# 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_spkb44419 # _entry.id spkb44419 # 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" "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 GLY 2 1 n LEU 3 1 n GLY 4 1 n PHE 5 1 n LEU 6 1 n ARG 7 1 n LEU 8 1 n ALA 9 1 n LEU 10 1 n PRO 11 1 n LEU 12 1 n LEU 13 1 n MET 14 1 n VAL 15 1 n ALA 16 1 n ALA 17 1 n SER 18 1 n ALA 19 1 n PRO 20 1 n ALA 21 1 n VAL 22 1 n ALA 23 # _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 15:26:21)" _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 91.00 _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 77.01 1 1 A GLY 2 2 92.06 1 2 A LEU 3 2 89.69 1 3 A GLY 4 2 95.64 1 4 A PHE 5 2 91.81 1 5 A LEU 6 2 94.60 1 6 A ARG 7 2 89.29 1 7 A LEU 8 2 94.86 1 8 A ALA 9 2 96.74 1 9 A LEU 10 2 94.07 1 10 A PRO 11 2 96.21 1 11 A LEU 12 2 94.95 1 12 A LEU 13 2 94.75 1 13 A MET 14 2 91.63 1 14 A VAL 15 2 93.52 1 15 A ALA 16 2 94.34 1 16 A ALA 17 2 94.15 1 17 A SER 18 2 91.85 1 18 A ALA 19 2 88.50 1 19 A PRO 20 2 89.49 1 20 A ALA 21 2 86.54 1 21 A VAL 22 2 83.65 1 22 A ALA 23 2 80.28 1 23 # _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 GLY . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n GLY . 4 A 4 A 5 1 n PHE . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n ARG . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n PRO . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n MET . 14 A 14 A 15 1 n VAL . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n SER . 18 A 18 A 19 1 n ALA . 19 A 19 A 20 1 n PRO . 20 A 20 A 21 1 n ALA . 21 A 21 A 22 1 n VAL . 22 A 22 A 23 1 n ALA . 23 A 23 # _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 ? -8.896 10.286 17.237 1.00 84.33 1 A 1 ATOM 2 C CA . MET A 1 1 ? -7.779 9.379 16.907 1.00 84.53 1 A 1 ATOM 3 C C . MET A 1 1 ? -8.102 8.528 15.682 1.00 84.40 1 A 1 ATOM 4 O O . MET A 1 1 ? -8.975 7.669 15.738 1.00 78.83 1 A 1 ATOM 5 C CB . MET A 1 1 ? -7.482 8.463 18.093 1.00 78.63 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.841 9.208 19.250 1.00 73.74 1 A 1 ATOM 7 S SD . MET A 1 1 ? -6.304 8.097 20.548 1.00 71.14 1 A 1 ATOM 8 C CE . MET A 1 1 ? -5.455 9.246 21.607 1.00 60.47 1 A 1 ATOM 9 N N . GLY A 1 2 ? -7.400 8.777 14.583 1.00 90.01 2 A 1 ATOM 10 C CA . GLY A 1 2 ? -7.621 8.018 13.354 1.00 91.96 2 A 1 ATOM 11 C C . GLY A 1 2 ? -6.560 8.293 12.301 1.00 93.89 2 A 1 ATOM 12 O O . GLY A 1 2 ? -6.814 8.148 11.108 1.00 92.36 2 A 1 ATOM 13 N N . LEU A 1 3 ? -5.359 8.696 12.724 1.00 93.19 3 A 1 ATOM 14 C CA . LEU A 1 3 ? -4.267 8.997 11.796 1.00 93.82 3 A 1 ATOM 15 C C . LEU A 1 3 ? -3.348 7.796 11.601 1.00 95.01 3 A 1 ATOM 16 O O . LEU A 1 3 ? -2.743 7.640 10.545 1.00 93.00 3 A 1 ATOM 17 C CB . LEU A 1 3 ? -3.457 10.193 12.307 1.00 91.71 3 A 1 ATOM 18 C CG . LEU A 1 3 ? -4.234 11.500 12.414 1.00 87.56 3 A 1 ATOM 19 C CD1 . LEU A 1 3 ? -3.369 12.574 13.048 1.00 83.77 3 A 1 ATOM 20 C CD2 . LEU A 1 3 ? -4.719 11.953 11.048 1.00 79.44 3 A 1 ATOM 21 N N . GLY A 1 4 ? -3.239 6.953 12.608 1.00 95.04 4 A 1 ATOM 22 C CA . GLY A 1 4 ? -2.384 5.770 12.531 1.00 95.37 4 A 1 ATOM 23 C C . GLY A 1 4 ? -2.801 4.819 11.432 1.00 96.40 4 A 1 ATOM 24 O O . GLY A 1 4 ? -1.967 4.291 10.699 1.00 95.75 4 A 1 ATOM 25 N N . PHE A 1 5 ? -4.110 4.597 11.299 1.00 95.97 5 A 1 ATOM 26 C CA . PHE A 1 5 ? -4.642 3.704 10.273 1.00 95.89 5 A 1 ATOM 27 C C . PHE A 1 5 ? -4.491 4.304 8.876 1.00 96.64 5 A 1 ATOM 28 O O . PHE A 1 5 ? -4.048 3.628 7.944 1.00 95.68 5 A 1 ATOM 29 C CB . PHE A 1 5 ? -6.113 3.408 10.563 1.00 94.86 5 A 1 ATOM 30 C CG . PHE A 1 5 ? -6.792 2.690 9.432 1.00 91.71 5 A 1 ATOM 31 C CD1 . PHE A 1 5 ? -7.517 3.397 8.485 1.00 89.32 5 A 1 ATOM 32 C CD2 . PHE A 1 5 ? -6.692 1.317 9.312 1.00 88.34 5 A 1 ATOM 33 C CE1 . PHE A 1 5 ? -8.134 2.741 7.434 1.00 87.83 5 A 1 ATOM 34 C CE2 . PHE A 1 5 ? -7.309 0.658 8.258 1.00 86.52 5 A 1 ATOM 35 C CZ . PHE A 1 5 ? -8.030 1.372 7.318 1.00 87.14 5 A 1 ATOM 36 N N . LEU A 1 6 ? -4.852 5.576 8.715 1.00 96.36 6 A 1 ATOM 37 C CA . LEU A 1 6 ? -4.762 6.260 7.426 1.00 96.40 6 A 1 ATOM 38 C C . LEU A 1 6 ? -3.312 6.479 7.006 1.00 96.89 6 A 1 ATOM 39 O O . LEU A 1 6 ? -2.962 6.328 5.835 1.00 96.41 6 A 1 ATOM 40 C CB . LEU A 1 6 ? -5.495 7.604 7.488 1.00 96.17 6 A 1 ATOM 41 C CG . LEU A 1 6 ? -6.950 7.549 7.035 1.00 93.73 6 A 1 ATOM 42 C CD1 . LEU A 1 6 ? -7.034 7.126 5.583 1.00 91.35 6 A 1 ATOM 43 C CD2 . LEU A 1 6 ? -7.751 6.606 7.908 1.00 89.53 6 A 1 ATOM 44 N N . ARG A 1 7 ? -2.456 6.852 7.962 1.00 96.69 7 A 1 ATOM 45 C CA . ARG A 1 7 ? -1.045 7.109 7.688 1.00 96.97 7 A 1 ATOM 46 C C . ARG A 1 7 ? -0.276 5.816 7.427 1.00 97.31 7 A 1 ATOM 47 O O . ARG A 1 7 ? 0.873 5.859 6.991 1.00 96.70 7 A 1 ATOM 48 C CB . ARG A 1 7 ? -0.408 7.857 8.860 1.00 96.13 7 A 1 ATOM 49 C CG . ARG A 1 7 ? -0.347 9.367 8.648 1.00 90.54 7 A 1 ATOM 50 C CD . ARG A 1 7 ? -1.731 9.963 8.474 1.00 88.65 7 A 1 ATOM 51 N NE . ARG A 1 7 ? -1.690 11.395 8.186 1.00 83.95 7 A 1 ATOM 52 C CZ . ARG A 1 7 ? -2.647 12.053 7.551 1.00 82.46 7 A 1 ATOM 53 N NH1 . ARG A 1 7 ? -3.731 11.420 7.131 1.00 75.19 7 A 1 ATOM 54 N NH2 . ARG A 1 7 ? -2.524 13.351 7.331 1.00 77.62 7 A 1 ATOM 55 N N . LEU A 1 8 ? -0.887 4.671 7.690 1.00 97.17 8 A 1 ATOM 56 C CA . LEU A 1 8 ? -0.240 3.379 7.486 1.00 96.89 8 A 1 ATOM 57 C C . LEU A 1 8 ? -0.745 2.691 6.220 1.00 97.17 8 A 1 ATOM 58 O O . LEU A 1 8 ? 0.038 2.119 5.462 1.00 96.44 8 A 1 ATOM 59 C CB . LEU A 1 8 ? -0.488 2.478 8.700 1.00 96.31 8 A 1 ATOM 60 C CG . LEU A 1 8 ? 0.475 1.306 8.805 1.00 92.88 8 A 1 ATOM 61 C CD1 . LEU A 1 8 ? 1.840 1.775 9.288 1.00 91.58 8 A 1 ATOM 62 C CD2 . LEU A 1 8 ? -0.085 0.248 9.738 1.00 90.47 8 A 1 ATOM 63 N N . ALA A 1 9 ? -2.042 2.746 5.977 1.00 97.09 9 A 1 ATOM 64 C CA . ALA A 1 9 ? -2.653 2.099 4.818 1.00 96.84 9 A 1 ATOM 65 C C . ALA A 1 9 ? -2.378 2.848 3.515 1.00 97.23 9 A 1 ATOM 66 O O . ALA A 1 9 ? -2.256 2.231 2.458 1.00 96.44 9 A 1 ATOM 67 C CB . ALA A 1 9 ? -4.158 1.968 5.036 1.00 96.12 9 A 1 ATOM 68 N N . LEU A 1 10 ? -2.282 4.170 3.585 1.00 96.79 10 A 1 ATOM 69 C CA . LEU A 1 10 ? -2.031 4.989 2.397 1.00 96.60 10 A 1 ATOM 70 C C . LEU A 1 10 ? -0.692 4.664 1.728 1.00 97.00 10 A 1 ATOM 71 O O . LEU A 1 10 ? -0.666 4.302 0.547 1.00 96.62 10 A 1 ATOM 72 C CB . LEU A 1 10 ? -2.097 6.475 2.763 1.00 96.04 10 A 1 ATOM 73 C CG . LEU A 1 10 ? -3.385 7.169 2.339 1.00 91.02 10 A 1 ATOM 74 C CD1 . LEU A 1 10 ? -3.490 8.543 2.978 1.00 89.77 10 A 1 ATOM 75 C CD2 . LEU A 1 10 ? -3.446 7.282 0.830 1.00 88.71 10 A 1 ATOM 76 N N . PRO A 1 11 ? 0.434 4.800 2.440 1.00 96.96 11 A 1 ATOM 77 C CA . PRO A 1 11 ? 1.757 4.527 1.859 1.00 96.64 11 A 1 ATOM 78 C C . PRO A 1 11 ? 1.956 3.063 1.506 1.00 97.06 11 A 1 ATOM 79 O O . PRO A 1 11 ? 2.632 2.748 0.526 1.00 96.15 11 A 1 ATOM 80 C CB . PRO A 1 11 ? 2.730 4.965 2.957 1.00 95.65 11 A 1 ATOM 81 C CG . PRO A 1 11 ? 1.944 4.887 4.218 1.00 94.76 11 A 1 ATOM 82 C CD . PRO A 1 11 ? 0.530 5.233 3.830 1.00 96.27 11 A 1 ATOM 83 N N . LEU A 1 12 ? 1.378 2.158 2.277 1.00 96.49 12 A 1 ATOM 84 C CA . LEU A 1 12 ? 1.515 0.729 2.025 1.00 96.25 12 A 1 ATOM 85 C C . LEU A 1 12 ? 0.875 0.336 0.698 1.00 96.58 12 A 1 ATOM 86 O O . LEU A 1 12 ? 1.414 -0.489 -0.038 1.00 95.89 12 A 1 ATOM 87 C CB . LEU A 1 12 ? 0.872 -0.063 3.164 1.00 95.80 12 A 1 ATOM 88 C CG . LEU A 1 12 ? 1.744 -0.181 4.411 1.00 93.87 12 A 1 ATOM 89 C CD1 . LEU A 1 12 ? 0.961 -0.840 5.537 1.00 92.77 12 A 1 ATOM 90 C CD2 . LEU A 1 12 ? 2.996 -0.990 4.106 1.00 91.95 12 A 1 ATOM 91 N N . LEU A 1 13 ? -0.269 0.926 0.387 1.00 96.69 13 A 1 ATOM 92 C CA . LEU A 1 13 ? -0.971 0.645 -0.860 1.00 96.51 13 A 1 ATOM 93 C C . LEU A 1 13 ? -0.154 1.099 -2.064 1.00 96.70 13 A 1 ATOM 94 O O . LEU A 1 13 ? -0.118 0.436 -3.098 1.00 96.03 13 A 1 ATOM 95 C CB . LEU A 1 13 ? -2.338 1.340 -0.856 1.00 96.33 13 A 1 ATOM 96 C CG . LEU A 1 13 ? -3.517 0.381 -0.799 1.00 93.06 13 A 1 ATOM 97 C CD1 . LEU A 1 13 ? -3.593 -0.458 -2.055 1.00 91.64 13 A 1 ATOM 98 C CD2 . LEU A 1 13 ? -3.412 -0.502 0.430 1.00 91.03 13 A 1 ATOM 99 N N . MET A 1 14 ? 0.514 2.237 -1.935 1.00 96.19 14 A 1 ATOM 100 C CA . MET A 1 14 ? 1.343 2.782 -3.013 1.00 95.64 14 A 1 ATOM 101 C C . MET A 1 14 ? 2.558 1.896 -3.284 1.00 96.02 14 A 1 ATOM 102 O O . MET A 1 14 ? 2.938 1.692 -4.435 1.00 95.10 14 A 1 ATOM 103 C CB . MET A 1 14 ? 1.803 4.193 -2.651 1.00 94.89 14 A 1 ATOM 104 C CG . MET A 1 14 ? 0.656 5.183 -2.607 1.00 91.63 14 A 1 ATOM 105 S SD . MET A 1 14 ? 0.922 6.579 -3.693 1.00 85.47 14 A 1 ATOM 106 C CE . MET A 1 14 ? -0.745 7.171 -3.886 1.00 78.09 14 A 1 ATOM 107 N N . VAL A 1 15 ? 3.160 1.384 -2.244 1.00 94.74 15 A 1 ATOM 108 C CA . VAL A 1 15 ? 4.333 0.517 -2.372 1.00 94.11 15 A 1 ATOM 109 C C . VAL A 1 15 ? 3.967 -0.800 -3.045 1.00 94.79 15 A 1 ATOM 110 O O . VAL A 1 15 ? 4.719 -1.317 -3.874 1.00 94.58 15 A 1 ATOM 111 C CB . VAL A 1 15 ? 4.956 0.243 -0.993 1.00 93.14 15 A 1 ATOM 112 C CG1 . VAL A 1 15 ? 6.100 -0.752 -1.105 1.00 91.25 15 A 1 ATOM 113 C CG2 . VAL A 1 15 ? 5.454 1.532 -0.369 1.00 92.01 15 A 1 ATOM 114 N N . ALA A 1 16 ? 2.817 -1.343 -2.710 1.00 95.09 16 A 1 ATOM 115 C CA . ALA A 1 16 ? 2.361 -2.609 -3.275 1.00 94.35 16 A 1 ATOM 116 C C . ALA A 1 16 ? 2.040 -2.479 -4.759 1.00 95.00 16 A 1 ATOM 117 O O . ALA A 1 16 ? 2.240 -3.417 -5.530 1.00 93.92 16 A 1 ATOM 118 C CB . ALA A 1 16 ? 1.132 -3.102 -2.518 1.00 93.33 16 A 1 ATOM 119 N N . ALA A 1 17 ? 1.543 -1.328 -5.179 1.00 95.19 17 A 1 ATOM 120 C CA . ALA A 1 17 ? 1.182 -1.080 -6.572 1.00 94.22 17 A 1 ATOM 121 C C . ALA A 1 17 ? 2.369 -0.597 -7.400 1.00 94.99 17 A 1 ATOM 122 O O . ALA A 1 17 ? 2.273 -0.499 -8.624 1.00 93.32 17 A 1 ATOM 123 C CB . ALA A 1 17 ? 0.052 -0.056 -6.638 1.00 93.05 17 A 1 ATOM 124 N N . SER A 1 18 ? 3.486 -0.300 -6.752 1.00 95.03 18 A 1 ATOM 125 C CA . SER A 1 18 ? 4.678 0.209 -7.429 1.00 94.59 18 A 1 ATOM 126 C C . SER A 1 18 ? 5.492 -0.910 -8.068 1.00 94.49 18 A 1 ATOM 127 O O . SER A 1 18 ? 6.345 -0.652 -8.917 1.00 91.74 18 A 1 ATOM 128 C CB . SER A 1 18 ? 5.554 0.979 -6.443 1.00 92.83 18 A 1 ATOM 129 O OG . SER A 1 18 ? 6.658 1.543 -7.093 1.00 82.43 18 A 1 ATOM 130 N N . ALA A 1 19 ? 5.234 -2.156 -7.699 1.00 90.82 19 A 1 ATOM 131 C CA . ALA A 1 19 ? 5.967 -3.325 -8.195 1.00 88.77 19 A 1 ATOM 132 C C . ALA A 1 19 ? 7.439 -3.259 -7.791 1.00 89.52 19 A 1 ATOM 133 O O . ALA A 1 19 ? 8.193 -2.451 -8.335 1.00 87.31 19 A 1 ATOM 134 C CB . ALA A 1 19 ? 5.842 -3.427 -9.714 1.00 86.10 19 A 1 ATOM 135 N N . PRO A 1 20 ? 7.865 -4.120 -6.856 1.00 91.73 20 A 1 ATOM 136 C CA . PRO A 1 20 ? 9.239 -4.102 -6.337 1.00 91.03 20 A 1 ATOM 137 C C . PRO A 1 20 ? 10.288 -4.364 -7.408 1.00 91.22 20 A 1 ATOM 138 O O . PRO A 1 20 ? 11.304 -3.672 -7.475 1.00 87.41 20 A 1 ATOM 139 C CB . PRO A 1 20 ? 9.240 -5.213 -5.281 1.00 88.62 20 A 1 ATOM 140 C CG . PRO A 1 20 ? 8.121 -6.117 -5.684 1.00 86.24 20 A 1 ATOM 141 C CD . PRO A 1 20 ? 7.075 -5.226 -6.302 1.00 90.19 20 A 1 ATOM 142 N N . ALA A 1 21 ? 10.063 -5.366 -8.267 1.00 88.15 21 A 1 ATOM 143 C CA . ALA A 1 21 ? 11.022 -5.708 -9.309 1.00 86.88 21 A 1 ATOM 144 C C . ALA A 1 21 ? 10.326 -6.342 -10.505 1.00 88.04 21 A 1 ATOM 145 O O . ALA A 1 21 ? 9.262 -6.946 -10.371 1.00 84.51 21 A 1 ATOM 146 C CB . ALA A 1 21 ? 12.079 -6.650 -8.752 1.00 85.14 21 A 1 ATOM 147 N N . VAL A 1 22 ? 10.937 -6.196 -11.698 1.00 88.50 22 A 1 ATOM 148 C CA . VAL A 1 22 ? 10.383 -6.767 -12.925 1.00 87.17 22 A 1 ATOM 149 C C . VAL A 1 22 ? 11.403 -7.662 -13.614 1.00 87.94 22 A 1 ATOM 150 O O . VAL A 1 22 ? 11.172 -8.852 -13.822 1.00 83.60 22 A 1 ATOM 151 C CB . VAL A 1 22 ? 9.936 -5.654 -13.887 1.00 83.65 22 A 1 ATOM 152 C CG1 . VAL A 1 22 ? 9.333 -6.262 -15.144 1.00 76.42 22 A 1 ATOM 153 C CG2 . VAL A 1 22 ? 8.943 -4.733 -13.208 1.00 78.28 22 A 1 ATOM 154 N N . ALA A 1 23 ? 12.542 -7.068 -14.016 1.00 85.75 23 A 1 ATOM 155 C CA . ALA A 1 23 ? 13.595 -7.808 -14.696 1.00 84.58 23 A 1 ATOM 156 C C . ALA A 1 23 ? 14.969 -7.340 -14.236 1.00 82.09 23 A 1 ATOM 157 O O . ALA A 1 23 ? 15.130 -6.153 -13.955 1.00 77.98 23 A 1 ATOM 158 C CB . ALA A 1 23 ? 13.467 -7.641 -16.206 1.00 79.00 23 A 1 ATOM 159 O OXT . ALA A 1 23 ? 15.896 -8.177 -14.195 1.00 72.26 23 A 1 #