# 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_spkb14780 # _entry.id spkb14780 # 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" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[C@@H](C(=O)O)N ? "L-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" "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 GLN 2 1 n ALA 3 1 n ARG 4 1 n ALA 5 1 n LEU 6 1 n LEU 7 1 n PRO 8 1 n ALA 9 1 n THR 10 1 n LEU 11 1 n ALA 12 1 n ILE 13 1 n LEU 14 1 n ALA 15 1 n THR 16 1 n LEU 17 1 n ALA 18 1 n VAL 19 1 n LEU 20 1 n ALA 21 1 n LEU 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 @ 2025-07-04 15:15:58)" _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 95.72 _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 86.91 1 1 A GLN 2 2 85.64 1 2 A ALA 3 2 94.59 1 3 A ARG 4 2 88.75 1 4 A ALA 5 2 96.66 1 5 A LEU 6 2 96.11 1 6 A LEU 7 2 96.48 1 7 A PRO 8 2 97.88 1 8 A ALA 9 2 98.56 1 9 A THR 10 2 97.91 1 10 A LEU 11 2 97.49 1 11 A ALA 12 2 98.74 1 12 A ILE 13 2 98.02 1 13 A LEU 14 2 97.67 1 14 A ALA 15 2 98.82 1 15 A THR 16 2 98.33 1 16 A LEU 17 2 98.16 1 17 A ALA 18 2 98.85 1 18 A VAL 19 2 98.71 1 19 A LEU 20 2 98.16 1 20 A ALA 21 2 98.83 1 21 A LEU 22 2 96.84 1 22 A ALA 23 2 93.69 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 GLN . 2 A 2 A 3 1 n ALA . 3 A 3 A 4 1 n ARG . 4 A 4 A 5 1 n ALA . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n PRO . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n THR . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n ILE . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n VAL . 19 A 19 A 20 1 n LEU . 20 A 20 A 21 1 n ALA . 21 A 21 A 22 1 n LEU . 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 ? 1.326 5.327 19.527 1.00 91.59 1 A 1 ATOM 2 C CA . MET A 1 1 ? 2.484 4.769 18.806 1.00 91.84 1 A 1 ATOM 3 C C . MET A 1 1 ? 2.020 3.671 17.853 1.00 93.18 1 A 1 ATOM 4 O O . MET A 1 1 ? 1.178 2.855 18.209 1.00 90.44 1 A 1 ATOM 5 C CB . MET A 1 1 ? 3.494 4.205 19.801 1.00 88.77 1 A 1 ATOM 6 C CG . MET A 1 1 ? 4.025 5.279 20.740 1.00 86.14 1 A 1 ATOM 7 S SD . MET A 1 1 ? 5.052 4.605 22.055 1.00 82.32 1 A 1 ATOM 8 C CE . MET A 1 1 ? 5.359 6.080 23.002 1.00 71.04 1 A 1 ATOM 9 N N . GLN A 1 2 ? 2.549 3.652 16.641 1.00 92.28 2 A 1 ATOM 10 C CA . GLN A 1 2 ? 2.143 2.693 15.621 1.00 92.60 2 A 1 ATOM 11 C C . GLN A 1 2 ? 2.572 1.273 15.979 1.00 93.41 2 A 1 ATOM 12 O O . GLN A 1 2 ? 3.689 1.050 16.440 1.00 92.20 2 A 1 ATOM 13 C CB . GLN A 1 2 ? 2.752 3.091 14.287 1.00 89.89 2 A 1 ATOM 14 C CG . GLN A 1 2 ? 2.284 4.457 13.813 1.00 82.04 2 A 1 ATOM 15 C CD . GLN A 1 2 ? 3.101 4.956 12.640 1.00 79.91 2 A 1 ATOM 16 O OE1 . GLN A 1 2 ? 3.338 4.234 11.682 1.00 75.11 2 A 1 ATOM 17 N NE2 . GLN A 1 2 ? 3.563 6.187 12.705 1.00 73.35 2 A 1 ATOM 18 N N . ALA A 1 3 ? 1.673 0.330 15.763 1.00 93.72 3 A 1 ATOM 19 C CA . ALA A 1 3 ? 1.964 -1.073 16.060 1.00 95.02 3 A 1 ATOM 20 C C . ALA A 1 3 ? 1.158 -2.008 15.160 1.00 96.18 3 A 1 ATOM 21 O O . ALA A 1 3 ? 1.707 -2.894 14.510 1.00 94.56 3 A 1 ATOM 22 C CB . ALA A 1 3 ? 1.674 -1.355 17.530 1.00 93.47 3 A 1 ATOM 23 N N . ARG A 1 4 ? -0.166 -1.801 15.101 1.00 97.14 4 A 1 ATOM 24 C CA . ARG A 1 4 ? -1.055 -2.637 14.283 1.00 97.20 4 A 1 ATOM 25 C C . ARG A 1 4 ? -1.498 -1.932 13.008 1.00 97.74 4 A 1 ATOM 26 O O . ARG A 1 4 ? -2.040 -2.571 12.110 1.00 96.82 4 A 1 ATOM 27 C CB . ARG A 1 4 ? -2.286 -3.043 15.095 1.00 95.97 4 A 1 ATOM 28 C CG . ARG A 1 4 ? -2.086 -4.354 15.835 1.00 90.58 4 A 1 ATOM 29 C CD . ARG A 1 4 ? -3.419 -4.885 16.327 1.00 86.96 4 A 1 ATOM 30 N NE . ARG A 1 4 ? -3.291 -6.245 16.853 1.00 83.36 4 A 1 ATOM 31 C CZ . ARG A 1 4 ? -4.324 -7.047 17.073 1.00 81.50 4 A 1 ATOM 32 N NH1 . ARG A 1 4 ? -5.559 -6.647 16.825 1.00 74.41 4 A 1 ATOM 33 N NH2 . ARG A 1 4 ? -4.122 -8.259 17.547 1.00 74.56 4 A 1 ATOM 34 N N . ALA A 1 5 ? -1.278 -0.635 12.904 1.00 96.28 5 A 1 ATOM 35 C CA . ALA A 1 5 ? -1.701 0.144 11.742 1.00 96.72 5 A 1 ATOM 36 C C . ALA A 1 5 ? -0.698 0.051 10.591 1.00 97.62 5 A 1 ATOM 37 O O . ALA A 1 5 ? -1.026 0.379 9.451 1.00 97.01 5 A 1 ATOM 38 C CB . ALA A 1 5 ? -1.910 1.598 12.149 1.00 95.66 5 A 1 ATOM 39 N N . LEU A 1 6 ? 0.509 -0.395 10.868 1.00 97.02 6 A 1 ATOM 40 C CA . LEU A 1 6 ? 1.557 -0.483 9.855 1.00 97.54 6 A 1 ATOM 41 C C . LEU A 1 6 ? 1.265 -1.573 8.829 1.00 98.02 6 A 1 ATOM 42 O O . LEU A 1 6 ? 1.630 -1.446 7.660 1.00 97.82 6 A 1 ATOM 43 C CB . LEU A 1 6 ? 2.907 -0.741 10.531 1.00 97.44 6 A 1 ATOM 44 C CG . LEU A 1 6 ? 3.419 0.434 11.365 1.00 95.77 6 A 1 ATOM 45 C CD1 . LEU A 1 6 ? 4.608 -0.002 12.213 1.00 93.02 6 A 1 ATOM 46 C CD2 . LEU A 1 6 ? 3.820 1.593 10.468 1.00 92.23 6 A 1 ATOM 47 N N . LEU A 1 7 ? 0.616 -2.639 9.252 1.00 97.89 7 A 1 ATOM 48 C CA . LEU A 1 7 ? 0.298 -3.745 8.350 1.00 98.00 7 A 1 ATOM 49 C C . LEU A 1 7 ? -0.784 -3.363 7.330 1.00 98.27 7 A 1 ATOM 50 O O . LEU A 1 7 ? -0.537 -3.428 6.124 1.00 98.25 7 A 1 ATOM 51 C CB . LEU A 1 7 ? -0.125 -4.974 9.164 1.00 97.87 7 A 1 ATOM 52 C CG . LEU A 1 7 ? 0.202 -6.291 8.474 1.00 95.71 7 A 1 ATOM 53 C CD1 . LEU A 1 7 ? 1.632 -6.716 8.789 1.00 93.12 7 A 1 ATOM 54 C CD2 . LEU A 1 7 ? -0.771 -7.368 8.913 1.00 92.71 7 A 1 ATOM 55 N N . PRO A 1 8 ? -1.994 -2.968 7.771 1.00 98.29 8 A 1 ATOM 56 C CA . PRO A 1 8 ? -3.071 -2.619 6.835 1.00 98.26 8 A 1 ATOM 57 C C . PRO A 1 8 ? -2.825 -1.316 6.090 1.00 98.53 8 A 1 ATOM 58 O O . PRO A 1 8 ? -3.165 -1.204 4.908 1.00 98.50 8 A 1 ATOM 59 C CB . PRO A 1 8 ? -4.313 -2.508 7.729 1.00 97.65 8 A 1 ATOM 60 C CG . PRO A 1 8 ? -3.773 -2.175 9.079 1.00 96.37 8 A 1 ATOM 61 C CD . PRO A 1 8 ? -2.432 -2.859 9.164 1.00 97.53 8 A 1 ATOM 62 N N . ALA A 1 9 ? -2.234 -0.328 6.748 1.00 98.49 9 A 1 ATOM 63 C CA . ALA A 1 9 ? -1.973 0.963 6.120 1.00 98.58 9 A 1 ATOM 64 C C . ALA A 1 9 ? -0.946 0.833 4.994 1.00 98.74 9 A 1 ATOM 65 O O . ALA A 1 9 ? -1.130 1.385 3.908 1.00 98.65 9 A 1 ATOM 66 C CB . ALA A 1 9 ? -1.496 1.965 7.167 1.00 98.36 9 A 1 ATOM 67 N N . THR A 1 10 ? 0.114 0.094 5.238 1.00 98.60 10 A 1 ATOM 68 C CA . THR A 1 10 ? 1.158 -0.096 4.234 1.00 98.63 10 A 1 ATOM 69 C C . THR A 1 10 ? 0.627 -0.877 3.034 1.00 98.73 10 A 1 ATOM 70 O O . THR A 1 10 ? 0.905 -0.535 1.885 1.00 98.64 10 A 1 ATOM 71 C CB . THR A 1 10 ? 2.358 -0.833 4.833 1.00 98.46 10 A 1 ATOM 72 O OG1 . THR A 1 10 ? 2.835 -0.121 5.970 1.00 96.63 10 A 1 ATOM 73 C CG2 . THR A 1 10 ? 3.488 -0.935 3.814 1.00 95.66 10 A 1 ATOM 74 N N . LEU A 1 11 ? -0.154 -1.908 3.287 1.00 98.67 11 A 1 ATOM 75 C CA . LEU A 1 11 ? -0.728 -2.721 2.220 1.00 98.67 11 A 1 ATOM 76 C C . LEU A 1 11 ? -1.682 -1.905 1.352 1.00 98.76 11 A 1 ATOM 77 O O . LEU A 1 11 ? -1.687 -2.048 0.129 1.00 98.73 11 A 1 ATOM 78 C CB . LEU A 1 11 ? -1.468 -3.916 2.823 1.00 98.52 11 A 1 ATOM 79 C CG . LEU A 1 11 ? -0.541 -4.985 3.395 1.00 96.62 11 A 1 ATOM 80 C CD1 . LEU A 1 11 ? -1.336 -5.991 4.205 1.00 94.93 11 A 1 ATOM 81 C CD2 . LEU A 1 11 ? 0.212 -5.690 2.273 1.00 95.04 11 A 1 ATOM 82 N N . ALA A 1 12 ? -2.484 -1.052 1.970 1.00 98.74 12 A 1 ATOM 83 C CA . ALA A 1 12 ? -3.433 -0.218 1.241 1.00 98.77 12 A 1 ATOM 84 C C . ALA A 1 12 ? -2.714 0.774 0.327 1.00 98.83 12 A 1 ATOM 85 O O . ALA A 1 12 ? -3.111 0.970 -0.825 1.00 98.76 12 A 1 ATOM 86 C CB . ALA A 1 12 ? -4.330 0.524 2.226 1.00 98.61 12 A 1 ATOM 87 N N . ILE A 1 13 ? -1.661 1.387 0.825 1.00 98.71 13 A 1 ATOM 88 C CA . ILE A 1 13 ? -0.896 2.361 0.050 1.00 98.66 13 A 1 ATOM 89 C C . ILE A 1 13 ? -0.188 1.674 -1.118 1.00 98.77 13 A 1 ATOM 90 O O . ILE A 1 13 ? -0.230 2.149 -2.256 1.00 98.70 13 A 1 ATOM 91 C CB . ILE A 1 13 ? 0.119 3.089 0.950 1.00 98.53 13 A 1 ATOM 92 C CG1 . ILE A 1 13 ? -0.610 3.930 2.008 1.00 97.86 13 A 1 ATOM 93 C CG2 . ILE A 1 13 ? 1.030 3.990 0.110 1.00 97.62 13 A 1 ATOM 94 C CD1 . ILE A 1 13 ? 0.279 4.358 3.160 1.00 95.27 13 A 1 ATOM 95 N N . LEU A 1 14 ? 0.449 0.558 -0.856 1.00 98.67 14 A 1 ATOM 96 C CA . LEU A 1 14 ? 1.170 -0.172 -1.892 1.00 98.65 14 A 1 ATOM 97 C C . LEU A 1 14 ? 0.223 -0.705 -2.961 1.00 98.77 14 A 1 ATOM 98 O O . LEU A 1 14 ? 0.548 -0.691 -4.151 1.00 98.74 14 A 1 ATOM 99 C CB . LEU A 1 14 ? 1.951 -1.328 -1.263 1.00 98.46 14 A 1 ATOM 100 C CG . LEU A 1 14 ? 3.143 -0.889 -0.414 1.00 96.73 14 A 1 ATOM 101 C CD1 . LEU A 1 14 ? 3.724 -2.081 0.330 1.00 95.69 14 A 1 ATOM 102 C CD2 . LEU A 1 14 ? 4.216 -0.243 -1.282 1.00 95.65 14 A 1 ATOM 103 N N . ALA A 1 15 ? -0.948 -1.167 -2.555 1.00 98.83 15 A 1 ATOM 104 C CA . ALA A 1 15 ? -1.939 -1.686 -3.491 1.00 98.84 15 A 1 ATOM 105 C C . ALA A 1 15 ? -2.420 -0.593 -4.440 1.00 98.90 15 A 1 ATOM 106 O O . ALA A 1 15 ? -2.558 -0.819 -5.645 1.00 98.83 15 A 1 ATOM 107 C CB . ALA A 1 15 ? -3.117 -2.273 -2.720 1.00 98.72 15 A 1 ATOM 108 N N . THR A 1 16 ? -2.665 0.592 -3.913 1.00 98.85 16 A 1 ATOM 109 C CA . THR A 1 16 ? -3.120 1.718 -4.725 1.00 98.84 16 A 1 ATOM 110 C C . THR A 1 16 ? -2.052 2.117 -5.743 1.00 98.90 16 A 1 ATOM 111 O O . THR A 1 16 ? -2.350 2.328 -6.922 1.00 98.80 16 A 1 ATOM 112 C CB . THR A 1 16 ? -3.462 2.918 -3.835 1.00 98.67 16 A 1 ATOM 113 O OG1 . THR A 1 16 ? -4.425 2.532 -2.855 1.00 97.38 16 A 1 ATOM 114 C CG2 . THR A 1 16 ? -4.027 4.063 -4.660 1.00 96.85 16 A 1 ATOM 115 N N . LEU A 1 17 ? -0.812 2.210 -5.302 1.00 98.87 17 A 1 ATOM 116 C CA . LEU A 1 17 ? 0.289 2.581 -6.181 1.00 98.84 17 A 1 ATOM 117 C C . LEU A 1 17 ? 0.517 1.525 -7.258 1.00 98.89 17 A 1 ATOM 118 O O . LEU A 1 17 ? 0.813 1.854 -8.409 1.00 98.82 17 A 1 ATOM 119 C CB . LEU A 1 17 ? 1.564 2.772 -5.357 1.00 98.72 17 A 1 ATOM 120 C CG . LEU A 1 17 ? 1.540 3.998 -4.444 1.00 97.87 17 A 1 ATOM 121 C CD1 . LEU A 1 17 ? 2.717 3.963 -3.481 1.00 96.64 17 A 1 ATOM 122 C CD2 . LEU A 1 17 ? 1.574 5.280 -5.265 1.00 96.61 17 A 1 ATOM 123 N N . ALA A 1 18 ? 0.374 0.261 -6.899 1.00 98.88 18 A 1 ATOM 124 C CA . ALA A 1 18 ? 0.564 -0.835 -7.845 1.00 98.87 18 A 1 ATOM 125 C C . ALA A 1 18 ? -0.477 -0.791 -8.961 1.00 98.91 18 A 1 ATOM 126 O O . ALA A 1 18 ? -0.150 -0.979 -10.132 1.00 98.84 18 A 1 ATOM 127 C CB . ALA A 1 18 ? 0.494 -2.169 -7.108 1.00 98.76 18 A 1 ATOM 128 N N . VAL A 1 19 ? -1.730 -0.530 -8.611 1.00 98.92 19 A 1 ATOM 129 C CA . VAL A 1 19 ? -2.806 -0.451 -9.600 1.00 98.90 19 A 1 ATOM 130 C C . VAL A 1 19 ? -2.578 0.724 -10.546 1.00 98.93 19 A 1 ATOM 131 O O . VAL A 1 19 ? -2.737 0.596 -11.765 1.00 98.86 19 A 1 ATOM 132 C CB . VAL A 1 19 ? -4.169 -0.330 -8.899 1.00 98.80 19 A 1 ATOM 133 C CG1 . VAL A 1 19 ? -5.282 -0.082 -9.904 1.00 98.28 19 A 1 ATOM 134 C CG2 . VAL A 1 19 ? -4.465 -1.594 -8.107 1.00 98.26 19 A 1 ATOM 135 N N . LEU A 1 20 ? -2.196 1.865 -10.005 1.00 98.89 20 A 1 ATOM 136 C CA . LEU A 1 20 ? -1.946 3.056 -10.812 1.00 98.86 20 A 1 ATOM 137 C C . LEU A 1 20 ? -0.760 2.853 -11.753 1.00 98.89 20 A 1 ATOM 138 O O . LEU A 1 20 ? -0.767 3.345 -12.882 1.00 98.82 20 A 1 ATOM 139 C CB . LEU A 1 20 ? -1.683 4.253 -9.895 1.00 98.74 20 A 1 ATOM 140 C CG . LEU A 1 20 ? -2.916 4.720 -9.120 1.00 97.79 20 A 1 ATOM 141 C CD1 . LEU A 1 20 ? -2.516 5.730 -8.053 1.00 96.71 20 A 1 ATOM 142 C CD2 . LEU A 1 20 ? -3.942 5.334 -10.062 1.00 96.58 20 A 1 ATOM 143 N N . ALA A 1 21 ? 0.245 2.135 -11.307 1.00 98.87 21 A 1 ATOM 144 C CA . ALA A 1 21 ? 1.427 1.868 -12.124 1.00 98.86 21 A 1 ATOM 145 C C . ALA A 1 21 ? 1.118 0.907 -13.272 1.00 98.88 21 A 1 ATOM 146 O O . ALA A 1 21 ? 1.697 1.014 -14.355 1.00 98.76 21 A 1 ATOM 147 C CB . ALA A 1 21 ? 2.540 1.299 -11.248 1.00 98.76 21 A 1 ATOM 148 N N . LEU A 1 22 ? 0.203 -0.029 -13.038 1.00 98.64 22 A 1 ATOM 149 C CA . LEU A 1 22 ? -0.181 -1.007 -14.056 1.00 98.53 22 A 1 ATOM 150 C C . LEU A 1 22 ? -1.041 -0.370 -15.145 1.00 98.58 22 A 1 ATOM 151 O O . LEU A 1 22 ? -0.959 -0.758 -16.314 1.00 97.98 22 A 1 ATOM 152 C CB . LEU A 1 22 ? -0.934 -2.169 -13.399 1.00 98.17 22 A 1 ATOM 153 C CG . LEU A 1 22 ? -0.054 -3.084 -12.543 1.00 96.27 22 A 1 ATOM 154 C CD1 . LEU A 1 22 ? -0.914 -3.988 -11.671 1.00 93.94 22 A 1 ATOM 155 C CD2 . LEU A 1 22 ? 0.855 -3.929 -13.428 1.00 92.64 22 A 1 ATOM 156 N N . ALA A 1 23 ? -1.848 0.602 -14.780 1.00 97.42 23 A 1 ATOM 157 C CA . ALA A 1 23 ? -2.752 1.279 -15.711 1.00 96.40 23 A 1 ATOM 158 C C . ALA A 1 23 ? -2.391 2.752 -15.833 1.00 95.16 23 A 1 ATOM 159 O O . ALA A 1 23 ? -2.772 3.541 -14.964 1.00 92.38 23 A 1 ATOM 160 C CB . ALA A 1 23 ? -4.190 1.112 -15.252 1.00 94.24 23 A 1 ATOM 161 O OXT . ALA A 1 23 ? -1.714 3.106 -16.792 1.00 86.55 23 A 1 #