# 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_spkb18404 # _entry.id spkb18404 # 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 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" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)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" "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 ARG 3 1 n ILE 4 1 n LEU 5 1 n THR 6 1 n LEU 7 1 n THR 8 1 n VAL 9 1 n ALA 10 1 n ALA 11 1 n LEU 12 1 n ALA 13 1 n LEU 14 1 n GLY 15 1 n THR 16 1 n PRO 17 1 n ALA 18 1 n LEU 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 @ 2025-07-03 15:54:22)" _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 91.77 _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 87.27 1 1 A LYS 2 2 90.52 1 2 A ARG 3 2 89.44 1 3 A ILE 4 2 93.79 1 4 A LEU 5 2 93.05 1 5 A THR 6 2 94.47 1 6 A LEU 7 2 92.82 1 7 A THR 8 2 92.77 1 8 A VAL 9 2 95.50 1 9 A ALA 10 2 95.00 1 10 A ALA 11 2 95.16 1 11 A LEU 12 2 92.95 1 12 A ALA 13 2 96.37 1 13 A LEU 14 2 94.14 1 14 A GLY 15 2 95.07 1 15 A THR 16 2 91.62 1 16 A PRO 17 2 93.12 1 17 A ALA 18 2 90.11 1 18 A LEU 19 2 86.05 1 19 A ALA 20 2 80.72 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 ARG . 3 A 3 A 4 1 n ILE . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n THR . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n THR . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n ALA . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n GLY . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n PRO . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n LEU . 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 ? -2.923 12.404 -3.365 1.00 92.07 1 A 1 ATOM 2 C CA . MET A 1 1 ? -2.922 10.936 -3.292 1.00 93.81 1 A 1 ATOM 3 C C . MET A 1 1 ? -1.579 10.394 -2.789 1.00 94.71 1 A 1 ATOM 4 O O . MET A 1 1 ? -0.788 9.848 -3.559 1.00 92.48 1 A 1 ATOM 5 C CB . MET A 1 1 ? -3.249 10.335 -4.661 1.00 89.72 1 A 1 ATOM 6 C CG . MET A 1 1 ? -2.500 10.989 -5.811 1.00 84.96 1 A 1 ATOM 7 S SD . MET A 1 1 ? -3.195 10.534 -7.398 1.00 80.53 1 A 1 ATOM 8 C CE . MET A 1 1 ? -2.326 11.663 -8.465 1.00 69.84 1 A 1 ATOM 9 N N . LYS A 1 2 ? -1.333 10.575 -1.526 1.00 95.29 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -0.089 10.110 -0.912 1.00 96.11 2 A 1 ATOM 11 C C . LYS A 1 2 ? -0.356 8.962 0.062 1.00 96.75 2 A 1 ATOM 12 O O . LYS A 1 2 ? 0.402 7.994 0.111 1.00 95.65 2 A 1 ATOM 13 C CB . LYS A 1 2 ? 0.599 11.277 -0.195 1.00 94.80 2 A 1 ATOM 14 C CG . LYS A 1 2 ? 2.038 10.982 0.158 1.00 90.39 2 A 1 ATOM 15 C CD . LYS A 1 2 ? 2.732 12.220 0.713 1.00 88.09 2 A 1 ATOM 16 C CE . LYS A 1 2 ? 2.567 12.305 2.212 1.00 81.49 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? 3.366 13.435 2.771 1.00 76.09 2 A 1 ATOM 18 N N . ARG A 1 3 ? -1.442 9.093 0.822 1.00 96.57 3 A 1 ATOM 19 C CA . ARG A 1 3 ? -1.818 8.075 1.800 1.00 97.10 3 A 1 ATOM 20 C C . ARG A 1 3 ? -2.243 6.776 1.124 1.00 97.61 3 A 1 ATOM 21 O O . ARG A 1 3 ? -1.847 5.691 1.551 1.00 96.31 3 A 1 ATOM 22 C CB . ARG A 1 3 ? -2.943 8.597 2.692 1.00 96.28 3 A 1 ATOM 23 C CG . ARG A 1 3 ? -2.435 9.410 3.872 1.00 92.98 3 A 1 ATOM 24 C CD . ARG A 1 3 ? -1.793 8.492 4.908 1.00 89.60 3 A 1 ATOM 25 N NE . ARG A 1 3 ? -1.497 9.183 6.158 1.00 84.16 3 A 1 ATOM 26 C CZ . ARG A 1 3 ? -0.855 8.633 7.178 1.00 82.08 3 A 1 ATOM 27 N NH1 . ARG A 1 3 ? -0.423 7.392 7.098 1.00 76.18 3 A 1 ATOM 28 N NH2 . ARG A 1 3 ? -0.639 9.322 8.282 1.00 74.99 3 A 1 ATOM 29 N N . ILE A 1 4 ? -3.045 6.894 0.069 1.00 96.13 4 A 1 ATOM 30 C CA . ILE A 1 4 ? -3.531 5.730 -0.667 1.00 95.76 4 A 1 ATOM 31 C C . ILE A 1 4 ? -2.381 4.930 -1.279 1.00 95.64 4 A 1 ATOM 32 O O . ILE A 1 4 ? -2.408 3.699 -1.288 1.00 94.38 4 A 1 ATOM 33 C CB . ILE A 1 4 ? -4.530 6.149 -1.765 1.00 95.79 4 A 1 ATOM 34 C CG1 . ILE A 1 4 ? -3.991 7.301 -2.612 1.00 93.21 4 A 1 ATOM 35 C CG2 . ILE A 1 4 ? -5.877 6.510 -1.138 1.00 92.17 4 A 1 ATOM 36 C CD1 . ILE A 1 4 ? -4.626 7.385 -3.980 1.00 87.22 4 A 1 ATOM 37 N N . LEU A 1 5 ? -1.388 5.645 -1.781 1.00 96.45 5 A 1 ATOM 38 C CA . LEU A 1 5 ? -0.227 5.006 -2.393 1.00 96.02 5 A 1 ATOM 39 C C . LEU A 1 5 ? 0.626 4.312 -1.337 1.00 95.94 5 A 1 ATOM 40 O O . LEU A 1 5 ? 1.124 3.209 -1.555 1.00 95.10 5 A 1 ATOM 41 C CB . LEU A 1 5 ? 0.602 6.049 -3.148 1.00 95.83 5 A 1 ATOM 42 C CG . LEU A 1 5 ? 1.134 5.571 -4.489 1.00 90.81 5 A 1 ATOM 43 C CD1 . LEU A 1 5 ? 0.644 6.473 -5.617 1.00 87.29 5 A 1 ATOM 44 C CD2 . LEU A 1 5 ? 2.645 5.520 -4.482 1.00 86.94 5 A 1 ATOM 45 N N . THR A 1 6 ? 0.773 4.958 -0.212 1.00 96.53 6 A 1 ATOM 46 C CA . THR A 1 6 ? 1.555 4.417 0.900 1.00 96.08 6 A 1 ATOM 47 C C . THR A 1 6 ? 0.924 3.124 1.411 1.00 95.71 6 A 1 ATOM 48 O O . THR A 1 6 ? 1.630 2.167 1.732 1.00 94.82 6 A 1 ATOM 49 C CB . THR A 1 6 ? 1.655 5.438 2.040 1.00 95.60 6 A 1 ATOM 50 O OG1 . THR A 1 6 ? 2.124 6.677 1.528 1.00 92.13 6 A 1 ATOM 51 C CG2 . THR A 1 6 ? 2.617 4.969 3.123 1.00 90.44 6 A 1 ATOM 52 N N . LEU A 1 7 ? -0.398 3.100 1.458 1.00 95.70 7 A 1 ATOM 53 C CA . LEU A 1 7 ? -1.130 1.926 1.922 1.00 95.10 7 A 1 ATOM 54 C C . LEU A 1 7 ? -0.922 0.746 0.977 1.00 95.24 7 A 1 ATOM 55 O O . LEU A 1 7 ? -0.775 -0.394 1.418 1.00 94.16 7 A 1 ATOM 56 C CB . LEU A 1 7 ? -2.620 2.250 2.035 1.00 94.67 7 A 1 ATOM 57 C CG . LEU A 1 7 ? -3.005 3.071 3.264 1.00 91.41 7 A 1 ATOM 58 C CD1 . LEU A 1 7 ? -4.349 3.741 3.066 1.00 88.36 7 A 1 ATOM 59 C CD2 . LEU A 1 7 ? -3.041 2.183 4.502 1.00 87.94 7 A 1 ATOM 60 N N . THR A 1 8 ? -0.904 1.029 -0.310 1.00 93.96 8 A 1 ATOM 61 C CA . THR A 1 8 ? -0.703 0.003 -1.331 1.00 93.69 8 A 1 ATOM 62 C C . THR A 1 8 ? 0.695 -0.598 -1.214 1.00 94.37 8 A 1 ATOM 63 O O . THR A 1 8 ? 0.866 -1.815 -1.306 1.00 94.06 8 A 1 ATOM 64 C CB . THR A 1 8 ? -0.907 0.590 -2.733 1.00 93.66 8 A 1 ATOM 65 O OG1 . THR A 1 8 ? -2.139 1.295 -2.779 1.00 91.10 8 A 1 ATOM 66 C CG2 . THR A 1 8 ? -0.930 -0.498 -3.795 1.00 88.53 8 A 1 ATOM 67 N N . VAL A 1 9 ? 1.671 0.250 -1.006 1.00 96.34 9 A 1 ATOM 68 C CA . VAL A 1 9 ? 3.061 -0.181 -0.869 1.00 96.29 9 A 1 ATOM 69 C C . VAL A 1 9 ? 3.224 -1.027 0.393 1.00 96.29 9 A 1 ATOM 70 O O . VAL A 1 9 ? 3.938 -2.033 0.388 1.00 95.70 9 A 1 ATOM 71 C CB . VAL A 1 9 ? 4.018 1.029 -0.836 1.00 95.92 9 A 1 ATOM 72 C CG1 . VAL A 1 9 ? 5.455 0.589 -0.623 1.00 94.22 9 A 1 ATOM 73 C CG2 . VAL A 1 9 ? 3.915 1.829 -2.126 1.00 93.72 9 A 1 ATOM 74 N N . ALA A 1 10 ? 2.551 -0.616 1.446 1.00 95.86 10 A 1 ATOM 75 C CA . ALA A 1 10 ? 2.608 -1.331 2.716 1.00 95.05 10 A 1 ATOM 76 C C . ALA A 1 10 ? 2.031 -2.737 2.577 1.00 95.45 10 A 1 ATOM 77 O O . ALA A 1 10 ? 2.572 -3.693 3.134 1.00 94.20 10 A 1 ATOM 78 C CB . ALA A 1 10 ? 1.849 -0.556 3.783 1.00 94.45 10 A 1 ATOM 79 N N . ALA A 1 11 ? 0.950 -2.856 1.827 1.00 95.60 11 A 1 ATOM 80 C CA . ALA A 1 11 ? 0.300 -4.143 1.594 1.00 95.28 11 A 1 ATOM 81 C C . ALA A 1 11 ? 1.202 -5.073 0.791 1.00 95.94 11 A 1 ATOM 82 O O . ALA A 1 11 ? 1.269 -6.272 1.059 1.00 94.43 11 A 1 ATOM 83 C CB . ALA A 1 11 ? -1.020 -3.933 0.865 1.00 94.55 11 A 1 ATOM 84 N N . LEU A 1 12 ? 1.896 -4.509 -0.180 1.00 96.30 12 A 1 ATOM 85 C CA . LEU A 1 12 ? 2.812 -5.275 -1.021 1.00 95.86 12 A 1 ATOM 86 C C . LEU A 1 12 ? 3.983 -5.808 -0.207 1.00 96.33 12 A 1 ATOM 87 O O . LEU A 1 12 ? 4.407 -6.950 -0.394 1.00 94.93 12 A 1 ATOM 88 C CB . LEU A 1 12 ? 3.326 -4.396 -2.161 1.00 95.17 12 A 1 ATOM 89 C CG . LEU A 1 12 ? 2.380 -4.280 -3.353 1.00 90.36 12 A 1 ATOM 90 C CD1 . LEU A 1 12 ? 2.647 -3.009 -4.136 1.00 86.89 12 A 1 ATOM 91 C CD2 . LEU A 1 12 ? 2.517 -5.494 -4.257 1.00 87.79 12 A 1 ATOM 92 N N . ALA A 1 13 ? 4.497 -4.978 0.669 1.00 96.85 13 A 1 ATOM 93 C CA . ALA A 1 13 ? 5.618 -5.356 1.522 1.00 96.64 13 A 1 ATOM 94 C C . ALA A 1 13 ? 5.216 -6.432 2.527 1.00 97.00 13 A 1 ATOM 95 O O . ALA A 1 13 ? 6.004 -7.324 2.836 1.00 95.60 13 A 1 ATOM 96 C CB . ALA A 1 13 ? 6.149 -4.130 2.251 1.00 95.78 13 A 1 ATOM 97 N N . LEU A 1 14 ? 3.986 -6.347 3.006 1.00 97.19 14 A 1 ATOM 98 C CA . LEU A 1 14 ? 3.475 -7.307 3.978 1.00 96.99 14 A 1 ATOM 99 C C . LEU A 1 14 ? 3.170 -8.652 3.337 1.00 97.12 14 A 1 ATOM 100 O O . LEU A 1 14 ? 3.578 -9.696 3.849 1.00 95.61 14 A 1 ATOM 101 C CB . LEU A 1 14 ? 2.227 -6.745 4.657 1.00 96.12 14 A 1 ATOM 102 C CG . LEU A 1 14 ? 2.519 -5.798 5.818 1.00 92.74 14 A 1 ATOM 103 C CD1 . LEU A 1 14 ? 1.325 -4.897 6.087 1.00 88.84 14 A 1 ATOM 104 C CD2 . LEU A 1 14 ? 2.876 -6.589 7.063 1.00 88.52 14 A 1 ATOM 105 N N . GLY A 1 15 ? 2.455 -8.639 2.233 1.00 95.28 15 A 1 ATOM 106 C CA . GLY A 1 15 ? 2.125 -9.886 1.550 1.00 94.99 15 A 1 ATOM 107 C C . GLY A 1 15 ? 1.082 -9.745 0.467 1.00 95.66 15 A 1 ATOM 108 O O . GLY A 1 15 ? 0.826 -10.698 -0.270 1.00 94.36 15 A 1 ATOM 109 N N . THR A 1 16 ? 0.492 -8.564 0.365 1.00 94.33 16 A 1 ATOM 110 C CA . THR A 1 16 ? -0.530 -8.272 -0.649 1.00 94.13 16 A 1 ATOM 111 C C . THR A 1 16 ? -1.694 -9.264 -0.573 1.00 94.43 16 A 1 ATOM 112 O O . THR A 1 16 ? -1.691 -10.287 -1.263 1.00 93.22 16 A 1 ATOM 113 C CB . THR A 1 16 ? 0.081 -8.304 -2.059 1.00 92.75 16 A 1 ATOM 114 O OG1 . THR A 1 16 ? 1.386 -7.740 -2.042 1.00 86.99 16 A 1 ATOM 115 C CG2 . THR A 1 16 ? -0.782 -7.536 -3.040 1.00 85.49 16 A 1 ATOM 116 N N . PRO A 1 17 ? -2.688 -8.972 0.246 1.00 95.25 17 A 1 ATOM 117 C CA . PRO A 1 17 ? -3.848 -9.859 0.408 1.00 94.52 17 A 1 ATOM 118 C C . PRO A 1 17 ? -4.704 -9.954 -0.848 1.00 94.73 17 A 1 ATOM 119 O O . PRO A 1 17 ? -5.359 -10.968 -1.083 1.00 91.99 17 A 1 ATOM 120 C CB . PRO A 1 17 ? -4.639 -9.212 1.548 1.00 92.55 17 A 1 ATOM 121 C CG . PRO A 1 17 ? -4.236 -7.782 1.524 1.00 89.90 17 A 1 ATOM 122 C CD . PRO A 1 17 ? -2.800 -7.763 1.062 1.00 92.92 17 A 1 ATOM 123 N N . ALA A 1 18 ? -4.703 -8.908 -1.655 1.00 90.91 18 A 1 ATOM 124 C CA . ALA A 1 18 ? -5.483 -8.874 -2.889 1.00 89.95 18 A 1 ATOM 125 C C . ALA A 1 18 ? -4.943 -9.842 -3.936 1.00 91.64 18 A 1 ATOM 126 O O . ALA A 1 18 ? -5.706 -10.501 -4.637 1.00 89.82 18 A 1 ATOM 127 C CB . ALA A 1 18 ? -5.509 -7.459 -3.446 1.00 88.21 18 A 1 ATOM 128 N N . LEU A 1 19 ? -3.622 -9.925 -4.036 1.00 91.13 19 A 1 ATOM 129 C CA . LEU A 1 19 ? -2.976 -10.812 -5.000 1.00 90.58 19 A 1 ATOM 130 C C . LEU A 1 19 ? -2.788 -12.217 -4.451 1.00 92.00 19 A 1 ATOM 131 O O . LEU A 1 19 ? -2.667 -13.175 -5.217 1.00 89.31 19 A 1 ATOM 132 C CB . LEU A 1 19 ? -1.625 -10.232 -5.421 1.00 88.82 19 A 1 ATOM 133 C CG . LEU A 1 19 ? -1.710 -9.064 -6.394 1.00 83.02 19 A 1 ATOM 134 C CD1 . LEU A 1 19 ? -0.392 -8.317 -6.447 1.00 78.16 19 A 1 ATOM 135 C CD2 . LEU A 1 19 ? -2.087 -9.562 -7.784 1.00 75.38 19 A 1 ATOM 136 N N . ALA A 1 20 ? -2.747 -12.346 -3.146 1.00 85.85 20 A 1 ATOM 137 C CA . ALA A 1 20 ? -2.570 -13.632 -2.486 1.00 84.46 20 A 1 ATOM 138 C C . ALA A 1 20 ? -3.747 -14.578 -2.732 1.00 82.38 20 A 1 ATOM 139 O O . ALA A 1 20 ? -4.813 -14.119 -3.176 1.00 78.45 20 A 1 ATOM 140 C CB . ALA A 1 20 ? -2.361 -13.420 -0.994 1.00 79.79 20 A 1 ATOM 141 O OXT . ALA A 1 20 ? -3.613 -15.785 -2.470 1.00 73.37 20 A 1 #