# 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_spkb14807 # _entry.id spkb14807 # 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" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "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 VAL 2 1 n SER 3 1 n ALA 4 1 n ARG 5 1 n ALA 6 1 n LEU 7 1 n LEU 8 1 n TRP 9 1 n ALA 10 1 n ILE 11 1 n CYS 12 1 n VAL 13 1 n LEU 14 1 n ARG 15 1 n VAL 16 1 n ALA 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 22:05:26)" _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 94.21 _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 84.31 1 1 A VAL 2 2 87.52 1 2 A SER 3 2 93.36 1 3 A ALA 4 2 97.58 1 4 A ARG 5 2 90.04 1 5 A ALA 6 2 98.00 1 6 A LEU 7 2 95.55 1 7 A LEU 8 2 96.61 1 8 A TRP 9 2 94.59 1 9 A ALA 10 2 98.21 1 10 A ILE 11 2 96.89 1 11 A CYS 12 2 97.67 1 12 A VAL 13 2 97.91 1 13 A LEU 14 2 96.21 1 14 A ARG 15 2 90.62 1 15 A VAL 16 2 97.60 1 16 A ALA 17 2 98.11 1 17 A LEU 18 2 95.33 1 18 A ALA 19 2 92.41 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 VAL . 2 A 2 A 3 1 n SER . 3 A 3 A 4 1 n ALA . 4 A 4 A 5 1 n ARG . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n TRP . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n ILE . 11 A 11 A 12 1 n CYS . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n ARG . 15 A 15 A 16 1 n VAL . 16 A 16 A 17 1 n ALA . 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 ? -4.070 16.365 3.126 1.00 89.89 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.634 15.345 4.034 1.00 91.07 1 A 1 ATOM 3 C C . MET A 1 1 ? -4.460 13.959 3.427 1.00 92.16 1 A 1 ATOM 4 O O . MET A 1 1 ? -4.575 13.791 2.220 1.00 87.90 1 A 1 ATOM 5 C CB . MET A 1 1 ? -6.122 15.608 4.267 1.00 86.88 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.379 16.993 4.852 1.00 81.21 1 A 1 ATOM 7 S SD . MET A 1 1 ? -5.557 17.215 6.420 1.00 77.66 1 A 1 ATOM 8 C CE . MET A 1 1 ? -5.974 18.910 6.763 1.00 67.75 1 A 1 ATOM 9 N N . VAL A 1 2 ? -4.189 12.967 4.254 1.00 88.19 2 A 1 ATOM 10 C CA . VAL A 1 2 ? -3.980 11.598 3.798 1.00 91.68 2 A 1 ATOM 11 C C . VAL A 1 2 ? -5.277 10.811 3.874 1.00 94.04 2 A 1 ATOM 12 O O . VAL A 1 2 ? -5.982 10.867 4.879 1.00 91.95 2 A 1 ATOM 13 C CB . VAL A 1 2 ? -2.914 10.910 4.647 1.00 87.22 2 A 1 ATOM 14 C CG1 . VAL A 1 2 ? -2.680 9.490 4.160 1.00 78.05 2 A 1 ATOM 15 C CG2 . VAL A 1 2 ? -1.626 11.705 4.599 1.00 81.52 2 A 1 ATOM 16 N N . SER A 1 3 ? -5.583 10.079 2.822 1.00 95.01 3 A 1 ATOM 17 C CA . SER A 1 3 ? -6.789 9.266 2.774 1.00 96.41 3 A 1 ATOM 18 C C . SER A 1 3 ? -6.531 7.893 3.382 1.00 97.05 3 A 1 ATOM 19 O O . SER A 1 3 ? -5.394 7.431 3.429 1.00 96.50 3 A 1 ATOM 20 C CB . SER A 1 3 ? -7.264 9.112 1.340 1.00 93.97 3 A 1 ATOM 21 O OG . SER A 1 3 ? -7.530 10.374 0.771 1.00 81.20 3 A 1 ATOM 22 N N . ALA A 1 4 ? -7.600 7.246 3.827 1.00 97.24 4 A 1 ATOM 23 C CA . ALA A 1 4 ? -7.483 5.909 4.410 1.00 97.75 4 A 1 ATOM 24 C C . ALA A 1 4 ? -6.942 4.918 3.387 1.00 98.06 4 A 1 ATOM 25 O O . ALA A 1 4 ? -6.244 3.964 3.730 1.00 97.61 4 A 1 ATOM 26 C CB . ALA A 1 4 ? -8.843 5.455 4.916 1.00 97.23 4 A 1 ATOM 27 N N . ARG A 1 5 ? -7.250 5.160 2.127 1.00 97.65 5 A 1 ATOM 28 C CA . ARG A 1 5 ? -6.800 4.307 1.031 1.00 97.62 5 A 1 ATOM 29 C C . ARG A 1 5 ? -5.288 4.330 0.914 1.00 98.06 5 A 1 ATOM 30 O O . ARG A 1 5 ? -4.671 3.304 0.642 1.00 97.70 5 A 1 ATOM 31 C CB . ARG A 1 5 ? -7.434 4.781 -0.269 1.00 96.83 5 A 1 ATOM 32 C CG . ARG A 1 5 ? -7.334 3.739 -1.355 1.00 91.43 5 A 1 ATOM 33 C CD . ARG A 1 5 ? -8.067 4.197 -2.591 1.00 89.29 5 A 1 ATOM 34 N NE . ARG A 1 5 ? -8.523 3.048 -3.373 1.00 85.29 5 A 1 ATOM 35 C CZ . ARG A 1 5 ? -9.452 3.123 -4.313 1.00 83.14 5 A 1 ATOM 36 N NH1 . ARG A 1 5 ? -9.998 4.278 -4.633 1.00 77.44 5 A 1 ATOM 37 N NH2 . ARG A 1 5 ? -9.847 2.022 -4.929 1.00 76.04 5 A 1 ATOM 38 N N . ALA A 1 6 ? -4.689 5.487 1.113 1.00 97.88 6 A 1 ATOM 39 C CA . ALA A 1 6 ? -3.239 5.624 1.030 1.00 98.06 6 A 1 ATOM 40 C C . ALA A 1 6 ? -2.556 4.786 2.102 1.00 98.30 6 A 1 ATOM 41 O O . ALA A 1 6 ? -1.533 4.149 1.845 1.00 98.02 6 A 1 ATOM 42 C CB . ALA A 1 6 ? -2.851 7.087 1.186 1.00 97.72 6 A 1 ATOM 43 N N . LEU A 1 7 ? -3.133 4.789 3.294 1.00 97.81 7 A 1 ATOM 44 C CA . LEU A 1 7 ? -2.591 4.002 4.398 1.00 97.77 7 A 1 ATOM 45 C C . LEU A 1 7 ? -2.714 2.513 4.105 1.00 97.87 7 A 1 ATOM 46 O O . LEU A 1 7 ? -1.776 1.743 4.318 1.00 97.57 7 A 1 ATOM 47 C CB . LEU A 1 7 ? -3.335 4.343 5.686 1.00 97.63 7 A 1 ATOM 48 C CG . LEU A 1 7 ? -2.641 3.811 6.934 1.00 94.02 7 A 1 ATOM 49 C CD1 . LEU A 1 7 ? -1.390 4.625 7.238 1.00 90.63 7 A 1 ATOM 50 C CD2 . LEU A 1 7 ? -3.584 3.847 8.124 1.00 91.07 7 A 1 ATOM 51 N N . LEU A 1 8 ? -3.865 2.112 3.609 1.00 98.06 8 A 1 ATOM 52 C CA . LEU A 1 8 ? -4.123 0.713 3.275 1.00 98.09 8 A 1 ATOM 53 C C . LEU A 1 8 ? -3.184 0.260 2.166 1.00 98.19 8 A 1 ATOM 54 O O . LEU A 1 8 ? -2.630 -0.840 2.212 1.00 98.05 8 A 1 ATOM 55 C CB . LEU A 1 8 ? -5.583 0.558 2.843 1.00 98.02 8 A 1 ATOM 56 C CG . LEU A 1 8 ? -6.254 -0.685 3.419 1.00 95.89 8 A 1 ATOM 57 C CD1 . LEU A 1 8 ? -7.751 -0.632 3.181 1.00 93.40 8 A 1 ATOM 58 C CD2 . LEU A 1 8 ? -5.682 -1.951 2.811 1.00 93.16 8 A 1 ATOM 59 N N . TRP A 1 9 ? -2.991 1.117 1.172 1.00 97.90 9 A 1 ATOM 60 C CA . TRP A 1 9 ? -2.103 0.820 0.057 1.00 97.77 9 A 1 ATOM 61 C C . TRP A 1 9 ? -0.677 0.634 0.542 1.00 98.06 9 A 1 ATOM 62 O O . TRP A 1 9 ? 0.019 -0.288 0.112 1.00 97.88 9 A 1 ATOM 63 C CB . TRP A 1 9 ? -2.170 1.954 -0.965 1.00 97.39 9 A 1 ATOM 64 C CG . TRP A 1 9 ? -1.313 1.701 -2.153 1.00 95.70 9 A 1 ATOM 65 C CD1 . TRP A 1 9 ? -0.188 2.385 -2.495 1.00 92.50 9 A 1 ATOM 66 C CD2 . TRP A 1 9 ? -1.484 0.678 -3.152 1.00 94.78 9 A 1 ATOM 67 N NE1 . TRP A 1 9 ? 0.344 1.854 -3.649 1.00 91.85 9 A 1 ATOM 68 C CE2 . TRP A 1 9 ? -0.433 0.804 -4.075 1.00 94.07 9 A 1 ATOM 69 C CE3 . TRP A 1 9 ? -2.431 -0.322 -3.357 1.00 91.87 9 A 1 ATOM 70 C CZ2 . TRP A 1 9 ? -0.311 -0.046 -5.178 1.00 92.64 9 A 1 ATOM 71 C CZ3 . TRP A 1 9 ? -2.312 -1.167 -4.457 1.00 90.67 9 A 1 ATOM 72 C CH2 . TRP A 1 9 ? -1.253 -1.024 -5.353 1.00 91.22 9 A 1 ATOM 73 N N . ALA A 1 10 ? -0.242 1.498 1.450 1.00 98.28 10 A 1 ATOM 74 C CA . ALA A 1 10 ? 1.109 1.408 1.992 1.00 98.29 10 A 1 ATOM 75 C C . ALA A 1 10 ? 1.322 0.072 2.700 1.00 98.41 10 A 1 ATOM 76 O O . ALA A 1 10 ? 2.376 -0.550 2.565 1.00 98.08 10 A 1 ATOM 77 C CB . ALA A 1 10 ? 1.353 2.562 2.957 1.00 97.99 10 A 1 ATOM 78 N N . ILE A 1 11 ? 0.320 -0.370 3.440 1.00 98.24 11 A 1 ATOM 79 C CA . ILE A 1 11 ? 0.391 -1.644 4.148 1.00 98.10 11 A 1 ATOM 80 C C . ILE A 1 11 ? 0.449 -2.796 3.151 1.00 98.22 11 A 1 ATOM 81 O O . ILE A 1 11 ? 1.224 -3.738 3.323 1.00 97.81 11 A 1 ATOM 82 C CB . ILE A 1 11 ? -0.814 -1.807 5.091 1.00 97.85 11 A 1 ATOM 83 C CG1 . ILE A 1 11 ? -0.745 -0.763 6.212 1.00 96.41 11 A 1 ATOM 84 C CG2 . ILE A 1 11 ? -0.818 -3.214 5.696 1.00 96.05 11 A 1 ATOM 85 C CD1 . ILE A 1 11 ? -2.039 -0.641 6.985 1.00 92.41 11 A 1 ATOM 86 N N . CYS A 1 12 ? -0.360 -2.718 2.108 1.00 98.39 12 A 1 ATOM 87 C CA . CYS A 1 12 ? -0.377 -3.757 1.083 1.00 98.38 12 A 1 ATOM 88 C C . CYS A 1 12 ? 0.985 -3.879 0.406 1.00 98.52 12 A 1 ATOM 89 O O . CYS A 1 12 ? 1.477 -4.982 0.181 1.00 98.24 12 A 1 ATOM 90 C CB . CYS A 1 12 ? -1.450 -3.441 0.044 1.00 98.09 12 A 1 ATOM 91 S SG . CYS A 1 12 ? -3.108 -3.720 0.687 1.00 94.42 12 A 1 ATOM 92 N N . VAL A 1 13 ? 1.583 -2.751 0.092 1.00 98.58 13 A 1 ATOM 93 C CA . VAL A 1 13 ? 2.897 -2.740 -0.546 1.00 98.54 13 A 1 ATOM 94 C C . VAL A 1 13 ? 3.937 -3.354 0.383 1.00 98.58 13 A 1 ATOM 95 O O . VAL A 1 13 ? 4.784 -4.144 -0.044 1.00 98.23 13 A 1 ATOM 96 C CB . VAL A 1 13 ? 3.305 -1.309 -0.932 1.00 98.21 13 A 1 ATOM 97 C CG1 . VAL A 1 13 ? 4.739 -1.270 -1.449 1.00 96.60 13 A 1 ATOM 98 C CG2 . VAL A 1 13 ? 2.362 -0.767 -1.991 1.00 96.62 13 A 1 ATOM 99 N N . LEU A 1 14 ? 3.865 -2.999 1.654 1.00 98.48 14 A 1 ATOM 100 C CA . LEU A 1 14 ? 4.796 -3.538 2.641 1.00 98.34 14 A 1 ATOM 101 C C . LEU A 1 14 ? 4.628 -5.047 2.776 1.00 98.40 14 A 1 ATOM 102 O O . LEU A 1 14 ? 5.611 -5.775 2.907 1.00 97.99 14 A 1 ATOM 103 C CB . LEU A 1 14 ? 4.560 -2.857 3.992 1.00 98.12 14 A 1 ATOM 104 C CG . LEU A 1 14 ? 5.120 -1.438 4.059 1.00 94.40 14 A 1 ATOM 105 C CD1 . LEU A 1 14 ? 4.561 -0.694 5.264 1.00 91.72 14 A 1 ATOM 106 C CD2 . LEU A 1 14 ? 6.645 -1.471 4.141 1.00 92.26 14 A 1 ATOM 107 N N . ARG A 1 15 ? 3.389 -5.521 2.741 1.00 98.35 15 A 1 ATOM 108 C CA . ARG A 1 15 ? 3.107 -6.950 2.844 1.00 98.29 15 A 1 ATOM 109 C C . ARG A 1 15 ? 3.721 -7.704 1.678 1.00 98.47 15 A 1 ATOM 110 O O . ARG A 1 15 ? 4.318 -8.765 1.863 1.00 98.16 15 A 1 ATOM 111 C CB . ARG A 1 15 ? 1.593 -7.179 2.876 1.00 97.92 15 A 1 ATOM 112 C CG . ARG A 1 15 ? 0.957 -6.730 4.170 1.00 91.87 15 A 1 ATOM 113 C CD . ARG A 1 15 ? 0.870 -7.859 5.182 1.00 89.94 15 A 1 ATOM 114 N NE . ARG A 1 15 ? 2.198 -8.298 5.622 1.00 86.39 15 A 1 ATOM 115 C CZ . ARG A 1 15 ? 2.421 -8.991 6.735 1.00 83.00 15 A 1 ATOM 116 N NH1 . ARG A 1 15 ? 1.435 -9.347 7.527 1.00 76.78 15 A 1 ATOM 117 N NH2 . ARG A 1 15 ? 3.655 -9.329 7.049 1.00 77.64 15 A 1 ATOM 118 N N . VAL A 1 16 ? 3.583 -7.158 0.475 1.00 98.57 16 A 1 ATOM 119 C CA . VAL A 1 16 ? 4.142 -7.783 -0.720 1.00 98.47 16 A 1 ATOM 120 C C . VAL A 1 16 ? 5.663 -7.743 -0.679 1.00 98.54 16 A 1 ATOM 121 O O . VAL A 1 16 ? 6.331 -8.718 -1.032 1.00 98.16 16 A 1 ATOM 122 C CB . VAL A 1 16 ? 3.629 -7.087 -1.987 1.00 97.95 16 A 1 ATOM 123 C CG1 . VAL A 1 16 ? 4.305 -7.659 -3.225 1.00 95.53 16 A 1 ATOM 124 C CG2 . VAL A 1 16 ? 2.125 -7.249 -2.088 1.00 95.97 16 A 1 ATOM 125 N N . ALA A 1 17 ? 6.209 -6.618 -0.250 1.00 98.42 17 A 1 ATOM 126 C CA . ALA A 1 17 ? 7.658 -6.456 -0.172 1.00 98.27 17 A 1 ATOM 127 C C . ALA A 1 17 ? 8.262 -7.372 0.887 1.00 98.34 17 A 1 ATOM 128 O O . ALA A 1 17 ? 9.378 -7.870 0.725 1.00 97.71 17 A 1 ATOM 129 C CB . ALA A 1 17 ? 8.003 -5.001 0.138 1.00 97.83 17 A 1 ATOM 130 N N . LEU A 1 18 ? 7.526 -7.587 1.966 1.00 97.72 18 A 1 ATOM 131 C CA . LEU A 1 18 ? 7.983 -8.438 3.058 1.00 97.37 18 A 1 ATOM 132 C C . LEU A 1 18 ? 7.912 -9.910 2.676 1.00 97.42 18 A 1 ATOM 133 O O . LEU A 1 18 ? 8.732 -10.716 3.130 1.00 96.10 18 A 1 ATOM 134 C CB . LEU A 1 18 ? 7.126 -8.176 4.298 1.00 96.73 18 A 1 ATOM 135 C CG . LEU A 1 18 ? 7.681 -8.801 5.572 1.00 95.06 18 A 1 ATOM 136 C CD1 . LEU A 1 18 ? 8.958 -8.093 6.011 1.00 91.55 18 A 1 ATOM 137 C CD2 . LEU A 1 18 ? 6.642 -8.733 6.682 1.00 90.65 18 A 1 ATOM 138 N N . ALA A 1 19 ? 6.942 -10.248 1.850 1.00 96.75 19 A 1 ATOM 139 C CA . ALA A 1 19 ? 6.745 -11.626 1.406 1.00 95.36 19 A 1 ATOM 140 C C . ALA A 1 19 ? 7.787 -12.010 0.362 1.00 94.20 19 A 1 ATOM 141 O O . ALA A 1 19 ? 8.129 -13.201 0.266 1.00 90.63 19 A 1 ATOM 142 C CB . ALA A 1 19 ? 5.331 -11.791 0.848 1.00 92.67 19 A 1 ATOM 143 O OXT . ALA A 1 19 ? 8.260 -11.129 -0.366 1.00 84.82 19 A 1 #