   . GLY C 87  ? 0.379 0.409 0.259 -0.047 0.029  -0.006 416 GLY EEE N   
3149 C CA  . GLY C 87  ? 0.345 0.383 0.248 -0.035 0.030  -0.016 416 GLY EEE CA  
3150 C C   . GLY C 87  ? 0.330 0.357 0.241 -0.027 0.018  -0.010 416 GLY EEE C   
3151 O O   . GLY C 87  ? 0.332 0.349 0.237 -0.030 0.010  0.001  416 GLY EEE O   
3152 N N   . LYS C 88  ? 0.321 0.350 0.248 -0.017 0.018  -0.016 417 LYS EEE N   
3153 C CA  . LYS C 88  ? 0.308 0.328 0.242 -0.012 0.009  -0.012 417 LYS EEE CA  
3154 C C   . LYS C 88  ? 0.294 0.310 0.236 -0.011 0.005  -0.002 417 LYS EEE C   
3155 O O   . LYS C 88  ? 0.284 0.294 0.229 -0.011 -0.003 0.003  417 LYS EEE O   
3156 C CB  . LYS C 88  ? 0.337 0.359 0.285 -0.004 0.010  -0.020 417 LYS EEE CB  
3157 C CG  . LYS C 88  ? 0.421 0.446 0.365 -0.002 0.013  -0.032 417 LYS EEE CG  
3158 C CD  . LYS C 88  ? 0.454 0.475 0.383 -0.007 0.011  -0.034 417 LYS EEE CD  
3159 C CE  . LYS C 88  ? 0.485 0.511 0.411 -0.007 0.016  -0.048 417 LYS EEE CE  
3160 N NZ  . LYS C 88  ? 0.527 0.547 0.437 -0.011 0.013  -0.051 417 LYS EEE NZ  
3161 N N   . ILE C 89  ? 0.258 0.278 0.207 -0.011 0.009  -0.001 418 ILE EEE N   
3162 C CA  . ILE C 89  ? 0.265 0.281 0.224 -0.010 0.005  0.006  418 ILE EEE CA  
3163 C C   . ILE C 89  ? 0.272 0.282 0.222 -0.016 -0.000 0.014  418 ILE EEE C   
3164 O O   . ILE C 89  ? 0.261 0.264 0.217 -0.014 -0.008 0.019  418 ILE EEE O   
3165 C CB  . ILE C 89  ? 0.261 0.283 0.229 -0.008 0.010  0.004  418 ILE EEE CB  
3166 C CG1 . ILE C 89  ? 0.263 0.288 0.238 -0.001 0.012  -0.003 418 ILE EEE CG1 
3167 C CG2 . ILE C 89  ? 0.248 0.264 0.224 -0.007 0.007  0.010  418 ILE EEE CG2 
3168 C CD1 . ILE C 89  ? 0.272 0.289 0.250 0.002  0.008  -0.002 418 ILE EEE CD1 
3169 N N   . ALA C 90  ? 0.257 0.267 0.192 -0.024 0.003  0.016  419 ALA EEE N   
3170 C CA  . ALA C 90  ? 0.286 0.285 0.208 -0.031 -0.004 0.026  419 ALA EEE CA  
3171 C C   . ALA C 90  ? 0.312 0.303 0.225 -0.032 -0.014 0.029  419 ALA EEE C   
3172 O O   . ALA C 90  ? 0.361 0.340 0.275 -0.033 -0.026 0.037  419 ALA EEE O   
3173 C CB  . ALA C 90  ? 0.314 0.316 0.220 -0.042 0.003  0.027  419 ALA EEE CB  
3174 N N   . ASP C 91  ? 0.317 0.312 0.223 -0.032 -0.012 0.022  420 ASP EEE N   
3175 C CA  . ASP C 91  ? 0.333 0.320 0.226 -0.034 -0.021 0.024  420 ASP EEE CA  
3176 C C   . ASP C 91  ? 0.319 0.305 0.233 -0.026 -0.030 0.024  420 ASP EEE C   
3177 O O   . ASP C 91  ? 0.333 0.310 0.246 -0.027 -0.042 0.029  420 ASP EEE O   
3178 C CB  . ASP C 91  ? 0.357 0.349 0.233 -0.038 -0.015 0.015  420 ASP EEE CB  
3179 C CG  . ASP C 91  ? 0.428 0.423 0.282 -0.048 -0.005 0.013  420 ASP EEE CG  
3180 O OD1 . ASP C 91  ? 0.430 0.420 0.274 -0.056 -0.006 0.022  420 ASP EEE OD1 
3181 O OD2 . ASP C 91  ? 0.444 0.447 0.291 -0.049 0.005  0.002  420 ASP EEE OD2 
3182 N N   . TYR C 92  ? 0.289 0.282 0.221 -0.019 -0.023 0.017  421 TYR EEE N   
3183 C CA  . TYR C 92  ? 0.272 0.265 0.221 -0.014 -0.028 0.015  421 TYR EEE CA  
3184 C C   . TYR C 92  ? 0.263 0.258 0.233 -0.009 -0.026 0.015  421 TYR EEE C   
3185 O O   . TYR C 92  ? 0.256 0.253 0.242 -0.006 -0.029 0.013  421 TYR EEE O   
3186 C CB  . TYR C 92  ? 0.269 0.265 0.215 -0.012 -0.023 0.006  421 TYR EEE CB  
3187 C CG  . TYR C 92  ? 0.279 0.273 0.205 -0.016 -0.024 0.002  421 TYR EEE CG  
3188 C CD1 . TYR C 92  ? 0.305 0.293 0.214 -0.023 -0.032 0.007  421 TYR EEE CD1 
3189 C CD2 . TYR C 92  ? 0.294 0.292 0.218 -0.014 -0.018 -0.007 421 TYR EEE CD2 
3190 C CE1 . TYR C 92  ? 0.326 0.311 0.213 -0.028 -0.032 0.002  421 TYR EEE CE1 
3191 C CE2 . TYR C 92  ? 0.318 0.315 0.225 -0.018 -0.017 -0.013 421 TYR EEE CE2 
3192 C CZ  . TYR C 92  ? 0.332 0.323 0.219 -0.026 -0.024 -0.009 421 TYR EEE CZ  
3193 O OH  . TYR C 92  ? 0.356 0.345 0.222 -0.031 -0.022 -0.016 421 TYR EEE OH  
3194 N N   . ASN C 93  ? 0.267 0.264 0.240 -0.008 -0.021 0.017  422 ASN EEE N   
3195 C CA  . ASN C 93  ? 0.244 0.245 0.236 -0.004 -0.017 0.015  422 ASN EEE CA  
3196 C C   . ASN C 93  ? 0.245 0.242 0.244 -0.004 -0.020 0.020  422 ASN EEE C   
3197 O O   . ASN C 93  ? 0.261 0.258 0.278 -0.002 -0.023 0.018  422 ASN EEE O   
3198 C CB  . ASN C 93  ? 0.234 0.238 0.223 -0.002 -0.007 0.011  422 ASN EEE CB  
3199 C CG  . ASN C 93  ? 0.229 0.234 0.215 -0.001 -0.006 0.006  422 ASN EEE CG  
3200 O OD1 . ASN C 93  ? 0.236 0.240 0.231 0.000  -0.005 0.004  422 ASN EEE OD1 
3201 N ND2 . ASN C 93  ? 0.242 0.248 0.217 -0.002 -0.006 0.004  422 ASN EEE ND2 
3202 N N   . TYR C 94  ? 0.259 0.254 0.248 -0.008 -0.019 0.024  423 TYR EEE N   
3203 C CA  . TYR C 94  ? 0.247 0.237 0.243 -0.009 -0.022 0.028  423 TYR EEE CA  
3204 C C   . TYR C 94  ? 0.274 0.257 0.250 -0.016 -0.025 0.035  423 TYR EEE C   
3205 O O   . TYR C 94  ? 0.278 0.267 0.243 -0.020 -0.016 0.033  423 TYR EEE O   
3206 C CB  . TYR C 94  ? 0.247 0.242 0.252 -0.006 -0.014 0.023  423 TYR EEE CB  
3207 C CG  . TYR C 94  ? 0.243 0.231 0.258 -0.006 -0.017 0.026  423 TYR EEE CG  
3208 C CD1 . TYR C 94  ? 0.243 0.230 0.278 -0.002 -0.021 0.023  423 TYR EEE CD1 
3209 C CD2 . TYR C 94  ? 0.246 0.231 0.252 -0.011 -0.017 0.030  423 TYR EEE CD2 
3210 C CE1 . TYR C 94  ? 0.234 0.214 0.281 -0.001 -0.026 0.024  423 TYR EEE CE1 
3211 C CE2 . TYR C 94  ? 0.260 0.237 0.275 -0.011 -0.021 0.033  423 TYR EEE CE2 
3212 C CZ  . TYR C 94  ? 0.249 0.222 0.285 -0.006 -0.026 0.029  423 TYR EEE CZ  
3213 O OH  . TYR C 94  ? 0.266 0.231 0.313 -0.005 -0.031 0.030  423 TYR EEE OH  
3214 N N   . LYS C 95  ? 0.275 0.246 0.249 -0.018 -0.037 0.042  424 LYS EEE N   
3215 C CA  . LYS C 95  ? 0.316 0.277 0.266 -0.028 -0.042 0.051  424 LYS EEE CA  
3216 C C   . LYS C 95  ? 0.333 0.282 0.288 -0.030 -0.049 0.058  424 LYS EEE C   
3217 O O   . LYS C 95  ? 0.343 0.283 0.315 -0.025 -0.061 0.060  424 LYS EEE O   
3218 C CB  . LYS C 95  ? 0.340 0.292 0.276 -0.031 -0.054 0.056  424 LYS EEE CB  
3219 C CG  . LYS C 95  ? 0.391 0.329 0.296 -0.044 -0.060 0.066  424 LYS EEE CG  
3220 C CD  . LYS C 95  ? 0.427 0.374 0.312 -0.052 -0.044 0.063  424 LYS EEE CD  
3221 C CE  . LYS C 95  ? 0.487 0.421 0.336 -0.067 -0.046 0.071  424 LYS EEE CE  
3222 N NZ  . LYS C 95  ? 0.487 0.435 0.323 -0.075 -0.028 0.064  424 LYS EEE NZ  
3223 N N   . LEU C 96  ? 0.337 0.284 0.279 -0.038 -0.042 0.062  425 LEU EEE N   
3224 C CA  . LEU C 96  ? 0.348 0.279 0.290 -0.043 -0.050 0.070  425 LEU EEE CA  
3225 C C   . LEU C 96  ? 0.401 0.314 0.316 -0.054 -0.062 0.083  425 LEU EEE C   
3226 O O   . LEU C 96  ? 0.448 0.363 0.337 -0.062 -0.057 0.083  425 LEU EEE O   
3227 C CB  . LEU C 96  ? 0.345 0.283 0.286 -0.048 -0.037 0.068  425 LEU EEE CB  
3228 C CG  . LEU C 96  ? 0.321 0.271 0.287 -0.038 -0.030 0.057  425 LEU EEE CG  
3229 C CD1 . LEU C 96  ? 0.329 0.286 0.294 -0.043 -0.019 0.055  425 LEU EEE CD1 
3230 C CD2 . LEU C 96  ? 0.320 0.260 0.308 -0.030 -0.040 0.057  425 LEU EEE CD2 
3231 N N   . PRO C 97  ? 0.433 0.325 0.350 -0.055 -0.078 0.092  426 PRO EEE N   
3232 C CA  . PRO C 97  ? 0.477 0.345 0.364 -0.067 -0.093 0.106  426 PRO EEE CA  
3233 C C   . PRO C 97  ? 0.504 0.367 0.363 -0.084 -0.083 0.113  426 PRO EEE C   
3234 O O   . PRO C 97  ? 0.491 0.364 0.362 -0.084 -0.070 0.108  426 PRO EEE O   
3235 C CB  . PRO C 97  ? 0.490 0.339 0.398 -0.061 -0.114 0.113  426 PRO EEE CB  
3236 C CG  . PRO C 97  ? 0.468 0.327 0.407 -0.052 -0.104 0.103  426 PRO EEE CG  
3237 C CD  . PRO C 97  ? 0.437 0.324 0.386 -0.045 -0.085 0.089  426 PRO EEE CD  
3238 N N   . ASP C 98  ? 0.578 0.425 0.400 -0.099 -0.089 0.124  427 ASP EEE N   
3239 C CA  . ASP C 98  ? 0.620 0.459 0.412 -0.118 -0.081 0.132  427 ASP EEE CA  
3240 C C   . ASP C 98  ? 0.604 0.425 0.408 -0.120 -0.089 0.140  427 ASP EEE C   
3241 O O   . ASP C 98  ? 0.604 0.431 0.404 -0.129 -0.074 0.138  427 ASP EEE O   
3242 C CB  . ASP C 98  ? 0.697 0.516 0.442 -0.135 -0.089 0.144  427 ASP EEE CB  
3243 C CG  . ASP C 98  ? 0.729 0.565 0.459 -0.136 -0.080 0.135  427 ASP EEE CG  
3244 O OD1 . ASP C 98  ? 0.705 0.569 0.456 -0.126 -0.063 0.120  427 ASP EEE OD1 
3245 O OD2 . ASP C 98  ? 0.877 0.696 0.572 -0.147 -0.091 0.144  427 ASP EEE OD2 
3246 N N   . ASP C 99  ? 0.607 0.409 0.429 -0.110 -0.111 0.146  428 ASP EEE N   
3247 C CA  . ASP C 99  ? 0.661 0.439 0.493 -0.112 -0.123 0.154  428 ASP EEE CA  
3248 C C   . ASP C 99  ? 0.604 0.398 0.481 -0.095 -0.117 0.140  428 ASP EEE C   
3249 O O   . ASP C 99  ? 0.635 0.412 0.533 -0.090 -0.131 0.143  428 ASP EEE O   
3250 C CB  . ASP C 99  ? 0.700 0.445 0.526 -0.111 -0.153 0.168  428 ASP EEE CB  
3251 C CG  . ASP C 99  ? 0.702 0.452 0.561 -0.091 -0.167 0.161  428 ASP EEE CG  
3252 O OD1 . ASP C 99  ? 0.668 0.448 0.552 -0.079 -0.153 0.145  428 ASP EEE OD1 
3253 O OD2 . ASP C 99  ? 0.818 0.543 0.680 -0.089 -0.194 0.171  428 ASP EEE OD2 
3254 N N   . PHE C 100 ? 0.566 0.392 0.458 -0.088 -0.097 0.126  429 PHE EEE N   
3255 C CA  . PHE C 100 ? 0.486 0.329 0.415 -0.073 -0.089 0.111  429 PHE EEE CA  
3256 C C   . PHE C 100 ? 0.501 0.332 0.440 -0.076 -0.090 0.113  429 PHE EEE C   
3257 O O   . PHE C 100 ? 0.484 0.313 0.404 -0.091 -0.082 0.118  429 PHE EEE O   
3258 C CB  . PHE C 100 ? 0.444 0.317 0.375 -0.070 -0.068 0.099  429 PHE EEE CB  
3259 C CG  . PHE C 100 ? 0.391 0.280 0.353 -0.057 -0.059 0.085  429 PHE EEE CG  
3260 C CD1 . PHE C 100 ? 0.377 0.265 0.366 -0.044 -0.067 0.079  429 PHE EEE CD1 
3261 C CD2 . PHE C 100 ? 0.388 0.295 0.352 -0.060 -0.043 0.078  429 PHE EEE CD2 
3262 C CE1 . PHE C 100 ? 0.355 0.257 0.367 -0.035 -0.058 0.066  429 PHE EEE CE1 
3263 C CE2 . PHE C 100 ? 0.338 0.256 0.325 -0.050 -0.037 0.066  429 PHE EEE CE2 
3264 C CZ  . PHE C 100 ? 0.336 0.252 0.345 -0.038 -0.044 0.061  429 PHE EEE CZ  
3265 N N   . THR C 101 ? 0.477 0.303 0.448 -0.064 -0.099 0.107  430 THR EEE N   
3266 C CA  . THR C 101 ? 0.463 0.282 0.450 -0.063 -0.097 0.103  430 THR EEE CA  
3267 C C   . THR C 101 ? 0.414 0.258 0.430 -0.050 -0.084 0.085  430 THR EEE C   
3268 O O   . THR C 101 ? 0.380 0.226 0.420 -0.037 -0.090 0.077  430 THR EEE O   
3269 C CB  . THR C 101 ? 0.491 0.280 0.491 -0.061 -0.120 0.111  430 THR EEE CB  
3270 O OG1 . THR C 101 ? 0.539 0.303 0.506 -0.076 -0.133 0.130  430 THR EEE OG1 
3271 C CG2 . THR C 101 ? 0.512 0.292 0.528 -0.061 -0.119 0.107  430 THR EEE CG2 
3272 N N   . GLY C 102 ? 0.391 0.252 0.403 -0.055 -0.068 0.079  431 GLY EEE N   
3273 C CA  . GLY C 102 ? 0.382 0.264 0.413 -0.044 -0.056 0.063  431 GLY EEE CA  
3274 C C   . GLY C 102 ? 0.359 0.260 0.380 -0.050 -0.040 0.059  431 GLY EEE C   
3275 O O   . GLY C 102 ? 0.370 0.269 0.373 -0.063 -0.036 0.066  431 GLY EEE O   
3276 N N   . CYS C 103 ? 0.335 0.254 0.369 -0.042 -0.031 0.047  432 CYS EEE N   
3277 C CA  . CYS C 103 ? 0.328 0.264 0.358 -0.045 -0.019 0.040  432 CYS EEE CA  
3278 C C   . CYS C 103 ? 0.298 0.252 0.328 -0.037 -0.012 0.033  432 CYS EEE C   
3279 O O   . CYS C 103 ? 0.299 0.252 0.339 -0.028 -0.014 0.029  432 CYS EEE O   
3280 C CB  . CYS C 103 ? 0.339 0.274 0.382 -0.044 -0.017 0.033  432 CYS EEE CB  
3281 S SG  . CYS C 103 ? 0.410 0.322 0.456 -0.054 -0.026 0.040  432 CYS EEE SG  
3282 N N   . VAL C 104 ? 0.279 0.247 0.300 -0.041 -0.004 0.032  433 VAL EEE N   
3283 C CA  . VAL C 104 ? 0.251 0.234 0.271 -0.034 0.002  0.026  433 VAL EEE CA  
3284 C C   . VAL C 104 ? 0.254 0.248 0.281 -0.033 0.007  0.018  433 VAL EEE C   
3285 O O   . VAL C 104 ? 0.259 0.258 0.286 -0.040 0.010  0.018  433 VAL EEE O   
3286 C CB  . VAL C 104 ? 0.262 0.252 0.268 -0.038 0.006  0.029  433 VAL EEE CB  
3287 C CG1 . VAL C 104 ? 0.244 0.247 0.251 -0.031 0.010  0.022  433 VAL EEE CG1 
3288 C CG2 . VAL C 104 ? 0.286 0.264 0.282 -0.041 -0.001 0.038  433 VAL EEE CG2 
3289 N N   . ILE C 105 ? 0.225 0.220 0.256 -0.026 0.007  0.011  434 ILE EEE N   
3290 C CA  . ILE C 105 ? 0.235 0.236 0.270 -0.024 0.009  0.003  434 ILE EEE CA  
3291 C C   . ILE C 105 ? 0.224 0.233 0.254 -0.019 0.011  -0.000 434 ILE EEE C   
3292 O O   . ILE C 105 ? 0.221 0.227 0.248 -0.015 0.011  0.000  434 ILE EEE O   
3293 C CB  . ILE C 105 ? 0.238 0.229 0.279 -0.023 0.007  -0.002 434 ILE EEE CB  
3294 C CG1 . ILE C 105 ? 0.275 0.255 0.323 -0.027 0.003  0.003  434 ILE EEE CG1 
3295 C CG2 . ILE C 105 ? 0.243 0.239 0.284 -0.023 0.008  -0.009 434 ILE EEE CG2 
3296 C CD1 . ILE C 105 ? 0.279 0.248 0.337 -0.023 0.001  -0.003 434 ILE EEE CD1 
3297 N N   . ALA C 106 ? 0.208 0.227 0.238 -0.019 0.012  -0.003 435 ALA EEE N   
3298 C CA  . ALA C 106 ? 0.215 0.239 0.241 -0.014 0.011  -0.006 435 ALA EEE CA  
3299 C C   . ALA C 106 ? 0.219 0.247 0.246 -0.014 0.007  -0.011 435 ALA EEE C   
3300 O O   . ALA C 106 ? 0.235 0.267 0.270 -0.018 0.006  -0.013 435 ALA EEE O   
3301 C CB  . ALA C 106 ? 0.224 0.255 0.248 -0.014 0.013  -0.004 435 ALA EEE CB  
3302 N N   . TRP C 107 ? 0.229 0.253 0.247 -0.009 0.004  -0.013 436 TRP EEE N   
3303 C CA  . TRP C 107 ? 0.229 0.254 0.246 -0.008 -0.003 -0.017 436 TRP EEE CA  
3304 C C   . TRP C 107 ? 0.225 0.246 0.234 -0.004 -0.007 -0.016 436 TRP EEE C   
3305 O O   . TRP C 107 ? 0.222 0.237 0.223 -0.003 -0.004 -0.014 436 TRP EEE O   
3306 C CB  . TRP C 107 ? 0.247 0.263 0.257 -0.012 -0.005 -0.020 436 TRP EEE CB  
3307 C CG  . TRP C 107 ? 0.261 0.266 0.257 -0.012 -0.002 -0.020 436 TRP EEE CG  
3308 C CD1 . TRP C 107 ? 0.305 0.302 0.284 -0.013 -0.005 -0.021 436 TRP EEE CD1 
3309 C CD2 . TRP C 107 ? 0.261 0.262 0.258 -0.013 0.006  -0.020 436 TRP EEE CD2 
3310 N NE1 . TRP C 107 ? 0.319 0.309 0.289 -0.015 0.002  -0.022 436 TRP EEE NE1 
3311 C CE2 . TRP C 107 ? 0.298 0.292 0.282 -0.014 0.009  -0.023 436 TRP EEE CE2 
3312 C CE3 . TRP C 107 ? 0.251 0.254 0.261 -0.013 0.009  -0.018 436 TRP EEE CE3 
3313 C CZ2 . TRP C 107 ? 0.306 0.297 0.293 -0.015 0.016  -0.025 436 TRP EEE CZ2 
3314 C CZ3 . TRP C 107 ? 0.268 0.267 0.281 -0.013 0.014  -0.019 436 TRP EEE CZ3 
3315 C CH2 . TRP C 107 ? 0.278 0.273 0.282 -0.013 0.018  -0.024 436 TRP EEE CH2 
3316 N N   . ASN C 108 ? 0.240 0.265 0.255 -0.001 -0.016 -0.019 437 ASN EEE N   
3317 C CA  . ASN C 108 ? 0.228 0.248 0.237 0.004  -0.024 -0.019 437 ASN EEE CA  
3318 C C   . ASN C 108 ? 0.263 0.266 0.248 0.001  -0.026 -0.016 437 ASN EEE C   
3319 O O   . ASN C 108 ? 0.265 0.262 0.242 -0.003 -0.029 -0.017 437 ASN EEE O   
3320 C CB  . ASN C 108 ? 0.247 0.274 0.270 0.008  -0.035 -0.023 437 ASN EEE CB  
3321 C CG  . ASN C 108 ? 0.274 0.293 0.294 0.014  -0.045 -0.023 437 ASN EEE CG  
3322 O OD1 . ASN C 108 ? 0.285 0.287 0.284 0.013  -0.052 -0.018 437 ASN EEE OD1 
3323 N ND2 . ASN C 108 ? 0.250 0.281 0.290 0.020  -0.046 -0.027 437 ASN EEE ND2 
3324 N N   . SER C 109 ? 0.264 0.257 0.237 0.002  -0.025 -0.012 438 SER EEE N   
3325 C CA  . SER C 109 ? 0.275 0.252 0.224 -0.003 -0.025 -0.009 438 SER EEE CA  
3326 C C   . SER C 109 ? 0.285 0.249 0.222 -0.002 -0.036 -0.005 438 SER EEE C   
3327 O O   . SER C 109 ? 0.314 0.264 0.230 -0.007 -0.033 -0.002 438 SER EEE O   
3328 C CB  . SER C 109 ? 0.277 0.254 0.224 -0.006 -0.012 -0.009 438 SER EEE CB  
3329 O OG  . SER C 109 ? 0.273 0.253 0.226 -0.003 -0.010 -0.006 438 SER EEE OG  
3330 N N   . ASN C 110 ? 0.286 0.253 0.235 0.005  -0.047 -0.007 439 ASN EEE N   
3331 C CA  . ASN C 110 ? 0.307 0.260 0.248 0.008  -0.061 -0.003 439 ASN EEE CA  
3332 C C   . ASN C 110 ? 0.353 0.283 0.262 0.001  -0.069 0.002  439 ASN EEE C   
3333 O O   . ASN C 110 ? 0.386 0.298 0.277 -0.002 -0.074 0.008  439 ASN EEE O   
3334 C CB  . ASN C 110 ? 0.316 0.277 0.280 0.017  -0.074 -0.008 439 ASN EEE CB  
3335 C CG  . ASN C 110 ? 0.314 0.263 0.279 0.023  -0.086 -0.006 439 ASN EEE CG  
3336 O OD1 . ASN C 110 ? 0.323 0.267 0.283 0.023  -0.080 -0.004 439 ASN EEE OD1 
3337 N ND2 . ASN C 110 ? 0.362 0.305 0.335 0.028  -0.105 -0.007 439 ASN EEE ND2 
3338 N N   . ASN C 111 ? 0.355 0.284 0.254 -0.005 -0.070 0.000  440 ASN EEE N   
3339 C CA  . ASN C 111 ? 0.437 0.344 0.302 -0.014 -0.078 0.005  440 ASN EEE CA  
3340 C C   . ASN C 111 ? 0.453 0.350 0.293 -0.024 -0.063 0.007  440 ASN EEE C   
3341 O O   . ASN C 111 ? 0.480 0.355 0.288 -0.032 -0.070 0.013  440 ASN EEE O   
3342 C CB  . ASN C 111 ? 0.463 0.372 0.324 -0.017 -0.084 0.001  440 ASN EEE CB  
3343 C CG  . ASN C 111 ? 0.480 0.395 0.363 -0.008 -0.102 -0.002 440 ASN EEE CG  
3344 O OD1 . ASN C 111 ? 0.528 0.437 0.417 -0.002 -0.116 0.001  440 ASN EEE OD1 
3345 N ND2 . ASN C 111 ? 0.503 0.432 0.400 -0.008 -0.101 -0.008 440 ASN EEE ND2 
3346 N N   . LEU C 112 ? 0.444 0.357 0.299 -0.024 -0.045 0.003  441 LEU EEE N   
3347 C CA  . LEU C 112 ? 0.478 0.387 0.318 -0.033 -0.030 0.003  441 LEU EEE CA  
3348 C C   . LEU C 112 ? 0.467 0.374 0.311 -0.031 -0.026 0.007  441 LEU EEE C   
3349 O O   . LEU C 112 ? 0.512 0.406 0.335 -0.040 -0.021 0.010  441 LEU EEE O   
3350 C CB  . LEU C 112 ? 0.461 0.386 0.318 -0.033 -0.015 -0.005 441 LEU EEE CB  
3351 C CG  . LEU C 112 ? 0.524 0.451 0.376 -0.036 -0.016 -0.011 441 LEU EEE CG  
3352 C CD1 . LEU C 112 ? 0.509 0.451 0.383 -0.034 -0.002 -0.018 441 LEU EEE CD1 
3353 C CD2 . LEU C 112 ? 0.602 0.511 0.418 -0.048 -0.016 -0.011 441 LEU EEE CD2 
3354 N N   . ASP C 113 ? 0.407 0.326 0.278 -0.021 -0.029 0.007  442 ASP EEE N   
3355 C CA  . ASP C 113 ? 0.390 0.313 0.271 -0.019 -0.022 0.008  442 ASP EEE CA  
3356 C C   . ASP C 113 ? 0.431 0.344 0.311 -0.014 -0.034 0.013  442 ASP EEE C   
3357 O O   . ASP C 113 ? 0.448 0.361 0.334 -0.013 -0.029 0.013  442 ASP EEE O   
3358 C CB  . ASP C 113 ? 0.337 0.281 0.245 -0.013 -0.013 0.003  442 ASP EEE CB  
3359 C CG  . ASP C 113 ? 0.333 0.284 0.243 -0.018 -0.000 -0.001 442 ASP EEE CG  
3360 O OD1 . ASP C 113 ? 0.335 0.278 0.229 -0.026 0.007  -0.001 442 ASP EEE OD1 
3361 O OD2 . ASP C 113 ? 0.322 0.286 0.249 -0.014 0.003  -0.004 442 ASP EEE OD2 
3362 N N   A SER C 114 ? 0.456 0.359 0.331 -0.010 -0.050 0.015  443 SER EEE N   
3363 N N   B SER C 114 ? 0.429 0.331 0.304 -0.011 -0.050 0.015  443 SER EEE N   
3364 C CA  A SER C 114 ? 0.475 0.361 0.346 -0.007 -0.065 0.019  443 SER EEE CA  
3365 C CA  B SER C 114 ? 0.431 0.317 0.303 -0.006 -0.065 0.019  443 SER EEE CA  
3366 C C   A SER C 114 ? 0.498 0.356 0.335 -0.016 -0.075 0.027  443 SER EEE C   
3367 C C   B SER C 114 ? 0.474 0.332 0.310 -0.017 -0.075 0.027  443 SER EEE C   
3368 O O   A SER C 114 ? 0.489 0.345 0.309 -0.024 -0.073 0.027  443 SER EEE O   
3369 O O   B SER C 114 ? 0.467 0.322 0.285 -0.025 -0.072 0.027  443 SER EEE O   
3370 C CB  A SER C 114 ? 0.496 0.391 0.393 0.006  -0.077 0.014  443 SER EEE CB  
3371 C CB  B SER C 114 ? 0.421 0.316 0.317 0.006  -0.078 0.014  443 SER EEE CB  
3372 O OG  A SER C 114 ? 0.539 0.419 0.437 0.011  -0.089 0.017  443 SER EEE OG  
3373 O OG  B SER C 114 ? 0.404 0.291 0.291 0.005  -0.092 0.016  443 SER EEE OG  
3374 N N   . LYS C 115 ? 0.494 0.331 0.319 -0.018 -0.085 0.033  444 LYS EEE N   
3375 C CA  . LYS C 115 ? 0.556 0.362 0.343 -0.029 -0.098 0.043  444 LYS EEE CA  
3376 C C   . LYS C 115 ? 0.555 0.340 0.344 -0.022 -0.118 0.049  444 LYS EEE C   
3377 O O   . LYS C 115 ? 0.499 0.295 0.316 -0.012 -0.116 0.044  444 LYS EEE O   
3378 C CB  . LYS C 115 ? 0.627 0.425 0.386 -0.046 -0.081 0.047  444 LYS EEE CB  
3379 C CG  . LYS C 115 ? 0.657 0.458 0.423 -0.048 -0.069 0.047  444 LYS EEE CG  
3380 C CD  . LYS C 115 ? 0.733 0.522 0.469 -0.066 -0.056 0.051  444 LYS EEE CD  
3381 C CE  . LYS C 115 ? 0.767 0.567 0.520 -0.068 -0.041 0.048  444 LYS EEE CE  
3382 N NZ  . LYS C 115 ? 0.865 0.646 0.588 -0.087 -0.034 0.054  444 LYS EEE NZ  
3383 N N   . VAL C 116 ? 0.576 0.331 0.335 -0.028 -0.137 0.058  445 VAL EEE N   
3384 C CA  . VAL C 116 ? 0.645 0.373 0.402 -0.024 -0.160 0.065  445 VAL EEE CA  
3385 C C   . VAL C 116 ? 0.640 0.360 0.392 -0.030 -0.149 0.068  445 VAL EEE C   
3386 O O   . VAL C 116 ? 0.625 0.343 0.353 -0.046 -0.132 0.071  445 VAL EEE O   
3387 C CB  . VAL C 116 ? 0.713 0.405 0.429 -0.034 -0.182 0.077  445 VAL EEE CB  
3388 C CG1 . VAL C 116 ? 0.750 0.408 0.461 -0.030 -0.208 0.085  445 VAL EEE CG1 
3389 C CG2 . VAL C 116 ? 0.743 0.443 0.466 -0.027 -0.194 0.073  445 VAL EEE CG2 
3390 N N   . GLY C 117 ? 0.625 0.345 0.404 -0.018 -0.157 0.064  446 GLY EEE N   
3391 C CA  . GLY C 117 ? 0.659 0.375 0.440 -0.021 -0.148 0.065  446 GLY EEE CA  
3392 C C   . GLY C 117 ? 0.580 0.332 0.390 -0.016 -0.125 0.054  446 GLY EEE C   
3393 O O   . GLY C 117 ? 0.601 0.354 0.418 -0.017 -0.117 0.053  446 GLY EEE O   
3394 N N   . GLY C 118 ? 0.514 0.293 0.338 -0.012 -0.114 0.047  447 GLY EEE N   
3395 C CA  . GLY C 118 ? 0.466 0.278 0.316 -0.007 -0.095 0.037  447 GLY EEE CA  
3396 C C   . GLY C 118 ? 0.439 0.260 0.276 -0.019 -0.075 0.038  447 GLY EEE C   
3397 O O   . GLY C 118 ? 0.452 0.254 0.262 -0.033 -0.072 0.045  447 GLY EEE O   
3398 N N   . ASN C 119 ? 0.409 0.257 0.263 -0.016 -0.061 0.031  448 ASN EEE N   
3399 C CA  . ASN C 119 ? 0.386 0.246 0.236 -0.025 -0.042 0.029  448 ASN EEE CA  
3400 C C   . ASN C 119 ? 0.358 0.233 0.230 -0.021 -0.033 0.025  448 ASN EEE C   
3401 O O   . ASN C 119 ? 0.357 0.250 0.251 -0.011 -0.032 0.019  448 ASN EEE O   
3402 C CB  . ASN C 119 ? 0.381 0.257 0.236 -0.025 -0.034 0.025  448 ASN EEE CB  
3403 C CG  . ASN C 119 ? 0.409 0.297 0.264 -0.033 -0.016 0.021  448 ASN EEE CG  
3404 O OD1 . ASN C 119 ? 0.426 0.310 0.276 -0.041 -0.009 0.023  448 ASN EEE OD1 
3405 N ND2 . ASN C 119 ? 0.439 0.343 0.303 -0.032 -0.009 0.016  448 ASN EEE ND2 
3406 N N   . TYR C 120 ? 0.366 0.232 0.230 -0.029 -0.028 0.027  449 TYR EEE N   
3407 C CA  . TYR C 120 ? 0.355 0.233 0.238 -0.026 -0.022 0.023  449 TYR EEE CA  
3408 C C   . TYR C 120 ? 0.349 0.245 0.242 -0.031 -0.006 0.019  449 TYR EEE C   
3409 O O   . TYR C 120 ? 0.331 0.238 0.240 -0.029 -0.002 0.016  449 TYR EEE O   
3410 C CB  . TYR C 120 ? 0.373 0.230 0.246 -0.031 -0.029 0.028  449 TYR EEE CB  
3411 C CG  . TYR C 120 ? 0.372 0.213 0.245 -0.022 -0.046 0.029  449 TYR EEE CG  
3412 C CD1 . TYR C 120 ? 0.397 0.218 0.253 -0.023 -0.059 0.035  449 TYR EEE CD1 
3413 C CD2 . TYR C 120 ? 0.363 0.209 0.256 -0.012 -0.051 0.023  449 TYR EEE CD2 
3414 C CE1 . TYR C 120 ? 0.408 0.215 0.270 -0.014 -0.077 0.036  449 TYR EEE CE1 
3415 C CE2 . TYR C 120 ? 0.371 0.204 0.269 -0.003 -0.066 0.022  449 TYR EEE CE2 
3416 C CZ  . TYR C 120 ? 0.404 0.218 0.289 -0.003 -0.080 0.028  449 TYR EEE CZ  
3417 O OH  . TYR C 120 ? 0.416 0.217 0.310 0.008  -0.098 0.026  449 TYR EEE OH  
3418 N N   . ASN C 121 ? 0.368 0.269 0.254 -0.037 0.001  0.018  450 ASN EEE N   
3419 C CA  . ASN C 121 ? 0.371 0.289 0.268 -0.042 0.016  0.013  450 ASN EEE CA  
3420 C C   . ASN C 121 ? 0.346 0.284 0.270 -0.031 0.017  0.008  450 ASN EEE C   
3421 O O   . ASN C 121 ? 0.315 0.265 0.253 -0.033 0.025  0.004  450 ASN EEE O   
3422 C CB  . ASN C 121 ? 0.429 0.346 0.313 -0.049 0.023  0.011  450 ASN EEE CB  
3423 C CG  . ASN C 121 ? 0.487 0.384 0.341 -0.063 0.025  0.016  450 ASN EEE CG  
3424 O OD1 . ASN C 121 ? 0.535 0.422 0.382 -0.070 0.025  0.020  450 ASN EEE OD1 
3425 N ND2 . ASN C 121 ? 0.593 0.483 0.427 -0.069 0.026  0.016  450 ASN EEE ND2 
3426 N N   . TYR C 122 ? 0.282 0.224 0.211 -0.022 0.010  0.008  451 TYR EEE N   
3427 C CA  . TYR C 122 ? 0.277 0.236 0.225 -0.014 0.011  0.005  451 TYR EEE CA  
3428 C C   . TYR C 122 ? 0.258 0.219 0.214 -0.009 0.007  0.004  451 TYR EEE C   
3429 O O   . TYR C 122 ? 0.263 0.215 0.214 -0.006 -0.000 0.005  451 TYR EEE O   
3430 C CB  . TYR C 122 ? 0.261 0.223 0.210 -0.008 0.007  0.004  451 TYR EEE CB  
3431 C CG  . TYR C 122 ? 0.275 0.237 0.218 -0.013 0.012  0.003  451 TYR EEE CG  
3432 C CD1 . TYR C 122 ? 0.286 0.259 0.240 -0.014 0.020  -0.001 451 TYR EEE CD1 
3433 C CD2 . TYR C 122 ? 0.313 0.264 0.239 -0.015 0.007  0.005  451 TYR EEE CD2 
3434 C CE1 . TYR C 122 ? 0.298 0.271 0.247 -0.018 0.024  -0.004 451 TYR EEE CE1 
3435 C CE2 . TYR C 122 ? 0.334 0.285 0.252 -0.020 0.011  0.003  451 TYR EEE CE2 
3436 C CZ  . TYR C 122 ? 0.333 0.296 0.264 -0.021 0.021  -0.002 451 TYR EEE CZ  
3437 O OH  . TYR C 122 ? 0.320 0.282 0.244 -0.026 0.025  -0.006 451 TYR EEE OH  
3438 N N   . LEU C 123 ? 0.237 0.208 0.207 -0.009 0.011  0.002  452 LEU EEE N   
3439 C CA  . LEU C 123 ? 0.237 0.210 0.213 -0.007 0.007  0.001  452 LEU EEE CA  
3440 C C   . LEU C 123 ? 0.217 0.201 0.201 -0.002 0.006  -0.000 452 LEU EEE C   
3441 O O   . LEU C 123 ? 0.222 0.213 0.212 -0.002 0.009  0.000  452 LEU EEE O   
3442 C CB  . LEU C 123 ? 0.246 0.220 0.229 -0.013 0.010  0.000  452 LEU EEE CB  
3443 C CG  . LEU C 123 ? 0.278 0.241 0.251 -0.021 0.014  0.001  452 LEU EEE CG  
3444 C CD1 . LEU C 123 ? 0.292 0.259 0.276 -0.028 0.018  -0.001 452 LEU EEE CD1 
3445 C CD2 . LEU C 123 ? 0.277 0.224 0.235 -0.020 0.007  0.005  452 LEU EEE CD2 
3446 N N   . TYR C 124 ? 0.212 0.198 0.197 0.001  0.002  -0.002 453 TYR EEE N   
3447 C CA  . TYR C 124 ? 0.212 0.206 0.200 0.002  0.001  -0.002 453 TYR EEE CA  
3448 C C   . TYR C 124 ? 0.213 0.205 0.200 0.001  -0.003 -0.003 453 TYR EEE C   
3449 O O   . TYR C 124 ? 0.239 0.224 0.224 0.001  -0.004 -0.005 453 TYR EEE O   
3450 C CB  . TYR C 124 ? 0.229 0.226 0.212 0.006  0.001  -0.004 453 TYR EEE CB  
3451 C CG  . TYR C 124 ? 0.255 0.248 0.235 0.009  -0.001 -0.009 453 TYR EEE CG  
3452 C CD1 . TYR C 124 ? 0.256 0.241 0.234 0.011  -0.004 -0.009 453 TYR EEE CD1 
3453 C CD2 . TYR C 124 ? 0.262 0.257 0.239 0.010  -0.003 -0.013 453 TYR EEE CD2 
3454 C CE1 . TYR C 124 ? 0.277 0.257 0.256 0.015  -0.008 -0.014 453 TYR EEE CE1 
3455 C CE2 . TYR C 124 ? 0.286 0.277 0.263 0.013  -0.005 -0.019 453 TYR EEE CE2 
3456 C CZ  . TYR C 124 ? 0.292 0.274 0.271 0.017  -0.008 -0.020 453 TYR EEE CZ  
3457 O OH  . TYR C 124 ? 0.321 0.297 0.303 0.021  -0.013 -0.026 453 TYR EEE OH  
3458 N N   . ARG C 125 ? 0.226 0.223 0.216 0.000  -0.005 -0.002 454 ARG EEE N   
3459 C CA  . ARG C 125 ? 0.223 0.219 0.210 -0.001 -0.011 -0.004 454 ARG EEE CA  
3460 C C   . ARG C 125 ? 0.228 0.223 0.202 0.000  -0.011 -0.008 454 ARG EEE C   
3461 O O   . ARG C 125 ? 0.234 0.234 0.203 0.000  -0.008 -0.006 454 ARG EEE O   
3462 C CB  . ARG C 125 ? 0.231 0.229 0.224 -0.003 -0.016 -0.000 454 ARG EEE CB  
3463 C CG  . ARG C 125 ? 0.236 0.232 0.226 -0.005 -0.024 -0.002 454 ARG EEE CG  
3464 C CD  . ARG C 125 ? 0.252 0.250 0.251 -0.006 -0.033 0.002  454 ARG EEE CD  
3465 N NE  . ARG C 125 ? 0.230 0.232 0.250 -0.005 -0.031 0.002  454 ARG EEE NE  
3466 C CZ  . ARG C 125 ? 0.225 0.230 0.262 -0.007 -0.032 -0.002 454 ARG EEE CZ  
3467 N NH1 . ARG C 125 ? 0.230 0.232 0.262 -0.009 -0.035 -0.005 454 ARG EEE NH1 
3468 N NH2 . ARG C 125 ? 0.218 0.229 0.275 -0.007 -0.027 -0.004 454 ARG EEE NH2 
3469 N N   . LEU C 126 ? 0.229 0.220 0.199 0.001  -0.012 -0.013 455 LEU EEE N   
3470 C CA  . LEU C 126 ? 0.263 0.255 0.224 0.002  -0.011 -0.020 455 LEU EEE CA  
3471 C C   . LEU C 126 ? 0.270 0.263 0.221 -0.002 -0.015 -0.022 455 LEU EEE C   
3472 O O   . LEU C 126 ? 0.282 0.277 0.221 -0.003 -0.012 -0.027 455 LEU EEE O   
3473 C CB  . LEU C 126 ? 0.262 0.248 0.227 0.006  -0.012 -0.026 455 LEU EEE CB  
3474 C CG  . LEU C 126 ? 0.267 0.255 0.228 0.009  -0.010 -0.036 455 LEU EEE CG  
3475 C CD1 . LEU C 126 ? 0.278 0.278 0.239 0.010  -0.003 -0.038 455 LEU EEE CD1 
3476 C CD2 . LEU C 126 ? 0.293 0.271 0.261 0.014  -0.013 -0.041 455 LEU EEE CD2 
3477 N N   . PHE C 127 ? 0.273 0.261 0.226 -0.005 -0.022 -0.019 456 PHE EEE N   
3478 C CA  . PHE C 127 ? 0.281 0.266 0.223 -0.009 -0.029 -0.021 456 PHE EEE CA  
3479 C C   . PHE C 127 ? 0.279 0.265 0.225 -0.012 -0.037 -0.013 456 PHE EEE C   
3480 O O   . PHE C 127 ? 0.267 0.255 0.232 -0.011 -0.038 -0.009 456 PHE EEE O   
3481 C CB  . PHE C 127 ? 0.292 0.271 0.238 -0.009 -0.033 -0.027 456 PHE EEE CB  
3482 C CG  . PHE C 127 ? 0.316 0.292 0.261 -0.005 -0.027 -0.035 456 PHE EEE CG  
3483 C CD1 . PHE C 127 ? 0.336 0.314 0.269 -0.004 -0.024 -0.044 456 PHE EEE CD1 
3484 C CD2 . PHE C 127 ? 0.317 0.289 0.275 -0.001 -0.026 -0.034 456 PHE EEE CD2 
3485 C CE1 . PHE C 127 ? 0.352 0.328 0.290 0.001  -0.021 -0.054 456 PHE EEE CE1 
3486 C CE2 . PHE C 127 ? 0.332 0.298 0.290 0.003  -0.024 -0.041 456 PHE EEE CE2 
3487 C CZ  . PHE C 127 ? 0.336 0.305 0.287 0.005  -0.022 -0.052 456 PHE EEE CZ  
3488 N N   . ARG C 128 ? 0.302 0.286 0.233 -0.017 -0.043 -0.011 457 ARG EEE N   
3489 C CA  . ARG C 128 ? 0.302 0.283 0.235 -0.019 -0.056 -0.003 457 ARG EEE CA  
3490 C C   . ARG C 128 ? 0.338 0.312 0.245 -0.026 -0.064 -0.003 457 ARG EEE C   
3491 O O   . ARG C 128 ? 0.340 0.314 0.225 -0.029 -0.056 -0.007 457 ARG EEE O   
3492 C CB  . ARG C 128 ? 0.297 0.280 0.238 -0.018 -0.054 0.005  457 ARG EEE CB  
3493 C CG  . ARG C 128 ? 0.297 0.278 0.255 -0.017 -0.066 0.010  457 ARG EEE CG  
3494 C CD  . ARG C 128 ? 0.307 0.290 0.276 -0.014 -0.064 0.016  457 ARG EEE CD  
3495 N NE  . ARG C 128 ? 0.316 0.299 0.310 -0.012 -0.075 0.018  457 ARG EEE NE  
3496 C CZ  . ARG C 128 ? 0.371 0.346 0.363 -0.013 -0.090 0.025  457 ARG EEE CZ  
3497 N NH1 . ARG C 128 ? 0.367 0.332 0.328 -0.019 -0.096 0.032  457 ARG EEE NH1 
3498 N NH2 . ARG C 128 ? 0.368 0.346 0.389 -0.009 -0.100 0.025  457 ARG EEE NH2 
3499 N N   . LYS C 129 ? 0.357 0.327 0.267 -0.028 -0.079 0.000  458 LYS EEE N   
3500 C CA  . LYS C 129 ? 0.409 0.369 0.291 -0.036 -0.090 0.001  458 LYS EEE CA  
3501 C C   . LYS C 129 ? 0.426 0.379 0.284 -0.042 -0.093 0.010  458 LYS EEE C   
3502 O O   . LYS C 129 ? 0.441 0.385 0.267 -0.050 -0.098 0.011  458 LYS EEE O   
3503 C CB  . LYS C 129 ? 0.444 0.401 0.340 -0.036 -0.108 0.002  458 LYS EEE CB  
3504 C CG  . LYS C 129 ? 0.472 0.433 0.383 -0.034 -0.106 -0.007 458 LYS EEE CG  
3505 C CD  . LYS C 129 ? 0.523 0.487 0.464 -0.032 -0.120 -0.007 458 LYS EEE CD  
3506 C CE  . LYS C 129 ? 0.598 0.553 0.525 -0.037 -0.140 -0.005 458 LYS EEE CE  
3507 N NZ  . LYS C 129 ? 0.632 0.593 0.595 -0.035 -0.154 -0.005 458 LYS EEE NZ  
3508 N N   . SER C 130 ? 0.402 0.357 0.274 -0.038 -0.091 0.018  459 SER EEE N   
3509 C CA  . SER C 130 ? 0.429 0.375 0.282 -0.044 -0.095 0.028  459 SER EEE CA  
3510 C C   . SER C 130 ? 0.403 0.355 0.273 -0.039 -0.084 0.031  459 SER EEE C   
3511 O O   . SER C 130 ? 0.379 0.342 0.278 -0.031 -0.077 0.026  459 SER EEE O   
3512 C CB  . SER C 130 ? 0.471 0.405 0.324 -0.046 -0.118 0.038  459 SER EEE CB  
3513 O OG  . SER C 130 ? 0.474 0.413 0.366 -0.037 -0.124 0.039  459 SER EEE OG  
3514 N N   . ASN C 131 ? 0.400 0.346 0.251 -0.046 -0.082 0.038  460 ASN EEE N   
3515 C CA  . ASN C 131 ? 0.397 0.349 0.263 -0.043 -0.072 0.040  460 ASN EEE CA  
3516 C C   . ASN C 131 ? 0.381 0.328 0.272 -0.037 -0.085 0.047  460 ASN EEE C   
3517 O O   . ASN C 131 ? 0.393 0.328 0.282 -0.038 -0.103 0.053  460 ASN EEE O   
3518 C CB  . ASN C 131 ? 0.422 0.369 0.260 -0.053 -0.066 0.046  460 ASN EEE CB  
3519 C CG  . ASN C 131 ? 0.446 0.401 0.263 -0.059 -0.050 0.036  460 ASN EEE CG  
3520 O OD1 . ASN C 131 ? 0.453 0.418 0.281 -0.053 -0.043 0.025  460 ASN EEE OD1 
3521 N ND2 . ASN C 131 ? 0.485 0.436 0.274 -0.071 -0.045 0.039  460 ASN EEE ND2 
3522 N N   . LEU C 132 ? 0.348 0.303 0.264 -0.030 -0.076 0.044  461 LEU EEE N   
3523 C CA  . LEU C 132 ? 0.353 0.304 0.295 -0.024 -0.085 0.048  461 LEU EEE CA  
3524 C C   . LEU C 132 ? 0.395 0.330 0.321 -0.030 -0.096 0.060  461 LEU EEE C   
3525 O O   . LEU C 132 ? 0.405 0.336 0.303 -0.039 -0.089 0.064  461 LEU EEE O   
3526 C CB  . LEU C 132 ? 0.326 0.289 0.288 -0.018 -0.070 0.043  461 LEU EEE CB  
3527 C CG  . LEU C 132 ? 0.314 0.290 0.293 -0.013 -0.060 0.033  461 LEU EEE CG  
3528 C CD1 . LEU C 132 ? 0.303 0.286 0.295 -0.009 -0.048 0.029  461 LEU EEE CD1 
3529 C CD2 . LEU C 132 ? 0.333 0.310 0.336 -0.008 -0.070 0.030  461 LEU EEE CD2 
3530 N N   . LYS C 133 ? 0.407 0.333 0.351 -0.026 -0.113 0.065  462 LYS EEE N   
3531 C CA  . LYS C 133 ? 0.456 0.365 0.395 -0.030 -0.125 0.076  462 LYS EEE CA  
3532 C C   . LYS C 133 ? 0.425 0.341 0.382 -0.026 -0.111 0.072  462 LYS EEE C   
3533 O O   . LYS C 133 ? 0.359 0.292 0.338 -0.019 -0.098 0.062  462 LYS EEE O   
3534 C CB  . LYS C 133 ? 0.530 0.428 0.491 -0.024 -0.149 0.080  462 LYS EEE CB  
3535 C CG  . LYS C 133 ? 0.615 0.503 0.556 -0.029 -0.167 0.085  462 LYS EEE CG  
3536 C CD  . LYS C 133 ? 0.706 0.585 0.677 -0.022 -0.192 0.087  462 LYS EEE CD  
3537 C CE  . LYS C 133 ? 0.811 0.672 0.755 -0.029 -0.216 0.096  462 LYS EEE CE  
3538 N NZ  . LYS C 133 ? 0.858 0.731 0.801 -0.029 -0.215 0.088  462 LYS EEE NZ  
3539 N N   . PRO C 134 ? 0.423 0.325 0.369 -0.031 -0.115 0.081  463 PRO EEE N   
3540 C CA  . PRO C 134 ? 0.405 0.312 0.368 -0.028 -0.104 0.078  463 PRO EEE CA  
3541 C C   . PRO C 134 ? 0.361 0.276 0.366 -0.015 -0.106 0.069  463 PRO EEE C   
3542 O O   . PRO C 134 ? 0.365 0.272 0.388 -0.010 -0.124 0.070  463 PRO EEE O   
3543 C CB  . PRO C 134 ? 0.451 0.336 0.397 -0.036 -0.115 0.090  463 PRO EEE CB  
3544 C CG  . PRO C 134 ? 0.483 0.355 0.388 -0.049 -0.122 0.100  463 PRO EEE CG  
3545 C CD  . PRO C 134 ? 0.483 0.362 0.396 -0.043 -0.129 0.095  463 PRO EEE CD  
3546 N N   . PHE C 135 ? 0.328 0.259 0.348 -0.011 -0.089 0.059  464 PHE EEE N   
3547 C CA  . PHE C 135 ? 0.330 0.271 0.386 -0.001 -0.086 0.048  464 PHE EEE CA  
3548 C C   . PHE C 135 ? 0.335 0.285 0.410 0.005  -0.090 0.041  464 PHE EEE C   
3549 O O   . PHE C 135 ? 0.337 0.295 0.445 0.012  -0.090 0.032  464 PHE EEE O   
3550 C CB  . PHE C 135 ? 0.346 0.274 0.421 0.003  -0.098 0.050  464 PHE EEE CB  
3551 C CG  . PHE C 135 ? 0.356 0.275 0.417 -0.003 -0.092 0.055  464 PHE EEE CG  
3552 C CD1 . PHE C 135 ? 0.334 0.266 0.393 -0.003 -0.074 0.048  464 PHE EEE CD1 
3553 C CD2 . PHE C 135 ? 0.380 0.277 0.430 -0.008 -0.107 0.067  464 PHE EEE CD2 
3554 C CE1 . PHE C 135 ? 0.343 0.268 0.392 -0.009 -0.070 0.052  464 PHE EEE CE1 
3555 C CE2 . PHE C 135 ? 0.396 0.285 0.435 -0.014 -0.102 0.071  464 PHE EEE CE2 
3556 C CZ  . PHE C 135 ? 0.366 0.271 0.406 -0.014 -0.083 0.063  464 PHE EEE CZ  
3557 N N   . GLU C 136 ? 0.338 0.290 0.395 0.001  -0.092 0.044  465 GLU EEE N   
3558 C CA  . GLU C 136 ? 0.341 0.304 0.414 0.004  -0.093 0.037  465 GLU EEE CA  
3559 C C   . GLU C 136 ? 0.301 0.280 0.379 0.006  -0.073 0.027  465 GLU EEE C   
3560 O O   . GLU C 136 ? 0.272 0.252 0.328 0.002  -0.061 0.028  465 GLU EEE O   
3561 C CB  . GLU C 136 ? 0.364 0.320 0.412 -0.001 -0.103 0.043  465 GLU EEE CB  
3562 C CG  . GLU C 136 ? 0.380 0.345 0.448 0.002  -0.109 0.036  465 GLU EEE CG  
3563 C CD  . GLU C 136 ? 0.426 0.383 0.471 -0.003 -0.121 0.041  465 GLU EEE CD  
3564 O OE1 . GLU C 136 ? 0.445 0.391 0.456 -0.010 -0.124 0.050  465 GLU EEE OE1 
3565 O OE2 . GLU C 136 ? 0.450 0.413 0.512 -0.001 -0.128 0.036  465 GLU EEE OE2 
3566 N N   . ARG C 137 ? 0.275 0.265 0.381 0.010  -0.071 0.018  466 ARG EEE N   
3567 C CA  . ARG C 137 ? 0.259 0.261 0.366 0.009  -0.054 0.010  466 ARG EEE CA  
3568 C C   . ARG C 137 ? 0.261 0.268 0.372 0.008  -0.057 0.007  466 ARG EEE C   
3569 O O   . ARG C 137 ? 0.256 0.266 0.392 0.010  -0.069 0.004  466 ARG EEE O   
3570 C CB  . ARG C 137 ? 0.247 0.258 0.379 0.012  -0.044 -0.000 466 ARG EEE CB  
3571 C CG  . ARG C 137 ? 0.248 0.267 0.373 0.009  -0.027 -0.006 466 ARG EEE CG  
3572 C CD  . ARG C 137 ? 0.275 0.304 0.422 0.009  -0.015 -0.017 466 ARG EEE CD  
3573 N NE  . ARG C 137 ? 0.278 0.303 0.428 0.011  -0.014 -0.018 466 ARG EEE NE  
3574 C CZ  . ARG C 137 ? 0.327 0.352 0.503 0.016  -0.019 -0.023 466 ARG EEE CZ  
3575 N NH1 . ARG C 137 ? 0.330 0.362 0.537 0.019  -0.028 -0.028 466 ARG EEE NH1 
3576 N NH2 . ARG C 137 ? 0.333 0.353 0.508 0.017  -0.017 -0.023 466 ARG EEE NH2 
3577 N N   . ASP C 138 ? 0.261 0.270 0.353 0.004  -0.049 0.006  467 ASP EEE N   
3578 C CA  . ASP C 138 ? 0.266 0.279 0.361 0.002  -0.051 0.003  467 ASP EEE CA  
3579 C C   . ASP C 138 ? 0.234 0.254 0.333 -0.000 -0.035 -0.004 467 ASP EEE C   
3580 O O   . ASP C 138 ? 0.215 0.231 0.293 -0.001 -0.027 -0.002 467 ASP EEE O   
3581 C CB  . ASP C 138 ? 0.287 0.291 0.354 -0.001 -0.057 0.008  467 ASP EEE CB  
3582 C CG  . ASP C 138 ? 0.299 0.307 0.370 -0.003 -0.061 0.004  467 ASP EEE CG  
3583 O OD1 . ASP C 138 ? 0.295 0.311 0.390 -0.003 -0.058 -0.002 467 ASP EEE OD1 
3584 O OD2 . ASP C 138 ? 0.317 0.317 0.365 -0.006 -0.067 0.007  467 ASP EEE OD2 
3585 N N   . ILE C 139 ? 0.216 0.246 0.341 -0.001 -0.032 -0.011 468 ILE EEE N   
3586 C CA  . ILE C 139 ? 0.223 0.257 0.348 -0.006 -0.017 -0.017 468 ILE EEE CA  
3587 C C   . ILE C 139 ? 0.215 0.251 0.345 -0.011 -0.019 -0.020 468 ILE EEE C   
3588 O O   . ILE C 139 ? 0.210 0.251 0.346 -0.017 -0.007 -0.024 468 ILE EEE O   
3589 C CB  . ILE C 139 ? 0.218 0.262 0.365 -0.007 -0.006 -0.024 468 ILE EEE CB  
3590 C CG1 . ILE C 139 ? 0.224 0.279 0.408 -0.005 -0.012 -0.032 468 ILE EEE CG1 
3591 C CG2 . ILE C 139 ? 0.225 0.264 0.360 -0.004 -0.002 -0.022 468 ILE EEE CG2 
3592 C CD1 . ILE C 139 ? 0.249 0.316 0.457 -0.006 0.002  -0.043 468 ILE EEE CD1 
3593 N N   . SER C 140 ? 0.218 0.251 0.346 -0.009 -0.033 -0.017 469 SER EEE N   
3594 C CA  . SER C 140 ? 0.231 0.266 0.365 -0.014 -0.037 -0.020 469 SER EEE CA  
3595 C C   . SER C 140 ? 0.233 0.258 0.339 -0.018 -0.030 -0.018 469 SER EEE C   
3596 O O   . SER C 140 ? 0.234 0.252 0.318 -0.015 -0.026 -0.013 469 SER EEE O   
3597 C CB  . SER C 140 ? 0.246 0.279 0.383 -0.012 -0.055 -0.017 469 SER EEE CB  
3598 O OG  . SER C 140 ? 0.281 0.301 0.385 -0.010 -0.061 -0.010 469 SER EEE OG  
3599 N N   . THR C 141 ? 0.235 0.261 0.347 -0.023 -0.029 -0.021 470 THR EEE N   
3600 C CA  . THR C 141 ? 0.258 0.272 0.348 -0.027 -0.024 -0.020 470 THR EEE CA  
3601 C C   . THR C 141 ? 0.266 0.277 0.357 -0.030 -0.034 -0.023 470 THR EEE C   
3602 O O   . THR C 141 ? 0.281 0.286 0.371 -0.037 -0.030 -0.025 470 THR EEE O   
3603 C CB  . THR C 141 ? 0.295 0.308 0.384 -0.034 -0.010 -0.021 470 THR EEE CB  
3604 O OG1 . THR C 141 ? 0.292 0.317 0.409 -0.040 -0.006 -0.027 470 THR EEE OG1 
3605 C CG2 . THR C 141 ? 0.310 0.321 0.389 -0.030 -0.002 -0.018 470 THR EEE CG2 
3606 N N   . GLU C 142 ? 0.250 0.316 0.333 0.027  -0.027 -0.032 471 GLU EEE N   
3607 C CA  . GLU C 142 ? 0.263 0.325 0.334 0.024  -0.033 -0.025 471 GLU EEE CA  
3608 C C   . GLU C 142 ? 0.243 0.294 0.277 0.018  -0.023 -0.011 471 GLU EEE C   
3609 O O   . GLU C 142 ? 0.224 0.266 0.243 0.018  -0.022 -0.002 471 GLU EEE O   
3610 C CB  . GLU C 142 ? 0.334 0.381 0.413 0.029  -0.057 -0.017 471 GLU EEE CB  
3611 C CG  . GLU C 142 ? 0.417 0.459 0.478 0.023  -0.062 -0.008 471 GLU EEE CG  
3612 C CD  . GLU C 142 ? 0.533 0.557 0.594 0.023  -0.090 0.003  471 GLU EEE CD  
3613 O OE1 . GLU C 142 ? 0.559 0.586 0.636 0.024  -0.102 -0.002 471 GLU EEE OE1 
3614 O OE2 . GLU C 142 ? 0.520 0.524 0.561 0.018  -0.100 0.017  471 GLU EEE OE2 
3615 N N   . ILE C 143 ? 0.246 0.300 0.268 0.013  -0.016 -0.012 472 ILE EEE N   
3616 C CA  . ILE C 143 ? 0.260 0.305 0.255 0.009  -0.011 -0.003 472 ILE EEE CA  
3617 C C   . ILE C 143 ? 0.274 0.311 0.258 0.009  -0.020 0.007  472 ILE EEE C   
3618 O O   . ILE C 143 ? 0.305 0.341 0.293 0.007  -0.031 0.009  472 ILE EEE O   
3619 C CB  . ILE C 143 ? 0.262 0.307 0.247 0.004  -0.005 -0.007 472 ILE EEE CB  
3620 C CG1 . ILE C 143 ? 0.269 0.320 0.257 -0.003 0.003  -0.016 472 ILE EEE CG1 
3621 C CG2 . ILE C 143 ? 0.283 0.318 0.248 0.003  -0.004 -0.002 472 ILE EEE CG2 
3622 C CD1 . ILE C 143 ? 0.276 0.321 0.255 -0.005 0.008  -0.014 472 ILE EEE CD1 
3623 N N   . TYR C 144 ? 0.242 0.275 0.210 0.007  -0.015 0.011  473 TYR EEE N   
3624 C CA  . TYR C 144 ? 0.267 0.297 0.220 -0.000 -0.020 0.018  473 TYR EEE CA  
3625 C C   . TYR C 144 ? 0.257 0.292 0.196 -0.006 -0.015 0.014  473 TYR EEE C   
3626 O O   . TYR C 144 ? 0.247 0.286 0.186 -0.002 -0.007 0.006  473 TYR EEE O   
3627 C CB  . TYR C 144 ? 0.260 0.290 0.207 -0.001 -0.016 0.019  473 TYR EEE CB  
3628 C CG  . TYR C 144 ? 0.284 0.316 0.211 -0.014 -0.017 0.023  473 TYR EEE CG  
3629 C CD1 . TYR C 144 ? 0.306 0.326 0.222 -0.024 -0.030 0.034  473 TYR EEE CD1 
3630 C CD2 . TYR C 144 ? 0.287 0.331 0.206 -0.019 -0.006 0.013  473 TYR EEE CD2 
3631 C CE1 . TYR C 144 ? 0.348 0.369 0.238 -0.044 -0.031 0.038  473 TYR EEE CE1 
3632 C CE2 . TYR C 144 ? 0.317 0.370 0.217 -0.037 -0.004 0.012  473 TYR EEE CE2 
3633 C CZ  . TYR C 144 ? 0.347 0.387 0.227 -0.051 -0.015 0.026  473 TYR EEE CZ  
3634 O OH  . TYR C 144 ? 0.404 0.450 0.257 -0.076 -0.014 0.026  473 TYR EEE OH  
3635 N N   . GLN C 145 ? 0.269 0.303 0.197 -0.015 -0.023 0.018  474 GLN EEE N   
3636 C CA  . GLN C 145 ? 0.276 0.316 0.191 -0.022 -0.018 0.013  474 GLN EEE CA  
3637 C C   . GLN C 145 ? 0.299 0.349 0.198 -0.034 -0.011 0.008  474 GLN EEE C   
3638 O O   . GLN C 145 ? 0.322 0.368 0.202 -0.049 -0.017 0.016  474 GLN EEE O   
3639 C CB  . GLN C 145 ? 0.288 0.322 0.196 -0.029 -0.031 0.020  474 GLN EEE CB  
3640 C CG  . GLN C 145 ? 0.290 0.332 0.187 -0.037 -0.026 0.013  474 GLN EEE CG  
3641 C CD  . GLN C 145 ? 0.300 0.335 0.186 -0.047 -0.040 0.021  474 GLN EEE CD  
3642 O OE1 . GLN C 145 ? 0.322 0.349 0.223 -0.040 -0.053 0.026  474 GLN EEE OE1 
3643 N NE2 . GLN C 145 ? 0.328 0.368 0.189 -0.064 -0.038 0.019  474 GLN EEE NE2 
3644 N N   . ALA C 146 ? 0.298 0.359 0.204 -0.029 0.000  -0.007 475 ALA EEE N   
3645 C CA  . ALA C 146 ? 0.308 0.387 0.208 -0.039 0.010  -0.021 475 ALA EEE CA  
3646 C C   . ALA C 146 ? 0.334 0.429 0.225 -0.051 0.016  -0.034 475 ALA EEE C   
3647 O O   . ALA C 146 ? 0.356 0.472 0.239 -0.067 0.025  -0.048 475 ALA EEE O   
3648 C CB  . ALA C 146 ? 0.313 0.398 0.235 -0.025 0.015  -0.033 475 ALA EEE CB  
3649 N N   . GLY C 147 ? 0.306 0.394 0.198 -0.048 0.011  -0.033 476 GLY EEE N   
3650 C CA  . GLY C 147 ? 0.347 0.448 0.229 -0.060 0.016  -0.046 476 GLY EEE CA  
3651 C C   . GLY C 147 ? 0.358 0.448 0.218 -0.073 0.007  -0.030 476 GLY EEE C   
3652 O O   . GLY C 147 ? 0.359 0.435 0.209 -0.077 -0.005 -0.011 476 GLY EEE O   
3653 N N   . SER C 148 ? 0.355 0.452 0.210 -0.079 0.008  -0.039 477 SER EEE N   
3654 C CA  . SER C 148 ? 0.382 0.469 0.213 -0.095 -0.002 -0.026 477 SER EEE CA  
3655 C C   . SER C 148 ? 0.371 0.446 0.218 -0.079 -0.009 -0.021 477 SER EEE C   
3656 O O   . SER C 148 ? 0.397 0.469 0.232 -0.088 -0.017 -0.016 477 SER EEE O   
3657 C CB  . SER C 148 ? 0.433 0.540 0.240 -0.121 0.006  -0.039 477 SER EEE CB  
3658 O OG  . SER C 148 ? 0.451 0.576 0.277 -0.113 0.019  -0.065 477 SER EEE OG  
3659 N N   . THR C 149 ? 0.336 0.405 0.208 -0.058 -0.008 -0.023 478 THR EEE N   
3660 C CA  A THR C 149 ? 0.336 0.394 0.220 -0.046 -0.013 -0.019 478 THR EEE CA  
3661 C CA  B THR C 149 ? 0.344 0.402 0.227 -0.047 -0.013 -0.019 478 THR EEE CA  
3662 C C   . THR C 149 ? 0.324 0.373 0.220 -0.038 -0.020 -0.007 478 THR EEE C   
3663 O O   . THR C 149 ? 0.320 0.368 0.223 -0.031 -0.017 -0.006 478 THR EEE O   
3664 C CB  A THR C 149 ? 0.337 0.392 0.235 -0.035 -0.007 -0.032 478 THR EEE CB  
3665 C CB  B THR C 149 ? 0.357 0.413 0.253 -0.037 -0.007 -0.033 478 THR EEE CB  
3666 O OG1 A THR C 149 ? 0.348 0.415 0.243 -0.040 -0.001 -0.050 478 THR EEE OG1 
3667 O OG1 B THR C 149 ? 0.374 0.429 0.281 -0.027 -0.003 -0.037 478 THR EEE OG1 
3668 C CG2 A THR C 149 ? 0.331 0.375 0.233 -0.031 -0.012 -0.029 478 THR EEE CG2 
3669 C CG2 B THR C 149 ? 0.367 0.433 0.257 -0.044 -0.002 -0.049 478 THR EEE CG2 
3670 N N   . PRO C 150 ? 0.305 0.350 0.208 -0.037 -0.030 0.000  479 PRO EEE N   
3671 C CA  . PRO C 150 ? 0.293 0.336 0.216 -0.028 -0.036 0.005  479 PRO EEE CA  
3672 C C   . PRO C 150 ? 0.291 0.334 0.224 -0.020 -0.025 -0.002 479 PRO EEE C   
3673 O O   . PRO C 150 ? 0.280 0.321 0.210 -0.021 -0.020 -0.008 479 PRO EEE O   
3674 C CB  . PRO C 150 ? 0.300 0.345 0.234 -0.029 -0.048 0.005  479 PRO EEE CB  
3675 C CG  . PRO C 150 ? 0.328 0.371 0.240 -0.042 -0.053 0.008  479 PRO EEE CG  
3676 C CD  . PRO C 150 ? 0.325 0.371 0.221 -0.045 -0.037 0.001  479 PRO EEE CD  
3677 N N   . CYS C 151 ? 0.271 0.314 0.216 -0.014 -0.025 -0.000 480 CYS EEE N   
3678 C CA  . CYS C 151 ? 0.276 0.318 0.228 -0.010 -0.016 -0.005 480 CYS EEE CA  
3679 C C   . CYS C 151 ? 0.273 0.322 0.239 -0.013 -0.016 -0.011 480 CYS EEE C   
3680 O O   . CYS C 151 ? 0.275 0.321 0.235 -0.018 -0.009 -0.015 480 CYS EEE O   
3681 C CB  . CYS C 151 ? 0.284 0.324 0.240 -0.006 -0.015 -0.002 480 CYS EEE CB  
3682 S SG  . CYS C 151 ? 0.354 0.392 0.295 -0.006 -0.012 0.000  480 CYS EEE SG  
3683 N N   . ASN C 152 ? 0.303 0.363 0.288 -0.012 -0.024 -0.013 481 ASN EEE N   
3684 C CA  . ASN C 152 ? 0.313 0.390 0.321 -0.014 -0.023 -0.026 481 ASN EEE CA  
3685 C C   . ASN C 152 ? 0.296 0.380 0.311 -0.017 -0.012 -0.034 481 ASN EEE C   
3686 O O   . ASN C 152 ? 0.298 0.395 0.317 -0.027 -0.003 -0.045 481 ASN EEE O   
3687 C CB  . ASN C 152 ? 0.354 0.432 0.350 -0.024 -0.019 -0.029 481 ASN EEE CB  
3688 C CG  . ASN C 152 ? 0.406 0.476 0.390 -0.024 -0.028 -0.022 481 ASN EEE CG  
3689 O OD1 . ASN C 152 ? 0.446 0.519 0.441 -0.020 -0.041 -0.019 481 ASN EEE OD1 
3690 N ND2 . ASN C 152 ? 0.475 0.535 0.438 -0.029 -0.023 -0.020 481 ASN EEE ND2 
3691 N N   . GLY C 153 ? 0.262 0.340 0.277 -0.010 -0.012 -0.029 482 GLY EEE N   
3692 C CA  . GLY C 153 ? 0.265 0.350 0.287 -0.013 -0.003 -0.037 482 GLY EEE CA  
3693 C C   . GLY C 153 ? 0.282 0.353 0.275 -0.023 0.007  -0.033 482 GLY EEE C   
3694 O O   . GLY C 153 ? 0.292 0.369 0.285 -0.031 0.015  -0.039 482 GLY EEE O   
3695 N N   . VAL C 154 ? 0.270 0.324 0.240 -0.024 0.004  -0.023 483 VAL EEE N   
3696 C CA  . VAL C 154 ? 0.289 0.322 0.231 -0.033 0.006  -0.019 483 VAL EEE CA  
3697 C C   . VAL C 154 ? 0.270 0.287 0.204 -0.023 0.002  -0.011 483 VAL EEE C   
3698 O O   . VAL C 154 ? 0.278 0.294 0.214 -0.014 -0.002 -0.009 483 VAL EEE O   
3699 C CB  . VAL C 154 ? 0.316 0.338 0.243 -0.041 0.003  -0.018 483 VAL EEE CB  
3700 C CG1 . VAL C 154 ? 0.348 0.342 0.246 -0.052 -0.002 -0.013 483 VAL EEE CG1 
3701 C CG2 . VAL C 154 ? 0.331 0.372 0.267 -0.052 0.008  -0.027 483 VAL EEE CG2 
3702 N N   . GLU C 155 ? 0.263 0.272 0.190 -0.027 0.003  -0.009 484 GLU EEE N   
3703 C CA  . GLU C 155 ? 0.269 0.263 0.190 -0.018 -0.002 -0.004 484 GLU EEE CA  
3704 C C   . GLU C 155 ? 0.285 0.258 0.193 -0.018 -0.012 -0.003 484 GLU EEE C   
3705 O O   . GLU C 155 ? 0.306 0.262 0.196 -0.030 -0.017 -0.001 484 GLU EEE O   
3706 C CB  . GLU C 155 ? 0.289 0.279 0.203 -0.024 -0.000 -0.003 484 GLU EEE CB  
3707 C CG  . GLU C 155 ? 0.294 0.273 0.208 -0.015 -0.006 0.001  484 GLU EEE CG  
3708 C CD  . GLU C 155 ? 0.323 0.296 0.228 -0.023 -0.004 0.003  484 GLU EEE CD  
3709 O OE1 . GLU C 155 ? 0.315 0.298 0.216 -0.037 0.004  -0.001 484 GLU EEE OE1 
3710 O OE2 . GLU C 155 ? 0.310 0.274 0.215 -0.016 -0.010 0.005  484 GLU EEE OE2 
3711 N N   . GLY C 156 ? 0.284 0.258 0.201 -0.005 -0.016 -0.006 485 GLY EEE N   
3712 C CA  . GLY C 156 ? 0.307 0.263 0.221 -0.002 -0.027 -0.011 485 GLY EEE CA  
3713 C C   . GLY C 156 ? 0.294 0.264 0.224 0.010  -0.026 -0.021 485 GLY EEE C   
3714 O O   . GLY C 156 ? 0.284 0.270 0.222 0.014  -0.019 -0.022 485 GLY EEE O   
3715 N N   . PHE C 157 ? 0.304 0.269 0.240 0.014  -0.033 -0.032 486 PHE EEE N   
3716 C CA  . PHE C 157 ? 0.306 0.291 0.260 0.022  -0.030 -0.048 486 PHE EEE CA  
3717 C C   . PHE C 157 ? 0.294 0.306 0.245 0.016  -0.015 -0.046 486 PHE EEE C   
3718 O O   . PHE C 157 ? 0.281 0.296 0.223 0.009  -0.012 -0.039 486 PHE EEE O   
3719 C CB  . PHE C 157 ? 0.325 0.302 0.286 0.025  -0.039 -0.063 486 PHE EEE CB  
3720 C CG  . PHE C 157 ? 0.334 0.337 0.317 0.031  -0.034 -0.086 486 PHE EEE CG  
3721 C CD1 . PHE C 157 ? 0.345 0.354 0.351 0.041  -0.039 -0.102 486 PHE EEE CD1 
3722 C CD2 . PHE C 157 ? 0.385 0.411 0.365 0.023  -0.022 -0.095 486 PHE EEE CD2 
3723 C CE1 . PHE C 157 ? 0.361 0.403 0.391 0.043  -0.031 -0.130 486 PHE EEE CE1 
3724 C CE2 . PHE C 157 ? 0.368 0.424 0.366 0.023  -0.015 -0.120 486 PHE EEE CE2 
3725 C CZ  . PHE C 157 ? 0.376 0.442 0.399 0.032  -0.018 -0.139 486 PHE EEE CZ  
3726 N N   . ASN C 158 ? 0.283 0.312 0.241 0.017  -0.009 -0.051 487 ASN EEE N   
3727 C CA  . ASN C 158 ? 0.289 0.339 0.240 0.008  0.001  -0.047 487 ASN EEE CA  
3728 C C   . ASN C 158 ? 0.276 0.318 0.216 0.004  0.001  -0.028 487 ASN EEE C   
3729 O O   . ASN C 158 ? 0.267 0.318 0.199 -0.005 0.002  -0.022 487 ASN EEE O   
3730 C CB  . ASN C 158 ? 0.316 0.381 0.261 -0.001 0.006  -0.057 487 ASN EEE CB  
3731 C CG  . ASN C 158 ? 0.353 0.440 0.314 -0.002 0.011  -0.083 487 ASN EEE CG  
3732 O OD1 . ASN C 158 ? 0.391 0.485 0.365 0.004  0.012  -0.091 487 ASN EEE OD1 
3733 N ND2 . ASN C 158 ? 0.369 0.469 0.328 -0.009 0.015  -0.097 487 ASN EEE ND2 
3734 N N   . CYS C 159 ? 0.263 0.291 0.205 0.008  -0.003 -0.020 488 CYS EEE N   
3735 C CA  . CYS C 159 ? 0.253 0.278 0.193 0.006  -0.003 -0.009 488 CYS EEE CA  
3736 C C   . CYS C 159 ? 0.254 0.274 0.198 0.009  -0.003 -0.006 488 CYS EEE C   
3737 O O   . CYS C 159 ? 0.244 0.251 0.184 0.008  -0.005 -0.006 488 CYS EEE O   
3738 C CB  . CYS C 159 ? 0.262 0.283 0.200 0.002  -0.005 -0.009 488 CYS EEE CB  
3739 S SG  . CYS C 159 ? 0.301 0.330 0.234 -0.004 -0.007 -0.010 488 CYS EEE SG  
3740 N N   . TYR C 160 ? 0.245 0.271 0.192 0.010  -0.001 -0.003 489 TYR EEE N   
3741 C CA  . TYR C 160 ? 0.270 0.292 0.220 0.014  0.000  -0.002 489 TYR EEE CA  
3742 C C   . TYR C 160 ? 0.254 0.278 0.210 0.012  0.002  0.002  489 TYR EEE C   
3743 O O   . TYR C 160 ? 0.239 0.269 0.202 0.012  -0.000 0.005  489 TYR EEE O   
3744 C CB  . TYR C 160 ? 0.270 0.302 0.223 0.014  0.003  -0.004 489 TYR EEE CB  
3745 C CG  . TYR C 160 ? 0.317 0.357 0.271 0.015  0.004  -0.016 489 TYR EEE CG  
3746 C CD1 . TYR C 160 ? 0.395 0.428 0.355 0.020  -0.001 -0.025 489 TYR EEE CD1 
3747 C CD2 . TYR C 160 ? 0.355 0.411 0.305 0.007  0.009  -0.020 489 TYR EEE CD2 
3748 C CE1 . TYR C 160 ? 0.431 0.475 0.400 0.023  -0.001 -0.041 489 TYR EEE CE1 
3749 C CE2 . TYR C 160 ? 0.372 0.445 0.329 0.005  0.013  -0.037 489 TYR EEE CE2 
3750 C CZ  . TYR C 160 ? 0.395 0.463 0.365 0.015  0.008  -0.050 489 TYR EEE CZ  
3751 O OH  . TYR C 160 ? 0.470 0.557 0.453 0.014  0.011  -0.072 489 TYR EEE OH  
3752 N N   . PHE C 161 ? 0.244 0.261 0.197 0.010  0.003  0.001  490 PHE EEE N   
3753 C CA  . PHE C 161 ? 0.236 0.258 0.197 0.009  0.006  0.001  490 PHE EEE CA  
3754 C C   . PHE C 161 ? 0.235 0.260 0.202 0.014  0.005  0.004  490 PHE EEE C   
3755 O O   . PHE C 161 ? 0.246 0.267 0.207 0.016  0.005  0.004  490 PHE EEE O   
3756 C CB  . PHE C 161 ? 0.244 0.258 0.194 0.000  0.009  -0.001 490 PHE EEE CB  
3757 C CG  . PHE C 161 ? 0.248 0.274 0.208 -0.006 0.015  -0.008 490 PHE EEE CG  
3758 C CD1 . PHE C 161 ? 0.249 0.290 0.221 -0.013 0.020  -0.018 490 PHE EEE CD1 
3759 C CD2 . PHE C 161 ? 0.249 0.275 0.212 -0.004 0.017  -0.008 490 PHE EEE CD2 
3760 C CE1 . PHE C 161 ? 0.275 0.333 0.262 -0.018 0.027  -0.031 490 PHE EEE CE1 
3761 C CE2 . PHE C 161 ? 0.250 0.289 0.225 -0.010 0.024  -0.018 490 PHE EEE CE2 
3762 C CZ  . PHE C 161 ? 0.257 0.314 0.245 -0.017 0.029  -0.031 490 PHE EEE CZ  
3763 N N   . PRO C 162 ? 0.224 0.254 0.203 0.016  0.003  0.004  491 PRO EEE N   
3764 C CA  . PRO C 162 ? 0.236 0.265 0.214 0.017  -0.000 0.010  491 PRO EEE CA  
3765 C C   . PRO C 162 ? 0.244 0.271 0.222 0.018  0.003  0.009  491 PRO EEE C   
3766 O O   . PRO C 162 ? 0.240 0.267 0.215 0.017  0.002  0.013  491 PRO EEE O   
3767 C CB  . PRO C 162 ? 0.219 0.246 0.208 0.018  -0.010 0.012  491 PRO EEE CB  
3768 C CG  . PRO C 162 ? 0.209 0.244 0.217 0.020  -0.008 0.001  491 PRO EEE CG  
3769 C CD  . PRO C 162 ? 0.211 0.248 0.206 0.016  0.000  -0.001 491 PRO EEE CD  
3770 N N   . LEU C 163 ? 0.232 0.259 0.213 0.017  0.008  0.004  492 LEU EEE N   
3771 C CA  . LEU C 163 ? 0.241 0.266 0.220 0.017  0.011  0.004  492 LEU EEE CA  
3772 C C   . LEU C 163 ? 0.250 0.267 0.215 0.015  0.010  0.005  492 LEU EEE C   
3773 O O   . LEU C 163 ? 0.248 0.258 0.204 0.011  0.009  0.005  492 LEU EEE O   
3774 C CB  . LEU C 163 ? 0.232 0.263 0.222 0.013  0.015  -0.005 492 LEU EEE CB  
3775 C CG  . LEU C 163 ? 0.227 0.267 0.241 0.017  0.011  -0.012 492 LEU EEE CG  
3776 C CD1 . LEU C 163 ? 0.235 0.288 0.265 0.012  0.018  -0.028 492 LEU EEE CD1 
3777 C CD2 . LEU C 163 ? 0.242 0.275 0.262 0.023  0.001  -0.005 492 LEU EEE CD2 
3778 N N   . GLN C 164 ? 0.238 0.253 0.203 0.018  0.009  0.006  493 GLN EEE N   
3779 C CA  . GLN C 164 ? 0.231 0.235 0.186 0.017  0.004  0.006  493 GLN EEE CA  
3780 C C   . GLN C 164 ? 0.227 0.229 0.180 0.015  0.004  0.007  493 GLN EEE C   
3781 O O   . GLN C 164 ? 0.222 0.232 0.183 0.015  0.009  0.007  493 GLN EEE O   
3782 C CB  . GLN C 164 ? 0.232 0.242 0.195 0.025  -0.001 0.002  493 GLN EEE CB  
3783 C CG  . GLN C 164 ? 0.240 0.254 0.204 0.026  0.000  0.000  493 GLN EEE CG  
3784 C CD  . GLN C 164 ? 0.250 0.265 0.222 0.032  -0.006 -0.009 493 GLN EEE CD  
3785 O OE1 . GLN C 164 ? 0.290 0.309 0.272 0.036  -0.011 -0.017 493 GLN EEE OE1 
3786 N NE2 . GLN C 164 ? 0.251 0.265 0.221 0.032  -0.008 -0.012 493 GLN EEE NE2 
3787 N N   . SER C 165 ? 0.243 0.230 0.184 0.011  -0.005 0.009  494 SER EEE N   
3788 C CA  . SER C 165 ? 0.242 0.223 0.176 0.006  -0.007 0.010  494 SER EEE CA  
3789 C C   . SER C 165 ? 0.267 0.250 0.213 0.016  -0.014 0.008  494 SER EEE C   
3790 O O   . SER C 165 ? 0.274 0.254 0.228 0.023  -0.024 0.004  494 SER EEE O   
3791 C CB  . SER C 165 ? 0.267 0.226 0.176 -0.009 -0.015 0.015  494 SER EEE CB  
3792 O OG  . SER C 165 ? 0.290 0.243 0.190 -0.016 -0.018 0.017  494 SER EEE OG  
3793 N N   . TYR C 166 ? 0.237 0.227 0.187 0.015  -0.009 0.008  495 TYR EEE N   
3794 C CA  . TYR C 166 ? 0.234 0.229 0.195 0.022  -0.016 0.004  495 TYR EEE CA  
3795 C C   . TYR C 166 ? 0.279 0.252 0.232 0.021  -0.035 0.005  495 TYR EEE C   
3796 O O   . TYR C 166 ? 0.290 0.268 0.261 0.031  -0.046 -0.003 495 TYR EEE O   
3797 C CB  . TYR C 166 ? 0.231 0.234 0.194 0.019  -0.008 0.005  495 TYR EEE CB  
3798 C CG  . TYR C 166 ? 0.208 0.227 0.180 0.020  0.003  0.004  495 TYR EEE CG  
3799 C CD1 . TYR C 166 ? 0.214 0.248 0.197 0.023  0.004  -0.001 495 TYR EEE CD1 
3800 C CD2 . TYR C 166 ? 0.207 0.226 0.178 0.016  0.010  0.007  495 TYR EEE CD2 
3801 C CE1 . TYR C 166 ? 0.211 0.254 0.194 0.018  0.011  0.001  495 TYR EEE CE1 
3802 C CE2 . TYR C 166 ? 0.203 0.228 0.180 0.016  0.013  0.008  495 TYR EEE CE2 
3803 C CZ  . TYR C 166 ? 0.211 0.245 0.189 0.015  0.013  0.007  495 TYR EEE CZ  
3804 O OH  . TYR C 166 ? 0.238 0.273 0.213 0.009  0.013  0.012  495 TYR EEE OH  
3805 N N   . GLY C 167 ? 0.295 0.247 0.223 0.008  -0.041 0.013  496 GLY EEE N   
3806 C CA  . GLY C 167 ? 0.329 0.251 0.241 0.002  -0.064 0.018  496 GLY EEE CA  
3807 C C   . GLY C 167 ? 0.331 0.256 0.255 0.008  -0.073 0.015  496 GLY EEE C   
3808 O O   . GLY C 167 ? 0.332 0.246 0.271 0.018  -0.095 0.010  496 GLY EEE O   
3809 N N   . PHE C 168 ? 0.318 0.258 0.241 0.003  -0.058 0.016  497 PHE EEE N   
3810 C CA  . PHE C 168 ? 0.311 0.257 0.246 0.008  -0.063 0.012  497 PHE EEE CA  
3811 C C   . PHE C 168 ? 0.387 0.302 0.306 0.002  -0.091 0.018  497 PHE EEE C   
3812 O O   . PHE C 168 ? 0.433 0.327 0.317 -0.018 -0.094 0.028  497 PHE EEE O   
3813 C CB  . PHE C 168 ? 0.295 0.256 0.226 0.001  -0.044 0.013  497 PHE EEE CB  
3814 C CG  . PHE C 168 ? 0.248 0.234 0.196 0.007  -0.024 0.008  497 PHE EEE CG  
3815 C CD1 . PHE C 168 ? 0.235 0.240 0.206 0.017  -0.022 0.001  497 PHE EEE CD1 
3816 C CD2 . PHE C 168 ? 0.244 0.234 0.186 0.001  -0.010 0.009  497 PHE EEE CD2 
3817 C CE1 . PHE C 168 ? 0.219 0.240 0.197 0.018  -0.007 -0.001 497 PHE EEE CE1 
3818 C CE2 . PHE C 168 ? 0.218 0.223 0.174 0.006  0.002  0.006  497 PHE EEE CE2 
3819 C CZ  . PHE C 168 ? 0.216 0.233 0.186 0.013  0.002  0.004  497 PHE EEE CZ  
3820 N N   . GLN C 169 ? 0.398 0.312 0.343 0.016  -0.111 0.009  498 GLN EEE N   
3821 C CA  . GLN C 169 ? 0.453 0.336 0.392 0.015  -0.145 0.013  498 GLN EEE CA  
3822 C C   . GLN C 169 ? 0.475 0.374 0.428 0.018  -0.144 0.008  498 GLN EEE C   
3823 O O   . GLN C 169 ? 0.408 0.343 0.395 0.031  -0.128 -0.007 498 GLN EEE O   
3824 C CB  . GLN C 169 ? 0.489 0.364 0.459 0.033  -0.172 0.001  498 GLN EEE CB  
3825 C CG  . GLN C 169 ? 0.513 0.373 0.474 0.033  -0.175 0.005  498 GLN EEE CG  
3826 C CD  . GLN C 169 ? 0.580 0.388 0.494 0.012  -0.200 0.024  498 GLN EEE CD  
3827 O OE1 . GLN C 169 ? 0.611 0.394 0.497 -0.003 -0.216 0.036  498 GLN EEE OE1 
3828 N NE2 . GLN C 169 ? 0.615 0.407 0.519 0.010  -0.206 0.028  498 GLN EEE NE2 
3829 N N   . PRO C 170 ? 0.514 0.387 0.441 0.004  -0.161 0.018  499 PRO EEE N   
3830 C CA  . PRO C 170 ? 0.529 0.417 0.465 0.004  -0.157 0.014  499 PRO EEE CA  
3831 C C   . PRO C 170 ? 0.513 0.421 0.499 0.026  -0.172 -0.004 499 PRO EEE C   
3832 O O   . PRO C 170 ? 0.433 0.368 0.436 0.029  -0.160 -0.012 499 PRO EEE O   
3833 C CB  . PRO C 170 ? 0.611 0.460 0.503 -0.018 -0.178 0.030  499 PRO EEE CB  
3834 C CG  . PRO C 170 ? 0.658 0.466 0.526 -0.026 -0.206 0.041  499 PRO EEE CG  
3835 C CD  . PRO C 170 ? 0.617 0.443 0.498 -0.017 -0.185 0.036  499 PRO EEE CD  
3836 N N   . THR C 171 ? 0.500 0.397 0.510 0.041  -0.197 -0.014 500 THR EEE N   
3837 C CA  . THR C 171 ? 0.559 0.476 0.625 0.063  -0.217 -0.038 500 THR EEE CA  
3838 C C   . THR C 171 ? 0.490 0.458 0.595 0.075  -0.188 -0.061 500 THR EEE C   
3839 O O   . THR C 171 ? 0.487 0.485 0.642 0.091  -0.196 -0.088 500 THR EEE O   
3840 C CB  . THR C 171 ? 0.615 0.490 0.689 0.071  -0.264 -0.039 500 THR EEE CB  
3841 O OG1 . THR C 171 ? 0.654 0.508 0.701 0.064  -0.260 -0.027 500 THR EEE OG1 
3842 C CG2 . THR C 171 ? 0.670 0.497 0.712 0.058  -0.300 -0.021 500 THR EEE CG2 
3843 N N   . TYR C 172 ? 0.470 0.449 0.553 0.066  -0.156 -0.052 501 TYR EEE N   
3844 C CA  . TYR C 172 ? 0.434 0.457 0.540 0.071  -0.127 -0.068 501 TYR EEE CA  
3845 C C   . TYR C 172 ? 0.426 0.487 0.557 0.071  -0.115 -0.084 501 TYR EEE C   
3846 O O   . TYR C 172 ? 0.394 0.446 0.509 0.063  -0.116 -0.073 501 TYR EEE O   
3847 C CB  . TYR C 172 ? 0.432 0.452 0.503 0.058  -0.100 -0.050 501 TYR EEE CB  
3848 C CG  . TYR C 172 ? 0.436 0.440 0.494 0.058  -0.101 -0.044 501 TYR EEE CG  
3849 C CD1 . TYR C 172 ? 0.460 0.445 0.530 0.068  -0.126 -0.050 501 TYR EEE CD1 
3850 C CD2 . TYR C 172 ? 0.427 0.434 0.461 0.049  -0.077 -0.032 501 TYR EEE CD2 
3851 C CE1 . TYR C 172 ? 0.467 0.437 0.522 0.066  -0.124 -0.043 501 TYR EEE CE1 
3852 C CE2 . TYR C 172 ? 0.402 0.398 0.424 0.048  -0.075 -0.027 501 TYR EEE CE2 
3853 C CZ  . TYR C 172 ? 0.459 0.437 0.490 0.056  -0.097 -0.032 501 TYR EEE CZ  
3854 O OH  . TYR C 172 ? 0.386 0.353 0.403 0.053  -0.093 -0.026 501 TYR EEE OH  
3855 N N   . GLY C 173 ? 0.383 0.488 0.553 0.076  -0.103 -0.111 502 GLY EEE N   
3856 C CA  . GLY C 173 ? 0.348 0.494 0.533 0.069  -0.083 -0.125 502 GLY EEE CA  
3857 C C   . GLY C 173 ? 0.303 0.450 0.449 0.051  -0.055 -0.105 502 GLY EEE C   
3858 O O   . GLY C 173 ? 0.269 0.394 0.387 0.047  -0.048 -0.087 502 GLY EEE O   
3859 N N   . VAL C 174 ? 0.289 0.457 0.435 0.040  -0.040 -0.108 503 VAL EEE N   
3860 C CA  . VAL C 174 ? 0.286 0.446 0.396 0.023  -0.021 -0.088 503 VAL EEE CA  
3861 C C   . VAL C 174 ? 0.243 0.404 0.334 0.015  -0.005 -0.081 503 VAL EEE C   
3862 O O   . VAL C 174 ? 0.261 0.396 0.323 0.010  0.000  -0.059 503 VAL EEE O   
3863 C CB  . VAL C 174 ? 0.336 0.523 0.453 0.011  -0.010 -0.097 503 VAL EEE CB  
3864 C CG1 . VAL C 174 ? 0.317 0.548 0.452 -0.000 0.006  -0.120 503 VAL EEE CG1 
3865 C CG2 . VAL C 174 ? 0.339 0.505 0.421 -0.001 -0.000 -0.074 503 VAL EEE CG2 
3866 N N   . GLY C 175 ? 0.232 0.422 0.342 0.014  0.002  -0.100 504 GLY EEE N   
3867 C CA  . GLY C 175 ? 0.211 0.402 0.302 0.004  0.015  -0.094 504 GLY EEE CA  
3868 C C   . GLY C 175 ? 0.219 0.375 0.294 0.015  0.007  -0.076 504 GLY EEE C   
3869 O O   . GLY C 175 ? 0.211 0.358 0.264 0.006  0.016  -0.062 504 GLY EEE O   
3870 N N   . TYR C 176 ? 0.235 0.374 0.322 0.030  -0.011 -0.076 505 TYR EEE N   
3871 C CA  . TYR C 176 ? 0.255 0.363 0.325 0.036  -0.019 -0.061 505 TYR EEE CA  
3872 C C   . TYR C 176 ? 0.235 0.312 0.278 0.033  -0.022 -0.040 505 TYR EEE C   
3873 O O   . TYR C 176 ? 0.244 0.298 0.269 0.032  -0.024 -0.028 505 TYR EEE O   
3874 C CB  . TYR C 176 ? 0.338 0.435 0.427 0.051  -0.040 -0.071 505 TYR EEE CB  
3875 C CG  . TYR C 176 ? 0.398 0.525 0.527 0.060  -0.045 -0.100 505 TYR EEE CG  
3876 C CD1 . TYR C 176 ? 0.436 0.582 0.573 0.058  -0.035 -0.112 505 TYR EEE CD1 
3877 C CD2 . TYR C 176 ? 0.511 0.647 0.674 0.070  -0.063 -0.119 505 TYR EEE CD2 
3878 C CE1 . TYR C 176 ? 0.413 0.591 0.592 0.066  -0.039 -0.145 505 TYR EEE CE1 
3879 C CE2 . TYR C 176 ? 0.482 0.650 0.691 0.080  -0.070 -0.152 505 TYR EEE CE2 
3880 C CZ  . TYR C 176 ? 0.488 0.678 0.706 0.078  -0.056 -0.167 505 TYR EEE CZ  
3881 O OH  . TYR C 176 ? 0.493 0.721 0.762 0.087  -0.061 -0.205 505 TYR EEE OH  
3882 N N   . GLN C 177 ? 0.221 0.299 0.262 0.029  -0.022 -0.039 506 GLN EEE N   
3883 C CA  . GLN C 177 ? 0.237 0.290 0.256 0.023  -0.024 -0.023 506 GLN EEE CA  
3884 C C   . GLN C 177 ? 0.224 0.272 0.224 0.015  -0.009 -0.013 506 GLN EEE C   
3885 O O   . GLN C 177 ? 0.225 0.286 0.228 0.012  0.001  -0.014 506 GLN EEE O   
3886 C CB  . GLN C 177 ? 0.249 0.306 0.272 0.021  -0.029 -0.026 506 GLN EEE CB  
3887 C CG  . GLN C 177 ? 0.271 0.324 0.311 0.030  -0.052 -0.035 506 GLN EEE CG  
3888 C CD  . GLN C 177 ? 0.273 0.333 0.321 0.028  -0.057 -0.040 506 GLN EEE CD  
3889 O OE1 . GLN C 177 ? 0.289 0.350 0.323 0.018  -0.045 -0.033 506 GLN EEE OE1 
3890 N NE2 . GLN C 177 ? 0.277 0.340 0.351 0.038  -0.079 -0.053 506 GLN EEE NE2 
3891 N N   . PRO C 178 ? 0.223 0.252 0.205 0.011  -0.009 -0.004 507 PRO EEE N   
3892 C CA  . PRO C 178 ? 0.233 0.260 0.209 0.006  0.002  0.001  507 PRO EEE CA  
3893 C C   . PRO C 178 ? 0.238 0.269 0.216 0.001  0.008  0.000  507 PRO EEE C   
3894 O O   . PRO C 178 ? 0.229 0.261 0.206 -0.001 0.005  -0.001 507 PRO EEE O   
3895 C CB  . PRO C 178 ? 0.240 0.252 0.200 0.000  0.001  0.004  507 PRO EEE CB  
3896 C CG  . PRO C 178 ? 0.252 0.254 0.204 -0.003 -0.011 0.005  507 PRO EEE CG  
3897 C CD  . PRO C 178 ? 0.242 0.251 0.210 0.008  -0.022 0.000  507 PRO EEE CD  
3898 N N   . TYR C 179 ? 0.210 0.243 0.190 -0.001 0.013  0.003  508 TYR EEE N   
3899 C CA  . TYR C 179 ? 0.219 0.248 0.199 -0.006 0.015  0.004  508 TYR EEE CA  
3900 C C   . TYR C 179 ? 0.224 0.242 0.207 -0.005 0.015  0.004  508 TYR EEE C   
3901 O O   . TYR C 179 ? 0.218 0.233 0.203 -0.002 0.014  0.005  508 TYR EEE O   
3902 C CB  . TYR C 179 ? 0.221 0.257 0.199 -0.013 0.015  0.006  508 TYR EEE CB  
3903 C CG  . TYR C 179 ? 0.228 0.282 0.211 -0.016 0.017  -0.000 508 TYR EEE CG  
3904 C CD1 . TYR C 179 ? 0.224 0.291 0.217 -0.009 0.015  -0.008 508 TYR EEE CD1 
3905 C CD2 . TYR C 179 ? 0.245 0.302 0.225 -0.026 0.018  -0.001 508 TYR EEE CD2 
3906 C CE1 . TYR C 179 ? 0.234 0.319 0.239 -0.010 0.013  -0.018 508 TYR EEE CE1 
3907 C CE2 . TYR C 179 ? 0.245 0.323 0.234 -0.029 0.019  -0.010 508 TYR EEE CE2 
3908 C CZ  . TYR C 179 ? 0.231 0.324 0.235 -0.020 0.016  -0.020 508 TYR EEE CZ  
3909 O OH  . TYR C 179 ? 0.238 0.354 0.258 -0.021 0.015  -0.033 508 TYR EEE OH  
3910 N N   . ARG C 180 ? 0.239 0.251 0.225 -0.007 0.016  -0.001 509 ARG EEE N   
3911 C CA  . ARG C 180 ? 0.217 0.221 0.217 -0.005 0.014  -0.007 509 ARG EEE CA  
3912 C C   . ARG C 180 ? 0.225 0.216 0.226 -0.007 0.004  -0.000 509 ARG EEE C   
3913 O O   . ARG C 180 ? 0.219 0.209 0.211 -0.014 0.003  0.005  509 ARG EEE O   
3914 C CB  . ARG C 180 ? 0.241 0.248 0.245 -0.008 0.019  -0.019 509 ARG EEE CB  
3915 C CG  . ARG C 180 ? 0.228 0.244 0.224 -0.012 0.027  -0.025 509 ARG EEE CG  
3916 C CD  . ARG C 180 ? 0.248 0.271 0.243 -0.022 0.034  -0.038 509 ARG EEE CD  
3917 N NE  . ARG C 180 ? 0.253 0.280 0.231 -0.032 0.039  -0.041 509 ARG EEE NE  
3918 C CZ  . ARG C 180 ? 0.280 0.317 0.255 -0.046 0.049  -0.057 509 ARG EEE CZ  
3919 N NH1 . ARG C 180 ? 0.298 0.345 0.291 -0.048 0.054  -0.074 509 ARG EEE NH1 
3920 N NH2 . ARG C 180 ? 0.288 0.328 0.242 -0.059 0.053  -0.057 509 ARG EEE NH2 
3921 N N   . VAL C 181 ? 0.251 0.178 0.360 -0.006 0.024  0.019  510 VAL EEE N   
3922 C CA  . VAL C 181 ? 0.245 0.172 0.351 -0.002 0.023  0.019  510 VAL EEE CA  
3923 C C   . VAL C 181 ? 0.235 0.166 0.351 -0.006 0.022  0.018  510 VAL EEE C   
3924 O O   . VAL C 181 ? 0.229 0.159 0.357 -0.008 0.021  0.017  510 VAL EEE O   
3925 C CB  . VAL C 181 ? 0.256 0.170 0.346 0.007  0.018  0.017  510 VAL EEE CB  
3926 C CG1 . VAL C 181 ? 0.271 0.177 0.348 0.015  0.021  0.019  510 VAL EEE CG1 
3927 C CG2 . VAL C 181 ? 0.270 0.176 0.347 0.013  0.022  0.020  510 VAL EEE CG2 
3928 N N   . VAL C 182 ? 0.246 0.181 0.363 -0.005 0.024  0.019  511 VAL EEE N   
3929 C CA  . VAL C 182 ? 0.244 0.180 0.365 -0.006 0.024  0.018  511 VAL EEE CA  
3930 C C   . VAL C 182 ? 0.255 0.189 0.371 -0.002 0.023  0.019  511 VAL EEE C   
3931 O O   . VAL C 182 ? 0.254 0.190 0.372 0.001  0.027  0.024  511 VAL EEE O   
3932 C CB  . VAL C 182 ? 0.248 0.183 0.367 -0.007 0.025  0.018  511 VAL EEE CB  
3933 C CG1 . VAL C 182 ? 0.251 0.187 0.375 -0.007 0.026  0.017  511 VAL EEE CG1 
3934 C CG2 . VAL C 182 ? 0.261 0.188 0.372 -0.005 0.031  0.019  511 VAL EEE CG2 
3935 N N   . VAL C 183 ? 0.254 0.183 0.369 0.000  0.016  0.015  512 VAL EEE N   
3936 C CA  . VAL C 183 ? 0.276 0.195 0.377 0.008  0.015  0.015  512 VAL EEE CA  
3937 C C   . VAL C 183 ? 0.271 0.197 0.385 0.003  0.014  0.014  512 VAL EEE C   
3938 O O   . VAL C 183 ? 0.262 0.190 0.392 -0.001 0.007  0.011  512 VAL EEE O   
3939 C CB  . VAL C 183 ? 0.308 0.201 0.385 0.019  0.002  0.010  512 VAL EEE CB  
3940 C CG1 . VAL C 183 ? 0.339 0.214 0.389 0.032  0.002  0.011  512 VAL EEE CG1 
3941 C CG2 . VAL C 183 ? 0.325 0.207 0.384 0.026  0.003  0.011  512 VAL EEE CG2 
3942 N N   . LEU C 184 ? 0.275 0.206 0.391 0.003  0.020  0.018  513 LEU EEE N   
3943 C CA  . LEU C 184 ? 0.278 0.213 0.401 0.001  0.018  0.016  513 LEU EEE CA  
3944 C C   . LEU C 184 ? 0.299 0.221 0.406 0.009  0.015  0.016  513 LEU EEE C   
3945 O O   . LEU C 184 ? 0.321 0.236 0.416 0.018  0.024  0.024  513 LEU EEE O   
3946 C CB  . LEU C 184 ? 0.278 0.220 0.412 -0.003 0.020  0.020  513 LEU EEE CB  
3947 C CG  . LEU C 184 ? 0.274 0.215 0.409 -0.006 0.018  0.019  513 LEU EEE CG  
3948 C CD1 . LEU C 184 ? 0.287 0.225 0.431 -0.007 0.010  0.020  513 LEU EEE CD1 
3949 C CD2 . LEU C 184 ? 0.291 0.231 0.422 -0.006 0.021  0.015  513 LEU EEE CD2 
3950 N N   . SER C 185 ? 0.303 0.218 0.411 0.009  0.003  0.010  514 SER EEE N   
3951 C CA  . SER C 185 ? 0.343 0.240 0.432 0.019  -0.005 0.007  514 SER EEE CA  
3952 C C   . SER C 185 ? 0.328 0.236 0.432 0.014  -0.002 0.008  514 SER EEE C   
3953 O O   . SER C 185 ? 0.303 0.225 0.433 0.005  -0.004 0.006  514 SER EEE O   
3954 C CB  . SER C 185 ? 0.367 0.244 0.454 0.023  -0.028 -0.001 514 SER EEE CB  
3955 O OG  . SER C 185 ? 0.463 0.314 0.517 0.035  -0.034 -0.003 514 SER EEE OG  
3956 N N   . PHE C 186 ? 0.347 0.248 0.436 0.021  0.005  0.013  515 PHE EEE N   
3957 C CA  . PHE C 186 ? 0.354 0.264 0.456 0.017  0.005  0.014  515 PHE EEE CA  
3958 C C   . PHE C 186 ? 0.393 0.282 0.476 0.025  -0.007 0.008  515 PHE EEE C   
3959 O O   . PHE C 186 ? 0.418 0.281 0.465 0.041  -0.006 0.011  515 PHE EEE O   
3960 C CB  . PHE C 186 ? 0.368 0.284 0.477 0.018  0.019  0.025  515 PHE EEE CB  
3961 C CG  . PHE C 186 ? 0.354 0.284 0.485 0.010  0.023  0.030  515 PHE EEE CG  
3962 C CD1 . PHE C 186 ? 0.358 0.297 0.501 0.001  0.016  0.023  515 PHE EEE CD1 
3963 C CD2 . PHE C 186 ? 0.369 0.298 0.505 0.015  0.035  0.041  515 PHE EEE CD2 
3964 C CE1 . PHE C 186 ? 0.351 0.294 0.506 -0.003 0.014  0.025  515 PHE EEE CE1 
3965 C CE2 . PHE C 186 ? 0.366 0.306 0.526 0.008  0.033  0.044  515 PHE EEE CE2 
3966 C CZ  . PHE C 186 ? 0.347 0.291 0.513 -0.001 0.020  0.035  515 PHE EEE CZ  
3967 N N   . GLU C 187 ? 0.387 0.284 0.492 0.018  -0.018 0.002  516 GLU EEE N   
3968 C CA  . GLU C 187 ? 0.418 0.296 0.516 0.024  -0.036 -0.005 516 GLU EEE CA  
3969 C C   . GLU C 187 ? 0.426 0.308 0.522 0.025  -0.029 -0.002 516 GLU EEE C   
3970 O O   . GLU C 187 ? 0.391 0.296 0.510 0.015  -0.019 0.001  516 GLU EEE O   
3971 C CB  . GLU C 187 ? 0.416 0.302 0.556 0.016  -0.050 -0.009 516 GLU EEE CB  
3972 C CG  . GLU C 187 ? 0.455 0.318 0.600 0.022  -0.077 -0.016 516 GLU EEE CG  
3973 C CD  . GLU C 187 ? 0.446 0.327 0.656 0.012  -0.085 -0.014 516 GLU EEE CD  
3974 O OE1 . GLU C 187 ? 0.468 0.370 0.703 0.006  -0.070 -0.009 516 GLU EEE OE1 
3975 O OE2 . GLU C 187 ? 0.452 0.322 0.689 0.012  -0.106 -0.016 516 GLU EEE OE2 
3976 N N   . LEU C 188 ? 0.474 0.328 0.536 0.039  -0.036 -0.003 517 LEU EEE N   
3977 C CA  . LEU C 188 ? 0.517 0.369 0.571 0.042  -0.028 0.002  517 LEU EEE CA  
3978 C C   . LEU C 188 ? 0.519 0.347 0.561 0.049  -0.050 -0.008 517 LEU EEE C   
3979 O O   . LEU C 188 ? 0.570 0.369 0.571 0.065  -0.050 -0.005 517 LEU EEE O   
3980 C CB  . LEU C 188 ? 0.599 0.432 0.617 0.059  -0.008 0.015  517 LEU EEE CB  
3981 C CG  . LEU C 188 ? 0.627 0.476 0.659 0.056  0.013  0.027  517 LEU EEE CG  
3982 C CD1 . LEU C 188 ? 0.680 0.511 0.685 0.066  0.010  0.024  517 LEU EEE CD1 
3983 C CD2 . LEU C 188 ? 0.710 0.555 0.741 0.067  0.038  0.047  517 LEU EEE CD2 
3984 N N   . LEU C 189 ? 0.472 0.311 0.551 0.039  -0.069 -0.016 518 LEU EEE N   
3985 C CA  . LEU C 189 ? 0.493 0.311 0.575 0.044  -0.095 -0.024 518 LEU EEE CA  
3986 C C   . LEU C 189 ? 0.478 0.306 0.560 0.042  -0.084 -0.021 518 LEU EEE C   
3987 O O   . LEU C 189 ? 0.418 0.276 0.517 0.033  -0.061 -0.013 518 LEU EEE O   
3988 C CB  . LEU C 189 ? 0.481 0.315 0.625 0.032  -0.111 -0.027 518 LEU EEE CB  
3989 C CG  . LEU C 189 ? 0.510 0.333 0.667 0.033  -0.128 -0.030 518 LEU EEE CG  
3990 C CD1 . LEU C 189 ? 0.499 0.333 0.731 0.024  -0.148 -0.029 518 LEU EEE CD1 
3991 C CD2 . LEU C 189 ? 0.574 0.344 0.668 0.053  -0.152 -0.039 518 LEU EEE CD2 
3992 N N   . HIS C 190 ? 0.496 0.297 0.560 0.052  -0.103 -0.027 519 HIS EEE N   
3993 C CA  . HIS C 190 ? 0.485 0.294 0.554 0.050  -0.098 -0.025 519 HIS EEE CA  
3994 C C   . HIS C 190 ? 0.446 0.286 0.577 0.035  -0.101 -0.026 519 HIS EEE C   
3995 O O   . HIS C 190 ? 0.469 0.298 0.622 0.036  -0.124 -0.032 519 HIS EEE O   
3996 C CB  . HIS C 190 ? 0.561 0.324 0.581 0.069  -0.116 -0.030 519 HIS EEE CB  
3997 C CG  . HIS C 190 ? 0.625 0.351 0.577 0.091  -0.103 -0.024 519 HIS EEE CG  
3998 N ND1 . HIS C 190 ? 0.611 0.355 0.557 0.091  -0.068 -0.008 519 HIS EEE ND1 
3999 C CD2 . HIS C 190 ? 0.719 0.388 0.607 0.116  -0.121 -0.029 519 HIS EEE CD2 
4000 C CE1 . HIS C 190 ? 0.691 0.395 0.577 0.116  -0.056 -0.001 519 HIS EEE CE1 
4001 N NE2 . HIS C 190 ? 0.762 0.416 0.602 0.133  -0.088 -0.015 519 HIS EEE NE2 
4002 N N   . ALA C 191 ? 0.410 0.283 0.567 0.024  -0.079 -0.020 520 ALA EEE N   
4003 C CA  . ALA C 191 ? 0.381 0.279 0.588 0.015  -0.073 -0.017 520 ALA EEE CA  
4004 C C   . ALA C 191 ? 0.354 0.271 0.555 0.011  -0.048 -0.011 520 ALA EEE C   
4005 O O   . ALA C 191 ? 0.320 0.235 0.493 0.011  -0.041 -0.010 520 ALA EEE O   
4006 C CB  . ALA C 191 ? 0.385 0.286 0.630 0.012  -0.080 -0.016 520 ALA EEE CB  
4007 N N   . PRO C 192 ? 0.336 0.266 0.562 0.011  -0.036 -0.007 521 PRO EEE N   
4008 C CA  . PRO C 192 ? 0.344 0.278 0.552 0.012  -0.020 -0.004 521 PRO EEE CA  
4009 C C   . PRO C 192 ? 0.346 0.281 0.544 0.010  -0.014 -0.002 521 PRO EEE C   
4010 O O   . PRO C 192 ? 0.345 0.285 0.564 0.009  -0.013 0.000  521 PRO EEE O   
4011 C CB  . PRO C 192 ? 0.354 0.292 0.585 0.019  -0.005 0.002  521 PRO EEE CB  
4012 C CG  . PRO C 192 ? 0.347 0.287 0.610 0.018  -0.017 0.001  521 PRO EEE CG  
4013 C CD  . PRO C 192 ? 0.351 0.286 0.622 0.012  -0.038 -0.004 521 PRO EEE CD  
4014 N N   . ALA C 193 ? 0.345 0.276 0.518 0.009  -0.012 -0.003 522 ALA EEE N   
4015 C CA  . ALA C 193 ? 0.348 0.280 0.512 0.007  -0.009 -0.001 522 ALA EEE CA  
4016 C C   . ALA C 193 ? 0.380 0.304 0.529 0.013  -0.001 -0.000 522 ALA EEE C   
4017 O O   . ALA C 193 ? 0.431 0.343 0.564 0.016  -0.009 -0.003 522 ALA EEE O   
4018 C CB  . ALA C 193 ? 0.363 0.293 0.517 0.004  -0.014 0.001  522 ALA EEE CB  
4019 N N   . THR C 194 ? 0.378 0.304 0.532 0.018  0.011  0.004  523 THR EEE N   
4020 C CA  . THR C 194 ? 0.428 0.336 0.558 0.031  0.023  0.006  523 THR EEE CA  
4021 C C   . THR C 194 ? 0.420 0.319 0.530 0.033  0.023  0.006  523 THR EEE C   
4022 O O   . THR C 194 ? 0.474 0.349 0.552 0.048  0.032  0.008  523 THR EEE O   
4023 C CB  . THR C 194 ? 0.463 0.375 0.615 0.041  0.045  0.017  523 THR EEE CB  
4024 O OG1 . THR C 194 ? 0.474 0.402 0.661 0.034  0.050  0.022  523 THR EEE OG1 
4025 C CG2 . THR C 194 ? 0.484 0.403 0.662 0.040  0.044  0.018  523 THR EEE CG2 
4026 N N   . VAL C 195 ? 0.372 0.284 0.494 0.021  0.014  0.004  524 VAL EEE N   
4027 C CA  . VAL C 195 ? 0.389 0.291 0.495 0.021  0.009  0.003  524 VAL EEE CA  
4028 C C   . VAL C 195 ? 0.386 0.284 0.494 0.015  -0.010 0.000  524 VAL EEE C   
4029 O O   . VAL C 195 ? 0.353 0.267 0.482 0.006  -0.012 0.003  524 VAL EEE O   
4030 C CB  . VAL C 195 ? 0.391 0.310 0.515 0.014  0.015  0.006  524 VAL EEE CB  
4031 C CG1 . VAL C 195 ? 0.395 0.302 0.500 0.016  0.013  0.006  524 VAL EEE CG1 
4032 C CG2 . VAL C 195 ? 0.388 0.316 0.534 0.016  0.030  0.012  524 VAL EEE CG2 
4033 N N   . CYS C 196 ? 0.449 0.321 0.534 0.023  -0.025 -0.004 525 CYS EEE N   
4034 C CA  . CYS C 196 ? 0.456 0.320 0.557 0.018  -0.049 -0.004 525 CYS EEE CA  
4035 C C   . CYS C 196 ? 0.475 0.316 0.568 0.022  -0.069 -0.007 525 CYS EEE C   
4036 O O   . CYS C 196 ? 0.506 0.327 0.561 0.033  -0.065 -0.011 525 CYS EEE O   
4037 C CB  . CYS C 196 ? 0.498 0.343 0.586 0.025  -0.062 -0.009 525 CYS EEE CB  
4038 S SG  . CYS C 196 ? 0.510 0.380 0.613 0.020  -0.044 -0.006 525 CYS EEE SG  
4039 N N   . GLY C 197 ? 0.472 0.313 0.603 0.013  -0.089 -0.003 526 GLY EEE N   
4040 C CA  . GLY C 197 ? 0.511 0.323 0.645 0.017  -0.121 -0.006 526 GLY EEE CA  
4041 C C   . GLY C 197 ? 0.588 0.350 0.677 0.034  -0.150 -0.019 526 GLY EEE C   
4042 O O   . GLY C 197 ? 0.636 0.391 0.696 0.042  -0.142 -0.022 526 GLY EEE O   
4043 N N   . PRO C 198 ? 0.640 0.360 0.720 0.042  -0.189 -0.025 527 PRO EEE N   
4044 C CA  . PRO C 198 ? 0.725 0.381 0.746 0.064  -0.224 -0.040 527 PRO EEE CA  
4045 C C   . PRO C 198 ? 0.770 0.417 0.812 0.062  -0.246 -0.041 527 PRO EEE C   
4046 O O   . PRO C 198 ? 0.774 0.457 0.896 0.042  -0.249 -0.029 527 PRO EEE O   
4047 C CB  . PRO C 198 ? 0.758 0.373 0.785 0.069  -0.271 -0.045 527 PRO EEE CB  
4048 C CG  . PRO C 198 ? 0.720 0.380 0.791 0.053  -0.246 -0.034 527 PRO EEE CG  
4049 C CD  . PRO C 198 ? 0.628 0.355 0.754 0.032  -0.204 -0.020 527 PRO EEE CD  
4050 N N   . GLN D 3   ? 0.823 0.779 0.478 0.127  -0.012 -0.064 1   GLN FFF N   
4051 C CA  . GLN D 3   ? 0.794 0.757 0.475 0.117  -0.033 -0.076 1   GLN FFF CA  
4052 C C   . GLN D 3   ? 0.699 0.663 0.423 0.103  -0.028 -0.070 1   GLN FFF C   
4053 O O   . GLN D 3   ? 0.754 0.712 0.488 0.101  -0.011 -0.061 1   GLN FFF O   
4054 C CB  . GLN D 3   ? 0.877 0.842 0.552 0.118  -0.045 -0.100 1   GLN FFF CB  
4055 C CG  . GLN D 3   ? 0.988 0.947 0.612 0.133  -0.045 -0.108 1   GLN FFF CG  
4056 C CD  . GLN D 3   ? 1.048 1.012 0.658 0.137  -0.069 -0.130 1   GLN FFF CD  
4057 O OE1 . GLN D 3   ? 1.037 1.009 0.653 0.136  -0.089 -0.130 1   GLN FFF OE1 
4058 N NE2 . GLN D 3   ? 1.092 1.051 0.682 0.141  -0.068 -0.149 1   GLN FFF NE2 
4059 N N   . VAL D 4   ? 0.591 0.561 0.340 0.094  -0.041 -0.073 2   VAL FFF N   
4060 C CA  . VAL D 4   ? 0.540 0.509 0.324 0.081  -0.038 -0.067 2   VAL FFF CA  
4061 C C   . VAL D 4   ? 0.511 0.476 0.311 0.076  -0.032 -0.074 2   VAL FFF C   
4062 O O   . VAL D 4   ? 0.501 0.467 0.298 0.078  -0.037 -0.089 2   VAL FFF O   
4063 C CB  . VAL D 4   ? 0.527 0.501 0.331 0.073  -0.051 -0.070 2   VAL FFF CB  
4064 C CG1 . VAL D 4   ? 0.504 0.474 0.335 0.061  -0.048 -0.065 2   VAL FFF CG1 
4065 C CG2 . VAL D 4   ? 0.536 0.513 0.329 0.078  -0.056 -0.062 2   VAL FFF CG2 
4066 N N   . GLN D 5   ? 0.486 0.447 0.305 0.070  -0.021 -0.063 3   GLN FFF N   
4067 C CA  . GLN D 5   ? 0.491 0.449 0.333 0.065  -0.017 -0.067 3   GLN FFF CA  
4068 C C   . GLN D 5   ? 0.430 0.387 0.299 0.053  -0.020 -0.058 3   GLN FFF C   
4069 O O   . GLN D 5   ? 0.417 0.373 0.285 0.052  -0.018 -0.047 3   GLN FFF O   
4070 C CB  . GLN D 5   ? 0.566 0.518 0.405 0.071  0.000  -0.062 3   GLN FFF CB  
4071 C CG  . GLN D 5   ? 0.688 0.639 0.494 0.083  0.007  -0.069 3   GLN FFF CG  
4072 C CD  . GLN D 5   ? 0.773 0.723 0.579 0.084  0.003  -0.088 3   GLN FFF CD  
4073 O OE1 . GLN D 5   ? 0.816 0.766 0.652 0.076  0.002  -0.093 3   GLN FFF OE1 
4074 N NE2 . GLN D 5   ? 0.880 0.830 0.652 0.094  -0.000 -0.100 3   GLN FFF NE2 
4075 N N   . LEU D 6   ? 0.383 0.339 0.274 0.046  -0.024 -0.063 4   LEU FFF N   
4076 C CA  . LEU D 6   ? 0.362 0.315 0.274 0.037  -0.028 -0.054 4   LEU FFF CA  
4077 C C   . LEU D 6   ? 0.373 0.323 0.307 0.035  -0.021 -0.051 4   LEU FFF C   
4078 O O   . LEU D 6   ? 0.405 0.355 0.349 0.036  -0.021 -0.059 4   LEU FFF O   
4079 C CB  . LEU D 6   ? 0.346 0.299 0.266 0.030  -0.038 -0.060 4   LEU FFF CB  
4080 C CG  . LEU D 6   ? 0.361 0.318 0.267 0.032  -0.043 -0.063 4   LEU FFF CG  
4081 C CD1 . LEU D 6   ? 0.348 0.304 0.268 0.026  -0.050 -0.069 4   LEU FFF CD1 
4082 C CD2 . LEU D 6   ? 0.367 0.321 0.265 0.030  -0.041 -0.052 4   LEU FFF CD2 
4083 N N   . VAL D 7   ? 0.376 0.323 0.318 0.034  -0.016 -0.040 5   VAL FFF N   
4084 C CA  . VAL D 7   ? 0.372 0.316 0.340 0.033  -0.010 -0.036 5   VAL FFF CA  
4085 C C   . VAL D 7   ? 0.373 0.315 0.364 0.024  -0.021 -0.030 5   VAL FFF C   
4086 O O   . VAL D 7   ? 0.366 0.306 0.355 0.019  -0.028 -0.023 5   VAL FFF O   
4087 C CB  . VAL D 7   ? 0.396 0.339 0.367 0.038  0.003  -0.027 5   VAL FFF CB  
4088 C CG1 . VAL D 7   ? 0.401 0.341 0.406 0.037  0.010  -0.022 5   VAL FFF CG1 
4089 C CG2 . VAL D 7   ? 0.421 0.364 0.364 0.049  0.015  -0.030 5   VAL FFF CG2 
4090 N N   . GLU D 8   ? 0.370 0.312 0.379 0.021  -0.025 -0.033 6   GLU FFF N   
4091 C CA  . GLU D 8   ? 0.368 0.307 0.394 0.013  -0.037 -0.027 6   GLU FFF CA  
4092 C C   . GLU D 8   ? 0.367 0.304 0.426 0.012  -0.037 -0.020 6   GLU FFF C   
4093 O O   . GLU D 8   ? 0.352 0.290 0.426 0.017  -0.025 -0.023 6   GLU FFF O   
4094 C CB  . GLU D 8   ? 0.368 0.306 0.397 0.012  -0.041 -0.034 6   GLU FFF CB  
4095 C CG  . GLU D 8   ? 0.387 0.328 0.393 0.013  -0.042 -0.042 6   GLU FFF CG  
4096 C CD  . GLU D 8   ? 0.397 0.339 0.415 0.013  -0.042 -0.052 6   GLU FFF CD  
4097 O OE1 . GLU D 8   ? 0.482 0.425 0.518 0.016  -0.037 -0.057 6   GLU FFF OE1 
4098 O OE2 . GLU D 8   ? 0.381 0.322 0.395 0.011  -0.047 -0.054 6   GLU FFF OE2 
4099 N N   . SER D 9   ? 0.373 0.307 0.443 0.006  -0.050 -0.010 7   SER FFF N   
4100 C CA  . SER D 9   ? 0.374 0.307 0.481 0.004  -0.054 -0.002 7   SER FFF CA  
4101 C C   . SER D 9   ? 0.376 0.304 0.486 -0.003 -0.073 0.006  7   SER FFF C   
4102 O O   . SER D 9   ? 0.369 0.294 0.450 -0.006 -0.080 0.005  7   SER FFF O   
4103 C CB  . SER D 9   ? 0.397 0.330 0.517 0.005  -0.049 0.002  7   SER FFF CB  
4104 O OG  . SER D 9   ? 0.434 0.367 0.598 0.006  -0.047 0.007  7   SER FFF OG  
4105 N N   . GLY D 10  ? 0.388 0.316 0.533 -0.005 -0.081 0.013  8   GLY FFF N   
4106 C CA  . GLY D 10  ? 0.400 0.323 0.549 -0.010 -0.100 0.023  8   GLY FFF CA  
4107 C C   . GLY D 10  ? 0.447 0.368 0.604 -0.010 -0.100 0.025  8   GLY FFF C   
4108 O O   . GLY D 10  ? 0.455 0.381 0.621 -0.006 -0.085 0.016  8   GLY FFF O   
4109 N N   . GLY D 11  ? 0.473 0.389 0.627 -0.013 -0.116 0.035  9   GLY FFF N   
4110 C CA  . GLY D 11  ? 0.518 0.433 0.685 -0.013 -0.114 0.039  9   GLY FFF CA  
4111 C C   . GLY D 11  ? 0.511 0.430 0.730 -0.011 -0.113 0.043  9   GLY FFF C   
4112 O O   . GLY D 11  ? 0.556 0.477 0.800 -0.011 -0.116 0.045  9   GLY FFF O   
4113 N N   . GLY D 12  ? 0.496 0.414 0.734 -0.010 -0.107 0.044  10  GLY FFF N   
4114 C CA  . GLY D 12  ? 0.489 0.409 0.779 -0.009 -0.108 0.051  10  GLY FFF CA  
4115 C C   . GLY D 12  ? 0.482 0.397 0.779 -0.011 -0.124 0.068  10  GLY FFF C   
4116 O O   . GLY D 12  ? 0.454 0.362 0.717 -0.012 -0.125 0.071  10  GLY FFF O   
4117 N N   . SER D 13  ? 0.496 0.411 0.835 -0.011 -0.135 0.080  11  SER FFF N   
4118 C CA  . SER D 13  ? 0.538 0.447 0.890 -0.011 -0.151 0.099  11  SER FFF CA  
4119 C C   . SER D 13  ? 0.590 0.494 0.917 -0.014 -0.177 0.113  11  SER FFF C   
4120 O O   . SER D 13  ? 0.615 0.522 0.947 -0.015 -0.186 0.109  11  SER FFF O   
4121 C CB  . SER D 13  ? 0.541 0.455 0.958 -0.009 -0.147 0.104  11  SER FFF CB  
4122 O OG  . SER D 13  ? 0.516 0.433 0.949 -0.007 -0.122 0.090  11  SER FFF OG  
4123 N N   . VAL D 14  ? 0.604 0.499 0.903 -0.014 -0.189 0.127  12  VAL FFF N   
4124 C CA  . VAL D 14  ? 0.631 0.518 0.898 -0.015 -0.216 0.140  12  VAL FFF CA  
4125 C C   . VAL D 14  ? 0.651 0.528 0.910 -0.013 -0.225 0.161  12  VAL FFF C   
4126 O O   . VAL D 14  ? 0.583 0.458 0.847 -0.012 -0.207 0.162  12  VAL FFF O   
4127 C CB  . VAL D 14  ? 0.648 0.530 0.854 -0.018 -0.216 0.130  12  VAL FFF CB  
4128 C CG1 . VAL D 14  ? 0.655 0.530 0.820 -0.017 -0.200 0.128  12  VAL FFF CG1 
4129 C CG2 . VAL D 14  ? 0.705 0.579 0.882 -0.020 -0.244 0.138  12  VAL FFF CG2 
4130 N N   . GLN D 15  ? 0.670 0.540 0.922 -0.013 -0.253 0.178  13  GLN FFF N   
4131 C CA  . GLN D 15  ? 0.701 0.560 0.939 -0.010 -0.263 0.201  13  GLN FFF CA  
4132 C C   . GLN D 15  ? 0.697 0.543 0.859 -0.010 -0.261 0.202  13  GLN FFF C   
4133 O O   . GLN D 15  ? 0.653 0.498 0.778 -0.013 -0.262 0.187  13  GLN FFF O   
4134 C CB  . GLN D 15  ? 0.772 0.631 1.038 -0.008 -0.293 0.221  13  GLN FFF CB  
4135 C CG  . GLN D 15  ? 0.834 0.687 1.063 -0.010 -0.324 0.221  13  GLN FFF CG  
4136 C CD  . GLN D 15  ? 0.934 0.782 1.179 -0.006 -0.357 0.244  13  GLN FFF CD  
4137 O OE1 . GLN D 15  ? 0.931 0.787 1.242 -0.004 -0.360 0.255  13  GLN FFF OE1 
4138 N NE2 . GLN D 15  ? 1.004 0.839 1.189 -0.006 -0.382 0.253  13  GLN FFF NE2 
4139 N N   . ALA D 16  ? 0.698 0.532 0.840 -0.007 -0.254 0.218  14  ALA FFF N   
4140 C CA  . ALA D 16  ? 0.734 0.552 0.806 -0.006 -0.249 0.222  14  ALA FFF CA  
4141 C C   . ALA D 16  ? 0.773 0.581 0.791 -0.007 -0.276 0.224  14  ALA FFF C   
4142 O O   . ALA D 16  ? 0.794 0.602 0.827 -0.006 -0.305 0.236  14  ALA FFF O   
4143 C CB  . ALA D 16  ? 0.765 0.572 0.834 -0.001 -0.240 0.245  14  ALA FFF CB  
4144 N N   . GLY D 17  ? 0.792 0.592 0.753 -0.009 -0.269 0.212  15  GLY FFF N   
4145 C CA  . GLY D 17  ? 0.828 0.618 0.735 -0.011 -0.292 0.208  15  GLY FFF CA  
4146 C C   . GLY D 17  ? 0.813 0.616 0.740 -0.016 -0.298 0.186  15  GLY FFF C   
4147 O O   . GLY D 17  ? 0.836 0.632 0.721 -0.018 -0.313 0.177  15  GLY FFF O   
4148 N N   . GLY D 18  ? 0.765 0.586 0.755 -0.017 -0.287 0.177  16  GLY FFF N   
4149 C CA  . GLY D 18  ? 0.721 0.555 0.739 -0.021 -0.288 0.158  16  GLY FFF CA  
4150 C C   . GLY D 18  ? 0.693 0.528 0.682 -0.023 -0.266 0.139  16  GLY FFF C   
4151 O O   . GLY D 18  ? 0.675 0.502 0.627 -0.023 -0.249 0.140  16  GLY FFF O   
4152 N N   . SER D 19  ? 0.687 0.533 0.697 -0.026 -0.265 0.123  17  SER FFF N   
4153 C CA  . SER D 19  ? 0.663 0.510 0.650 -0.028 -0.247 0.105  17  SER FFF CA  
4154 C C   . SER D 19  ? 0.601 0.465 0.638 -0.028 -0.230 0.094  17  SER FFF C   
4155 O O   . SER D 19  ? 0.585 0.457 0.671 -0.027 -0.238 0.098  17  SER FFF O   
4156 C CB  . SER D 19  ? 0.735 0.576 0.688 -0.031 -0.262 0.097  17  SER FFF CB  
4157 O OG  . SER D 19  ? 0.807 0.631 0.706 -0.031 -0.276 0.106  17  SER FFF OG  
4158 N N   . LEU D 20  ? 0.559 0.426 0.581 -0.028 -0.207 0.082  18  LEU FFF N   
4159 C CA  . LEU D 20  ? 0.530 0.409 0.583 -0.027 -0.190 0.070  18  LEU FFF CA  
4160 C C   . LEU D 20  ? 0.518 0.396 0.536 -0.028 -0.181 0.058  18  LEU FFF C   
4161 O O   . LEU D 20  ? 0.548 0.416 0.523 -0.029 -0.179 0.058  18  LEU FFF O   
4162 C CB  . LEU D 20  ? 0.508 0.394 0.583 -0.023 -0.171 0.069  18  LEU FFF CB  
4163 C CG  . LEU D 20  ? 0.521 0.411 0.643 -0.021 -0.175 0.078  18  LEU FFF CG  
4164 C CD1 . LEU D 20  ? 0.537 0.430 0.675 -0.019 -0.156 0.076  18  LEU FFF CD1 
4165 C CD2 . LEU D 20  ? 0.514 0.413 0.680 -0.021 -0.177 0.075  18  LEU FFF CD2 
4166 N N   . THR D 21  ? 0.476 0.363 0.514 -0.027 -0.173 0.048  19  THR FFF N   
4167 C CA  . THR D 21  ? 0.459 0.347 0.472 -0.028 -0.159 0.037  19  THR FFF CA  
4168 C C   . THR D 21  ? 0.434 0.332 0.466 -0.023 -0.138 0.030  19  THR FFF C   
4169 O O   . THR D 21  ? 0.424 0.330 0.493 -0.021 -0.135 0.030  19  THR FFF O   
4170 C CB  . THR D 21  ? 0.481 0.369 0.497 -0.030 -0.168 0.032  19  THR FFF CB  
4171 O OG1 . THR D 21  ? 0.512 0.390 0.513 -0.033 -0.191 0.038  19  THR FFF OG1 
4172 C CG2 . THR D 21  ? 0.475 0.362 0.464 -0.030 -0.155 0.023  19  THR FFF CG2 
4173 N N   . LEU D 22  ? 0.421 0.320 0.431 -0.022 -0.125 0.025  20  LEU FFF N   
4174 C CA  . LEU D 22  ? 0.415 0.322 0.433 -0.018 -0.107 0.016  20  LEU FFF CA  
4175 C C   . LEU D 22  ? 0.386 0.295 0.387 -0.017 -0.101 0.009  20  LEU FFF C   
4176 O O   . LEU D 22  ? 0.398 0.300 0.373 -0.020 -0.106 0.009  20  LEU FFF O   
4177 C CB  . LEU D 22  ? 0.414 0.320 0.420 -0.016 -0.099 0.013  20  LEU FFF CB  
4178 C CG  . LEU D 22  ? 0.432 0.334 0.453 -0.017 -0.104 0.021  20  LEU FFF CG  
4179 C CD1 . LEU D 22  ? 0.446 0.349 0.464 -0.016 -0.094 0.016  20  LEU FFF CD1 
4180 C CD2 . LEU D 22  ? 0.433 0.341 0.494 -0.015 -0.106 0.024  20  LEU FFF CD2 
4181 N N   . SER D 23  ? 0.385 0.302 0.401 -0.012 -0.090 0.004  21  SER FFF N   
4182 C CA  . SER D 23  ? 0.391 0.310 0.394 -0.010 -0.081 -0.000 21  SER FFF CA  
4183 C C   . SER D 23  ? 0.355 0.280 0.351 -0.004 -0.067 -0.007 21  SER FFF C   
4184 O O   . SER D 23  ? 0.343 0.271 0.353 -0.001 -0.063 -0.010 21  SER FFF O   
4185 C CB  . SER D 23  ? 0.407 0.328 0.433 -0.009 -0.080 0.003  21  SER FFF CB  
4186 O OG  . SER D 23  ? 0.463 0.390 0.517 -0.004 -0.071 0.003  21  SER FFF OG  
4187 N N   . CYS D 24  ? 0.346 0.272 0.320 -0.003 -0.062 -0.011 22  CYS FFF N   
4188 C CA  . CYS D 24  ? 0.340 0.272 0.303 0.004  -0.052 -0.018 22  CYS FFF CA  
4189 C C   . CYS D 24  ? 0.349 0.283 0.302 0.007  -0.045 -0.017 22  CYS FFF C   
4190 O O   . CYS D 24  ? 0.360 0.290 0.302 0.003  -0.049 -0.015 22  CYS FFF O   
4191 C CB  . CYS D 24  ? 0.349 0.280 0.298 0.002  -0.054 -0.023 22  CYS FFF CB  
4192 S SG  . CYS D 24  ? 0.368 0.307 0.307 0.010  -0.047 -0.033 22  CYS FFF SG  
4193 N N   . VAL D 25  ? 0.338 0.276 0.296 0.014  -0.035 -0.017 23  VAL FFF N   
4194 C CA  . VAL D 25  ? 0.343 0.283 0.291 0.019  -0.026 -0.014 23  VAL FFF CA  
4195 C C   . VAL D 25  ? 0.345 0.289 0.271 0.027  -0.022 -0.020 23  VAL FFF C   
4196 O O   . VAL D 25  ? 0.343 0.289 0.268 0.032  -0.018 -0.026 23  VAL FFF O   
4197 C CB  . VAL D 25  ? 0.352 0.291 0.320 0.023  -0.016 -0.008 23  VAL FFF CB  
4198 C CG1 . VAL D 25  ? 0.371 0.311 0.331 0.029  -0.005 -0.002 23  VAL FFF CG1 
4199 C CG2 . VAL D 25  ? 0.347 0.283 0.343 0.016  -0.024 -0.003 23  VAL FFF CG2 
4200 N N   . ALA D 26  ? 0.342 0.287 0.253 0.027  -0.023 -0.020 24  ALA FFF N   
4201 C CA  . ALA D 26  ? 0.358 0.308 0.250 0.035  -0.021 -0.024 24  ALA FFF CA  
4202 C C   . ALA D 26  ? 0.393 0.344 0.277 0.044  -0.010 -0.018 24  ALA FFF C   
4203 O O   . ALA D 26  ? 0.389 0.337 0.282 0.044  -0.003 -0.008 24  ALA FFF O   
4204 C CB  . ALA D 26  ? 0.364 0.314 0.250 0.031  -0.028 -0.026 24  ALA FFF CB  
4205 N N   . SER D 27  ? 0.401 0.355 0.267 0.053  -0.006 -0.023 25  SER FFF N   
4206 C CA  . SER D 27  ? 0.447 0.401 0.296 0.064  0.005  -0.015 25  SER FFF CA  
4207 C C   . SER D 27  ? 0.462 0.420 0.283 0.072  -0.002 -0.021 25  SER FFF C   
4208 O O   . SER D 27  ? 0.480 0.441 0.297 0.071  -0.012 -0.034 25  SER FFF O   
4209 C CB  . SER D 27  ? 0.504 0.454 0.355 0.070  0.019  -0.013 25  SER FFF CB  
4210 O OG  . SER D 27  ? 0.516 0.466 0.358 0.072  0.016  -0.026 25  SER FFF OG  
4211 N N   . GLY D 28  ? 0.457 0.416 0.263 0.080  0.002  -0.011 26  GLY FFF N   
4212 C CA  . GLY D 28  ? 0.480 0.443 0.261 0.088  -0.006 -0.014 26  GLY FFF CA  
4213 C C   . GLY D 28  ? 0.451 0.418 0.244 0.082  -0.018 -0.015 26  GLY FFF C   
4214 O O   . GLY D 28  ? 0.475 0.447 0.254 0.088  -0.028 -0.017 26  GLY FFF O   
4215 N N   A VAL D 29  ? 0.438 0.403 0.256 0.071  -0.018 -0.013 27  VAL FFF N   
4216 N N   B VAL D 29  ? 0.440 0.405 0.259 0.071  -0.018 -0.013 27  VAL FFF N   
4217 C CA  A VAL D 29  ? 0.418 0.384 0.249 0.064  -0.024 -0.013 27  VAL FFF CA  
4218 C CA  B VAL D 29  ? 0.421 0.387 0.254 0.063  -0.025 -0.013 27  VAL FFF CA  
4219 C C   A VAL D 29  ? 0.401 0.362 0.251 0.056  -0.015 -0.005 27  VAL FFF C   
4220 C C   B VAL D 29  ? 0.405 0.365 0.255 0.055  -0.016 -0.006 27  VAL FFF C   
4221 O O   A VAL D 29  ? 0.407 0.364 0.265 0.054  -0.010 -0.003 27  VAL FFF O   
4222 O O   B VAL D 29  ? 0.414 0.370 0.273 0.051  -0.012 -0.006 27  VAL FFF O   
4223 C CB  A VAL D 29  ? 0.414 0.381 0.255 0.056  -0.035 -0.026 27  VAL FFF CB  
4224 C CB  B VAL D 29  ? 0.419 0.387 0.260 0.056  -0.036 -0.027 27  VAL FFF CB  
4225 C CG1 A VAL D 29  ? 0.404 0.367 0.256 0.048  -0.033 -0.030 27  VAL FFF CG1 
4226 C CG1 B VAL D 29  ? 0.397 0.361 0.255 0.046  -0.037 -0.026 27  VAL FFF CG1 
4227 C CG2 A VAL D 29  ? 0.396 0.363 0.249 0.051  -0.039 -0.026 27  VAL FFF CG2 
4228 C CG2 B VAL D 29  ? 0.434 0.407 0.263 0.063  -0.047 -0.036 27  VAL FFF CG2 
4229 N N   . THR D 30  ? 0.372 0.331 0.231 0.053  -0.015 0.000  28  THR FFF N   
4230 C CA  . THR D 30  ? 0.363 0.316 0.240 0.045  -0.008 0.005  28  THR FFF CA  
4231 C C   . THR D 30  ? 0.329 0.279 0.213 0.035  -0.015 -0.004 28  THR FFF C   
4232 O O   . THR D 30  ? 0.327 0.279 0.210 0.035  -0.019 -0.007 28  THR FFF O   
4233 C CB  . THR D 30  ? 0.365 0.319 0.248 0.050  -0.000 0.016  28  THR FFF CB  
4234 O OG1 . THR D 30  ? 0.381 0.337 0.253 0.061  0.008  0.025  28  THR FFF OG1 
4235 C CG2 . THR D 30  ? 0.369 0.316 0.273 0.042  0.006  0.018  28  THR FFF CG2 
4236 N N   . LEU D 31  ? 0.309 0.253 0.199 0.026  -0.016 -0.007 29  LEU FFF N   
4237 C CA  . LEU D 31  ? 0.313 0.250 0.204 0.017  -0.021 -0.013 29  LEU FFF CA  
4238 C C   . LEU D 31  ? 0.296 0.229 0.193 0.014  -0.016 -0.011 29  LEU FFF C   
4239 O O   . LEU D 31  ? 0.311 0.244 0.216 0.017  -0.009 -0.005 29  LEU FFF O   
4240 C CB  . LEU D 31  ? 0.317 0.248 0.210 0.010  -0.025 -0.015 29  LEU FFF CB  
4241 C CG  . LEU D 31  ? 0.325 0.258 0.217 0.011  -0.029 -0.017 29  LEU FFF CG  
4242 C CD1 . LEU D 31  ? 0.327 0.254 0.223 0.004  -0.035 -0.018 29  LEU FFF CD1 
4243 C CD2 . LEU D 31  ? 0.337 0.275 0.223 0.014  -0.033 -0.023 29  LEU FFF CD2 
4244 N N   . GLY D 32  ? 0.295 0.224 0.190 0.009  -0.016 -0.016 30  GLY FFF N   
4245 C CA  . GLY D 32  ? 0.292 0.214 0.193 0.006  -0.010 -0.017 30  GLY FFF CA  
4246 C C   . GLY D 32  ? 0.287 0.211 0.192 0.008  -0.009 -0.019 30  GLY FFF C   
4247 O O   . GLY D 32  ? 0.285 0.204 0.198 0.005  -0.001 -0.020 30  GLY FFF O   
4248 N N   . ARG D 33  ? 0.279 0.212 0.184 0.012  -0.015 -0.021 31  ARG FFF N   
4249 C CA  . ARG D 33  ? 0.286 0.220 0.201 0.013  -0.016 -0.025 31  ARG FFF CA  
4250 C C   . ARG D 33  ? 0.295 0.228 0.209 0.010  -0.021 -0.031 31  ARG FFF C   
4251 O O   . ARG D 33  ? 0.300 0.226 0.222 0.005  -0.016 -0.035 31  ARG FFF O   
4252 C CB  . ARG D 33  ? 0.286 0.233 0.209 0.023  -0.022 -0.021 31  ARG FFF CB  
4253 C CG  . ARG D 33  ? 0.280 0.230 0.221 0.023  -0.026 -0.026 31  ARG FFF CG  
4254 C CD  . ARG D 33  ? 0.276 0.217 0.232 0.017  -0.014 -0.027 31  ARG FFF CD  
4255 N NE  . ARG D 33  ? 0.278 0.223 0.258 0.018  -0.017 -0.031 31  ARG FFF NE  
4256 C CZ  . ARG D 33  ? 0.285 0.222 0.284 0.013  -0.006 -0.032 31  ARG FFF CZ  
4257 N NH1 . ARG D 33  ? 0.291 0.215 0.284 0.008  0.008  -0.030 31  ARG FFF NH1 
4258 N NH2 . ARG D 33  ? 0.282 0.223 0.309 0.015  -0.009 -0.036 31  ARG FFF NH2 
4259 N N   . HIS D 34  ? 0.297 0.235 0.203 0.012  -0.028 -0.033 32  HIS FFF N   
4260 C CA  . HIS D 34  ? 0.301 0.241 0.212 0.011  -0.033 -0.040 32  HIS FFF CA  
4261 C C   . HIS D 34  ? 0.293 0.222 0.198 0.003  -0.030 -0.040 32  HIS FFF C   
4262 O O   . HIS D 34  ? 0.299 0.222 0.192 0.000  -0.028 -0.036 32  HIS FFF O   
4263 C CB  . HIS D 34  ? 0.306 0.256 0.212 0.019  -0.042 -0.043 32  HIS FFF CB  
4264 C CG  . HIS D 34  ? 0.317 0.276 0.223 0.027  -0.046 -0.041 32  HIS FFF CG  
4265 N ND1 . HIS D 34  ? 0.321 0.283 0.214 0.034  -0.045 -0.034 32  HIS FFF ND1 
4266 C CD2 . HIS D 34  ? 0.337 0.301 0.256 0.031  -0.051 -0.043 32  HIS FFF CD2 
4267 C CE1 . HIS D 34  ? 0.346 0.315 0.238 0.041  -0.049 -0.032 32  HIS FFF CE1 
4268 N NE2 . HIS D 34  ? 0.353 0.324 0.263 0.040  -0.055 -0.038 32  HIS FFF NE2 
4269 N N   . ALA D 35  ? 0.313 0.240 0.229 0.001  -0.030 -0.044 33  ALA FFF N   
4270 C CA  . ALA D 35  ? 0.318 0.236 0.229 -0.004 -0.028 -0.043 33  ALA FFF CA  
4271 C C   . ALA D 35  ? 0.324 0.248 0.233 -0.002 -0.036 -0.044 33  ALA FFF C   
4272 O O   . ALA D 35  ? 0.314 0.248 0.231 0.004  -0.042 -0.049 33  ALA FFF O   
4273 C CB  . ALA D 35  ? 0.330 0.245 0.259 -0.006 -0.024 -0.047 33  ALA FFF CB  
4274 N N   . ILE D 36  ? 0.329 0.245 0.227 -0.006 -0.036 -0.039 34  ILE FFF N   
4275 C CA  . ILE D 36  ? 0.337 0.258 0.237 -0.004 -0.042 -0.039 34  ILE FFF CA  
4276 C C   . ILE D 36  ? 0.345 0.256 0.243 -0.009 -0.043 -0.034 34  ILE FFF C   
4277 O O   . ILE D 36  ? 0.363 0.263 0.246 -0.014 -0.040 -0.029 34  ILE FFF O   
4278 C CB  . ILE D 36  ? 0.335 0.261 0.230 -0.001 -0.044 -0.036 34  ILE FFF CB  
4279 C CG1 . ILE D 36  ? 0.331 0.261 0.232 0.002  -0.048 -0.037 34  ILE FFF CG1 
4280 C CG2 . ILE D 36  ? 0.347 0.264 0.231 -0.006 -0.043 -0.030 34  ILE FFF CG2 
4281 C CD1 . ILE D 36  ? 0.331 0.266 0.230 0.007  -0.046 -0.034 34  ILE FFF CD1 
4282 N N   . GLY D 37  ? 0.347 0.260 0.256 -0.009 -0.046 -0.035 35  GLY FFF N   
4283 C CA  . GLY D 37  ? 0.371 0.275 0.280 -0.013 -0.047 -0.028 35  GLY FFF CA  
4284 C C   . GLY D 37  ? 0.354 0.262 0.282 -0.011 -0.051 -0.028 35  GLY FFF C   
4285 O O   . GLY D 37  ? 0.316 0.235 0.253 -0.007 -0.053 -0.035 35  GLY FFF O   
4286 N N   . TRP D 38  ? 0.369 0.270 0.301 -0.014 -0.051 -0.022 36  TRP FFF N   
4287 C CA  A TRP D 38  ? 0.364 0.267 0.318 -0.013 -0.054 -0.020 36  TRP FFF CA  
4288 C CA  B TRP D 38  ? 0.360 0.264 0.315 -0.013 -0.054 -0.020 36  TRP FFF CA  
4289 C C   . TRP D 38  ? 0.368 0.269 0.341 -0.014 -0.048 -0.021 36  TRP FFF C   
4290 O O   . TRP D 38  ? 0.363 0.254 0.325 -0.016 -0.042 -0.015 36  TRP FFF O   
4291 C CB  A TRP D 38  ? 0.393 0.289 0.340 -0.016 -0.061 -0.008 36  TRP FFF CB  
4292 C CB  B TRP D 38  ? 0.385 0.282 0.334 -0.016 -0.062 -0.009 36  TRP FFF CB  
4293 C CG  A TRP D 38  ? 0.391 0.290 0.327 -0.016 -0.067 -0.008 36  TRP FFF CG  
4294 C CG  B TRP D 38  ? 0.376 0.280 0.329 -0.014 -0.067 -0.010 36  TRP FFF CG  
4295 C CD1 A TRP D 38  ? 0.409 0.302 0.322 -0.018 -0.069 -0.007 36  TRP FFF CD1 
4296 C CD1 B TRP D 38  ? 0.358 0.270 0.334 -0.011 -0.068 -0.013 36  TRP FFF CD1 
4297 C CD2 A TRP D 38  ? 0.384 0.291 0.337 -0.013 -0.070 -0.011 36  TRP FFF CD2 
4298 C CD2 B TRP D 38  ? 0.383 0.286 0.319 -0.015 -0.071 -0.009 36  TRP FFF CD2 
4299 N NE1 A TRP D 38  ? 0.408 0.307 0.325 -0.017 -0.073 -0.008 36  TRP FFF NE1 
4300 N NE1 B TRP D 38  ? 0.370 0.285 0.345 -0.010 -0.071 -0.013 36  TRP FFF NE1 
4301 C CE2 A TRP D 38  ? 0.395 0.303 0.337 -0.014 -0.073 -0.009 36  TRP FFF CE2 
4302 C CE2 B TRP D 38  ? 0.375 0.285 0.328 -0.012 -0.073 -0.010 36  TRP FFF CE2 
4303 C CE3 A TRP D 38  ? 0.373 0.287 0.352 -0.010 -0.069 -0.014 36  TRP FFF CE3 
4304 C CE3 B TRP D 38  ? 0.400 0.296 0.312 -0.018 -0.071 -0.008 36  TRP FFF CE3 
4305 C CZ2 A TRP D 38  ? 0.394 0.307 0.350 -0.011 -0.074 -0.010 36  TRP FFF CZ2 
4306 C CZ2 B TRP D 38  ? 0.386 0.297 0.335 -0.013 -0.075 -0.009 36  TRP FFF CZ2 
4307 C CZ3 A TRP D 38  ? 0.387 0.307 0.377 -0.008 -0.069 -0.015 36  TRP FFF CZ3 
4308 C CZ3 B TRP D 38  ? 0.399 0.296 0.305 -0.018 -0.075 -0.008 36  TRP FFF CZ3 
4309 C CH2 A TRP D 38  ? 0.374 0.293 0.353 -0.008 -0.071 -0.012 36  TRP FFF CH2 
4310 C CH2 B TRP D 38  ? 0.388 0.293 0.314 -0.016 -0.077 -0.008 36  TRP FFF CH2 
4311 N N   . PHE D 39  ? 0.340 0.248 0.340 -0.011 -0.049 -0.028 37  PHE FFF N   
4312 C CA  . PHE D 39  ? 0.345 0.251 0.373 -0.011 -0.044 -0.029 37  PHE FFF CA  
4313 C C   . PHE D 39  ? 0.346 0.252 0.392 -0.011 -0.047 -0.022 37  PHE FFF C   
4314 O O   . PHE D 39  ? 0.362 0.272 0.402 -0.010 -0.053 -0.022 37  PHE FFF O   
4315 C CB  . PHE D 39  ? 0.333 0.249 0.383 -0.008 -0.043 -0.046 37  PHE FFF CB  
4316 C CG  . PHE D 39  ? 0.338 0.254 0.383 -0.008 -0.039 -0.051 37  PHE FFF CG  
4317 C CD1 . PHE D 39  ? 0.352 0.270 0.370 -0.007 -0.041 -0.051 37  PHE FFF CD1 
4318 C CD2 . PHE D 39  ? 0.337 0.252 0.410 -0.009 -0.033 -0.055 37  PHE FFF CD2 
4319 C CE1 . PHE D 39  ? 0.364 0.282 0.383 -0.007 -0.038 -0.055 37  PHE FFF CE1 
4320 C CE2 . PHE D 39  ? 0.356 0.271 0.431 -0.009 -0.030 -0.059 37  PHE FFF CE2 
4321 C CZ  . PHE D 39  ? 0.363 0.280 0.411 -0.008 -0.032 -0.059 37  PHE FFF CZ  
4322 N N   . ARG D 40  ? 0.341 0.265 0.265 -0.004 -0.035 0.016  38  ARG FFF N   
4323 C CA  . ARG D 40  ? 0.345 0.281 0.286 -0.010 -0.030 0.013  38  ARG FFF CA  
4324 C C   . ARG D 40  ? 0.328 0.274 0.285 -0.008 -0.030 0.015  38  ARG FFF C   
4325 O O   . ARG D 40  ? 0.322 0.274 0.288 -0.003 -0.032 0.017  38  ARG FFF O   
4326 C CB  . ARG D 40  ? 0.365 0.308 0.316 -0.007 -0.035 0.011  38  ARG FFF CB  
4327 C CG  . ARG D 40  ? 0.387 0.324 0.325 0.002  -0.037 0.019  38  ARG FFF CG  
4328 C CD  . ARG D 40  ? 0.449 0.371 0.371 0.007  -0.051 0.017  38  ARG FFF CD  
4329 N NE  . ARG D 40  ? 0.509 0.400 0.388 0.013  -0.047 0.026  38  ARG FFF NE  
4330 C CZ  . ARG D 40  ? 0.581 0.436 0.417 0.020  -0.064 0.026  38  ARG FFF CZ  
4331 N NH1 . ARG D 40  ? 0.559 0.419 0.412 0.025  -0.094 0.015  38  ARG FFF NH1 
4332 N NH2 . ARG D 40  ? 0.665 0.474 0.442 0.022  -0.051 0.033  38  ARG FFF NH2 
4333 N N   . GLN D 41  ? 0.330 0.280 0.300 -0.014 -0.026 0.011  39  GLN FFF N   
4334 C CA  . GLN D 41  ? 0.317 0.275 0.304 -0.014 -0.025 0.011  39  GLN FFF CA  
4335 C C   . GLN D 41  ? 0.301 0.265 0.309 -0.012 -0.025 0.009  39  GLN FFF C   
4336 O O   . GLN D 41  ? 0.306 0.272 0.332 -0.018 -0.019 -0.002 39  GLN FFF O   
4337 C CB  . GLN D 41  ? 0.347 0.293 0.321 -0.020 -0.025 0.006  39  GLN FFF CB  
4338 C CG  . GLN D 41  ? 0.339 0.294 0.336 -0.020 -0.025 0.004  39  GLN FFF CG  
4339 C CD  . GLN D 41  ? 0.407 0.344 0.384 -0.025 -0.033 -0.004 39  GLN FFF CD  
4340 O OE1 . GLN D 41  ? 0.508 0.413 0.441 -0.030 -0.032 -0.008 39  GLN FFF OE1 
4341 N NE2 . GLN D 41  ? 0.419 0.366 0.422 -0.024 -0.040 -0.009 39  GLN FFF NE2 
4342 N N   . ALA D 42  ? 0.330 0.287 0.334 -0.004 -0.030 0.017  40  ALA FFF N   
4343 C CA  . ALA D 42  ? 0.361 0.307 0.372 0.004  -0.041 0.018  40  ALA FFF CA  
4344 C C   . ALA D 42  ? 0.345 0.289 0.371 0.001  -0.032 0.018  40  ALA FFF C   
4345 O O   . ALA D 42  ? 0.331 0.279 0.356 -0.006 -0.020 0.020  40  ALA FFF O   
4346 C CB  . ALA D 42  ? 0.421 0.334 0.389 0.013  -0.049 0.028  40  ALA FFF CB  
4347 N N   . PRO D 43  ? 0.351 0.291 0.400 0.008  -0.042 0.012  41  PRO FFF N   
4348 C CA  . PRO D 43  ? 0.349 0.282 0.410 0.006  -0.034 0.012  41  PRO FFF CA  
4349 C C   . PRO D 43  ? 0.381 0.287 0.408 0.003  -0.022 0.026  41  PRO FFF C   
4350 O O   . PRO D 43  ? 0.396 0.267 0.381 0.010  -0.025 0.037  41  PRO FFF O   
4351 C CB  . PRO D 43  ? 0.369 0.290 0.455 0.020  -0.055 0.005  41  PRO FFF CB  
4352 C CG  . PRO D 43  ? 0.353 0.298 0.471 0.022  -0.067 -0.010 41  PRO FFF CG  
4353 C CD  . PRO D 43  ? 0.363 0.304 0.437 0.019  -0.065 0.001  41  PRO FFF CD  
4354 N N   . GLY D 44  ? 0.351 0.269 0.396 -0.008 -0.005 0.022  42  GLY FFF N   
4355 C CA  . GLY D 44  ? 0.381 0.280 0.419 -0.016 0.015  0.026  42  GLY FFF CA  
4356 C C   . GLY D 44  ? 0.405 0.306 0.436 -0.021 0.028  0.027  42  GLY FFF C   
4357 O O   . GLY D 44  ? 0.421 0.301 0.451 -0.029 0.054  0.027  42  GLY FFF O   
4358 N N   . LYS D 45  ? 0.375 0.299 0.405 -0.017 0.016  0.025  43  LYS FFF N   
4359 C CA  . LYS D 45  ? 0.397 0.327 0.429 -0.019 0.026  0.023  43  LYS FFF CA  
4360 C C   . LYS D 45  ? 0.344 0.309 0.408 -0.019 0.010  0.011  43  LYS FFF C   
4361 O O   . LYS D 45  ? 0.333 0.304 0.388 -0.017 -0.007 0.010  43  LYS FFF O   
4362 C CB  . LYS D 45  ? 0.471 0.377 0.456 -0.012 0.022  0.033  43  LYS FFF CB  
4363 C CG  . LYS D 45  ? 0.577 0.428 0.506 -0.007 0.024  0.045  43  LYS FFF CG  
4364 C CD  . LYS D 45  ? 0.729 0.535 0.633 -0.017 0.061  0.048  43  LYS FFF CD  
4365 C CE  . LYS D 45  ? 0.874 0.602 0.699 -0.011 0.059  0.063  43  LYS FFF CE  
4366 N NZ  . LYS D 45  ? 0.966 0.651 0.720 0.002  0.035  0.071  43  LYS FFF NZ  
4367 N N   . GLU D 46  ? 0.351 0.329 0.449 -0.021 0.017  0.000  44  GLU FFF N   
4368 C CA  . GLU D 46  ? 0.334 0.331 0.455 -0.015 -0.008 -0.012 44  GLU FFF CA  
4369 C C   . GLU D 46  ? 0.327 0.315 0.405 -0.008 -0.019 -0.002 44  GLU FFF C   
4370 O O   . GLU D 46  ? 0.328 0.305 0.383 -0.007 -0.004 0.007  44  GLU FFF O   
4371 C CB  . GLU D 46  ? 0.351 0.368 0.538 -0.015 -0.001 -0.031 44  GLU FFF CB  
4372 C CG  . GLU D 46  ? 0.387 0.419 0.634 -0.024 0.004  -0.049 44  GLU FFF CG  
4373 C CD  . GLU D 46  ? 0.415 0.476 0.756 -0.022 0.001  -0.079 44  GLU FFF CD  
4374 O OE1 . GLU D 46  ? 0.428 0.503 0.804 -0.013 -0.042 -0.097 44  GLU FFF OE1 
4375 O OE2 . GLU D 46  ? 0.447 0.511 0.825 -0.030 0.041  -0.088 44  GLU FFF OE2 
4376 N N   . ARG D 47  ? 0.323 0.306 0.384 -0.003 -0.044 -0.005 45  ARG FFF N   
4377 C CA  . ARG D 47  ? 0.345 0.312 0.368 0.002  -0.051 0.001  45  ARG FFF CA  
4378 C C   . ARG D 47  ? 0.335 0.311 0.383 0.008  -0.044 -0.002 45  ARG FFF C   
4379 O O   . ARG D 47  ? 0.335 0.327 0.436 0.012  -0.047 -0.017 45  ARG FFF O   
4380 C CB  . ARG D 47  ? 0.404 0.343 0.391 0.006  -0.077 -0.003 45  ARG FFF CB  
4381 C CG  . ARG D 47  ? 0.443 0.353 0.379 0.005  -0.075 0.004  45  ARG FFF CG  
4382 C CD  . ARG D 47  ? 0.549 0.404 0.420 0.006  -0.094 0.003  45  ARG FFF CD  
4383 N NE  . ARG D 47  ? 0.622 0.461 0.468 -0.006 -0.084 0.000  45  ARG FFF NE  
4384 C CZ  . ARG D 47  ? 0.707 0.482 0.474 -0.013 -0.086 -0.001 45  ARG FFF CZ  
4385 N NH1 . ARG D 47  ? 0.724 0.438 0.422 -0.008 -0.100 0.002  45  ARG FFF NH1 
4386 N NH2 . ARG D 47  ? 0.719 0.482 0.471 -0.025 -0.070 -0.007 45  ARG FFF NH2 
4387 N N   . GLU D 48  ? 0.341 0.308 0.360 0.008  -0.034 0.006  46  GLU FFF N   
4388 C CA  . GLU D 48  ? 0.377 0.345 0.410 0.012  -0.020 0.002  46  GLU FFF CA  
4389 C C   . GLU D 48  ? 0.361 0.313 0.360 0.017  -0.029 0.006  46  GLU FFF C   
4390 O O   . GLU D 48  ? 0.357 0.297 0.320 0.013  -0.034 0.013  46  GLU FFF O   
4391 C CB  . GLU D 48  ? 0.431 0.388 0.450 0.005  0.009  0.007  46  GLU FFF CB  
4392 C CG  . GLU D 48  ? 0.476 0.413 0.441 0.004  0.003  0.020  46  GLU FFF CG  
4393 C CD  . GLU D 48  ? 0.612 0.517 0.540 0.001  0.019  0.027  46  GLU FFF CD  
4394 O OE1 . GLU D 48  ? 0.625 0.517 0.561 -0.005 0.046  0.024  46  GLU FFF OE1 
4395 O OE2 . GLU D 48  ? 0.662 0.546 0.550 0.005  0.004  0.033  46  GLU FFF OE2 
4396 N N   . ARG D 49  ? 0.383 0.335 0.402 0.024  -0.025 -0.002 47  ARG FFF N   
4397 C CA  . ARG D 49  ? 0.412 0.344 0.400 0.028  -0.028 -0.000 47  ARG FFF CA  
4398 C C   . ARG D 49  ? 0.389 0.309 0.335 0.020  -0.013 0.008  47  ARG FFF C   
4399 O O   . ARG D 49  ? 0.411 0.327 0.352 0.016  0.005  0.009  47  ARG FFF O   
4400 C CB  . ARG D 49  ? 0.458 0.395 0.488 0.037  -0.020 -0.015 47  ARG FFF CB  
4401 C CG  . ARG D 49  ? 0.519 0.465 0.600 0.053  -0.049 -0.028 47  ARG FFF CG  
4402 C CD  . ARG D 49  ? 0.568 0.524 0.713 0.063  -0.040 -0.049 47  ARG FFF CD  
4403 N NE  . ARG D 49  ? 0.606 0.565 0.802 0.084  -0.084 -0.065 47  ARG FFF NE  
4404 C CZ  . ARG D 49  ? 0.663 0.585 0.818 0.100  -0.123 -0.059 47  ARG FFF CZ  
4405 N NH1 . ARG D 49  ? 0.692 0.577 0.764 0.094  -0.116 -0.040 47  ARG FFF NH1 
4406 N NH2 . ARG D 49  ? 0.684 0.596 0.877 0.122  -0.173 -0.075 47  ARG FFF NH2 
4407 N N   . VAL D 50  ? 0.395 0.301 0.310 0.018  -0.023 0.011  48  VAL FFF N   
4408 C CA  . VAL D 50  ? 0.406 0.299 0.289 0.013  -0.020 0.012  48  VAL FFF CA  
4409 C C   . VAL D 50  ? 0.425 0.300 0.292 0.016  -0.017 0.007  48  VAL FFF C   
4410 O O   . VAL D 50  ? 0.450 0.308 0.293 0.017  -0.005 0.004  48  VAL FFF O   
4411 C CB  . VAL D 50  ? 0.423 0.321 0.305 0.006  -0.032 0.012  48  VAL FFF CB  
4412 C CG1 . VAL D 50  ? 0.442 0.330 0.310 0.004  -0.041 0.005  48  VAL FFF CG1 
4413 C CG2 . VAL D 50  ? 0.425 0.338 0.324 0.004  -0.034 0.015  48  VAL FFF CG2 
4414 N N   . SER D 51  ? 0.416 0.283 0.283 0.018  -0.024 0.005  49  SER FFF N   
4415 C CA  . SER D 51  ? 0.434 0.280 0.287 0.020  -0.021 -0.000 49  SER FFF CA  
4416 C C   . SER D 51  ? 0.431 0.258 0.283 0.027  -0.031 0.001  49  SER FFF C   
4417 O O   . SER D 51  ? 0.445 0.264 0.287 0.024  -0.040 0.006  49  SER FFF O   
4418 C CB  . SER D 51  ? 0.468 0.303 0.297 0.011  -0.024 -0.005 49  SER FFF CB  
4419 O OG  . SER D 51  ? 0.529 0.342 0.342 0.013  -0.019 -0.011 49  SER FFF OG  
4420 N N   . CYS D 52  ? 0.471 0.313 0.252 -0.061 -0.042 0.040  50  CYS FFF N   
4421 C CA  . CYS D 52  ? 0.438 0.296 0.238 -0.061 -0.039 0.033  50  CYS FFF CA  
4422 C C   . CYS D 52  ? 0.423 0.277 0.205 -0.061 -0.036 0.029  50  CYS FFF C   
4423 O O   . CYS D 52  ? 0.454 0.293 0.211 -0.060 -0.031 0.033  50  CYS FFF O   
4424 C CB  . CYS D 52  ? 0.443 0.306 0.265 -0.063 -0.029 0.033  50  CYS FFF CB  
4425 S SG  . CYS D 52  ? 0.465 0.345 0.310 -0.062 -0.030 0.024  50  CYS FFF SG  
4426 N N   . ILE D 53  ? 0.407 0.275 0.202 -0.059 -0.040 0.023  51  ILE FFF N   
4427 C CA  . ILE D 53  ? 0.405 0.272 0.191 -0.059 -0.036 0.019  51  ILE FFF CA  
4428 C C   . ILE D 53  ? 0.388 0.269 0.195 -0.059 -0.030 0.015  51  ILE FFF C   
4429 O O   . ILE D 53  ? 0.368 0.261 0.194 -0.056 -0.034 0.013  51  ILE FFF O   
4430 C CB  . ILE D 53  ? 0.415 0.281 0.196 -0.057 -0.049 0.016  51  ILE FFF CB  
4431 C CG1 . ILE D 53  ? 0.426 0.287 0.196 -0.056 -0.047 0.012  51  ILE FFF CG1 
4432 C CG2 . ILE D 53  ? 0.389 0.269 0.194 -0.054 -0.055 0.015  51  ILE FFF CG2 
4433 C CD1 . ILE D 53  ? 0.446 0.300 0.210 -0.054 -0.062 0.008  51  ILE FFF CD1 
4434 N N   . ARG D 54  ? 0.384 0.264 0.187 -0.060 -0.019 0.014  52  ARG FFF N   
4435 C CA  . ARG D 54  ? 0.374 0.267 0.195 -0.059 -0.013 0.010  52  ARG FFF CA  
4436 C C   . ARG D 54  ? 0.358 0.255 0.178 -0.057 -0.019 0.006  52  ARG FFF C   
4437 O O   . ARG D 54  ? 0.360 0.248 0.163 -0.057 -0.018 0.004  52  ARG FFF O   
4438 C CB  . ARG D 54  ? 0.397 0.284 0.217 -0.061 0.002  0.012  52  ARG FFF CB  
4439 C CG  . ARG D 54  ? 0.422 0.304 0.251 -0.064 0.010  0.017  52  ARG FFF CG  
4440 C CD  . ARG D 54  ? 0.472 0.342 0.292 -0.064 0.028  0.022  52  ARG FFF CD  
4441 N NE  . ARG D 54  ? 0.475 0.354 0.306 -0.064 0.035  0.017  52  ARG FFF NE  
4442 C CZ  . ARG D 54  ? 0.516 0.406 0.380 -0.066 0.040  0.016  52  ARG FFF CZ  
4443 N NH1 . ARG D 54  ? 0.535 0.427 0.426 -0.067 0.041  0.020  52  ARG FFF NH1 
4444 N NH2 . ARG D 54  ? 0.541 0.437 0.412 -0.065 0.045  0.012  52  ARG FFF NH2 
4445 N N   . THR D 55  ? 0.326 0.234 0.162 -0.054 -0.025 0.004  53  THR FFF N   
4446 C CA  . THR D 55  ? 0.318 0.231 0.159 -0.051 -0.028 0.002  53  THR FFF CA  
4447 C C   . THR D 55  ? 0.311 0.228 0.156 -0.051 -0.020 -0.001 53  THR FFF C   
4448 O O   . THR D 55  ? 0.306 0.226 0.156 -0.050 -0.022 -0.003 53  THR FFF O   
4449 C CB  . THR D 55  ? 0.304 0.225 0.159 -0.045 -0.033 0.004  53  THR FFF CB  
4450 O OG1 . THR D 55  ? 0.295 0.222 0.157 -0.041 -0.028 0.003  53  THR FFF OG1 
4451 C CG2 . THR D 55  ? 0.316 0.231 0.166 -0.045 -0.040 0.007  53  THR FFF CG2 
4452 N N   . PHE D 56  ? 0.320 0.238 0.167 -0.053 -0.012 -0.002 54  PHE FFF N   
4453 C CA  . PHE D 56  ? 0.316 0.238 0.169 -0.053 -0.004 -0.005 54  PHE FFF CA  
4454 C C   . PHE D 56  ? 0.339 0.249 0.172 -0.056 0.001  -0.006 54  PHE FFF C   
4455 O O   . PHE D 56  ? 0.344 0.255 0.180 -0.055 0.003  -0.010 54  PHE FFF O   
4456 C CB  . PHE D 56  ? 0.316 0.243 0.183 -0.054 0.003  -0.005 54  PHE FFF CB  
4457 C CG  . PHE D 56  ? 0.319 0.251 0.197 -0.054 0.010  -0.008 54  PHE FFF CG  
4458 C CD1 . PHE D 56  ? 0.312 0.253 0.200 -0.049 0.007  -0.009 54  PHE FFF CD1 
4459 C CD2 . PHE D 56  ? 0.345 0.272 0.223 -0.057 0.022  -0.008 54  PHE FFF CD2 
4460 C CE1 . PHE D 56  ? 0.315 0.261 0.214 -0.049 0.014  -0.012 54  PHE FFF CE1 
4461 C CE2 . PHE D 56  ? 0.334 0.267 0.225 -0.056 0.029  -0.010 54  PHE FFF CE2 
4462 C CZ  . PHE D 56  ? 0.315 0.258 0.217 -0.053 0.024  -0.012 54  PHE FFF CZ  
4463 N N   . ASP D 57  ? 0.369 0.266 0.183 -0.057 0.001  -0.004 55  ASP FFF N   
4464 C CA  . ASP D 57  ? 0.395 0.274 0.182 -0.057 0.006  -0.006 55  ASP FFF CA  
4465 C C   . ASP D 57  ? 0.422 0.284 0.181 -0.056 -0.003 -0.005 55  ASP FFF C   
4466 O O   . ASP D 57  ? 0.441 0.283 0.169 -0.053 -0.001 -0.007 55  ASP FFF O   
4467 C CB  . ASP D 57  ? 0.421 0.296 0.207 -0.058 0.025  -0.003 55  ASP FFF CB  
4468 C CG  . ASP D 57  ? 0.443 0.315 0.233 -0.060 0.030  0.004  55  ASP FFF CG  
4469 O OD1 . ASP D 57  ? 0.443 0.312 0.225 -0.060 0.021  0.006  55  ASP FFF OD1 
4470 O OD2 . ASP D 57  ? 0.480 0.353 0.283 -0.061 0.046  0.007  55  ASP FFF OD2 
4471 N N   . GLY D 58  ? 0.410 0.276 0.176 -0.056 -0.015 -0.002 56  GLY FFF N   
4472 C CA  . GLY D 58  ? 0.440 0.290 0.184 -0.055 -0.028 -0.002 56  GLY FFF CA  
4473 C C   . GLY D 58  ? 0.463 0.295 0.179 -0.054 -0.022 0.004  56  GLY FFF C   
4474 O O   . GLY D 58  ? 0.492 0.308 0.185 -0.051 -0.034 0.005  56  GLY FFF O   
4475 N N   . ILE D 59  ? 0.470 0.304 0.190 -0.055 -0.005 0.009  57  ILE FFF N   
4476 C CA  . ILE D 59  ? 0.504 0.319 0.200 -0.054 0.006  0.016  57  ILE FFF CA  
4477 C C   . ILE D 59  ? 0.492 0.312 0.200 -0.056 -0.002 0.022  57  ILE FFF C   
4478 O O   . ILE D 59  ? 0.452 0.291 0.194 -0.059 -0.004 0.021  57  ILE FFF O   
4479 C CB  . ILE D 59  ? 0.520 0.337 0.227 -0.055 0.029  0.020  57  ILE FFF CB  
4480 C CG1 . ILE D 59  ? 0.558 0.365 0.246 -0.051 0.038  0.016  57  ILE FFF CG1 
4481 C CG2 . ILE D 59  ? 0.549 0.351 0.246 -0.053 0.042  0.031  57  ILE FFF CG2 
4482 C CD1 . ILE D 59  ? 0.576 0.386 0.280 -0.052 0.061  0.020  57  ILE FFF CD1 
4483 N N   . THR D 60  ? 0.519 0.319 0.197 -0.053 -0.008 0.026  58  THR FFF N   
4484 C CA  . THR D 60  ? 0.520 0.322 0.205 -0.054 -0.017 0.031  58  THR FFF CA  
4485 C C   . THR D 60  ? 0.550 0.340 0.228 -0.053 -0.001 0.041  58  THR FFF C   
4486 O O   . THR D 60  ? 0.559 0.331 0.212 -0.050 0.016  0.045  58  THR FFF O   
4487 C CB  . THR D 60  ? 0.540 0.328 0.202 -0.051 -0.037 0.029  58  THR FFF CB  
4488 O OG1 . THR D 60  ? 0.595 0.353 0.210 -0.045 -0.034 0.031  58  THR FFF OG1 
4489 C CG2 . THR D 60  ? 0.529 0.328 0.206 -0.051 -0.053 0.020  58  THR FFF CG2 
4490 N N   . SER D 61  ? 0.539 0.336 0.238 -0.056 -0.005 0.046  59  SER FFF N   
4491 C CA  . SER D 61  ? 0.576 0.362 0.275 -0.056 0.008  0.057  59  SER FFF CA  
4492 C C   . SER D 61  ? 0.587 0.371 0.286 -0.056 -0.006 0.060  59  SER FFF C   
4493 O O   . SER D 61  ? 0.538 0.336 0.253 -0.058 -0.024 0.053  59  SER FFF O   
4494 C CB  . SER D 61  ? 0.558 0.361 0.300 -0.060 0.021  0.058  59  SER FFF CB  
4495 O OG  . SER D 61  ? 0.535 0.360 0.309 -0.064 0.007  0.050  59  SER FFF OG  
4496 N N   . TYR D 62  ? 0.619 0.384 0.299 -0.054 0.002  0.071  60  TYR FFF N   
4497 C CA  . TYR D 62  ? 0.663 0.419 0.336 -0.053 -0.009 0.076  60  TYR FFF CA  
4498 C C   . TYR D 62  ? 0.697 0.446 0.383 -0.053 0.008  0.088  60  TYR FFF C   
4499 O O   . TYR D 62  ? 0.743 0.486 0.431 -0.052 0.031  0.094  60  TYR FFF O   
4500 C CB  . TYR D 62  ? 0.707 0.438 0.331 -0.046 -0.021 0.077  60  TYR FFF CB  
4501 C CG  . TYR D 62  ? 0.691 0.427 0.307 -0.045 -0.039 0.065  60  TYR FFF CG  
4502 C CD1 . TYR D 62  ? 0.679 0.425 0.312 -0.047 -0.061 0.060  60  TYR FFF CD1 
4503 C CD2 . TYR D 62  ? 0.706 0.435 0.301 -0.042 -0.034 0.059  60  TYR FFF CD2 
4504 C CE1 . TYR D 62  ? 0.687 0.439 0.321 -0.046 -0.077 0.050  60  TYR FFF CE1 
4505 C CE2 . TYR D 62  ? 0.709 0.443 0.303 -0.042 -0.052 0.049  60  TYR FFF CE2 
4506 C CZ  . TYR D 62  ? 0.693 0.438 0.308 -0.044 -0.073 0.044  60  TYR FFF CZ  
4507 O OH  . TYR D 62  ? 0.708 0.459 0.331 -0.043 -0.089 0.035  60  TYR FFF OH  
4508 N N   . VAL D 63  ? 0.718 0.467 0.416 -0.055 -0.000 0.093  61  VAL FFF N   
4509 C CA  . VAL D 63  ? 0.758 0.497 0.468 -0.055 0.015  0.106  61  VAL FFF CA  
4510 C C   . VAL D 63  ? 0.827 0.536 0.487 -0.047 0.016  0.116  61  VAL FFF C   
4511 O O   . VAL D 63  ? 0.823 0.525 0.452 -0.044 -0.004 0.110  61  VAL FFF O   
4512 C CB  . VAL D 63  ? 0.727 0.484 0.484 -0.060 0.006  0.104  61  VAL FFF CB  
4513 C CG1 . VAL D 63  ? 0.687 0.468 0.488 -0.065 0.006  0.095  61  VAL FFF CG1 
4514 C CG2 . VAL D 63  ? 0.705 0.466 0.456 -0.060 -0.018 0.099  61  VAL FFF CG2 
4515 N N   . GLU D 64  ? 0.884 0.575 0.539 -0.044 0.037  0.132  62  GLU FFF N   
4516 C CA  . GLU D 64  ? 0.972 0.627 0.570 -0.034 0.043  0.144  62  GLU FFF CA  
4517 C C   . GLU D 64  ? 0.962 0.613 0.542 -0.032 0.014  0.140  62  GLU FFF C   
4518 O O   . GLU D 64  ? 1.043 0.668 0.568 -0.024 0.005  0.141  62  GLU FFF O   
4519 C CB  . GLU D 64  ? 1.049 0.690 0.659 -0.032 0.070  0.163  62  GLU FFF CB  
4520 C CG  . GLU D 64  ? 1.140 0.760 0.725 -0.024 0.102  0.174  62  GLU FFF CG  
4521 C CD  . GLU D 64  ? 1.142 0.785 0.768 -0.030 0.115  0.167  62  GLU FFF CD  
4522 O OE1 . GLU D 64  ? 1.139 0.798 0.766 -0.034 0.098  0.150  62  GLU FFF OE1 
4523 O OE2 . GLU D 64  ? 1.161 0.802 0.818 -0.031 0.143  0.179  62  GLU FFF OE2 
4524 N N   . SER D 65  ? 0.929 0.601 0.552 -0.040 -0.000 0.136  63  SER FFF N   
4525 C CA  . SER D 65  ? 0.935 0.605 0.551 -0.039 -0.025 0.135  63  SER FFF CA  
4526 C C   . SER D 65  ? 0.927 0.604 0.532 -0.039 -0.050 0.120  63  SER FFF C   
4527 O O   . SER D 65  ? 0.982 0.653 0.578 -0.036 -0.071 0.119  63  SER FFF O   
4528 C CB  . SER D 65  ? 0.902 0.591 0.569 -0.045 -0.029 0.136  63  SER FFF CB  
4529 O OG  . SER D 65  ? 0.825 0.543 0.536 -0.052 -0.033 0.123  63  SER FFF OG  
4530 N N   . THR D 66  ? 0.906 0.597 0.517 -0.041 -0.048 0.110  64  THR FFF N   
4531 C CA  . THR D 66  ? 0.903 0.605 0.516 -0.041 -0.070 0.096  64  THR FFF CA  
4532 C C   . THR D 66  ? 0.981 0.664 0.549 -0.035 -0.071 0.092  64  THR FFF C   
4533 O O   . THR D 66  ? 1.012 0.694 0.573 -0.033 -0.093 0.084  64  THR FFF O   
4534 C CB  . THR D 66  ? 0.833 0.568 0.494 -0.049 -0.069 0.087  64  THR FFF CB  
4535 O OG1 . THR D 66  ? 0.817 0.557 0.483 -0.050 -0.051 0.085  64  THR FFF OG1 
4536 C CG2 . THR D 66  ? 0.803 0.552 0.503 -0.053 -0.069 0.089  64  THR FFF CG2 
4537 N N   . LYS D 67  ? 0.980 0.648 0.523 -0.031 -0.049 0.098  65  LYS FFF N   
4538 C CA  . LYS D 67  ? 1.036 0.681 0.530 -0.023 -0.048 0.094  65  LYS FFF CA  
4539 C C   . LYS D 67  ? 1.050 0.668 0.500 -0.015 -0.074 0.092  65  LYS FFF C   
4540 O O   . LYS D 67  ? 1.018 0.619 0.452 -0.011 -0.078 0.101  65  LYS FFF O   
4541 C CB  . LYS D 67  ? 1.113 0.736 0.577 -0.017 -0.017 0.106  65  LYS FFF CB  
4542 C CG  . LYS D 67  ? 1.120 0.762 0.615 -0.023 0.005  0.104  65  LYS FFF CG  
4543 C CD  . LYS D 67  ? 1.195 0.822 0.682 -0.019 0.040  0.119  65  LYS FFF CD  
4544 C CE  . LYS D 67  ? 1.197 0.850 0.734 -0.026 0.058  0.117  65  LYS FFF CE  
4545 N NZ  . LYS D 67  ? 1.262 0.904 0.808 -0.024 0.092  0.133  65  LYS FFF NZ  
4546 N N   . GLY D 68  ? 1.053 0.666 0.487 -0.012 -0.092 0.080  66  GLY FFF N   
4547 C CA  . GLY D 68  ? 1.080 0.665 0.473 -0.003 -0.121 0.075  66  GLY FFF CA  
4548 C C   . GLY D 68  ? 1.028 0.631 0.462 -0.008 -0.149 0.068  66  GLY FFF C   
4549 O O   . GLY D 68  ? 1.059 0.663 0.498 -0.007 -0.172 0.057  66  GLY FFF O   
4550 N N   . ARG D 69  ? 0.954 0.573 0.420 -0.014 -0.147 0.076  67  ARG FFF N   
4551 C CA  . ARG D 69  ? 0.890 0.523 0.395 -0.018 -0.171 0.073  67  ARG FFF CA  
4552 C C   . ARG D 69  ? 0.831 0.500 0.392 -0.027 -0.171 0.063  67  ARG FFF C   
4553 O O   . ARG D 69  ? 0.792 0.469 0.379 -0.027 -0.194 0.057  67  ARG FFF O   
4554 C CB  . ARG D 69  ? 0.886 0.523 0.406 -0.020 -0.164 0.084  67  ARG FFF CB  
4555 C CG  . ARG D 69  ? 0.951 0.551 0.418 -0.011 -0.163 0.095  67  ARG FFF CG  
4556 C CD  . ARG D 69  ? 0.957 0.562 0.446 -0.014 -0.162 0.106  67  ARG FFF CD  
4557 N NE  . ARG D 69  ? 0.911 0.543 0.442 -0.023 -0.138 0.110  67  ARG FFF NE  
4558 C CZ  . ARG D 69  ? 0.849 0.507 0.431 -0.030 -0.141 0.108  67  ARG FFF CZ  
4559 N NH1 . ARG D 69  ? 0.823 0.487 0.425 -0.030 -0.164 0.104  67  ARG FFF NH1 
4560 N NH2 . ARG D 69  ? 0.808 0.485 0.422 -0.036 -0.121 0.111  67  ARG FFF NH2 
4561 N N   . PHE D 70  ? 0.774 0.465 0.356 -0.032 -0.147 0.064  68  PHE FFF N   
4562 C CA  . PHE D 70  ? 0.732 0.455 0.362 -0.039 -0.145 0.057  68  PHE FFF CA  
4563 C C   . PHE D 70  ? 0.738 0.462 0.357 -0.038 -0.139 0.049  68  PHE FFF C   
4564 O O   . PHE D 70  ? 0.764 0.472 0.348 -0.036 -0.124 0.052  68  PHE FFF O   
4565 C CB  . PHE D 70  ? 0.694 0.438 0.355 -0.045 -0.127 0.061  68  PHE FFF CB  
4566 C CG  . PHE D 70  ? 0.687 0.434 0.367 -0.046 -0.132 0.067  68  PHE FFF CG  
4567 C CD1 . PHE D 70  ? 0.724 0.453 0.389 -0.042 -0.150 0.070  68  PHE FFF CD1 
4568 C CD2 . PHE D 70  ? 0.676 0.441 0.387 -0.050 -0.120 0.068  68  PHE FFF CD2 
4569 C CE1 . PHE D 70  ? 0.722 0.454 0.406 -0.043 -0.154 0.076  68  PHE FFF CE1 
4570 C CE2 . PHE D 70  ? 0.675 0.441 0.403 -0.050 -0.125 0.073  68  PHE FFF CE2 
4571 C CZ  . PHE D 70  ? 0.677 0.428 0.392 -0.047 -0.141 0.078  68  PHE FFF CZ  
4572 N N   . THR D 71  ? 0.705 0.446 0.355 -0.041 -0.148 0.041  69  THR FFF N   
4573 C CA  A THR D 71  ? 0.699 0.445 0.348 -0.041 -0.143 0.033  69  THR FFF CA  
4574 C CA  B THR D 71  ? 0.691 0.437 0.340 -0.041 -0.143 0.033  69  THR FFF CA  
4575 C C   . THR D 71  ? 0.627 0.404 0.324 -0.046 -0.135 0.030  69  THR FFF C   
4576 O O   . THR D 71  ? 0.611 0.399 0.340 -0.047 -0.146 0.030  69  THR FFF O   
4577 C CB  A THR D 71  ? 0.730 0.458 0.362 -0.036 -0.166 0.025  69  THR FFF CB  
4578 C CB  B THR D 71  ? 0.711 0.440 0.345 -0.036 -0.166 0.025  69  THR FFF CB  
4579 O OG1 A THR D 71  ? 0.730 0.464 0.395 -0.037 -0.187 0.024  69  THR FFF OG1 
4580 O OG1 B THR D 71  ? 0.769 0.465 0.354 -0.029 -0.176 0.028  69  THR FFF OG1 
4581 C CG2 A THR D 71  ? 0.796 0.488 0.369 -0.028 -0.172 0.027  69  THR FFF CG2 
4582 C CG2 B THR D 71  ? 0.707 0.438 0.337 -0.036 -0.160 0.017  69  THR FFF CG2 
4583 N N   . ILE D 72  ? 0.615 0.403 0.315 -0.048 -0.116 0.029  70  ILE FFF N   
4584 C CA  . ILE D 72  ? 0.568 0.382 0.305 -0.051 -0.108 0.026  70  ILE FFF CA  
4585 C C   . ILE D 72  ? 0.587 0.403 0.326 -0.050 -0.110 0.019  70  ILE FFF C   
4586 O O   . ILE D 72  ? 0.630 0.430 0.338 -0.049 -0.108 0.017  70  ILE FFF O   
4587 C CB  . ILE D 72  ? 0.541 0.366 0.285 -0.054 -0.089 0.029  70  ILE FFF CB  
4588 C CG1 . ILE D 72  ? 0.501 0.349 0.281 -0.054 -0.086 0.026  70  ILE FFF CG1 
4589 C CG2 . ILE D 72  ? 0.541 0.359 0.265 -0.054 -0.075 0.029  70  ILE FFF CG2 
4590 C CD1 . ILE D 72  ? 0.493 0.350 0.282 -0.055 -0.073 0.028  70  ILE FFF CD1 
4591 N N   . SER D 73  ? 0.564 0.397 0.337 -0.051 -0.112 0.016  71  SER FFF N   
4592 C CA  . SER D 73  ? 0.556 0.394 0.340 -0.050 -0.113 0.010  71  SER FFF CA  
4593 C C   . SER D 73  ? 0.538 0.399 0.358 -0.050 -0.103 0.011  71  SER FFF C   
4594 O O   . SER D 73  ? 0.512 0.381 0.348 -0.049 -0.101 0.016  71  SER FFF O   
4595 C CB  . SER D 73  ? 0.580 0.406 0.367 -0.048 -0.134 0.006  71  SER FFF CB  
4596 O OG  . SER D 73  ? 0.587 0.418 0.404 -0.048 -0.145 0.009  71  SER FFF OG  
4597 N N   . SER D 74  ? 0.505 0.373 0.331 -0.050 -0.095 0.007  72  SER FFF N   
4598 C CA  . SER D 74  ? 0.484 0.370 0.339 -0.048 -0.085 0.009  72  SER FFF CA  
4599 C C   . SER D 74  ? 0.454 0.343 0.334 -0.047 -0.091 0.006  72  SER FFF C   
4600 O O   . SER D 74  ? 0.485 0.363 0.353 -0.048 -0.100 0.001  72  SER FFF O   
4601 C CB  . SER D 74  ? 0.503 0.396 0.350 -0.049 -0.070 0.008  72  SER FFF CB  
4602 O OG  . SER D 74  ? 0.531 0.438 0.400 -0.045 -0.061 0.009  72  SER FFF OG  
4603 N N   . ASN D 75  ? 0.407 0.308 0.320 -0.043 -0.086 0.010  73  ASN FFF N   
4604 C CA  . ASN D 75  ? 0.393 0.301 0.338 -0.041 -0.084 0.010  73  ASN FFF CA  
4605 C C   . ASN D 75  ? 0.360 0.279 0.309 -0.037 -0.065 0.014  73  ASN FFF C   
4606 O O   . ASN D 75  ? 0.341 0.266 0.305 -0.031 -0.057 0.020  73  ASN FFF O   
4607 C CB  . ASN D 75  ? 0.418 0.326 0.400 -0.039 -0.093 0.014  73  ASN FFF CB  
4608 C CG  . ASN D 75  ? 0.448 0.363 0.470 -0.037 -0.092 0.015  73  ASN FFF CG  
4609 O OD1 . ASN D 75  ? 0.451 0.374 0.480 -0.034 -0.076 0.017  73  ASN FFF OD1 
4610 N ND2 . ASN D 75  ? 0.500 0.408 0.551 -0.038 -0.109 0.013  73  ASN FFF ND2 
4611 N N   . ASN D 76  ? 0.343 0.264 0.277 -0.039 -0.059 0.010  74  ASN FFF N   
4612 C CA  . ASN D 76  ? 0.322 0.252 0.256 -0.034 -0.043 0.012  74  ASN FFF CA  
4613 C C   . ASN D 76  ? 0.314 0.252 0.281 -0.027 -0.035 0.019  74  ASN FFF C   
4614 O O   . ASN D 76  ? 0.314 0.254 0.278 -0.020 -0.024 0.024  74  ASN FFF O   
4615 C CB  . ASN D 76  ? 0.320 0.251 0.240 -0.037 -0.039 0.007  74  ASN FFF CB  
4616 C CG  . ASN D 76  ? 0.325 0.251 0.217 -0.042 -0.039 0.003  74  ASN FFF CG  
4617 O OD1 . ASN D 76  ? 0.329 0.249 0.209 -0.043 -0.044 0.005  74  ASN FFF OD1 
4618 N ND2 . ASN D 76  ? 0.327 0.252 0.209 -0.044 -0.034 -0.000 74  ASN FFF ND2 
4619 N N   . ALA D 77  ? 0.309 0.247 0.303 -0.028 -0.040 0.019  75  ALA FFF N   
4620 C CA  . ALA D 77  ? 0.321 0.265 0.353 -0.022 -0.029 0.027  75  ALA FFF CA  
4621 C C   . ALA D 77  ? 0.326 0.270 0.371 -0.015 -0.022 0.036  75  ALA FFF C   
4622 O O   . ALA D 77  ? 0.332 0.280 0.391 -0.005 -0.005 0.044  75  ALA FFF O   
4623 C CB  . ALA D 77  ? 0.321 0.264 0.387 -0.026 -0.040 0.024  75  ALA FFF CB  
4624 N N   . MET D 78  ? 0.350 0.290 0.390 -0.018 -0.034 0.034  76  MET FFF N   
4625 C CA  A MET D 78  ? 0.364 0.303 0.420 -0.012 -0.029 0.042  76  MET FFF CA  
4626 C CA  B MET D 78  ? 0.364 0.303 0.419 -0.012 -0.029 0.042  76  MET FFF CA  
4627 C C   . MET D 78  ? 0.360 0.296 0.378 -0.008 -0.024 0.042  76  MET FFF C   
4628 O O   . MET D 78  ? 0.344 0.277 0.368 -0.002 -0.019 0.047  76  MET FFF O   
4629 C CB  A MET D 78  ? 0.403 0.338 0.481 -0.017 -0.047 0.041  76  MET FFF CB  
4630 C CB  B MET D 78  ? 0.403 0.337 0.479 -0.017 -0.048 0.041  76  MET FFF CB  
4631 C CG  A MET D 78  ? 0.425 0.362 0.546 -0.020 -0.055 0.041  76  MET FFF CG  
4632 C CG  B MET D 78  ? 0.427 0.364 0.558 -0.016 -0.050 0.045  76  MET FFF CG  
4633 S SD  A MET D 78  ? 0.480 0.424 0.659 -0.009 -0.033 0.055  76  MET FFF SD  
4634 S SD  B MET D 78  ? 0.478 0.406 0.629 -0.025 -0.082 0.037  76  MET FFF SD  
4635 C CE  A MET D 78  ? 0.469 0.409 0.678 -0.009 -0.043 0.060  76  MET FFF CE  
4636 C CE  B MET D 78  ? 0.478 0.400 0.605 -0.026 -0.090 0.038  76  MET FFF CE  
4637 N N   . ASN D 79  ? 0.345 0.280 0.330 -0.011 -0.025 0.035  77  ASN FFF N   
4638 C CA  . ASN D 79  ? 0.355 0.287 0.310 -0.008 -0.023 0.033  77  ASN FFF CA  
4639 C C   . ASN D 79  ? 0.364 0.291 0.313 -0.011 -0.033 0.033  77  ASN FFF C   
4640 O O   . ASN D 79  ? 0.348 0.271 0.284 -0.005 -0.030 0.034  77  ASN FFF O   
4641 C CB  . ASN D 79  ? 0.381 0.311 0.334 0.006  -0.007 0.039  77  ASN FFF CB  
4642 C CG  . ASN D 79  ? 0.410 0.339 0.338 0.010  -0.003 0.035  77  ASN FFF CG  
4643 O OD1 . ASN D 79  ? 0.395 0.329 0.323 0.005  -0.003 0.032  77  ASN FFF OD1 
4644 N ND2 . ASN D 79  ? 0.450 0.373 0.357 0.020  -0.000 0.035  77  ASN FFF ND2 
4645 N N   . THR D 80  ? 0.365 0.290 0.320 -0.020 -0.047 0.030  78  THR FFF N   
4646 C CA  . THR D 80  ? 0.381 0.300 0.335 -0.023 -0.058 0.031  78  THR FFF CA  
4647 C C   . THR D 80  ? 0.395 0.307 0.323 -0.032 -0.070 0.025  78  THR FFF C   
4648 O O   . THR D 80  ? 0.410 0.319 0.333 -0.036 -0.074 0.021  78  THR FFF O   
4649 C CB  . THR D 80  ? 0.386 0.304 0.375 -0.022 -0.064 0.036  78  THR FFF CB  
4650 O OG1 . THR D 80  ? 0.387 0.311 0.403 -0.012 -0.048 0.043  78  THR FFF OG1 
4651 C CG2 . THR D 80  ? 0.402 0.314 0.392 -0.023 -0.075 0.037  78  THR FFF CG2 
4652 N N   . VAL D 81  ? 0.402 0.309 0.314 -0.033 -0.073 0.026  79  VAL FFF N   
4653 C CA  A VAL D 81  ? 0.421 0.318 0.309 -0.040 -0.083 0.023  79  VAL FFF CA  
4654 C CA  B VAL D 81  ? 0.418 0.314 0.305 -0.040 -0.083 0.023  79  VAL FFF CA  
4655 C C   . VAL D 81  ? 0.454 0.343 0.346 -0.040 -0.095 0.026  79  VAL FFF C   
4656 O O   . VAL D 81  ? 0.430 0.323 0.342 -0.036 -0.093 0.030  79  VAL FFF O   
4657 C CB  A VAL D 81  ? 0.438 0.335 0.305 -0.041 -0.076 0.021  79  VAL FFF CB  
4658 C CB  B VAL D 81  ? 0.431 0.327 0.298 -0.041 -0.075 0.021  79  VAL FFF CB  
4659 C CG1 A VAL D 81  ? 0.440 0.342 0.304 -0.041 -0.066 0.018  79  VAL FFF CG1 
4660 C CG1 B VAL D 81  ? 0.430 0.328 0.300 -0.037 -0.074 0.024  79  VAL FFF CG1 
4661 C CG2 A VAL D 81  ? 0.435 0.333 0.305 -0.037 -0.073 0.023  79  VAL FFF CG2 
4662 C CG2 B VAL D 81  ? 0.446 0.332 0.289 -0.047 -0.079 0.021  79  VAL FFF CG2 
4663 N N   . TYR D 82  ? 0.470 0.347 0.345 -0.044 -0.107 0.025  80  TYR FFF N   
4664 C CA  . TYR D 82  ? 0.509 0.377 0.388 -0.045 -0.122 0.027  80  TYR FFF CA  
4665 C C   . TYR D 82  ? 0.518 0.372 0.363 -0.047 -0.125 0.028  80  TYR FFF C   
4666 O O   . TYR D 82  ? 0.519 0.367 0.337 -0.049 -0.120 0.026  80  TYR FFF O   
4667 C CB  . TYR D 82  ? 0.542 0.403 0.433 -0.045 -0.139 0.025  80  TYR FFF CB  
4668 C CG  . TYR D 82  ? 0.537 0.410 0.465 -0.042 -0.134 0.024  80  TYR FFF CG  
4669 C CD1 . TYR D 82  ? 0.550 0.427 0.475 -0.043 -0.127 0.020  80  TYR FFF CD1 
4670 C CD2 . TYR D 82  ? 0.558 0.438 0.527 -0.039 -0.136 0.029  80  TYR FFF CD2 
4671 C CE1 . TYR D 82  ? 0.567 0.455 0.529 -0.040 -0.122 0.021  80  TYR FFF CE1 
4672 C CE2 . TYR D 82  ? 0.561 0.450 0.567 -0.036 -0.129 0.031  80  TYR FFF CE2 
4673 C CZ  . TYR D 82  ? 0.594 0.488 0.597 -0.037 -0.122 0.027  80  TYR FFF CZ  
4674 O OH  . TYR D 82  ? 0.601 0.504 0.642 -0.034 -0.114 0.030  80  TYR FFF OH  
4675 N N   . LEU D 83  ? 0.510 0.360 0.357 -0.047 -0.131 0.033  81  LEU FFF N   
4676 C CA  . LEU D 83  ? 0.527 0.360 0.343 -0.049 -0.136 0.036  81  LEU FFF CA  
4677 C C   . LEU D 83  ? 0.531 0.351 0.348 -0.047 -0.156 0.037  81  LEU FFF C   
4678 O O   . LEU D 83  ? 0.497 0.323 0.340 -0.046 -0.161 0.041  81  LEU FFF O   
4679 C CB  . LEU D 83  ? 0.521 0.359 0.339 -0.049 -0.125 0.040  81  LEU FFF CB  
4680 C CG  . LEU D 83  ? 0.562 0.384 0.351 -0.051 -0.125 0.044  81  LEU FFF CG  
4681 C CD1 . LEU D 83  ? 0.583 0.397 0.345 -0.052 -0.115 0.043  81  LEU FFF CD1 
4682 C CD2 . LEU D 83  ? 0.553 0.380 0.352 -0.052 -0.117 0.048  81  LEU FFF CD2 
4683 N N   . GLN D 84  ? 0.574 0.376 0.364 -0.046 -0.168 0.035  82  GLN FFF N   
4684 C CA  . GLN D 84  ? 0.614 0.397 0.396 -0.043 -0.191 0.035  82  GLN FFF CA  
4685 C C   . GLN D 84  ? 0.643 0.410 0.391 -0.043 -0.190 0.042  82  GLN FFF C   
4686 O O   . GLN D 84  ? 0.641 0.395 0.350 -0.042 -0.180 0.044  82  GLN FFF O   
4687 C CB  . GLN D 84  ? 0.664 0.431 0.426 -0.041 -0.207 0.028  82  GLN FFF CB  
4688 C CG  . GLN D 84  ? 0.738 0.483 0.492 -0.036 -0.236 0.027  82  GLN FFF CG  
4689 C CD  . GLN D 84  ? 0.751 0.510 0.560 -0.037 -0.248 0.029  82  GLN FFF CD  
4690 O OE1 . GLN D 84  ? 0.748 0.529 0.601 -0.040 -0.238 0.028  82  GLN FFF OE1 
4691 N NE2 . GLN D 84  ? 0.797 0.540 0.602 -0.035 -0.267 0.032  82  GLN FFF NE2 
4692 N N   . MET D 85  ? 0.638 0.406 0.405 -0.042 -0.198 0.047  83  MET FFF N   
4693 C CA  A MET D 85  ? 0.670 0.425 0.412 -0.042 -0.196 0.055  83  MET FFF CA  
4694 C CA  B MET D 85  ? 0.658 0.413 0.402 -0.042 -0.196 0.055  83  MET FFF CA  
4695 C C   . MET D 85  ? 0.700 0.431 0.426 -0.037 -0.221 0.056  83  MET FFF C   
4696 O O   . MET D 85  ? 0.685 0.422 0.446 -0.037 -0.235 0.057  83  MET FFF O   
4697 C CB  A MET D 85  ? 0.659 0.431 0.432 -0.044 -0.185 0.059  83  MET FFF CB  
4698 C CB  B MET D 85  ? 0.631 0.403 0.407 -0.044 -0.186 0.059  83  MET FFF CB  
4699 C CG  A MET D 85  ? 0.642 0.433 0.427 -0.047 -0.164 0.057  83  MET FFF CG  
4700 C CG  B MET D 85  ? 0.595 0.389 0.389 -0.047 -0.165 0.056  83  MET FFF CG  
4701 S SD  A MET D 85  ? 0.644 0.445 0.448 -0.049 -0.152 0.061  83  MET FFF SD  
4702 S SD  B MET D 85  ? 0.559 0.371 0.391 -0.047 -0.158 0.058  83  MET FFF SD  
4703 C CE  A MET D 85  ? 0.622 0.431 0.464 -0.046 -0.164 0.061  83  MET FFF CE  
4704 C CE  B MET D 85  ? 0.572 0.370 0.388 -0.048 -0.159 0.066  83  MET FFF CE  
4705 N N   . ASN D 86  ? 0.744 0.448 0.420 -0.032 -0.227 0.057  84  ASN FFF N   
4706 C CA  . ASN D 86  ? 0.804 0.480 0.453 -0.025 -0.254 0.058  84  ASN FFF CA  
4707 C C   . ASN D 86  ? 0.823 0.480 0.439 -0.022 -0.247 0.069  84  ASN FFF C   
4708 O O   . ASN D 86  ? 0.797 0.460 0.404 -0.025 -0.221 0.075  84  ASN FFF O   
4709 C CB  . ASN D 86  ? 0.870 0.521 0.477 -0.019 -0.267 0.050  84  ASN FFF CB  
4710 C CG  . ASN D 86  ? 0.895 0.560 0.538 -0.021 -0.278 0.039  84  ASN FFF CG  
4711 O OD1 . ASN D 86  ? 0.887 0.575 0.586 -0.025 -0.284 0.038  84  ASN FFF OD1 
4712 N ND2 . ASN D 86  ? 0.918 0.569 0.530 -0.018 -0.280 0.032  84  ASN FFF ND2 
4713 N N   . SER D 87  ? 0.853 0.489 0.456 -0.017 -0.271 0.072  85  SER FFF N   
4714 C CA  . SER D 87  ? 0.910 0.521 0.473 -0.012 -0.268 0.084  85  SER FFF CA  
4715 C C   . SER D 87  ? 0.872 0.505 0.464 -0.019 -0.244 0.092  85  SER FFF C   
4716 O O   . SER D 87  ? 0.873 0.495 0.436 -0.017 -0.223 0.102  85  SER FFF O   
4717 C CB  . SER D 87  ? 0.971 0.551 0.466 -0.003 -0.259 0.086  85  SER FFF CB  
4718 O OG  . SER D 87  ? 0.996 0.555 0.465 0.004  -0.285 0.076  85  SER FFF OG  
4719 N N   . LEU D 88  ? 0.819 0.479 0.468 -0.025 -0.246 0.089  86  LEU FFF N   
4720 C CA  . LEU D 88  ? 0.775 0.458 0.458 -0.031 -0.226 0.094  86  LEU FFF CA  
4721 C C   . LEU D 88  ? 0.791 0.457 0.459 -0.028 -0.228 0.106  86  LEU FFF C   
4722 O O   . LEU D 88  ? 0.827 0.472 0.480 -0.023 -0.250 0.108  86  LEU FFF O   
4723 C CB  . LEU D 88  ? 0.729 0.439 0.468 -0.035 -0.230 0.088  86  LEU FFF CB  
4724 C CG  . LEU D 88  ? 0.695 0.427 0.453 -0.038 -0.218 0.079  86  LEU FFF CG  
4725 C CD1 . LEU D 88  ? 0.661 0.413 0.469 -0.039 -0.225 0.074  86  LEU FFF CD1 
4726 C CD2 . LEU D 88  ? 0.673 0.417 0.429 -0.042 -0.193 0.081  86  LEU FFF CD2 
4727 N N   . LYS D 89  ? 0.784 0.457 0.459 -0.032 -0.206 0.112  87  LYS FFF N   
4728 C CA  . LYS D 89  ? 0.831 0.490 0.497 -0.030 -0.201 0.124  87  LYS FFF CA  
4729 C C   . LYS D 89  ? 0.769 0.452 0.486 -0.036 -0.194 0.123  87  LYS FFF C   
4730 O O   . LYS D 89  ? 0.720 0.427 0.467 -0.041 -0.186 0.115  87  LYS FFF O   
4731 C CB  . LYS D 89  ? 0.888 0.530 0.517 -0.028 -0.179 0.134  87  LYS FFF CB  
4732 C CG  . LYS D 89  ? 0.972 0.589 0.546 -0.021 -0.182 0.132  87  LYS FFF CG  
4733 C CD  . LYS D 89  ? 1.027 0.630 0.568 -0.018 -0.154 0.141  87  LYS FFF CD  
4734 C CE  . LYS D 89  ? 1.148 0.709 0.627 -0.006 -0.155 0.153  87  LYS FFF CE  
4735 N NZ  . LYS D 89  ? 1.195 0.737 0.632 -0.000 -0.131 0.158  87  LYS FFF NZ  
4736 N N   . PRO D 90  ? 0.770 0.447 0.498 -0.036 -0.199 0.131  88  PRO FFF N   
4737 C CA  . PRO D 90  ? 0.721 0.417 0.493 -0.040 -0.192 0.130  88  PRO FFF CA  
4738 C C   . PRO D 90  ? 0.685 0.396 0.471 -0.045 -0.170 0.127  88  PRO FFF C   
4739 O O   . PRO D 90  ? 0.637 0.368 0.457 -0.047 -0.167 0.119  88  PRO FFF O   
4740 C CB  . PRO D 90  ? 0.751 0.430 0.519 -0.038 -0.197 0.142  88  PRO FFF CB  
4741 C CG  . PRO D 90  ? 0.791 0.446 0.521 -0.031 -0.216 0.146  88  PRO FFF CG  
4742 C CD  . PRO D 90  ? 0.810 0.458 0.504 -0.029 -0.211 0.142  88  PRO FFF CD  
4743 N N   . GLU D 91  ? 0.706 0.404 0.464 -0.044 -0.155 0.134  89  GLU FFF N   
4744 C CA  . GLU D 91  ? 0.713 0.422 0.486 -0.048 -0.134 0.134  89  GLU FFF CA  
4745 C C   . GLU D 91  ? 0.668 0.396 0.451 -0.051 -0.132 0.120  89  GLU FFF C   
4746 O O   . GLU D 91  ? 0.638 0.378 0.442 -0.054 -0.119 0.117  89  GLU FFF O   
4747 C CB  . GLU D 91  ? 0.773 0.460 0.514 -0.046 -0.117 0.146  89  GLU FFF CB  
4748 C CG  . GLU D 91  ? 0.864 0.531 0.595 -0.043 -0.115 0.161  89  GLU FFF CG  
4749 C CD  . GLU D 91  ? 0.928 0.568 0.612 -0.035 -0.129 0.168  89  GLU FFF CD  
4750 O OE1 . GLU D 91  ? 0.932 0.571 0.601 -0.033 -0.147 0.159  89  GLU FFF OE1 
4751 O OE2 . GLU D 91  ? 1.017 0.633 0.679 -0.030 -0.122 0.183  89  GLU FFF OE2 
4752 N N   . ASP D 92  ? 0.658 0.389 0.430 -0.049 -0.145 0.113  90  ASP FFF N   
4753 C CA  . ASP D 92  ? 0.626 0.375 0.410 -0.050 -0.143 0.102  90  ASP FFF CA  
4754 C C   . ASP D 92  ? 0.581 0.349 0.402 -0.051 -0.148 0.094  90  ASP FFF C   
4755 O O   . ASP D 92  ? 0.572 0.355 0.404 -0.051 -0.144 0.085  90  ASP FFF O   
4756 C CB  . ASP D 92  ? 0.649 0.391 0.409 -0.048 -0.155 0.098  90  ASP FFF CB  
4757 C CG  . ASP D 92  ? 0.693 0.414 0.409 -0.045 -0.149 0.103  90  ASP FFF CG  
4758 O OD1 . ASP D 92  ? 0.700 0.422 0.411 -0.047 -0.129 0.106  90  ASP FFF OD1 
4759 O OD2 . ASP D 92  ? 0.758 0.461 0.446 -0.040 -0.163 0.105  90  ASP FFF OD2 
4760 N N   . THR D 93  ? 0.554 0.320 0.393 -0.050 -0.155 0.097  91  THR FFF N   
4761 C CA  . THR D 93  ? 0.526 0.306 0.398 -0.048 -0.157 0.091  91  THR FFF CA  
4762 C C   . THR D 93  ? 0.497 0.288 0.381 -0.050 -0.145 0.084  91  THR FFF C   
4763 O O   . THR D 93  ? 0.498 0.284 0.384 -0.052 -0.138 0.088  91  THR FFF O   
4764 C CB  . THR D 93  ? 0.527 0.301 0.413 -0.047 -0.165 0.096  91  THR FFF CB  
4765 O OG1 . THR D 93  ? 0.553 0.317 0.429 -0.045 -0.179 0.101  91  THR FFF OG1 
4766 C CG2 . THR D 93  ? 0.502 0.287 0.418 -0.044 -0.165 0.089  91  THR FFF CG2 
4767 N N   . ALA D 94  ? 0.472 0.276 0.367 -0.047 -0.143 0.075  92  ALA FFF N   
4768 C CA  . ALA D 94  ? 0.459 0.271 0.361 -0.046 -0.135 0.067  92  ALA FFF CA  
4769 C C   . ALA D 94  ? 0.437 0.260 0.346 -0.040 -0.134 0.058  92  ALA FFF C   
4770 O O   . ALA D 94  ? 0.442 0.267 0.349 -0.038 -0.137 0.060  92  ALA FFF O   
4771 C CB  . ALA D 94  ? 0.461 0.272 0.349 -0.051 -0.126 0.069  92  ALA FFF CB  
4772 N N   . VAL D 95  ? 0.427 0.254 0.341 -0.037 -0.130 0.050  93  VAL FFF N   
4773 C CA  . VAL D 95  ? 0.431 0.266 0.343 -0.030 -0.126 0.043  93  VAL FFF CA  
4774 C C   . VAL D 95  ? 0.427 0.267 0.327 -0.035 -0.120 0.042  93  VAL FFF C   
4775 O O   . VAL D 95  ? 0.420 0.258 0.320 -0.040 -0.118 0.042  93  VAL FFF O   
4776 C CB  . VAL D 95  ? 0.437 0.270 0.354 -0.022 -0.126 0.033  93  VAL FFF CB  
4777 C CG1 . VAL D 95  ? 0.441 0.279 0.350 -0.014 -0.120 0.028  93  VAL FFF CG1 
4778 C CG2 . VAL D 95  ? 0.455 0.281 0.383 -0.017 -0.131 0.033  93  VAL FFF CG2 
4779 N N   . TYR D 96  ? 0.412 0.257 0.306 -0.034 -0.118 0.043  94  TYR FFF N   
4780 C CA  . TYR D 96  ? 0.421 0.271 0.304 -0.037 -0.112 0.041  94  TYR FFF CA  
4781 C C   . TYR D 96  ? 0.422 0.279 0.307 -0.031 -0.107 0.034  94  TYR FFF C   
4782 O O   . TYR D 96  ? 0.437 0.295 0.328 -0.023 -0.105 0.033  94  TYR FFF O   
4783 C CB  . TYR D 96  ? 0.411 0.260 0.288 -0.041 -0.116 0.046  94  TYR FFF CB  
4784 C CG  . TYR D 96  ? 0.433 0.270 0.297 -0.046 -0.121 0.053  94  TYR FFF CG  
4785 C CD1 . TYR D 96  ? 0.433 0.263 0.304 -0.045 -0.128 0.058  94  TYR FFF CD1 
4786 C CD2 . TYR D 96  ? 0.441 0.272 0.285 -0.050 -0.118 0.055  94  TYR FFF CD2 
4787 C CE1 . TYR D 96  ? 0.458 0.275 0.313 -0.049 -0.133 0.065  94  TYR FFF CE1 
4788 C CE2 . TYR D 96  ? 0.465 0.281 0.291 -0.052 -0.121 0.063  94  TYR FFF CE2 
4789 C CZ  . TYR D 96  ? 0.473 0.282 0.305 -0.052 -0.128 0.068  94  TYR FFF CZ  
4790 O OH  . TYR D 96  ? 0.509 0.301 0.320 -0.053 -0.131 0.076  94  TYR FFF OH  
4791 N N   . PHE D 97  ? 0.418 0.278 0.300 -0.032 -0.103 0.030  95  PHE FFF N   
4792 C CA  . PHE D 97  ? 0.408 0.272 0.287 -0.025 -0.099 0.023  95  PHE FFF CA  
4793 C C   . PHE D 97  ? 0.405 0.276 0.278 -0.029 -0.093 0.023  95  PHE FFF C   
4794 O O   . PHE D 97  ? 0.405 0.276 0.276 -0.037 -0.091 0.025  95  PHE FFF O   
4795 C CB  . PHE D 97  ? 0.407 0.268 0.291 -0.023 -0.103 0.016  95  PHE FFF CB  
4796 C CG  . PHE D 97  ? 0.419 0.271 0.311 -0.020 -0.110 0.014  95  PHE FFF CG  
4797 C CD1 . PHE D 97  ? 0.432 0.281 0.334 -0.028 -0.114 0.019  95  PHE FFF CD1 
4798 C CD2 . PHE D 97  ? 0.440 0.286 0.327 -0.007 -0.113 0.008  95  PHE FFF CD2 
4799 C CE1 . PHE D 97  ? 0.439 0.280 0.350 -0.025 -0.121 0.017  95  PHE FFF CE1 
4800 C CE2 . PHE D 97  ? 0.446 0.283 0.339 -0.004 -0.121 0.005  95  PHE FFF CE2 
4801 C CZ  . PHE D 97  ? 0.449 0.285 0.357 -0.013 -0.125 0.009  95  PHE FFF CZ  
4802 N N   . CYS D 98  ? 0.392 0.267 0.263 -0.023 -0.088 0.022  96  CYS FFF N   
4803 C CA  . CYS D 98  ? 0.392 0.274 0.259 -0.024 -0.082 0.020  96  CYS FFF CA  
4804 C C   . CYS D 98  ? 0.388 0.270 0.254 -0.021 -0.082 0.013  96  CYS FFF C   
4805 O O   . CYS D 98  ? 0.393 0.269 0.257 -0.013 -0.086 0.009  96  CYS FFF O   
4806 C CB  . CYS D 98  ? 0.395 0.281 0.265 -0.017 -0.076 0.022  96  CYS FFF CB  
4807 S SG  . CYS D 98  ? 0.438 0.332 0.306 -0.020 -0.070 0.020  96  CYS FFF SG  
4808 N N   . ALA D 99  ? 0.377 0.262 0.242 -0.027 -0.079 0.012  97  ALA FFF N   
4809 C CA  . ALA D 99  ? 0.375 0.261 0.245 -0.025 -0.081 0.006  97  ALA FFF CA  
4810 C C   . ALA D 99  ? 0.359 0.251 0.226 -0.027 -0.075 0.005  97  ALA FFF C   
4811 O O   . ALA D 99  ? 0.369 0.264 0.235 -0.035 -0.069 0.009  97  ALA FFF O   
4812 C CB  . ALA D 99  ? 0.389 0.271 0.271 -0.031 -0.085 0.006  97  ALA FFF CB  
4813 N N   . LEU D 100 ? 0.355 0.247 0.220 -0.019 -0.076 -0.001 98  LEU FFF N   
4814 C CA  . LEU D 100 ? 0.349 0.248 0.214 -0.019 -0.070 -0.002 98  LEU FFF CA  
4815 C C   . LEU D 100 ? 0.346 0.244 0.221 -0.019 -0.076 -0.008 98  LEU FFF C   
4816 O O   . LEU D 100 ? 0.352 0.243 0.228 -0.010 -0.086 -0.014 98  LEU FFF O   
4817 C CB  . LEU D 100 ? 0.360 0.258 0.213 -0.007 -0.066 -0.002 98  LEU FFF CB  
4818 C CG  . LEU D 100 ? 0.358 0.261 0.209 -0.005 -0.061 -0.003 98  LEU FFF CG  
4819 C CD1 . LEU D 100 ? 0.353 0.265 0.211 -0.015 -0.053 0.001  98  LEU FFF CD1 
4820 C CD2 . LEU D 100 ? 0.377 0.277 0.217 0.009  -0.056 -0.002 98  LEU FFF CD2 
4821 N N   . GLY D 101 ? 0.331 0.236 0.217 -0.026 -0.069 -0.007 99  GLY FFF N   
4822 C CA  . GLY D 101 ? 0.331 0.236 0.234 -0.027 -0.074 -0.012 99  GLY FFF CA  
4823 C C   . GLY D 101 ? 0.335 0.241 0.230 -0.017 -0.076 -0.017 99  GLY FFF C   
4824 O O   . GLY D 101 ? 0.346 0.253 0.224 -0.012 -0.070 -0.014 99  GLY FFF O   
4825 N N   . VAL D 102 ? 0.341 0.246 0.252 -0.015 -0.085 -0.023 100 VAL FFF N   
4826 C CA  . VAL D 102 ? 0.347 0.252 0.254 -0.007 -0.087 -0.028 100 VAL FFF CA  
4827 C C   . VAL D 102 ? 0.342 0.256 0.271 -0.017 -0.079 -0.026 100 VAL FFF C   
4828 O O   . VAL D 102 ? 0.321 0.236 0.253 -0.012 -0.082 -0.029 100 VAL FFF O   
4829 C CB  . VAL D 102 ? 0.369 0.262 0.274 0.005  -0.107 -0.037 100 VAL FFF CB  
4830 C CG1 . VAL D 102 ? 0.385 0.266 0.260 0.018  -0.111 -0.038 100 VAL FFF CG1 
4831 C CG2 . VAL D 102 ? 0.368 0.258 0.306 0.000  -0.120 -0.042 100 VAL FFF CG2 
4832 N N   . THR D 103 ? 0.331 0.250 0.271 -0.029 -0.067 -0.020 101 THR FFF N   
4833 C CA  . THR D 103 ? 0.339 0.265 0.294 -0.037 -0.054 -0.017 101 THR FFF CA  
4834 C C   . THR D 103 ? 0.336 0.264 0.272 -0.043 -0.039 -0.010 101 THR FFF C   
4835 O O   . THR D 103 ? 0.341 0.266 0.259 -0.042 -0.041 -0.008 101 THR FFF O   
4836 C CB  . THR D 103 ? 0.343 0.268 0.333 -0.043 -0.054 -0.016 101 THR FFF CB  
4837 O OG1 . THR D 103 ? 0.354 0.277 0.344 -0.050 -0.045 -0.009 101 THR FFF OG1 
4838 C CG2 . THR D 103 ? 0.357 0.279 0.370 -0.037 -0.073 -0.024 101 THR FFF CG2 
4839 N N   . ALA D 104 ? 0.324 0.255 0.265 -0.049 -0.026 -0.007 102 ALA FFF N   
4840 C CA  . ALA D 104 ? 0.335 0.263 0.255 -0.053 -0.014 -0.003 102 ALA FFF CA  
4841 C C   . ALA D 104 ? 0.344 0.264 0.263 -0.059 -0.008 0.003  102 ALA FFF C   
4842 O O   . ALA D 104 ? 0.364 0.277 0.259 -0.061 -0.002 0.007  102 ALA FFF O   
4843 C CB  . ALA D 104 ? 0.326 0.257 0.250 -0.055 -0.004 -0.003 102 ALA FFF CB  
4844 N N   . ALA D 105 ? 0.348 0.267 0.292 -0.060 -0.009 0.005  103 ALA FFF N   
4845 C CA  . ALA D 105 ? 0.365 0.275 0.311 -0.065 0.002  0.013  103 ALA FFF CA  
4846 C C   . ALA D 105 ? 0.374 0.278 0.309 -0.065 -0.006 0.015  103 ALA FFF C   
4847 O O   . ALA D 105 ? 0.360 0.267 0.308 -0.062 -0.021 0.010  103 ALA FFF O   
4848 C CB  . ALA D 105 ? 0.373 0.284 0.360 -0.068 0.008  0.014  103 ALA FFF CB  
4849 N N   . CYS D 106 ? 0.406 0.300 0.314 -0.067 0.001  0.022  104 CYS FFF N   
4850 C CA  . CYS D 106 ? 0.424 0.310 0.321 -0.067 -0.005 0.026  104 CYS FFF CA  
4851 C C   . CYS D 106 ? 0.432 0.316 0.359 -0.069 -0.002 0.030  104 CYS FFF C   
4852 O O   . CYS D 106 ? 0.459 0.340 0.389 -0.069 -0.012 0.031  104 CYS FFF O   
4853 C CB  . CYS D 106 ? 0.458 0.332 0.319 -0.067 0.001  0.031  104 CYS FFF CB  
4854 S SG  . CYS D 106 ? 0.485 0.362 0.321 -0.064 -0.012 0.025  104 CYS FFF SG  
4855 N N   . SER D 107 ? 0.429 0.313 0.381 -0.072 0.011  0.034  105 SER FFF N   
4856 C CA  . SER D 107 ? 0.437 0.318 0.428 -0.074 0.017  0.039  105 SER FFF CA  
4857 C C   . SER D 107 ? 0.427 0.317 0.454 -0.073 -0.003 0.030  105 SER FFF C   
4858 O O   . SER D 107 ? 0.417 0.305 0.478 -0.075 -0.006 0.033  105 SER FFF O   
4859 C CB  . SER D 107 ? 0.448 0.325 0.457 -0.077 0.040  0.047  105 SER FFF CB  
4860 O OG  . SER D 107 ? 0.441 0.328 0.462 -0.076 0.039  0.040  105 SER FFF OG  
4861 N N   . ASP D 108 ? 0.411 0.309 0.431 -0.069 -0.018 0.019  106 ASP FFF N   
4862 C CA  . ASP D 108 ? 0.418 0.320 0.462 -0.065 -0.039 0.009  106 ASP FFF CA  
4863 C C   . ASP D 108 ? 0.438 0.335 0.465 -0.061 -0.053 0.006  106 ASP FFF C   
4864 O O   . ASP D 108 ? 0.458 0.353 0.452 -0.061 -0.049 0.010  106 ASP FFF O   
4865 C CB  . ASP D 108 ? 0.407 0.317 0.446 -0.060 -0.047 -0.000 106 ASP FFF CB  
4866 C CG  . ASP D 108 ? 0.410 0.325 0.479 -0.062 -0.038 0.000  106 ASP FFF CG  
4867 O OD1 . ASP D 108 ? 0.417 0.329 0.520 -0.068 -0.028 0.007  106 ASP FFF OD1 
4868 O OD2 . ASP D 108 ? 0.403 0.323 0.463 -0.059 -0.041 -0.005 106 ASP FFF OD2 
4869 N N   . ASN D 109 ? 0.460 0.355 0.510 -0.057 -0.072 -0.002 107 ASN FFF N   
4870 C CA  . ASN D 109 ? 0.486 0.375 0.522 -0.052 -0.086 -0.006 107 ASN FFF CA  
4871 C C   . ASN D 109 ? 0.455 0.345 0.452 -0.044 -0.092 -0.011 107 ASN FFF C   
4872 O O   . ASN D 109 ? 0.448 0.341 0.441 -0.039 -0.096 -0.017 107 ASN FFF O   
4873 C CB  . ASN D 109 ? 0.533 0.417 0.603 -0.049 -0.105 -0.014 107 ASN FFF CB  
4874 C CG  . ASN D 109 ? 0.586 0.471 0.707 -0.056 -0.099 -0.009 107 ASN FFF CG  
4875 O OD1 . ASN D 109 ? 0.650 0.533 0.776 -0.064 -0.081 0.004  107 ASN FFF OD1 
4876 N ND2 . ASN D 109 ? 0.624 0.508 0.783 -0.054 -0.114 -0.017 107 ASN FFF ND2 
4877 N N   . PRO D 110 ? 0.438 0.325 0.407 -0.041 -0.092 -0.009 108 PRO FFF N   
4878 C CA  . PRO D 110 ? 0.430 0.317 0.370 -0.032 -0.095 -0.013 108 PRO FFF CA  
4879 C C   . PRO D 110 ? 0.414 0.294 0.353 -0.020 -0.113 -0.024 108 PRO FFF C   
4880 O O   . PRO D 110 ? 0.420 0.293 0.378 -0.019 -0.126 -0.030 108 PRO FFF O   
4881 C CB  . PRO D 110 ? 0.464 0.349 0.386 -0.033 -0.092 -0.007 108 PRO FFF CB  
4882 C CG  . PRO D 110 ? 0.484 0.364 0.423 -0.040 -0.092 -0.002 108 PRO FFF CG  
4883 C CD  . PRO D 110 ? 0.480 0.362 0.449 -0.046 -0.088 -0.002 108 PRO FFF CD  
4884 N N   . TYR D 111 ? 0.405 0.284 0.319 -0.011 -0.112 -0.027 109 TYR FFF N   
4885 C CA  . TYR D 111 ? 0.408 0.275 0.308 0.005  -0.127 -0.037 109 TYR FFF CA  
4886 C C   . TYR D 111 ? 0.418 0.276 0.289 0.016  -0.126 -0.037 109 TYR FFF C   
4887 O O   . TYR D 111 ? 0.445 0.289 0.308 0.027  -0.141 -0.045 109 TYR FFF O   
4888 C CB  . TYR D 111 ? 0.418 0.287 0.310 0.010  -0.126 -0.040 109 TYR FFF CB  
4889 C CG  . TYR D 111 ? 0.448 0.302 0.327 0.026  -0.144 -0.051 109 TYR FFF CG  
4890 C CD1 . TYR D 111 ? 0.471 0.312 0.312 0.043  -0.144 -0.052 109 TYR FFF CD1 
4891 C CD2 . TYR D 111 ? 0.462 0.312 0.365 0.027  -0.161 -0.060 109 TYR FFF CD2 
4892 C CE1 . TYR D 111 ? 0.517 0.339 0.338 0.060  -0.161 -0.063 109 TYR FFF CE1 
4893 C CE2 . TYR D 111 ? 0.496 0.329 0.383 0.043  -0.181 -0.071 109 TYR FFF CE2 
4894 C CZ  . TYR D 111 ? 0.531 0.348 0.373 0.061  -0.182 -0.073 109 TYR FFF CZ  
4895 O OH  . TYR D 111 ? 0.577 0.372 0.395 0.080  -0.202 -0.085 109 TYR FFF OH  
4896 N N   . PHE D 112 ? 0.407 0.272 0.265 0.013  -0.111 -0.028 110 PHE FFF N   
4897 C CA  . PHE D 112 ? 0.425 0.283 0.261 0.024  -0.106 -0.025 110 PHE FFF CA  
4898 C C   . PHE D 112 ? 0.421 0.283 0.267 0.014  -0.101 -0.018 110 PHE FFF C   
4899 O O   . PHE D 112 ? 0.405 0.278 0.263 0.001  -0.095 -0.012 110 PHE FFF O   
4900 C CB  . PHE D 112 ? 0.427 0.289 0.248 0.029  -0.092 -0.020 110 PHE FFF CB  
4901 C CG  . PHE D 112 ? 0.437 0.295 0.247 0.039  -0.095 -0.025 110 PHE FFF CG  
4902 C CD1 . PHE D 112 ? 0.482 0.322 0.266 0.058  -0.102 -0.031 110 PHE FFF CD1 
4903 C CD2 . PHE D 112 ? 0.435 0.305 0.257 0.031  -0.090 -0.023 110 PHE FFF CD2 
4904 C CE1 . PHE D 112 ? 0.495 0.329 0.265 0.068  -0.105 -0.035 110 PHE FFF CE1 
4905 C CE2 . PHE D 112 ? 0.440 0.305 0.251 0.040  -0.093 -0.027 110 PHE FFF CE2 
4906 C CZ  . PHE D 112 ? 0.470 0.317 0.256 0.059  -0.101 -0.033 110 PHE FFF CZ  
4907 N N   . TRP D 113 ? 0.434 0.287 0.271 0.022  -0.105 -0.019 111 TRP FFF N   
4908 C CA  . TRP D 113 ? 0.442 0.297 0.289 0.015  -0.103 -0.013 111 TRP FFF CA  
4909 C C   . TRP D 113 ? 0.437 0.288 0.272 0.024  -0.094 -0.008 111 TRP FFF C   
4910 O O   . TRP D 113 ? 0.446 0.286 0.264 0.040  -0.094 -0.012 111 TRP FFF O   
4911 C CB  . TRP D 113 ? 0.460 0.306 0.317 0.015  -0.117 -0.019 111 TRP FFF CB  
4912 C CG  . TRP D 113 ? 0.468 0.317 0.346 0.004  -0.123 -0.022 111 TRP FFF CG  
4913 C CD1 . TRP D 113 ? 0.503 0.348 0.390 0.008  -0.134 -0.031 111 TRP FFF CD1 
4914 C CD2 . TRP D 113 ? 0.455 0.312 0.354 -0.010 -0.119 -0.014 111 TRP FFF CD2 
4915 N NE1 . TRP D 113 ? 0.485 0.336 0.401 -0.004 -0.136 -0.029 111 TRP FFF NE1 
4916 C CE2 . TRP D 113 ? 0.475 0.333 0.396 -0.015 -0.125 -0.018 111 TRP FFF CE2 
4917 C CE3 . TRP D 113 ? 0.460 0.320 0.359 -0.019 -0.111 -0.004 111 TRP FFF CE3 
4918 C CZ2 . TRP D 113 ? 0.473 0.335 0.416 -0.028 -0.119 -0.011 111 TRP FFF CZ2 
4919 C CZ3 . TRP D 113 ? 0.469 0.332 0.383 -0.030 -0.108 0.002  111 TRP FFF CZ3 
4920 C CH2 . TRP D 113 ? 0.468 0.331 0.404 -0.034 -0.109 -0.000 111 TRP FFF CH2 
4921 N N   . GLY D 114 ? 0.341 0.331 0.339 0.078  -0.024 0.064  112 GLY FFF N   
4922 C CA  . GLY D 114 ? 0.357 0.379 0.350 0.087  0.003  0.101  112 GLY FFF CA  
4923 C C   . GLY D 114 ? 0.386 0.412 0.362 0.120  0.002  0.078  112 GLY FFF C   
4924 O O   . GLY D 114 ? 0.368 0.365 0.359 0.119  -0.028 0.037  112 GLY FFF O   
4925 N N   . GLN D 115 ? 0.425 0.489 0.382 0.152  0.030  0.109  113 GLN FFF N   
4926 C CA  . GLN D 115 ? 0.495 0.555 0.415 0.203  0.026  0.085  113 GLN FFF CA  
4927 C C   . GLN D 115 ? 0.434 0.487 0.416 0.160  0.013  0.071  113 GLN FFF C   
4928 O O   . GLN D 115 ? 0.465 0.487 0.433 0.188  -0.014 0.036  113 GLN FFF O   
4929 C CB  . GLN D 115 ? 0.570 0.693 0.456 0.258  0.073  0.137  113 GLN FFF CB  
4930 C CG  . GLN D 115 ? 0.702 0.830 0.497 0.328  0.090  0.152  113 GLN FFF CG  
4931 C CD  . GLN D 115 ? 0.797 1.003 0.550 0.407  0.149  0.213  113 GLN FFF CD  
4932 O OE1 . GLN D 115 ? 0.812 1.070 0.610 0.410  0.174  0.240  113 GLN FFF OE1 
4933 N NE2 . GLN D 115 ? 0.933 1.156 0.598 0.479  0.176  0.244  113 GLN FFF NE2 
4934 N N   . GLY D 116 ? 0.363 0.435 0.406 0.103  0.025  0.098  114 GLY FFF N   
4935 C CA  . GLY D 116 ? 0.319 0.386 0.408 0.069  0.017  0.094  114 GLY FFF CA  
4936 C C   . GLY D 116 ? 0.310 0.420 0.427 0.068  0.037  0.130  114 GLY FFF C   
4937 O O   . GLY D 116 ? 0.345 0.494 0.444 0.110  0.060  0.152  114 GLY FFF O   
4938 N N   . THR D 117 ? 0.279 0.384 0.434 0.029  0.029  0.139  115 THR FFF N   
4939 C CA  A THR D 117 ? 0.265 0.407 0.465 0.021  0.034  0.173  115 THR FFF CA  
4940 C CA  B THR D 117 ? 0.274 0.417 0.474 0.022  0.035  0.173  115 THR FFF CA  
4941 C C   . THR D 117 ? 0.253 0.370 0.455 0.015  0.022  0.153  115 THR FFF C   
4942 O O   . THR D 117 ? 0.256 0.336 0.446 -0.004 0.009  0.137  115 THR FFF O   
4943 C CB  A THR D 117 ? 0.263 0.410 0.509 -0.015 0.017  0.209  115 THR FFF CB  
4944 C CB  B THR D 117 ? 0.282 0.434 0.531 -0.013 0.019  0.212  115 THR FFF CB  
4945 O OG1 A THR D 117 ? 0.243 0.428 0.553 -0.023 0.012  0.244  115 THR FFF OG1 
4946 O OG1 B THR D 117 ? 0.310 0.407 0.544 -0.037 -0.014 0.188  115 THR FFF OG1 
4947 C CG2 A THR D 117 ? 0.274 0.357 0.492 -0.038 -0.016 0.181  115 THR FFF CG2 
4948 C CG2 B THR D 117 ? 0.290 0.447 0.537 -0.015 0.024  0.232  115 THR FFF CG2 
4949 N N   . GLN D 118 ? 0.268 0.411 0.482 0.039  0.030  0.160  116 GLN FFF N   
4950 C CA  . GLN D 118 ? 0.263 0.380 0.482 0.036  0.016  0.147  116 GLN FFF CA  
4951 C C   . GLN D 118 ? 0.250 0.367 0.496 0.005  0.001  0.168  116 GLN FFF C   
4952 O O   . GLN D 118 ? 0.245 0.403 0.539 -0.002 -0.003 0.200  116 GLN FFF O   
4953 C CB  . GLN D 118 ? 0.291 0.429 0.508 0.080  0.022  0.145  116 GLN FFF CB  
4954 C CG  . GLN D 118 ? 0.301 0.405 0.525 0.078  0.002  0.133  116 GLN FFF CG  
4955 C CD  . GLN D 118 ? 0.312 0.351 0.525 0.069  -0.021 0.107  116 GLN FFF CD  
4956 O OE1 . GLN D 118 ? 0.355 0.367 0.548 0.091  -0.036 0.081  116 GLN FFF OE1 
4957 N NE2 . GLN D 118 ? 0.293 0.309 0.525 0.039  -0.027 0.121  116 GLN FFF NE2 
4958 N N   . VAL D 119 ? 0.266 0.339 0.487 -0.006 -0.012 0.156  117 VAL FFF N   
4959 C CA  . VAL D 119 ? 0.293 0.345 0.507 -0.014 -0.036 0.165  117 VAL FFF CA  
4960 C C   . VAL D 119 ? 0.319 0.357 0.527 -0.001 -0.033 0.165  117 VAL FFF C   
4961 O O   . VAL D 119 ? 0.316 0.335 0.514 0.001  -0.020 0.163  117 VAL FFF O   
4962 C CB  . VAL D 119 ? 0.332 0.343 0.493 -0.015 -0.049 0.156  117 VAL FFF CB  
4963 C CG1 . VAL D 119 ? 0.392 0.362 0.509 -0.001 -0.080 0.157  117 VAL FFF CG1 
4964 C CG2 . VAL D 119 ? 0.331 0.341 0.502 -0.028 -0.064 0.156  117 VAL FFF CG2 
4965 N N   . THR D 120 ? 0.332 0.383 0.564 0.004  -0.049 0.176  118 THR FFF N   
4966 C CA  . THR D 120 ? 0.368 0.398 0.593 0.018  -0.053 0.179  118 THR FFF CA  
4967 C C   . THR D 120 ? 0.421 0.425 0.619 0.021  -0.083 0.188  118 THR FFF C   
4968 O O   . THR D 120 ? 0.435 0.460 0.674 0.017  -0.113 0.194  118 THR FFF O   
4969 C CB  . THR D 120 ? 0.369 0.431 0.632 0.039  -0.048 0.176  118 THR FFF CB  
4970 O OG1 . THR D 120 ? 0.362 0.430 0.621 0.050  -0.032 0.159  118 THR FFF OG1 
4971 C CG2 . THR D 120 ? 0.403 0.430 0.660 0.054  -0.061 0.176  118 THR FFF CG2 
4972 N N   . VAL D 121 ? 0.474 0.437 0.613 0.034  -0.079 0.195  119 VAL FFF N   
4973 C CA  . VAL D 121 ? 0.548 0.469 0.624 0.057  -0.110 0.199  119 VAL FFF CA  
4974 C C   . VAL D 121 ? 0.594 0.504 0.672 0.071  -0.108 0.218  119 VAL FFF C   
4975 O O   . VAL D 121 ? 0.565 0.469 0.641 0.073  -0.076 0.241  119 VAL FFF O   
4976 C CB  . VAL D 121 ? 0.608 0.495 0.589 0.085  -0.097 0.203  119 VAL FFF CB  
4977 C CG1 . VAL D 121 ? 0.725 0.554 0.607 0.130  -0.139 0.199  119 VAL FFF CG1 
4978 C CG2 . VAL D 121 ? 0.599 0.492 0.581 0.073  -0.098 0.184  119 VAL FFF CG2 
4979 N N   . SER D 122 ? 0.628 0.537 0.727 0.077  -0.147 0.213  120 SER FFF N   
4980 C CA  . SER D 122 ? 0.688 0.582 0.788 0.094  -0.155 0.227  120 SER FFF CA  
4981 C C   . SER D 122 ? 0.810 0.647 0.807 0.130  -0.170 0.243  120 SER FFF C   
4982 O O   . SER D 122 ? 0.847 0.652 0.778 0.151  -0.205 0.227  120 SER FFF O   
4983 C CB  . SER D 122 ? 0.689 0.619 0.863 0.093  -0.187 0.220  120 SER FFF CB  
4984 O OG  . SER D 122 ? 0.745 0.675 0.931 0.089  -0.238 0.213  120 SER FFF OG  
4985 N N   . SER D 123 ? 0.878 0.695 0.858 0.145  -0.151 0.274  121 SER FFF N   
4986 C CA  . SER D 123 ? 1.006 0.774 0.878 0.193  -0.151 0.306  121 SER FFF CA  
4987 C C   . SER D 123 ? 1.073 0.811 0.933 0.214  -0.204 0.298  121 SER FFF C   
4988 O O   . SER D 123 ? 1.037 0.797 0.967 0.196  -0.246 0.266  121 SER FFF O   
4989 C CB  . SER D 123 ? 1.040 0.814 0.923 0.193  -0.094 0.366  121 SER FFF CB  
4990 O OG  . SER D 123 ? 1.169 0.919 0.935 0.250  -0.072 0.411  121 SER FFF OG  
# 
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 ?   ?   ?   AAA . n 
A 1 2   ASN 2   331 ?   ?   ?   AAA . n 
A 1 3   ILE 3   332 ?   ?   ?   AAA . n 
A 1 4   THR 4   333 ?   ?   ?   AAA . n 
A 1 5   ASN 5   334 334 ASN ASN AAA . n 
A 1 6   LEU 6   335 335 LEU LEU AAA . n 
A 1 7   CYS 7   336 336 CYS CYS AAA . n 
A 1 8   PRO 8   337 337 PRO PRO AAA . n 
A 1 9   PHE 9   338 338 PHE PHE AAA . n 
A 1 10  GLY 10  339 339 GLY GLY AAA . n 
A 1 11  GLU 11  340 340 GLU GLU AAA . n 
A 1 12  VAL 12  341 341 VAL VAL AAA . n 
A 1 13  PHE 13  342 342 PHE PHE AAA . n 
A 1 14  ASN 14  343 343 ASN ASN AAA . n 
A 1 15  ALA 15  344 344 ALA ALA AAA . n 
A 1 16  THR 16  345 345 THR THR AAA . n 
A 1 17  ARG 17  346 346 ARG ARG AAA . n 
A 1 18  PHE 18  347 347 PHE PHE AAA . n 
A 1 19  ALA 19  348 348 ALA ALA AAA . n 
A 1 20  SER 20  349 349 SER SER AAA . n 
A 1 21  VAL 21  350 350 VAL VAL AAA . n 
A 1 22  TYR 22  351 351 TYR TYR AAA . n 
A 1 23  ALA 23  352 352 ALA ALA AAA . n 
A 1 24  TRP 24  353 353 TRP TRP AAA . n 
A 1 25  ASN 25  354 354 ASN ASN AAA . n 
A 1 26  ARG 26  355 355 ARG ARG AAA . n 
A 1 27  LYS 27  356 356 LYS LYS AAA . n 
A 1 28  ARG 28  357 357 ARG ARG AAA . n 
A 1 29  ILE 29  358 358 ILE ILE AAA . n 
A 1 30  SER 30  359 359 SER SER AAA . n 
A 1 31  ASN 31  360 360 ASN ASN AAA . n 
A 1 32  CYS 32  361 361 CYS CYS AAA . n 
A 1 33  VAL 33  362 362 VAL VAL AAA . n 
A 1 34  ALA 34  363 363 ALA ALA AAA . n 
A 1 35  ASP 35  364 364 ASP ASP AAA . n 
A 1 36  TYR 36  365 365 TYR TYR AAA . n 
A 1 37  SER 37  366 366 SER SER AAA . n 
A 1 38  VAL 38  367 367 VAL VAL AAA . n 
A 1 39  LEU 39  368 368 LEU LEU AAA . n 
A 1 40  TYR 40  369 369 TYR TYR AAA . n 
A 1 41  ASN 41  370 370 ASN ASN AAA . n 
A 1 42  SER 42  371 371 SER SER AAA . n 
A 1 43  ALA 43  372 372 ALA ALA AAA . n 
A 1 44  SER 44  373 373 SER SER AAA . n 
A 1 45  PHE 45  374 374 PHE PHE AAA . n 
A 1 46  SER 46  375 375 SER SER AAA . n 
A 1 47  THR 47  376 376 THR THR AAA . n 
A 1 48  PHE 48  377 377 PHE PHE AAA . n 
A 1 49  LYS 49  378 378 LYS LYS AAA . n 
A 1 50  CYS 50  379 379 CYS CYS AAA . n 
A 1 51  TYR 51  380 380 TYR TYR AAA . n 
A 1 52  GLY 52  381 381 GLY GLY AAA . n 
A 1 53  VAL 53  382 382 VAL VAL AAA . n 
A 1 54  SER 54  383 383 SER SER AAA . n 
A 1 55  PRO 55  384 384 PRO PRO AAA . n 
A 1 56  THR 56  385 385 THR THR AAA . n 
A 1 57  LYS 57  386 386 LYS LYS AAA . n 
A 1 58  LEU 58  387 387 LEU LEU AAA . n 
A 1 59  ASN 59  388 388 ASN ASN AAA . n 
A 1 60  ASP 60  389 389 ASP ASP AAA . n 
A 1 61  LEU 61  390 390 LEU LEU AAA . n 
A 1 62  CYS 62  391 391 CYS CYS AAA . n 
A 1 63  PHE 63  392 392 PHE PHE AAA . n 
A 1 64  THR 64  393 393 THR THR AAA . n 
A 1 65  ASN 65  394 394 ASN ASN AAA . n 
A 1 66  VAL 66  395 395 VAL VAL AAA . n 
A 1 67  TYR 67  396 396 TYR TYR AAA . n 
A 1 68  ALA 68  397 397 ALA ALA AAA . n 
A 1 69  ASP 69  398 398 ASP ASP AAA . n 
A 1 70  SER 70  399 399 SER SER AAA . n 
A 1 71  PHE 71  400 400 PHE PHE AAA . n 
A 1 72  VAL 72  401 401 VAL VAL AAA . n 
A 1 73  ILE 73  402 402 ILE ILE AAA . n 
A 1 74  ARG 74  403 403 ARG ARG AAA . n 
A 1 75  GLY 75  404 404 GLY GLY AAA . n 
A 1 76  ASP 76  405 405 ASP ASP AAA . n 
A 1 77  GLU 77  406 406 GLU GLU AAA . n 
A 1 78  VAL 78  407 407 VAL VAL AAA . n 
A 1 79  ARG 79  408 408 ARG ARG AAA . n 
A 1 80  GLN 80  409 409 GLN GLN AAA . n 
A 1 81  ILE 81  410 410 ILE ILE AAA . n 
A 1 82  ALA 82  411 411 ALA ALA AAA . n 
A 1 83  PRO 83  412 412 PRO PRO AAA . n 
A 1 84  GLY 84  413 413 GLY GLY AAA . n 
A 1 85  GLN 85  414 414 GLN GLN AAA . n 
A 1 86  THR 86  415 415 THR THR AAA . n 
A 1 87  GLY 87  416 416 GLY GLY AAA . n 
A 1 88  LYS 88  417 417 LYS LYS AAA . n 
A 1 89  ILE 89  418 418 ILE ILE AAA . n 
A 1 90  ALA 90  419 419 ALA ALA AAA . n 
A 1 91  ASP 91  420 420 ASP ASP AAA . n 
A 1 92  TYR 92  421 421 TYR TYR AAA . n 
A 1 93  ASN 93  422 422 ASN ASN AAA . n 
A 1 94  TYR 94  423 423 TYR TYR AAA . n 
A 1 95  LYS 95  424 424 LYS LYS AAA . n 
A 1 96  LEU 96  425 425 LEU LEU AAA . n 
A 1 97  PRO 97  426 426 PRO PRO AAA . n 
A 1 98  ASP 98  427 427 ASP ASP AAA . n 
A 1 99  ASP 99  428 428 ASP ASP AAA . n 
A 1 100 PHE 100 429 429 PHE PHE AAA . n 
A 1 101 THR 101 430 430 THR THR AAA . n 
A 1 102 GLY 102 431 431 GLY GLY AAA . n 
A 1 103 CYS 103 432 432 CYS CYS AAA . n 
A 1 104 VAL 104 433 433 VAL VAL AAA . n 
A 1 105 ILE 105 434 434 ILE ILE AAA . n 
A 1 106 ALA 106 435 435 ALA ALA AAA . n 
A 1 107 TRP 107 436 436 TRP TRP AAA . n 
A 1 108 ASN 108 437 437 ASN ASN AAA . n 
A 1 109 SER 109 438 438 SER SER AAA . n 
A 1 110 ASN 110 439 439 ASN ASN AAA . n 
A 1 111 ASN 111 440 440 ASN ASN AAA . n 
A 1 112 LEU 112 441 441 LEU LEU AAA . n 
A 1 113 ASP 113 442 442 ASP ASP AAA . n 
A 1 114 SER 114 443 443 SER SER AAA . n 
A 1 115 LYS 115 444 444 LYS LYS AAA . n 
A 1 116 VAL 116 445 445 VAL VAL AAA . n 
A 1 117 GLY 117 446 446 GLY GLY AAA . n 
A 1 118 GLY 118 447 447 GLY GLY AAA . n 
A 1 119 ASN 119 448 448 ASN ASN AAA . n 
A 1 120 TYR 120 449 449 TYR TYR AAA . n 
A 1 121 ASN 121 450 450 ASN ASN AAA . n 
A 1 122 TYR 122 451 451 TYR TYR AAA . n 
A 1 123 LEU 123 452 452 LEU LEU AAA . n 
A 1 124 TYR 124 453 453 TYR TYR AAA . n 
A 1 125 ARG 125 454 454 ARG ARG AAA . n 
A 1 126 LEU 126 455 455 LEU LEU AAA . n 
A 1 127 PHE 127 456 456 PHE PHE AAA . n 
A 1 128 ARG 128 457 457 ARG ARG AAA . n 
A 1 129 LYS 129 458 458 LYS LYS AAA . n 
A 1 130 SER 130 459 459 SER SER AAA . n 
A 1 131 ASN 131 460 460 ASN ASN AAA . n 
A 1 132 LEU 132 461 461 LEU LEU AAA . n 
A 1 133 LYS 133 462 462 LYS LYS AAA . n 
A 1 134 PRO 134 463 463 PRO PRO AAA . n 
A 1 135 PHE 135 464 464 PHE PHE AAA . n 
A 1 136 GLU 136 465 465 GLU GLU AAA . n 
A 1 137 ARG 137 466 466 ARG ARG AAA . n 
A 1 138 ASP 138 467 467 ASP ASP AAA . n 
A 1 139 ILE 139 468 468 ILE ILE AAA . n 
A 1 140 SER 140 469 469 SER SER AAA . n 
A 1 141 THR 141 470 470 THR THR AAA . n 
A 1 142 GLU 142 471 471 GLU GLU AAA . n 
A 1 143 ILE 143 472 472 ILE ILE AAA . n 
A 1 144 TYR 144 473 473 TYR TYR AAA . n 
A 1 145 GLN 145 474 474 GLN GLN AAA . n 
A 1 146 ALA 146 475 475 ALA ALA AAA . n 
A 1 147 GLY 147 476 476 GLY GLY AAA . n 
A 1 148 SER 148 477 477 SER SER AAA . n 
A 1 149 THR 149 478 478 THR THR AAA . n 
A 1 150 PRO 150 479 479 PRO PRO AAA . n 
A 1 151 CYS 151 480 480 CYS CYS AAA . n 
A 1 152 ASN 152 481 481 ASN ASN AAA . n 
A 1 153 GLY 153 482 482 GLY GLY AAA . n 
A 1 154 VAL 154 483 483 VAL VAL AAA . n 
A 1 155 GLU 155 484 484 GLU GLU AAA . n 
A 1 156 GLY 156 485 485 GLY GLY AAA . n 
A 1 157 PHE 157 486 486 PHE PHE AAA . n 
A 1 158 ASN 158 487 487 ASN ASN AAA . n 
A 1 159 CYS 159 488 488 CYS CYS AAA . n 
A 1 160 TYR 160 489 489 TYR TYR AAA . n 
A 1 161 PHE 161 490 490 PHE PHE AAA . n 
A 1 162 PRO 162 491 491 PRO PRO AAA . n 
A 1 163 LEU 163 492 492 LEU LEU AAA . n 
A 1 164 GLN 164 493 493 GLN GLN AAA . n 
A 1 165 SER 165 494 494 SER SER AAA . n 
A 1 166 TYR 166 495 495 TYR TYR AAA . n 
A 1 167 GLY 167 496 496 GLY GLY AAA . n 
A 1 168 PHE 168 497 497 PHE PHE AAA . n 
A 1 169 GLN 169 498 498 GLN GLN AAA . n 
A 1 170 PRO 170 499 499 PRO PRO AAA . n 
A 1 171 THR 171 500 500 THR THR AAA . n 
A 1 172 TYR 172 501 501 TYR TYR AAA . n 
A 1 173 GLY 173 502 502 GLY GLY AAA . n 
A 1 174 VAL 174 503 503 VAL VAL AAA . n 
A 1 175 GLY 175 504 504 GLY GLY AAA . n 
A 1 176 TYR 176 505 505 TYR TYR AAA . n 
A 1 177 GLN 177 506 506 GLN GLN AAA . n 
A 1 178 PRO 178 507 507 PRO PRO AAA . n 
A 1 179 TYR 179 508 508 TYR TYR AAA . n 
A 1 180 ARG 180 509 509 ARG ARG AAA . n 
A 1 181 VAL 181 510 510 VAL VAL AAA . n 
A 1 182 VAL 182 511 511 VAL VAL AAA . n 
A 1 183 VAL 183 512 512 VAL VAL AAA . n 
A 1 184 LEU 184 513 513 LEU LEU AAA . n 
A 1 185 SER 185 514 514 SER SER AAA . n 
A 1 186 PHE 186 515 515 PHE PHE AAA . n 
A 1 187 GLU 187 516 516 GLU GLU AAA . n 
A 1 188 LEU 188 517 517 LEU LEU AAA . n 
A 1 189 LEU 189 518 518 LEU LEU AAA . n 
A 1 190 HIS 190 519 519 HIS HIS AAA . n 
A 1 191 ALA 191 520 520 ALA ALA AAA . n 
A 1 192 PRO 192 521 521 PRO PRO AAA . n 
A 1 193 ALA 193 522 522 ALA ALA AAA . n 
A 1 194 THR 194 523 523 THR THR AAA . n 
A 1 195 VAL 195 524 524 VAL VAL AAA . n 
A 1 196 CYS 196 525 525 CYS CYS AAA . n 
A 1 197 GLY 197 526 526 GLY GLY AAA . n 
A 1 198 PRO 198 527 527 PRO PRO AAA . n 
A 1 199 LYS 199 528 ?   ?   ?   AAA . n 
A 1 200 LYS 200 529 ?   ?   ?   AAA . n 
A 1 201 SER 201 530 ?   ?   ?   AAA . n 
A 1 202 THR 202 531 ?   ?   ?   AAA . n 
A 1 203 ASN 203 532 ?   ?   ?   AAA . n 
A 1 204 LYS 204 533 ?   ?   ?   AAA . n 
A 1 205 HIS 205 534 ?   ?   ?   AAA . n 
A 1 206 HIS 206 535 ?   ?   ?   AAA . n 
A 1 207 HIS 207 536 ?   ?   ?   AAA . n 
A 1 208 HIS 208 537 ?   ?   ?   AAA . n 
A 1 209 HIS 209 538 ?   ?   ?   AAA . n 
A 1 210 HIS 210 539 ?   ?   ?   AAA . n 
B 2 1   MET 1   -1  ?   ?   ?   BBB . n 
B 2 2   ALA 2   0   ?   ?   ?   BBB . n 
B 2 3   GLN 3   1   1   GLN GLN BBB . n 
B 2 4   VAL 4   2   2   VAL VAL BBB . n 
B 2 5   GLN 5   3   3   GLN GLN BBB . n 
B 2 6   LEU 6   4   4   LEU LEU BBB . n 
B 2 7   VAL 7   5   5   VAL VAL BBB . n 
B 2 8   GLU 8   6   6   GLU GLU BBB . n 
B 2 9   SER 9   7   7   SER SER BBB . n 
B 2 10  GLY 10  8   8   GLY GLY BBB . n 
B 2 11  GLY 11  9   9   GLY GLY BBB . n 
B 2 12  GLY 12  10  10  GLY GLY BBB . n 
B 2 13  SER 13  11  11  SER SER BBB . n 
B 2 14  VAL 14  12  12  VAL VAL BBB . n 
B 2 15  GLN 15  13  13  GLN GLN BBB . n 
B 2 16  ALA 16  14  14  ALA ALA BBB . n 
B 2 17  GLY 17  15  15  GLY GLY BBB . n 
B 2 18  GLY 18  16  16  GLY GLY BBB . n 
B 2 19  SER 19  17  17  SER SER BBB . n 
B 2 20  LEU 20  18  18  LEU LEU BBB . n 
B 2 21  THR 21  19  19  THR THR BBB . n 
B 2 22  LEU 22  20  20  LEU LEU BBB . n 
B 2 23  SER 23  21  21  SER SER BBB . n 
B 2 24  CYS 24  22  22  CYS CYS BBB . n 
B 2 25  VAL 25  23  23  VAL VAL BBB . n 
B 2 26  ALA 26  24  24  ALA ALA BBB . n 
B 2 27  SER 27  25  25  SER SER BBB . n 
B 2 28  GLY 28  26  26  GLY GLY BBB . n 
B 2 29  VAL 29  27  27  VAL VAL BBB . n 
B 2 30  THR 30  28  28  THR THR BBB . n 
B 2 31  LEU 31  29  29  LEU LEU BBB . n 
B 2 32  GLY 32  30  30  GLY GLY BBB . n 
B 2 33  ARG 33  31  31  ARG ARG BBB . n 
B 2 34  HIS 34  32  32  HIS HIS BBB . n 
B 2 35  ALA 35  33  33  ALA ALA BBB . n 
B 2 36  ILE 36  34  34  ILE ILE BBB . n 
B 2 37  GLY 37  35  35  GLY GLY BBB . n 
B 2 38  TRP 38  36  36  TRP TRP BBB . n 
B 2 39  PHE 39  37  37  PHE PHE BBB . n 
B 2 40  ARG 40  38  38  ARG ARG BBB . n 
B 2 41  GLN 41  39  39  GLN GLN BBB . n 
B 2 42  ALA 42  40  40  ALA ALA BBB . n 
B 2 43  PRO 43  41  41  PRO PRO BBB . n 
B 2 44  GLY 44  42  42  GLY GLY BBB . n 
B 2 45  LYS 45  43  43  LYS LYS BBB . n 
B 2 46  GLU 46  44  44  GLU GLU BBB . n 
B 2 47  ARG 47  45  45  ARG ARG BBB . n 
B 2 48  GLU 48  46  46  GLU GLU BBB . n 
B 2 49  ARG 49  47  47  ARG ARG BBB . n 
B 2 50  VAL 50  48  48  VAL VAL BBB . n 
B 2 51  SER 51  49  49  SER SER BBB . n 
B 2 52  CYS 52  50  50  CYS CYS BBB . n 
B 2 53  ILE 53  51  51  ILE ILE BBB . n 
B 2 54  ARG 54  52  52  ARG ARG BBB . n 
B 2 55  THR 55  53  53  THR THR BBB . n 
B 2 56  PHE 56  54  54  PHE PHE BBB . n 
B 2 57  ASP 57  55  55  ASP ASP BBB . n 
B 2 58  GLY 58  56  56  GLY GLY BBB . n 
B 2 59  ILE 59  57  57  ILE ILE BBB . n 
B 2 60  THR 60  58  58  THR THR BBB . n 
B 2 61  SER 61  59  59  SER SER BBB . n 
B 2 62  TYR 62  60  60  TYR TYR BBB . n 
B 2 63  VAL 63  61  61  VAL VAL BBB . n 
B 2 64  GLU 64  62  62  GLU GLU BBB . n 
B 2 65  SER 65  63  63  SER SER BBB . n 
B 2 66  THR 66  64  64  THR THR BBB . n 
B 2 67  LYS 67  65  65  LYS LYS BBB . n 
B 2 68  GLY 68  66  66  GLY GLY BBB . n 
B 2 69  ARG 69  67  67  ARG ARG BBB . n 
B 2 70  PHE 70  68  68  PHE PHE BBB . n 
B 2 71  THR 71  69  69  THR THR BBB . n 
B 2 72  ILE 72  70  70  ILE ILE BBB . n 
B 2 73  SER 73  71  71  SER SER BBB . n 
B 2 74  SER 74  72  72  SER SER BBB . n 
B 2 75  ASN 75  73  73  ASN ASN BBB . n 
B 2 76  ASN 76  74  74  ASN ASN BBB . n 
B 2 77  ALA 77  75  75  ALA ALA BBB . n 
B 2 78  MET 78  76  76  MET MET BBB . n 
B 2 79  ASN 79  77  77  ASN ASN BBB . n 
B 2 80  THR 80  78  78  THR THR BBB . n 
B 2 81  VAL 81  79  79  VAL VAL BBB . n 
B 2 82  TYR 82  80  80  TYR TYR BBB . n 
B 2 83  LEU 83  81  81  LEU LEU BBB . n 
B 2 84  GLN 84  82  82  GLN GLN BBB . n 
B 2 85  MET 85  83  83  MET MET BBB . n 
B 2 86  ASN 86  84  84  ASN ASN BBB . n 
B 2 87  SER 87  85  85  SER SER BBB . n 
B 2 88  LEU 88  86  86  LEU LEU BBB . n 
B 2 89  LYS 89  87  87  LYS LYS BBB . n 
B 2 90  PRO 90  88  88  PRO PRO BBB . n 
B 2 91  GLU 91  89  89  GLU GLU BBB . n 
B 2 92  ASP 92  90  90  ASP ASP BBB . n 
B 2 93  THR 93  91  91  THR THR BBB . n 
B 2 94  ALA 94  92  92  ALA ALA BBB . n 
B 2 95  VAL 95  93  93  VAL VAL BBB . n 
B 2 96  TYR 96  94  94  TYR TYR BBB . n 
B 2 97  PHE 97  95  95  PHE PHE BBB . n 
B 2 98  CYS 98  96  96  CYS CYS BBB . n 
B 2 99  ALA 99  97  97  ALA ALA BBB . n 
B 2 100 LEU 100 98  98  LEU LEU BBB . n 
B 2 101 GLY 101 99  99  GLY GLY BBB . n 
B 2 102 VAL 102 100 100 VAL VAL BBB . n 
B 2 103 THR 103 101 101 THR THR BBB . n 
B 2 104 ALA 104 102 102 ALA ALA BBB . n 
B 2 105 ALA 105 103 103 ALA ALA BBB . n 
B 2 106 CYS 106 104 104 CYS CYS BBB . n 
B 2 107 SER 107 105 105 SER SER BBB . n 
B 2 108 ASP 108 106 106 ASP ASP BBB . n 
B 2 109 ASN 109 107 107 ASN ASN BBB . n 
B 2 110 PRO 110 108 108 PRO PRO BBB . n 
B 2 111 TYR 111 109 109 TYR TYR BBB . n 
B 2 112 PHE 112 110 110 PHE PHE BBB . n 
B 2 113 TRP 113 111 111 TRP TRP BBB . n 
B 2 114 GLY 114 112 112 GLY GLY BBB . n 
B 2 115 GLN 115 113 113 GLN GLN BBB . n 
B 2 116 GLY 116 114 114 GLY GLY BBB . n 
B 2 117 THR 117 115 115 THR THR BBB . n 
B 2 118 GLN 118 116 116 GLN GLN BBB . n 
B 2 119 VAL 119 117 117 VAL VAL BBB . n 
B 2 120 THR 120 118 118 THR THR BBB . n 
B 2 121 VAL 121 119 119 VAL VAL BBB . n 
B 2 122 SER 122 120 120 SER SER BBB . n 
B 2 123 SER 123 121 121 SER SER BBB . n 
B 2 124 HIS 124 122 122 HIS HIS BBB . n 
B 2 125 HIS 125 123 ?   ?   ?   BBB . n 
B 2 126 HIS 126 124 ?   ?   ?   BBB . n 
B 2 127 HIS 127 125 ?   ?   ?   BBB . n 
B 2 128 HIS 128 126 ?   ?   ?   BBB . n 
B 2 129 HIS 129 127 ?   ?   ?   BBB . n 
C 1 1   PRO 1   330 ?   ?   ?   EEE . n 
C 1 2   ASN 2   331 ?   ?   ?   EEE . n 
C 1 3   ILE 3   332 ?   ?   ?   EEE . n 
C 1 4   THR 4   333 ?   ?   ?   EEE . n 
C 1 5   ASN 5   334 334 ASN ASN EEE . n 
C 1 6   LEU 6   335 335 LEU LEU EEE . n 
C 1 7   CYS 7   336 336 CYS CYS EEE . n 
C 1 8   PRO 8   337 337 PRO PRO EEE . n 
C 1 9   PHE 9   338 338 PHE PHE EEE . n 
C 1 10  GLY 10  339 339 GLY GLY EEE . n 
C 1 11  GLU 11  340 340 GLU GLU EEE . n 
C 1 12  VAL 12  341 341 VAL VAL EEE . n 
C 1 13  PHE 13  342 342 PHE PHE EEE . n 
C 1 14  ASN 14  343 343 ASN ASN EEE . n 
C 1 15  ALA 15  344 344 ALA ALA EEE . n 
C 1 16  THR 16  345 345 THR THR EEE . n 
C 1 17  ARG 17  346 346 ARG ARG EEE . n 
C 1 18  PHE 18  347 347 PHE PHE EEE . n 
C 1 19  ALA 19  348 348 ALA ALA EEE . n 
C 1 20  SER 20  349 349 SER SER EEE . n 
C 1 21  VAL 21  350 350 VAL VAL EEE . n 
C 1 22  TYR 22  351 351 TYR TYR EEE . n 
C 1 23  ALA 23  352 352 ALA ALA EEE . n 
C 1 24  TRP 24  353 353 TRP TRP EEE . n 
C 1 25  ASN 25  354 354 ASN ASN EEE . n 
C 1 26  ARG 26  355 355 ARG ARG EEE . n 
C 1 27  LYS 27  356 356 LYS LYS EEE . n 
C 1 28  ARG 28  357 357 ARG ARG EEE . n 
C 1 29  ILE 29  358 358 ILE ILE EEE . n 
C 1 30  SER 30  359 359 SER SER EEE . n 
C 1 31  ASN 31  360 360 ASN ASN EEE . n 
C 1 32  CYS 32  361 361 CYS CYS EEE . n 
C 1 33  VAL 33  362 362 VAL VAL EEE . n 
C 1 34  ALA 34  363 363 ALA ALA EEE . n 
C 1 35  ASP 35  364 364 ASP ASP EEE . n 
C 1 36  TYR 36  365 365 TYR TYR EEE . n 
C 1 37  SER 37  366 366 SER SER EEE . n 
C 1 38  VAL 38  367 367 VAL VAL EEE . n 
C 1 39  LEU 39  368 368 LEU LEU EEE . n 
C 1 40  TYR 40  369 369 TYR TYR EEE . n 
C 1 41  ASN 41  370 370 ASN ASN EEE . n 
C 1 42  SER 42  371 371 SER SER EEE . n 
C 1 43  ALA 43  372 372 ALA ALA EEE . n 
C 1 44  SER 44  373 373 SER SER EEE . n 
C 1 45  PHE 45  374 374 PHE PHE EEE . n 
C 1 46  SER 46  375 375 SER SER EEE . n 
C 1 47  THR 47  376 376 THR THR EEE . n 
C 1 48  PHE 48  377 377 PHE PHE EEE . n 
C 1 49  LYS 49  378 378 LYS LYS EEE . n 
C 1 50  CYS 50  379 379 CYS CYS EEE . n 
C 1 51  TYR 51  380 380 TYR TYR EEE . n 
C 1 52  GLY 52  381 381 GLY GLY EEE . n 
C 1 53  VAL 53  382 382 VAL VAL EEE . n 
C 1 54  SER 54  383 383 SER SER EEE . n 
C 1 55  PRO 55  384 384 PRO PRO EEE . n 
C 1 56  THR 56  385 385 THR THR EEE . n 
C 1 57  LYS 57  386 386 LYS LYS EEE . n 
C 1 58  LEU 58  387 387 LEU LEU EEE . n 
C 1 59  ASN 59  388 388 ASN ASN EEE . n 
C 1 60  ASP 60  389 389 ASP ASP EEE . n 
C 1 61  LEU 61  390 390 LEU LEU EEE . n 
C 1 62  CYS 62  391 391 CYS CYS EEE . n 
C 1 63  PHE 63  392 392 PHE PHE EEE . n 
C 1 64  THR 64  393 393 THR THR EEE . n 
C 1 65  ASN 65  394 394 ASN ASN EEE . n 
C 1 66  VAL 66  395 395 VAL VAL EEE . n 
C 1 67  TYR 67  396 396 TYR TYR EEE . n 
C 1 68  ALA 68  397 397 ALA ALA EEE . n 
C 1 69  ASP 69  398 398 ASP ASP EEE . n 
C 1 70  SER 70  399 399 SER SER EEE . n 
C 1 71  PHE 71  400 400 PHE PHE EEE . n 
C 1 72  VAL 72  401 401 VAL VAL EEE . n 
C 1 73  ILE 73  402 402 ILE ILE EEE . n 
C 1 74  ARG 74  403 403 ARG ARG EEE . n 
C 1 75  GLY 75  404 404 GLY GLY EEE . n 
C 1 76  ASP 76  405 405 ASP ASP EEE . n 
C 1 77  GLU 77  406 406 GLU GLU EEE . n 
C 1 78  VAL 78  407 407 VAL VAL EEE . n 
C 1 79  ARG 79  408 408 ARG ARG EEE . n 
C 1 80  GLN 80  409 409 GLN GLN EEE . n 
C 1 81  ILE 81  410 410 ILE ILE EEE . n 
C 1 82  ALA 82  411 411 ALA ALA EEE . n 
C 1 83  PRO 83  412 412 PRO PRO EEE . n 
C 1 84  GLY 84  413 413 GLY GLY EEE . n 
C 1 85  GLN 85  414 414 GLN GLN EEE . n 
C 1 86  THR 86  415 415 THR THR EEE . n 
C 1 87  GLY 87  416 416 GLY GLY EEE . n 
C 1 88  LYS 88  417 417 LYS LYS EEE . n 
C 1 89  ILE 89  418 418 ILE ILE EEE . n 
C 1 90  ALA 90  419 419 ALA ALA EEE . n 
C 1 91  ASP 91  420 420 ASP ASP EEE . n 
C 1 92  TYR 92  421 421 TYR TYR EEE . n 
C 1 93  ASN 93  422 422 ASN ASN EEE . n 
C 1 94  TYR 94  423 423 TYR TYR EEE . n 
C 1 95  LYS 95  424 424 LYS LYS EEE . n 
C 1 96  LEU 96  425 425 LEU LEU EEE . n 
C 1 97  PRO 97  426 426 PRO PRO EEE . n 
C 1 98  ASP 98  427 427 ASP ASP EEE . n 
C 1 99  ASP 99  428 428 ASP ASP EEE . n 
C 1 100 PHE 100 429 429 PHE PHE EEE . n 
C 1 101 THR 101 430 430 THR THR EEE . n 
C 1 102 GLY 102 431 431 GLY GLY EEE . n 
C 1 103 CYS 103 432 432 CYS CYS EEE . n 
C 1 104 VAL 104 433 433 VAL VAL EEE . n 
C 1 105 ILE 105 434 434 ILE ILE EEE . n 
C 1 106 ALA 106 435 435 ALA ALA EEE . n 
C 1 107 TRP 107 436 436 TRP TRP EEE . n 
C 1 108 ASN 108 437 437 ASN ASN EEE . n 
C 1 109 SER 109 438 438 SER SER EEE . n 
C 1 110 ASN 110 439 439 ASN ASN EEE . n 
C 1 111 ASN 111 440 440 ASN ASN EEE . n 
C 1 112 LEU 112 441 441 LEU LEU EEE . n 
C 1 113 ASP 113 442 442 ASP ASP EEE . n 
C 1 114 SER 114 443 443 SER SER EEE . n 
C 1 115 LYS 115 444 444 LYS LYS EEE . n 
C 1 116 VAL 116 445 445 VAL VAL EEE . n 
C 1 117 GLY 117 446 446 GLY GLY EEE . n 
C 1 118 GLY 118 447 447 GLY GLY EEE . n 
C 1 119 ASN 119 448 448 ASN ASN EEE . n 
C 1 120 TYR 120 449 449 TYR TYR EEE . n 
C 1 121 ASN 121 450 450 ASN ASN EEE . n 
C 1 122 TYR 122 451 451 TYR TYR EEE . n 
C 1 123 LEU 123 452 452 LEU LEU EEE . n 
C 1 124 TYR 124 453 453 TYR TYR EEE . n 
C 1 125 ARG 125 454 454 ARG ARG EEE . n 
C 1 126 LEU 126 455 455 LEU LEU EEE . n 
C 1 127 PHE 127 456 456 PHE PHE EEE . n 
C 1 128 ARG 128 457 457 ARG ARG EEE . n 
C 1 129 LYS 129 458 458 LYS LYS EEE . n 
C 1 130 SER 130 459 459 SER SER EEE . n 
C 1 131 ASN 131 460 460 ASN ASN EEE . n 
C 1 132 LEU 132 461 461 LEU LEU EEE . n 
C 1 133 LYS 133 462 462 LYS LYS EEE . n 
C 1 134 PRO 134 463 463 PRO PRO EEE . n 
C 1 135 PHE 135 464 464 PHE PHE EEE . n 
C 1 136 GLU 136 465 465 GLU GLU EEE . n 
C 1 137 ARG 137 466 466 ARG ARG EEE . n 
C 1 138 ASP 138 467 467 ASP ASP EEE . n 
C 1 139 ILE 139 468 468 ILE ILE EEE . n 
C 1 140 SER 140 469 469 SER SER EEE . n 
C 1 141 THR 141 470 470 THR THR EEE . n 
C 1 142 GLU 142 471 471 GLU GLU EEE . n 
C 1 143 ILE 143 472 472 ILE ILE EEE . n 
C 1 144 TYR 144 473 473 TYR TYR EEE . n 
C 1 145 GLN 145 474 474 GLN GLN EEE . n 
C 1 146 ALA 146 475 475 ALA ALA EEE . n 
C 1 147 GLY 147 476 476 GLY GLY EEE . n 
C 1 148 SER 148 477 477 SER SER EEE . n 
C 1 149 THR 149 478 478 THR THR EEE . n 
C 1 150 PRO 150 479 479 PRO PRO EEE . n 
C 1 151 CYS 151 480 480 CYS CYS EEE . n 
C 1 152 ASN 152 481 481 ASN ASN EEE . n 
C 1 153 GLY 153 482 482 GLY GLY EEE . n 
C 1 154 VAL 154 483 483 VAL VAL EEE . n 
C 1 155 GLU 155 484 484 GLU GLU EEE . n 
C 1 156 GLY 156 485 485 GLY GLY EEE . n 
C 1 157 PHE 157 486 486 PHE PHE EEE . n 
C 1 158 ASN 158 487 487 ASN ASN EEE . n 
C 1 159 CYS 159 488 488 CYS CYS EEE . n 
C 1 160 TYR 160 489 489 TYR TYR EEE . n 
C 1 161 PHE 161 490 490 PHE PHE EEE . n 
C 1 162 PRO 162 491 491 PRO PRO EEE . n 
C 1 163 LEU 163 492 492 LEU LEU EEE . n 
C 1 164 GLN 164 493 493 GLN GLN EEE . n 
C 1 165 SER 165 494 494 SER SER EEE . n 
C 1 166 TYR 166 495 495 TYR TYR EEE . n 
C 1 167 GLY 167 496 496 GLY GLY EEE . n 
C 1 168 PHE 168 497 497 PHE PHE EEE . n 
C 1 169 GLN 169 498 498 GLN GLN EEE . n 
C 1 170 PRO 170 499 499 PRO PRO EEE . n 
C 1 171 THR 171 500 500 THR THR EEE . n 
C 1 172 TYR 172 501 501 TYR TYR EEE . n 
C 1 173 GLY 173 502 502 GLY GLY EEE . n 
C 1 174 VAL 174 503 503 VAL VAL EEE . n 
C 1 175 GLY 175 504 504 GLY GLY EEE . n 
C 1 176 TYR 176 505 505 TYR TYR EEE . n 
C 1 177 GLN 177 506 506 GLN GLN EEE . n 
C 1 178 PRO 178 507 507 PRO PRO EEE . n 
C 1 179 TYR 179 508 508 TYR TYR EEE . n 
C 1 180 ARG 180 509 509 ARG ARG EEE . n 
C 1 181 VAL 181 510 510 VAL VAL EEE . n 
C 1 182 VAL 182 511 511 VAL VAL EEE . n 
C 1 183 VAL 183 512 512 VAL VAL EEE . n 
C 1 184 LEU 184 513 513 LEU LEU EEE . n 
C 1 185 SER 185 514 514 SER SER EEE . n 
C 1 186 PHE 186 515 515 PHE PHE EEE . n 
C 1 187 GLU 187 516 516 GLU GLU EEE . n 
C 1 188 LEU 188 517 517 LEU LEU EEE . n 
C 1 189 LEU 189 518 518 LEU LEU EEE . n 
C 1 190 HIS 190 519 519 HIS HIS EEE . n 
C 1 191 ALA 191 520 520 ALA ALA EEE . n 
C 1 192 PRO 192 521 521 PRO PRO EEE . n 
C 1 193 ALA 193 522 522 ALA ALA EEE . n 
C 1 194 THR 194 523 523 THR THR EEE . n 
C 1 195 VAL 195 524 524 VAL VAL EEE . n 
C 1 196 CYS 196 525 525 CYS CYS EEE . n 
C 1 197 GLY 197 526 526 GLY GLY EEE . n 
C 1 198 PRO 198 527 527 PRO PRO EEE . n 
C 1 199 LYS 199 528 ?   ?   ?   EEE . n 
C 1 200 LYS 200 529 ?   ?   ?   EEE . n 
C 1 201 SER 201 530 ?   ?   ?   EEE . n 
C 1 202 THR 202 531 ?   ?   ?   EEE . n 
C 1 203 ASN 203 532 ?   ?   ?   EEE . n 
C 1 204 LYS 204 533 ?   ?   ?   EEE . n 
C 1 205 HIS 205 534 ?   ?   ?   EEE . n 
C 1 206 HIS 206 535 ?   ?   ?   EEE . n 
C 1 207 HIS 207 536 ?   ?   ?   EEE . n 
C 1 208 HIS 208 537 ?   ?   ?   EEE . n 
C 1 209 HIS 209 538 ?   ?   ?   EEE . n 
C 1 210 HIS 210 539 ?   ?   ?   EEE . n 
D 2 1   MET 1   -1  ?   ?   ?   FFF . n 
D 2 2   ALA 2   0   ?   ?   ?   FFF . n 
D 2 3   GLN 3   1   1   GLN GLN FFF . n 
D 2 4   VAL 4   2   2   VAL VAL FFF . n 
D 2 5   GLN 5   3   3   GLN GLN FFF . n 
D 2 6   LEU 6   4   4   LEU LEU FFF . n 
D 2 7   VAL 7   5   5   VAL VAL FFF . n 
D 2 8   GLU 8   6   6   GLU GLU FFF . n 
D 2 9   SER 9   7   7   SER SER FFF . n 
D 2 10  GLY 10  8   8   GLY GLY FFF . n 
D 2 11  GLY 11  9   9   GLY GLY FFF . n 
D 2 12  GLY 12  10  10  GLY GLY FFF . n 
D 2 13  SER 13  11  11  SER SER FFF . n 
D 2 14  VAL 14  12  12  VAL VAL FFF . n 
D 2 15  GLN 15  13  13  GLN GLN FFF . n 
D 2 16  ALA 16  14  14  ALA ALA FFF . n 
D 2 17  GLY 17  15  15  GLY GLY FFF . n 
D 2 18  GLY 18  16  16  GLY GLY FFF . n 
D 2 19  SER 19  17  17  SER SER FFF . n 
D 2 20  LEU 20  18  18  LEU LEU FFF . n 
D 2 21  THR 21  19  19  THR THR FFF . n 
D 2 22  LEU 22  20  20  LEU LEU FFF . n 
D 2 23  SER 23  21  21  SER SER FFF . n 
D 2 24  CYS 24  22  22  CYS CYS FFF . n 
D 2 25  VAL 25  23  23  VAL VAL FFF . n 
D 2 26  ALA 26  24  24  ALA ALA FFF . n 
D 2 27  SER 27  25  25  SER SER FFF . n 
D 2 28  GLY 28  26  26  GLY GLY FFF . n 
D 2 29  VAL 29  27  27  VAL VAL FFF . n 
D 2 30  THR 30  28  28  THR THR FFF . n 
D 2 31  LEU 31  29  29  LEU LEU FFF . n 
D 2 32  GLY 32  30  30  GLY GLY FFF . n 
D 2 33  ARG 33  31  31  ARG ARG FFF . n 
D 2 34  HIS 34  32  32  HIS HIS FFF . n 
D 2 35  ALA 35  33  33  ALA ALA FFF . n 
D 2 36  ILE 36  34  34  ILE ILE FFF . n 
D 2 37  GLY 37  35  35  GLY GLY FFF . n 
D 2 38  TRP 38  36  36  TRP TRP FFF . n 
D 2 39  PHE 39  37  37  PHE PHE FFF . n 
D 2 40  ARG 40  38  38  ARG ARG FFF . n 
D 2 41  GLN 41  39  39  GLN GLN FFF . n 
D 2 42  ALA 42  40  40  ALA ALA FFF . n 
D 2 43  PRO 43  41  41  PRO PRO FFF . n 
D 2 44  GLY 44  42  42  GLY GLY FFF . n 
D 2 45  LYS 45  43  43  LYS LYS FFF . n 
D 2 46  GLU 46  44  44  GLU GLU FFF . n 
D 2 47  ARG 47  45  45  ARG ARG FFF . n 
D 2 48  GLU 48  46  46  GLU GLU FFF . n 
D 2 49  ARG 49  47  47  ARG ARG FFF . n 
D 2 50  VAL 50  48  48  VAL VAL FFF . n 
D 2 51  SER 51  49  49  SER SER FFF . n 
D 2 52  CYS 52  50  50  CYS CYS FFF . n 
D 2 53  ILE 53  51  51  ILE ILE FFF . n 
D 2 54  ARG 54  52  52  ARG ARG FFF . n 
D 2 55  THR 55  53  53  THR THR FFF . n 
D 2 56  PHE 56  54  54  PHE PHE FFF . n 
D 2 57  ASP 57  55  55  ASP ASP FFF . n 
D 2 58  GLY 58  56  56  GLY GLY FFF . n 
D 2 59  ILE 59  57  57  ILE ILE FFF . n 
D 2 60  THR 60  58  58  THR THR FFF . n 
D 2 61  SER 61  59  59  SER SER FFF . n 
D 2 62  TYR 62  60  60  TYR TYR FFF . n 
D 2 63  VAL 63  61  61  VAL VAL FFF . n 
D 2 64  GLU 64  62  62  GLU GLU FFF . n 
D 2 65  SER 65  63  63  SER SER FFF . n 
D 2 66  THR 66  64  64  THR THR FFF . n 
D 2 67  LYS 67  65  65  LYS LYS FFF . n 
D 2 68  GLY 68  66  66  GLY GLY FFF . n 
D 2 69  ARG 69  67  67  ARG ARG FFF . n 
D 2 70  PHE 70  68  68  PHE PHE FFF . n 
D 2 71  THR 71  69  69  THR THR FFF . n 
D 2 72  ILE 72  70  70  ILE ILE FFF . n 
D 2 73  SER 73  71  71  SER SER FFF . n 
D 2 74  SER 74  72  72  SER SER FFF . n 
D 2 75  ASN 75  73  73  ASN ASN FFF . n 
D 2 76  ASN 76  74  74  ASN ASN FFF . n 
D 2 77  ALA 77  75  75  ALA ALA FFF . n 
D 2 78  MET 78  76  76  MET MET FFF . n 
D 2 79  ASN 79  77  77  ASN ASN FFF . n 
D 2 80  THR 80  78  78  THR THR FFF . n 
D 2 81  VAL 81  79  79  VAL VAL FFF . n 
D 2 82  TYR 82  80  80  TYR TYR FFF . n 
D 2 83  LEU 83  81  81  LEU LEU FFF . n 
D 2 84  GLN 84  82  82  GLN GLN FFF . n 
D 2 85  MET 85  83  83  MET MET FFF . n 
D 2 86  ASN 86  84  84  ASN ASN FFF . n 
D 2 87  SER 87  85  85  SER SER FFF . n 
D 2 88  LEU 88  86  86  LEU LEU FFF . n 
D 2 89  LYS 89  87  87  LYS LYS FFF . n 
D 2 90  PRO 90  88  88  PRO PRO FFF . n 
D 2 91  GLU 91  89  89  GLU GLU FFF . n 
D 2 92  ASP 92  90  90  ASP ASP FFF . n 
D 2 93  THR 93  91  91  THR THR FFF . n 
D 2 94  ALA 94  92  92  ALA ALA FFF . n 
D 2 95  VAL 95  93  93  VAL VAL FFF . n 
D 2 96  TYR 96  94  94  TYR TYR FFF . n 
D 2 97  PHE 97  95  95  PHE PHE FFF . n 
D 2 98  CYS 98  96  96  CYS CYS FFF . n 
D 2 99  ALA 99  97  97  ALA ALA FFF . n 
D 2 100 LEU 100 98  98  LEU LEU FFF . n 
D 2 101 GLY 101 99  99  GLY GLY FFF . n 
D 2 102 VAL 102 100 100 VAL VAL FFF . n 
D 2 103 THR 103 101 101 THR THR FFF . n 
D 2 104 ALA 104 102 102 ALA ALA FFF . n 
D 2 105 ALA 105 103 103 ALA ALA FFF . n 
D 2 106 CYS 106 104 104 CYS CYS FFF . n 
D 2 107 SER 107 105 105 SER SER FFF . n 
D 2 108 ASP 108 106 106 ASP ASP FFF . n 
D 2 109 ASN 109 107 107 ASN ASN FFF . n 
D 2 110 PRO 110 108 108 PRO PRO FFF . n 
D 2 111 TYR 111 109 109 TYR TYR FFF . n 
D 2 112 PHE 112 110 110 PHE PHE FFF . n 
D 2 113 TRP 113 111 111 TRP TRP FFF . n 
D 2 114 GLY 114 112 112 GLY GLY FFF . n 
D 2 115 GLN 115 113 113 GLN GLN FFF . n 
D 2 116 GLY 116 114 114 GLY GLY FFF . n 
D 2 117 THR 117 115 115 THR THR FFF . n 
D 2 118 GLN 118 116 116 GLN GLN FFF . n 
D 2 119 VAL 119 117 117 VAL VAL FFF . n 
D 2 120 THR 120 118 118 THR THR FFF . n 
D 2 121 VAL 121 119 119 VAL VAL FFF . n 
D 2 122 SER 122 120 120 SER SER FFF . n 
D 2 123 SER 123 121 121 SER SER FFF . n 
D 2 124 HIS 124 122 ?   ?   ?   FFF . n 
D 2 125 HIS 125 123 ?   ?   ?   FFF . n 
D 2 126 HIS 126 124 ?   ?   ?   FFF . n 
D 2 127 HIS 127 125 ?   ?   ?   FFF . n 
D 2 128 HIS 128 126 ?   ?   ?   FFF . n 
D 2 129 HIS 129 127 ?   ?   ?   FFF . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
E 3 NAG 1   601 601 NAG NAG AAA . 
F 4 GOL 1   201 1   GOL GOL BBB . 
G 3 NAG 1   601 601 NAG NAG EEE . 
H 5 HOH 1   701 194 HOH HOH AAA . 
H 5 HOH 2   702 27  HOH HOH AAA . 
H 5 HOH 3   703 256 HOH HOH AAA . 
H 5 HOH 4   704 470 HOH HOH AAA . 
H 5 HOH 5   705 353 HOH HOH AAA . 
H 5 HOH 6   706 405 HOH HOH AAA . 
H 5 HOH 7   707 222 HOH HOH AAA . 
H 5 HOH 8   708 410 HOH HOH AAA . 
H 5 HOH 9   709 21  HOH HOH AAA . 
H 5 HOH 10  710 142 HOH HOH AAA . 
H 5 HOH 11  711 407 HOH HOH AAA . 
H 5 HOH 12  712 45  HOH HOH AAA . 
H 5 HOH 13  713 178 HOH HOH AAA . 
H 5 HOH 14  714 235 HOH HOH AAA . 
H 5 HOH 15  715 401 HOH HOH AAA . 
H 5 HOH 16  716 223 HOH HOH AAA . 
H 5 HOH 17  717 397 HOH HOH AAA . 
H 5 HOH 18  718 2   HOH HOH AAA . 
H 5 HOH 19  719 195 HOH HOH AAA . 
H 5 HOH 20  720 409 HOH HOH AAA . 
H 5 HOH 21  721 38  HOH HOH AAA . 
H 5 HOH 22  722 417 HOH HOH AAA . 
H 5 HOH 23  723 176 HOH HOH AAA . 
H 5 HOH 24  724 37  HOH HOH AAA . 
H 5 HOH 25  725 63  HOH HOH AAA . 
H 5 HOH 26  726 173 HOH HOH AAA . 
H 5 HOH 27  727 149 HOH HOH AAA . 
H 5 HOH 28  728 34  HOH HOH AAA . 
H 5 HOH 29  729 39  HOH HOH AAA . 
H 5 HOH 30  730 346 HOH HOH AAA . 
H 5 HOH 31  731 393 HOH HOH AAA . 
H 5 HOH 32  732 272 HOH HOH AAA . 
H 5 HOH 33  733 85  HOH HOH AAA . 
H 5 HOH 34  734 341 HOH HOH AAA . 
H 5 HOH 35  735 186 HOH HOH AAA . 
H 5 HOH 36  736 255 HOH HOH AAA . 
H 5 HOH 37  737 20  HOH HOH AAA . 
H 5 HOH 38  738 41  HOH HOH AAA . 
H 5 HOH 39  739 412 HOH HOH AAA . 
H 5 HOH 40  740 94  HOH HOH AAA . 
H 5 HOH 41  741 24  HOH HOH AAA . 
H 5 HOH 42  742 3   HOH HOH AAA . 
H 5 HOH 43  743 5   HOH HOH AAA . 
H 5 HOH 44  744 117 HOH HOH AAA . 
H 5 HOH 45  745 25  HOH HOH AAA . 
H 5 HOH 46  746 8   HOH HOH AAA . 
H 5 HOH 47  747 42  HOH HOH AAA . 
H 5 HOH 48  748 82  HOH HOH AAA . 
H 5 HOH 49  749 150 HOH HOH AAA . 
H 5 HOH 50  750 167 HOH HOH AAA . 
H 5 HOH 51  751 130 HOH HOH AAA . 
H 5 HOH 52  752 162 HOH HOH AAA . 
H 5 HOH 53  753 64  HOH HOH AAA . 
H 5 HOH 54  754 471 HOH HOH AAA . 
H 5 HOH 55  755 49  HOH HOH AAA . 
H 5 HOH 56  756 33  HOH HOH AAA . 
H 5 HOH 57  757 129 HOH HOH AAA . 
H 5 HOH 58  758 200 HOH HOH AAA . 
H 5 HOH 59  759 76  HOH HOH AAA . 
H 5 HOH 60  760 172 HOH HOH AAA . 
H 5 HOH 61  761 282 HOH HOH AAA . 
H 5 HOH 62  762 179 HOH HOH AAA . 
H 5 HOH 63  763 269 HOH HOH AAA . 
H 5 HOH 64  764 225 HOH HOH AAA . 
H 5 HOH 65  765 62  HOH HOH AAA . 
H 5 HOH 66  766 7   HOH HOH AAA . 
H 5 HOH 67  767 61  HOH HOH AAA . 
H 5 HOH 68  768 290 HOH HOH AAA . 
H 5 HOH 69  769 358 HOH HOH AAA . 
H 5 HOH 70  770 352 HOH HOH AAA . 
H 5 HOH 71  771 71  HOH HOH AAA . 
H 5 HOH 72  772 54  HOH HOH AAA . 
H 5 HOH 73  773 53  HOH HOH AAA . 
H 5 HOH 74  774 330 HOH HOH AAA . 
H 5 HOH 75  775 146 HOH HOH AAA . 
H 5 HOH 76  776 17  HOH HOH AAA . 
H 5 HOH 77  777 267 HOH HOH AAA . 
H 5 HOH 78  778 99  HOH HOH AAA . 
H 5 HOH 79  779 168 HOH HOH AAA . 
H 5 HOH 80  780 14  HOH HOH AAA . 
H 5 HOH 81  781 224 HOH HOH AAA . 
H 5 HOH 82  782 349 HOH HOH AAA . 
H 5 HOH 83  783 31  HOH HOH AAA . 
H 5 HOH 84  784 24  HOH HOH AAA . 
H 5 HOH 85  785 19  HOH HOH AAA . 
H 5 HOH 86  786 92  HOH HOH AAA . 
H 5 HOH 87  787 170 HOH HOH AAA . 
H 5 HOH 88  788 74  HOH HOH AAA . 
H 5 HOH 89  789 361 HOH HOH AAA . 
H 5 HOH 90  790 78  HOH HOH AAA . 
H 5 HOH 91  791 47  HOH HOH AAA . 
H 5 HOH 92  792 84  HOH HOH AAA . 
H 5 HOH 93  793 38  HOH HOH AAA . 
H 5 HOH 94  794 411 HOH HOH AAA . 
H 5 HOH 95  795 12  HOH HOH AAA . 
H 5 HOH 96  796 56  HOH HOH AAA . 
H 5 HOH 97  797 273 HOH HOH AAA . 
H 5 HOH 98  798 347 HOH HOH AAA . 
H 5 HOH 99  799 88  HOH HOH AAA . 
H 5 HOH 100 800 14  HOH HOH AAA . 
H 5 HOH 101 801 322 HOH HOH AAA . 
H 5 HOH 102 802 125 HOH HOH AAA . 
H 5 HOH 103 803 55  HOH HOH AAA . 
H 5 HOH 104 804 23  HOH HOH AAA . 
H 5 HOH 105 805 243 HOH HOH AAA . 
H 5 HOH 106 806 15  HOH HOH AAA . 
H 5 HOH 107 807 209 HOH HOH AAA . 
H 5 HOH 108 808 124 HOH HOH AAA . 
H 5 HOH 109 809 220 HOH HOH AAA . 
H 5 HOH 110 810 28  HOH HOH AAA . 
H 5 HOH 111 811 285 HOH HOH AAA . 
H 5 HOH 112 812 262 HOH HOH AAA . 
H 5 HOH 113 813 416 HOH HOH AAA . 
H 5 HOH 114 814 126 HOH HOH AAA . 
H 5 HOH 115 815 5   HOH HOH AAA . 
H 5 HOH 116 816 10  HOH HOH AAA . 
H 5 HOH 117 817 406 HOH HOH AAA . 
H 5 HOH 118 818 100 HOH HOH AAA . 
H 5 HOH 119 819 237 HOH HOH AAA . 
H 5 HOH 120 820 408 HOH HOH AAA . 
H 5 HOH 121 821 418 HOH HOH AAA . 
H 5 HOH 122 822 373 HOH HOH AAA . 
H 5 HOH 123 823 123 HOH HOH AAA . 
H 5 HOH 124 824 399 HOH HOH AAA . 
H 5 HOH 125 825 3   HOH HOH AAA . 
H 5 HOH 126 826 286 HOH HOH AAA . 
H 5 HOH 127 827 364 HOH HOH AAA . 
H 5 HOH 128 828 11  HOH HOH AAA . 
H 5 HOH 129 829 35  HOH HOH AAA . 
H 5 HOH 130 830 284 HOH HOH AAA . 
H 5 HOH 131 831 95  HOH HOH AAA . 
H 5 HOH 132 832 203 HOH HOH AAA . 
H 5 HOH 133 833 185 HOH HOH AAA . 
H 5 HOH 134 834 469 HOH HOH AAA . 
H 5 HOH 135 835 2   HOH HOH AAA . 
H 5 HOH 136 836 2   HOH HOH AAA . 
H 5 HOH 137 837 32  HOH HOH AAA . 
H 5 HOH 138 838 466 HOH HOH AAA . 
H 5 HOH 139 839 398 HOH HOH AAA . 
H 5 HOH 140 840 157 HOH HOH AAA . 
H 5 HOH 141 841 302 HOH HOH AAA . 
H 5 HOH 142 842 25  HOH HOH AAA . 
H 5 HOH 143 843 27  HOH HOH AAA . 
H 5 HOH 144 844 127 HOH HOH AAA . 
H 5 HOH 145 845 199 HOH HOH AAA . 
H 5 HOH 146 846 303 HOH HOH AAA . 
H 5 HOH 147 847 413 HOH HOH AAA . 
H 5 HOH 148 848 402 HOH HOH AAA . 
H 5 HOH 149 849 242 HOH HOH AAA . 
I 5 HOH 1   301 264 HOH HOH BBB . 
I 5 HOH 2   302 111 HOH HOH BBB . 
I 5 HOH 3   303 30  HOH HOH BBB . 
I 5 HOH 4   304 118 HOH HOH BBB . 
I 5 HOH 5   305 377 HOH HOH BBB . 
I 5 HOH 6   306 208 HOH HOH BBB . 
I 5 HOH 7   307 108 HOH HOH BBB . 
I 5 HOH 8   308 166 HOH HOH BBB . 
I 5 HOH 9   309 374 HOH HOH BBB . 
I 5 HOH 10  310 9   HOH HOH BBB . 
I 5 HOH 11  311 147 HOH HOH BBB . 
I 5 HOH 12  312 356 HOH HOH BBB . 
I 5 HOH 13  313 295 HOH HOH BBB . 
I 5 HOH 14  314 7   HOH HOH BBB . 
I 5 HOH 15  315 143 HOH HOH BBB . 
I 5 HOH 16  316 196 HOH HOH BBB . 
I 5 HOH 17  317 321 HOH HOH BBB . 
I 5 HOH 18  318 263 HOH HOH BBB . 
I 5 HOH 19  319 10  HOH HOH BBB . 
I 5 HOH 20  320 77  HOH HOH BBB . 
I 5 HOH 21  321 354 HOH HOH BBB . 
I 5 HOH 22  322 115 HOH HOH BBB . 
I 5 HOH 23  323 343 HOH HOH BBB . 
I 5 HOH 24  324 91  HOH HOH BBB . 
I 5 HOH 25  325 294 HOH HOH BBB . 
I 5 HOH 26  326 59  HOH HOH BBB . 
I 5 HOH 27  327 241 HOH HOH BBB . 
I 5 HOH 28  328 319 HOH HOH BBB . 
I 5 HOH 29  329 2   HOH HOH BBB . 
I 5 HOH 30  330 113 HOH HOH BBB . 
I 5 HOH 31  331 107 HOH HOH BBB . 
I 5 HOH 32  332 403 HOH HOH BBB . 
I 5 HOH 33  333 211 HOH HOH BBB . 
I 5 HOH 34  334 187 HOH HOH BBB . 
I 5 HOH 35  335 221 HOH HOH BBB . 
I 5 HOH 36  336 51  HOH HOH BBB . 
I 5 HOH 37  337 174 HOH HOH BBB . 
I 5 HOH 38  338 164 HOH HOH BBB . 
I 5 HOH 39  339 281 HOH HOH BBB . 
I 5 HOH 40  340 270 HOH HOH BBB . 
I 5 HOH 41  341 80  HOH HOH BBB . 
I 5 HOH 42  342 229 HOH HOH BBB . 
I 5 HOH 43  343 101 HOH HOH BBB . 
I 5 HOH 44  344 72  HOH HOH BBB . 
I 5 HOH 45  345 204 HOH HOH BBB . 
I 5 HOH 46  346 119 HOH HOH BBB . 
I 5 HOH 47  347 44  HOH HOH BBB . 
I 5 HOH 48  348 32  HOH HOH BBB . 
I 5 HOH 49  349 245 HOH HOH BBB . 
I 5 HOH 50  350 152 HOH HOH BBB . 
I 5 HOH 51  351 137 HOH HOH BBB . 
I 5 HOH 52  352 20  HOH HOH BBB . 
I 5 HOH 53  353 22  HOH HOH BBB . 
I 5 HOH 54  354 102 HOH HOH BBB . 
I 5 HOH 55  355 387 HOH HOH BBB . 
I 5 HOH 56  356 202 HOH HOH BBB . 
I 5 HOH 57  357 104 HOH HOH BBB . 
I 5 HOH 58  358 105 HOH HOH BBB . 
I 5 HOH 59  359 184 HOH HOH BBB . 
I 5 HOH 60  360 244 HOH HOH BBB . 
I 5 HOH 61  361 9   HOH HOH BBB . 
I 5 HOH 62  362 376 HOH HOH BBB . 
I 5 HOH 63  363 140 HOH HOH BBB . 
I 5 HOH 64  364 112 HOH HOH BBB . 
I 5 HOH 65  365 103 HOH HOH BBB . 
I 5 HOH 66  366 116 HOH HOH BBB . 
I 5 HOH 67  367 16  HOH HOH BBB . 
I 5 HOH 68  368 226 HOH HOH BBB . 
I 5 HOH 69  369 350 HOH HOH BBB . 
I 5 HOH 70  370 278 HOH HOH BBB . 
I 5 HOH 71  371 106 HOH HOH BBB . 
I 5 HOH 72  372 230 HOH HOH BBB . 
I 5 HOH 73  373 357 HOH HOH BBB . 
I 5 HOH 74  374 251 HOH HOH BBB . 
I 5 HOH 75  375 207 HOH HOH BBB . 
I 5 HOH 76  376 396 HOH HOH BBB . 
I 5 HOH 77  377 109 HOH HOH BBB . 
I 5 HOH 78  378 218 HOH HOH BBB . 
I 5 HOH 79  379 29  HOH HOH BBB . 
I 5 HOH 80  380 299 HOH HOH BBB . 
I 5 HOH 81  381 258 HOH HOH BBB . 
I 5 HOH 82  382 198 HOH HOH BBB . 
I 5 HOH 83  383 289 HOH HOH BBB . 
I 5 HOH 84  384 216 HOH HOH BBB . 
I 5 HOH 85  385 192 HOH HOH BBB . 
I 5 HOH 86  386 155 HOH HOH BBB . 
I 5 HOH 87  387 165 HOH HOH BBB . 
I 5 HOH 88  388 271 HOH HOH BBB . 
I 5 HOH 89  389 228 HOH HOH BBB . 
I 5 HOH 90  390 261 HOH HOH BBB . 
I 5 HOH 91  391 240 HOH HOH BBB . 
I 5 HOH 92  392 232 HOH HOH BBB . 
I 5 HOH 93  393 250 HOH HOH BBB . 
J 5 HOH 1   701 365 HOH HOH EEE . 
J 5 HOH 2   702 83  HOH HOH EEE . 
J 5 HOH 3   703 467 HOH HOH EEE . 
J 5 HOH 4   704 247 HOH HOH EEE . 
J 5 HOH 5   705 434 HOH HOH EEE . 
J 5 HOH 6   706 360 HOH HOH EEE . 
J 5 HOH 7   707 233 HOH HOH EEE . 
J 5 HOH 8   708 337 HOH HOH EEE . 
J 5 HOH 9   709 317 HOH HOH EEE . 
J 5 HOH 10  710 193 HOH HOH EEE . 
J 5 HOH 11  711 236 HOH HOH EEE . 
J 5 HOH 12  712 58  HOH HOH EEE . 
J 5 HOH 13  713 426 HOH HOH EEE . 
J 5 HOH 14  714 439 HOH HOH EEE . 
J 5 HOH 15  715 227 HOH HOH EEE . 
J 5 HOH 16  716 332 HOH HOH EEE . 
J 5 HOH 17  717 81  HOH HOH EEE . 
J 5 HOH 18  718 342 HOH HOH EEE . 
J 5 HOH 19  719 36  HOH HOH EEE . 
J 5 HOH 20  720 17  HOH HOH EEE . 
J 5 HOH 21  721 175 HOH HOH EEE . 
J 5 HOH 22  722 388 HOH HOH EEE . 
J 5 HOH 23  723 436 HOH HOH EEE . 
J 5 HOH 24  724 23  HOH HOH EEE . 
J 5 HOH 25  725 318 HOH HOH EEE . 
J 5 HOH 26  726 205 HOH HOH EEE . 
J 5 HOH 27  727 389 HOH HOH EEE . 
J 5 HOH 28  728 110 HOH HOH EEE . 
J 5 HOH 29  729 444 HOH HOH EEE . 
J 5 HOH 30  730 19  HOH HOH EEE . 
J 5 HOH 31  731 274 HOH HOH EEE . 
J 5 HOH 32  732 120 HOH HOH EEE . 
J 5 HOH 33  733 458 HOH HOH EEE . 
J 5 HOH 34  734 190 HOH HOH EEE . 
J 5 HOH 35  735 21  HOH HOH EEE . 
J 5 HOH 36  736 15  HOH HOH EEE . 
J 5 HOH 37  737 18  HOH HOH EEE . 
J 5 HOH 38  738 316 HOH HOH EEE . 
J 5 HOH 39  739 1   HOH HOH EEE . 
J 5 HOH 40  740 182 HOH HOH EEE . 
J 5 HOH 41  741 217 HOH HOH EEE . 
J 5 HOH 42  742 395 HOH HOH EEE . 
J 5 HOH 43  743 449 HOH HOH EEE . 
J 5 HOH 44  744 298 HOH HOH EEE . 
J 5 HOH 45  745 68  HOH HOH EEE . 
J 5 HOH 46  746 136 HOH HOH EEE . 
J 5 HOH 47  747 468 HOH HOH EEE . 
J 5 HOH 48  748 40  HOH HOH EEE . 
J 5 HOH 49  749 48  HOH HOH EEE . 
J 5 HOH 50  750 144 HOH HOH EEE . 
J 5 HOH 51  751 60  HOH HOH EEE . 
J 5 HOH 52  752 13  HOH HOH EEE . 
J 5 HOH 53  753 57  HOH HOH EEE . 
J 5 HOH 54  754 310 HOH HOH EEE . 
J 5 HOH 55  755 334 HOH HOH EEE . 
J 5 HOH 56  756 160 HOH HOH EEE . 
J 5 HOH 57  757 371 HOH HOH EEE . 
J 5 HOH 58  758 181 HOH HOH EEE . 
J 5 HOH 59  759 26  HOH HOH EEE . 
J 5 HOH 60  760 50  HOH HOH EEE . 
J 5 HOH 61  761 34  HOH HOH EEE . 
J 5 HOH 62  762 314 HOH HOH EEE . 
J 5 HOH 63  763 246 HOH HOH EEE . 
J 5 HOH 64  764 96  HOH HOH EEE . 
J 5 HOH 65  765 206 HOH HOH EEE . 
J 5 HOH 66  766 141 HOH HOH EEE . 
J 5 HOH 67  767 3   HOH HOH EEE . 
J 5 HOH 68  768 70  HOH HOH EEE . 
J 5 HOH 69  769 46  HOH HOH EEE . 
J 5 HOH 70  770 180 HOH HOH EEE . 
J 5 HOH 71  771 340 HOH HOH EEE . 
J 5 HOH 72  772 313 HOH HOH EEE . 
J 5 HOH 73  773 348 HOH HOH EEE . 
J 5 HOH 74  774 151 HOH HOH EEE . 
J 5 HOH 75  775 239 HOH HOH EEE . 
J 5 HOH 76  776 98  HOH HOH EEE . 
J 5 HOH 77  777 73  HOH HOH EEE . 
J 5 HOH 78  778 133 HOH HOH EEE . 
J 5 HOH 79  779 339 HOH HOH EEE . 
J 5 HOH 80  780 309 HOH HOH EEE . 
J 5 HOH 81  781 122 HOH HOH EEE . 
J 5 HOH 82  782 131 HOH HOH EEE . 
J 5 HOH 83  783 66  HOH HOH EEE . 
J 5 HOH 84  784 327 HOH HOH EEE . 
J 5 HOH 85  785 191 HOH HOH EEE . 
J 5 HOH 86  786 326 HOH HOH EEE . 
J 5 HOH 87  787 139 HOH HOH EEE . 
J 5 HOH 88  788 328 HOH HOH EEE . 
J 5 HOH 89  789 362 HOH HOH EEE . 
J 5 HOH 90  790 379 HOH HOH EEE . 
J 5 HOH 91  791 463 HOH HOH EEE . 
J 5 HOH 92  792 39  HOH HOH EEE . 
J 5 HOH 93  793 8   HOH HOH EEE . 
J 5 HOH 94  794 301 HOH HOH EEE . 
J 5 HOH 95  795 6   HOH HOH EEE . 
J 5 HOH 96  796 67  HOH HOH EEE . 
J 5 HOH 97  797 11  HOH HOH EEE . 
J 5 HOH 98  798 277 HOH HOH EEE . 
J 5 HOH 99  799 22  HOH HOH EEE . 
J 5 HOH 100 800 446 HOH HOH EEE . 
J 5 HOH 101 801 325 HOH HOH EEE . 
J 5 HOH 102 802 158 HOH HOH EEE . 
J 5 HOH 103 803 135 HOH HOH EEE . 
J 5 HOH 104 804 391 HOH HOH EEE . 
J 5 HOH 105 805 134 HOH HOH EEE . 
J 5 HOH 106 806 69  HOH HOH EEE . 
J 5 HOH 107 807 169 HOH HOH EEE . 
J 5 HOH 108 808 375 HOH HOH EEE . 
J 5 HOH 109 809 363 HOH HOH EEE . 
J 5 HOH 110 810 177 HOH HOH EEE . 
J 5 HOH 111 811 445 HOH HOH EEE . 
J 5 HOH 112 812 29  HOH HOH EEE . 
J 5 HOH 113 813 344 HOH HOH EEE . 
J 5 HOH 114 814 171 HOH HOH EEE . 
J 5 HOH 115 815 35  HOH HOH EEE . 
J 5 HOH 116 816 86  HOH HOH EEE . 
J 5 HOH 117 817 447 HOH HOH EEE . 
J 5 HOH 118 818 37  HOH HOH EEE . 
J 5 HOH 119 819 254 HOH HOH EEE . 
J 5 HOH 120 820 338 HOH HOH EEE . 
J 5 HOH 121 821 323 HOH HOH EEE . 
J 5 HOH 122 822 293 HOH HOH EEE . 
J 5 HOH 123 823 28  HOH HOH EEE . 
J 5 HOH 124 824 197 HOH HOH EEE . 
J 5 HOH 125 825 331 HOH HOH EEE . 
J 5 HOH 126 826 4   HOH HOH EEE . 
J 5 HOH 127 827 238 HOH HOH EEE . 
J 5 HOH 128 828 351 HOH HOH EEE . 
J 5 HOH 129 829 461 HOH HOH EEE . 
J 5 HOH 130 830 390 HOH HOH EEE . 
J 5 HOH 131 831 369 HOH HOH EEE . 
J 5 HOH 132 832 26  HOH HOH EEE . 
J 5 HOH 133 833 183 HOH HOH EEE . 
J 5 HOH 134 834 437 HOH HOH EEE . 
J 5 HOH 135 835 283 HOH HOH EEE . 
J 5 HOH 136 836 288 HOH HOH EEE . 
J 5 HOH 137 837 9   HOH HOH EEE . 
J 5 HOH 138 838 380 HOH HOH EEE . 
J 5 HOH 139 839 300 HOH HOH EEE . 
J 5 HOH 140 840 257 HOH HOH EEE . 
J 5 HOH 141 841 304 HOH HOH EEE . 
J 5 HOH 142 842 448 HOH HOH EEE . 
J 5 HOH 143 843 394 HOH HOH EEE . 
J 5 HOH 144 844 423 HOH HOH EEE . 
J 5 HOH 145 845 465 HOH HOH EEE . 
J 5 HOH 146 846 307 HOH HOH EEE . 
J 5 HOH 147 847 7   HOH HOH EEE . 
J 5 HOH 148 848 459 HOH HOH EEE . 
J 5 HOH 149 849 93  HOH HOH EEE . 
J 5 HOH 150 850 153 HOH HOH EEE . 
J 5 HOH 151 851 188 HOH HOH EEE . 
J 5 HOH 152 852 97  HOH HOH EEE . 
J 5 HOH 153 853 428 HOH HOH EEE . 
J 5 HOH 154 854 438 HOH HOH EEE . 
J 5 HOH 155 855 306 HOH HOH EEE . 
J 5 HOH 156 856 385 HOH HOH EEE . 
J 5 HOH 157 857 454 HOH HOH EEE . 
J 5 HOH 158 858 79  HOH HOH EEE . 
J 5 HOH 159 859 279 HOH HOH EEE . 
J 5 HOH 160 860 462 HOH HOH EEE . 
J 5 HOH 161 861 392 HOH HOH EEE . 
K 5 HOH 1   201 452 HOH HOH FFF . 
K 5 HOH 2   202 296 HOH HOH FFF . 
K 5 HOH 3   203 335 HOH HOH FFF . 
K 5 HOH 4   204 260 HOH HOH FFF . 
K 5 HOH 5   205 429 HOH HOH FFF . 
K 5 HOH 6   206 1   HOH HOH FFF . 
K 5 HOH 7   207 370 HOH HOH FFF . 
K 5 HOH 8   208 419 HOH HOH FFF . 
K 5 HOH 9   209 280 HOH HOH FFF . 
K 5 HOH 10  210 424 HOH HOH FFF . 
K 5 HOH 11  211 201 HOH HOH FFF . 
K 5 HOH 12  212 433 HOH HOH FFF . 
K 5 HOH 13  213 473 HOH HOH FFF . 
K 5 HOH 14  214 163 HOH HOH FFF . 
K 5 HOH 15  215 65  HOH HOH FFF . 
K 5 HOH 16  216 89  HOH HOH FFF . 
K 5 HOH 17  217 128 HOH HOH FFF . 
K 5 HOH 18  218 266 HOH HOH FFF . 
K 5 HOH 19  219 456 HOH HOH FFF . 
K 5 HOH 20  220 384 HOH HOH FFF . 
K 5 HOH 21  221 75  HOH HOH FFF . 
K 5 HOH 22  222 12  HOH HOH FFF . 
K 5 HOH 23  223 5   HOH HOH FFF . 
K 5 HOH 24  224 308 HOH HOH FFF . 
K 5 HOH 25  225 121 HOH HOH FFF . 
K 5 HOH 26  226 355 HOH HOH FFF . 
K 5 HOH 27  227 276 HOH HOH FFF . 
K 5 HOH 28  228 156 HOH HOH FFF . 
K 5 HOH 29  229 422 HOH HOH FFF . 
K 5 HOH 30  230 320 HOH HOH FFF . 
K 5 HOH 31  231 265 HOH HOH FFF . 
K 5 HOH 32  232 87  HOH HOH FFF . 
K 5 HOH 33  233 114 HOH HOH FFF . 
K 5 HOH 34  234 43  HOH HOH FFF . 
K 5 HOH 35  235 368 HOH HOH FFF . 
K 5 HOH 36  236 324 HOH HOH FFF . 
K 5 HOH 37  237 52  HOH HOH FFF . 
K 5 HOH 38  238 464 HOH HOH FFF . 
K 5 HOH 39  239 214 HOH HOH FFF . 
K 5 HOH 40  240 415 HOH HOH FFF . 
K 5 HOH 41  241 154 HOH HOH FFF . 
K 5 HOH 42  242 311 HOH HOH FFF . 
K 5 HOH 43  243 345 HOH HOH FFF . 
K 5 HOH 44  244 430 HOH HOH FFF . 
K 5 HOH 45  245 90  HOH HOH FFF . 
K 5 HOH 46  246 248 HOH HOH FFF . 
K 5 HOH 47  247 215 HOH HOH FFF . 
K 5 HOH 48  248 381 HOH HOH FFF . 
K 5 HOH 49  249 333 HOH HOH FFF . 
K 5 HOH 50  250 315 HOH HOH FFF . 
K 5 HOH 51  251 329 HOH HOH FFF . 
K 5 HOH 52  252 420 HOH HOH FFF . 
K 5 HOH 53  253 336 HOH HOH FFF . 
K 5 HOH 54  254 138 HOH HOH FFF . 
K 5 HOH 55  255 11  HOH HOH FFF . 
K 5 HOH 56  256 367 HOH HOH FFF . 
K 5 HOH 57  257 5   HOH HOH FFF . 
K 5 HOH 58  258 472 HOH HOH FFF . 
K 5 HOH 59  259 453 HOH HOH FFF . 
K 5 HOH 60  260 457 HOH HOH FFF . 
K 5 HOH 61  261 145 HOH HOH FFF . 
K 5 HOH 62  262 159 HOH HOH FFF . 
K 5 HOH 63  263 414 HOH HOH FFF . 
K 5 HOH 64  264 425 HOH HOH FFF . 
K 5 HOH 65  265 253 HOH HOH FFF . 
K 5 HOH 66  266 189 HOH HOH FFF . 
K 5 HOH 67  267 386 HOH HOH FFF . 
# 
loop_
_pdbx_struct_assembly.id 
_pdbx_struct_assembly.details 
_pdbx_struct_assembly.method_details 
_pdbx_struct_assembly.oligomeric_details 
_pdbx_struct_assembly.oligomeric_count 
1 author_and_software_defined_assembly PISA dimeric 2 
2 author_and_software_defined_assembly PISA dimeric 2 
# 
loop_
_pdbx_struct_assembly_gen.assembly_id 
_pdbx_struct_assembly_gen.oper_expression 
_pdbx_struct_assembly_gen.asym_id_list 
1 1 A,B,E,F,H,I 
2 1 C,D,G,J,K   
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 2010  ? 
1 MORE         -3    ? 
1 'SSA (A^2)'  15000 ? 
2 'ABSA (A^2)' 1680  ? 
2 MORE         -3    ? 
2 'SSA (A^2)'  15160 ? 
# 
_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 
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2021-08-11 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
loop_
_pdbx_refine_tls.id 
_pdbx_refine_tls.pdbx_refine_id 
_pdbx_refine_tls.details 
_pdbx_refine_tls.method 
_pdbx_refine_tls.origin_x 
_pdbx_refine_tls.origin_y 
_pdbx_refine_tls.origin_z 
_pdbx_refine_tls.T[1][1] 
_pdbx_refine_tls.T[1][1]_esd 
_pdbx_refine_tls.T[1][2] 
_pdbx_refine_tls.T[1][2]_esd 
_pdbx_refine_tls.T[1][3] 
_pdbx_refine_tls.T[1][3]_esd 
_pdbx_refine_tls.T[2][2] 
_pdbx_refine_tls.T[2][2]_esd 
_pdbx_refine_tls.T[2][3] 
_pdbx_refine_tls.T[2][3]_esd 
_pdbx_refine_tls.T[3][3] 
_pdbx_refine_tls.T[3][3]_esd 
_pdbx_refine_tls.L[1][1] 
_pdbx_refine_tls.L[1][1]_esd 
_pdbx_refine_tls.L[1][2] 
_pdbx_refine_tls.L[1][2]_esd 
_pdbx_refine_tls.L[1][3] 
_pdbx_refine_tls.L[1][3]_esd 
_pdbx_refine_tls.L[2][2] 
_pdbx_refine_tls.L[2][2]_esd 
_pdbx_refine_tls.L[2][3] 
_pdbx_refine_tls.L[2][3]_esd 
_pdbx_refine_tls.L[3][3] 
_pdbx_refine_tls.L[3][3]_esd 
_pdbx_refine_tls.S[1][1] 
_pdbx_refine_tls.S[1][1]_esd 
_pdbx_refine_tls.S[1][2] 
_pdbx_refine_tls.S[1][2]_esd 
_pdbx_refine_tls.S[1][3] 
_pdbx_refine_tls.S[1][3]_esd 
_pdbx_refine_tls.S[2][1] 
_pdbx_refine_tls.S[2][1]_esd 
_pdbx_refine_tls.S[2][2] 
_pdbx_refine_tls.S[2][2]_esd 
_pdbx_refine_tls.S[2][3] 
_pdbx_refine_tls.S[2][3]_esd 
_pdbx_refine_tls.S[3][1] 
_pdbx_refine_tls.S[3][1]_esd 
_pdbx_refine_tls.S[3][2] 
_pdbx_refine_tls.S[3][2]_esd 
_pdbx_refine_tls.S[3][3] 
_pdbx_refine_tls.S[3][3]_esd 
1  'X-RAY DIFFRACTION' ? refined 11.4230 -1.1390  -25.5300 0.2311 ? 0.0112  ? -0.0078 ? 0.1540 ? 0.0140  ? 0.1361 ? 0.8453  ? 
0.0506   ? 1.2185  ? 18.9204 ? 3.4616  ? 2.3672 ? -0.0263 ? -0.0179 ? -0.0024 ? 0.4218  ? 0.0568  ? -0.2744 ? 0.0210  ? 0.0001  ? 
-0.0305 ? 
2  'X-RAY DIFFRACTION' ? refined 13.0590 8.7750   -31.4660 0.1737 ? 0.0161  ? -0.0376 ? 0.0882 ? 0.0031  ? 0.0862 ? 1.0441  ? 
1.0786   ? -0.2402 ? 6.5546  ? -2.1966 ? 1.8768 ? 0.0389  ? -0.1718 ? -0.1541 ? 0.5111  ? -0.0841 ? -0.4401 ? 0.1525  ? 0.0649  ? 
0.0452  ? 
3  'X-RAY DIFFRACTION' ? refined 1.4740  -1.5720  -35.5790 0.2290 ? -0.0505 ? 0.0539  ? 0.1439 ? -0.0143 ? 0.2828 ? 2.3148  ? 
-1.3651  ? -0.7598 ? 4.9801  ? -0.0078 ? 0.9402 ? -0.1953 ? 0.0388  ? -0.2127 ? 0.3955  ? 0.0590  ? 0.5409  ? 0.2448  ? -0.1001 ? 
0.1363  ? 
4  'X-RAY DIFFRACTION' ? refined 8.5110  21.3490  -40.1270 0.0262 ? 0.0075  ? 0.0028  ? 0.0566 ? -0.0150 ? 0.0273 ? 1.4888  ? 
1.0192   ? -0.5221 ? 3.1578  ? -1.0980 ? 1.3008 ? -0.0320 ? 0.0251  ? -0.1020 ? -0.0075 ? 0.0395  ? 0.1292  ? 0.0594  ? -0.0802 ? 
-0.0075 ? 
5  'X-RAY DIFFRACTION' ? refined 12.9780 -6.9820  -39.5200 0.1586 ? -0.0176 ? -0.0194 ? 0.0837 ? -0.0027 ? 0.2044 ? 3.9086  ? 
-4.4325  ? -3.7229 ? 6.5954  ? 3.5869  ? 6.2282 ? -0.1684 ? -0.0646 ? 0.0129  ? -0.0008 ? -0.0694 ? -0.0629 ? 0.1400  ? -0.0768 ? 
0.2377  ? 
6  'X-RAY DIFFRACTION' ? refined 0.1440  45.4780  -36.3320 0.1320 ? 0.0022  ? 0.0351  ? 0.0913 ? 0.0003  ? 0.0661 ? 2.2830  ? 
-0.6084  ? 0.3031  ? 1.7754  ? 0.1855  ? 0.1136 ? 0.0685  ? 0.1128  ? 0.0805  ? 0.0520  ? -0.0806 ? 0.1470  ? -0.0231 ? -0.0185 ? 
0.0121  ? 
7  'X-RAY DIFFRACTION' ? refined 7.7220  54.3440  -31.4700 0.1221 ? -0.0053 ? 0.0243  ? 0.0930 ? -0.0205 ? 0.0849 ? 0.8369  ? 
-1.3073  ? 0.3183  ? 9.8954  ? -0.9445 ? 0.3504 ? -0.0220 ? -0.0350 ? 0.1574  ? 0.0145  ? 0.0138  ? -0.2263 ? -0.0194 ? 0.0380  ? 
0.0082  ? 
8  'X-RAY DIFFRACTION' ? refined 4.2530  46.5550  -29.1540 0.1689 ? -0.0226 ? 0.0334  ? 0.1035 ? -0.0279 ? 0.0359 ? 0.9918  ? 
-1.1759  ? -0.2073 ? 2.4688  ? 0.7186  ? 0.4421 ? -0.0059 ? -0.1253 ? 0.0523  ? 0.2300  ? 0.0248  ? -0.0079 ? -0.0273 ? 0.0063  ? 
-0.0190 ? 
9  'X-RAY DIFFRACTION' ? refined 1.2310  54.5100  -35.2530 0.1133 ? -0.0239 ? 0.0417  ? 0.0467 ? -0.0207 ? 0.0767 ? 6.0567  ? 
-4.1822  ? -4.0092 ? 4.2113  ? 2.7640  ? 3.8326 ? 0.0859  ? -0.1260 ? 0.1302  ? -0.0575 ? -0.0674 ? -0.0041 ? -0.1401 ? 0.0288  ? 
-0.0185 ? 
10 'X-RAY DIFFRACTION' ? refined 11.3170 -11.6470 12.4400  0.1550 ? 0.0092  ? 0.0668  ? 0.1450 ? -0.0360 ? 0.2329 ? 2.7966  ? 
-4.1620  ? 1.3130  ? 11.4563 ? -1.4796 ? 3.5881 ? -0.1648 ? -0.1810 ? 0.0987  ? 0.3907  ? 0.1671  ? 0.4051  ? -0.1941 ? -0.1982 ? 
-0.0023 ? 
11 'X-RAY DIFFRACTION' ? refined 15.5400 -8.0520  2.9560   0.0996 ? -0.0103 ? 0.0021  ? 0.0700 ? 0.0090  ? 0.1545 ? 0.6999  ? 
-0.1439  ? 0.2113  ? 3.5491  ? 0.0907  ? 0.5483 ? -0.0250 ? 0.0066  ? 0.2924  ? 0.1433  ? -0.0501 ? -0.0614 ? -0.1532 ? 0.0703  ? 
0.0751  ? 
12 'X-RAY DIFFRACTION' ? refined 14.1540 -23.7290 -2.8380  0.0280 ? -0.0020 ? 0.0046  ? 0.0384 ? 0.0105  ? 0.0225 ? 1.7106  ? 
0.9464   ? 0.6864  ? 2.5459  ? 0.8710  ? 1.3626 ? -0.0544 ? 0.1479  ? 0.1167  ? -0.1569 ? 0.0549  ? 0.1198  ? -0.0386 ? 0.0858  ? 
-0.0005 ? 
13 'X-RAY DIFFRACTION' ? refined 11.7760 -36.7350 -3.6270  0.0472 ? 0.0255  ? 0.0027  ? 0.0666 ? 0.0004  ? 0.0135 ? 2.9046  ? 
2.6610   ? 2.1338  ? 3.0524  ? 2.2793  ? 2.6816 ? 0.0872  ? 0.1592  ? -0.1185 ? 0.0857  ? 0.0643  ? -0.1227 ? 0.1562  ? 0.1011  ? 
-0.1515 ? 
14 'X-RAY DIFFRACTION' ? refined 10.0440 -3.1630  -0.4070  0.1495 ? 0.0001  ? 0.0026  ? 0.0862 ? 0.0080  ? 0.2933 ? 1.6990  ? 
-3.5108  ? 1.0699  ? 8.1834  ? -1.8834 ? 0.7897 ? 0.0589  ? 0.0279  ? -0.0099 ? -0.2043 ? -0.1214 ? 0.1942  ? 0.0144  ? -0.0019 ? 
0.0625  ? 
15 'X-RAY DIFFRACTION' ? refined 21.6280 -52.1160 0.1330   0.1723 ? -0.0008 ? -0.0585 ? 0.1004 ? -0.0230 ? 0.1257 ? 2.5359  ? 
-0.4957  ? -0.5159 ? 3.5600  ? -0.0584 ? 0.1159 ? 0.1094  ? 0.0845  ? -0.2635 ? 0.0739  ? -0.1632 ? -0.3146 ? -0.0105 ? -0.0046 ? 
0.0538  ? 
16 'X-RAY DIFFRACTION' ? refined 14.8630 -64.6610 4.9290   0.1291 ? -0.0002 ? -0.0214 ? 0.0853 ? 0.0201  ? 0.1093 ? 2.0849  ? 
0.2817   ? -0.4941 ? 12.9858 ? 4.3775  ? 3.5387 ? -0.1084 ? -0.0529 ? -0.1930 ? 0.2333  ? -0.0256 ? 0.4357  ? -0.0763 ? -0.1298 ? 
0.1340  ? 
17 'X-RAY DIFFRACTION' ? refined 16.8250 -52.8280 6.0300   0.2962 ? -0.0565 ? -0.0722 ? 0.1507 ? 0.0345  ? 0.0969 ? 1.4621  ? 
-1.4051  ? 0.0974  ? 4.0083  ? -0.2780 ? 0.1561 ? 0.0523  ? -0.1837 ? -0.1720 ? 0.4920  ? -0.0220 ? 0.0039  ? 0.0904  ? -0.0229 ? 
-0.0303 ? 
18 'X-RAY DIFFRACTION' ? refined 26.4170 -64.1890 3.2870   0.1171 ? -0.0013 ? -0.0098 ? 0.1909 ? 0.1542  ? 0.3400 ? 11.3730 ? 
-10.0100 ? 7.3904  ? 14.1367 ? -5.9343 ? 8.4650 ? 0.1324  ? 0.3381  ? -0.1892 ? 0.2501  ? -0.4261 ? -0.6179 ? 0.1651  ? 0.6447  ? 
0.2937  ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.beg_PDB_ins_code 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.end_PDB_ins_code 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1  'X-RAY DIFFRACTION' 1  ? ? AAA 334 ? ? ? AAA 340 ? ALL ? 
2  'X-RAY DIFFRACTION' 2  ? ? AAA 341 ? ? ? AAA 362 ? ALL ? 
3  'X-RAY DIFFRACTION' 3  ? ? AAA 363 ? ? ? AAA 395 ? ALL ? 
4  'X-RAY DIFFRACTION' 4  ? ? AAA 396 ? ? ? AAA 513 ? ALL ? 
5  'X-RAY DIFFRACTION' 5  ? ? AAA 514 ? ? ? AAA 527 ? ALL ? 
6  'X-RAY DIFFRACTION' 6  ? ? BBB 1   ? ? ? BBB 36  ? ALL ? 
7  'X-RAY DIFFRACTION' 7  ? ? BBB 37  ? ? ? BBB 52  ? ALL ? 
8  'X-RAY DIFFRACTION' 8  ? ? BBB 53  ? ? ? BBB 106 ? ALL ? 
9  'X-RAY DIFFRACTION' 9  ? ? BBB 107 ? ? ? BBB 122 ? ALL ? 
10 'X-RAY DIFFRACTION' 10 ? ? EEE 334 ? ? ? EEE 346 ? ALL ? 
11 'X-RAY DIFFRACTION' 11 ? ? EEE 347 ? ? ? EEE 395 ? ALL ? 
12 'X-RAY DIFFRACTION' 12 ? ? EEE 396 ? ? ? EEE 470 ? ALL ? 
13 'X-RAY DIFFRACTION' 13 ? ? EEE 471 ? ? ? EEE 509 ? ALL ? 
14 'X-RAY DIFFRACTION' 14 ? ? EEE 510 ? ? ? EEE 527 ? ALL ? 
15 'X-RAY DIFFRACTION' 15 ? ? FFF 1   ? ? ? FFF 37  ? ALL ? 
16 'X-RAY DIFFRACTION' 16 ? ? FFF 38  ? ? ? FFF 49  ? ALL ? 
17 'X-RAY DIFFRACTION' 17 ? ? FFF 50  ? ? ? FFF 111 ? ALL ? 
18 'X-RAY DIFFRACTION' 18 ? ? FFF 112 ? ? ? FFF 121 ? ALL ? 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0267 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .        4 
# 
_pdbx_entry_details.entry_id                 7OAU 
_pdbx_entry_details.has_ligand_of_interest   N 
_pdbx_entry_details.compound_details         ? 
_pdbx_entry_details.source_details           ? 
_pdbx_entry_details.nonpolymer_details       ? 
_pdbx_entry_details.sequence_details         ? 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 O  BBB HOH 352 ? ? O  BBB HOH 377 ? ? 1.90 
2 1 O  FFF HOH 208 ? ? O  FFF HOH 257 ? ? 1.91 
3 1 OG BBB SER 7   ? A OG BBB SER 21  ? ? 2.07 
4 1 O  EEE HOH 779 ? ? O  FFF HOH 257 ? ? 2.16 
# 
_pdbx_validate_rmsd_angle.id                         1 
_pdbx_validate_rmsd_angle.PDB_model_num              1 
_pdbx_validate_rmsd_angle.auth_atom_id_1             CB 
_pdbx_validate_rmsd_angle.auth_asym_id_1             EEE 
_pdbx_validate_rmsd_angle.auth_comp_id_1             TYR 
_pdbx_validate_rmsd_angle.auth_seq_id_1              501 
_pdbx_validate_rmsd_angle.PDB_ins_code_1             ? 
_pdbx_validate_rmsd_angle.label_alt_id_1             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_2             CG 
_pdbx_validate_rmsd_angle.auth_asym_id_2             EEE 
_pdbx_validate_rmsd_angle.auth_comp_id_2             TYR 
_pdbx_validate_rmsd_angle.auth_seq_id_2              501 
_pdbx_validate_rmsd_angle.PDB_ins_code_2             ? 
_pdbx_validate_rmsd_angle.label_alt_id_2             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_3             CD1 
_pdbx_validate_rmsd_angle.auth_asym_id_3             EEE 
_pdbx_validate_rmsd_angle.auth_comp_id_3             TYR 
_pdbx_validate_rmsd_angle.auth_seq_id_3              501 
_pdbx_validate_rmsd_angle.PDB_ins_code_3             ? 
_pdbx_validate_rmsd_angle.label_alt_id_3             ? 
_pdbx_validate_rmsd_angle.angle_value                125.44 
_pdbx_validate_rmsd_angle.angle_target_value         121.00 
_pdbx_validate_rmsd_angle.angle_deviation            4.44 
_pdbx_validate_rmsd_angle.angle_standard_deviation   0.60 
_pdbx_validate_rmsd_angle.linker_flag                N 
# 
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 ALA AAA 352 ? ? -108.00 41.81  
2 1 PHE AAA 377 ? ? -151.61 85.81  
3 1 ASN AAA 422 ? ? -126.03 -54.87 
4 1 ALA EEE 352 ? ? -108.59 42.87  
5 1 ASN EEE 422 ? ? -125.65 -56.00 
# 
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 AAA PRO 330 ? A PRO 1   
2  1 Y 1 AAA ASN 331 ? A ASN 2   
3  1 Y 1 AAA ILE 332 ? A ILE 3   
4  1 Y 1 AAA THR 333 ? A THR 4   
5  1 Y 1 AAA LYS 528 ? A LYS 199 
6  1 Y 1 AAA LYS 529 ? A LYS 200 
7  1 Y 1 AAA SER 530 ? A SER 201 
8  1 Y 1 AAA THR 531 ? A THR 202 
9  1 Y 1 AAA ASN 532 ? A ASN 203 
10 1 Y 1 AAA LYS 533 ? A LYS 204 
11 1 Y 1 AAA HIS 534 ? A HIS 205 
12 1 Y 1 AAA HIS 535 ? A HIS 206 
13 1 Y 1 AAA HIS 536 ? A HIS 207 
14 1 Y 1 AAA HIS 537 ? A HIS 208 
15 1 Y 1 AAA HIS 538 ? A HIS 209 
16 1 Y 1 AAA HIS 539 ? A HIS 210 
17 1 Y 1 BBB MET -1  ? B MET 1   
18 1 Y 1 BBB ALA 0   ? B ALA 2   
19 1 Y 1 BBB HIS 123 ? B HIS 125 
20 1 Y 1 BBB HIS 124 ? B HIS 126 
21 1 Y 1 BBB HIS 125 ? B HIS 127 
22 1 Y 1 BBB HIS 126 ? B HIS 128 
23 1 Y 1 BBB HIS 127 ? B HIS 129 
24 1 Y 1 EEE PRO 330 ? C PRO 1   
25 1 Y 1 EEE ASN 331 ? C ASN 2   
26 1 Y 1 EEE ILE 332 ? C ILE 3   
27 1 Y 1 EEE THR 333 ? C THR 4   
28 1 Y 1 EEE LYS 528 ? C LYS 199 
29 1 Y 1 EEE LYS 529 ? C LYS 200 
30 1 Y 1 EEE SER 530 ? C SER 201 
31 1 Y 1 EEE THR 531 ? C THR 202 
32 1 Y 1 EEE ASN 532 ? C ASN 203 
33 1 Y 1 EEE LYS 533 ? C LYS 204 
34 1 Y 1 EEE HIS 534 ? C HIS 205 
35 1 Y 1 EEE HIS 535 ? C HIS 206 
36 1 Y 1 EEE HIS 536 ? C HIS 207 
37 1 Y 1 EEE HIS 537 ? C HIS 208 
38 1 Y 1 EEE HIS 538 ? C HIS 209 
39 1 Y 1 EEE HIS 539 ? C HIS 210 
40 1 Y 1 FFF MET -1  ? D MET 1   
41 1 Y 1 FFF ALA 0   ? D ALA 2   
42 1 Y 1 FFF HIS 122 ? D HIS 124 
43 1 Y 1 FFF HIS 123 ? D HIS 125 
44 1 Y 1 FFF HIS 124 ? D HIS 126 
45 1 Y 1 FFF HIS 125 ? D HIS 127 
46 1 Y 1 FFF HIS 126 ? D HIS 128 
47 1 Y 1 FFF HIS 127 ? D HIS 129 
# 
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                         
# 
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 water                                    HOH 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
