# 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_spkb17403 # _entry.id spkb17403 # 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" "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 PHE 2 1 n LYS 3 1 n PHE 4 1 n ALA 5 1 n LEU 6 1 n THR 7 1 n LEU 8 1 n THR 9 1 n LEU 10 1 n CYS 11 1 n LEU 12 1 n ALA 13 1 n GLY 14 1 n SER 15 1 n LEU 16 1 n SER 17 1 n LEU 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 @ 2025-07-06 08:58:03)" _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 90.37 _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 85.47 1 1 A PHE 2 2 87.64 1 2 A LYS 3 2 88.28 1 3 A PHE 4 2 92.23 1 4 A ALA 5 2 95.94 1 5 A LEU 6 2 91.09 1 6 A THR 7 2 91.97 1 7 A LEU 8 2 91.51 1 8 A THR 9 2 92.38 1 9 A LEU 10 2 93.28 1 10 A CYS 11 2 93.82 1 11 A LEU 12 2 91.49 1 12 A ALA 13 2 95.93 1 13 A GLY 14 2 95.51 1 14 A SER 15 2 92.05 1 15 A LEU 16 2 88.83 1 16 A SER 17 2 88.24 1 17 A LEU 18 2 85.98 1 18 A ALA 19 2 81.81 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 PHE . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n ALA . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n THR . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n THR . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n CYS . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n GLY . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n SER . 17 A 17 A 18 1 n LEU . 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 ? -13.666 6.164 1.006 1.00 91.00 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.565 5.559 1.786 1.00 93.11 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.337 5.313 0.908 1.00 93.62 1 A 1 ATOM 4 O O . MET A 1 1 ? -10.676 4.289 1.016 1.00 91.47 1 A 1 ATOM 5 C CB . MET A 1 1 ? -13.043 4.244 2.403 1.00 87.50 1 A 1 ATOM 6 C CG . MET A 1 1 ? -14.052 4.487 3.504 1.00 80.92 1 A 1 ATOM 7 S SD . MET A 1 1 ? -14.752 2.951 4.100 1.00 77.59 1 A 1 ATOM 8 C CE . MET A 1 1 ? -15.564 3.543 5.576 1.00 68.53 1 A 1 ATOM 9 N N . PHE A 1 2 ? -11.056 6.256 0.045 1.00 91.81 2 A 1 ATOM 10 C CA . PHE A 1 2 ? -9.920 6.146 -0.874 1.00 94.08 2 A 1 ATOM 11 C C . PHE A 1 2 ? -8.591 6.313 -0.132 1.00 95.85 2 A 1 ATOM 12 O O . PHE A 1 2 ? -7.568 5.771 -0.533 1.00 94.94 2 A 1 ATOM 13 C CB . PHE A 1 2 ? -10.075 7.216 -1.953 1.00 92.01 2 A 1 ATOM 14 C CG . PHE A 1 2 ? -9.145 6.998 -3.109 1.00 87.72 2 A 1 ATOM 15 C CD1 . PHE A 1 2 ? -9.366 5.959 -4.002 1.00 84.43 2 A 1 ATOM 16 C CD2 . PHE A 1 2 ? -8.055 7.839 -3.295 1.00 82.61 2 A 1 ATOM 17 C CE1 . PHE A 1 2 ? -8.509 5.755 -5.077 1.00 80.59 2 A 1 ATOM 18 C CE2 . PHE A 1 2 ? -7.191 7.642 -4.366 1.00 80.90 2 A 1 ATOM 19 C CZ . PHE A 1 2 ? -7.422 6.600 -5.257 1.00 79.05 2 A 1 ATOM 20 N N . LYS A 1 3 ? -8.618 7.045 0.960 1.00 94.86 3 A 1 ATOM 21 C CA . LYS A 1 3 ? -7.424 7.295 1.773 1.00 95.61 3 A 1 ATOM 22 C C . LYS A 1 3 ? -6.819 5.997 2.309 1.00 96.01 3 A 1 ATOM 23 O O . LYS A 1 3 ? -5.600 5.868 2.394 1.00 95.78 3 A 1 ATOM 24 C CB . LYS A 1 3 ? -7.791 8.224 2.930 1.00 94.44 3 A 1 ATOM 25 C CG . LYS A 1 3 ? -7.176 9.600 2.772 1.00 87.11 3 A 1 ATOM 26 C CD . LYS A 1 3 ? -5.777 9.618 3.363 1.00 84.24 3 A 1 ATOM 27 C CE . LYS A 1 3 ? -5.155 10.999 3.302 1.00 76.83 3 A 1 ATOM 28 N NZ . LYS A 1 3 ? -3.879 11.020 4.067 1.00 69.65 3 A 1 ATOM 29 N N . PHE A 1 4 ? -7.669 5.049 2.644 1.00 94.52 4 A 1 ATOM 30 C CA . PHE A 1 4 ? -7.218 3.768 3.183 1.00 95.01 4 A 1 ATOM 31 C C . PHE A 1 4 ? -6.375 3.008 2.159 1.00 96.28 4 A 1 ATOM 32 O O . PHE A 1 4 ? -5.316 2.480 2.491 1.00 95.70 4 A 1 ATOM 33 C CB . PHE A 1 4 ? -8.438 2.949 3.594 1.00 94.39 4 A 1 ATOM 34 C CG . PHE A 1 4 ? -8.066 1.762 4.442 1.00 93.05 4 A 1 ATOM 35 C CD1 . PHE A 1 4 ? -7.538 1.947 5.714 1.00 89.70 4 A 1 ATOM 36 C CD2 . PHE A 1 4 ? -8.247 0.476 3.955 1.00 90.15 4 A 1 ATOM 37 C CE1 . PHE A 1 4 ? -7.188 0.856 6.501 1.00 88.64 4 A 1 ATOM 38 C CE2 . PHE A 1 4 ? -7.898 -0.626 4.737 1.00 88.96 4 A 1 ATOM 39 C CZ . PHE A 1 4 ? -7.369 -0.433 6.011 1.00 88.09 4 A 1 ATOM 40 N N . ALA A 1 5 ? -6.836 2.972 0.922 1.00 95.65 5 A 1 ATOM 41 C CA . ALA A 1 5 ? -6.101 2.300 -0.150 1.00 95.86 5 A 1 ATOM 42 C C . ALA A 1 5 ? -4.767 3.000 -0.418 1.00 96.72 5 A 1 ATOM 43 O O . ALA A 1 5 ? -3.745 2.348 -0.632 1.00 96.20 5 A 1 ATOM 44 C CB . ALA A 1 5 ? -6.962 2.276 -1.407 1.00 95.29 5 A 1 ATOM 45 N N . LEU A 1 6 ? -4.781 4.311 -0.384 1.00 94.68 6 A 1 ATOM 46 C CA . LEU A 1 6 ? -3.573 5.107 -0.589 1.00 94.93 6 A 1 ATOM 47 C C . LEU A 1 6 ? -2.550 4.840 0.514 1.00 96.02 6 A 1 ATOM 48 O O . LEU A 1 6 ? -1.366 4.653 0.242 1.00 95.82 6 A 1 ATOM 49 C CB . LEU A 1 6 ? -3.952 6.590 -0.611 1.00 94.27 6 A 1 ATOM 50 C CG . LEU A 1 6 ? -2.829 7.464 -1.156 1.00 86.47 6 A 1 ATOM 51 C CD1 . LEU A 1 6 ? -2.944 7.577 -2.675 1.00 83.18 6 A 1 ATOM 52 C CD2 . LEU A 1 6 ? -2.886 8.844 -0.531 1.00 83.38 6 A 1 ATOM 53 N N . THR A 1 7 ? -3.007 4.803 1.743 1.00 93.65 7 A 1 ATOM 54 C CA . THR A 1 7 ? -2.138 4.556 2.897 1.00 93.97 7 A 1 ATOM 55 C C . THR A 1 7 ? -1.520 3.163 2.824 1.00 94.93 7 A 1 ATOM 56 O O . THR A 1 7 ? -0.335 2.991 3.109 1.00 94.19 7 A 1 ATOM 57 C CB . THR A 1 7 ? -2.942 4.701 4.194 1.00 93.55 7 A 1 ATOM 58 O OG1 . THR A 1 7 ? -3.561 5.976 4.227 1.00 87.17 7 A 1 ATOM 59 C CG2 . THR A 1 7 ? -2.043 4.593 5.417 1.00 86.30 7 A 1 ATOM 60 N N . LEU A 1 8 ? -2.312 2.189 2.431 1.00 95.94 8 A 1 ATOM 61 C CA . LEU A 1 8 ? -1.830 0.812 2.304 1.00 95.74 8 A 1 ATOM 62 C C . LEU A 1 8 ? -0.732 0.714 1.250 1.00 96.21 8 A 1 ATOM 63 O O . LEU A 1 8 ? 0.319 0.120 1.490 1.00 95.92 8 A 1 ATOM 64 C CB . LEU A 1 8 ? -3.011 -0.095 1.939 1.00 95.43 8 A 1 ATOM 65 C CG . LEU A 1 8 ? -3.406 -1.022 3.088 1.00 86.55 8 A 1 ATOM 66 C CD1 . LEU A 1 8 ? -4.881 -1.370 3.015 1.00 82.96 8 A 1 ATOM 67 C CD2 . LEU A 1 8 ? -2.578 -2.300 3.031 1.00 83.31 8 A 1 ATOM 68 N N . THR A 1 9 ? -0.966 1.306 0.105 1.00 94.85 9 A 1 ATOM 69 C CA . THR A 1 9 ? 0.007 1.288 -0.992 1.00 94.48 9 A 1 ATOM 70 C C . THR A 1 9 ? 1.289 2.017 -0.594 1.00 95.30 9 A 1 ATOM 71 O O . THR A 1 9 ? 2.393 1.540 -0.860 1.00 93.98 9 A 1 ATOM 72 C CB . THR A 1 9 ? -0.601 1.946 -2.235 1.00 93.78 9 A 1 ATOM 73 O OG1 . THR A 1 9 ? -1.821 1.306 -2.562 1.00 88.02 9 A 1 ATOM 74 C CG2 . THR A 1 9 ? 0.326 1.820 -3.437 1.00 86.23 9 A 1 ATOM 75 N N . LEU A 1 10 ? 1.144 3.151 0.050 1.00 97.00 10 A 1 ATOM 76 C CA . LEU A 1 10 ? 2.291 3.943 0.493 1.00 96.62 10 A 1 ATOM 77 C C . LEU A 1 10 ? 3.103 3.183 1.540 1.00 97.07 10 A 1 ATOM 78 O O . LEU A 1 10 ? 4.332 3.172 1.495 1.00 96.56 10 A 1 ATOM 79 C CB . LEU A 1 10 ? 1.791 5.268 1.071 1.00 96.07 10 A 1 ATOM 80 C CG . LEU A 1 10 ? 2.856 6.358 1.012 1.00 89.81 10 A 1 ATOM 81 C CD1 . LEU A 1 10 ? 2.471 7.420 -0.009 1.00 86.27 10 A 1 ATOM 82 C CD2 . LEU A 1 10 ? 3.040 6.999 2.374 1.00 86.87 10 A 1 ATOM 83 N N . CYS A 1 11 ? 2.422 2.541 2.460 1.00 95.67 11 A 1 ATOM 84 C CA . CYS A 1 11 ? 3.074 1.762 3.512 1.00 95.47 11 A 1 ATOM 85 C C . CYS A 1 11 ? 3.843 0.585 2.918 1.00 95.61 11 A 1 ATOM 86 O O . CYS A 1 11 ? 4.954 0.282 3.345 1.00 93.76 11 A 1 ATOM 87 C CB . CYS A 1 11 ? 2.015 1.273 4.498 1.00 94.38 11 A 1 ATOM 88 S SG . CYS A 1 11 ? 2.781 0.645 6.002 1.00 88.02 11 A 1 ATOM 89 N N . LEU A 1 12 ? 3.256 -0.059 1.934 1.00 96.22 12 A 1 ATOM 90 C CA . LEU A 1 12 ? 3.893 -1.194 1.265 1.00 95.62 12 A 1 ATOM 91 C C . LEU A 1 12 ? 5.192 -0.765 0.587 1.00 96.22 12 A 1 ATOM 92 O O . LEU A 1 12 ? 6.228 -1.411 0.750 1.00 95.82 12 A 1 ATOM 93 C CB . LEU A 1 12 ? 2.925 -1.778 0.236 1.00 94.78 12 A 1 ATOM 94 C CG . LEU A 1 12 ? 3.366 -3.154 -0.263 1.00 87.03 12 A 1 ATOM 95 C CD1 . LEU A 1 12 ? 2.520 -4.247 0.373 1.00 82.80 12 A 1 ATOM 96 C CD2 . LEU A 1 12 ? 3.256 -3.233 -1.772 1.00 83.43 12 A 1 ATOM 97 N N . ALA A 1 13 ? 5.145 0.319 -0.155 1.00 96.61 13 A 1 ATOM 98 C CA . ALA A 1 13 ? 6.326 0.839 -0.845 1.00 96.25 13 A 1 ATOM 99 C C . ALA A 1 13 ? 7.403 1.267 0.151 1.00 96.72 13 A 1 ATOM 100 O O . ALA A 1 13 ? 8.587 0.996 -0.050 1.00 95.24 13 A 1 ATOM 101 C CB . ALA A 1 13 ? 5.912 2.013 -1.730 1.00 94.84 13 A 1 ATOM 102 N N . GLY A 1 14 ? 6.990 1.914 1.229 1.00 96.01 14 A 1 ATOM 103 C CA . GLY A 1 14 ? 7.919 2.351 2.266 1.00 95.31 14 A 1 ATOM 104 C C . GLY A 1 14 ? 8.550 1.184 3.005 1.00 96.02 14 A 1 ATOM 105 O O . GLY A 1 14 ? 9.741 1.204 3.298 1.00 94.72 14 A 1 ATOM 106 N N . SER A 1 15 ? 7.768 0.157 3.277 1.00 95.38 15 A 1 ATOM 107 C CA . SER A 1 15 ? 8.246 -1.033 3.983 1.00 94.74 15 A 1 ATOM 108 C C . SER A 1 15 ? 9.302 -1.768 3.165 1.00 94.75 15 A 1 ATOM 109 O O . SER A 1 15 ? 10.320 -2.201 3.697 1.00 91.91 15 A 1 ATOM 110 C CB . SER A 1 15 ? 7.075 -1.963 4.284 1.00 92.72 15 A 1 ATOM 111 O OG . SER A 1 15 ? 7.472 -2.960 5.189 1.00 82.81 15 A 1 ATOM 112 N N . LEU A 1 16 ? 9.074 -1.892 1.872 1.00 94.34 16 A 1 ATOM 113 C CA . LEU A 1 16 ? 10.026 -2.549 0.975 1.00 93.60 16 A 1 ATOM 114 C C . LEU A 1 16 ? 11.329 -1.761 0.879 1.00 94.61 16 A 1 ATOM 115 O O . LEU A 1 16 ? 12.414 -2.344 0.870 1.00 92.78 16 A 1 ATOM 116 C CB . LEU A 1 16 ? 9.399 -2.705 -0.411 1.00 92.08 16 A 1 ATOM 117 C CG . LEU A 1 16 ? 9.219 -4.163 -0.812 1.00 86.24 16 A 1 ATOM 118 C CD1 . LEU A 1 16 ? 7.753 -4.551 -0.821 1.00 79.11 16 A 1 ATOM 119 C CD2 . LEU A 1 16 ? 9.830 -4.407 -2.183 1.00 77.90 16 A 1 ATOM 120 N N . SER A 1 17 ? 11.223 -0.458 0.807 1.00 91.00 17 A 1 ATOM 121 C CA . SER A 1 17 ? 12.394 0.419 0.716 1.00 91.40 17 A 1 ATOM 122 C C . SER A 1 17 ? 13.152 0.488 2.039 1.00 92.01 17 A 1 ATOM 123 O O . SER A 1 17 ? 14.378 0.585 2.055 1.00 88.82 17 A 1 ATOM 124 C CB . SER A 1 17 ? 11.952 1.816 0.295 1.00 88.52 17 A 1 ATOM 125 O OG . SER A 1 17 ? 13.079 2.609 0.005 1.00 77.70 17 A 1 ATOM 126 N N . LEU A 1 18 ? 12.429 0.440 3.130 1.00 91.83 18 A 1 ATOM 127 C CA . LEU A 1 18 ? 13.012 0.500 4.476 1.00 91.07 18 A 1 ATOM 128 C C . LEU A 1 18 ? 13.790 -0.764 4.813 1.00 92.28 18 A 1 ATOM 129 O O . LEU A 1 18 ? 14.758 -0.713 5.578 1.00 89.77 18 A 1 ATOM 130 C CB . LEU A 1 18 ? 11.892 0.712 5.499 1.00 88.74 18 A 1 ATOM 131 C CG . LEU A 1 18 ? 12.386 0.890 6.927 1.00 83.61 18 A 1 ATOM 132 C CD1 . LEU A 1 18 ? 12.529 2.363 7.272 1.00 76.66 18 A 1 ATOM 133 C CD2 . LEU A 1 18 ? 11.430 0.225 7.903 1.00 73.87 18 A 1 ATOM 134 N N . ALA A 1 19 ? 13.384 -1.889 4.262 1.00 88.04 19 A 1 ATOM 135 C CA . ALA A 1 19 ? 14.005 -3.181 4.534 1.00 86.62 19 A 1 ATOM 136 C C . ALA A 1 19 ? 15.520 -3.141 4.343 1.00 84.44 19 A 1 ATOM 137 O O . ALA A 1 19 ? 15.984 -2.626 3.311 1.00 79.07 19 A 1 ATOM 138 C CB . ALA A 1 19 ? 13.377 -4.252 3.656 1.00 80.55 19 A 1 ATOM 139 O OXT . ALA A 1 19 ? 16.246 -3.624 5.228 1.00 72.16 19 A 1 #