# 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_lidtsur_6 # _entry.id lidtsur_6 # 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" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "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" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[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 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" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[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" "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 THR 2 1 n LYS 3 1 n VAL 4 1 n THR 5 1 n VAL 6 1 n LEU 7 1 n LEU 8 1 n THR 9 1 n SER 10 1 n ASP 11 1 n LYS 12 1 n VAL 13 1 n THR 14 1 n LEU 15 1 n ILE 16 1 n ALA 17 1 n LEU 18 1 n LEU 19 1 n GLY 20 1 n ASP 21 1 n ALA 22 1 n VAL 23 1 n GLU 24 1 n ASP 25 1 n THR 26 1 n PRO 27 1 n SER 28 1 n LEU 29 1 n ALA 30 1 n LEU 31 1 n ASP 32 1 n ILE 33 1 n LYS 34 1 n PRO 35 1 n GLY 36 1 n SER 37 1 n ASP 38 1 n LEU 39 1 n SER 40 1 n ALA 41 1 n ALA 42 1 n ILE 43 1 n ALA 44 1 n GLU 45 1 n LEU 46 1 n GLU 47 1 n THR 48 1 n GLN 49 1 n LEU 50 1 n LYS 51 1 n LYS 52 1 n PRO 53 1 n THR 54 1 n ALA 55 1 n PRO 56 1 n ILE 57 1 n MET 58 1 n PHE 59 1 n ILE 60 1 n VAL 61 1 n ASN 62 1 n GLY 63 1 n GLY 64 1 n GLY 65 1 n TYR 66 1 n SER 67 1 n PRO 68 1 n GLU 69 1 n ALA 70 1 n ALA 71 1 n ALA 72 1 n GLN 73 1 n TYR 74 1 n SER 75 1 n PRO 76 1 n GLU 77 1 n LYS 78 1 n VAL 79 1 n ALA 80 1 n GLU 81 1 n PHE 82 1 n THR 83 1 n VAL 84 1 n ASP 85 1 n ASN 86 1 n PRO 87 1 n ALA 88 1 n LEU 89 1 n ASP 90 1 n GLU 91 1 n PHE 92 1 n VAL 93 1 n ALA 94 1 n ALA 95 1 n VAL 96 1 n ALA 97 # _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 (3.0.1 @ 2025-04-07 01:06:21)" _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 91.72 _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 85.62 1 1 A THR 2 2 95.00 1 2 A LYS 3 2 93.78 1 3 A VAL 4 2 97.13 1 4 A THR 5 2 96.67 1 5 A VAL 6 2 96.71 1 6 A LEU 7 2 95.83 1 7 A LEU 8 2 94.40 1 8 A THR 9 2 92.89 1 9 A SER 10 2 90.48 1 10 A ASP 11 2 87.98 1 11 A LYS 12 2 85.37 1 12 A VAL 13 2 89.93 1 13 A THR 14 2 93.04 1 14 A LEU 15 2 92.75 1 15 A ILE 16 2 95.19 1 16 A ALA 17 2 96.69 1 17 A LEU 18 2 95.20 1 18 A LEU 19 2 95.64 1 19 A GLY 20 2 96.04 1 20 A ASP 21 2 92.75 1 21 A ALA 22 2 94.69 1 22 A VAL 23 2 92.88 1 23 A GLU 24 2 89.30 1 24 A ASP 25 2 89.72 1 25 A THR 26 2 93.92 1 26 A PRO 27 2 95.27 1 27 A SER 28 2 94.94 1 28 A LEU 29 2 93.13 1 29 A ALA 30 2 93.70 1 30 A LEU 31 2 90.17 1 31 A ASP 32 2 87.75 1 32 A ILE 33 2 88.68 1 33 A LYS 34 2 77.55 1 34 A PRO 35 2 81.84 1 35 A GLY 36 2 84.48 1 36 A SER 37 2 83.20 1 37 A ASP 38 2 88.09 1 38 A LEU 39 2 90.98 1 39 A SER 40 2 91.56 1 40 A ALA 41 2 93.99 1 41 A ALA 42 2 94.81 1 42 A ILE 43 2 95.30 1 43 A ALA 44 2 95.62 1 44 A GLU 45 2 85.56 1 45 A LEU 46 2 95.33 1 46 A GLU 47 2 91.06 1 47 A THR 48 2 95.25 1 48 A GLN 49 2 88.86 1 49 A LEU 50 2 96.33 1 50 A LYS 51 2 93.95 1 51 A LYS 52 2 93.88 1 52 A PRO 53 2 96.33 1 53 A THR 54 2 94.97 1 54 A ALA 55 2 95.82 1 55 A PRO 56 2 95.29 1 56 A ILE 57 2 92.43 1 57 A MET 58 2 87.84 1 58 A PHE 59 2 93.21 1 59 A ILE 60 2 90.50 1 60 A VAL 61 2 89.96 1 61 A ASN 62 2 83.20 1 62 A GLY 63 2 89.03 1 63 A GLY 64 2 91.01 1 64 A GLY 65 2 92.76 1 65 A TYR 66 2 93.90 1 66 A SER 67 2 92.77 1 67 A PRO 68 2 93.56 1 68 A GLU 69 2 84.64 1 69 A ALA 70 2 91.35 1 70 A ALA 71 2 91.96 1 71 A ALA 72 2 92.73 1 72 A GLN 73 2 84.38 1 73 A TYR 74 2 88.86 1 74 A SER 75 2 92.33 1 75 A PRO 76 2 94.70 1 76 A GLU 77 2 87.15 1 77 A LYS 78 2 93.25 1 78 A VAL 79 2 96.26 1 79 A ALA 80 2 97.39 1 80 A GLU 81 2 93.03 1 81 A PHE 82 2 96.85 1 82 A THR 83 2 95.29 1 83 A VAL 84 2 94.99 1 84 A ASP 85 2 91.72 1 85 A ASN 86 2 96.55 1 86 A PRO 87 2 96.08 1 87 A ALA 88 2 96.14 1 88 A LEU 89 2 93.83 1 89 A ASP 90 2 93.41 1 90 A GLU 91 2 88.71 1 91 A PHE 92 2 92.92 1 92 A VAL 93 2 92.43 1 93 A ALA 94 2 92.57 1 94 A ALA 95 2 90.91 1 95 A VAL 96 2 83.96 1 96 A ALA 97 2 71.77 1 97 # _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 THR . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n VAL . 4 A 4 A 5 1 n THR . 5 A 5 A 6 1 n VAL . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n THR . 9 A 9 A 10 1 n SER . 10 A 10 A 11 1 n ASP . 11 A 11 A 12 1 n LYS . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n THR . 14 A 14 A 15 1 n LEU . 15 A 15 A 16 1 n ILE . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n LEU . 18 A 18 A 19 1 n LEU . 19 A 19 A 20 1 n GLY . 20 A 20 A 21 1 n ASP . 21 A 21 A 22 1 n ALA . 22 A 22 A 23 1 n VAL . 23 A 23 A 24 1 n GLU . 24 A 24 A 25 1 n ASP . 25 A 25 A 26 1 n THR . 26 A 26 A 27 1 n PRO . 27 A 27 A 28 1 n SER . 28 A 28 A 29 1 n LEU . 29 A 29 A 30 1 n ALA . 30 A 30 A 31 1 n LEU . 31 A 31 A 32 1 n ASP . 32 A 32 A 33 1 n ILE . 33 A 33 A 34 1 n LYS . 34 A 34 A 35 1 n PRO . 35 A 35 A 36 1 n GLY . 36 A 36 A 37 1 n SER . 37 A 37 A 38 1 n ASP . 38 A 38 A 39 1 n LEU . 39 A 39 A 40 1 n SER . 40 A 40 A 41 1 n ALA . 41 A 41 A 42 1 n ALA . 42 A 42 A 43 1 n ILE . 43 A 43 A 44 1 n ALA . 44 A 44 A 45 1 n GLU . 45 A 45 A 46 1 n LEU . 46 A 46 A 47 1 n GLU . 47 A 47 A 48 1 n THR . 48 A 48 A 49 1 n GLN . 49 A 49 A 50 1 n LEU . 50 A 50 A 51 1 n LYS . 51 A 51 A 52 1 n LYS . 52 A 52 A 53 1 n PRO . 53 A 53 A 54 1 n THR . 54 A 54 A 55 1 n ALA . 55 A 55 A 56 1 n PRO . 56 A 56 A 57 1 n ILE . 57 A 57 A 58 1 n MET . 58 A 58 A 59 1 n PHE . 59 A 59 A 60 1 n ILE . 60 A 60 A 61 1 n VAL . 61 A 61 A 62 1 n ASN . 62 A 62 A 63 1 n GLY . 63 A 63 A 64 1 n GLY . 64 A 64 A 65 1 n GLY . 65 A 65 A 66 1 n TYR . 66 A 66 A 67 1 n SER . 67 A 67 A 68 1 n PRO . 68 A 68 A 69 1 n GLU . 69 A 69 A 70 1 n ALA . 70 A 70 A 71 1 n ALA . 71 A 71 A 72 1 n ALA . 72 A 72 A 73 1 n GLN . 73 A 73 A 74 1 n TYR . 74 A 74 A 75 1 n SER . 75 A 75 A 76 1 n PRO . 76 A 76 A 77 1 n GLU . 77 A 77 A 78 1 n LYS . 78 A 78 A 79 1 n VAL . 79 A 79 A 80 1 n ALA . 80 A 80 A 81 1 n GLU . 81 A 81 A 82 1 n PHE . 82 A 82 A 83 1 n THR . 83 A 83 A 84 1 n VAL . 84 A 84 A 85 1 n ASP . 85 A 85 A 86 1 n ASN . 86 A 86 A 87 1 n PRO . 87 A 87 A 88 1 n ALA . 88 A 88 A 89 1 n LEU . 89 A 89 A 90 1 n ASP . 90 A 90 A 91 1 n GLU . 91 A 91 A 92 1 n PHE . 92 A 92 A 93 1 n VAL . 93 A 93 A 94 1 n ALA . 94 A 94 A 95 1 n ALA . 95 A 95 A 96 1 n VAL . 96 A 96 A 97 1 n ALA . 97 A 97 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (fa08f1a239cfd4fd49a5c37bef32bd41139da97e359ba389d3209450484ef018)" # _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 ? -1.194 -10.173 10.747 1.00 92.14 1 A 1 ATOM 2 C CA . MET A 1 1 ? -2.044 -9.206 10.011 1.00 94.75 1 A 1 ATOM 3 C C . MET A 1 1 ? -1.259 -7.925 9.809 1.00 95.69 1 A 1 ATOM 4 O O . MET A 1 1 ? -0.872 -7.299 10.792 1.00 93.00 1 A 1 ATOM 5 C CB . MET A 1 1 ? -3.366 -8.889 10.731 1.00 89.35 1 A 1 ATOM 6 C CG . MET A 1 1 ? -4.339 -10.064 10.741 1.00 78.73 1 A 1 ATOM 7 S SD . MET A 1 1 ? -5.967 -9.642 11.444 1.00 75.28 1 A 1 ATOM 8 C CE . MET A 1 1 ? -6.803 -9.017 9.976 1.00 66.05 1 A 1 ATOM 9 N N . THR A 1 2 ? -1.044 -7.536 8.568 1.00 95.44 2 A 1 ATOM 10 C CA . THR A 1 2 ? -0.258 -6.357 8.194 1.00 96.43 2 A 1 ATOM 11 C C . THR A 1 2 ? -1.173 -5.150 7.999 1.00 97.18 2 A 1 ATOM 12 O O . THR A 1 2 ? -2.140 -5.211 7.236 1.00 96.82 2 A 1 ATOM 13 C CB . THR A 1 2 ? 0.560 -6.646 6.930 1.00 95.60 2 A 1 ATOM 14 O OG1 . THR A 1 2 ? 1.517 -7.628 7.210 1.00 91.78 2 A 1 ATOM 15 C CG2 . THR A 1 2 ? 1.335 -5.422 6.444 1.00 91.75 2 A 1 ATOM 16 N N . LYS A 1 3 ? -0.866 -4.047 8.679 1.00 97.07 3 A 1 ATOM 17 C CA . LYS A 1 3 ? -1.508 -2.748 8.435 1.00 97.40 3 A 1 ATOM 18 C C . LYS A 1 3 ? -1.065 -2.206 7.076 1.00 97.61 3 A 1 ATOM 19 O O . LYS A 1 3 ? 0.117 -2.244 6.756 1.00 97.31 3 A 1 ATOM 20 C CB . LYS A 1 3 ? -1.155 -1.781 9.576 1.00 96.81 3 A 1 ATOM 21 C CG . LYS A 1 3 ? -1.797 -0.398 9.394 1.00 94.89 3 A 1 ATOM 22 C CD . LYS A 1 3 ? -1.361 0.558 10.508 1.00 92.80 3 A 1 ATOM 23 C CE . LYS A 1 3 ? -1.950 1.942 10.249 1.00 87.91 3 A 1 ATOM 24 N NZ . LYS A 1 3 ? -1.502 2.923 11.257 1.00 82.18 3 A 1 ATOM 25 N N . VAL A 1 4 ? -2.005 -1.667 6.306 1.00 97.22 4 A 1 ATOM 26 C CA . VAL A 1 4 ? -1.737 -0.991 5.031 1.00 97.64 4 A 1 ATOM 27 C C . VAL A 1 4 ? -2.302 0.420 5.092 1.00 97.79 4 A 1 ATOM 28 O O . VAL A 1 4 ? -3.494 0.606 5.320 1.00 97.60 4 A 1 ATOM 29 C CB . VAL A 1 4 ? -2.318 -1.772 3.842 1.00 97.47 4 A 1 ATOM 30 C CG1 . VAL A 1 4 ? -1.972 -1.092 2.511 1.00 96.14 4 A 1 ATOM 31 C CG2 . VAL A 1 4 ? -1.771 -3.206 3.803 1.00 96.07 4 A 1 ATOM 32 N N . THR A 1 5 ? -1.437 1.404 4.861 1.00 97.45 5 A 1 ATOM 33 C CA . THR A 1 5 ? -1.833 2.806 4.675 1.00 97.58 5 A 1 ATOM 34 C C . THR A 1 5 ? -1.744 3.140 3.193 1.00 97.63 5 A 1 ATOM 35 O O . THR A 1 5 ? -0.748 2.837 2.549 1.00 97.37 5 A 1 ATOM 36 C CB . THR A 1 5 ? -0.947 3.741 5.513 1.00 97.48 5 A 1 ATOM 37 O OG1 . THR A 1 5 ? -1.071 3.426 6.880 1.00 94.71 5 A 1 ATOM 38 C CG2 . THR A 1 5 ? -1.341 5.213 5.365 1.00 94.48 5 A 1 ATOM 39 N N . VAL A 1 6 ? -2.778 3.758 2.635 1.00 97.17 6 A 1 ATOM 40 C CA . VAL A 1 6 ? -2.814 4.166 1.228 1.00 97.39 6 A 1 ATOM 41 C C . VAL A 1 6 ? -2.837 5.684 1.152 1.00 97.36 6 A 1 ATOM 42 O O . VAL A 1 6 ? -3.717 6.331 1.722 1.00 97.05 6 A 1 ATOM 43 C CB . VAL A 1 6 ? -4.003 3.546 0.476 1.00 97.11 6 A 1 ATOM 44 C CG1 . VAL A 1 6 ? -3.918 3.853 -1.025 1.00 95.37 6 A 1 ATOM 45 C CG2 . VAL A 1 6 ? -4.041 2.021 0.638 1.00 95.49 6 A 1 ATOM 46 N N . LEU A 1 7 ? -1.868 6.234 0.431 1.00 97.19 7 A 1 ATOM 47 C CA . LEU A 1 7 ? -1.775 7.655 0.121 1.00 96.89 7 A 1 ATOM 48 C C . LEU A 1 7 ? -2.103 7.885 -1.357 1.00 96.70 7 A 1 ATOM 49 O O . LEU A 1 7 ? -1.823 7.038 -2.198 1.00 96.55 7 A 1 ATOM 50 C CB . LEU A 1 7 ? -0.375 8.191 0.468 1.00 96.86 7 A 1 ATOM 51 C CG . LEU A 1 7 ? 0.185 7.821 1.855 1.00 95.68 7 A 1 ATOM 52 C CD1 . LEU A 1 7 ? 1.583 8.423 2.009 1.00 93.24 7 A 1 ATOM 53 C CD2 . LEU A 1 7 ? -0.690 8.343 2.992 1.00 93.54 7 A 1 ATOM 54 N N . LEU A 1 8 ? -2.667 9.048 -1.666 1.00 96.53 8 A 1 ATOM 55 C CA . LEU A 1 8 ? -2.915 9.517 -3.028 1.00 96.12 8 A 1 ATOM 56 C C . LEU A 1 8 ? -2.149 10.822 -3.245 1.00 95.91 8 A 1 ATOM 57 O O . LEU A 1 8 ? -2.249 11.733 -2.427 1.00 95.28 8 A 1 ATOM 58 C CB . LEU A 1 8 ? -4.429 9.703 -3.219 1.00 95.19 8 A 1 ATOM 59 C CG . LEU A 1 8 ? -4.844 10.225 -4.606 1.00 93.61 8 A 1 ATOM 60 C CD1 . LEU A 1 8 ? -4.562 9.220 -5.719 1.00 91.46 8 A 1 ATOM 61 C CD2 . LEU A 1 8 ? -6.344 10.531 -4.607 1.00 91.11 8 A 1 ATOM 62 N N . THR A 1 9 ? -1.411 10.925 -4.350 1.00 94.99 9 A 1 ATOM 63 C CA . THR A 1 9 ? -0.752 12.176 -4.739 1.00 94.33 9 A 1 ATOM 64 C C . THR A 1 9 ? -1.776 13.256 -5.102 1.00 93.84 9 A 1 ATOM 65 O O . THR A 1 9 ? -2.888 12.970 -5.552 1.00 92.93 9 A 1 ATOM 66 C CB . THR A 1 9 ? 0.240 11.958 -5.889 1.00 93.42 9 A 1 ATOM 67 O OG1 . THR A 1 9 ? -0.398 11.322 -6.971 1.00 90.74 9 A 1 ATOM 68 C CG2 . THR A 1 9 ? 1.414 11.080 -5.461 1.00 89.98 9 A 1 ATOM 69 N N . SER A 1 10 ? -1.404 14.523 -4.917 1.00 92.82 10 A 1 ATOM 70 C CA . SER A 1 10 ? -2.303 15.667 -5.153 1.00 92.11 10 A 1 ATOM 71 C C . SER A 1 10 ? -2.783 15.788 -6.606 1.00 91.84 10 A 1 ATOM 72 O O . SER A 1 10 ? -3.893 16.268 -6.857 1.00 90.08 10 A 1 ATOM 73 C CB . SER A 1 10 ? -1.603 16.960 -4.730 1.00 91.54 10 A 1 ATOM 74 O OG . SER A 1 10 ? -0.402 17.158 -5.457 1.00 84.47 10 A 1 ATOM 75 N N . ASP A 1 11 ? -1.975 15.308 -7.562 1.00 92.29 11 A 1 ATOM 76 C CA . ASP A 1 11 ? -2.329 15.231 -8.988 1.00 91.56 11 A 1 ATOM 77 C C . ASP A 1 11 ? -3.259 14.049 -9.329 1.00 92.17 11 A 1 ATOM 78 O O . ASP A 1 11 ? -3.771 13.962 -10.446 1.00 90.09 11 A 1 ATOM 79 C CB . ASP A 1 11 ? -1.038 15.198 -9.824 1.00 89.32 11 A 1 ATOM 80 C CG . ASP A 1 11 ? -0.157 13.964 -9.593 1.00 85.40 11 A 1 ATOM 81 O OD1 . ASP A 1 11 ? -0.518 13.109 -8.754 1.00 81.07 11 A 1 ATOM 82 O OD2 . ASP A 1 11 ? 0.896 13.880 -10.255 1.00 81.92 11 A 1 ATOM 83 N N . LYS A 1 12 ? -3.517 13.164 -8.351 1.00 91.85 12 A 1 ATOM 84 C CA . LYS A 1 12 ? -4.407 11.998 -8.452 1.00 91.48 12 A 1 ATOM 85 C C . LYS A 1 12 ? -3.989 10.992 -9.528 1.00 92.10 12 A 1 ATOM 86 O O . LYS A 1 12 ? -4.851 10.362 -10.143 1.00 90.09 12 A 1 ATOM 87 C CB . LYS A 1 12 ? -5.871 12.437 -8.596 1.00 89.40 12 A 1 ATOM 88 C CG . LYS A 1 12 ? -6.306 13.420 -7.506 1.00 86.97 12 A 1 ATOM 89 C CD . LYS A 1 12 ? -7.775 13.787 -7.692 1.00 81.15 12 A 1 ATOM 90 C CE . LYS A 1 12 ? -8.149 14.763 -6.580 1.00 77.36 12 A 1 ATOM 91 N NZ . LYS A 1 12 ? -9.572 15.156 -6.659 1.00 67.93 12 A 1 ATOM 92 N N . VAL A 1 13 ? -2.675 10.844 -9.749 1.00 92.39 13 A 1 ATOM 93 C CA . VAL A 1 13 ? -2.146 9.874 -10.719 1.00 92.60 13 A 1 ATOM 94 C C . VAL A 1 13 ? -1.410 8.710 -10.066 1.00 93.34 13 A 1 ATOM 95 O O . VAL A 1 13 ? -1.190 7.705 -10.730 1.00 91.66 13 A 1 ATOM 96 C CB . VAL A 1 13 ? -1.269 10.525 -11.804 1.00 90.53 13 A 1 ATOM 97 C CG1 . VAL A 1 13 ? -2.053 11.604 -12.565 1.00 84.54 13 A 1 ATOM 98 C CG2 . VAL A 1 13 ? 0.031 11.113 -11.268 1.00 84.43 13 A 1 ATOM 99 N N . THR A 1 14 ? -1.054 8.803 -8.785 1.00 94.38 14 A 1 ATOM 100 C CA . THR A 1 14 ? -0.304 7.744 -8.102 1.00 94.58 14 A 1 ATOM 101 C C . THR A 1 14 ? -0.903 7.426 -6.737 1.00 95.11 14 A 1 ATOM 102 O O . THR A 1 14 ? -1.080 8.308 -5.896 1.00 94.51 14 A 1 ATOM 103 C CB . THR A 1 14 ? 1.179 8.113 -7.977 1.00 93.37 14 A 1 ATOM 104 O OG1 . THR A 1 14 ? 1.706 8.465 -9.238 1.00 89.84 14 A 1 ATOM 105 C CG2 . THR A 1 14 ? 2.037 6.965 -7.457 1.00 89.48 14 A 1 ATOM 106 N N . LEU A 1 15 ? -1.176 6.139 -6.504 1.00 95.12 15 A 1 ATOM 107 C CA . LEU A 1 15 ? -1.405 5.578 -5.178 1.00 95.38 15 A 1 ATOM 108 C C . LEU A 1 15 ? -0.076 5.092 -4.602 1.00 95.51 15 A 1 ATOM 109 O O . LEU A 1 15 ? 0.689 4.422 -5.289 1.00 94.71 15 A 1 ATOM 110 C CB . LEU A 1 15 ? -2.410 4.416 -5.246 1.00 94.41 15 A 1 ATOM 111 C CG . LEU A 1 15 ? -3.863 4.847 -5.489 1.00 90.84 15 A 1 ATOM 112 C CD1 . LEU A 1 15 ? -4.731 3.610 -5.724 1.00 88.10 15 A 1 ATOM 113 C CD2 . LEU A 1 15 ? -4.436 5.604 -4.296 1.00 87.91 15 A 1 ATOM 114 N N . ILE A 1 16 ? 0.167 5.366 -3.336 1.00 96.29 16 A 1 ATOM 115 C CA . ILE A 1 16 ? 1.311 4.839 -2.592 1.00 96.27 16 A 1 ATOM 116 C C . ILE A 1 16 ? 0.763 3.927 -1.495 1.00 96.82 16 A 1 ATOM 117 O O . ILE A 1 16 ? 0.100 4.393 -0.571 1.00 96.81 16 A 1 ATOM 118 C CB . ILE A 1 16 ? 2.194 5.978 -2.035 1.00 95.62 16 A 1 ATOM 119 C CG1 . ILE A 1 16 ? 2.613 6.982 -3.133 1.00 94.42 16 A 1 ATOM 120 C CG2 . ILE A 1 16 ? 3.433 5.364 -1.352 1.00 94.27 16 A 1 ATOM 121 C CD1 . ILE A 1 16 ? 3.313 8.237 -2.588 1.00 91.02 16 A 1 ATOM 122 N N . ALA A 1 17 ? 1.015 2.626 -1.616 1.00 96.53 17 A 1 ATOM 123 C CA . ALA A 1 17 ? 0.680 1.652 -0.587 1.00 96.86 17 A 1 ATOM 124 C C . ALA A 1 17 ? 1.873 1.468 0.355 1.00 96.90 17 A 1 ATOM 125 O O . ALA A 1 17 ? 2.972 1.162 -0.101 1.00 96.45 17 A 1 ATOM 126 C CB . ALA A 1 17 ? 0.269 0.333 -1.255 1.00 96.73 17 A 1 ATOM 127 N N . LEU A 1 18 ? 1.655 1.624 1.646 1.00 96.85 18 A 1 ATOM 128 C CA . LEU A 1 18 ? 2.644 1.464 2.707 1.00 97.01 18 A 1 ATOM 129 C C . LEU A 1 18 ? 2.276 0.262 3.578 1.00 97.10 18 A 1 ATOM 130 O O . LEU A 1 18 ? 1.124 0.140 3.998 1.00 96.83 18 A 1 ATOM 131 C CB . LEU A 1 18 ? 2.701 2.737 3.569 1.00 96.60 18 A 1 ATOM 132 C CG . LEU A 1 18 ? 2.908 4.056 2.806 1.00 94.82 18 A 1 ATOM 133 C CD1 . LEU A 1 18 ? 2.904 5.219 3.793 1.00 91.02 18 A 1 ATOM 134 C CD2 . LEU A 1 18 ? 4.233 4.079 2.052 1.00 91.37 18 A 1 ATOM 135 N N . LEU A 1 19 ? 3.251 -0.591 3.892 1.00 96.60 19 A 1 ATOM 136 C CA . LEU A 1 19 ? 3.079 -1.708 4.825 1.00 96.47 19 A 1 ATOM 137 C C . LEU A 1 19 ? 3.316 -1.254 6.274 1.00 96.06 19 A 1 ATOM 138 O O . LEU A 1 19 ? 4.219 -1.735 6.955 1.00 94.90 19 A 1 ATOM 139 C CB . LEU A 1 19 ? 3.972 -2.897 4.414 1.00 96.21 19 A 1 ATOM 140 C CG . LEU A 1 19 ? 3.742 -3.427 2.990 1.00 95.73 19 A 1 ATOM 141 C CD1 . LEU A 1 19 ? 4.627 -4.655 2.760 1.00 94.40 19 A 1 ATOM 142 C CD2 . LEU A 1 19 ? 2.288 -3.829 2.735 1.00 94.77 19 A 1 ATOM 143 N N . GLY A 1 20 ? 2.528 -0.293 6.729 1.00 96.06 20 A 1 ATOM 144 C CA . GLY A 1 20 ? 2.657 0.323 8.049 1.00 95.90 20 A 1 ATOM 145 C C . GLY A 1 20 ? 2.245 1.793 8.054 1.00 96.55 20 A 1 ATOM 146 O O . GLY A 1 20 ? 1.418 2.235 7.244 1.00 95.65 20 A 1 ATOM 147 N N . ASP A 1 21 ? 2.800 2.542 8.991 1.00 95.14 21 A 1 ATOM 148 C CA . ASP A 1 21 ? 2.630 3.990 9.070 1.00 95.19 21 A 1 ATOM 149 C C . ASP A 1 21 ? 3.530 4.718 8.061 1.00 95.59 21 A 1 ATOM 150 O O . ASP A 1 21 ? 4.534 4.186 7.602 1.00 94.71 21 A 1 ATOM 151 C CB . ASP A 1 21 ? 2.875 4.473 10.507 1.00 94.25 21 A 1 ATOM 152 C CG . ASP A 1 21 ? 1.751 4.021 11.443 1.00 92.09 21 A 1 ATOM 153 O OD1 . ASP A 1 21 ? 0.568 4.279 11.101 1.00 88.03 21 A 1 ATOM 154 O OD2 . ASP A 1 21 ? 2.018 3.388 12.480 1.00 86.97 21 A 1 ATOM 155 N N . ALA A 1 22 ? 3.176 5.949 7.720 1.00 94.96 22 A 1 ATOM 156 C CA . ALA A 1 22 ? 3.928 6.789 6.789 1.00 94.92 22 A 1 ATOM 157 C C . ALA A 1 22 ? 5.185 7.400 7.451 1.00 95.29 22 A 1 ATOM 158 O O . ALA A 1 22 ? 5.271 8.611 7.658 1.00 94.02 22 A 1 ATOM 159 C CB . ALA A 1 22 ? 2.971 7.837 6.200 1.00 94.26 22 A 1 ATOM 160 N N . VAL A 1 23 ? 6.142 6.534 7.804 1.00 94.67 23 A 1 ATOM 161 C CA . VAL A 1 23 ? 7.443 6.895 8.386 1.00 94.93 23 A 1 ATOM 162 C C . VAL A 1 23 ? 8.579 6.490 7.444 1.00 95.18 23 A 1 ATOM 163 O O . VAL A 1 23 ? 8.357 5.725 6.501 1.00 94.58 23 A 1 ATOM 164 C CB . VAL A 1 23 ? 7.628 6.298 9.796 1.00 93.85 23 A 1 ATOM 165 C CG1 . VAL A 1 23 ? 6.536 6.810 10.746 1.00 88.49 23 A 1 ATOM 166 C CG2 . VAL A 1 23 ? 7.625 4.767 9.821 1.00 88.46 23 A 1 ATOM 167 N N . GLU A 1 24 ? 9.774 7.023 7.676 1.00 94.88 24 A 1 ATOM 168 C CA . GLU A 1 24 ? 10.961 6.733 6.861 1.00 95.02 24 A 1 ATOM 169 C C . GLU A 1 24 ? 11.209 5.222 6.753 1.00 94.74 24 A 1 ATOM 170 O O . GLU A 1 24 ? 11.003 4.482 7.710 1.00 93.74 24 A 1 ATOM 171 C CB . GLU A 1 24 ? 12.185 7.463 7.445 1.00 94.44 24 A 1 ATOM 172 C CG . GLU A 1 24 ? 13.367 7.587 6.463 1.00 88.89 24 A 1 ATOM 173 C CD . GLU A 1 24 ? 13.084 8.520 5.265 1.00 86.04 24 A 1 ATOM 174 O OE1 . GLU A 1 24 ? 13.706 8.362 4.193 1.00 77.74 24 A 1 ATOM 175 O OE2 . GLU A 1 24 ? 12.213 9.416 5.387 1.00 78.23 24 A 1 ATOM 176 N N . ASP A 1 25 ? 11.612 4.781 5.564 1.00 94.78 25 A 1 ATOM 177 C CA . ASP A 1 25 ? 11.932 3.393 5.202 1.00 94.23 25 A 1 ATOM 178 C C . ASP A 1 25 ? 10.780 2.377 5.312 1.00 95.18 25 A 1 ATOM 179 O O . ASP A 1 25 ? 10.984 1.183 5.073 1.00 94.01 25 A 1 ATOM 180 C CB . ASP A 1 25 ? 13.218 2.930 5.905 1.00 91.99 25 A 1 ATOM 181 C CG . ASP A 1 25 ? 14.447 3.753 5.496 1.00 85.84 25 A 1 ATOM 182 O OD1 . ASP A 1 25 ? 14.546 4.085 4.289 1.00 81.36 25 A 1 ATOM 183 O OD2 . ASP A 1 25 ? 15.307 3.987 6.373 1.00 80.34 25 A 1 ATOM 184 N N . THR A 1 26 ? 9.548 2.806 5.575 1.00 94.15 26 A 1 ATOM 185 C CA . THR A 1 26 ? 8.393 1.891 5.507 1.00 95.08 26 A 1 ATOM 186 C C . THR A 1 26 ? 8.311 1.280 4.107 1.00 95.34 26 A 1 ATOM 187 O O . THR A 1 26 ? 8.279 2.035 3.129 1.00 94.99 26 A 1 ATOM 188 C CB . THR A 1 26 ? 7.070 2.595 5.827 1.00 95.05 26 A 1 ATOM 189 O OG1 . THR A 1 26 ? 7.095 3.077 7.146 1.00 91.39 26 A 1 ATOM 190 C CG2 . THR A 1 26 ? 5.860 1.657 5.748 1.00 91.44 26 A 1 ATOM 191 N N . PRO A 1 27 ? 8.216 -0.064 3.963 1.00 95.41 27 A 1 ATOM 192 C CA . PRO A 1 27 ? 8.065 -0.690 2.653 1.00 95.71 27 A 1 ATOM 193 C C . PRO A 1 27 ? 6.870 -0.111 1.899 1.00 96.11 27 A 1 ATOM 194 O O . PRO A 1 27 ? 5.743 -0.107 2.399 1.00 95.81 27 A 1 ATOM 195 C CB . PRO A 1 27 ? 7.907 -2.192 2.908 1.00 95.10 27 A 1 ATOM 196 C CG . PRO A 1 27 ? 8.611 -2.387 4.247 1.00 93.89 27 A 1 ATOM 197 C CD . PRO A 1 27 ? 8.316 -1.086 4.990 1.00 94.86 27 A 1 ATOM 198 N N . SER A 1 28 ? 7.130 0.377 0.697 1.00 96.13 28 A 1 ATOM 199 C CA . SER A 1 28 ? 6.163 1.125 -0.100 1.00 96.21 28 A 1 ATOM 200 C C . SER A 1 28 ? 6.107 0.630 -1.537 1.00 95.91 28 A 1 ATOM 201 O O . SER A 1 28 ? 7.092 0.147 -2.089 1.00 94.94 28 A 1 ATOM 202 C CB . SER A 1 28 ? 6.466 2.626 -0.044 1.00 95.37 28 A 1 ATOM 203 O OG . SER A 1 28 ? 7.649 2.938 -0.745 1.00 91.07 28 A 1 ATOM 204 N N . LEU A 1 29 ? 4.938 0.766 -2.149 1.00 95.70 29 A 1 ATOM 205 C CA . LEU A 1 29 ? 4.698 0.459 -3.555 1.00 95.48 29 A 1 ATOM 206 C C . LEU A 1 29 ? 3.925 1.614 -4.192 1.00 95.75 29 A 1 ATOM 207 O O . LEU A 1 29 ? 2.815 1.931 -3.760 1.00 95.14 29 A 1 ATOM 208 C CB . LEU A 1 29 ? 3.930 -0.872 -3.636 1.00 94.39 29 A 1 ATOM 209 C CG . LEU A 1 29 ? 3.523 -1.289 -5.060 1.00 90.98 29 A 1 ATOM 210 C CD1 . LEU A 1 29 ? 4.736 -1.606 -5.930 1.00 88.65 29 A 1 ATOM 211 C CD2 . LEU A 1 29 ? 2.649 -2.541 -4.988 1.00 88.98 29 A 1 ATOM 212 N N . ALA A 1 30 ? 4.505 2.211 -5.234 1.00 95.03 30 A 1 ATOM 213 C CA . ALA A 1 30 ? 3.826 3.208 -6.051 1.00 94.29 30 A 1 ATOM 214 C C . ALA A 1 30 ? 3.037 2.525 -7.178 1.00 93.92 30 A 1 ATOM 215 O O . ALA A 1 30 ? 3.551 1.650 -7.876 1.00 92.38 30 A 1 ATOM 216 C CB . ALA A 1 30 ? 4.851 4.220 -6.574 1.00 92.90 30 A 1 ATOM 217 N N . LEU A 1 31 ? 1.786 2.916 -7.348 1.00 94.05 31 A 1 ATOM 218 C CA . LEU A 1 31 ? 0.863 2.388 -8.345 1.00 93.63 31 A 1 ATOM 219 C C . LEU A 1 31 ? 0.267 3.543 -9.145 1.00 94.06 31 A 1 ATOM 220 O O . LEU A 1 31 ? -0.495 4.345 -8.604 1.00 93.25 31 A 1 ATOM 221 C CB . LEU A 1 31 ? -0.248 1.587 -7.649 1.00 92.52 31 A 1 ATOM 222 C CG . LEU A 1 31 ? 0.224 0.344 -6.877 1.00 87.70 31 A 1 ATOM 223 C CD1 . LEU A 1 31 ? -0.941 -0.211 -6.062 1.00 83.42 31 A 1 ATOM 224 C CD2 . LEU A 1 31 ? 0.715 -0.752 -7.821 1.00 82.75 31 A 1 ATOM 225 N N . ASP A 1 32 ? 0.573 3.588 -10.441 1.00 93.16 32 A 1 ATOM 226 C CA . ASP A 1 32 ? -0.024 4.580 -11.326 1.00 93.04 32 A 1 ATOM 227 C C . ASP A 1 32 ? -1.511 4.300 -11.545 1.00 93.29 32 A 1 ATOM 228 O O . ASP A 1 32 ? -1.930 3.182 -11.864 1.00 91.61 32 A 1 ATOM 229 C CB . ASP A 1 32 ? 0.724 4.637 -12.662 1.00 91.01 32 A 1 ATOM 230 C CG . ASP A 1 32 ? 2.150 5.177 -12.530 1.00 84.30 32 A 1 ATOM 231 O OD1 . ASP A 1 32 ? 2.399 5.983 -11.605 1.00 78.08 32 A 1 ATOM 232 O OD2 . ASP A 1 32 ? 2.974 4.786 -13.385 1.00 77.53 32 A 1 ATOM 233 N N . ILE A 1 33 ? -2.318 5.342 -11.416 1.00 92.61 33 A 1 ATOM 234 C CA . ILE A 1 33 ? -3.741 5.324 -11.733 1.00 91.74 33 A 1 ATOM 235 C C . ILE A 1 33 ? -4.045 6.384 -12.789 1.00 90.60 33 A 1 ATOM 236 O O . ILE A 1 33 ? -3.435 7.449 -12.850 1.00 87.67 33 A 1 ATOM 237 C CB . ILE A 1 33 ? -4.626 5.457 -10.473 1.00 90.68 33 A 1 ATOM 238 C CG1 . ILE A 1 33 ? -4.401 6.780 -9.711 1.00 87.38 33 A 1 ATOM 239 C CG2 . ILE A 1 33 ? -4.417 4.237 -9.564 1.00 84.65 33 A 1 ATOM 240 C CD1 . ILE A 1 33 ? -5.454 7.055 -8.632 1.00 84.10 33 A 1 ATOM 241 N N . LYS A 1 34 ? -5.021 6.096 -13.647 1.00 89.58 34 A 1 ATOM 242 C CA . LYS A 1 34 ? -5.444 7.093 -14.632 1.00 87.65 34 A 1 ATOM 243 C C . LYS A 1 34 ? -6.205 8.223 -13.933 1.00 86.90 34 A 1 ATOM 244 O O . LYS A 1 34 ? -7.053 7.933 -13.086 1.00 83.83 34 A 1 ATOM 245 C CB . LYS A 1 34 ? -6.284 6.447 -15.737 1.00 84.32 34 A 1 ATOM 246 C CG . LYS A 1 34 ? -5.439 5.483 -16.579 1.00 76.20 34 A 1 ATOM 247 C CD . LYS A 1 34 ? -6.283 4.854 -17.689 1.00 70.47 34 A 1 ATOM 248 C CE . LYS A 1 34 ? -5.410 3.885 -18.485 1.00 63.51 34 A 1 ATOM 249 N NZ . LYS A 1 34 ? -6.187 3.191 -19.542 1.00 55.45 34 A 1 ATOM 250 N N . PRO A 1 35 ? -5.980 9.492 -14.305 1.00 84.82 35 A 1 ATOM 251 C CA . PRO A 1 35 ? -6.803 10.593 -13.820 1.00 83.68 35 A 1 ATOM 252 C C . PRO A 1 35 ? -8.295 10.311 -14.040 1.00 84.18 35 A 1 ATOM 253 O O . PRO A 1 35 ? -8.709 9.898 -15.123 1.00 79.62 35 A 1 ATOM 254 C CB . PRO A 1 35 ? -6.337 11.830 -14.595 1.00 81.31 35 A 1 ATOM 255 C CG . PRO A 1 35 ? -4.891 11.495 -14.959 1.00 78.58 35 A 1 ATOM 256 C CD . PRO A 1 35 ? -4.928 9.985 -15.180 1.00 80.67 35 A 1 ATOM 257 N N . GLY A 1 36 ? -9.099 10.505 -13.000 1.00 84.28 36 A 1 ATOM 258 C CA . GLY A 1 36 ? -10.539 10.223 -13.039 1.00 84.60 36 A 1 ATOM 259 C C . GLY A 1 36 ? -10.923 8.747 -12.898 1.00 86.49 36 A 1 ATOM 260 O O . GLY A 1 36 ? -12.106 8.432 -13.025 1.00 82.57 36 A 1 ATOM 261 N N . SER A 1 37 ? -9.970 7.846 -12.625 1.00 85.16 37 A 1 ATOM 262 C CA . SER A 1 37 ? -10.285 6.467 -12.246 1.00 85.04 37 A 1 ATOM 263 C C . SER A 1 37 ? -11.103 6.418 -10.957 1.00 87.16 37 A 1 ATOM 264 O O . SER A 1 37 ? -10.978 7.285 -10.091 1.00 85.38 37 A 1 ATOM 265 C CB . SER A 1 37 ? -9.019 5.624 -12.059 1.00 81.86 37 A 1 ATOM 266 O OG . SER A 1 37 ? -8.357 5.459 -13.296 1.00 74.61 37 A 1 ATOM 267 N N . ASP A 1 38 ? -11.897 5.363 -10.812 1.00 89.82 38 A 1 ATOM 268 C CA . ASP A 1 38 ? -12.587 5.066 -9.559 1.00 91.90 38 A 1 ATOM 269 C C . ASP A 1 38 ? -11.562 4.663 -8.489 1.00 93.03 38 A 1 ATOM 270 O O . ASP A 1 38 ? -10.998 3.565 -8.509 1.00 92.08 38 A 1 ATOM 271 C CB . ASP A 1 38 ? -13.657 3.990 -9.794 1.00 90.00 38 A 1 ATOM 272 C CG . ASP A 1 38 ? -14.522 3.724 -8.551 1.00 85.50 38 A 1 ATOM 273 O OD1 . ASP A 1 38 ? -14.053 3.976 -7.418 1.00 82.19 38 A 1 ATOM 274 O OD2 . ASP A 1 38 ? -15.662 3.248 -8.747 1.00 80.19 38 A 1 ATOM 275 N N . LEU A 1 39 ? -11.313 5.575 -7.557 1.00 93.10 39 A 1 ATOM 276 C CA . LEU A 1 39 ? -10.375 5.387 -6.456 1.00 93.79 39 A 1 ATOM 277 C C . LEU A 1 39 ? -10.783 4.213 -5.555 1.00 94.91 39 A 1 ATOM 278 O O . LEU A 1 39 ? -9.930 3.445 -5.126 1.00 94.86 39 A 1 ATOM 279 C CB . LEU A 1 39 ? -10.291 6.708 -5.668 1.00 92.52 39 A 1 ATOM 280 C CG . LEU A 1 39 ? -9.341 6.656 -4.460 1.00 87.71 39 A 1 ATOM 281 C CD1 . LEU A 1 39 ? -7.901 6.370 -4.882 1.00 85.55 39 A 1 ATOM 282 C CD2 . LEU A 1 39 ? -9.375 7.999 -3.727 1.00 85.43 39 A 1 ATOM 283 N N . SER A 1 40 ? -12.072 4.042 -5.297 1.00 93.79 40 A 1 ATOM 284 C CA . SER A 1 40 ? -12.576 2.948 -4.464 1.00 94.21 40 A 1 ATOM 285 C C . SER A 1 40 ? -12.319 1.593 -5.117 1.00 94.77 40 A 1 ATOM 286 O O . SER A 1 40 ? -11.883 0.662 -4.446 1.00 94.39 40 A 1 ATOM 287 C CB . SER A 1 40 ? -14.076 3.115 -4.203 1.00 93.06 40 A 1 ATOM 288 O OG . SER A 1 40 ? -14.323 4.340 -3.535 1.00 79.15 40 A 1 ATOM 289 N N . ALA A 1 41 ? -12.513 1.491 -6.432 1.00 94.51 41 A 1 ATOM 290 C CA . ALA A 1 41 ? -12.191 0.285 -7.190 1.00 94.12 41 A 1 ATOM 291 C C . ALA A 1 41 ? -10.681 -0.003 -7.193 1.00 94.33 41 A 1 ATOM 292 O O . ALA A 1 41 ? -10.280 -1.148 -6.991 1.00 93.73 41 A 1 ATOM 293 C CB . ALA A 1 41 ? -12.745 0.429 -8.613 1.00 93.25 41 A 1 ATOM 294 N N . ALA A 1 42 ? -9.840 1.022 -7.344 1.00 95.08 42 A 1 ATOM 295 C CA . ALA A 1 42 ? -8.385 0.866 -7.300 1.00 94.71 42 A 1 ATOM 296 C C . ALA A 1 42 ? -7.890 0.385 -5.922 1.00 95.34 42 A 1 ATOM 297 O O . ALA A 1 42 ? -7.045 -0.506 -5.845 1.00 94.96 42 A 1 ATOM 298 C CB . ALA A 1 42 ? -7.739 2.200 -7.703 1.00 93.94 42 A 1 ATOM 299 N N . ILE A 1 43 ? -8.451 0.909 -4.836 1.00 95.79 43 A 1 ATOM 300 C CA . ILE A 1 43 ? -8.136 0.471 -3.468 1.00 96.08 43 A 1 ATOM 301 C C . ILE A 1 43 ? -8.616 -0.967 -3.227 1.00 96.19 43 A 1 ATOM 302 O O . ILE A 1 43 ? -7.879 -1.767 -2.656 1.00 96.26 43 A 1 ATOM 303 C CB . ILE A 1 43 ? -8.728 1.464 -2.440 1.00 96.01 43 A 1 ATOM 304 C CG1 . ILE A 1 43 ? -7.989 2.823 -2.530 1.00 95.18 43 A 1 ATOM 305 C CG2 . ILE A 1 43 ? -8.632 0.911 -1.005 1.00 95.27 43 A 1 ATOM 306 C CD1 . ILE A 1 43 ? -8.698 3.963 -1.791 1.00 91.59 43 A 1 ATOM 307 N N . ALA A 1 44 ? -9.804 -1.330 -3.694 1.00 96.02 44 A 1 ATOM 308 C CA . ALA A 1 44 ? -10.331 -2.691 -3.556 1.00 95.75 44 A 1 ATOM 309 C C . ALA A 1 44 ? -9.488 -3.723 -4.333 1.00 95.57 44 A 1 ATOM 310 O O . ALA A 1 44 ? -9.239 -4.831 -3.843 1.00 95.16 44 A 1 ATOM 311 C CB . ALA A 1 44 ? -11.790 -2.694 -4.028 1.00 95.58 44 A 1 ATOM 312 N N . GLU A 1 45 ? -9.008 -3.363 -5.522 1.00 96.07 45 A 1 ATOM 313 C CA . GLU A 1 45 ? -8.078 -4.198 -6.288 1.00 95.15 45 A 1 ATOM 314 C C . GLU A 1 45 ? -6.740 -4.344 -5.558 1.00 95.40 45 A 1 ATOM 315 O O . GLU A 1 45 ? -6.260 -5.467 -5.394 1.00 94.92 45 A 1 ATOM 316 C CB . GLU A 1 45 ? -7.903 -3.627 -7.705 1.00 94.05 45 A 1 ATOM 317 C CG . GLU A 1 45 ? -6.966 -4.463 -8.603 1.00 82.02 45 A 1 ATOM 318 C CD . GLU A 1 45 ? -7.390 -5.935 -8.782 1.00 75.81 45 A 1 ATOM 319 O OE1 . GLU A 1 45 ? -6.487 -6.781 -9.004 1.00 68.24 45 A 1 ATOM 320 O OE2 . GLU A 1 45 ? -8.602 -6.232 -8.704 1.00 68.35 45 A 1 ATOM 321 N N . LEU A 1 46 ? -6.171 -3.260 -5.033 1.00 95.75 46 A 1 ATOM 322 C CA . LEU A 1 46 ? -4.959 -3.301 -4.213 1.00 95.96 46 A 1 ATOM 323 C C . LEU A 1 46 ? -5.132 -4.244 -3.017 1.00 96.49 46 A 1 ATOM 324 O O . LEU A 1 46 ? -4.310 -5.138 -2.821 1.00 96.63 46 A 1 ATOM 325 C CB . LEU A 1 46 ? -4.599 -1.872 -3.767 1.00 95.82 46 A 1 ATOM 326 C CG . LEU A 1 46 ? -3.446 -1.797 -2.748 1.00 94.77 46 A 1 ATOM 327 C CD1 . LEU A 1 46 ? -2.127 -2.301 -3.327 1.00 93.69 46 A 1 ATOM 328 C CD2 . LEU A 1 46 ? -3.273 -0.351 -2.286 1.00 93.53 46 A 1 ATOM 329 N N . GLU A 1 47 ? -6.214 -4.126 -2.262 1.00 96.85 47 A 1 ATOM 330 C CA . GLU A 1 47 ? -6.502 -5.008 -1.127 1.00 97.03 47 A 1 ATOM 331 C C . GLU A 1 47 ? -6.567 -6.481 -1.560 1.00 97.07 47 A 1 ATOM 332 O O . GLU A 1 47 ? -6.023 -7.367 -0.897 1.00 96.78 47 A 1 ATOM 333 C CB . GLU A 1 47 ? -7.823 -4.582 -0.462 1.00 96.82 47 A 1 ATOM 334 C CG . GLU A 1 47 ? -7.999 -5.273 0.903 1.00 88.88 47 A 1 ATOM 335 C CD . GLU A 1 47 ? -9.398 -5.092 1.512 1.00 86.39 47 A 1 ATOM 336 O OE1 . GLU A 1 47 ? -9.829 -6.053 2.204 1.00 79.49 47 A 1 ATOM 337 O OE2 . GLU A 1 47 ? -10.059 -4.068 1.250 1.00 80.23 47 A 1 ATOM 338 N N . THR A 1 48 ? -7.186 -6.750 -2.715 1.00 97.12 48 A 1 ATOM 339 C CA . THR A 1 48 ? -7.270 -8.100 -3.292 1.00 96.94 48 A 1 ATOM 340 C C . THR A 1 48 ? -5.889 -8.637 -3.677 1.00 96.90 48 A 1 ATOM 341 O O . THR A 1 48 ? -5.591 -9.806 -3.426 1.00 96.40 48 A 1 ATOM 342 C CB . THR A 1 48 ? -8.201 -8.105 -4.514 1.00 96.48 48 A 1 ATOM 343 O OG1 . THR A 1 48 ? -9.492 -7.716 -4.105 1.00 92.37 48 A 1 ATOM 344 C CG2 . THR A 1 48 ? -8.336 -9.494 -5.147 1.00 90.55 48 A 1 ATOM 345 N N . GLN A 1 49 ? -5.020 -7.814 -4.261 1.00 96.72 49 A 1 ATOM 346 C CA . GLN A 1 49 ? -3.649 -8.204 -4.608 1.00 96.20 49 A 1 ATOM 347 C C . GLN A 1 49 ? -2.805 -8.483 -3.360 1.00 96.84 49 A 1 ATOM 348 O O . GLN A 1 49 ? -2.092 -9.489 -3.324 1.00 96.52 49 A 1 ATOM 349 C CB . GLN A 1 49 ? -2.986 -7.130 -5.484 1.00 95.43 49 A 1 ATOM 350 C CG . GLN A 1 49 ? -3.639 -6.956 -6.865 1.00 89.68 49 A 1 ATOM 351 C CD . GLN A 1 49 ? -3.616 -8.192 -7.753 1.00 82.73 49 A 1 ATOM 352 O OE1 . GLN A 1 49 ? -2.760 -9.063 -7.689 1.00 75.18 49 A 1 ATOM 353 N NE2 . GLN A 1 49 ? -4.580 -8.327 -8.635 1.00 70.46 49 A 1 ATOM 354 N N . LEU A 1 50 ? -2.942 -7.674 -2.315 1.00 96.46 50 A 1 ATOM 355 C CA . LEU A 1 50 ? -2.197 -7.833 -1.063 1.00 97.04 50 A 1 ATOM 356 C C . LEU A 1 50 ? -2.596 -9.089 -0.274 1.00 97.47 50 A 1 ATOM 357 O O . LEU A 1 50 ? -1.804 -9.580 0.529 1.00 97.37 50 A 1 ATOM 358 C CB . LEU A 1 50 ? -2.358 -6.567 -0.210 1.00 97.03 50 A 1 ATOM 359 C CG . LEU A 1 50 ? -1.700 -5.302 -0.790 1.00 96.21 50 A 1 ATOM 360 C CD1 . LEU A 1 50 ? -1.959 -4.130 0.150 1.00 94.62 50 A 1 ATOM 361 C CD2 . LEU A 1 50 ? -0.192 -5.446 -0.971 1.00 94.45 50 A 1 ATOM 362 N N . LYS A 1 51 ? -3.764 -9.674 -0.539 1.00 97.27 51 A 1 ATOM 363 C CA . LYS A 1 51 ? -4.171 -10.968 0.039 1.00 97.56 51 A 1 ATOM 364 C C . LYS A 1 51 ? -3.485 -12.169 -0.620 1.00 97.85 51 A 1 ATOM 365 O O . LYS A 1 51 ? -3.525 -13.271 -0.072 1.00 97.50 51 A 1 ATOM 366 C CB . LYS A 1 51 ? -5.703 -11.102 -0.025 1.00 97.30 51 A 1 ATOM 367 C CG . LYS A 1 51 ? -6.381 -10.190 1.009 1.00 95.73 51 A 1 ATOM 368 C CD . LYS A 1 51 ? -7.899 -10.115 0.809 1.00 93.12 51 A 1 ATOM 369 C CE . LYS A 1 51 ? -8.442 -9.070 1.792 1.00 88.40 51 A 1 ATOM 370 N NZ . LYS A 1 51 ? -9.851 -8.680 1.529 1.00 80.86 51 A 1 ATOM 371 N N . LYS A 1 52 ? -2.866 -12.004 -1.792 1.00 97.37 52 A 1 ATOM 372 C CA . LYS A 1 52 ? -2.210 -13.102 -2.506 1.00 97.45 52 A 1 ATOM 373 C C . LYS A 1 52 ? -0.867 -13.447 -1.851 1.00 97.60 52 A 1 ATOM 374 O O . LYS A 1 52 ? -0.130 -12.541 -1.475 1.00 97.42 52 A 1 ATOM 375 C CB . LYS A 1 52 ? -2.027 -12.761 -3.991 1.00 97.19 52 A 1 ATOM 376 C CG . LYS A 1 52 ? -3.374 -12.544 -4.698 1.00 95.75 52 A 1 ATOM 377 C CD . LYS A 1 52 ? -3.171 -12.146 -6.162 1.00 92.69 52 A 1 ATOM 378 C CE . LYS A 1 52 ? -4.540 -11.874 -6.800 1.00 88.74 52 A 1 ATOM 379 N NZ . LYS A 1 52 ? -4.415 -11.340 -8.177 1.00 80.67 52 A 1 ATOM 380 N N . PRO A 1 53 ? -0.464 -14.731 -1.823 1.00 97.16 53 A 1 ATOM 381 C CA . PRO A 1 53 ? 0.852 -15.131 -1.303 1.00 96.90 53 A 1 ATOM 382 C C . PRO A 1 53 ? 2.042 -14.475 -2.021 1.00 96.92 53 A 1 ATOM 383 O O . PRO A 1 53 ? 3.137 -14.409 -1.480 1.00 95.75 53 A 1 ATOM 384 C CB . PRO A 1 53 ? 0.902 -16.655 -1.470 1.00 96.39 53 A 1 ATOM 385 C CG . PRO A 1 53 ? -0.565 -17.069 -1.466 1.00 94.50 53 A 1 ATOM 386 C CD . PRO A 1 53 ? -1.256 -15.900 -2.161 1.00 96.66 53 A 1 ATOM 387 N N . THR A 1 54 ? 1.831 -13.990 -3.243 1.00 96.64 54 A 1 ATOM 388 C CA . THR A 1 54 ? 2.841 -13.293 -4.051 1.00 96.35 54 A 1 ATOM 389 C C . THR A 1 54 ? 2.957 -11.796 -3.746 1.00 96.38 54 A 1 ATOM 390 O O . THR A 1 54 ? 3.806 -11.137 -4.343 1.00 95.46 54 A 1 ATOM 391 C CB . THR A 1 54 ? 2.562 -13.492 -5.546 1.00 95.57 54 A 1 ATOM 392 O OG1 . THR A 1 54 ? 1.247 -13.081 -5.849 1.00 93.19 54 A 1 ATOM 393 C CG2 . THR A 1 54 ? 2.685 -14.960 -5.960 1.00 91.22 54 A 1 ATOM 394 N N . ALA A 1 55 ? 2.149 -11.253 -2.842 1.00 96.02 55 A 1 ATOM 395 C CA . ALA A 1 55 ? 2.160 -9.825 -2.514 1.00 96.02 55 A 1 ATOM 396 C C . ALA A 1 55 ? 3.556 -9.267 -2.154 1.00 95.96 55 A 1 ATOM 397 O O . ALA A 1 55 ? 3.908 -8.217 -2.694 1.00 95.34 55 A 1 ATOM 398 C CB . ALA A 1 55 ? 1.129 -9.547 -1.413 1.00 95.75 55 A 1 ATOM 399 N N . PRO A 1 56 ? 4.409 -9.960 -1.363 1.00 95.98 56 A 1 ATOM 400 C CA . PRO A 1 56 ? 5.759 -9.465 -1.063 1.00 95.72 56 A 1 ATOM 401 C C . PRO A 1 56 ? 6.616 -9.205 -2.306 1.00 95.54 56 A 1 ATOM 402 O O . PRO A 1 56 ? 7.410 -8.268 -2.330 1.00 94.82 56 A 1 ATOM 403 C CB . PRO A 1 56 ? 6.397 -10.540 -0.182 1.00 94.99 56 A 1 ATOM 404 C CG . PRO A 1 56 ? 5.202 -11.205 0.490 1.00 94.18 56 A 1 ATOM 405 C CD . PRO A 1 56 ? 4.145 -11.174 -0.603 1.00 95.80 56 A 1 ATOM 406 N N . ILE A 1 57 ? 6.427 -9.996 -3.373 1.00 95.80 57 A 1 ATOM 407 C CA . ILE A 1 57 ? 7.188 -9.857 -4.623 1.00 95.26 57 A 1 ATOM 408 C C . ILE A 1 57 ? 6.955 -8.478 -5.256 1.00 94.70 57 A 1 ATOM 409 O O . ILE A 1 57 ? 7.884 -7.897 -5.815 1.00 93.91 57 A 1 ATOM 410 C CB . ILE A 1 57 ? 6.842 -10.998 -5.612 1.00 94.70 57 A 1 ATOM 411 C CG1 . ILE A 1 57 ? 7.168 -12.376 -4.981 1.00 91.63 57 A 1 ATOM 412 C CG2 . ILE A 1 57 ? 7.589 -10.830 -6.948 1.00 90.90 57 A 1 ATOM 413 C CD1 . ILE A 1 57 ? 6.769 -13.582 -5.845 1.00 82.50 57 A 1 ATOM 414 N N . MET A 1 58 ? 5.758 -7.916 -5.136 1.00 94.24 58 A 1 ATOM 415 C CA . MET A 1 58 ? 5.457 -6.581 -5.669 1.00 93.39 58 A 1 ATOM 416 C C . MET A 1 58 ? 6.318 -5.506 -4.997 1.00 93.02 58 A 1 ATOM 417 O O . MET A 1 58 ? 6.852 -4.636 -5.681 1.00 91.51 58 A 1 ATOM 418 C CB . MET A 1 58 ? 3.972 -6.242 -5.494 1.00 91.82 58 A 1 ATOM 419 C CG . MET A 1 58 ? 3.042 -7.237 -6.196 1.00 85.18 58 A 1 ATOM 420 S SD . MET A 1 58 ? 1.291 -6.756 -6.242 1.00 82.24 58 A 1 ATOM 421 C CE . MET A 1 58 ? 0.931 -6.550 -4.477 1.00 71.30 58 A 1 ATOM 422 N N . PHE A 1 59 ? 6.504 -5.616 -3.681 1.00 93.06 59 A 1 ATOM 423 C CA . PHE A 1 59 ? 7.328 -4.676 -2.917 1.00 93.50 59 A 1 ATOM 424 C C . PHE A 1 59 ? 8.825 -4.897 -3.153 1.00 93.14 59 A 1 ATOM 425 O O . PHE A 1 59 ? 9.585 -3.938 -3.157 1.00 90.42 59 A 1 ATOM 426 C CB . PHE A 1 59 ? 6.981 -4.779 -1.428 1.00 93.89 59 A 1 ATOM 427 C CG . PHE A 1 59 ? 5.598 -4.260 -1.101 1.00 95.08 59 A 1 ATOM 428 C CD1 . PHE A 1 59 ? 5.426 -2.915 -0.722 1.00 92.39 59 A 1 ATOM 429 C CD2 . PHE A 1 59 ? 4.479 -5.104 -1.213 1.00 93.50 59 A 1 ATOM 430 C CE1 . PHE A 1 59 ? 4.141 -2.416 -0.453 1.00 92.57 59 A 1 ATOM 431 C CE2 . PHE A 1 59 ? 3.190 -4.603 -0.954 1.00 93.08 59 A 1 ATOM 432 C CZ . PHE A 1 59 ? 3.022 -3.262 -0.573 1.00 94.68 59 A 1 ATOM 433 N N . ILE A 1 60 ? 9.257 -6.136 -3.405 1.00 93.13 60 A 1 ATOM 434 C CA . ILE A 1 60 ? 10.661 -6.444 -3.719 1.00 92.21 60 A 1 ATOM 435 C C . ILE A 1 60 ? 11.049 -5.924 -5.111 1.00 91.44 60 A 1 ATOM 436 O O . ILE A 1 60 ? 12.142 -5.395 -5.295 1.00 89.88 60 A 1 ATOM 437 C CB . ILE A 1 60 ? 10.910 -7.968 -3.588 1.00 92.09 60 A 1 ATOM 438 C CG1 . ILE A 1 60 ? 10.766 -8.408 -2.111 1.00 90.62 60 A 1 ATOM 439 C CG2 . ILE A 1 60 ? 12.302 -8.366 -4.117 1.00 90.40 60 A 1 ATOM 440 C CD1 . ILE A 1 60 ? 10.645 -9.929 -1.929 1.00 84.27 60 A 1 ATOM 441 N N . VAL A 1 61 ? 10.176 -6.104 -6.109 1.00 92.69 61 A 1 ATOM 442 C CA . VAL A 1 61 ? 10.493 -5.809 -7.517 1.00 91.85 61 A 1 ATOM 443 C C . VAL A 1 61 ? 10.192 -4.359 -7.889 1.00 90.68 61 A 1 ATOM 444 O O . VAL A 1 61 ? 10.956 -3.752 -8.639 1.00 88.45 61 A 1 ATOM 445 C CB . VAL A 1 61 ? 9.757 -6.789 -8.455 1.00 91.65 61 A 1 ATOM 446 C CG1 . VAL A 1 61 ? 9.995 -6.477 -9.938 1.00 86.95 61 A 1 ATOM 447 C CG2 . VAL A 1 61 ? 10.231 -8.233 -8.225 1.00 87.45 61 A 1 ATOM 448 N N . ASN A 1 62 ? 9.082 -3.815 -7.397 1.00 90.81 62 A 1 ATOM 449 C CA . ASN A 1 62 ? 8.556 -2.513 -7.822 1.00 88.83 62 A 1 ATOM 450 C C . ASN A 1 62 ? 8.437 -1.498 -6.676 1.00 88.50 62 A 1 ATOM 451 O O . ASN A 1 62 ? 8.004 -0.368 -6.903 1.00 83.92 62 A 1 ATOM 452 C CB . ASN A 1 62 ? 7.185 -2.723 -8.482 1.00 87.21 62 A 1 ATOM 453 C CG . ASN A 1 62 ? 7.198 -3.690 -9.648 1.00 81.21 62 A 1 ATOM 454 O OD1 . ASN A 1 62 ? 7.989 -3.614 -10.574 1.00 73.45 62 A 1 ATOM 455 N ND2 . ASN A 1 62 ? 6.298 -4.646 -9.655 1.00 71.69 62 A 1 ATOM 456 N N . GLY A 1 63 ? 8.750 -1.913 -5.459 1.00 89.59 63 A 1 ATOM 457 C CA . GLY A 1 63 ? 8.661 -1.080 -4.270 1.00 89.12 63 A 1 ATOM 458 C C . GLY A 1 63 ? 9.997 -0.481 -3.845 1.00 90.08 63 A 1 ATOM 459 O O . GLY A 1 63 ? 11.019 -0.588 -4.526 1.00 87.33 63 A 1 ATOM 460 N N . GLY A 1 64 ? 9.972 0.151 -2.687 1.00 89.49 64 A 1 ATOM 461 C CA . GLY A 1 64 ? 11.135 0.739 -2.031 1.00 90.48 64 A 1 ATOM 462 C C . GLY A 1 64 ? 10.788 1.205 -0.622 1.00 92.86 64 A 1 ATOM 463 O O . GLY A 1 64 ? 9.672 0.986 -0.145 1.00 91.22 64 A 1 ATOM 464 N N . GLY A 1 65 ? 11.743 1.838 0.044 1.00 91.70 65 A 1 ATOM 465 C CA . GLY A 1 65 ? 11.487 2.560 1.288 1.00 92.85 65 A 1 ATOM 466 C C . GLY A 1 65 ? 10.689 3.838 1.016 1.00 93.94 65 A 1 ATOM 467 O O . GLY A 1 65 ? 10.980 4.571 0.067 1.00 92.54 65 A 1 ATOM 468 N N . TYR A 1 66 ? 9.671 4.094 1.828 1.00 93.75 66 A 1 ATOM 469 C CA . TYR A 1 66 ? 8.952 5.359 1.797 1.00 94.72 66 A 1 ATOM 470 C C . TYR A 1 66 ? 9.821 6.469 2.385 1.00 95.04 66 A 1 ATOM 471 O O . TYR A 1 66 ? 10.401 6.306 3.455 1.00 94.33 66 A 1 ATOM 472 C CB . TYR A 1 66 ? 7.632 5.220 2.554 1.00 94.80 66 A 1 ATOM 473 C CG . TYR A 1 66 ? 6.824 6.500 2.627 1.00 95.21 66 A 1 ATOM 474 C CD1 . TYR A 1 66 ? 6.710 7.201 3.846 1.00 93.44 66 A 1 ATOM 475 C CD2 . TYR A 1 66 ? 6.196 7.000 1.474 1.00 93.93 66 A 1 ATOM 476 C CE1 . TYR A 1 66 ? 5.957 8.388 3.913 1.00 92.87 66 A 1 ATOM 477 C CE2 . TYR A 1 66 ? 5.446 8.189 1.535 1.00 93.04 66 A 1 ATOM 478 C CZ . TYR A 1 66 ? 5.321 8.881 2.757 1.00 93.46 66 A 1 ATOM 479 O OH . TYR A 1 66 ? 4.584 10.026 2.821 1.00 92.24 66 A 1 ATOM 480 N N . SER A 1 67 ? 9.876 7.606 1.713 1.00 94.17 67 A 1 ATOM 481 C CA . SER A 1 67 ? 10.495 8.813 2.254 1.00 94.30 67 A 1 ATOM 482 C C . SER A 1 67 ? 9.449 9.920 2.376 1.00 94.57 67 A 1 ATOM 483 O O . SER A 1 67 ? 8.963 10.416 1.352 1.00 94.67 67 A 1 ATOM 484 C CB . SER A 1 67 ? 11.679 9.258 1.402 1.00 93.21 67 A 1 ATOM 485 O OG . SER A 1 67 ? 12.287 10.379 2.020 1.00 85.70 67 A 1 ATOM 486 N N . PRO A 1 68 ? 9.087 10.328 3.605 1.00 94.08 68 A 1 ATOM 487 C CA . PRO A 1 68 ? 8.181 11.454 3.817 1.00 94.15 68 A 1 ATOM 488 C C . PRO A 1 68 ? 8.675 12.746 3.157 1.00 94.36 68 A 1 ATOM 489 O O . PRO A 1 68 ? 7.875 13.483 2.582 1.00 93.15 68 A 1 ATOM 490 C CB . PRO A 1 68 ? 8.081 11.614 5.337 1.00 93.27 68 A 1 ATOM 491 C CG . PRO A 1 68 ? 8.415 10.231 5.883 1.00 91.91 68 A 1 ATOM 492 C CD . PRO A 1 68 ? 9.429 9.698 4.879 1.00 93.97 68 A 1 ATOM 493 N N . GLU A 1 69 ? 9.989 12.993 3.184 1.00 94.09 69 A 1 ATOM 494 C CA . GLU A 1 69 ? 10.593 14.175 2.564 1.00 93.93 69 A 1 ATOM 495 C C . GLU A 1 69 ? 10.434 14.154 1.037 1.00 93.69 69 A 1 ATOM 496 O O . GLU A 1 69 ? 9.968 15.128 0.438 1.00 92.97 69 A 1 ATOM 497 C CB . GLU A 1 69 ? 12.071 14.270 2.979 1.00 93.45 69 A 1 ATOM 498 C CG . GLU A 1 69 ? 12.726 15.567 2.465 1.00 81.62 69 A 1 ATOM 499 C CD . GLU A 1 69 ? 14.186 15.757 2.920 1.00 75.22 69 A 1 ATOM 500 O OE1 . GLU A 1 69 ? 14.749 16.825 2.575 1.00 68.60 69 A 1 ATOM 501 O OE2 . GLU A 1 69 ? 14.736 14.865 3.597 1.00 68.16 69 A 1 ATOM 502 N N . ALA A 1 70 ? 10.746 13.016 0.399 1.00 92.80 70 A 1 ATOM 503 C CA . ALA A 1 70 ? 10.587 12.862 -1.046 1.00 91.53 70 A 1 ATOM 504 C C . ALA A 1 70 ? 9.111 12.906 -1.470 1.00 91.87 70 A 1 ATOM 505 O O . ALA A 1 70 ? 8.784 13.461 -2.519 1.00 90.60 70 A 1 ATOM 506 C CB . ALA A 1 70 ? 11.251 11.552 -1.479 1.00 89.95 70 A 1 ATOM 507 N N . ALA A 1 71 ? 8.206 12.355 -0.655 1.00 92.08 71 A 1 ATOM 508 C CA . ALA A 1 71 ? 6.776 12.367 -0.940 1.00 91.87 71 A 1 ATOM 509 C C . ALA A 1 71 ? 6.135 13.753 -0.752 1.00 92.54 71 A 1 ATOM 510 O O . ALA A 1 71 ? 5.155 14.064 -1.432 1.00 92.22 71 A 1 ATOM 511 C CB . ALA A 1 71 ? 6.104 11.307 -0.068 1.00 91.08 71 A 1 ATOM 512 N N . ALA A 1 72 ? 6.697 14.610 0.113 1.00 92.76 72 A 1 ATOM 513 C CA . ALA A 1 72 ? 6.127 15.920 0.443 1.00 93.06 72 A 1 ATOM 514 C C . ALA A 1 72 ? 5.899 16.814 -0.787 1.00 93.22 72 A 1 ATOM 515 O O . ALA A 1 72 ? 4.919 17.558 -0.834 1.00 92.06 72 A 1 ATOM 516 C CB . ALA A 1 72 ? 7.046 16.611 1.456 1.00 92.56 72 A 1 ATOM 517 N N . GLN A 1 73 ? 6.746 16.688 -1.825 1.00 93.47 73 A 1 ATOM 518 C CA . GLN A 1 73 ? 6.600 17.436 -3.082 1.00 92.52 73 A 1 ATOM 519 C C . GLN A 1 73 ? 5.295 17.127 -3.834 1.00 92.74 73 A 1 ATOM 520 O O . GLN A 1 73 ? 4.817 17.954 -4.602 1.00 91.33 73 A 1 ATOM 521 C CB . GLN A 1 73 ? 7.833 17.179 -3.963 1.00 90.89 73 A 1 ATOM 522 C CG . GLN A 1 73 ? 7.829 15.803 -4.645 1.00 82.16 73 A 1 ATOM 523 C CD . GLN A 1 73 ? 9.158 15.484 -5.320 1.00 77.50 73 A 1 ATOM 524 O OE1 . GLN A 1 73 ? 9.577 16.136 -6.265 1.00 71.22 73 A 1 ATOM 525 N NE2 . GLN A 1 73 ? 9.863 14.474 -4.862 1.00 67.62 73 A 1 ATOM 526 N N . TYR A 1 74 ? 4.714 15.947 -3.594 1.00 93.72 74 A 1 ATOM 527 C CA . TYR A 1 74 ? 3.454 15.509 -4.199 1.00 93.39 74 A 1 ATOM 528 C C . TYR A 1 74 ? 2.240 15.745 -3.294 1.00 94.39 74 A 1 ATOM 529 O O . TYR A 1 74 ? 1.126 15.400 -3.686 1.00 93.06 74 A 1 ATOM 530 C CB . TYR A 1 74 ? 3.573 14.035 -4.599 1.00 92.15 74 A 1 ATOM 531 C CG . TYR A 1 74 ? 4.752 13.732 -5.502 1.00 90.31 74 A 1 ATOM 532 C CD1 . TYR A 1 74 ? 4.771 14.209 -6.829 1.00 86.71 74 A 1 ATOM 533 C CD2 . TYR A 1 74 ? 5.843 12.991 -5.009 1.00 86.98 74 A 1 ATOM 534 C CE1 . TYR A 1 74 ? 5.873 13.944 -7.662 1.00 84.88 74 A 1 ATOM 535 C CE2 . TYR A 1 74 ? 6.950 12.724 -5.838 1.00 84.89 74 A 1 ATOM 536 C CZ . TYR A 1 74 ? 6.965 13.203 -7.165 1.00 84.18 74 A 1 ATOM 537 O OH . TYR A 1 74 ? 8.042 12.955 -7.964 1.00 81.61 74 A 1 ATOM 538 N N . SER A 1 75 ? 2.445 16.315 -2.106 1.00 94.02 75 A 1 ATOM 539 C CA . SER A 1 75 ? 1.389 16.565 -1.112 1.00 94.42 75 A 1 ATOM 540 C C . SER A 1 75 ? 0.427 15.373 -0.948 1.00 94.98 75 A 1 ATOM 541 O O . SER A 1 75 ? -0.773 15.520 -1.192 1.00 93.89 75 A 1 ATOM 542 C CB . SER A 1 75 ? 0.640 17.862 -1.456 1.00 92.93 75 A 1 ATOM 543 O OG . SER A 1 75 ? 1.552 18.945 -1.525 1.00 83.77 75 A 1 ATOM 544 N N . PRO A 1 76 ? 0.935 14.169 -0.615 1.00 95.30 76 A 1 ATOM 545 C CA . PRO A 1 76 ? 0.099 12.978 -0.575 1.00 95.51 76 A 1 ATOM 546 C C . PRO A 1 76 ? -0.899 13.048 0.586 1.00 96.02 76 A 1 ATOM 547 O O . PRO A 1 76 ? -0.560 13.411 1.711 1.00 95.20 76 A 1 ATOM 548 C CB . PRO A 1 76 ? 1.068 11.803 -0.440 1.00 94.28 76 A 1 ATOM 549 C CG . PRO A 1 76 ? 2.243 12.413 0.325 1.00 92.28 76 A 1 ATOM 550 C CD . PRO A 1 76 ? 2.301 13.838 -0.216 1.00 94.30 76 A 1 ATOM 551 N N . GLU A 1 77 ? -2.127 12.632 0.325 1.00 96.09 77 A 1 ATOM 552 C CA . GLU A 1 77 ? -3.200 12.546 1.313 1.00 96.12 77 A 1 ATOM 553 C C . GLU A 1 77 ? -3.510 11.086 1.638 1.00 96.84 77 A 1 ATOM 554 O O . GLU A 1 77 ? -3.579 10.243 0.744 1.00 96.35 77 A 1 ATOM 555 C CB . GLU A 1 77 ? -4.456 13.267 0.805 1.00 94.27 77 A 1 ATOM 556 C CG . GLU A 1 77 ? -4.259 14.789 0.677 1.00 82.27 77 A 1 ATOM 557 C CD . GLU A 1 77 ? -5.542 15.531 0.252 1.00 79.62 77 A 1 ATOM 558 O OE1 . GLU A 1 77 ? -5.508 16.781 0.236 1.00 71.25 77 A 1 ATOM 559 O OE2 . GLU A 1 77 ? -6.559 14.863 -0.056 1.00 71.52 77 A 1 ATOM 560 N N . LYS A 1 78 ? -3.744 10.774 2.915 1.00 96.47 78 A 1 ATOM 561 C CA . LYS A 1 78 ? -4.206 9.431 3.305 1.00 96.94 78 A 1 ATOM 562 C C . LYS A 1 78 ? -5.643 9.228 2.844 1.00 96.92 78 A 1 ATOM 563 O O . LYS A 1 78 ? -6.546 9.904 3.330 1.00 96.51 78 A 1 ATOM 564 C CB . LYS A 1 78 ? -4.050 9.205 4.816 1.00 96.73 78 A 1 ATOM 565 C CG . LYS A 1 78 ? -4.375 7.735 5.167 1.00 94.97 78 A 1 ATOM 566 C CD . LYS A 1 78 ? -4.033 7.350 6.612 1.00 92.64 78 A 1 ATOM 567 C CE . LYS A 1 78 ? -5.014 7.911 7.641 1.00 87.31 78 A 1 ATOM 568 N NZ . LYS A 1 78 ? -4.821 7.228 8.956 1.00 80.72 78 A 1 ATOM 569 N N . VAL A 1 79 ? -5.856 8.255 1.957 1.00 97.18 79 A 1 ATOM 570 C CA . VAL A 1 79 ? -7.173 7.948 1.373 1.00 97.01 79 A 1 ATOM 571 C C . VAL A 1 79 ? -7.780 6.646 1.890 1.00 97.33 79 A 1 ATOM 572 O O . VAL A 1 79 ? -8.994 6.476 1.829 1.00 97.01 79 A 1 ATOM 573 C CB . VAL A 1 79 ? -7.124 7.944 -0.162 1.00 96.39 79 A 1 ATOM 574 C CG1 . VAL A 1 79 ? -6.819 9.351 -0.686 1.00 94.50 79 A 1 ATOM 575 C CG2 . VAL A 1 79 ? -6.096 6.957 -0.738 1.00 94.37 79 A 1 ATOM 576 N N . ALA A 1 80 ? -6.963 5.736 2.414 1.00 97.20 80 A 1 ATOM 577 C CA . ALA A 1 80 ? -7.436 4.499 3.019 1.00 97.35 80 A 1 ATOM 578 C C . ALA A 1 80 ? -6.453 3.970 4.069 1.00 97.82 80 A 1 ATOM 579 O O . ALA A 1 80 ? -5.259 4.256 4.045 1.00 97.66 80 A 1 ATOM 580 C CB . ALA A 1 80 ? -7.684 3.454 1.921 1.00 96.91 80 A 1 ATOM 581 N N . GLU A 1 81 ? -6.988 3.154 4.980 1.00 98.00 81 A 1 ATOM 582 C CA . GLU A 1 81 ? -6.217 2.351 5.919 1.00 98.08 81 A 1 ATOM 583 C C . GLU A 1 81 ? -7.002 1.066 6.178 1.00 98.03 81 A 1 ATOM 584 O O . GLU A 1 81 ? -8.195 1.114 6.469 1.00 97.33 81 A 1 ATOM 585 C CB . GLU A 1 81 ? -5.973 3.149 7.206 1.00 97.34 81 A 1 ATOM 586 C CG . GLU A 1 81 ? -5.024 2.446 8.183 1.00 90.22 81 A 1 ATOM 587 C CD . GLU A 1 81 ? -4.749 3.368 9.386 1.00 91.04 81 A 1 ATOM 588 O OE1 . GLU A 1 81 ? -5.245 3.064 10.487 1.00 82.71 81 A 1 ATOM 589 O OE2 . GLU A 1 81 ? -4.058 4.407 9.212 1.00 84.52 81 A 1 ATOM 590 N N . PHE A 1 82 ? -6.345 -0.081 6.041 1.00 97.98 82 A 1 ATOM 591 C CA . PHE A 1 82 ? -6.954 -1.387 6.267 1.00 97.79 82 A 1 ATOM 592 C C . PHE A 1 82 ? -5.909 -2.386 6.763 1.00 98.07 82 A 1 ATOM 593 O O . PHE A 1 82 ? -4.714 -2.098 6.812 1.00 97.76 82 A 1 ATOM 594 C CB . PHE A 1 82 ? -7.672 -1.864 4.990 1.00 97.33 82 A 1 ATOM 595 C CG . PHE A 1 82 ? -6.824 -1.906 3.731 1.00 97.57 82 A 1 ATOM 596 C CD1 . PHE A 1 82 ? -6.798 -0.792 2.866 1.00 96.02 82 A 1 ATOM 597 C CD2 . PHE A 1 82 ? -6.085 -3.054 3.405 1.00 96.43 82 A 1 ATOM 598 C CE1 . PHE A 1 82 ? -6.045 -0.830 1.682 1.00 95.03 82 A 1 ATOM 599 C CE2 . PHE A 1 82 ? -5.325 -3.095 2.221 1.00 95.49 82 A 1 ATOM 600 C CZ . PHE A 1 82 ? -5.307 -1.981 1.357 1.00 95.86 82 A 1 ATOM 601 N N . THR A 1 83 ? -6.352 -3.566 7.160 1.00 97.84 83 A 1 ATOM 602 C CA . THR A 1 83 ? -5.464 -4.643 7.606 1.00 97.78 83 A 1 ATOM 603 C C . THR A 1 83 ? -5.631 -5.847 6.692 1.00 97.82 83 A 1 ATOM 604 O O . THR A 1 83 ? -6.751 -6.261 6.401 1.00 97.23 83 A 1 ATOM 605 C CB . THR A 1 83 ? -5.727 -5.014 9.067 1.00 97.16 83 A 1 ATOM 606 O OG1 . THR A 1 83 ? -5.645 -3.874 9.887 1.00 90.62 83 A 1 ATOM 607 C CG2 . THR A 1 83 ? -4.684 -5.993 9.608 1.00 88.57 83 A 1 ATOM 608 N N . VAL A 1 84 ? -4.506 -6.414 6.255 1.00 97.64 84 A 1 ATOM 609 C CA . VAL A 1 84 ? -4.478 -7.597 5.392 1.00 97.55 84 A 1 ATOM 610 C C . VAL A 1 84 ? -4.067 -8.816 6.213 1.00 97.52 84 A 1 ATOM 611 O O . VAL A 1 84 ? -3.072 -8.789 6.933 1.00 97.06 84 A 1 ATOM 612 C CB . VAL A 1 84 ? -3.554 -7.373 4.181 1.00 96.59 84 A 1 ATOM 613 C CG1 . VAL A 1 84 ? -3.479 -8.602 3.278 1.00 88.87 84 A 1 ATOM 614 C CG2 . VAL A 1 84 ? -4.075 -6.213 3.324 1.00 89.72 84 A 1 ATOM 615 N N . ASP A 1 85 ? -4.838 -9.894 6.090 1.00 97.43 85 A 1 ATOM 616 C CA . ASP A 1 85 ? -4.460 -11.207 6.604 1.00 97.17 85 A 1 ATOM 617 C C . ASP A 1 85 ? -3.713 -11.971 5.505 1.00 97.44 85 A 1 ATOM 618 O O . ASP A 1 85 ? -4.314 -12.518 4.578 1.00 96.77 85 A 1 ATOM 619 C CB . ASP A 1 85 ? -5.698 -11.948 7.119 1.00 95.76 85 A 1 ATOM 620 C CG . ASP A 1 85 ? -5.343 -13.216 7.908 1.00 86.55 85 A 1 ATOM 621 O OD1 . ASP A 1 85 ? -4.154 -13.386 8.259 1.00 81.82 85 A 1 ATOM 622 O OD2 . ASP A 1 85 ? -6.294 -13.976 8.209 1.00 80.82 85 A 1 ATOM 623 N N . ASN A 1 86 ? -2.389 -11.911 5.554 1.00 97.19 86 A 1 ATOM 624 C CA . ASN A 1 86 ? -1.496 -12.582 4.621 1.00 97.41 86 A 1 ATOM 625 C C . ASN A 1 86 ? -0.186 -12.943 5.341 1.00 97.46 86 A 1 ATOM 626 O O . ASN A 1 86 ? 0.679 -12.074 5.476 1.00 97.07 86 A 1 ATOM 627 C CB . ASN A 1 86 ? -1.250 -11.683 3.400 1.00 96.86 86 A 1 ATOM 628 C CG . ASN A 1 86 ? -0.356 -12.337 2.357 1.00 97.00 86 A 1 ATOM 629 O OD1 . ASN A 1 86 ? 0.198 -13.418 2.527 1.00 94.89 86 A 1 ATOM 630 N ND2 . ASN A 1 86 ? -0.192 -11.699 1.225 1.00 94.52 86 A 1 ATOM 631 N N . PRO A 1 87 ? 0.004 -14.212 5.744 1.00 96.88 87 A 1 ATOM 632 C CA . PRO A 1 87 ? 1.207 -14.643 6.461 1.00 96.53 87 A 1 ATOM 633 C C . PRO A 1 87 ? 2.516 -14.329 5.726 1.00 96.64 87 A 1 ATOM 634 O O . PRO A 1 87 ? 3.485 -13.914 6.350 1.00 95.76 87 A 1 ATOM 635 C CB . PRO A 1 87 ? 1.034 -16.153 6.659 1.00 95.97 87 A 1 ATOM 636 C CG . PRO A 1 87 ? -0.482 -16.332 6.682 1.00 94.33 87 A 1 ATOM 637 C CD . PRO A 1 87 ? -0.970 -15.287 5.683 1.00 96.45 87 A 1 ATOM 638 N N . ALA A 1 88 ? 2.535 -14.456 4.392 1.00 96.45 88 A 1 ATOM 639 C CA . ALA A 1 88 ? 3.727 -14.138 3.603 1.00 96.17 88 A 1 ATOM 640 C C . ALA A 1 88 ? 4.079 -12.642 3.653 1.00 96.30 88 A 1 ATOM 641 O O . ALA A 1 88 ? 5.250 -12.270 3.624 1.00 95.87 88 A 1 ATOM 642 C CB . ALA A 1 88 ? 3.490 -14.599 2.157 1.00 95.89 88 A 1 ATOM 643 N N . LEU A 1 89 ? 3.068 -11.779 3.728 1.00 96.08 89 A 1 ATOM 644 C CA . LEU A 1 89 ? 3.263 -10.340 3.872 1.00 95.74 89 A 1 ATOM 645 C C . LEU A 1 89 ? 3.682 -9.975 5.303 1.00 95.58 89 A 1 ATOM 646 O O . LEU A 1 89 ? 4.560 -9.134 5.474 1.00 95.42 89 A 1 ATOM 647 C CB . LEU A 1 89 ? 1.979 -9.620 3.433 1.00 94.84 89 A 1 ATOM 648 C CG . LEU A 1 89 ? 2.155 -8.115 3.180 1.00 92.31 89 A 1 ATOM 649 C CD1 . LEU A 1 89 ? 3.075 -7.846 1.987 1.00 89.76 89 A 1 ATOM 650 C CD2 . LEU A 1 89 ? 0.791 -7.497 2.863 1.00 90.93 89 A 1 ATOM 651 N N . ASP A 1 90 ? 3.112 -10.648 6.307 1.00 95.85 90 A 1 ATOM 652 C CA . ASP A 1 90 ? 3.509 -10.497 7.710 1.00 95.57 90 A 1 ATOM 653 C C . ASP A 1 90 ? 4.994 -10.874 7.911 1.00 95.72 90 A 1 ATOM 654 O O . ASP A 1 90 ? 5.754 -10.120 8.522 1.00 95.58 90 A 1 ATOM 655 C CB . ASP A 1 90 ? 2.603 -11.359 8.624 1.00 94.86 90 A 1 ATOM 656 C CG . ASP A 1 90 ? 1.115 -10.948 8.697 1.00 92.33 90 A 1 ATOM 657 O OD1 . ASP A 1 90 ? 0.787 -9.758 8.507 1.00 88.77 90 A 1 ATOM 658 O OD2 . ASP A 1 90 ? 0.273 -11.814 9.035 1.00 88.59 90 A 1 ATOM 659 N N . GLU A 1 91 ? 5.432 -12.007 7.340 1.00 95.58 91 A 1 ATOM 660 C CA . GLU A 1 91 ? 6.834 -12.454 7.367 1.00 95.53 91 A 1 ATOM 661 C C . GLU A 1 91 ? 7.766 -11.472 6.642 1.00 95.45 91 A 1 ATOM 662 O O . GLU A 1 91 ? 8.846 -11.160 7.145 1.00 94.90 91 A 1 ATOM 663 C CB . GLU A 1 91 ? 6.963 -13.841 6.711 1.00 95.33 91 A 1 ATOM 664 C CG . GLU A 1 91 ? 6.421 -14.980 7.593 1.00 87.01 91 A 1 ATOM 665 C CD . GLU A 1 91 ? 6.473 -16.360 6.906 1.00 83.22 91 A 1 ATOM 666 O OE1 . GLU A 1 91 ? 5.908 -17.314 7.488 1.00 75.03 91 A 1 ATOM 667 O OE2 . GLU A 1 91 ? 7.079 -16.480 5.814 1.00 76.32 91 A 1 ATOM 668 N N . PHE A 1 92 ? 7.347 -10.966 5.485 1.00 95.04 92 A 1 ATOM 669 C CA . PHE A 1 92 ? 8.117 -9.974 4.736 1.00 94.24 92 A 1 ATOM 670 C C . PHE A 1 92 ? 8.326 -8.690 5.546 1.00 93.99 92 A 1 ATOM 671 O O . PHE A 1 92 ? 9.461 -8.244 5.683 1.00 93.50 92 A 1 ATOM 672 C CB . PHE A 1 92 ? 7.427 -9.680 3.401 1.00 93.90 92 A 1 ATOM 673 C CG . PHE A 1 92 ? 8.057 -8.527 2.646 1.00 93.99 92 A 1 ATOM 674 C CD1 . PHE A 1 92 ? 7.391 -7.288 2.555 1.00 92.07 92 A 1 ATOM 675 C CD2 . PHE A 1 92 ? 9.336 -8.671 2.084 1.00 92.51 92 A 1 ATOM 676 C CE1 . PHE A 1 92 ? 7.995 -6.209 1.893 1.00 90.89 92 A 1 ATOM 677 C CE2 . PHE A 1 92 ? 9.944 -7.587 1.423 1.00 91.04 92 A 1 ATOM 678 C CZ . PHE A 1 92 ? 9.272 -6.356 1.325 1.00 90.99 92 A 1 ATOM 679 N N . VAL A 1 93 ? 7.265 -8.138 6.124 1.00 94.35 93 A 1 ATOM 680 C CA . VAL A 1 93 ? 7.359 -6.928 6.959 1.00 93.43 93 A 1 ATOM 681 C C . VAL A 1 93 ? 8.284 -7.161 8.152 1.00 92.60 93 A 1 ATOM 682 O O . VAL A 1 93 ? 9.148 -6.336 8.416 1.00 92.28 93 A 1 ATOM 683 C CB . VAL A 1 93 ? 5.964 -6.461 7.413 1.00 93.04 93 A 1 ATOM 684 C CG1 . VAL A 1 93 ? 6.014 -5.341 8.459 1.00 90.09 93 A 1 ATOM 685 C CG2 . VAL A 1 93 ? 5.185 -5.912 6.213 1.00 91.20 93 A 1 ATOM 686 N N . ALA A 1 94 ? 8.167 -8.316 8.822 1.00 93.71 94 A 1 ATOM 687 C CA . ALA A 1 94 ? 9.038 -8.660 9.945 1.00 93.17 94 A 1 ATOM 688 C C . ALA A 1 94 ? 10.519 -8.812 9.551 1.00 92.38 94 A 1 ATOM 689 O O . ALA A 1 94 ? 11.394 -8.609 10.389 1.00 90.76 94 A 1 ATOM 690 C CB . ALA A 1 94 ? 8.507 -9.954 10.577 1.00 92.82 94 A 1 ATOM 691 N N . ALA A 1 95 ? 10.809 -9.183 8.297 1.00 92.48 95 A 1 ATOM 692 C CA . ALA A 1 95 ? 12.175 -9.359 7.804 1.00 91.69 95 A 1 ATOM 693 C C . ALA A 1 95 ? 12.865 -8.047 7.391 1.00 90.73 95 A 1 ATOM 694 O O . ALA A 1 95 ? 14.093 -8.014 7.323 1.00 88.22 95 A 1 ATOM 695 C CB . ALA A 1 95 ? 12.137 -10.353 6.638 1.00 91.43 95 A 1 ATOM 696 N N . VAL A 1 96 ? 12.101 -7.003 7.087 1.00 90.76 96 A 1 ATOM 697 C CA . VAL A 1 96 ? 12.617 -5.703 6.608 1.00 87.27 96 A 1 ATOM 698 C C . VAL A 1 96 ? 12.434 -4.558 7.614 1.00 83.99 96 A 1 ATOM 699 O O . VAL A 1 96 ? 12.880 -3.449 7.339 1.00 79.56 96 A 1 ATOM 700 C CB . VAL A 1 96 ? 12.027 -5.329 5.233 1.00 85.89 96 A 1 ATOM 701 C CG1 . VAL A 1 96 ? 12.283 -6.423 4.186 1.00 80.18 96 A 1 ATOM 702 C CG2 . VAL A 1 96 ? 10.521 -5.041 5.292 1.00 80.04 96 A 1 ATOM 703 N N . ALA A 1 97 ? 11.782 -4.823 8.743 1.00 81.18 97 A 1 ATOM 704 C CA . ALA A 1 97 ? 11.587 -3.876 9.837 1.00 77.60 97 A 1 ATOM 705 C C . ALA A 1 97 ? 12.821 -3.714 10.731 1.00 71.91 97 A 1 ATOM 706 O O . ALA A 1 97 ? 13.601 -4.679 10.869 1.00 66.89 97 A 1 ATOM 707 C CB . ALA A 1 97 ? 10.365 -4.307 10.654 1.00 70.89 97 A 1 ATOM 708 O OXT . ALA A 1 97 ? 12.963 -2.607 11.304 1.00 62.12 97 A 1 #