# 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_spkb23676
#
_entry.id spkb23676
#
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
"C3 H7 N O2"    89.093  ALA y ALANINE    C[C@@H](C(=O)O)N                 ? "L-PEPTIDE LINKING" 
"C6 H15 N4 O2"  175.209 ARG y ARGININE   C(C[C@@H](C(=O)O)N)CNC(=[NH2+])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 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" 
"C3 H7 N O3"    105.093 SER y SERINE     C([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 ARG 2  
1 n LEU 3  
1 n LEU 4  
1 n LEU 5  
1 n SER 6  
1 n VAL 7  
1 n LEU 8  
1 n LEU 9  
1 n LEU 10 
1 n LEU 11 
1 n VAL 12 
1 n ALA 13 
1 n SER 14 
1 n LEU 15 
1 n GLY 16 
1 n LEU 17 
1 n VAL 18 
1 n SER 19 
1 n ALA 20 
#
_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 @ 2025-07-06 14:52:11)"
_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 91.17
_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 81.36 1 1  
A ARG 2  2 81.48 1 2  
A LEU 3  2 91.23 1 3  
A LEU 4  2 92.22 1 4  
A LEU 5  2 91.88 1 5  
A SER 6  2 94.43 1 6  
A VAL 7  2 96.08 1 7  
A LEU 8  2 92.48 1 8  
A LEU 9  2 94.08 1 9  
A LEU 10 2 93.58 1 10 
A LEU 11 2 92.85 1 11 
A VAL 12 2 94.74 1 12 
A ALA 13 2 97.12 1 13 
A SER 14 2 95.01 1 14 
A LEU 15 2 93.32 1 15 
A GLY 16 2 96.06 1 16 
A LEU 17 2 89.33 1 17 
A VAL 18 2 91.78 1 18 
A SER 19 2 89.39 1 19 
A ALA 20 2 83.95 1 20 
#
_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 ARG . 2  A 2  
A 3  1 n LEU . 3  A 3  
A 4  1 n LEU . 4  A 4  
A 5  1 n LEU . 5  A 5  
A 6  1 n SER . 6  A 6  
A 7  1 n VAL . 7  A 7  
A 8  1 n LEU . 8  A 8  
A 9  1 n LEU . 9  A 9  
A 10 1 n LEU . 10 A 10 
A 11 1 n LEU . 11 A 11 
A 12 1 n VAL . 12 A 12 
A 13 1 n ALA . 13 A 13 
A 14 1 n SER . 14 A 14 
A 15 1 n LEU . 15 A 15 
A 16 1 n GLY . 16 A 16 
A 17 1 n LEU . 17 A 17 
A 18 1 n VAL . 18 A 18 
A 19 1 n SER . 19 A 19 
A 20 1 n ALA . 20 A 20 
#
_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  ? -14.642 -3.264 3.168  1.00 88.89 1  A 1 
ATOM 2   C CA  . MET A 1 1  ? -13.443 -3.062 4.002  1.00 89.73 1  A 1 
ATOM 3   C C   . MET A 1 1  ? -12.178 -3.173 3.159  1.00 91.12 1  A 1 
ATOM 4   O O   . MET A 1 1  ? -11.546 -4.224 3.108  1.00 87.26 1  A 1 
ATOM 5   C CB  . MET A 1 1  ? -13.411 -4.098 5.124  1.00 82.95 1  A 1 
ATOM 6   C CG  . MET A 1 1  ? -12.261 -3.881 6.082  1.00 77.31 1  A 1 
ATOM 7   S SD  . MET A 1 1  ? -12.260 -5.054 7.449  1.00 71.65 1  A 1 
ATOM 8   C CE  . MET A 1 1  ? -13.567 -4.368 8.456  1.00 61.94 1  A 1 
ATOM 9   N N   . ARG A 1 2  ? -11.816 -2.084 2.499  1.00 91.56 2  A 1 
ATOM 10  C CA  . ARG A 1 2  ? -10.615 -2.046 1.656  1.00 93.50 2  A 1 
ATOM 11  C C   . ARG A 1 2  ? -9.618  -0.996 2.140  1.00 95.13 2  A 1 
ATOM 12  O O   . ARG A 1 2  ? -8.573  -0.791 1.515  1.00 92.20 2  A 1 
ATOM 13  C CB  . ARG A 1 2  ? -11.009 -1.780 0.198  1.00 90.07 2  A 1 
ATOM 14  C CG  . ARG A 1 2  ? -11.679 -0.429 -0.023 1.00 82.45 2  A 1 
ATOM 15  C CD  . ARG A 1 2  ? -10.657 0.665  -0.272 1.00 80.60 2  A 1 
ATOM 16  N NE  . ARG A 1 2  ? -9.860  0.414  -1.488 1.00 73.73 2  A 1 
ATOM 17  C CZ  . ARG A 1 2  ? -10.243 0.771  -2.708 1.00 70.30 2  A 1 
ATOM 18  N NH1 . ARG A 1 2  ? -11.389 1.391  -2.895 1.00 63.91 2  A 1 
ATOM 19  N NH2 . ARG A 1 2  ? -9.473  0.503  -3.751 1.00 62.80 2  A 1 
ATOM 20  N N   . LEU A 1 3  ? -9.956  -0.332 3.244  1.00 94.79 3  A 1 
ATOM 21  C CA  . LEU A 1 3  ? -9.080  0.699  3.804  1.00 95.52 3  A 1 
ATOM 22  C C   . LEU A 1 3  ? -7.747  0.103  4.247  1.00 96.65 3  A 1 
ATOM 23  O O   . LEU A 1 3  ? -6.712  0.767  4.179  1.00 95.30 3  A 1 
ATOM 24  C CB  . LEU A 1 3  ? -9.762  1.381  4.991  1.00 94.54 3  A 1 
ATOM 25  C CG  . LEU A 1 3  ? -11.019 2.168  4.616  1.00 87.15 3  A 1 
ATOM 26  C CD1 . LEU A 1 3  ? -11.689 2.703  5.872  1.00 83.85 3  A 1 
ATOM 27  C CD2 . LEU A 1 3  ? -10.670 3.318  3.677  1.00 82.04 3  A 1 
ATOM 28  N N   . LEU A 1 4  ? -7.776  -1.147 4.697  1.00 96.27 4  A 1 
ATOM 29  C CA  . LEU A 1 4  ? -6.554  -1.826 5.131  1.00 96.47 4  A 1 
ATOM 30  C C   . LEU A 1 4  ? -5.536  -1.883 3.996  1.00 96.95 4  A 1 
ATOM 31  O O   . LEU A 1 4  ? -4.348  -1.615 4.194  1.00 96.37 4  A 1 
ATOM 32  C CB  . LEU A 1 4  ? -6.886  -3.245 5.599  1.00 96.24 4  A 1 
ATOM 33  C CG  . LEU A 1 4  ? -7.821  -3.294 6.807  1.00 88.10 4  A 1 
ATOM 34  C CD1 . LEU A 1 4  ? -8.167  -4.734 7.144  1.00 84.28 4  A 1 
ATOM 35  C CD2 . LEU A 1 4  ? -7.172  -2.619 8.013  1.00 83.08 4  A 1 
ATOM 36  N N   . LEU A 1 5  ? -5.999  -2.226 2.802  1.00 96.76 5  A 1 
ATOM 37  C CA  . LEU A 1 5  ? -5.124  -2.301 1.634  1.00 96.60 5  A 1 
ATOM 38  C C   . LEU A 1 5  ? -4.602  -0.918 1.264  1.00 96.94 5  A 1 
ATOM 39  O O   . LEU A 1 5  ? -3.429  -0.755 0.916  1.00 96.39 5  A 1 
ATOM 40  C CB  . LEU A 1 5  ? -5.885  -2.903 0.453  1.00 95.98 5  A 1 
ATOM 41  C CG  . LEU A 1 5  ? -6.266  -4.369 0.647  1.00 85.51 5  A 1 
ATOM 42  C CD1 . LEU A 1 5  ? -7.191  -4.822 -0.474 1.00 83.50 5  A 1 
ATOM 43  C CD2 . LEU A 1 5  ? -5.016  -5.242 0.679  1.00 83.39 5  A 1 
ATOM 44  N N   . SER A 1 6  ? -5.461  0.084  1.341  1.00 96.61 6  A 1 
ATOM 45  C CA  . SER A 1 6  ? -5.080  1.456  1.015  1.00 96.62 6  A 1 
ATOM 46  C C   . SER A 1 6  ? -4.001  1.968  1.963  1.00 97.11 6  A 1 
ATOM 47  O O   . SER A 1 6  ? -3.009  2.556  1.532  1.00 96.41 6  A 1 
ATOM 48  C CB  . SER A 1 6  ? -6.299  2.369  1.088  1.00 95.69 6  A 1 
ATOM 49  O OG  . SER A 1 6  ? -7.266  1.974  0.137  1.00 84.14 6  A 1 
ATOM 50  N N   . VAL A 1 7  ? -4.199  1.735  3.253  1.00 97.13 7  A 1 
ATOM 51  C CA  . VAL A 1 7  ? -3.231  2.172  4.261  1.00 97.30 7  A 1 
ATOM 52  C C   . VAL A 1 7  ? -1.893  1.467  4.065  1.00 97.48 7  A 1 
ATOM 53  O O   . VAL A 1 7  ? -0.831  2.096  4.112  1.00 96.75 7  A 1 
ATOM 54  C CB  . VAL A 1 7  ? -3.761  1.902  5.677  1.00 96.88 7  A 1 
ATOM 55  C CG1 . VAL A 1 7  ? -2.699  2.228  6.723  1.00 94.00 7  A 1 
ATOM 56  C CG2 . VAL A 1 7  ? -5.012  2.727  5.931  1.00 93.04 7  A 1 
ATOM 57  N N   . LEU A 1 8  ? -1.948  0.161  3.846  1.00 96.53 8  A 1 
ATOM 58  C CA  . LEU A 1 8  ? -0.730  -0.626 3.649  1.00 96.33 8  A 1 
ATOM 59  C C   . LEU A 1 8  ? 0.040   -0.141 2.426  1.00 96.76 8  A 1 
ATOM 60  O O   . LEU A 1 8  ? 1.250   0.082  2.489  1.00 96.68 8  A 1 
ATOM 61  C CB  . LEU A 1 8  ? -1.084  -2.106 3.488  1.00 96.08 8  A 1 
ATOM 62  C CG  . LEU A 1 8  ? 0.130   -3.028 3.407  1.00 87.15 8  A 1 
ATOM 63  C CD1 . LEU A 1 8  ? 0.886   -3.035 4.729  1.00 84.66 8  A 1 
ATOM 64  C CD2 . LEU A 1 8  ? -0.302  -4.438 3.047  1.00 85.67 8  A 1 
ATOM 65  N N   . LEU A 1 9  ? -0.662  0.019  1.315  1.00 97.23 9  A 1 
ATOM 66  C CA  . LEU A 1 9  ? -0.038  0.478  0.074  1.00 97.13 9  A 1 
ATOM 67  C C   . LEU A 1 9  ? 0.537   1.877  0.240  1.00 97.35 9  A 1 
ATOM 68  O O   . LEU A 1 9  ? 1.612   2.184  -0.284 1.00 97.16 9  A 1 
ATOM 69  C CB  . LEU A 1 9  ? -1.072  0.471  -1.053 1.00 96.78 9  A 1 
ATOM 70  C CG  . LEU A 1 9  ? -1.456  -0.930 -1.519 1.00 90.12 9  A 1 
ATOM 71  C CD1 . LEU A 1 9  ? -2.676  -0.864 -2.429 1.00 88.36 9  A 1 
ATOM 72  C CD2 . LEU A 1 9  ? -0.293  -1.581 -2.258 1.00 88.52 9  A 1 
ATOM 73  N N   . LEU A 1 10 ? -0.172  2.726  0.961  1.00 97.15 10 A 1 
ATOM 74  C CA  . LEU A 1 10 ? 0.279   4.093  1.203  1.00 97.13 10 A 1 
ATOM 75  C C   . LEU A 1 10 ? 1.604   4.102  1.962  1.00 97.37 10 A 1 
ATOM 76  O O   . LEU A 1 10 ? 2.529   4.834  1.606  1.00 96.89 10 A 1 
ATOM 77  C CB  . LEU A 1 10 ? -0.778  4.861  1.997  1.00 96.84 10 A 1 
ATOM 78  C CG  . LEU A 1 10 ? -0.468  6.347  2.164  1.00 89.12 10 A 1 
ATOM 79  C CD1 . LEU A 1 10 ? -0.562  7.061  0.819  1.00 86.80 10 A 1 
ATOM 80  C CD2 . LEU A 1 10 ? -1.431  6.972  3.155  1.00 87.33 10 A 1 
ATOM 81  N N   . LEU A 1 11 ? 1.690   3.295  3.011  1.00 96.62 11 A 1 
ATOM 82  C CA  . LEU A 1 11 ? 2.904   3.213  3.818  1.00 96.51 11 A 1 
ATOM 83  C C   . LEU A 1 11 ? 4.068   2.679  2.996  1.00 96.91 11 A 1 
ATOM 84  O O   . LEU A 1 11 ? 5.180   3.215  3.056  1.00 96.55 11 A 1 
ATOM 85  C CB  . LEU A 1 11 ? 2.659   2.305  5.024  1.00 96.22 11 A 1 
ATOM 86  C CG  . LEU A 1 11 ? 1.730   2.918  6.070  1.00 88.55 11 A 1 
ATOM 87  C CD1 . LEU A 1 11 ? 1.317   1.866  7.088  1.00 85.44 11 A 1 
ATOM 88  C CD2 . LEU A 1 11 ? 2.417   4.081  6.774  1.00 85.97 11 A 1 
ATOM 89  N N   . VAL A 1 12 ? 3.820   1.625  2.230  1.00 96.52 12 A 1 
ATOM 90  C CA  . VAL A 1 12 ? 4.855   1.026  1.392  1.00 96.16 12 A 1 
ATOM 91  C C   . VAL A 1 12 ? 5.354   2.035  0.364  1.00 96.49 12 A 1 
ATOM 92  O O   . VAL A 1 12 ? 6.563   2.184  0.154  1.00 95.44 12 A 1 
ATOM 93  C CB  . VAL A 1 12 ? 4.324   -0.228 0.685  1.00 95.07 12 A 1 
ATOM 94  C CG1 . VAL A 1 12 ? 5.354   -0.769 -0.296 1.00 91.26 12 A 1 
ATOM 95  C CG2 . VAL A 1 12 ? 3.974   -1.290 1.711  1.00 92.22 12 A 1 
ATOM 96  N N   . ALA A 1 13 ? 4.431   2.732  -0.270 1.00 97.36 13 A 1 
ATOM 97  C CA  . ALA A 1 13 ? 4.783   3.731  -1.275 1.00 97.32 13 A 1 
ATOM 98  C C   . ALA A 1 13 ? 5.613   4.852  -0.660 1.00 97.65 13 A 1 
ATOM 99  O O   . ALA A 1 13 ? 6.574   5.330  -1.265 1.00 96.61 13 A 1 
ATOM 100 C CB  . ALA A 1 13 ? 3.518   4.300  -1.906 1.00 96.64 13 A 1 
ATOM 101 N N   . SER A 1 14 ? 5.252   5.270  0.543  1.00 97.24 14 A 1 
ATOM 102 C CA  . SER A 1 14 ? 5.966   6.333  1.241  1.00 97.22 14 A 1 
ATOM 103 C C   . SER A 1 14 ? 7.417   5.937  1.495  1.00 97.34 14 A 1 
ATOM 104 O O   . SER A 1 14 ? 8.335   6.715  1.244  1.00 95.77 14 A 1 
ATOM 105 C CB  . SER A 1 14 ? 5.280   6.652  2.565  1.00 96.38 14 A 1 
ATOM 106 O OG  . SER A 1 14 ? 3.978   7.152  2.339  1.00 86.09 14 A 1 
ATOM 107 N N   . LEU A 1 15 ? 7.623   4.720  1.981  1.00 96.97 15 A 1 
ATOM 108 C CA  . LEU A 1 15 ? 8.971   4.230  2.257  1.00 96.62 15 A 1 
ATOM 109 C C   . LEU A 1 15 ? 9.791   4.155  0.981  1.00 96.87 15 A 1 
ATOM 110 O O   . LEU A 1 15 ? 10.973  4.508  0.968  1.00 95.08 15 A 1 
ATOM 111 C CB  . LEU A 1 15 ? 8.892   2.849  2.905  1.00 95.74 15 A 1 
ATOM 112 C CG  . LEU A 1 15 ? 8.354   2.875  4.331  1.00 92.14 15 A 1 
ATOM 113 C CD1 . LEU A 1 15 ? 8.045   1.466  4.802  1.00 87.28 15 A 1 
ATOM 114 C CD2 . LEU A 1 15 ? 9.363   3.528  5.262  1.00 85.88 15 A 1 
ATOM 115 N N   . GLY A 1 16 ? 9.168   3.692  -0.088 1.00 96.44 16 A 1 
ATOM 116 C CA  . GLY A 1 16 ? 9.853   3.571  -1.367 1.00 96.23 16 A 1 
ATOM 117 C C   . GLY A 1 16 ? 10.268  4.908  -1.936 1.00 96.53 16 A 1 
ATOM 118 O O   . GLY A 1 16 ? 11.414  5.084  -2.355 1.00 95.02 16 A 1 
ATOM 119 N N   . LEU A 1 17 ? 9.351   5.873  -1.962 1.00 94.51 17 A 1 
ATOM 120 C CA  . LEU A 1 17 ? 9.651   7.188  -2.523 1.00 94.20 17 A 1 
ATOM 121 C C   . LEU A 1 17 ? 10.640  7.955  -1.655 1.00 94.54 17 A 1 
ATOM 122 O O   . LEU A 1 17 ? 11.462  8.722  -2.165 1.00 91.69 17 A 1 
ATOM 123 C CB  . LEU A 1 17 ? 8.353   7.984  -2.704 1.00 92.56 17 A 1 
ATOM 124 C CG  . LEU A 1 17 ? 7.689   8.422  -1.399 1.00 86.87 17 A 1 
ATOM 125 C CD1 . LEU A 1 17 ? 8.203   9.790  -0.974 1.00 81.63 17 A 1 
ATOM 126 C CD2 . LEU A 1 17 ? 6.181   8.476  -1.583 1.00 78.62 17 A 1 
ATOM 127 N N   . VAL A 1 18 ? 10.569  7.773  -0.340 1.00 95.54 18 A 1 
ATOM 128 C CA  . VAL A 1 18 ? 11.485  8.453  0.578  1.00 94.78 18 A 1 
ATOM 129 C C   . VAL A 1 18 ? 12.906  7.944  0.389  1.00 94.73 18 A 1 
ATOM 130 O O   . VAL A 1 18 ? 13.869  8.718  0.425  1.00 91.21 18 A 1 
ATOM 131 C CB  . VAL A 1 18 ? 11.044  8.255  2.039  1.00 92.24 18 A 1 
ATOM 132 C CG1 . VAL A 1 18 ? 12.120  8.747  2.999  1.00 86.66 18 A 1 
ATOM 133 C CG2 . VAL A 1 18 ? 9.751   8.997  2.295  1.00 87.32 18 A 1 
ATOM 134 N N   . SER A 1 19 ? 13.054  6.641  0.193  1.00 93.45 19 A 1 
ATOM 135 C CA  . SER A 1 19 ? 14.364  6.021  0.009  1.00 93.19 19 A 1 
ATOM 136 C C   . SER A 1 19 ? 14.918  6.247  -1.391 1.00 92.46 19 A 1 
ATOM 137 O O   . SER A 1 19 ? 16.083  5.945  -1.657 1.00 87.63 19 A 1 
ATOM 138 C CB  . SER A 1 19 ? 14.282  4.518  0.278  1.00 90.43 19 A 1 
ATOM 139 O OG  . SER A 1 19 ? 13.908  4.275  1.619  1.00 79.21 19 A 1 
ATOM 140 N N   . ALA A 1 20 ? 14.105  6.767  -2.286 1.00 91.31 20 A 1 
ATOM 141 C CA  . ALA A 1 20 ? 14.517  7.003  -3.663 1.00 88.85 20 A 1 
ATOM 142 C C   . ALA A 1 20 ? 15.572  8.107  -3.745 1.00 85.79 20 A 1 
ATOM 143 O O   . ALA A 1 20 ? 15.666  8.922  -2.811 1.00 80.11 20 A 1 
ATOM 144 C CB  . ALA A 1 20 ? 13.305  7.360  -4.514 1.00 83.39 20 A 1 
ATOM 145 O OXT . ALA A 1 20 ? 16.304  8.153  -4.749 1.00 74.23 20 A 1 
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