# By using this file you agree to the legally binding terms of use found at
# https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
# To request access to the AlphaFold 3 model parameters, follow the process set
# out at https://github.com/google-deepmind/alphafold3. You may only use these if
# received directly from Google. Use is subject to terms of use available at
# https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
data_spkb08706
#
_entry.id spkb08706
#
loop_
_atom_type.symbol
C 
N 
O 
S 
#
loop_
_audit_author.name
_audit_author.pdbx_ordinal
"Google DeepMind" 1 
"Isomorphic Labs" 2 
#
_audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic
_audit_conform.dict_name     mmcif_ma.dic
_audit_conform.dict_version  1.4.5
#
loop_
_chem_comp.formula
_chem_comp.formula_weight
_chem_comp.id
_chem_comp.mon_nstd_flag
_chem_comp.name
_chem_comp.pdbx_smiles
_chem_comp.pdbx_synonyms
_chem_comp.type
"C4 H8 N2 O3"   132.118 ASN y ASPARAGINE    C([C@@H](C(=O)O)N)C(=O)N             ? "L-PEPTIDE LINKING" 
"C5 H10 N2 O3"  146.144 GLN y GLUTAMINE     C(CC(=O)N)[C@@H](C(=O)O)N            ? "L-PEPTIDE LINKING" 
"C2 H5 N O2"    75.067  GLY y GLYCINE       C(C(=O)O)N                           ? "PEPTIDE LINKING"   
"C6 H13 N O2"   131.173 ILE y ISOLEUCINE    CC[C@H](C)[C@@H](C(=O)O)N            ? "L-PEPTIDE LINKING" 
"C6 H13 N O2"   131.173 LEU y LEUCINE       CC(C)C[C@@H](C(=O)O)N                ? "L-PEPTIDE LINKING" 
"C5 H11 N O2 S" 149.211 MET y METHIONINE    CSCC[C@@H](C(=O)O)N                  ? "L-PEPTIDE LINKING" 
"C9 H11 N O2"   165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N           ? "L-PEPTIDE LINKING" 
"C3 H7 N O3"    105.093 SER y SERINE        C([C@@H](C(=O)O)N)O                  ? "L-PEPTIDE LINKING" 
"C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN    c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" 
"C9 H11 N O3"   181.189 TYR y TYROSINE      c1cc(ccc1C[C@@H](C(=O)O)N)O          ? "L-PEPTIDE LINKING" 
"C5 H11 N O2"   117.146 VAL y VALINE        CC(C)[C@@H](C(=O)O)N                 ? "L-PEPTIDE LINKING" 
#
_citation.book_publisher          ?
_citation.country                 UK
_citation.id                      primary
_citation.journal_full            Nature
_citation.journal_id_ASTM         NATUAS
_citation.journal_id_CSD          0006
_citation.journal_id_ISSN         0028-0836
_citation.journal_volume          630
_citation.page_first              493
_citation.page_last               500
_citation.pdbx_database_id_DOI    10.1038/s41586-024-07487-w
_citation.pdbx_database_id_PubMed 38718835
_citation.title                   "Accurate structure prediction of biomolecular interactions with AlphaFold 3"
_citation.year                    2024
#
loop_
_citation_author.citation_id
_citation_author.name
_citation_author.ordinal
primary "Google DeepMind" 1 
primary "Isomorphic Labs" 2 
#
_entity.id               1
_entity.pdbx_description .
_entity.type             polymer
#
_entity_poly.entity_id      1
_entity_poly.pdbx_strand_id A
_entity_poly.type           polypeptide(L)
#
loop_
_entity_poly_seq.entity_id
_entity_poly_seq.hetero
_entity_poly_seq.mon_id
_entity_poly_seq.num
1 n MET 1  
1 n TRP 2  
1 n LEU 3  
1 n GLN 4  
1 n ASN 5  
1 n LEU 6  
1 n LEU 7  
1 n PHE 8  
1 n LEU 9  
1 n GLY 10 
1 n ILE 11 
1 n VAL 12 
1 n VAL 13 
1 n TYR 14 
1 n SER 15 
1 n LEU 16 
1 n SER 17 
#
_ma_data.content_type "model coordinates"
_ma_data.id           1
_ma_data.name         Model
#
_ma_model_list.data_id          1
_ma_model_list.model_group_id   1
_ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.0 @ 2025-07-09 20:36:37)"
_ma_model_list.model_id         1
_ma_model_list.model_name       "Top ranked model"
_ma_model_list.model_type       "Ab initio model"
_ma_model_list.ordinal_id       1
#
loop_
_ma_protocol_step.method_type
_ma_protocol_step.ordinal_id
_ma_protocol_step.protocol_id
_ma_protocol_step.step_id
"coevolution MSA" 1 1 1 
"template search" 2 1 2 
modeling          3 1 3 
#
loop_
_ma_qa_metric.id
_ma_qa_metric.mode
_ma_qa_metric.name
_ma_qa_metric.software_group_id
_ma_qa_metric.type
1 global pLDDT 1 pLDDT 
2 local  pLDDT 1 pLDDT 
#
_ma_qa_metric_global.metric_id    1
_ma_qa_metric_global.metric_value 94.97
_ma_qa_metric_global.model_id     1
_ma_qa_metric_global.ordinal_id   1
#
loop_
_ma_qa_metric_local.label_asym_id
_ma_qa_metric_local.label_comp_id
_ma_qa_metric_local.label_seq_id
_ma_qa_metric_local.metric_id
_ma_qa_metric_local.metric_value
_ma_qa_metric_local.model_id
_ma_qa_metric_local.ordinal_id
A MET 1  2 90.94 1 1  
A TRP 2  2 91.74 1 2  
A LEU 3  2 94.73 1 3  
A GLN 4  2 93.04 1 4  
A ASN 5  2 95.10 1 5  
A LEU 6  2 95.98 1 6  
A LEU 7  2 96.52 1 7  
A PHE 8  2 95.99 1 8  
A LEU 9  2 95.43 1 9  
A GLY 10 2 97.85 1 10 
A ILE 11 2 96.37 1 11 
A VAL 12 2 97.67 1 12 
A VAL 13 2 97.52 1 13 
A TYR 14 2 94.99 1 14 
A SER 15 2 97.24 1 15 
A LEU 16 2 96.07 1 16 
A SER 17 2 91.82 1 17 
#
_ma_software_group.group_id    1
_ma_software_group.ordinal_id  1
_ma_software_group.software_id 1
#
_ma_target_entity.data_id   1
_ma_target_entity.entity_id 1
_ma_target_entity.origin    .
#
_ma_target_entity_instance.asym_id   A
_ma_target_entity_instance.details   .
_ma_target_entity_instance.entity_id 1
#
loop_
_pdbx_data_usage.details
_pdbx_data_usage.id
_pdbx_data_usage.type
_pdbx_data_usage.url
;Non-commercial use only, by using this file you agree to the terms of use found
at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md.
To request access to the AlphaFold 3 model parameters, follow the process set
out at https://github.com/google-deepmind/alphafold3. You may only use these if
received directly from Google. Use is subject to terms of use available at
https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
;
1 license    https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md 
;AlphaFold 3 and its output are not intended for, have not been validated for,
and are not approved for clinical use. They are provided "as-is" without any
warranty of any kind, whether expressed or implied. No warranty is given that
use shall not infringe the rights of any third party.
;
2 disclaimer ?                                                                              
#
loop_
_pdbx_poly_seq_scheme.asym_id
_pdbx_poly_seq_scheme.auth_seq_num
_pdbx_poly_seq_scheme.entity_id
_pdbx_poly_seq_scheme.hetero
_pdbx_poly_seq_scheme.mon_id
_pdbx_poly_seq_scheme.pdb_ins_code
_pdbx_poly_seq_scheme.pdb_seq_num
_pdbx_poly_seq_scheme.pdb_strand_id
_pdbx_poly_seq_scheme.seq_id
A 1  1 n MET . 1  A 1  
A 2  1 n TRP . 2  A 2  
A 3  1 n LEU . 3  A 3  
A 4  1 n GLN . 4  A 4  
A 5  1 n ASN . 5  A 5  
A 6  1 n LEU . 6  A 6  
A 7  1 n LEU . 7  A 7  
A 8  1 n PHE . 8  A 8  
A 9  1 n LEU . 9  A 9  
A 10 1 n GLY . 10 A 10 
A 11 1 n ILE . 11 A 11 
A 12 1 n VAL . 12 A 12 
A 13 1 n VAL . 13 A 13 
A 14 1 n TYR . 14 A 14 
A 15 1 n SER . 15 A 15 
A 16 1 n LEU . 16 A 16 
A 17 1 n SER . 17 A 17 
#
_software.classification other
_software.date           ?
_software.description    "Structure prediction"
_software.name           AlphaFold
_software.pdbx_ordinal   1
_software.type           package
_software.version        "AlphaFold-beta-20231127 (9ceee3b5f7825b611ab42eaad843248507ced2da1e745fa3b3d93c6c4ad3ca74)"
#
_struct_asym.entity_id 1
_struct_asym.id        A
#
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.auth_seq_id
_atom_site.auth_asym_id
_atom_site.pdbx_PDB_model_num
ATOM 1   N N   . MET A 1 1  ? -7.744  2.912  12.218 1.00 95.81 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? -6.737  3.031  11.166 1.00 96.23 1  A 1 
ATOM 3   C C   . MET A 1 1  ? -6.060  1.687  10.892 1.00 96.90 1  A 1 
ATOM 4   O O   . MET A 1 1  ? -4.952  1.438  11.350 1.00 96.29 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? -5.684  4.065  11.558 1.00 93.24 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? -5.272  3.983  13.009 1.00 87.70 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? -4.253  5.393  13.514 1.00 84.79 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? -5.516  6.632  13.681 1.00 76.57 1  A 1 
ATOM 9   N N   . TRP A 1 2  ? -6.763  0.851  10.168 1.00 94.88 2  A 1 
ATOM 10  C CA  . TRP A 1 2  ? -6.243  -0.468 9.834  1.00 96.08 2  A 1 
ATOM 11  C C   . TRP A 1 2  ? -6.334  -0.710 8.335  1.00 96.81 2  A 1 
ATOM 12  O O   . TRP A 1 2  ? -5.375  -1.153 7.710  1.00 95.90 2  A 1 
ATOM 13  C CB  . TRP A 1 2  ? -7.027  -1.549 10.591 1.00 94.97 2  A 1 
ATOM 14  C CG  . TRP A 1 2  ? -7.502  -1.082 11.934 1.00 91.84 2  A 1 
ATOM 15  C CD1 . TRP A 1 2  ? -6.873  -1.271 13.117 1.00 91.31 2  A 1 
ATOM 16  C CD2 . TRP A 1 2  ? -8.694  -0.342 12.230 1.00 92.26 2  A 1 
ATOM 17  N NE1 . TRP A 1 2  ? -7.598  -0.708 14.132 1.00 88.93 2  A 1 
ATOM 18  C CE2 . TRP A 1 2  ? -8.720  -0.127 13.617 1.00 89.99 2  A 1 
ATOM 19  C CE3 . TRP A 1 2  ? -9.737  0.149  11.441 1.00 88.63 2  A 1 
ATOM 20  C CZ2 . TRP A 1 2  ? -9.767  0.565  14.233 1.00 89.29 2  A 1 
ATOM 21  C CZ3 . TRP A 1 2  ? -10.770 0.840  12.055 1.00 87.05 2  A 1 
ATOM 22  C CH2 . TRP A 1 2  ? -10.784 1.037  13.440 1.00 86.44 2  A 1 
ATOM 23  N N   . LEU A 1 3  ? -7.497  -0.417 7.770  1.00 97.04 3  A 1 
ATOM 24  C CA  . LEU A 1 3  ? -7.713  -0.583 6.344  1.00 97.30 3  A 1 
ATOM 25  C C   . LEU A 1 3  ? -6.832  0.370  5.548  1.00 97.71 3  A 1 
ATOM 26  O O   . LEU A 1 3  ? -6.329  0.018  4.479  1.00 97.40 3  A 1 
ATOM 27  C CB  . LEU A 1 3  ? -9.189  -0.337 6.000  1.00 96.79 3  A 1 
ATOM 28  C CG  . LEU A 1 3  ? -9.798  0.888  6.667  1.00 93.65 3  A 1 
ATOM 29  C CD1 . LEU A 1 3  ? -10.590 1.696  5.649  1.00 89.23 3  A 1 
ATOM 30  C CD2 . LEU A 1 3  ? -10.718 0.447  7.800  1.00 88.69 3  A 1 
ATOM 31  N N   . GLN A 1 4  ? -6.660  1.582  6.081  1.00 97.79 4  A 1 
ATOM 32  C CA  . GLN A 1 4  ? -5.822  2.575  5.431  1.00 97.96 4  A 1 
ATOM 33  C C   . GLN A 1 4  ? -4.375  2.107  5.375  1.00 98.14 4  A 1 
ATOM 34  O O   . GLN A 1 4  ? -3.624  2.481  4.474  1.00 97.46 4  A 1 
ATOM 35  C CB  . GLN A 1 4  ? -5.910  3.922  6.161  1.00 97.33 4  A 1 
ATOM 36  C CG  . GLN A 1 4  ? -5.881  3.822  7.665  1.00 92.59 4  A 1 
ATOM 37  C CD  . GLN A 1 4  ? -7.279  3.789  8.257  1.00 90.26 4  A 1 
ATOM 38  O OE1 . GLN A 1 4  ? -7.904  2.740  8.330  1.00 84.84 4  A 1 
ATOM 39  N NE2 . GLN A 1 4  ? -7.776  4.935  8.679  1.00 81.00 4  A 1 
ATOM 40  N N   . ASN A 1 5  ? -3.999  1.277  6.343  1.00 98.01 5  A 1 
ATOM 41  C CA  . ASN A 1 5  ? -2.648  0.725  6.390  1.00 98.04 5  A 1 
ATOM 42  C C   . ASN A 1 5  ? -2.463  -0.294 5.279  1.00 98.20 5  A 1 
ATOM 43  O O   . ASN A 1 5  ? -1.357  -0.487 4.776  1.00 97.74 5  A 1 
ATOM 44  C CB  . ASN A 1 5  ? -2.379  0.072  7.748  1.00 97.57 5  A 1 
ATOM 45  C CG  . ASN A 1 5  ? -1.334  0.817  8.549  1.00 94.24 5  A 1 
ATOM 46  O OD1 . ASN A 1 5  ? -1.316  2.044  8.584  1.00 88.48 5  A 1 
ATOM 47  N ND2 . ASN A 1 5  ? -0.454  0.078  9.207  1.00 88.49 5  A 1 
ATOM 48  N N   . LEU A 1 6  ? -3.556  -0.947 4.909  1.00 98.13 6  A 1 
ATOM 49  C CA  . LEU A 1 6  ? -3.535  -1.949 3.856  1.00 97.96 6  A 1 
ATOM 50  C C   . LEU A 1 6  ? -3.136  -1.312 2.532  1.00 98.04 6  A 1 
ATOM 51  O O   . LEU A 1 6  ? -2.251  -1.807 1.833  1.00 97.64 6  A 1 
ATOM 52  C CB  . LEU A 1 6  ? -4.916  -2.600 3.725  1.00 97.74 6  A 1 
ATOM 53  C CG  . LEU A 1 6  ? -4.917  -4.064 3.279  1.00 95.26 6  A 1 
ATOM 54  C CD1 . LEU A 1 6  ? -4.176  -4.227 1.963  1.00 91.40 6  A 1 
ATOM 55  C CD2 . LEU A 1 6  ? -4.277  -4.923 4.358  1.00 91.66 6  A 1 
ATOM 56  N N   . LEU A 1 7  ? -3.816  -0.224 2.197  1.00 98.23 7  A 1 
ATOM 57  C CA  . LEU A 1 7  ? -3.528  0.482  0.954  1.00 98.18 7  A 1 
ATOM 58  C C   . LEU A 1 7  ? -2.163  1.152  1.023  1.00 98.27 7  A 1 
ATOM 59  O O   . LEU A 1 7  ? -1.453  1.248  0.021  1.00 98.11 7  A 1 
ATOM 60  C CB  . LEU A 1 7  ? -4.620  1.524  0.690  1.00 98.02 7  A 1 
ATOM 61  C CG  . LEU A 1 7  ? -4.721  2.626  1.739  1.00 95.44 7  A 1 
ATOM 62  C CD1 . LEU A 1 7  ? -4.074  3.902  1.218  1.00 92.57 7  A 1 
ATOM 63  C CD2 . LEU A 1 7  ? -6.171  2.882  2.094  1.00 93.33 7  A 1 
ATOM 64  N N   . PHE A 1 8  ? -1.815  1.612  2.216  1.00 98.38 8  A 1 
ATOM 65  C CA  . PHE A 1 8  ? -0.533  2.266  2.436  1.00 98.33 8  A 1 
ATOM 66  C C   . PHE A 1 8  ? 0.604   1.311  2.113  1.00 98.36 8  A 1 
ATOM 67  O O   . PHE A 1 8  ? 1.595   1.698  1.490  1.00 98.05 8  A 1 
ATOM 68  C CB  . PHE A 1 8  ? -0.429  2.723  3.889  1.00 98.11 8  A 1 
ATOM 69  C CG  . PHE A 1 8  ? 0.593   3.810  4.102  1.00 96.55 8  A 1 
ATOM 70  C CD1 . PHE A 1 8  ? 0.449   5.038  3.476  1.00 93.75 8  A 1 
ATOM 71  C CD2 . PHE A 1 8  ? 1.681   3.598  4.929  1.00 94.50 8  A 1 
ATOM 72  C CE1 . PHE A 1 8  ? 1.385   6.043  3.668  1.00 93.08 8  A 1 
ATOM 73  C CE2 . PHE A 1 8  ? 2.621   4.601  5.127  1.00 93.18 8  A 1 
ATOM 74  C CZ  . PHE A 1 8  ? 2.472   5.825  4.493  1.00 93.56 8  A 1 
ATOM 75  N N   . LEU A 1 9  ? 0.443   0.071  2.542  1.00 97.94 9  A 1 
ATOM 76  C CA  . LEU A 1 9  ? 1.444   -0.956 2.292  1.00 97.67 9  A 1 
ATOM 77  C C   . LEU A 1 9  ? 1.417   -1.378 0.830  1.00 97.83 9  A 1 
ATOM 78  O O   . LEU A 1 9  ? 2.447   -1.665 0.228  1.00 97.38 9  A 1 
ATOM 79  C CB  . LEU A 1 9  ? 1.198   -2.166 3.198  1.00 97.17 9  A 1 
ATOM 80  C CG  . LEU A 1 9  ? 2.271   -2.408 4.255  1.00 93.77 9  A 1 
ATOM 81  C CD1 . LEU A 1 9  ? 3.620   -2.607 3.588  1.00 90.86 9  A 1 
ATOM 82  C CD2 . LEU A 1 9  ? 2.318   -1.237 5.224  1.00 90.81 9  A 1 
ATOM 83  N N   . GLY A 1 10 ? 0.216   -1.413 0.283  1.00 97.94 10 A 1 
ATOM 84  C CA  . GLY A 1 10 ? 0.047   -1.787 -1.113 1.00 97.76 10 A 1 
ATOM 85  C C   . GLY A 1 10 ? 0.807   -0.872 -2.050 1.00 98.08 10 A 1 
ATOM 86  O O   . GLY A 1 10 ? 1.372   -1.317 -3.050 1.00 97.62 10 A 1 
ATOM 87  N N   . ILE A 1 11 ? 0.808   0.402  -1.723 1.00 97.75 11 A 1 
ATOM 88  C CA  . ILE A 1 11 ? 1.505   1.395  -2.531 1.00 97.76 11 A 1 
ATOM 89  C C   . ILE A 1 11 ? 3.014   1.197  -2.445 1.00 98.04 11 A 1 
ATOM 90  O O   . ILE A 1 11 ? 3.724   1.298  -3.450 1.00 97.35 11 A 1 
ATOM 91  C CB  . ILE A 1 11 ? 1.149   2.824  -2.078 1.00 97.40 11 A 1 
ATOM 92  C CG1 . ILE A 1 11 ? -0.354  3.061  -2.174 1.00 95.65 11 A 1 
ATOM 93  C CG2 . ILE A 1 11 ? 1.892   3.844  -2.930 1.00 95.48 11 A 1 
ATOM 94  C CD1 . ILE A 1 11 ? -0.823  4.259  -1.388 1.00 91.51 11 A 1 
ATOM 95  N N   . VAL A 1 12 ? 3.480   0.928  -1.236 1.00 98.41 12 A 1 
ATOM 96  C CA  . VAL A 1 12 ? 4.905   0.710  -1.008 1.00 98.32 12 A 1 
ATOM 97  C C   . VAL A 1 12 ? 5.388   -0.509 -1.781 1.00 98.39 12 A 1 
ATOM 98  O O   . VAL A 1 12 ? 6.456   -0.489 -2.397 1.00 97.95 12 A 1 
ATOM 99  C CB  . VAL A 1 12 ? 5.209   0.518  0.490  1.00 97.89 12 A 1 
ATOM 100 C CG1 . VAL A 1 12 ? 6.702   0.339  0.717  1.00 96.44 12 A 1 
ATOM 101 C CG2 . VAL A 1 12 ? 4.692   1.697  1.293  1.00 96.31 12 A 1 
ATOM 102 N N   . VAL A 1 13 ? 4.596   -1.557 -1.737 1.00 98.44 13 A 1 
ATOM 103 C CA  . VAL A 1 13 ? 4.932   -2.794 -2.434 1.00 98.35 13 A 1 
ATOM 104 C C   . VAL A 1 13 ? 4.945   -2.572 -3.939 1.00 98.38 13 A 1 
ATOM 105 O O   . VAL A 1 13 ? 5.785   -3.127 -4.653 1.00 97.86 13 A 1 
ATOM 106 C CB  . VAL A 1 13 ? 3.933   -3.907 -2.087 1.00 97.81 13 A 1 
ATOM 107 C CG1 . VAL A 1 13 ? 4.299   -5.189 -2.810 1.00 95.96 13 A 1 
ATOM 108 C CG2 . VAL A 1 13 ? 3.898   -4.133 -0.591 1.00 95.85 13 A 1 
ATOM 109 N N   . TYR A 1 14 ? 4.015   -1.771 -4.396 1.00 98.41 14 A 1 
ATOM 110 C CA  . TYR A 1 14 ? 3.918   -1.471 -5.818 1.00 98.28 14 A 1 
ATOM 111 C C   . TYR A 1 14 ? 5.133   -0.683 -6.285 1.00 98.36 14 A 1 
ATOM 112 O O   . TYR A 1 14 ? 5.620   -0.878 -7.399 1.00 97.93 14 A 1 
ATOM 113 C CB  . TYR A 1 14 ? 2.647   -0.676 -6.093 1.00 97.82 14 A 1 
ATOM 114 C CG  . TYR A 1 14 ? 1.601   -1.477 -6.835 1.00 95.25 14 A 1 
ATOM 115 C CD1 . TYR A 1 14 ? 1.139   -2.683 -6.327 1.00 92.95 14 A 1 
ATOM 116 C CD2 . TYR A 1 14 ? 1.083   -1.020 -8.036 1.00 93.04 14 A 1 
ATOM 117 C CE1 . TYR A 1 14 ? 0.186   -3.423 -7.004 1.00 92.17 14 A 1 
ATOM 118 C CE2 . TYR A 1 14 ? 0.122   -1.752 -8.718 1.00 92.05 14 A 1 
ATOM 119 C CZ  . TYR A 1 14 ? -0.321  -2.952 -8.195 1.00 92.49 14 A 1 
ATOM 120 O OH  . TYR A 1 14 ? -1.272  -3.682 -8.868 1.00 91.12 14 A 1 
ATOM 121 N N   . SER A 1 15 ? 5.600   0.209  -5.432 1.00 98.28 15 A 1 
ATOM 122 C CA  . SER A 1 15 ? 6.768   1.019  -5.743 1.00 98.25 15 A 1 
ATOM 123 C C   . SER A 1 15 ? 8.023   0.160  -5.821 1.00 98.36 15 A 1 
ATOM 124 O O   . SER A 1 15 ? 8.833   0.311  -6.734 1.00 97.53 15 A 1 
ATOM 125 C CB  . SER A 1 15 ? 6.955   2.110  -4.692 1.00 97.78 15 A 1 
ATOM 126 O OG  . SER A 1 15 ? 5.988   3.127  -4.837 1.00 93.23 15 A 1 
ATOM 127 N N   . LEU A 1 16 ? 8.168   -0.731 -4.852 1.00 98.11 16 A 1 
ATOM 128 C CA  . LEU A 1 16 ? 9.307   -1.640 -4.814 1.00 97.93 16 A 1 
ATOM 129 C C   . LEU A 1 16 ? 9.211   -2.680 -5.916 1.00 98.00 16 A 1 
ATOM 130 O O   . LEU A 1 16 ? 10.164  -2.881 -6.672 1.00 97.17 16 A 1 
ATOM 131 C CB  . LEU A 1 16 ? 9.374   -2.335 -3.452 1.00 97.36 16 A 1 
ATOM 132 C CG  . LEU A 1 16 ? 9.988   -1.495 -2.335 1.00 95.48 16 A 1 
ATOM 133 C CD1 . LEU A 1 16 ? 9.591   -2.042 -0.977 1.00 92.64 16 A 1 
ATOM 134 C CD2 . LEU A 1 16 ? 11.498  -1.471 -2.480 1.00 91.84 16 A 1 
ATOM 135 N N   . SER A 1 17 ? 8.023   -3.319 -5.978 1.00 96.93 17 A 1 
ATOM 136 C CA  . SER A 1 17 ? 7.748   -4.344 -6.992 1.00 95.74 17 A 1 
ATOM 137 C C   . SER A 1 17 ? 9.019   -4.838 -7.683 1.00 94.09 17 A 1 
ATOM 138 O O   . SER A 1 17 ? 9.237   -4.524 -8.864 1.00 89.31 17 A 1 
ATOM 139 C CB  . SER A 1 17 ? 6.780   -3.789 -8.035 1.00 93.19 17 A 1 
ATOM 140 O OG  . SER A 1 17 ? 5.479   -3.712 -7.503 1.00 86.63 17 A 1 
ATOM 141 O OXT . SER A 1 17 ? 9.815   -5.559 -7.041 1.00 86.87 17 A 1 
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