# 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_spkb28774 # _entry.id spkb28774 # 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" "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" "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" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "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 PHE 3 1 n SER 4 1 n SER 5 1 n GLY 6 1 n LYS 7 1 n SER 8 1 n ILE 9 1 n ILE 10 1 n PHE 11 1 n ALA 12 1 n THR 13 1 n ILE 14 1 n ALA 15 1 n SER 16 1 n LEU 17 1 n ALA 18 1 n LEU 19 1 n SER 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 @ 2025-07-12 09:41:54)" _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 88.71 _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 80.03 1 1 A LYS 2 2 70.89 1 2 A PHE 3 2 74.19 1 3 A SER 4 2 83.15 1 4 A SER 5 2 85.78 1 5 A GLY 6 2 91.80 1 6 A LYS 7 2 86.61 1 7 A SER 8 2 91.18 1 8 A ILE 9 2 91.45 1 9 A ILE 10 2 91.89 1 10 A PHE 11 2 91.34 1 11 A ALA 12 2 95.73 1 12 A THR 13 2 95.01 1 13 A ILE 14 2 94.95 1 14 A ALA 15 2 97.58 1 15 A SER 16 2 95.73 1 16 A LEU 17 2 94.41 1 17 A ALA 18 2 97.97 1 18 A LEU 19 2 94.14 1 19 A SER 20 2 89.49 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 LYS . 2 A 2 A 3 1 n PHE . 3 A 3 A 4 1 n SER . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n GLY . 6 A 6 A 7 1 n LYS . 7 A 7 A 8 1 n SER . 8 A 8 A 9 1 n ILE . 9 A 9 A 10 1 n ILE . 10 A 10 A 11 1 n PHE . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n THR . 13 A 13 A 14 1 n ILE . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n LEU . 19 A 19 A 20 1 n SER . 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 ? -13.935 -0.594 -7.596 1.00 84.50 1 A 1 ATOM 2 C CA . MET A 1 1 ? -13.493 -1.345 -6.402 1.00 87.27 1 A 1 ATOM 3 C C . MET A 1 1 ? -12.460 -0.544 -5.604 1.00 87.95 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.327 -0.375 -6.046 1.00 82.54 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.883 -2.679 -6.814 1.00 81.80 1 A 1 ATOM 6 C CG . MET A 1 1 ? -13.114 -3.767 -5.792 1.00 77.76 1 A 1 ATOM 7 S SD . MET A 1 1 ? -12.870 -5.407 -6.484 1.00 73.52 1 A 1 ATOM 8 C CE . MET A 1 1 ? -14.315 -6.235 -5.861 1.00 64.94 1 A 1 ATOM 9 N N . LYS A 1 2 ? -12.863 -0.030 -4.452 1.00 75.78 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -11.975 0.773 -3.613 1.00 80.59 2 A 1 ATOM 11 C C . LYS A 1 2 ? -11.796 0.163 -2.224 1.00 81.13 2 A 1 ATOM 12 O O . LYS A 1 2 ? -10.784 0.411 -1.568 1.00 76.71 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -12.517 2.199 -3.483 1.00 74.64 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -13.906 2.267 -2.869 1.00 67.86 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -14.422 3.694 -2.854 1.00 67.78 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -15.820 3.769 -2.268 1.00 59.14 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -15.791 3.896 -0.794 1.00 54.37 2 A 1 ATOM 18 N N . PHE A 1 3 ? -12.776 -0.615 -1.777 1.00 83.19 3 A 1 ATOM 19 C CA . PHE A 1 3 ? -12.710 -1.241 -0.460 1.00 84.01 3 A 1 ATOM 20 C C . PHE A 1 3 ? -11.711 -2.390 -0.450 1.00 86.59 3 A 1 ATOM 21 O O . PHE A 1 3 ? -10.850 -2.472 0.430 1.00 82.61 3 A 1 ATOM 22 C CB . PHE A 1 3 ? -14.094 -1.738 -0.048 1.00 79.45 3 A 1 ATOM 23 C CG . PHE A 1 3 ? -14.367 -1.512 1.417 1.00 72.31 3 A 1 ATOM 24 C CD1 . PHE A 1 3 ? -13.974 -2.446 2.355 1.00 71.28 3 A 1 ATOM 25 C CD2 . PHE A 1 3 ? -15.006 -0.361 1.836 1.00 66.97 3 A 1 ATOM 26 C CE1 . PHE A 1 3 ? -14.216 -2.235 3.702 1.00 63.29 3 A 1 ATOM 27 C CE2 . PHE A 1 3 ? -15.251 -0.141 3.185 1.00 65.35 3 A 1 ATOM 28 C CZ . PHE A 1 3 ? -14.856 -1.080 4.118 1.00 61.09 3 A 1 ATOM 29 N N . SER A 1 4 ? -11.797 -3.260 -1.440 1.00 85.15 4 A 1 ATOM 30 C CA . SER A 1 4 ? -10.877 -4.390 -1.553 1.00 86.86 4 A 1 ATOM 31 C C . SER A 1 4 ? -9.490 -3.922 -1.968 1.00 87.85 4 A 1 ATOM 32 O O . SER A 1 4 ? -8.481 -4.394 -1.445 1.00 83.90 4 A 1 ATOM 33 C CB . SER A 1 4 ? -11.404 -5.404 -2.562 1.00 83.15 4 A 1 ATOM 34 O OG . SER A 1 4 ? -12.641 -5.933 -2.127 1.00 71.98 4 A 1 ATOM 35 N N . SER A 1 5 ? -9.431 -2.979 -2.905 1.00 87.24 5 A 1 ATOM 36 C CA . SER A 1 5 ? -8.161 -2.434 -3.381 1.00 89.50 5 A 1 ATOM 37 C C . SER A 1 5 ? -7.545 -1.494 -2.353 1.00 90.30 5 A 1 ATOM 38 O O . SER A 1 5 ? -6.335 -1.286 -2.343 1.00 87.21 5 A 1 ATOM 39 C CB . SER A 1 5 ? -8.364 -1.701 -4.703 1.00 85.24 5 A 1 ATOM 40 O OG . SER A 1 5 ? -8.804 -2.593 -5.705 1.00 75.20 5 A 1 ATOM 41 N N . GLY A 1 6 ? -8.382 -0.911 -1.495 1.00 89.79 6 A 1 ATOM 42 C CA . GLY A 1 6 ? -7.907 -0.000 -0.459 1.00 91.82 6 A 1 ATOM 43 C C . GLY A 1 6 ? -6.844 -0.633 0.414 1.00 93.78 6 A 1 ATOM 44 O O . GLY A 1 6 ? -5.838 -0.006 0.745 1.00 91.80 6 A 1 ATOM 45 N N . LYS A 1 7 ? -7.051 -1.891 0.772 1.00 93.39 7 A 1 ATOM 46 C CA . LYS A 1 7 ? -6.084 -2.618 1.596 1.00 94.22 7 A 1 ATOM 47 C C . LYS A 1 7 ? -4.763 -2.768 0.854 1.00 94.60 7 A 1 ATOM 48 O O . LYS A 1 7 ? -3.693 -2.624 1.446 1.00 93.20 7 A 1 ATOM 49 C CB . LYS A 1 7 ? -6.640 -3.994 1.962 1.00 92.69 7 A 1 ATOM 50 C CG . LYS A 1 7 ? -7.577 -3.948 3.159 1.00 86.23 7 A 1 ATOM 51 C CD . LYS A 1 7 ? -6.804 -4.049 4.461 1.00 81.64 7 A 1 ATOM 52 C CE . LYS A 1 7 ? -7.732 -4.227 5.650 1.00 75.94 7 A 1 ATOM 53 N NZ . LYS A 1 7 ? -7.000 -4.686 6.860 1.00 67.57 7 A 1 ATOM 54 N N . SER A 1 8 ? -4.827 -3.039 -0.435 1.00 92.75 8 A 1 ATOM 55 C CA . SER A 1 8 ? -3.631 -3.197 -1.256 1.00 93.58 8 A 1 ATOM 56 C C . SER A 1 8 ? -2.869 -1.881 -1.363 1.00 94.90 8 A 1 ATOM 57 O O . SER A 1 8 ? -1.643 -1.865 -1.333 1.00 93.95 8 A 1 ATOM 58 C CB . SER A 1 8 ? -4.006 -3.690 -2.646 1.00 91.65 8 A 1 ATOM 59 O OG . SER A 1 8 ? -4.628 -4.958 -2.564 1.00 80.22 8 A 1 ATOM 60 N N . ILE A 1 9 ? -3.603 -0.772 -1.485 1.00 92.88 9 A 1 ATOM 61 C CA . ILE A 1 9 ? -2.988 0.551 -1.584 1.00 93.76 9 A 1 ATOM 62 C C . ILE A 1 9 ? -2.242 0.886 -0.300 1.00 94.82 9 A 1 ATOM 63 O O . ILE A 1 9 ? -1.131 1.413 -0.333 1.00 94.19 9 A 1 ATOM 64 C CB . ILE A 1 9 ? -4.048 1.627 -1.868 1.00 93.39 9 A 1 ATOM 65 C CG1 . ILE A 1 9 ? -4.693 1.386 -3.236 1.00 89.97 9 A 1 ATOM 66 C CG2 . ILE A 1 9 ? -3.428 3.021 -1.824 1.00 89.18 9 A 1 ATOM 67 C CD1 . ILE A 1 9 ? -5.947 2.206 -3.460 1.00 83.41 9 A 1 ATOM 68 N N . ILE A 1 10 ? -2.857 0.592 0.828 1.00 93.61 10 A 1 ATOM 69 C CA . ILE A 1 10 ? -2.238 0.859 2.124 1.00 94.02 10 A 1 ATOM 70 C C . ILE A 1 10 ? -0.955 0.050 2.270 1.00 94.75 10 A 1 ATOM 71 O O . ILE A 1 10 ? 0.065 0.555 2.738 1.00 94.48 10 A 1 ATOM 72 C CB . ILE A 1 10 ? -3.207 0.523 3.271 1.00 93.74 10 A 1 ATOM 73 C CG1 . ILE A 1 10 ? -4.422 1.452 3.225 1.00 90.51 10 A 1 ATOM 74 C CG2 . ILE A 1 10 ? -2.504 0.658 4.622 1.00 89.90 10 A 1 ATOM 75 C CD1 . ILE A 1 10 ? -5.575 0.968 4.073 1.00 84.09 10 A 1 ATOM 76 N N . PHE A 1 11 ? -1.011 -1.199 1.865 1.00 94.48 11 A 1 ATOM 77 C CA . PHE A 1 11 ? 0.149 -2.081 1.947 1.00 94.44 11 A 1 ATOM 78 C C . PHE A 1 11 ? 1.282 -1.543 1.082 1.00 95.10 11 A 1 ATOM 79 O O . PHE A 1 11 ? 2.441 -1.522 1.499 1.00 94.84 11 A 1 ATOM 80 C CB . PHE A 1 11 ? -0.231 -3.488 1.494 1.00 93.81 11 A 1 ATOM 81 C CG . PHE A 1 11 ? 0.606 -4.562 2.145 1.00 91.21 11 A 1 ATOM 82 C CD1 . PHE A 1 11 ? 1.866 -4.869 1.659 1.00 87.84 11 A 1 ATOM 83 C CD2 . PHE A 1 11 ? 0.122 -5.253 3.248 1.00 88.74 11 A 1 ATOM 84 C CE1 . PHE A 1 11 ? 2.645 -5.851 2.261 1.00 87.88 11 A 1 ATOM 85 C CE2 . PHE A 1 11 ? 0.893 -6.239 3.854 1.00 88.40 11 A 1 ATOM 86 C CZ . PHE A 1 11 ? 2.157 -6.536 3.360 1.00 88.01 11 A 1 ATOM 87 N N . ALA A 1 12 ? 0.954 -1.110 -0.122 1.00 95.75 12 A 1 ATOM 88 C CA . ALA A 1 12 ? 1.949 -0.565 -1.041 1.00 95.72 12 A 1 ATOM 89 C C . ALA A 1 12 ? 2.512 0.750 -0.518 1.00 96.35 12 A 1 ATOM 90 O O . ALA A 1 12 ? 3.703 1.024 -0.663 1.00 95.76 12 A 1 ATOM 91 C CB . ALA A 1 12 ? 1.326 -0.356 -2.413 1.00 95.09 12 A 1 ATOM 92 N N . THR A 1 13 ? 1.656 1.568 0.090 1.00 96.44 13 A 1 ATOM 93 C CA . THR A 1 13 ? 2.074 2.860 0.637 1.00 96.50 13 A 1 ATOM 94 C C . THR A 1 13 ? 3.075 2.663 1.768 1.00 97.10 13 A 1 ATOM 95 O O . THR A 1 13 ? 4.101 3.341 1.824 1.00 96.67 13 A 1 ATOM 96 C CB . THR A 1 13 ? 0.863 3.637 1.160 1.00 95.91 13 A 1 ATOM 97 O OG1 . THR A 1 13 ? -0.061 3.845 0.097 1.00 91.94 13 A 1 ATOM 98 C CG2 . THR A 1 13 ? 1.283 4.994 1.710 1.00 90.53 13 A 1 ATOM 99 N N . ILE A 1 14 ? 2.774 1.748 2.667 1.00 96.73 14 A 1 ATOM 100 C CA . ILE A 1 14 ? 3.655 1.468 3.796 1.00 96.55 14 A 1 ATOM 101 C C . ILE A 1 14 ? 4.992 0.930 3.303 1.00 96.90 14 A 1 ATOM 102 O O . ILE A 1 14 ? 6.053 1.332 3.787 1.00 96.41 14 A 1 ATOM 103 C CB . ILE A 1 14 ? 3.006 0.458 4.761 1.00 95.89 14 A 1 ATOM 104 C CG1 . ILE A 1 14 ? 1.743 1.059 5.386 1.00 93.27 14 A 1 ATOM 105 C CG2 . ILE A 1 14 ? 3.994 0.066 5.864 1.00 93.23 14 A 1 ATOM 106 C CD1 . ILE A 1 14 ? 0.880 0.036 6.091 1.00 90.62 14 A 1 ATOM 107 N N . ALA A 1 15 ? 4.939 0.024 2.353 1.00 97.88 15 A 1 ATOM 108 C CA . ALA A 1 15 ? 6.152 -0.572 1.802 1.00 97.71 15 A 1 ATOM 109 C C . ALA A 1 15 ? 7.019 0.478 1.115 1.00 97.88 15 A 1 ATOM 110 O O . ALA A 1 15 ? 8.240 0.480 1.265 1.00 97.23 15 A 1 ATOM 111 C CB . ALA A 1 15 ? 5.785 -1.673 0.815 1.00 97.19 15 A 1 ATOM 112 N N . SER A 1 16 ? 6.392 1.376 0.362 1.00 97.94 16 A 1 ATOM 113 C CA . SER A 1 16 ? 7.113 2.429 -0.350 1.00 97.80 16 A 1 ATOM 114 C C . SER A 1 16 ? 7.716 3.440 0.619 1.00 98.06 16 A 1 ATOM 115 O O . SER A 1 16 ? 8.874 3.827 0.482 1.00 97.23 16 A 1 ATOM 116 C CB . SER A 1 16 ? 6.184 3.141 -1.327 1.00 97.06 16 A 1 ATOM 117 O OG . SER A 1 16 ? 5.759 2.254 -2.344 1.00 86.27 16 A 1 ATOM 118 N N . LEU A 1 17 ? 6.923 3.870 1.596 1.00 97.86 17 A 1 ATOM 119 C CA . LEU A 1 17 ? 7.389 4.841 2.588 1.00 97.59 17 A 1 ATOM 120 C C . LEU A 1 17 ? 8.499 4.260 3.451 1.00 97.95 17 A 1 ATOM 121 O O . LEU A 1 17 ? 9.457 4.956 3.798 1.00 97.38 17 A 1 ATOM 122 C CB . LEU A 1 17 ? 6.222 5.279 3.475 1.00 96.70 17 A 1 ATOM 123 C CG . LEU A 1 17 ? 5.307 6.314 2.830 1.00 90.83 17 A 1 ATOM 124 C CD1 . LEU A 1 17 ? 3.989 6.408 3.588 1.00 88.05 17 A 1 ATOM 125 C CD2 . LEU A 1 17 ? 5.987 7.674 2.807 1.00 88.90 17 A 1 ATOM 126 N N . ALA A 1 18 ? 8.375 3.000 3.805 1.00 98.17 18 A 1 ATOM 127 C CA . ALA A 1 18 ? 9.374 2.329 4.633 1.00 98.20 18 A 1 ATOM 128 C C . ALA A 1 18 ? 10.696 2.172 3.892 1.00 98.31 18 A 1 ATOM 129 O O . ALA A 1 18 ? 11.766 2.191 4.504 1.00 97.60 18 A 1 ATOM 130 C CB . ALA A 1 18 ? 8.859 0.965 5.072 1.00 97.59 18 A 1 ATOM 131 N N . LEU A 1 19 ? 10.624 2.017 2.579 1.00 97.73 19 A 1 ATOM 132 C CA . LEU A 1 19 ? 11.819 1.844 1.751 1.00 97.61 19 A 1 ATOM 133 C C . LEU A 1 19 ? 12.225 3.143 1.059 1.00 97.76 19 A 1 ATOM 134 O O . LEU A 1 19 ? 12.897 3.129 0.025 1.00 96.85 19 A 1 ATOM 135 C CB . LEU A 1 19 ? 11.578 0.748 0.709 1.00 96.70 19 A 1 ATOM 136 C CG . LEU A 1 19 ? 12.847 0.100 0.165 1.00 92.27 19 A 1 ATOM 137 C CD1 . LEU A 1 19 ? 13.421 -0.869 1.195 1.00 88.15 19 A 1 ATOM 138 C CD2 . LEU A 1 19 ? 12.556 -0.635 -1.137 1.00 86.06 19 A 1 ATOM 139 N N . SER A 1 20 ? 11.843 4.272 1.627 1.00 95.17 20 A 1 ATOM 140 C CA . SER A 1 20 ? 12.166 5.575 1.046 1.00 94.21 20 A 1 ATOM 141 C C . SER A 1 20 ? 13.160 6.315 1.920 1.00 92.31 20 A 1 ATOM 142 O O . SER A 1 20 ? 12.739 7.026 2.849 1.00 86.48 20 A 1 ATOM 143 C CB . SER A 1 20 ? 10.908 6.409 0.850 1.00 90.76 20 A 1 ATOM 144 O OG . SER A 1 20 ? 10.190 5.969 -0.288 1.00 82.83 20 A 1 ATOM 145 O OXT . SER A 1 20 ? 14.373 6.183 1.666 1.00 84.67 20 A 1 #