# 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_spkb31295 # _entry.id spkb31295 # 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" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])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" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "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 LYS 2 1 n CYS 3 1 n PHE 4 1 n PHE 5 1 n PRO 6 1 n VAL 7 1 n LEU 8 1 n SER 9 1 n CYS 10 1 n LEU 11 1 n ALA 12 1 n VAL 13 1 n LEU 14 1 n GLY 15 1 n VAL 16 1 n VAL 17 1 n SER 18 1 n ALA 19 # _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 @ 2025-07-11 11:09:17)" _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 85.12 _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 75.50 1 1 A LYS 2 2 76.16 1 2 A CYS 3 2 81.54 1 3 A PHE 4 2 81.08 1 4 A PHE 5 2 80.23 1 5 A PRO 6 2 88.09 1 6 A VAL 7 2 88.39 1 7 A LEU 8 2 87.45 1 8 A SER 9 2 89.05 1 9 A CYS 10 2 84.50 1 10 A LEU 11 2 86.23 1 11 A ALA 12 2 91.07 1 12 A VAL 13 2 88.51 1 13 A LEU 14 2 88.13 1 14 A GLY 15 2 91.64 1 15 A VAL 16 2 88.88 1 16 A VAL 17 2 89.57 1 17 A SER 18 2 89.31 1 18 A ALA 19 2 85.23 1 19 # _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 LYS . 2 A 2 A 3 1 n CYS . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n PHE . 5 A 5 A 6 1 n PRO . 6 A 6 A 7 1 n VAL . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n SER . 9 A 9 A 10 1 n CYS . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n GLY . 15 A 15 A 16 1 n VAL . 16 A 16 A 17 1 n VAL . 17 A 17 A 18 1 n SER . 18 A 18 A 19 1 n ALA . 19 A 19 # _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 ? 4.021 -2.418 8.758 1.00 80.37 1 A 1 ATOM 2 C CA . MET A 1 1 ? 3.123 -3.024 7.761 1.00 81.17 1 A 1 ATOM 3 C C . MET A 1 1 ? 1.661 -2.701 8.059 1.00 81.84 1 A 1 ATOM 4 O O . MET A 1 1 ? 0.768 -3.476 7.749 1.00 77.10 1 A 1 ATOM 5 C CB . MET A 1 1 ? 3.332 -4.538 7.734 1.00 77.30 1 A 1 ATOM 6 C CG . MET A 1 1 ? 3.146 -5.182 9.094 1.00 75.43 1 A 1 ATOM 7 S SD . MET A 1 1 ? 3.693 -6.894 9.101 1.00 68.45 1 A 1 ATOM 8 C CE . MET A 1 1 ? 5.409 -6.668 9.476 1.00 62.30 1 A 1 ATOM 9 N N . LYS A 1 2 ? 1.461 -1.569 8.672 1.00 83.29 2 A 1 ATOM 10 C CA . LYS A 1 2 ? 0.107 -1.146 9.020 1.00 83.34 2 A 1 ATOM 11 C C . LYS A 1 2 ? -0.453 -0.247 7.916 1.00 83.93 2 A 1 ATOM 12 O O . LYS A 1 2 ? -0.557 0.964 8.080 1.00 82.56 2 A 1 ATOM 13 C CB . LYS A 1 2 ? 0.140 -0.403 10.349 1.00 80.44 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -1.225 -0.312 11.000 1.00 75.08 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -1.371 -1.328 12.105 1.00 71.24 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -2.702 -1.169 12.814 1.00 66.70 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -2.641 -0.054 13.790 1.00 58.87 2 A 1 ATOM 18 N N . CYS A 1 3 ? -0.783 -0.849 6.807 1.00 83.21 3 A 1 ATOM 19 C CA . CYS A 1 3 ? -1.314 -0.106 5.666 1.00 84.09 3 A 1 ATOM 20 C C . CYS A 1 3 ? -2.804 -0.372 5.468 1.00 86.30 3 A 1 ATOM 21 O O . CYS A 1 3 ? -3.242 -0.707 4.374 1.00 82.32 3 A 1 ATOM 22 C CB . CYS A 1 3 ? -0.552 -0.503 4.407 1.00 79.74 3 A 1 ATOM 23 S SG . CYS A 1 3 ? 1.119 0.140 4.355 1.00 73.57 3 A 1 ATOM 24 N N . PHE A 1 4 ? -3.569 -0.218 6.539 1.00 82.54 4 A 1 ATOM 25 C CA . PHE A 1 4 ? -5.004 -0.443 6.443 1.00 83.90 4 A 1 ATOM 26 C C . PHE A 1 4 ? -5.722 0.836 6.046 1.00 86.87 4 A 1 ATOM 27 O O . PHE A 1 4 ? -6.681 0.809 5.283 1.00 85.97 4 A 1 ATOM 28 C CB . PHE A 1 4 ? -5.538 -0.950 7.780 1.00 83.38 4 A 1 ATOM 29 C CG . PHE A 1 4 ? -6.135 -2.329 7.665 1.00 81.68 4 A 1 ATOM 30 C CD1 . PHE A 1 4 ? -7.419 -2.496 7.179 1.00 78.46 4 A 1 ATOM 31 C CD2 . PHE A 1 4 ? -5.402 -3.447 8.032 1.00 78.55 4 A 1 ATOM 32 C CE1 . PHE A 1 4 ? -7.969 -3.764 7.061 1.00 76.09 4 A 1 ATOM 33 C CE2 . PHE A 1 4 ? -5.950 -4.719 7.918 1.00 76.69 4 A 1 ATOM 34 C CZ . PHE A 1 4 ? -7.235 -4.879 7.436 1.00 77.76 4 A 1 ATOM 35 N N . PHE A 1 5 ? -5.241 1.945 6.572 1.00 85.27 5 A 1 ATOM 36 C CA . PHE A 1 5 ? -5.820 3.245 6.240 1.00 85.96 5 A 1 ATOM 37 C C . PHE A 1 5 ? -5.413 3.663 4.830 1.00 88.43 5 A 1 ATOM 38 O O . PHE A 1 5 ? -6.268 3.889 3.972 1.00 86.98 5 A 1 ATOM 39 C CB . PHE A 1 5 ? -5.380 4.287 7.265 1.00 84.17 5 A 1 ATOM 40 C CG . PHE A 1 5 ? -6.021 4.080 8.613 1.00 79.87 5 A 1 ATOM 41 C CD1 . PHE A 1 5 ? -5.478 3.195 9.524 1.00 76.74 5 A 1 ATOM 42 C CD2 . PHE A 1 5 ? -7.170 4.776 8.952 1.00 76.27 5 A 1 ATOM 43 C CE1 . PHE A 1 5 ? -6.074 3.000 10.756 1.00 72.33 5 A 1 ATOM 44 C CE2 . PHE A 1 5 ? -7.767 4.588 10.189 1.00 73.52 5 A 1 ATOM 45 C CZ . PHE A 1 5 ? -7.217 3.695 11.090 1.00 73.00 5 A 1 ATOM 46 N N . PRO A 1 6 ? -4.108 3.746 4.581 1.00 88.80 6 A 1 ATOM 47 C CA . PRO A 1 6 ? -3.608 4.116 3.254 1.00 89.51 6 A 1 ATOM 48 C C . PRO A 1 6 ? -3.390 2.879 2.383 1.00 90.95 6 A 1 ATOM 49 O O . PRO A 1 6 ? -2.370 2.755 1.704 1.00 88.30 6 A 1 ATOM 50 C CB . PRO A 1 6 ? -2.281 4.805 3.564 1.00 86.49 6 A 1 ATOM 51 C CG . PRO A 1 6 ? -1.780 4.115 4.792 1.00 84.63 6 A 1 ATOM 52 C CD . PRO A 1 6 ? -3.019 3.685 5.561 1.00 87.97 6 A 1 ATOM 53 N N . VAL A 1 7 ? -4.342 1.969 2.436 1.00 89.45 7 A 1 ATOM 54 C CA . VAL A 1 7 ? -4.247 0.727 1.677 1.00 89.94 7 A 1 ATOM 55 C C . VAL A 1 7 ? -4.066 0.998 0.192 1.00 90.99 7 A 1 ATOM 56 O O . VAL A 1 7 ? -3.395 0.243 -0.511 1.00 90.01 7 A 1 ATOM 57 C CB . VAL A 1 7 ? -5.505 -0.135 1.888 1.00 88.76 7 A 1 ATOM 58 C CG1 . VAL A 1 7 ? -6.729 0.547 1.299 1.00 84.46 7 A 1 ATOM 59 C CG2 . VAL A 1 7 ? -5.308 -1.504 1.269 1.00 85.14 7 A 1 ATOM 60 N N . LEU A 1 8 ? -4.667 2.076 -0.267 1.00 89.27 8 A 1 ATOM 61 C CA . LEU A 1 8 ? -4.558 2.440 -1.679 1.00 90.14 8 A 1 ATOM 62 C C . LEU A 1 8 ? -3.108 2.696 -2.063 1.00 91.52 8 A 1 ATOM 63 O O . LEU A 1 8 ? -2.642 2.244 -3.110 1.00 91.60 8 A 1 ATOM 64 C CB . LEU A 1 8 ? -5.393 3.691 -1.959 1.00 90.00 8 A 1 ATOM 65 C CG . LEU A 1 8 ? -6.400 3.500 -3.087 1.00 84.00 8 A 1 ATOM 66 C CD1 . LEU A 1 8 ? -7.809 3.409 -2.533 1.00 81.86 8 A 1 ATOM 67 C CD2 . LEU A 1 8 ? -6.295 4.648 -4.078 1.00 81.24 8 A 1 ATOM 68 N N . SER A 1 9 ? -2.403 3.416 -1.202 1.00 90.32 9 A 1 ATOM 69 C CA . SER A 1 9 ? -1.001 3.741 -1.443 1.00 90.25 9 A 1 ATOM 70 C C . SER A 1 9 ? -0.135 2.490 -1.353 1.00 91.20 9 A 1 ATOM 71 O O . SER A 1 9 ? 0.737 2.266 -2.190 1.00 90.57 9 A 1 ATOM 72 C CB . SER A 1 9 ? -0.528 4.780 -0.431 1.00 89.45 9 A 1 ATOM 73 O OG . SER A 1 9 ? 0.464 5.604 -0.986 1.00 82.54 9 A 1 ATOM 74 N N . CYS A 1 10 ? -0.392 1.685 -0.341 1.00 86.47 10 A 1 ATOM 75 C CA . CYS A 1 10 ? 0.381 0.460 -0.159 1.00 86.68 10 A 1 ATOM 76 C C . CYS A 1 10 ? 0.108 -0.533 -1.287 1.00 88.32 10 A 1 ATOM 77 O O . CYS A 1 10 ? 0.991 -1.271 -1.711 1.00 84.88 10 A 1 ATOM 78 C CB . CYS A 1 10 ? 0.049 -0.160 1.196 1.00 83.31 10 A 1 ATOM 79 S SG . CYS A 1 10 ? 1.237 0.352 2.470 1.00 77.35 10 A 1 ATOM 80 N N . LEU A 1 11 ? -1.121 -0.524 -1.753 1.00 87.57 11 A 1 ATOM 81 C CA . LEU A 1 11 ? -1.493 -1.412 -2.852 1.00 89.06 11 A 1 ATOM 82 C C . LEU A 1 11 ? -0.793 -0.980 -4.132 1.00 91.45 11 A 1 ATOM 83 O O . LEU A 1 11 ? -0.384 -1.809 -4.947 1.00 91.31 11 A 1 ATOM 84 C CB . LEU A 1 11 ? -3.012 -1.391 -3.042 1.00 88.56 11 A 1 ATOM 85 C CG . LEU A 1 11 ? -3.651 -2.782 -3.036 1.00 82.42 11 A 1 ATOM 86 C CD1 . LEU A 1 11 ? -5.152 -2.678 -2.801 1.00 79.78 11 A 1 ATOM 87 C CD2 . LEU A 1 11 ? -3.365 -3.500 -4.343 1.00 79.70 11 A 1 ATOM 88 N N . ALA A 1 12 ? -0.660 0.324 -4.287 1.00 90.55 12 A 1 ATOM 89 C CA . ALA A 1 12 ? 0.007 0.879 -5.461 1.00 91.04 12 A 1 ATOM 90 C C . ALA A 1 12 ? 1.447 0.384 -5.530 1.00 92.54 12 A 1 ATOM 91 O O . ALA A 1 12 ? 1.955 0.067 -6.603 1.00 90.84 12 A 1 ATOM 92 C CB . ALA A 1 12 ? -0.023 2.400 -5.404 1.00 90.36 12 A 1 ATOM 93 N N . VAL A 1 13 ? 2.084 0.324 -4.366 1.00 89.76 13 A 1 ATOM 94 C CA . VAL A 1 13 ? 3.469 -0.139 -4.290 1.00 89.96 13 A 1 ATOM 95 C C . VAL A 1 13 ? 3.561 -1.578 -4.778 1.00 91.18 13 A 1 ATOM 96 O O . VAL A 1 13 ? 4.507 -1.960 -5.469 1.00 89.82 13 A 1 ATOM 97 C CB . VAL A 1 13 ? 4.000 -0.049 -2.850 1.00 88.55 13 A 1 ATOM 98 C CG1 . VAL A 1 13 ? 5.433 -0.547 -2.780 1.00 84.70 13 A 1 ATOM 99 C CG2 . VAL A 1 13 ? 3.911 1.380 -2.344 1.00 85.61 13 A 1 ATOM 100 N N . LEU A 1 14 ? 2.572 -2.352 -4.406 1.00 91.87 14 A 1 ATOM 101 C CA . LEU A 1 14 ? 2.534 -3.755 -4.814 1.00 91.63 14 A 1 ATOM 102 C C . LEU A 1 14 ? 2.421 -3.862 -6.329 1.00 92.98 14 A 1 ATOM 103 O O . LEU A 1 14 ? 3.035 -4.728 -6.949 1.00 91.57 14 A 1 ATOM 104 C CB . LEU A 1 14 ? 1.342 -4.452 -4.153 1.00 90.65 14 A 1 ATOM 105 C CG . LEU A 1 14 ? 1.320 -5.967 -4.351 1.00 85.30 14 A 1 ATOM 106 C CD1 . LEU A 1 14 ? 2.308 -6.636 -3.398 1.00 80.95 14 A 1 ATOM 107 C CD2 . LEU A 1 14 ? -0.080 -6.512 -4.116 1.00 80.11 14 A 1 ATOM 108 N N . GLY A 1 15 ? 1.627 -2.985 -6.900 1.00 91.44 15 A 1 ATOM 109 C CA . GLY A 1 15 ? 1.453 -2.979 -8.348 1.00 91.27 15 A 1 ATOM 110 C C . GLY A 1 15 ? 2.722 -2.564 -9.063 1.00 92.38 15 A 1 ATOM 111 O O . GLY A 1 15 ? 3.064 -3.107 -10.114 1.00 91.46 15 A 1 ATOM 112 N N . VAL A 1 16 ? 3.424 -1.608 -8.476 1.00 90.73 16 A 1 ATOM 113 C CA . VAL A 1 16 ? 4.675 -1.118 -9.059 1.00 91.10 16 A 1 ATOM 114 C C . VAL A 1 16 ? 5.738 -2.207 -9.042 1.00 92.11 16 A 1 ATOM 115 O O . VAL A 1 16 ? 6.440 -2.423 -10.031 1.00 90.14 16 A 1 ATOM 116 C CB . VAL A 1 16 ? 5.187 0.114 -8.298 1.00 89.49 16 A 1 ATOM 117 C CG1 . VAL A 1 16 ? 6.537 0.557 -8.846 1.00 83.92 16 A 1 ATOM 118 C CG2 . VAL A 1 16 ? 4.185 1.250 -8.399 1.00 84.64 16 A 1 ATOM 119 N N . VAL A 1 17 ? 5.849 -2.861 -7.905 1.00 92.02 17 A 1 ATOM 120 C CA . VAL A 1 17 ? 6.843 -3.930 -7.769 1.00 91.83 17 A 1 ATOM 121 C C . VAL A 1 17 ? 6.526 -5.081 -8.716 1.00 92.66 17 A 1 ATOM 122 O O . VAL A 1 17 ? 7.421 -5.801 -9.162 1.00 90.95 17 A 1 ATOM 123 C CB . VAL A 1 17 ? 6.889 -4.451 -6.317 1.00 89.60 17 A 1 ATOM 124 C CG1 . VAL A 1 17 ? 5.614 -5.212 -5.977 1.00 84.48 17 A 1 ATOM 125 C CG2 . VAL A 1 17 ? 8.097 -5.350 -6.123 1.00 85.43 17 A 1 ATOM 126 N N . SER A 1 18 ? 5.252 -5.256 -8.997 1.00 91.79 18 A 1 ATOM 127 C CA . SER A 1 18 ? 4.809 -6.316 -9.902 1.00 91.93 18 A 1 ATOM 128 C C . SER A 1 18 ? 5.247 -6.024 -11.331 1.00 91.82 18 A 1 ATOM 129 O O . SER A 1 18 ? 5.518 -6.938 -12.115 1.00 89.94 18 A 1 ATOM 130 C CB . SER A 1 18 ? 3.288 -6.451 -9.850 1.00 90.00 18 A 1 ATOM 131 O OG . SER A 1 18 ? 2.866 -7.614 -10.530 1.00 80.37 18 A 1 ATOM 132 N N . ALA A 1 19 ? 5.305 -4.742 -11.657 1.00 90.22 19 A 1 ATOM 133 C CA . ALA A 1 19 ? 5.707 -4.329 -12.994 1.00 88.99 19 A 1 ATOM 134 C C . ALA A 1 19 ? 7.206 -4.536 -13.215 1.00 87.77 19 A 1 ATOM 135 O O . ALA A 1 19 ? 7.945 -4.706 -12.231 1.00 83.24 19 A 1 ATOM 136 C CB . ALA A 1 19 ? 5.327 -2.868 -13.216 1.00 84.62 19 A 1 ATOM 137 O OXT . ALA A 1 19 ? 7.644 -4.528 -14.370 1.00 76.52 19 A 1 #