# 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_spkb28556 # _entry.id spkb28556 # 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" "C2 H5 N O2" 75.067 GLY y GLYCINE C(C(=O)O)N ? "PEPTIDE LINKING" "C6 H10 N3 O2" 156.162 HIS y HISTIDINE c1c([nH+]c[nH]1)C[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" "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" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[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 ALA 2 1 n PRO 3 1 n ILE 4 1 n HIS 5 1 n TYR 6 1 n LEU 7 1 n LEU 8 1 n PRO 9 1 n ILE 10 1 n ILE 11 1 n THR 12 1 n LEU 13 1 n GLY 14 1 n SER 15 1 n ALA 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 @ 2025-07-13 11:54:53)" _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 89.82 _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 70.52 1 1 A ALA 2 2 85.23 1 2 A PRO 3 2 89.71 1 3 A ILE 4 2 88.68 1 4 A HIS 5 2 88.81 1 5 A TYR 6 2 89.50 1 6 A LEU 7 2 91.79 1 7 A LEU 8 2 91.86 1 8 A PRO 9 2 94.39 1 9 A ILE 10 2 93.04 1 10 A ILE 11 2 93.73 1 11 A THR 12 2 93.72 1 12 A LEU 13 2 92.61 1 13 A GLY 14 2 95.27 1 14 A SER 15 2 92.53 1 15 A ALA 16 2 95.30 1 16 A ALA 17 2 94.04 1 17 A LEU 18 2 88.76 1 18 A ALA 19 2 81.83 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 ALA . 2 A 2 A 3 1 n PRO . 3 A 3 A 4 1 n ILE . 4 A 4 A 5 1 n HIS . 5 A 5 A 6 1 n TYR . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n PRO . 9 A 9 A 10 1 n ILE . 10 A 10 A 11 1 n ILE . 11 A 11 A 12 1 n THR . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n GLY . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n ALA . 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 ? -9.933 1.169 11.183 1.00 73.19 1 A 1 ATOM 2 C CA . MET A 1 1 ? -8.904 0.331 10.540 1.00 76.89 1 A 1 ATOM 3 C C . MET A 1 1 ? -8.833 0.579 9.035 1.00 77.36 1 A 1 ATOM 4 O O . MET A 1 1 ? -7.835 0.252 8.398 1.00 73.21 1 A 1 ATOM 5 C CB . MET A 1 1 ? -9.185 -1.155 10.794 1.00 70.93 1 A 1 ATOM 6 C CG . MET A 1 1 ? -8.967 -1.537 12.251 1.00 67.69 1 A 1 ATOM 7 S SD . MET A 1 1 ? -9.185 -3.293 12.539 1.00 65.48 1 A 1 ATOM 8 C CE . MET A 1 1 ? -8.719 -3.376 14.271 1.00 59.38 1 A 1 ATOM 9 N N . ALA A 1 2 ? -9.878 1.156 8.483 1.00 81.61 2 A 1 ATOM 10 C CA . ALA A 1 2 ? -9.899 1.481 7.056 1.00 86.38 2 A 1 ATOM 11 C C . ALA A 1 2 ? -8.726 2.377 6.645 1.00 89.06 2 A 1 ATOM 12 O O . ALA A 1 2 ? -8.075 2.111 5.631 1.00 87.45 2 A 1 ATOM 13 C CB . ALA A 1 2 ? -11.235 2.120 6.682 1.00 81.65 2 A 1 ATOM 14 N N . PRO A 1 3 ? -8.418 3.433 7.424 1.00 89.26 3 A 1 ATOM 15 C CA . PRO A 1 3 ? -7.285 4.312 7.099 1.00 91.57 3 A 1 ATOM 16 C C . PRO A 1 3 ? -5.964 3.558 7.048 1.00 93.24 3 A 1 ATOM 17 O O . PRO A 1 3 ? -5.096 3.863 6.228 1.00 91.46 3 A 1 ATOM 18 C CB . PRO A 1 3 ? -7.272 5.343 8.238 1.00 87.77 3 A 1 ATOM 19 C CG . PRO A 1 3 ? -8.671 5.335 8.758 1.00 85.38 3 A 1 ATOM 20 C CD . PRO A 1 3 ? -9.158 3.918 8.587 1.00 89.28 3 A 1 ATOM 21 N N . ILE A 1 4 ? -5.805 2.563 7.915 1.00 90.95 4 A 1 ATOM 22 C CA . ILE A 1 4 ? -4.587 1.759 7.959 1.00 91.49 4 A 1 ATOM 23 C C . ILE A 1 4 ? -4.414 0.991 6.657 1.00 92.89 4 A 1 ATOM 24 O O . ILE A 1 4 ? -3.301 0.829 6.152 1.00 92.48 4 A 1 ATOM 25 C CB . ILE A 1 4 ? -4.616 0.779 9.145 1.00 90.60 4 A 1 ATOM 26 C CG1 . ILE A 1 4 ? -4.849 1.530 10.465 1.00 86.68 4 A 1 ATOM 27 C CG2 . ILE A 1 4 ? -3.310 -0.019 9.210 1.00 85.25 4 A 1 ATOM 28 C CD1 . ILE A 1 4 ? -3.791 2.585 10.752 1.00 79.09 4 A 1 ATOM 29 N N . HIS A 1 5 ? -5.541 0.520 6.092 1.00 92.12 5 A 1 ATOM 30 C CA . HIS A 1 5 ? -5.516 -0.230 4.838 1.00 92.63 5 A 1 ATOM 31 C C . HIS A 1 5 ? -4.993 0.640 3.696 1.00 93.90 5 A 1 ATOM 32 O O . HIS A 1 5 ? -4.419 0.137 2.731 1.00 93.28 5 A 1 ATOM 33 C CB . HIS A 1 5 ? -6.917 -0.744 4.511 1.00 91.61 5 A 1 ATOM 34 C CG . HIS A 1 5 ? -6.906 -1.758 3.409 1.00 89.66 5 A 1 ATOM 35 N ND1 . HIS A 1 5 ? -6.959 -1.434 2.078 1.00 83.60 5 A 1 ATOM 36 C CD2 . HIS A 1 5 ? -6.838 -3.113 3.461 1.00 83.35 5 A 1 ATOM 37 C CE1 . HIS A 1 5 ? -6.925 -2.546 1.358 1.00 83.59 5 A 1 ATOM 38 N NE2 . HIS A 1 5 ? -6.850 -3.588 2.169 1.00 84.35 5 A 1 ATOM 39 N N . TYR A 1 6 ? -5.182 1.954 3.813 1.00 92.51 6 A 1 ATOM 40 C CA . TYR A 1 6 ? -4.685 2.886 2.805 1.00 92.76 6 A 1 ATOM 41 C C . TYR A 1 6 ? -3.190 3.148 2.991 1.00 94.20 6 A 1 ATOM 42 O O . TYR A 1 6 ? -2.467 3.385 2.024 1.00 93.37 6 A 1 ATOM 43 C CB . TYR A 1 6 ? -5.448 4.209 2.887 1.00 91.90 6 A 1 ATOM 44 C CG . TYR A 1 6 ? -6.846 4.114 2.323 1.00 89.16 6 A 1 ATOM 45 C CD1 . TYR A 1 6 ? -7.049 4.073 0.949 1.00 87.30 6 A 1 ATOM 46 C CD2 . TYR A 1 6 ? -7.951 4.073 3.161 1.00 87.04 6 A 1 ATOM 47 C CE1 . TYR A 1 6 ? -8.331 3.985 0.423 1.00 86.85 6 A 1 ATOM 48 C CE2 . TYR A 1 6 ? -9.238 3.982 2.641 1.00 86.37 6 A 1 ATOM 49 C CZ . TYR A 1 6 ? -9.418 3.943 1.273 1.00 87.02 6 A 1 ATOM 50 O OH . TYR A 1 6 ? -10.688 3.859 0.757 1.00 85.52 6 A 1 ATOM 51 N N . LEU A 1 7 ? -2.712 3.093 4.234 1.00 93.28 7 A 1 ATOM 52 C CA . LEU A 1 7 ? -1.305 3.349 4.533 1.00 93.55 7 A 1 ATOM 53 C C . LEU A 1 7 ? -0.398 2.270 3.949 1.00 94.56 7 A 1 ATOM 54 O O . LEU A 1 7 ? 0.691 2.572 3.458 1.00 94.15 7 A 1 ATOM 55 C CB . LEU A 1 7 ? -1.097 3.431 6.046 1.00 92.91 7 A 1 ATOM 56 C CG . LEU A 1 7 ? -1.788 4.626 6.707 1.00 89.78 7 A 1 ATOM 57 C CD1 . LEU A 1 7 ? -1.632 4.557 8.220 1.00 88.19 7 A 1 ATOM 58 C CD2 . LEU A 1 7 ? -1.210 5.934 6.186 1.00 87.87 7 A 1 ATOM 59 N N . LEU A 1 8 ? -0.840 1.016 3.991 1.00 93.94 8 A 1 ATOM 60 C CA . LEU A 1 8 ? -0.058 -0.101 3.458 1.00 93.95 8 A 1 ATOM 61 C C . LEU A 1 8 ? 0.312 0.094 1.983 1.00 94.68 8 A 1 ATOM 62 O O . LEU A 1 8 ? 1.491 0.038 1.633 1.00 94.43 8 A 1 ATOM 63 C CB . LEU A 1 8 ? -0.807 -1.424 3.650 1.00 93.10 8 A 1 ATOM 64 C CG . LEU A 1 8 ? -0.489 -2.136 4.964 1.00 89.84 8 A 1 ATOM 65 C CD1 . LEU A 1 8 ? -1.065 -1.371 6.153 1.00 87.77 8 A 1 ATOM 66 C CD2 . LEU A 1 8 ? -1.031 -3.556 4.939 1.00 87.20 8 A 1 ATOM 67 N N . PRO A 1 9 ? -0.676 0.319 1.098 1.00 94.71 9 A 1 ATOM 68 C CA . PRO A 1 9 ? -0.373 0.504 -0.326 1.00 94.78 9 A 1 ATOM 69 C C . PRO A 1 9 ? 0.437 1.767 -0.583 1.00 95.66 9 A 1 ATOM 70 O O . PRO A 1 9 ? 1.280 1.792 -1.481 1.00 94.81 9 A 1 ATOM 71 C CB . PRO A 1 9 ? -1.752 0.581 -0.992 1.00 93.42 9 A 1 ATOM 72 C CG . PRO A 1 9 ? -2.686 0.962 0.112 1.00 92.80 9 A 1 ATOM 73 C CD . PRO A 1 9 ? -2.106 0.342 1.361 1.00 94.54 9 A 1 ATOM 74 N N . ILE A 1 10 ? 0.219 2.807 0.208 1.00 94.57 10 A 1 ATOM 75 C CA . ILE A 1 10 ? 0.963 4.053 0.066 1.00 94.57 10 A 1 ATOM 76 C C . ILE A 1 10 ? 2.444 3.819 0.347 1.00 95.40 10 A 1 ATOM 77 O O . ILE A 1 10 ? 3.312 4.303 -0.384 1.00 94.67 10 A 1 ATOM 78 C CB . ILE A 1 10 ? 0.409 5.136 1.007 1.00 93.77 10 A 1 ATOM 79 C CG1 . ILE A 1 10 ? -0.999 5.556 0.556 1.00 91.67 10 A 1 ATOM 80 C CG2 . ILE A 1 10 ? 1.333 6.354 1.022 1.00 91.40 10 A 1 ATOM 81 C CD1 . ILE A 1 10 ? -1.723 6.396 1.587 1.00 88.29 10 A 1 ATOM 82 N N . ILE A 1 11 ? 2.734 3.069 1.398 1.00 95.44 11 A 1 ATOM 83 C CA . ILE A 1 11 ? 4.110 2.748 1.763 1.00 94.90 11 A 1 ATOM 84 C C . ILE A 1 11 ? 4.762 1.910 0.671 1.00 95.58 11 A 1 ATOM 85 O O . ILE A 1 11 ? 5.926 2.123 0.320 1.00 95.18 11 A 1 ATOM 86 C CB . ILE A 1 11 ? 4.160 2.004 3.106 1.00 94.59 11 A 1 ATOM 87 C CG1 . ILE A 1 11 ? 3.693 2.936 4.234 1.00 92.84 11 A 1 ATOM 88 C CG2 . ILE A 1 11 ? 5.578 1.509 3.392 1.00 92.21 11 A 1 ATOM 89 C CD1 . ILE A 1 11 ? 3.411 2.204 5.533 1.00 89.13 11 A 1 ATOM 90 N N . THR A 1 12 ? 4.013 0.962 0.131 1.00 95.52 12 A 1 ATOM 91 C CA . THR A 1 12 ? 4.515 0.096 -0.936 1.00 95.19 12 A 1 ATOM 92 C C . THR A 1 12 ? 4.913 0.922 -2.157 1.00 95.78 12 A 1 ATOM 93 O O . THR A 1 12 ? 6.001 0.746 -2.712 1.00 95.36 12 A 1 ATOM 94 C CB . THR A 1 12 ? 3.463 -0.939 -1.344 1.00 94.18 12 A 1 ATOM 95 O OG1 . THR A 1 12 ? 3.084 -1.705 -0.204 1.00 90.56 12 A 1 ATOM 96 C CG2 . THR A 1 12 ? 4.007 -1.879 -2.409 1.00 89.42 12 A 1 ATOM 97 N N . LEU A 1 13 ? 4.048 1.840 -2.560 1.00 95.05 13 A 1 ATOM 98 C CA . LEU A 1 13 ? 4.324 2.706 -3.699 1.00 95.03 13 A 1 ATOM 99 C C . LEU A 1 13 ? 5.498 3.629 -3.401 1.00 95.46 13 A 1 ATOM 100 O O . LEU A 1 13 ? 6.319 3.908 -4.278 1.00 94.60 13 A 1 ATOM 101 C CB . LEU A 1 13 ? 3.082 3.530 -4.040 1.00 94.05 13 A 1 ATOM 102 C CG . LEU A 1 13 ? 1.909 2.705 -4.573 1.00 90.18 13 A 1 ATOM 103 C CD1 . LEU A 1 13 ? 0.667 3.577 -4.703 1.00 88.57 13 A 1 ATOM 104 C CD2 . LEU A 1 13 ? 2.260 2.079 -5.916 1.00 87.90 13 A 1 ATOM 105 N N . GLY A 1 14 ? 5.586 4.089 -2.161 1.00 95.12 14 A 1 ATOM 106 C CA . GLY A 1 14 ? 6.686 4.944 -1.742 1.00 94.77 14 A 1 ATOM 107 C C . GLY A 1 14 ? 8.016 4.228 -1.839 1.00 95.75 14 A 1 ATOM 108 O O . GLY A 1 14 ? 9.019 4.809 -2.256 1.00 95.42 14 A 1 ATOM 109 N N . SER A 1 15 ? 8.033 2.943 -1.476 1.00 94.69 15 A 1 ATOM 110 C CA . SER A 1 15 ? 9.242 2.128 -1.563 1.00 94.44 15 A 1 ATOM 111 C C . SER A 1 15 ? 9.679 1.975 -3.012 1.00 95.09 15 A 1 ATOM 112 O O . SER A 1 15 ? 10.868 2.035 -3.321 1.00 93.95 15 A 1 ATOM 113 C CB . SER A 1 15 ? 9.001 0.751 -0.951 1.00 92.20 15 A 1 ATOM 114 O OG . SER A 1 15 ? 8.688 0.873 0.426 1.00 84.82 15 A 1 ATOM 115 N N . ALA A 1 16 ? 8.708 1.787 -3.913 1.00 95.45 16 A 1 ATOM 116 C CA . ALA A 1 16 ? 8.993 1.665 -5.339 1.00 95.48 16 A 1 ATOM 117 C C . ALA A 1 16 ? 9.571 2.963 -5.890 1.00 96.22 16 A 1 ATOM 118 O O . ALA A 1 16 ? 10.460 2.942 -6.743 1.00 94.98 16 A 1 ATOM 119 C CB . ALA A 1 16 ? 7.722 1.291 -6.094 1.00 94.35 16 A 1 ATOM 120 N N . ALA A 1 17 ? 9.075 4.088 -5.398 1.00 94.30 17 A 1 ATOM 121 C CA . ALA A 1 17 ? 9.560 5.397 -5.823 1.00 94.29 17 A 1 ATOM 122 C C . ALA A 1 17 ? 10.979 5.643 -5.325 1.00 94.99 17 A 1 ATOM 123 O O . ALA A 1 17 ? 11.769 6.318 -5.985 1.00 93.58 17 A 1 ATOM 124 C CB . ALA A 1 17 ? 8.626 6.489 -5.312 1.00 93.02 17 A 1 ATOM 125 N N . LEU A 1 18 ? 11.291 5.096 -4.152 1.00 92.85 18 A 1 ATOM 126 C CA . LEU A 1 18 ? 12.621 5.238 -3.571 1.00 92.52 18 A 1 ATOM 127 C C . LEU A 1 18 ? 13.653 4.474 -4.389 1.00 93.09 18 A 1 ATOM 128 O O . LEU A 1 18 ? 14.801 4.910 -4.522 1.00 91.73 18 A 1 ATOM 129 C CB . LEU A 1 18 ? 12.618 4.716 -2.130 1.00 89.97 18 A 1 ATOM 130 C CG . LEU A 1 18 ? 13.951 4.860 -1.402 1.00 85.79 18 A 1 ATOM 131 C CD1 . LEU A 1 18 ? 14.308 6.323 -1.214 1.00 83.23 18 A 1 ATOM 132 C CD2 . LEU A 1 18 ? 13.892 4.157 -0.047 1.00 80.90 18 A 1 ATOM 133 N N . ALA A 1 19 ? 13.245 3.323 -4.934 1.00 88.14 19 A 1 ATOM 134 C CA . ALA A 1 19 ? 14.123 2.481 -5.742 1.00 86.33 19 A 1 ATOM 135 C C . ALA A 1 19 ? 14.374 3.124 -7.099 1.00 82.91 19 A 1 ATOM 136 O O . ALA A 1 19 ? 15.511 3.062 -7.592 1.00 78.49 19 A 1 ATOM 137 C CB . ALA A 1 19 ? 13.512 1.091 -5.907 1.00 80.96 19 A 1 ATOM 138 O OXT . ALA A 1 19 ? 13.421 3.684 -7.670 1.00 74.18 19 A 1 #