# 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_spkb23363 # _entry.id spkb23363 # 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" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=O)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 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" "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" "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" "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 LYS 2 1 n LYS 3 1 n LEU 4 1 n LYS 5 1 n ILE 6 1 n ASN 7 1 n TYR 8 1 n LEU 9 1 n LEU 10 1 n ILE 11 1 n GLY 12 1 n ILE 13 1 n VAL 14 1 n THR 15 1 n LEU 16 1 n LEU 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 @ 2025-07-03 12:26:55)" _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 92.74 _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 81.57 1 1 A LYS 2 2 84.67 1 2 A LYS 3 2 85.78 1 3 A LEU 4 2 90.42 1 4 A LYS 5 2 89.19 1 5 A ILE 6 2 94.11 1 6 A ASN 7 2 93.03 1 7 A TYR 8 2 94.66 1 8 A LEU 9 2 95.49 1 9 A LEU 10 2 94.76 1 10 A ILE 11 2 95.87 1 11 A GLY 12 2 97.97 1 12 A ILE 13 2 96.35 1 13 A VAL 14 2 97.29 1 14 A THR 15 2 96.55 1 15 A LEU 16 2 95.56 1 16 A LEU 17 2 95.58 1 17 A LEU 18 2 95.26 1 18 A ALA 19 2 93.00 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 LYS . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n ILE . 6 A 6 A 7 1 n ASN . 7 A 7 A 8 1 n TYR . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n ILE . 11 A 11 A 12 1 n GLY . 12 A 12 A 13 1 n ILE . 13 A 13 A 14 1 n VAL . 14 A 14 A 15 1 n THR . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n LEU . 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 ? 11.203 -2.641 13.362 1.00 86.66 1 A 1 ATOM 2 C CA . MET A 1 1 ? 10.639 -2.039 12.144 1.00 90.15 1 A 1 ATOM 3 C C . MET A 1 1 ? 10.503 -3.077 11.040 1.00 91.31 1 A 1 ATOM 4 O O . MET A 1 1 ? 11.498 -3.517 10.476 1.00 86.12 1 A 1 ATOM 5 C CB . MET A 1 1 ? 11.531 -0.900 11.652 1.00 83.65 1 A 1 ATOM 6 C CG . MET A 1 1 ? 11.339 0.376 12.456 1.00 78.02 1 A 1 ATOM 7 S SD . MET A 1 1 ? 12.838 0.890 13.278 1.00 72.44 1 A 1 ATOM 8 C CE . MET A 1 1 ? 12.387 2.539 13.802 1.00 64.18 1 A 1 ATOM 9 N N . LYS A 1 2 ? 9.285 -3.469 10.765 1.00 92.31 2 A 1 ATOM 10 C CA . LYS A 1 2 ? 9.009 -4.457 9.733 1.00 93.43 2 A 1 ATOM 11 C C . LYS A 1 2 ? 8.936 -3.782 8.359 1.00 94.56 2 A 1 ATOM 12 O O . LYS A 1 2 ? 9.267 -2.609 8.223 1.00 92.89 2 A 1 ATOM 13 C CB . LYS A 1 2 ? 7.704 -5.177 10.074 1.00 90.44 2 A 1 ATOM 14 C CG . LYS A 1 2 ? 7.706 -6.643 9.647 1.00 82.39 2 A 1 ATOM 15 C CD . LYS A 1 2 ? 8.341 -7.537 10.692 1.00 79.46 2 A 1 ATOM 16 C CE . LYS A 1 2 ? 8.470 -8.962 10.186 1.00 72.01 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? 9.239 -9.800 11.119 1.00 64.57 2 A 1 ATOM 18 N N . LYS A 1 3 ? 8.496 -4.530 7.358 1.00 93.61 3 A 1 ATOM 19 C CA . LYS A 1 3 ? 8.367 -4.000 6.003 1.00 95.35 3 A 1 ATOM 20 C C . LYS A 1 3 ? 7.212 -2.998 5.937 1.00 96.28 3 A 1 ATOM 21 O O . LYS A 1 3 ? 6.094 -3.346 5.559 1.00 95.33 3 A 1 ATOM 22 C CB . LYS A 1 3 ? 8.154 -5.142 5.018 1.00 93.41 3 A 1 ATOM 23 C CG . LYS A 1 3 ? 9.456 -5.713 4.472 1.00 83.04 3 A 1 ATOM 24 C CD . LYS A 1 3 ? 9.804 -5.100 3.129 1.00 80.35 3 A 1 ATOM 25 C CE . LYS A 1 3 ? 11.013 -5.765 2.503 1.00 70.56 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? 11.435 -5.064 1.270 1.00 64.10 3 A 1 ATOM 27 N N . LEU A 1 4 ? 7.498 -1.754 6.301 1.00 94.22 4 A 1 ATOM 28 C CA . LEU A 1 4 ? 6.490 -0.702 6.289 1.00 95.26 4 A 1 ATOM 29 C C . LEU A 1 4 ? 6.251 -0.178 4.879 1.00 96.65 4 A 1 ATOM 30 O O . LEU A 1 4 ? 5.178 0.348 4.590 1.00 96.43 4 A 1 ATOM 31 C CB . LEU A 1 4 ? 6.921 0.440 7.208 1.00 94.16 4 A 1 ATOM 32 C CG . LEU A 1 4 ? 6.892 0.096 8.695 1.00 85.91 4 A 1 ATOM 33 C CD1 . LEU A 1 4 ? 7.748 1.073 9.481 1.00 80.96 4 A 1 ATOM 34 C CD2 . LEU A 1 4 ? 5.461 0.122 9.213 1.00 79.75 4 A 1 ATOM 35 N N . LYS A 1 5 ? 7.248 -0.339 4.014 1.00 95.82 5 A 1 ATOM 36 C CA . LYS A 1 5 ? 7.142 0.121 2.630 1.00 96.67 5 A 1 ATOM 37 C C . LYS A 1 5 ? 5.965 -0.551 1.932 1.00 96.93 5 A 1 ATOM 38 O O . LYS A 1 5 ? 5.218 0.100 1.201 1.00 96.26 5 A 1 ATOM 39 C CB . LYS A 1 5 ? 8.443 -0.169 1.884 1.00 96.00 5 A 1 ATOM 40 C CG . LYS A 1 5 ? 8.620 0.717 0.665 1.00 89.27 5 A 1 ATOM 41 C CD . LYS A 1 5 ? 9.309 2.025 1.029 1.00 84.86 5 A 1 ATOM 42 C CE . LYS A 1 5 ? 9.381 2.959 -0.160 1.00 77.41 5 A 1 ATOM 43 N NZ . LYS A 1 5 ? 10.319 4.085 0.076 1.00 69.47 5 A 1 ATOM 44 N N . ILE A 1 6 ? 5.811 -1.840 2.167 1.00 96.03 6 A 1 ATOM 45 C CA . ILE A 1 6 ? 4.712 -2.596 1.575 1.00 96.46 6 A 1 ATOM 46 C C . ILE A 1 6 ? 3.401 -2.264 2.278 1.00 96.90 6 A 1 ATOM 47 O O . ILE A 1 6 ? 2.337 -2.267 1.658 1.00 96.88 6 A 1 ATOM 48 C CB . ILE A 1 6 ? 4.997 -4.109 1.644 1.00 96.35 6 A 1 ATOM 49 C CG1 . ILE A 1 6 ? 6.271 -4.456 0.866 1.00 92.64 6 A 1 ATOM 50 C CG2 . ILE A 1 6 ? 3.816 -4.907 1.096 1.00 91.97 6 A 1 ATOM 51 C CD1 . ILE A 1 6 ? 6.832 -5.820 1.200 1.00 85.65 6 A 1 ATOM 52 N N . ASN A 1 7 ? 3.493 -1.972 3.567 1.00 97.31 7 A 1 ATOM 53 C CA . ASN A 1 7 ? 2.318 -1.636 4.360 1.00 97.19 7 A 1 ATOM 54 C C . ASN A 1 7 ? 1.670 -0.353 3.848 1.00 97.42 7 A 1 ATOM 55 O O . ASN A 1 7 ? 0.448 -0.241 3.800 1.00 97.23 7 A 1 ATOM 56 C CB . ASN A 1 7 ? 2.701 -1.485 5.827 1.00 96.69 7 A 1 ATOM 57 C CG . ASN A 1 7 ? 1.574 -1.900 6.746 1.00 91.94 7 A 1 ATOM 58 O OD1 . ASN A 1 7 ? 0.449 -2.101 6.321 1.00 82.36 7 A 1 ATOM 59 N ND2 . ASN A 1 7 ? 1.874 -2.041 8.027 1.00 84.07 7 A 1 ATOM 60 N N . TYR A 1 8 ? 2.502 0.614 3.479 1.00 97.31 8 A 1 ATOM 61 C CA . TYR A 1 8 ? 1.998 1.882 2.959 1.00 97.40 8 A 1 ATOM 62 C C . TYR A 1 8 ? 1.335 1.693 1.597 1.00 97.37 8 A 1 ATOM 63 O O . TYR A 1 8 ? 0.366 2.383 1.267 1.00 97.04 8 A 1 ATOM 64 C CB . TYR A 1 8 ? 3.148 2.882 2.845 1.00 97.32 8 A 1 ATOM 65 C CG . TYR A 1 8 ? 3.517 3.504 4.173 1.00 95.85 8 A 1 ATOM 66 C CD1 . TYR A 1 8 ? 2.596 4.274 4.874 1.00 91.61 8 A 1 ATOM 67 C CD2 . TYR A 1 8 ? 4.786 3.325 4.713 1.00 93.20 8 A 1 ATOM 68 C CE1 . TYR A 1 8 ? 2.930 4.848 6.093 1.00 91.90 8 A 1 ATOM 69 C CE2 . TYR A 1 8 ? 5.127 3.898 5.934 1.00 92.44 8 A 1 ATOM 70 C CZ . TYR A 1 8 ? 4.193 4.657 6.618 1.00 93.58 8 A 1 ATOM 71 O OH . TYR A 1 8 ? 4.531 5.221 7.825 1.00 90.89 8 A 1 ATOM 72 N N . LEU A 1 9 ? 1.850 0.753 0.828 1.00 97.36 9 A 1 ATOM 73 C CA . LEU A 1 9 ? 1.291 0.456 -0.487 1.00 97.35 9 A 1 ATOM 74 C C . LEU A 1 9 ? -0.095 -0.166 -0.355 1.00 97.58 9 A 1 ATOM 75 O O . LEU A 1 9 ? -0.951 0.031 -1.221 1.00 97.63 9 A 1 ATOM 76 C CB . LEU A 1 9 ? 2.225 -0.491 -1.241 1.00 97.39 9 A 1 ATOM 77 C CG . LEU A 1 9 ? 3.400 0.209 -1.922 1.00 94.63 9 A 1 ATOM 78 C CD1 . LEU A 1 9 ? 4.545 -0.758 -2.156 1.00 90.29 9 A 1 ATOM 79 C CD2 . LEU A 1 9 ? 2.956 0.813 -3.248 1.00 91.66 9 A 1 ATOM 80 N N . LEU A 1 10 ? -0.299 -0.898 0.724 1.00 97.40 10 A 1 ATOM 81 C CA . LEU A 1 10 ? -1.582 -1.538 0.984 1.00 97.45 10 A 1 ATOM 82 C C . LEU A 1 10 ? -2.673 -0.494 1.185 1.00 97.58 10 A 1 ATOM 83 O O . LEU A 1 10 ? -3.811 -0.692 0.770 1.00 97.68 10 A 1 ATOM 84 C CB . LEU A 1 10 ? -1.481 -2.435 2.218 1.00 97.33 10 A 1 ATOM 85 C CG . LEU A 1 10 ? -1.503 -3.929 1.905 1.00 91.82 10 A 1 ATOM 86 C CD1 . LEU A 1 10 ? -0.121 -4.415 1.497 1.00 88.29 10 A 1 ATOM 87 C CD2 . LEU A 1 10 ? -1.995 -4.710 3.111 1.00 90.52 10 A 1 ATOM 88 N N . ILE A 1 11 ? -2.315 0.605 1.813 1.00 97.88 11 A 1 ATOM 89 C CA . ILE A 1 11 ? -3.266 1.681 2.068 1.00 97.69 11 A 1 ATOM 90 C C . ILE A 1 11 ? -3.689 2.339 0.754 1.00 97.81 11 A 1 ATOM 91 O O . ILE A 1 11 ? -4.840 2.757 0.600 1.00 97.57 11 A 1 ATOM 92 C CB . ILE A 1 11 ? -2.655 2.720 3.027 1.00 97.24 11 A 1 ATOM 93 C CG1 . ILE A 1 11 ? -2.296 2.072 4.368 1.00 95.20 11 A 1 ATOM 94 C CG2 . ILE A 1 11 ? -3.631 3.876 3.252 1.00 94.55 11 A 1 ATOM 95 C CD1 . ILE A 1 11 ? -1.294 2.879 5.174 1.00 88.98 11 A 1 ATOM 96 N N . GLY A 1 12 ? -2.750 2.421 -0.169 1.00 97.92 12 A 1 ATOM 97 C CA . GLY A 1 12 ? -3.030 3.025 -1.469 1.00 97.88 12 A 1 ATOM 98 C C . GLY A 1 12 ? -4.040 2.227 -2.271 1.00 98.20 12 A 1 ATOM 99 O O . GLY A 1 12 ? -4.945 2.791 -2.882 1.00 97.90 12 A 1 ATOM 100 N N . ILE A 1 13 ? -3.885 0.918 -2.256 1.00 97.91 13 A 1 ATOM 101 C CA . ILE A 1 13 ? -4.793 0.037 -2.990 1.00 97.94 13 A 1 ATOM 102 C C . ILE A 1 13 ? -6.164 -0.029 -2.323 1.00 98.21 13 A 1 ATOM 103 O O . ILE A 1 13 ? -7.180 -0.175 -2.999 1.00 97.84 13 A 1 ATOM 104 C CB . ILE A 1 13 ? -4.196 -1.378 -3.131 1.00 97.57 13 A 1 ATOM 105 C CG1 . ILE A 1 13 ? -3.701 -1.917 -1.787 1.00 95.60 13 A 1 ATOM 106 C CG2 . ILE A 1 13 ? -3.070 -1.360 -4.162 1.00 94.66 13 A 1 ATOM 107 C CD1 . ILE A 1 13 ? -3.533 -3.418 -1.761 1.00 91.10 13 A 1 ATOM 108 N N . VAL A 1 14 ? -6.177 0.078 -1.009 1.00 98.28 14 A 1 ATOM 109 C CA . VAL A 1 14 ? -7.432 0.050 -0.255 1.00 98.21 14 A 1 ATOM 110 C C . VAL A 1 14 ? -8.258 1.289 -0.571 1.00 98.36 14 A 1 ATOM 111 O O . VAL A 1 14 ? -9.482 1.215 -0.693 1.00 97.96 14 A 1 ATOM 112 C CB . VAL A 1 14 ? -7.159 -0.054 1.259 1.00 97.65 14 A 1 ATOM 113 C CG1 . VAL A 1 14 ? -8.427 0.169 2.068 1.00 95.29 14 A 1 ATOM 114 C CG2 . VAL A 1 14 ? -6.578 -1.417 1.598 1.00 95.31 14 A 1 ATOM 115 N N . THR A 1 15 ? -7.590 2.416 -0.711 1.00 98.37 15 A 1 ATOM 116 C CA . THR A 1 15 ? -8.263 3.675 -1.022 1.00 98.33 15 A 1 ATOM 117 C C . THR A 1 15 ? -8.893 3.614 -2.413 1.00 98.45 15 A 1 ATOM 118 O O . THR A 1 15 ? -9.958 4.189 -2.644 1.00 97.95 15 A 1 ATOM 119 C CB . THR A 1 15 ? -7.270 4.838 -0.947 1.00 97.83 15 A 1 ATOM 120 O OG1 . THR A 1 15 ? -6.583 4.798 0.296 1.00 93.21 15 A 1 ATOM 121 C CG2 . THR A 1 15 ? -7.984 6.177 -1.050 1.00 91.68 15 A 1 ATOM 122 N N . LEU A 1 16 ? -8.244 2.911 -3.312 1.00 98.38 16 A 1 ATOM 123 C CA . LEU A 1 16 ? -8.744 2.762 -4.677 1.00 98.22 16 A 1 ATOM 124 C C . LEU A 1 16 ? -10.059 1.983 -4.695 1.00 98.27 16 A 1 ATOM 125 O O . LEU A 1 16 ? -10.949 2.275 -5.492 1.00 97.72 16 A 1 ATOM 126 C CB . LEU A 1 16 ? -7.700 2.055 -5.542 1.00 97.84 16 A 1 ATOM 127 C CG . LEU A 1 16 ? -7.273 2.854 -6.773 1.00 93.76 16 A 1 ATOM 128 C CD1 . LEU A 1 16 ? -6.224 3.889 -6.391 1.00 89.53 16 A 1 ATOM 129 C CD2 . LEU A 1 16 ? -6.728 1.930 -7.845 1.00 90.77 16 A 1 ATOM 130 N N . LEU A 1 17 ? -10.155 1.006 -3.815 1.00 98.21 17 A 1 ATOM 131 C CA . LEU A 1 17 ? -11.362 0.188 -3.718 1.00 98.04 17 A 1 ATOM 132 C C . LEU A 1 17 ? -12.451 0.903 -2.929 1.00 98.14 17 A 1 ATOM 133 O O . LEU A 1 17 ? -13.641 0.717 -3.195 1.00 97.62 17 A 1 ATOM 134 C CB . LEU A 1 17 ? -11.020 -1.151 -3.063 1.00 97.67 17 A 1 ATOM 135 C CG . LEU A 1 17 ? -10.464 -2.192 -4.030 1.00 94.81 17 A 1 ATOM 136 C CD1 . LEU A 1 17 ? -9.575 -3.187 -3.300 1.00 89.73 17 A 1 ATOM 137 C CD2 . LEU A 1 17 ? -11.607 -2.924 -4.716 1.00 90.41 17 A 1 ATOM 138 N N . LEU A 1 18 ? -12.030 1.702 -1.961 1.00 98.01 18 A 1 ATOM 139 C CA . LEU A 1 18 ? -12.966 2.445 -1.122 1.00 97.83 18 A 1 ATOM 140 C C . LEU A 1 18 ? -13.484 3.691 -1.829 1.00 97.91 18 A 1 ATOM 141 O O . LEU A 1 18 ? -14.655 4.057 -1.688 1.00 97.18 18 A 1 ATOM 142 C CB . LEU A 1 18 ? -12.287 2.815 0.200 1.00 97.23 18 A 1 ATOM 143 C CG . LEU A 1 18 ? -13.177 2.661 1.428 1.00 94.59 18 A 1 ATOM 144 C CD1 . LEU A 1 18 ? -12.325 2.387 2.663 1.00 89.71 18 A 1 ATOM 145 C CD2 . LEU A 1 18 ? -14.019 3.906 1.649 1.00 89.63 18 A 1 ATOM 146 N N . ALA A 1 19 ? -12.619 4.330 -2.579 1.00 97.04 19 A 1 ATOM 147 C CA . ALA A 1 19 ? -12.971 5.545 -3.296 1.00 96.06 19 A 1 ATOM 148 C C . ALA A 1 19 ? -13.019 5.320 -4.807 1.00 95.06 19 A 1 ATOM 149 O O . ALA A 1 19 ? -12.699 4.207 -5.270 1.00 91.50 19 A 1 ATOM 150 C CB . ALA A 1 19 ? -11.984 6.650 -2.946 1.00 93.92 19 A 1 ATOM 151 O OXT . ALA A 1 19 ? -13.325 6.262 -5.555 1.00 84.42 19 A 1 #