| data_5ZYH |
| |
| _entry.id 5ZYH |
| |
| _audit_conform.dict_name mmcif_pdbx.dic |
| _audit_conform.dict_version 5.387 |
| _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic |
| |
| loop_ |
| _database_2.database_id |
| _database_2.database_code |
| _database_2.pdbx_database_accession |
| _database_2.pdbx_DOI |
| PDB 5ZYH pdb_00005zyh 10.2210/pdb5zyh/pdb |
| WWPDB D_1300007853 ? ? |
| |
| loop_ |
| _pdbx_audit_revision_history.ordinal |
| _pdbx_audit_revision_history.data_content_type |
| _pdbx_audit_revision_history.major_revision |
| _pdbx_audit_revision_history.minor_revision |
| _pdbx_audit_revision_history.revision_date |
| 1 'Structure model' 1 0 2019-02-27 |
| 2 'Structure model' 1 1 2019-03-06 |
| 3 'Structure model' 1 2 2024-03-27 |
| |
| _pdbx_audit_revision_details.ordinal 1 |
| _pdbx_audit_revision_details.revision_ordinal 1 |
| _pdbx_audit_revision_details.data_content_type 'Structure model' |
| _pdbx_audit_revision_details.provider repository |
| _pdbx_audit_revision_details.type 'Initial release' |
| _pdbx_audit_revision_details.description ? |
| _pdbx_audit_revision_details.details ? |
| |
| loop_ |
| _pdbx_audit_revision_group.ordinal |
| _pdbx_audit_revision_group.revision_ordinal |
| _pdbx_audit_revision_group.data_content_type |
| _pdbx_audit_revision_group.group |
| 1 2 'Structure model' 'Data collection' |
| 2 2 'Structure model' 'Database references' |
| 3 3 'Structure model' 'Data collection' |
| 4 3 'Structure model' 'Database references' |
| |
| loop_ |
| _pdbx_audit_revision_category.ordinal |
| _pdbx_audit_revision_category.revision_ordinal |
| _pdbx_audit_revision_category.data_content_type |
| _pdbx_audit_revision_category.category |
| 1 2 'Structure model' citation |
| 2 3 'Structure model' chem_comp_atom |
| 3 3 'Structure model' chem_comp_bond |
| 4 3 'Structure model' citation |
| 5 3 'Structure model' database_2 |
| |
| loop_ |
| _pdbx_audit_revision_item.ordinal |
| _pdbx_audit_revision_item.revision_ordinal |
| _pdbx_audit_revision_item.data_content_type |
| _pdbx_audit_revision_item.item |
| 1 2 'Structure model' '_citation.journal_abbrev' |
| 2 2 'Structure model' '_citation.journal_id_CSD' |
| 3 2 'Structure model' '_citation.journal_id_ISSN' |
| 4 3 'Structure model' '_citation.country' |
| 5 3 'Structure model' '_database_2.pdbx_DOI' |
| 6 3 'Structure model' '_database_2.pdbx_database_accession' |
| |
| _pdbx_database_status.status_code REL |
| _pdbx_database_status.status_code_sf REL |
| _pdbx_database_status.status_code_mr ? |
| _pdbx_database_status.entry_id 5ZYH |
| _pdbx_database_status.recvd_initial_deposition_date 2018-05-25 |
| _pdbx_database_status.SG_entry N |
| _pdbx_database_status.deposit_site PDBJ |
| _pdbx_database_status.process_site PDBJ |
| _pdbx_database_status.status_code_cs ? |
| _pdbx_database_status.methods_development_category ? |
| _pdbx_database_status.pdb_format_compatible Y |
| _pdbx_database_status.status_code_nmr_data ? |
| |
| loop_ |
| _pdbx_database_related.db_name |
| _pdbx_database_related.details |
| _pdbx_database_related.db_id |
| _pdbx_database_related.content_type |
| PDB 'same protein complexed with different ligand' 5ZYG unspecified |
| PDB 'same protein complexed with different ligand' 5ZYI unspecified |
| PDB 'same protein complexed with different ligand' 5ZYJ unspecified |
| PDB 'same protein complexed with different ligand' 5ZYK unspecified |
| PDB 'same protein complexed with different ligand' 5ZYL unspecified |
| PDB 'same protein complexed with different ligand' 5ZYM unspecified |
| |
| loop_ |
| _audit_author.name |
| _audit_author.pdbx_ordinal |
| _audit_author.identifier_ORCID |
| 'Suzuki, M.' 1 ? |
| 'Nakao, N.' 2 ? |
| 'Ueno, M.' 3 ? |
| 'Sakai, S.' 4 ? |
| 'Egawa, D.' 5 ? |
| 'Hanzawa, H.' 6 ? |
| 'Kawasaki, S.' 7 ? |
| 'Kumagai, K.' 8 ? |
| 'Kobayashi, S.' 9 ? |
| 'Hanada, K.' 10 ? |
| |
| _citation.abstract ? |
| _citation.abstract_id_CAS ? |
| _citation.book_id_ISBN ? |
| _citation.book_publisher ? |
| _citation.book_publisher_city ? |
| _citation.book_title ? |
| _citation.coordinate_linkage ? |
| _citation.country UK |
| _citation.database_id_Medline ? |
| _citation.details ? |
| _citation.id primary |
| _citation.journal_abbrev 'Commun Chem' |
| _citation.journal_id_ASTM ? |
| _citation.journal_id_CSD ? |
| _citation.journal_id_ISSN 2399 |
| _citation.journal_full ? |
| _citation.journal_issue ? |
| _citation.journal_volume ? |
| _citation.language ? |
| _citation.page_first ? |
| _citation.page_last ? |
| _citation.title 'Natural ligand-nonmimetic inhibitors of the lipid-transfer protein CERT' |
| _citation.year 2019 |
| _citation.database_id_CSD ? |
| _citation.pdbx_database_id_DOI 10.1038/s42004-019-0118-3 |
| _citation.pdbx_database_id_PubMed ? |
| _citation.unpublished_flag ? |
| |
| loop_ |
| _citation_author.citation_id |
| _citation_author.name |
| _citation_author.ordinal |
| _citation_author.identifier_ORCID |
| primary 'Nakao, N.' 1 ? |
| primary 'Ueno, M.' 2 ? |
| primary 'Sakai, S.' 3 ? |
| primary 'Egawa, D.' 4 ? |
| primary 'Hanzawa, H.' 5 ? |
| primary 'Kawasaki, S.' 6 ? |
| primary 'Kumagai, K.' 7 ? |
| primary 'Suzuki, M.' 8 ? |
| primary 'Kobayashi, S.' 9 ? |
| primary 'Hanada, K.' 10 ? |
| |
| loop_ |
| _entity.id |
| _entity.type |
| _entity.src_method |
| _entity.pdbx_description |
| _entity.formula_weight |
| _entity.pdbx_number_of_molecules |
| _entity.pdbx_ec |
| _entity.pdbx_mutation |
| _entity.pdbx_fragment |
| _entity.details |
| 1 polymer man 'LIPID-TRANSFER PROTEIN CERT' 27056.781 1 ? |
| ? 'UNP residues 364-598' ? |
| 2 non-polymer syn '2-[4-[3-~{tert}-butyl-5-[(1~{R},2~{S})-2-pyridin-2-ylcyclopropyl]phenyl]phenyl]sulfonylethanol' 435.578 1 ? |
| ? ? ? |
| 3 water nat water 18.015 108 ? |
| ? ? ? |
| |
| _entity_name_com.entity_id 1 |
| _entity_name_com.name 'Ceramide transfer protein,hCERT,StAR-related lipid transfer protein 11' |
| |
| _entity_poly.entity_id 1 |
| _entity_poly.type 'polypeptide(L)' |
| _entity_poly.nstd_linkage no |
| _entity_poly.nstd_monomer no |
| _entity_poly.pdbx_seq_one_letter_code |
| ;GPTHRFVQKVEEMVQNHMTYSLQDVGGDANWQLVVEEGEMKVYRREVEENGIVLDPLKATHAVKGVTGHEVCNYFWNVDV |
| RNDWETTIENFHVVETLADNAIIIYQTHKRVWPASQRDVLYLSVIRKIPALTENDPETWIVCNFSVDHDSAPLNNRCVRA |
| KINVAMICQTLVSPPEGNQEISRDNILCKITYVANVNPGGWAPASVLRAVAKREYPKFLKRFTSYVQEKTAGKPILF |
| ; |
| _entity_poly.pdbx_seq_one_letter_code_can |
| ;GPTHRFVQKVEEMVQNHMTYSLQDVGGDANWQLVVEEGEMKVYRREVEENGIVLDPLKATHAVKGVTGHEVCNYFWNVDV |
| RNDWETTIENFHVVETLADNAIIIYQTHKRVWPASQRDVLYLSVIRKIPALTENDPETWIVCNFSVDHDSAPLNNRCVRA |
| KINVAMICQTLVSPPEGNQEISRDNILCKITYVANVNPGGWAPASVLRAVAKREYPKFLKRFTSYVQEKTAGKPILF |
| ; |
| _entity_poly.pdbx_strand_id A |
| _entity_poly.pdbx_target_identifier ? |
| |
| loop_ |
| _pdbx_entity_nonpoly.entity_id |
| _pdbx_entity_nonpoly.name |
| _pdbx_entity_nonpoly.comp_id |
| 2 '2-[4-[3-~{tert}-butyl-5-[(1~{R},2~{S})-2-pyridin-2-ylcyclopropyl]phenyl]phenyl]sulfonylethanol' 9N0 |
| 3 water HOH |
| |
| loop_ |
| _entity_poly_seq.entity_id |
| _entity_poly_seq.num |
| _entity_poly_seq.mon_id |
| _entity_poly_seq.hetero |
| 1 1 GLY n |
| 1 2 PRO n |
| 1 3 THR n |
| 1 4 HIS n |
| 1 5 ARG n |
| 1 6 PHE n |
| 1 7 VAL n |
| 1 8 GLN n |
| 1 9 LYS n |
| 1 10 VAL n |
| 1 11 GLU n |
| 1 12 GLU n |
| 1 13 MET n |
| 1 14 VAL n |
| 1 15 GLN n |
| 1 16 ASN n |
| 1 17 HIS n |
| 1 18 MET n |
| 1 19 THR n |
| 1 20 TYR n |
| 1 21 SER n |
| 1 22 LEU n |
| 1 23 GLN n |
| 1 24 ASP n |
| 1 25 VAL n |
| 1 26 GLY n |
| 1 27 GLY n |
| 1 28 ASP n |
| 1 29 ALA n |
| 1 30 ASN n |
| 1 31 TRP n |
| 1 32 GLN n |
| 1 33 LEU n |
| 1 34 VAL n |
| 1 35 VAL n |
| 1 36 GLU n |
| 1 37 GLU n |
| 1 38 GLY n |
| 1 39 GLU n |
| 1 40 MET n |
| 1 41 LYS n |
| 1 42 VAL n |
| 1 43 TYR n |
| 1 44 ARG n |
| 1 45 ARG n |
| 1 46 GLU n |
| 1 47 VAL n |
| 1 48 GLU n |
| 1 49 GLU n |
| 1 50 ASN n |
| 1 51 GLY n |
| 1 52 ILE n |
| 1 53 VAL n |
| 1 54 LEU n |
| 1 55 ASP n |
| 1 56 PRO n |
| 1 57 LEU n |
| 1 58 LYS n |
| 1 59 ALA n |
| 1 60 THR n |
| 1 61 HIS n |
| 1 62 ALA n |
| 1 63 VAL n |
| 1 64 LYS n |
| 1 65 GLY n |
| 1 66 VAL n |
| 1 67 THR n |
| 1 68 GLY n |
| 1 69 HIS n |
| 1 70 GLU n |
| 1 71 VAL n |
| 1 72 CYS n |
| 1 73 ASN n |
| 1 74 TYR n |
| 1 75 PHE n |
| 1 76 TRP n |
| 1 77 ASN n |
| 1 78 VAL n |
| 1 79 ASP n |
| 1 80 VAL n |
| 1 81 ARG n |
| 1 82 ASN n |
| 1 83 ASP n |
| 1 84 TRP n |
| 1 85 GLU n |
| 1 86 THR n |
| 1 87 THR n |
| 1 88 ILE n |
| 1 89 GLU n |
| 1 90 ASN n |
| 1 91 PHE n |
| 1 92 HIS n |
| 1 93 VAL n |
| 1 94 VAL n |
| 1 95 GLU n |
| 1 96 THR n |
| 1 97 LEU n |
| 1 98 ALA n |
| 1 99 ASP n |
| 1 100 ASN n |
| 1 101 ALA n |
| 1 102 ILE n |
| 1 103 ILE n |
| 1 104 ILE n |
| 1 105 TYR n |
| 1 106 GLN n |
| 1 107 THR n |
| 1 108 HIS n |
| 1 109 LYS n |
| 1 110 ARG n |
| 1 111 VAL n |
| 1 112 TRP n |
| 1 113 PRO n |
| 1 114 ALA n |
| 1 115 SER n |
| 1 116 GLN n |
| 1 117 ARG n |
| 1 118 ASP n |
| 1 119 VAL n |
| 1 120 LEU n |
| 1 121 TYR n |
| 1 122 LEU n |
| 1 123 SER n |
| 1 124 VAL n |
| 1 125 ILE n |
| 1 126 ARG n |
| 1 127 LYS n |
| 1 128 ILE n |
| 1 129 PRO n |
| 1 130 ALA n |
| 1 131 LEU n |
| 1 132 THR n |
| 1 133 GLU n |
| 1 134 ASN n |
| 1 135 ASP n |
| 1 136 PRO n |
| 1 137 GLU n |
| 1 138 THR n |
| 1 139 TRP n |
| 1 140 ILE n |
| 1 141 VAL n |
| 1 142 CYS n |
| 1 143 ASN n |
| 1 144 PHE n |
| 1 145 SER n |
| 1 146 VAL n |
| 1 147 ASP n |
| 1 148 HIS n |
| 1 149 ASP n |
| 1 150 SER n |
| 1 151 ALA n |
| 1 152 PRO n |
| 1 153 LEU n |
| 1 154 ASN n |
| 1 155 ASN n |
| 1 156 ARG n |
| 1 157 CYS n |
| 1 158 VAL n |
| 1 159 ARG n |
| 1 160 ALA n |
| 1 161 LYS n |
| 1 162 ILE n |
| 1 163 ASN n |
| 1 164 VAL n |
| 1 165 ALA n |
| 1 166 MET n |
| 1 167 ILE n |
| 1 168 CYS n |
| 1 169 GLN n |
| 1 170 THR n |
| 1 171 LEU n |
| 1 172 VAL n |
| 1 173 SER n |
| 1 174 PRO n |
| 1 175 PRO n |
| 1 176 GLU n |
| 1 177 GLY n |
| 1 178 ASN n |
| 1 179 GLN n |
| 1 180 GLU n |
| 1 181 ILE n |
| 1 182 SER n |
| 1 183 ARG n |
| 1 184 ASP n |
| 1 185 ASN n |
| 1 186 ILE n |
| 1 187 LEU n |
| 1 188 CYS n |
| 1 189 LYS n |
| 1 190 ILE n |
| 1 191 THR n |
| 1 192 TYR n |
| 1 193 VAL n |
| 1 194 ALA n |
| 1 195 ASN n |
| 1 196 VAL n |
| 1 197 ASN n |
| 1 198 PRO n |
| 1 199 GLY n |
| 1 200 GLY n |
| 1 201 TRP n |
| 1 202 ALA n |
| 1 203 PRO n |
| 1 204 ALA n |
| 1 205 SER n |
| 1 206 VAL n |
| 1 207 LEU n |
| 1 208 ARG n |
| 1 209 ALA n |
| 1 210 VAL n |
| 1 211 ALA n |
| 1 212 LYS n |
| 1 213 ARG n |
| 1 214 GLU n |
| 1 215 TYR n |
| 1 216 PRO n |
| 1 217 LYS n |
| 1 218 PHE n |
| 1 219 LEU n |
| 1 220 LYS n |
| 1 221 ARG n |
| 1 222 PHE n |
| 1 223 THR n |
| 1 224 SER n |
| 1 225 TYR n |
| 1 226 VAL n |
| 1 227 GLN n |
| 1 228 GLU n |
| 1 229 LYS n |
| 1 230 THR n |
| 1 231 ALA n |
| 1 232 GLY n |
| 1 233 LYS n |
| 1 234 PRO n |
| 1 235 ILE n |
| 1 236 LEU n |
| 1 237 PHE n |
| |
| _entity_src_gen.entity_id 1 |
| _entity_src_gen.pdbx_src_id 1 |
| _entity_src_gen.pdbx_alt_source_flag sample |
| _entity_src_gen.pdbx_seq_type 'Biological sequence' |
| _entity_src_gen.pdbx_beg_seq_num 1 |
| _entity_src_gen.pdbx_end_seq_num 237 |
| _entity_src_gen.gene_src_common_name Human |
| _entity_src_gen.gene_src_genus ? |
| _entity_src_gen.pdbx_gene_src_gene CERT |
| _entity_src_gen.gene_src_species ? |
| _entity_src_gen.gene_src_strain ? |
| _entity_src_gen.gene_src_tissue ? |
| _entity_src_gen.gene_src_tissue_fraction ? |
| _entity_src_gen.gene_src_details ? |
| _entity_src_gen.pdbx_gene_src_fragment ? |
| _entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' |
| _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 |
| _entity_src_gen.pdbx_gene_src_variant ? |
| _entity_src_gen.pdbx_gene_src_cell_line ? |
| _entity_src_gen.pdbx_gene_src_atcc ? |
| _entity_src_gen.pdbx_gene_src_organ ? |
| _entity_src_gen.pdbx_gene_src_organelle ? |
| _entity_src_gen.pdbx_gene_src_cell ? |
| _entity_src_gen.pdbx_gene_src_cellular_location ? |
| _entity_src_gen.host_org_common_name ? |
| _entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' |
| _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 |
| _entity_src_gen.host_org_genus ? |
| _entity_src_gen.pdbx_host_org_gene ? |
| _entity_src_gen.pdbx_host_org_organ ? |
| _entity_src_gen.host_org_species ? |
| _entity_src_gen.pdbx_host_org_tissue ? |
| _entity_src_gen.pdbx_host_org_tissue_fraction ? |
| _entity_src_gen.pdbx_host_org_strain ? |
| _entity_src_gen.pdbx_host_org_variant ? |
| _entity_src_gen.pdbx_host_org_cell_line ? |
| _entity_src_gen.pdbx_host_org_atcc ? |
| _entity_src_gen.pdbx_host_org_culture_collection ? |
| _entity_src_gen.pdbx_host_org_cell ? |
| _entity_src_gen.pdbx_host_org_organelle ? |
| _entity_src_gen.pdbx_host_org_cellular_location ? |
| _entity_src_gen.pdbx_host_org_vector_type pET28b |
| _entity_src_gen.pdbx_host_org_vector ? |
| _entity_src_gen.host_org_details ? |
| _entity_src_gen.expression_system_id ? |
| _entity_src_gen.plasmid_name 'pET28b-His-3C-CERT START' |
| _entity_src_gen.plasmid_details ? |
| _entity_src_gen.pdbx_description ? |
| |
| loop_ |
| _chem_comp.id |
| _chem_comp.type |
| _chem_comp.mon_nstd_flag |
| _chem_comp.name |
| _chem_comp.pdbx_synonyms |
| _chem_comp.formula |
| _chem_comp.formula_weight |
| 9N0 non-polymer . '2-[4-[3-~{tert}-butyl-5-[(1~{R},2~{S})-2-pyridin-2-ylcyclopropyl]phenyl]phenyl]sulfonylethanol' ? |
| 'C26 H29 N O3 S' 435.578 |
| ALA 'L-peptide linking' y ALANINE ? |
| 'C3 H7 N O2' 89.093 |
| ARG 'L-peptide linking' y ARGININE ? |
| 'C6 H15 N4 O2 1' 175.209 |
| ASN 'L-peptide linking' y ASPARAGINE ? |
| 'C4 H8 N2 O3' 132.118 |
| ASP 'L-peptide linking' y 'ASPARTIC ACID' ? |
| 'C4 H7 N O4' 133.103 |
| CYS 'L-peptide linking' y CYSTEINE ? |
| 'C3 H7 N O2 S' 121.158 |
| GLN 'L-peptide linking' y GLUTAMINE ? |
| 'C5 H10 N2 O3' 146.144 |
| GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? |
| 'C5 H9 N O4' 147.129 |
| GLY 'peptide linking' y GLYCINE ? |
| 'C2 H5 N O2' 75.067 |
| HIS 'L-peptide linking' y HISTIDINE ? |
| 'C6 H10 N3 O2 1' 156.162 |
| HOH non-polymer . WATER ? |
| 'H2 O' 18.015 |
| ILE 'L-peptide linking' y ISOLEUCINE ? |
| 'C6 H13 N O2' 131.173 |
| LEU 'L-peptide linking' y LEUCINE ? |
| 'C6 H13 N O2' 131.173 |
| LYS 'L-peptide linking' y LYSINE ? |
| 'C6 H15 N2 O2 1' 147.195 |
| MET 'L-peptide linking' y METHIONINE ? |
| 'C5 H11 N O2 S' 149.211 |
| PHE 'L-peptide linking' y PHENYLALANINE ? |
| 'C9 H11 N O2' 165.189 |
| PRO 'L-peptide linking' y PROLINE ? |
| 'C5 H9 N O2' 115.130 |
| SER 'L-peptide linking' y SERINE ? |
| 'C3 H7 N O3' 105.093 |
| THR 'L-peptide linking' y THREONINE ? |
| 'C4 H9 N O3' 119.119 |
| TRP 'L-peptide linking' y TRYPTOPHAN ? |
| 'C11 H12 N2 O2' 204.225 |
| TYR 'L-peptide linking' y TYROSINE ? |
| 'C9 H11 N O3' 181.189 |
| VAL 'L-peptide linking' y VALINE ? |
| 'C5 H11 N O2' 117.146 |
| |
| loop_ |
| _pdbx_poly_seq_scheme.asym_id |
| _pdbx_poly_seq_scheme.entity_id |
| _pdbx_poly_seq_scheme.seq_id |
| _pdbx_poly_seq_scheme.mon_id |
| _pdbx_poly_seq_scheme.ndb_seq_num |
| _pdbx_poly_seq_scheme.pdb_seq_num |
| _pdbx_poly_seq_scheme.auth_seq_num |
| _pdbx_poly_seq_scheme.pdb_mon_id |
| _pdbx_poly_seq_scheme.auth_mon_id |
| _pdbx_poly_seq_scheme.pdb_strand_id |
| _pdbx_poly_seq_scheme.pdb_ins_code |
| _pdbx_poly_seq_scheme.hetero |
| A 1 1 GLY 1 362 ? ? ? A . n |
| A 1 2 PRO 2 363 ? ? ? A . n |
| A 1 3 THR 3 364 364 THR THR A . n |
| A 1 4 HIS 4 365 365 HIS HIS A . n |
| A 1 5 ARG 5 366 366 ARG ARG A . n |
| A 1 6 PHE 6 367 367 PHE PHE A . n |
| A 1 7 VAL 7 368 368 VAL VAL A . n |
| A 1 8 GLN 8 369 369 GLN GLN A . n |
| A 1 9 LYS 9 370 370 LYS LYS A . n |
| A 1 10 VAL 10 371 371 VAL VAL A . n |
| A 1 11 GLU 11 372 372 GLU GLU A . n |
| A 1 12 GLU 12 373 373 GLU GLU A . n |
| A 1 13 MET 13 374 374 MET MET A . n |
| A 1 14 VAL 14 375 375 VAL VAL A . n |
| A 1 15 GLN 15 376 376 GLN GLN A . n |
| A 1 16 ASN 16 377 377 ASN ASN A . n |
| A 1 17 HIS 17 378 378 HIS HIS A . n |
| A 1 18 MET 18 379 379 MET MET A . n |
| A 1 19 THR 19 380 380 THR THR A . n |
| A 1 20 TYR 20 381 381 TYR TYR A . n |
| A 1 21 SER 21 382 382 SER SER A . n |
| A 1 22 LEU 22 383 383 LEU LEU A . n |
| A 1 23 GLN 23 384 384 GLN GLN A . n |
| A 1 24 ASP 24 385 385 ASP ASP A . n |
| A 1 25 VAL 25 386 386 VAL VAL A . n |
| A 1 26 GLY 26 387 ? ? ? A . n |
| A 1 27 GLY 27 388 388 GLY GLY A . n |
| A 1 28 ASP 28 389 389 ASP ASP A . n |
| A 1 29 ALA 29 390 390 ALA ALA A . n |
| A 1 30 ASN 30 391 391 ASN ASN A . n |
| A 1 31 TRP 31 392 392 TRP TRP A . n |
| A 1 32 GLN 32 393 393 GLN GLN A . n |
| A 1 33 LEU 33 394 394 LEU LEU A . n |
| A 1 34 VAL 34 395 395 VAL VAL A . n |
| A 1 35 VAL 35 396 396 VAL VAL A . n |
| A 1 36 GLU 36 397 397 GLU GLU A . n |
| A 1 37 GLU 37 398 398 GLU GLU A . n |
| A 1 38 GLY 38 399 399 GLY GLY A . n |
| A 1 39 GLU 39 400 400 GLU GLU A . n |
| A 1 40 MET 40 401 401 MET MET A . n |
| A 1 41 LYS 41 402 402 LYS LYS A . n |
| A 1 42 VAL 42 403 403 VAL VAL A . n |
| A 1 43 TYR 43 404 404 TYR TYR A . n |
| A 1 44 ARG 44 405 405 ARG ARG A . n |
| A 1 45 ARG 45 406 406 ARG ARG A . n |
| A 1 46 GLU 46 407 407 GLU GLU A . n |
| A 1 47 VAL 47 408 408 VAL VAL A . n |
| A 1 48 GLU 48 409 409 GLU GLU A . n |
| A 1 49 GLU 49 410 410 GLU GLU A . n |
| A 1 50 ASN 50 411 411 ASN ASN A . n |
| A 1 51 GLY 51 412 412 GLY GLY A . n |
| A 1 52 ILE 52 413 413 ILE ILE A . n |
| A 1 53 VAL 53 414 414 VAL VAL A . n |
| A 1 54 LEU 54 415 415 LEU LEU A . n |
| A 1 55 ASP 55 416 416 ASP ASP A . n |
| A 1 56 PRO 56 417 417 PRO PRO A . n |
| A 1 57 LEU 57 418 418 LEU LEU A . n |
| A 1 58 LYS 58 419 419 LYS LYS A . n |
| A 1 59 ALA 59 420 420 ALA ALA A . n |
| A 1 60 THR 60 421 421 THR THR A . n |
| A 1 61 HIS 61 422 422 HIS HIS A . n |
| A 1 62 ALA 62 423 423 ALA ALA A . n |
| A 1 63 VAL 63 424 424 VAL VAL A . n |
| A 1 64 LYS 64 425 425 LYS LYS A . n |
| A 1 65 GLY 65 426 426 GLY GLY A . n |
| A 1 66 VAL 66 427 427 VAL VAL A . n |
| A 1 67 THR 67 428 428 THR THR A . n |
| A 1 68 GLY 68 429 429 GLY GLY A . n |
| A 1 69 HIS 69 430 430 HIS HIS A . n |
| A 1 70 GLU 70 431 431 GLU GLU A . n |
| A 1 71 VAL 71 432 432 VAL VAL A . n |
| A 1 72 CYS 72 433 433 CYS CYS A . n |
| A 1 73 ASN 73 434 434 ASN ASN A . n |
| A 1 74 TYR 74 435 435 TYR TYR A . n |
| A 1 75 PHE 75 436 436 PHE PHE A . n |
| A 1 76 TRP 76 437 437 TRP TRP A . n |
| A 1 77 ASN 77 438 438 ASN ASN A . n |
| A 1 78 VAL 78 439 439 VAL VAL A . n |
| A 1 79 ASP 79 440 440 ASP ASP A . n |
| A 1 80 VAL 80 441 441 VAL VAL A . n |
| A 1 81 ARG 81 442 442 ARG ARG A . n |
| A 1 82 ASN 82 443 443 ASN ASN A . n |
| A 1 83 ASP 83 444 444 ASP ASP A . n |
| A 1 84 TRP 84 445 445 TRP TRP A . n |
| A 1 85 GLU 85 446 446 GLU GLU A . n |
| A 1 86 THR 86 447 447 THR THR A . n |
| A 1 87 THR 87 448 448 THR THR A . n |
| A 1 88 ILE 88 449 449 ILE ILE A . n |
| A 1 89 GLU 89 450 450 GLU GLU A . n |
| A 1 90 ASN 90 451 451 ASN ASN A . n |
| A 1 91 PHE 91 452 452 PHE PHE A . n |
| A 1 92 HIS 92 453 453 HIS HIS A . n |
| A 1 93 VAL 93 454 454 VAL VAL A . n |
| A 1 94 VAL 94 455 455 VAL VAL A . n |
| A 1 95 GLU 95 456 456 GLU GLU A . n |
| A 1 96 THR 96 457 457 THR THR A . n |
| A 1 97 LEU 97 458 458 LEU LEU A . n |
| A 1 98 ALA 98 459 459 ALA ALA A . n |
| A 1 99 ASP 99 460 460 ASP ASP A . n |
| A 1 100 ASN 100 461 461 ASN ASN A . n |
| A 1 101 ALA 101 462 462 ALA ALA A . n |
| A 1 102 ILE 102 463 463 ILE ILE A . n |
| A 1 103 ILE 103 464 464 ILE ILE A . n |
| A 1 104 ILE 104 465 465 ILE ILE A . n |
| A 1 105 TYR 105 466 466 TYR TYR A . n |
| A 1 106 GLN 106 467 467 GLN GLN A . n |
| A 1 107 THR 107 468 468 THR THR A . n |
| A 1 108 HIS 108 469 469 HIS HIS A . n |
| A 1 109 LYS 109 470 470 LYS LYS A . n |
| A 1 110 ARG 110 471 471 ARG ARG A . n |
| A 1 111 VAL 111 472 472 VAL VAL A . n |
| A 1 112 TRP 112 473 473 TRP TRP A . n |
| A 1 113 PRO 113 474 474 PRO PRO A . n |
| A 1 114 ALA 114 475 475 ALA ALA A . n |
| A 1 115 SER 115 476 476 SER SER A . n |
| A 1 116 GLN 116 477 477 GLN GLN A . n |
| A 1 117 ARG 117 478 478 ARG ARG A . n |
| A 1 118 ASP 118 479 479 ASP ASP A . n |
| A 1 119 VAL 119 480 480 VAL VAL A . n |
| A 1 120 LEU 120 481 481 LEU LEU A . n |
| A 1 121 TYR 121 482 482 TYR TYR A . n |
| A 1 122 LEU 122 483 483 LEU LEU A . n |
| A 1 123 SER 123 484 484 SER SER A . n |
| A 1 124 VAL 124 485 485 VAL VAL A . n |
| A 1 125 ILE 125 486 486 ILE ILE A . n |
| A 1 126 ARG 126 487 487 ARG ARG A . n |
| A 1 127 LYS 127 488 488 LYS LYS A . n |
| A 1 128 ILE 128 489 489 ILE ILE A . n |
| A 1 129 PRO 129 490 490 PRO PRO A . n |
| A 1 130 ALA 130 491 491 ALA ALA A . n |
| A 1 131 LEU 131 492 492 LEU LEU A . n |
| A 1 132 THR 132 493 493 THR THR A . n |
| A 1 133 GLU 133 494 494 GLU GLU A . n |
| A 1 134 ASN 134 495 495 ASN ASN A . n |
| A 1 135 ASP 135 496 496 ASP ASP A . n |
| A 1 136 PRO 136 497 497 PRO PRO A . n |
| A 1 137 GLU 137 498 498 GLU GLU A . n |
| A 1 138 THR 138 499 499 THR THR A . n |
| A 1 139 TRP 139 500 500 TRP TRP A . n |
| A 1 140 ILE 140 501 501 ILE ILE A . n |
| A 1 141 VAL 141 502 502 VAL VAL A . n |
| A 1 142 CYS 142 503 503 CYS CYS A . n |
| A 1 143 ASN 143 504 504 ASN ASN A . n |
| A 1 144 PHE 144 505 505 PHE PHE A . n |
| A 1 145 SER 145 506 506 SER SER A . n |
| A 1 146 VAL 146 507 507 VAL VAL A . n |
| A 1 147 ASP 147 508 508 ASP ASP A . n |
| A 1 148 HIS 148 509 509 HIS HIS A . n |
| A 1 149 ASP 149 510 510 ASP ASP A . n |
| A 1 150 SER 150 511 511 SER SER A . n |
| A 1 151 ALA 151 512 512 ALA ALA A . n |
| A 1 152 PRO 152 513 513 PRO PRO A . n |
| A 1 153 LEU 153 514 514 LEU LEU A . n |
| A 1 154 ASN 154 515 515 ASN ASN A . n |
| A 1 155 ASN 155 516 516 ASN ASN A . n |
| A 1 156 ARG 156 517 517 ARG ARG A . n |
| A 1 157 CYS 157 518 518 CYS CYS A . n |
| A 1 158 VAL 158 519 519 VAL VAL A . n |
| A 1 159 ARG 159 520 520 ARG ARG A . n |
| A 1 160 ALA 160 521 521 ALA ALA A . n |
| A 1 161 LYS 161 522 522 LYS LYS A . n |
| A 1 162 ILE 162 523 523 ILE ILE A . n |
| A 1 163 ASN 163 524 524 ASN ASN A . n |
| A 1 164 VAL 164 525 525 VAL VAL A . n |
| A 1 165 ALA 165 526 526 ALA ALA A . n |
| A 1 166 MET 166 527 527 MET MET A . n |
| A 1 167 ILE 167 528 528 ILE ILE A . n |
| A 1 168 CYS 168 529 529 CYS CYS A . n |
| A 1 169 GLN 169 530 530 GLN GLN A . n |
| A 1 170 THR 170 531 531 THR THR A . n |
| A 1 171 LEU 171 532 532 LEU LEU A . n |
| A 1 172 VAL 172 533 533 VAL VAL A . n |
| A 1 173 SER 173 534 534 SER SER A . n |
| A 1 174 PRO 174 535 ? ? ? A . n |
| A 1 175 PRO 175 536 ? ? ? A . n |
| A 1 176 GLU 176 537 ? ? ? A . n |
| A 1 177 GLY 177 538 ? ? ? A . n |
| A 1 178 ASN 178 539 ? ? ? A . n |
| A 1 179 GLN 179 540 ? ? ? A . n |
| A 1 180 GLU 180 541 541 GLU GLU A . n |
| A 1 181 ILE 181 542 542 ILE ILE A . n |
| A 1 182 SER 182 543 543 SER SER A . n |
| A 1 183 ARG 183 544 544 ARG ARG A . n |
| A 1 184 ASP 184 545 545 ASP ASP A . n |
| A 1 185 ASN 185 546 546 ASN ASN A . n |
| A 1 186 ILE 186 547 547 ILE ILE A . n |
| A 1 187 LEU 187 548 548 LEU LEU A . n |
| A 1 188 CYS 188 549 549 CYS CYS A . n |
| A 1 189 LYS 189 550 550 LYS LYS A . n |
| A 1 190 ILE 190 551 551 ILE ILE A . n |
| A 1 191 THR 191 552 552 THR THR A . n |
| A 1 192 TYR 192 553 553 TYR TYR A . n |
| A 1 193 VAL 193 554 554 VAL VAL A . n |
| A 1 194 ALA 194 555 555 ALA ALA A . n |
| A 1 195 ASN 195 556 556 ASN ASN A . n |
| A 1 196 VAL 196 557 557 VAL VAL A . n |
| A 1 197 ASN 197 558 558 ASN ASN A . n |
| A 1 198 PRO 198 559 559 PRO PRO A . n |
| A 1 199 GLY 199 560 560 GLY GLY A . n |
| A 1 200 GLY 200 561 561 GLY GLY A . n |
| A 1 201 TRP 201 562 562 TRP TRP A . n |
| A 1 202 ALA 202 563 563 ALA ALA A . n |
| A 1 203 PRO 203 564 564 PRO PRO A . n |
| A 1 204 ALA 204 565 565 ALA ALA A . n |
| A 1 205 SER 205 566 566 SER SER A . n |
| A 1 206 VAL 206 567 567 VAL VAL A . n |
| A 1 207 LEU 207 568 568 LEU LEU A . n |
| A 1 208 ARG 208 569 569 ARG ARG A . n |
| A 1 209 ALA 209 570 570 ALA ALA A . n |
| A 1 210 VAL 210 571 571 VAL VAL A . n |
| A 1 211 ALA 211 572 572 ALA ALA A . n |
| A 1 212 LYS 212 573 573 LYS LYS A . n |
| A 1 213 ARG 213 574 574 ARG ARG A . n |
| A 1 214 GLU 214 575 575 GLU GLU A . n |
| A 1 215 TYR 215 576 576 TYR TYR A . n |
| A 1 216 PRO 216 577 577 PRO PRO A . n |
| A 1 217 LYS 217 578 578 LYS LYS A . n |
| A 1 218 PHE 218 579 579 PHE PHE A . n |
| A 1 219 LEU 219 580 580 LEU LEU A . n |
| A 1 220 LYS 220 581 581 LYS LYS A . n |
| A 1 221 ARG 221 582 582 ARG ARG A . n |
| A 1 222 PHE 222 583 583 PHE PHE A . n |
| A 1 223 THR 223 584 584 THR THR A . n |
| A 1 224 SER 224 585 585 SER SER A . n |
| A 1 225 TYR 225 586 586 TYR TYR A . n |
| A 1 226 VAL 226 587 587 VAL VAL A . n |
| A 1 227 GLN 227 588 588 GLN GLN A . n |
| A 1 228 GLU 228 589 589 GLU GLU A . n |
| A 1 229 LYS 229 590 590 LYS LYS A . n |
| A 1 230 THR 230 591 591 THR THR A . n |
| A 1 231 ALA 231 592 592 ALA ALA A . n |
| A 1 232 GLY 232 593 593 GLY GLY A . n |
| A 1 233 LYS 233 594 594 LYS LYS A . n |
| A 1 234 PRO 234 595 595 PRO PRO A . n |
| A 1 235 ILE 235 596 596 ILE ILE A . n |
| A 1 236 LEU 236 597 597 LEU LEU A . n |
| A 1 237 PHE 237 598 598 PHE PHE A . n |
| |
| loop_ |
| _pdbx_nonpoly_scheme.asym_id |
| _pdbx_nonpoly_scheme.entity_id |
| _pdbx_nonpoly_scheme.mon_id |
| _pdbx_nonpoly_scheme.ndb_seq_num |
| _pdbx_nonpoly_scheme.pdb_seq_num |
| _pdbx_nonpoly_scheme.auth_seq_num |
| _pdbx_nonpoly_scheme.pdb_mon_id |
| _pdbx_nonpoly_scheme.auth_mon_id |
| _pdbx_nonpoly_scheme.pdb_strand_id |
| _pdbx_nonpoly_scheme.pdb_ins_code |
| B 2 9N0 1 600 600 9N0 EXB A . |
| C 3 HOH 1 701 102 HOH HOH A . |
| C 3 HOH 2 702 112 HOH HOH A . |
| C 3 HOH 3 703 101 HOH HOH A . |
| C 3 HOH 4 704 81 HOH HOH A . |
| C 3 HOH 5 705 86 HOH HOH A . |
| C 3 HOH 6 706 10 HOH HOH A . |
| C 3 HOH 7 707 22 HOH HOH A . |
| C 3 HOH 8 708 48 HOH HOH A . |
| C 3 HOH 9 709 95 HOH HOH A . |
| C 3 HOH 10 710 44 HOH HOH A . |
| C 3 HOH 11 711 114 HOH HOH A . |
| C 3 HOH 12 712 113 HOH HOH A . |
| C 3 HOH 13 713 94 HOH HOH A . |
| C 3 HOH 14 714 49 HOH HOH A . |
| C 3 HOH 15 715 70 HOH HOH A . |
| C 3 HOH 16 716 2 HOH HOH A . |
| C 3 HOH 17 717 8 HOH HOH A . |
| C 3 HOH 18 718 5 HOH HOH A . |
| C 3 HOH 19 719 76 HOH HOH A . |
| C 3 HOH 20 720 43 HOH HOH A . |
| C 3 HOH 21 721 15 HOH HOH A . |
| C 3 HOH 22 722 33 HOH HOH A . |
| C 3 HOH 23 723 20 HOH HOH A . |
| C 3 HOH 24 724 29 HOH HOH A . |
| C 3 HOH 25 725 38 HOH HOH A . |
| C 3 HOH 26 726 78 HOH HOH A . |
| C 3 HOH 27 727 56 HOH HOH A . |
| C 3 HOH 28 728 68 HOH HOH A . |
| C 3 HOH 29 729 31 HOH HOH A . |
| C 3 HOH 30 730 109 HOH HOH A . |
| C 3 HOH 31 731 108 HOH HOH A . |
| C 3 HOH 32 732 71 HOH HOH A . |
| C 3 HOH 33 733 1 HOH HOH A . |
| C 3 HOH 34 734 34 HOH HOH A . |
| C 3 HOH 35 735 6 HOH HOH A . |
| C 3 HOH 36 736 39 HOH HOH A . |
| C 3 HOH 37 737 37 HOH HOH A . |
| C 3 HOH 38 738 41 HOH HOH A . |
| C 3 HOH 39 739 90 HOH HOH A . |
| C 3 HOH 40 740 3 HOH HOH A . |
| C 3 HOH 41 741 30 HOH HOH A . |
| C 3 HOH 42 742 57 HOH HOH A . |
| C 3 HOH 43 743 106 HOH HOH A . |
| C 3 HOH 44 744 85 HOH HOH A . |
| C 3 HOH 45 745 45 HOH HOH A . |
| C 3 HOH 46 746 47 HOH HOH A . |
| C 3 HOH 47 747 74 HOH HOH A . |
| C 3 HOH 48 748 24 HOH HOH A . |
| C 3 HOH 49 749 83 HOH HOH A . |
| C 3 HOH 50 750 16 HOH HOH A . |
| C 3 HOH 51 751 7 HOH HOH A . |
| C 3 HOH 52 752 26 HOH HOH A . |
| C 3 HOH 53 753 97 HOH HOH A . |
| C 3 HOH 54 754 14 HOH HOH A . |
| C 3 HOH 55 755 11 HOH HOH A . |
| C 3 HOH 56 756 67 HOH HOH A . |
| C 3 HOH 57 757 66 HOH HOH A . |
| C 3 HOH 58 758 12 HOH HOH A . |
| C 3 HOH 59 759 4 HOH HOH A . |
| C 3 HOH 60 760 88 HOH HOH A . |
| C 3 HOH 61 761 103 HOH HOH A . |
| C 3 HOH 62 762 9 HOH HOH A . |
| C 3 HOH 63 763 59 HOH HOH A . |
| C 3 HOH 64 764 21 HOH HOH A . |
| C 3 HOH 65 765 23 HOH HOH A . |
| C 3 HOH 66 766 32 HOH HOH A . |
| C 3 HOH 67 767 87 HOH HOH A . |
| C 3 HOH 68 768 28 HOH HOH A . |
| C 3 HOH 69 769 13 HOH HOH A . |
| C 3 HOH 70 770 18 HOH HOH A . |
| C 3 HOH 71 771 53 HOH HOH A . |
| C 3 HOH 72 772 51 HOH HOH A . |
| C 3 HOH 73 773 55 HOH HOH A . |
| C 3 HOH 74 774 75 HOH HOH A . |
| C 3 HOH 75 775 104 HOH HOH A . |
| C 3 HOH 76 776 107 HOH HOH A . |
| C 3 HOH 77 777 58 HOH HOH A . |
| C 3 HOH 78 778 42 HOH HOH A . |
| C 3 HOH 79 779 36 HOH HOH A . |
| C 3 HOH 80 780 25 HOH HOH A . |
| C 3 HOH 81 781 27 HOH HOH A . |
| C 3 HOH 82 782 19 HOH HOH A . |
| C 3 HOH 83 783 35 HOH HOH A . |
| C 3 HOH 84 784 110 HOH HOH A . |
| C 3 HOH 85 785 50 HOH HOH A . |
| C 3 HOH 86 786 61 HOH HOH A . |
| C 3 HOH 87 787 46 HOH HOH A . |
| C 3 HOH 88 788 79 HOH HOH A . |
| C 3 HOH 89 789 89 HOH HOH A . |
| C 3 HOH 90 790 105 HOH HOH A . |
| C 3 HOH 91 791 17 HOH HOH A . |
| C 3 HOH 92 792 77 HOH HOH A . |
| C 3 HOH 93 793 69 HOH HOH A . |
| C 3 HOH 94 794 82 HOH HOH A . |
| C 3 HOH 95 795 84 HOH HOH A . |
| C 3 HOH 96 796 93 HOH HOH A . |
| C 3 HOH 97 797 62 HOH HOH A . |
| C 3 HOH 98 798 52 HOH HOH A . |
| C 3 HOH 99 799 54 HOH HOH A . |
| C 3 HOH 100 800 63 HOH HOH A . |
| C 3 HOH 101 801 65 HOH HOH A . |
| C 3 HOH 102 802 64 HOH HOH A . |
| C 3 HOH 103 803 100 HOH HOH A . |
| C 3 HOH 104 804 60 HOH HOH A . |
| C 3 HOH 105 805 98 HOH HOH A . |
| C 3 HOH 106 806 72 HOH HOH A . |
| C 3 HOH 107 807 73 HOH HOH A . |
| C 3 HOH 108 808 111 HOH HOH A . |
| |
| loop_ |
| _pdbx_unobs_or_zero_occ_atoms.id |
| _pdbx_unobs_or_zero_occ_atoms.PDB_model_num |
| _pdbx_unobs_or_zero_occ_atoms.polymer_flag |
| _pdbx_unobs_or_zero_occ_atoms.occupancy_flag |
| _pdbx_unobs_or_zero_occ_atoms.auth_asym_id |
| _pdbx_unobs_or_zero_occ_atoms.auth_comp_id |
| _pdbx_unobs_or_zero_occ_atoms.auth_seq_id |
| _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code |
| _pdbx_unobs_or_zero_occ_atoms.auth_atom_id |
| _pdbx_unobs_or_zero_occ_atoms.label_alt_id |
| _pdbx_unobs_or_zero_occ_atoms.label_asym_id |
| _pdbx_unobs_or_zero_occ_atoms.label_comp_id |
| _pdbx_unobs_or_zero_occ_atoms.label_seq_id |
| _pdbx_unobs_or_zero_occ_atoms.label_atom_id |
| 1 1 Y 1 A GLN 369 ? CD ? A GLN 8 CD |
| 2 1 Y 1 A GLN 369 ? OE1 ? A GLN 8 OE1 |
| 3 1 Y 1 A GLN 369 ? NE2 ? A GLN 8 NE2 |
| 4 1 Y 1 A GLU 494 ? CG ? A GLU 133 CG |
| 5 1 Y 1 A GLU 494 ? CD ? A GLU 133 CD |
| 6 1 Y 1 A GLU 494 ? OE1 ? A GLU 133 OE1 |
| 7 1 Y 1 A GLU 494 ? OE2 ? A GLU 133 OE2 |
| 8 1 Y 1 A LYS 594 ? CD ? A LYS 233 CD |
| 9 1 Y 1 A LYS 594 ? CE ? A LYS 233 CE |
| 10 1 Y 1 A LYS 594 ? NZ ? A LYS 233 NZ |
| |
| loop_ |
| _software.citation_id |
| _software.classification |
| _software.compiler_name |
| _software.compiler_version |
| _software.contact_author |
| _software.contact_author_email |
| _software.date |
| _software.description |
| _software.dependencies |
| _software.hardware |
| _software.language |
| _software.location |
| _software.mods |
| _software.name |
| _software.os |
| _software.os_version |
| _software.type |
| _software.version |
| _software.pdbx_ordinal |
| ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? MOSFLM ? ? ? 7.2.1 1 |
| ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? 0.5.32 2 |
| ? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0222 3 |
| ? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.24 4 |
| ? phasing ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? . 5 |
| |
| _cell.angle_alpha 90.000 |
| _cell.angle_alpha_esd ? |
| _cell.angle_beta 90.000 |
| _cell.angle_beta_esd ? |
| _cell.angle_gamma 90.000 |
| _cell.angle_gamma_esd ? |
| _cell.entry_id 5ZYH |
| _cell.details ? |
| _cell.formula_units_Z ? |
| _cell.length_a 60.090 |
| _cell.length_a_esd ? |
| _cell.length_b 60.090 |
| _cell.length_b_esd ? |
| _cell.length_c 153.770 |
| _cell.length_c_esd ? |
| _cell.volume ? |
| _cell.volume_esd ? |
| _cell.Z_PDB 8 |
| _cell.reciprocal_angle_alpha ? |
| _cell.reciprocal_angle_beta ? |
| _cell.reciprocal_angle_gamma ? |
| _cell.reciprocal_angle_alpha_esd ? |
| _cell.reciprocal_angle_beta_esd ? |
| _cell.reciprocal_angle_gamma_esd ? |
| _cell.reciprocal_length_a ? |
| _cell.reciprocal_length_b ? |
| _cell.reciprocal_length_c ? |
| _cell.reciprocal_length_a_esd ? |
| _cell.reciprocal_length_b_esd ? |
| _cell.reciprocal_length_c_esd ? |
| _cell.pdbx_unique_axis ? |
| |
| _symmetry.entry_id 5ZYH |
| _symmetry.cell_setting ? |
| _symmetry.Int_Tables_number 92 |
| _symmetry.space_group_name_Hall ? |
| _symmetry.space_group_name_H-M 'P 41 21 2' |
| _symmetry.pdbx_full_space_group_name_H-M ? |
| |
| _exptl.absorpt_coefficient_mu ? |
| _exptl.absorpt_correction_T_max ? |
| _exptl.absorpt_correction_T_min ? |
| _exptl.absorpt_correction_type ? |
| _exptl.absorpt_process_details ? |
| _exptl.entry_id 5ZYH |
| _exptl.crystals_number 1 |
| _exptl.details ? |
| _exptl.method 'X-RAY DIFFRACTION' |
| _exptl.method_details ? |
| |
| _exptl_crystal.colour ? |
| _exptl_crystal.density_diffrn ? |
| _exptl_crystal.density_Matthews 2.57 |
| _exptl_crystal.density_method ? |
| _exptl_crystal.density_percent_sol 52.05 |
| _exptl_crystal.description ? |
| _exptl_crystal.F_000 ? |
| _exptl_crystal.id 1 |
| _exptl_crystal.preparation ? |
| _exptl_crystal.size_max ? |
| _exptl_crystal.size_mid ? |
| _exptl_crystal.size_min ? |
| _exptl_crystal.size_rad ? |
| _exptl_crystal.colour_lustre ? |
| _exptl_crystal.colour_modifier ? |
| _exptl_crystal.colour_primary ? |
| _exptl_crystal.density_meas ? |
| _exptl_crystal.density_meas_esd ? |
| _exptl_crystal.density_meas_gt ? |
| _exptl_crystal.density_meas_lt ? |
| _exptl_crystal.density_meas_temp ? |
| _exptl_crystal.density_meas_temp_esd ? |
| _exptl_crystal.density_meas_temp_gt ? |
| _exptl_crystal.density_meas_temp_lt ? |
| _exptl_crystal.pdbx_crystal_image_url ? |
| _exptl_crystal.pdbx_crystal_image_format ? |
| _exptl_crystal.pdbx_mosaicity ? |
| _exptl_crystal.pdbx_mosaicity_esd ? |
| |
| _exptl_crystal_grow.apparatus ? |
| _exptl_crystal_grow.atmosphere ? |
| _exptl_crystal_grow.crystal_id 1 |
| _exptl_crystal_grow.details ? |
| _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' |
| _exptl_crystal_grow.method_ref ? |
| _exptl_crystal_grow.pH 5.9 |
| _exptl_crystal_grow.pressure ? |
| _exptl_crystal_grow.pressure_esd ? |
| _exptl_crystal_grow.seeding ? |
| _exptl_crystal_grow.seeding_ref ? |
| _exptl_crystal_grow.temp 293 |
| _exptl_crystal_grow.temp_details ? |
| _exptl_crystal_grow.temp_esd ? |
| _exptl_crystal_grow.time ? |
| _exptl_crystal_grow.pdbx_details |
| '0.1M trisodium citrate/HCl buffer, pH 5.9, containing 24% PEG3350 and 0.2% n-octyl-beta-D-glucoside' |
| _exptl_crystal_grow.pdbx_pH_range ? |
| |
| _diffrn.ambient_environment ? |
| _diffrn.ambient_temp 100 |
| _diffrn.ambient_temp_details ? |
| _diffrn.ambient_temp_esd ? |
| _diffrn.crystal_id 1 |
| _diffrn.crystal_support ? |
| _diffrn.crystal_treatment ? |
| _diffrn.details ? |
| _diffrn.id 1 |
| _diffrn.ambient_pressure ? |
| _diffrn.ambient_pressure_esd ? |
| _diffrn.ambient_pressure_gt ? |
| _diffrn.ambient_pressure_lt ? |
| _diffrn.ambient_temp_gt ? |
| _diffrn.ambient_temp_lt ? |
| |
| _diffrn_detector.details ? |
| _diffrn_detector.detector 'IMAGE PLATE' |
| _diffrn_detector.diffrn_id 1 |
| _diffrn_detector.type 'RIGAKU RAXIS IV' |
| _diffrn_detector.area_resol_mean ? |
| _diffrn_detector.dtime ? |
| _diffrn_detector.pdbx_frames_total ? |
| _diffrn_detector.pdbx_collection_time_total ? |
| _diffrn_detector.pdbx_collection_date 2016-01-15 |
| |
| _diffrn_radiation.collimation ? |
| _diffrn_radiation.diffrn_id 1 |
| _diffrn_radiation.filter_edge ? |
| _diffrn_radiation.inhomogeneity ? |
| _diffrn_radiation.monochromator mirror |
| _diffrn_radiation.polarisn_norm ? |
| _diffrn_radiation.polarisn_ratio ? |
| _diffrn_radiation.probe ? |
| _diffrn_radiation.type ? |
| _diffrn_radiation.xray_symbol ? |
| _diffrn_radiation.wavelength_id 1 |
| _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M |
| _diffrn_radiation.pdbx_wavelength_list ? |
| _diffrn_radiation.pdbx_wavelength ? |
| _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' |
| _diffrn_radiation.pdbx_analyzer ? |
| _diffrn_radiation.pdbx_scattering_type x-ray |
| |
| _diffrn_radiation_wavelength.id 1 |
| _diffrn_radiation_wavelength.wavelength 1.5418 |
| _diffrn_radiation_wavelength.wt 1.0 |
| |
| _diffrn_source.current ? |
| _diffrn_source.details ? |
| _diffrn_source.diffrn_id 1 |
| _diffrn_source.power ? |
| _diffrn_source.size ? |
| _diffrn_source.source 'ROTATING ANODE' |
| _diffrn_source.target ? |
| _diffrn_source.type 'RIGAKU FR-E SUPERBRIGHT' |
| _diffrn_source.voltage ? |
| _diffrn_source.take-off_angle ? |
| _diffrn_source.pdbx_wavelength_list 1.5418 |
| _diffrn_source.pdbx_wavelength ? |
| _diffrn_source.pdbx_synchrotron_beamline ? |
| _diffrn_source.pdbx_synchrotron_site ? |
| |
| _reflns.B_iso_Wilson_estimate ? |
| _reflns.entry_id 5ZYH |
| _reflns.data_reduction_details ? |
| _reflns.data_reduction_method ? |
| _reflns.d_resolution_high 1.950 |
| _reflns.d_resolution_low 55.970 |
| _reflns.details ? |
| _reflns.limit_h_max ? |
| _reflns.limit_h_min ? |
| _reflns.limit_k_max ? |
| _reflns.limit_k_min ? |
| _reflns.limit_l_max ? |
| _reflns.limit_l_min ? |
| _reflns.number_all ? |
| _reflns.number_obs 21424 |
| _reflns.observed_criterion ? |
| _reflns.observed_criterion_F_max ? |
| _reflns.observed_criterion_F_min ? |
| _reflns.observed_criterion_I_max ? |
| _reflns.observed_criterion_I_min ? |
| _reflns.observed_criterion_sigma_F ? |
| _reflns.observed_criterion_sigma_I ? |
| _reflns.percent_possible_obs 100.000 |
| _reflns.R_free_details ? |
| _reflns.Rmerge_F_all ? |
| _reflns.Rmerge_F_obs ? |
| _reflns.Friedel_coverage ? |
| _reflns.number_gt ? |
| _reflns.threshold_expression ? |
| _reflns.pdbx_redundancy 3.800 |
| _reflns.pdbx_Rmerge_I_obs 0.063 |
| _reflns.pdbx_Rmerge_I_all ? |
| _reflns.pdbx_Rsym_value ? |
| _reflns.pdbx_netI_over_av_sigmaI ? |
| _reflns.pdbx_netI_over_sigmaI 14.500 |
| _reflns.pdbx_res_netI_over_av_sigmaI_2 ? |
| _reflns.pdbx_res_netI_over_sigmaI_2 ? |
| _reflns.pdbx_chi_squared ? |
| _reflns.pdbx_scaling_rejects 268 |
| _reflns.pdbx_d_res_high_opt ? |
| _reflns.pdbx_d_res_low_opt ? |
| _reflns.pdbx_d_res_opt_method ? |
| _reflns.phase_calculation_details ? |
| _reflns.pdbx_Rrim_I_all 0.074 |
| _reflns.pdbx_Rpim_I_all 0.038 |
| _reflns.pdbx_d_opt ? |
| _reflns.pdbx_number_measured_all 81037 |
| _reflns.pdbx_diffrn_id 1 |
| _reflns.pdbx_ordinal 1 |
| _reflns.pdbx_CC_half 0.992 |
| _reflns.pdbx_R_split ? |
| |
| loop_ |
| _reflns_shell.d_res_high |
| _reflns_shell.d_res_low |
| _reflns_shell.meanI_over_sigI_all |
| _reflns_shell.meanI_over_sigI_obs |
| _reflns_shell.number_measured_all |
| _reflns_shell.number_measured_obs |
| _reflns_shell.number_possible |
| _reflns_shell.number_unique_all |
| _reflns_shell.number_unique_obs |
| _reflns_shell.percent_possible_all |
| _reflns_shell.percent_possible_obs |
| _reflns_shell.Rmerge_F_all |
| _reflns_shell.Rmerge_F_obs |
| _reflns_shell.Rmerge_I_all |
| _reflns_shell.Rmerge_I_obs |
| _reflns_shell.meanI_over_sigI_gt |
| _reflns_shell.meanI_over_uI_all |
| _reflns_shell.meanI_over_uI_gt |
| _reflns_shell.number_measured_gt |
| _reflns_shell.number_unique_gt |
| _reflns_shell.percent_possible_gt |
| _reflns_shell.Rmerge_F_gt |
| _reflns_shell.Rmerge_I_gt |
| _reflns_shell.pdbx_redundancy |
| _reflns_shell.pdbx_Rsym_value |
| _reflns_shell.pdbx_chi_squared |
| _reflns_shell.pdbx_netI_over_sigmaI_all |
| _reflns_shell.pdbx_netI_over_sigmaI_obs |
| _reflns_shell.pdbx_Rrim_I_all |
| _reflns_shell.pdbx_Rpim_I_all |
| _reflns_shell.pdbx_rejects |
| _reflns_shell.pdbx_ordinal |
| _reflns_shell.pdbx_diffrn_id |
| _reflns_shell.pdbx_CC_half |
| _reflns_shell.pdbx_R_split |
| 1.950 2.000 ? ? ? ? ? ? 1481 100.000 ? ? ? ? 0.414 ? ? ? ? ? ? ? ? 3.800 ? ? ? ? 0.483 0.243 ? 1 1 0.799 ? |
| 8.940 55.970 ? ? ? ? ? ? 280 99.200 ? ? ? ? 0.043 ? ? ? ? ? ? ? ? 3.100 ? ? ? ? 0.055 0.033 ? 2 1 0.970 ? |
| |
| _refine.aniso_B[1][1] 0.1200 |
| _refine.aniso_B[1][2] -0.0000 |
| _refine.aniso_B[1][3] -0.0000 |
| _refine.aniso_B[2][2] 0.1200 |
| _refine.aniso_B[2][3] -0.0000 |
| _refine.aniso_B[3][3] -0.2300 |
| _refine.B_iso_max 98.780 |
| _refine.B_iso_mean 31.5470 |
| _refine.B_iso_min 11.470 |
| _refine.correlation_coeff_Fo_to_Fc 0.9460 |
| _refine.correlation_coeff_Fo_to_Fc_free 0.9310 |
| _refine.details 'U VALUES : REFINED INDIVIDUALLY' |
| _refine.diff_density_max ? |
| _refine.diff_density_max_esd ? |
| _refine.diff_density_min ? |
| _refine.diff_density_min_esd ? |
| _refine.diff_density_rms ? |
| _refine.diff_density_rms_esd ? |
| _refine.entry_id 5ZYH |
| _refine.pdbx_refine_id 'X-RAY DIFFRACTION' |
| _refine.ls_abs_structure_details ? |
| _refine.ls_abs_structure_Flack ? |
| _refine.ls_abs_structure_Flack_esd ? |
| _refine.ls_abs_structure_Rogers ? |
| _refine.ls_abs_structure_Rogers_esd ? |
| _refine.ls_d_res_high 1.9500 |
| _refine.ls_d_res_low 25.0000 |
| _refine.ls_extinction_coef ? |
| _refine.ls_extinction_coef_esd ? |
| _refine.ls_extinction_expression ? |
| _refine.ls_extinction_method ? |
| _refine.ls_goodness_of_fit_all ? |
| _refine.ls_goodness_of_fit_all_esd ? |
| _refine.ls_goodness_of_fit_obs ? |
| _refine.ls_goodness_of_fit_obs_esd ? |
| _refine.ls_hydrogen_treatment ? |
| _refine.ls_matrix_type ? |
| _refine.ls_number_constraints ? |
| _refine.ls_number_parameters ? |
| _refine.ls_number_reflns_all ? |
| _refine.ls_number_reflns_obs 20280 |
| _refine.ls_number_reflns_R_free 1074 |
| _refine.ls_number_reflns_R_work ? |
| _refine.ls_number_restraints ? |
| _refine.ls_percent_reflns_obs 99.8500 |
| _refine.ls_percent_reflns_R_free 5.0000 |
| _refine.ls_R_factor_all ? |
| _refine.ls_R_factor_obs 0.2140 |
| _refine.ls_R_factor_R_free 0.2524 |
| _refine.ls_R_factor_R_free_error ? |
| _refine.ls_R_factor_R_free_error_details ? |
| _refine.ls_R_factor_R_work 0.2121 |
| _refine.ls_R_Fsqd_factor_obs ? |
| _refine.ls_R_I_factor_obs ? |
| _refine.ls_redundancy_reflns_all ? |
| _refine.ls_redundancy_reflns_obs ? |
| _refine.ls_restrained_S_all ? |
| _refine.ls_restrained_S_obs ? |
| _refine.ls_shift_over_esd_max ? |
| _refine.ls_shift_over_esd_mean ? |
| _refine.ls_structure_factor_coef ? |
| _refine.ls_weighting_details ? |
| _refine.ls_weighting_scheme ? |
| _refine.ls_wR_factor_all ? |
| _refine.ls_wR_factor_obs ? |
| _refine.ls_wR_factor_R_free ? |
| _refine.ls_wR_factor_R_work ? |
| _refine.occupancy_max ? |
| _refine.occupancy_min ? |
| _refine.solvent_model_details ? |
| _refine.solvent_model_param_bsol ? |
| _refine.solvent_model_param_ksol ? |
| _refine.ls_R_factor_gt ? |
| _refine.ls_goodness_of_fit_gt ? |
| _refine.ls_goodness_of_fit_ref ? |
| _refine.ls_shift_over_su_max ? |
| _refine.ls_shift_over_su_max_lt ? |
| _refine.ls_shift_over_su_mean ? |
| _refine.ls_shift_over_su_mean_lt ? |
| _refine.pdbx_ls_sigma_I ? |
| _refine.pdbx_ls_sigma_F 0.000 |
| _refine.pdbx_ls_sigma_Fsqd ? |
| _refine.pdbx_data_cutoff_high_absF ? |
| _refine.pdbx_data_cutoff_high_rms_absF ? |
| _refine.pdbx_data_cutoff_low_absF ? |
| _refine.pdbx_isotropic_thermal_model ? |
| _refine.pdbx_ls_cross_valid_method THROUGHOUT |
| _refine.pdbx_method_to_determine_struct ? |
| _refine.pdbx_starting_model ? |
| _refine.pdbx_stereochemistry_target_values ? |
| _refine.pdbx_R_Free_selection_details RANDOM |
| _refine.pdbx_stereochem_target_val_spec_case ? |
| _refine.pdbx_overall_ESU_R 0.1680 |
| _refine.pdbx_overall_ESU_R_Free 0.1570 |
| _refine.pdbx_solvent_vdw_probe_radii 1.2000 |
| _refine.pdbx_solvent_ion_probe_radii 0.8000 |
| _refine.pdbx_solvent_shrinkage_radii 0.8000 |
| _refine.pdbx_real_space_R ? |
| _refine.pdbx_density_correlation ? |
| _refine.pdbx_pd_number_of_powder_patterns ? |
| _refine.pdbx_pd_number_of_points ? |
| _refine.pdbx_pd_meas_number_of_points ? |
| _refine.pdbx_pd_proc_ls_prof_R_factor ? |
| _refine.pdbx_pd_proc_ls_prof_wR_factor ? |
| _refine.pdbx_pd_Marquardt_correlation_coeff ? |
| _refine.pdbx_pd_Fsqrd_R_factor ? |
| _refine.pdbx_pd_ls_matrix_band_width ? |
| _refine.pdbx_overall_phase_error ? |
| _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? |
| _refine.pdbx_overall_SU_R_free_Blow_DPI ? |
| _refine.pdbx_overall_SU_R_Blow_DPI ? |
| _refine.pdbx_TLS_residual_ADP_flag ? |
| _refine.pdbx_diffrn_id 1 |
| _refine.overall_SU_B 4.3290 |
| _refine.overall_SU_ML 0.1180 |
| _refine.overall_SU_R_Cruickshank_DPI ? |
| _refine.overall_SU_R_free ? |
| _refine.overall_FOM_free_R_set ? |
| _refine.overall_FOM_work_R_set ? |
| _refine.pdbx_average_fsc_overall ? |
| _refine.pdbx_average_fsc_work ? |
| _refine.pdbx_average_fsc_free ? |
| |
| _refine_hist.cycle_id final |
| _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' |
| _refine_hist.d_res_high 1.9500 |
| _refine_hist.d_res_low 25.0000 |
| _refine_hist.pdbx_number_atoms_ligand 31 |
| _refine_hist.number_atoms_solvent 108 |
| _refine_hist.number_atoms_total 1974 |
| _refine_hist.pdbx_number_residues_total 228 |
| _refine_hist.pdbx_B_iso_mean_ligand 46.36 |
| _refine_hist.pdbx_B_iso_mean_solvent 34.36 |
| _refine_hist.pdbx_number_atoms_protein 1835 |
| _refine_hist.pdbx_number_atoms_nucleic_acid 0 |
| |
| loop_ |
| _refine_ls_restr.pdbx_refine_id |
| _refine_ls_restr.criterion |
| _refine_ls_restr.dev_ideal |
| _refine_ls_restr.dev_ideal_target |
| _refine_ls_restr.number |
| _refine_ls_restr.rejects |
| _refine_ls_restr.type |
| _refine_ls_restr.weight |
| _refine_ls_restr.pdbx_restraint_function |
| 'X-RAY DIFFRACTION' ? 0.009 0.012 1915 ? r_bond_refined_d ? ? |
| 'X-RAY DIFFRACTION' ? 1.889 1.662 2610 ? r_angle_refined_deg ? ? |
| 'X-RAY DIFFRACTION' ? 7.346 5.000 225 ? r_dihedral_angle_1_deg ? ? |
| 'X-RAY DIFFRACTION' ? 28.793 22.381 105 ? r_dihedral_angle_2_deg ? ? |
| 'X-RAY DIFFRACTION' ? 17.339 15.000 318 ? r_dihedral_angle_3_deg ? ? |
| 'X-RAY DIFFRACTION' ? 16.619 15.000 13 ? r_dihedral_angle_4_deg ? ? |
| 'X-RAY DIFFRACTION' ? 0.116 0.200 252 ? r_chiral_restr ? ? |
| 'X-RAY DIFFRACTION' ? 0.009 0.020 1431 ? r_gen_planes_refined ? ? |
| |
| _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' |
| _refine_ls_shell.d_res_high 1.9500 |
| _refine_ls_shell.d_res_low 2.0180 |
| _refine_ls_shell.number_reflns_all 2038 |
| _refine_ls_shell.number_reflns_obs ? |
| _refine_ls_shell.number_reflns_R_free 117 |
| _refine_ls_shell.number_reflns_R_work 1921 |
| _refine_ls_shell.percent_reflns_obs 99.8500 |
| _refine_ls_shell.percent_reflns_R_free ? |
| _refine_ls_shell.R_factor_all ? |
| _refine_ls_shell.R_factor_obs ? |
| _refine_ls_shell.R_factor_R_free 0.3670 |
| _refine_ls_shell.R_factor_R_free_error 0.0000 |
| _refine_ls_shell.R_factor_R_work 0.2950 |
| _refine_ls_shell.redundancy_reflns_all ? |
| _refine_ls_shell.redundancy_reflns_obs ? |
| _refine_ls_shell.wR_factor_all ? |
| _refine_ls_shell.wR_factor_obs ? |
| _refine_ls_shell.wR_factor_R_free ? |
| _refine_ls_shell.wR_factor_R_work ? |
| _refine_ls_shell.pdbx_total_number_of_bins_used 15 |
| _refine_ls_shell.pdbx_phase_error ? |
| _refine_ls_shell.pdbx_fsc_work ? |
| _refine_ls_shell.pdbx_fsc_free ? |
| |
| _struct.entry_id 5ZYH |
| _struct.title 'Crystal structure of CERT START domain in complex with compound E5' |
| _struct.pdbx_model_details ? |
| _struct.pdbx_formula_weight ? |
| _struct.pdbx_formula_weight_method ? |
| _struct.pdbx_model_type_details ? |
| _struct.pdbx_CASP_flag N |
| |
| _struct_keywords.entry_id 5ZYH |
| _struct_keywords.text 'CERT, PH, START, COMPLEX, LIPID TRANSPORT' |
| _struct_keywords.pdbx_keywords 'LIPID TRANSPORT' |
| |
| loop_ |
| _struct_asym.id |
| _struct_asym.pdbx_blank_PDB_chainid_flag |
| _struct_asym.pdbx_modified |
| _struct_asym.entity_id |
| _struct_asym.details |
| A N N 1 ? |
| B N N 2 ? |
| C N N 3 ? |
| |
| _struct_ref.id 1 |
| _struct_ref.db_name UNP |
| _struct_ref.db_code C43BP_HUMAN |
| _struct_ref.pdbx_db_accession Q9Y5P4 |
| _struct_ref.pdbx_db_isoform Q9Y5P4-2 |
| _struct_ref.entity_id 1 |
| _struct_ref.pdbx_seq_one_letter_code |
| ;THRFVQKVEEMVQNHMTYSLQDVGGDANWQLVVEEGEMKVYRREVEENGIVLDPLKATHAVKGVTGHEVCNYFWNVDVRN |
| DWETTIENFHVVETLADNAIIIYQTHKRVWPASQRDVLYLSVIRKIPALTENDPETWIVCNFSVDHDSAPLNNRCVRAKI |
| NVAMICQTLVSPPEGNQEISRDNILCKITYVANVNPGGWAPASVLRAVAKREYPKFLKRFTSYVQEKTAGKPILF |
| ; |
| _struct_ref.pdbx_align_begin 364 |
| |
| _struct_ref_seq.align_id 1 |
| _struct_ref_seq.ref_id 1 |
| _struct_ref_seq.pdbx_PDB_id_code 5ZYH |
| _struct_ref_seq.pdbx_strand_id A |
| _struct_ref_seq.seq_align_beg 3 |
| _struct_ref_seq.pdbx_seq_align_beg_ins_code ? |
| _struct_ref_seq.seq_align_end 237 |
| _struct_ref_seq.pdbx_seq_align_end_ins_code ? |
| _struct_ref_seq.pdbx_db_accession Q9Y5P4 |
| _struct_ref_seq.db_align_beg 364 |
| _struct_ref_seq.pdbx_db_align_beg_ins_code ? |
| _struct_ref_seq.db_align_end 598 |
| _struct_ref_seq.pdbx_db_align_end_ins_code ? |
| _struct_ref_seq.pdbx_auth_seq_align_beg 364 |
| _struct_ref_seq.pdbx_auth_seq_align_end 598 |
| |
| loop_ |
| _struct_ref_seq_dif.align_id |
| _struct_ref_seq_dif.pdbx_pdb_id_code |
| _struct_ref_seq_dif.mon_id |
| _struct_ref_seq_dif.pdbx_pdb_strand_id |
| _struct_ref_seq_dif.seq_num |
| _struct_ref_seq_dif.pdbx_pdb_ins_code |
| _struct_ref_seq_dif.pdbx_seq_db_name |
| _struct_ref_seq_dif.pdbx_seq_db_accession_code |
| _struct_ref_seq_dif.db_mon_id |
| _struct_ref_seq_dif.pdbx_seq_db_seq_num |
| _struct_ref_seq_dif.details |
| _struct_ref_seq_dif.pdbx_auth_seq_num |
| _struct_ref_seq_dif.pdbx_ordinal |
| 1 5ZYH GLY A 1 ? UNP Q9Y5P4 ? ? conflict 362 1 |
| 1 5ZYH PRO A 2 ? UNP Q9Y5P4 ? ? conflict 363 2 |
| |
| _pdbx_struct_assembly.id 1 |
| _pdbx_struct_assembly.details author_defined_assembly |
| _pdbx_struct_assembly.method_details ? |
| _pdbx_struct_assembly.oligomeric_details monomeric |
| _pdbx_struct_assembly.oligomeric_count 1 |
| |
| loop_ |
| _pdbx_struct_assembly_prop.biol_id |
| _pdbx_struct_assembly_prop.type |
| _pdbx_struct_assembly_prop.value |
| _pdbx_struct_assembly_prop.details |
| 1 'ABSA (A^2)' 0 ? |
| 1 MORE 0 ? |
| 1 'SSA (A^2)' 11650 ? |
| |
| _pdbx_struct_assembly_gen.assembly_id 1 |
| _pdbx_struct_assembly_gen.oper_expression 1 |
| _pdbx_struct_assembly_gen.asym_id_list A,B,C |
| |
| _pdbx_struct_assembly_auth_evidence.id 1 |
| _pdbx_struct_assembly_auth_evidence.assembly_id 1 |
| _pdbx_struct_assembly_auth_evidence.experimental_support none |
| _pdbx_struct_assembly_auth_evidence.details ? |
| |
| _pdbx_struct_oper_list.id 1 |
| _pdbx_struct_oper_list.type 'identity operation' |
| _pdbx_struct_oper_list.name 1_555 |
| _pdbx_struct_oper_list.symmetry_operation x,y,z |
| _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 |
| _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 |
| _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 |
| _pdbx_struct_oper_list.vector[1] 0.0000000000 |
| _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 |
| _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 |
| _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 |
| _pdbx_struct_oper_list.vector[2] 0.0000000000 |
| _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 |
| _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 |
| _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 |
| _pdbx_struct_oper_list.vector[3] 0.0000000000 |
| |
| loop_ |
| _struct_conf.conf_type_id |
| _struct_conf.id |
| _struct_conf.pdbx_PDB_helix_id |
| _struct_conf.beg_label_comp_id |
| _struct_conf.beg_label_asym_id |
| _struct_conf.beg_label_seq_id |
| _struct_conf.pdbx_beg_PDB_ins_code |
| _struct_conf.end_label_comp_id |
| _struct_conf.end_label_asym_id |
| _struct_conf.end_label_seq_id |
| _struct_conf.pdbx_end_PDB_ins_code |
| _struct_conf.beg_auth_comp_id |
| _struct_conf.beg_auth_asym_id |
| _struct_conf.beg_auth_seq_id |
| _struct_conf.end_auth_comp_id |
| _struct_conf.end_auth_asym_id |
| _struct_conf.end_auth_seq_id |
| _struct_conf.pdbx_PDB_helix_class |
| _struct_conf.details |
| _struct_conf.pdbx_PDB_helix_length |
| HELX_P HELX_P1 AA1 PHE A 6 ? SER A 21 ? PHE A 367 SER A 382 1 ? 16 |
| HELX_P HELX_P2 AA2 THR A 67 ? ASN A 77 ? THR A 428 ASN A 438 1 ? 11 |
| HELX_P HELX_P3 AA3 VAL A 80 ? GLU A 85 ? VAL A 441 GLU A 446 1 ? 6 |
| HELX_P HELX_P4 AA4 SER A 182 ? ASP A 184 ? SER A 543 ASP A 545 5 ? 3 |
| HELX_P HELX_P5 AA5 PRO A 203 ? ALA A 231 ? PRO A 564 ALA A 592 1 ? 29 |
| |
| _struct_conf_type.id HELX_P |
| _struct_conf_type.criteria ? |
| _struct_conf_type.reference ? |
| |
| _struct_mon_prot_cis.pdbx_id 1 |
| _struct_mon_prot_cis.label_comp_id TRP |
| _struct_mon_prot_cis.label_seq_id 112 |
| _struct_mon_prot_cis.label_asym_id A |
| _struct_mon_prot_cis.label_alt_id . |
| _struct_mon_prot_cis.pdbx_PDB_ins_code ? |
| _struct_mon_prot_cis.auth_comp_id TRP |
| _struct_mon_prot_cis.auth_seq_id 473 |
| _struct_mon_prot_cis.auth_asym_id A |
| _struct_mon_prot_cis.pdbx_label_comp_id_2 PRO |
| _struct_mon_prot_cis.pdbx_label_seq_id_2 113 |
| _struct_mon_prot_cis.pdbx_label_asym_id_2 A |
| _struct_mon_prot_cis.pdbx_PDB_ins_code_2 ? |
| _struct_mon_prot_cis.pdbx_auth_comp_id_2 PRO |
| _struct_mon_prot_cis.pdbx_auth_seq_id_2 474 |
| _struct_mon_prot_cis.pdbx_auth_asym_id_2 A |
| _struct_mon_prot_cis.pdbx_PDB_model_num 1 |
| _struct_mon_prot_cis.pdbx_omega_angle 0.38 |
| |
| loop_ |
| _struct_sheet.id |
| _struct_sheet.type |
| _struct_sheet.number_strands |
| _struct_sheet.details |
| AA1 ? 9 ? |
| AA2 ? 8 ? |
| AA3 ? 2 ? |
| |
| loop_ |
| _struct_sheet_order.sheet_id |
| _struct_sheet_order.range_id_1 |
| _struct_sheet_order.range_id_2 |
| _struct_sheet_order.offset |
| _struct_sheet_order.sense |
| AA1 1 2 ? anti-parallel |
| AA1 2 3 ? anti-parallel |
| AA1 3 4 ? anti-parallel |
| AA1 4 5 ? anti-parallel |
| AA1 5 6 ? anti-parallel |
| AA1 6 7 ? anti-parallel |
| AA1 7 8 ? anti-parallel |
| AA1 8 9 ? anti-parallel |
| AA2 1 2 ? anti-parallel |
| AA2 2 3 ? anti-parallel |
| AA2 3 4 ? anti-parallel |
| AA2 4 5 ? anti-parallel |
| AA2 5 6 ? anti-parallel |
| AA2 6 7 ? anti-parallel |
| AA2 7 8 ? parallel |
| AA3 1 2 ? anti-parallel |
| |
| loop_ |
| _struct_sheet_range.sheet_id |
| _struct_sheet_range.id |
| _struct_sheet_range.beg_label_comp_id |
| _struct_sheet_range.beg_label_asym_id |
| _struct_sheet_range.beg_label_seq_id |
| _struct_sheet_range.pdbx_beg_PDB_ins_code |
| _struct_sheet_range.end_label_comp_id |
| _struct_sheet_range.end_label_asym_id |
| _struct_sheet_range.end_label_seq_id |
| _struct_sheet_range.pdbx_end_PDB_ins_code |
| _struct_sheet_range.beg_auth_comp_id |
| _struct_sheet_range.beg_auth_asym_id |
| _struct_sheet_range.beg_auth_seq_id |
| _struct_sheet_range.end_auth_comp_id |
| _struct_sheet_range.end_auth_asym_id |
| _struct_sheet_range.end_auth_seq_id |
| AA1 1 GLN A 32 ? GLU A 37 ? GLN A 393 GLU A 398 |
| AA1 2 MET A 40 ? ARG A 44 ? MET A 401 ARG A 405 |
| AA1 3 LEU A 57 ? LYS A 64 ? LEU A 418 LYS A 425 |
| AA1 4 ILE A 186 ? ASN A 197 ? ILE A 547 ASN A 558 |
| AA1 5 LYS A 161 ? VAL A 172 ? LYS A 522 VAL A 533 |
| AA1 6 THR A 138 ? SER A 145 ? THR A 499 SER A 506 |
| AA1 7 GLN A 116 ? ILE A 128 ? GLN A 477 ILE A 489 |
| AA1 8 ALA A 101 ? HIS A 108 ? ALA A 462 HIS A 469 |
| AA1 9 ILE A 88 ? ALA A 98 ? ILE A 449 ALA A 459 |
| AA2 1 GLN A 32 ? GLU A 37 ? GLN A 393 GLU A 398 |
| AA2 2 MET A 40 ? ARG A 44 ? MET A 401 ARG A 405 |
| AA2 3 LEU A 57 ? LYS A 64 ? LEU A 418 LYS A 425 |
| AA2 4 ILE A 186 ? ASN A 197 ? ILE A 547 ASN A 558 |
| AA2 5 LYS A 161 ? VAL A 172 ? LYS A 522 VAL A 533 |
| AA2 6 THR A 138 ? SER A 145 ? THR A 499 SER A 506 |
| AA2 7 GLN A 116 ? ILE A 128 ? GLN A 477 ILE A 489 |
| AA2 8 CYS A 157 ? ARG A 159 ? CYS A 518 ARG A 520 |
| AA3 1 GLU A 48 ? GLU A 49 ? GLU A 409 GLU A 410 |
| AA3 2 ILE A 52 ? VAL A 53 ? ILE A 413 VAL A 414 |
| |
| loop_ |
| _pdbx_struct_sheet_hbond.sheet_id |
| _pdbx_struct_sheet_hbond.range_id_1 |
| _pdbx_struct_sheet_hbond.range_id_2 |
| _pdbx_struct_sheet_hbond.range_1_label_atom_id |
| _pdbx_struct_sheet_hbond.range_1_label_comp_id |
| _pdbx_struct_sheet_hbond.range_1_label_asym_id |
| _pdbx_struct_sheet_hbond.range_1_label_seq_id |
| _pdbx_struct_sheet_hbond.range_1_PDB_ins_code |
| _pdbx_struct_sheet_hbond.range_1_auth_atom_id |
| _pdbx_struct_sheet_hbond.range_1_auth_comp_id |
| _pdbx_struct_sheet_hbond.range_1_auth_asym_id |
| _pdbx_struct_sheet_hbond.range_1_auth_seq_id |
| _pdbx_struct_sheet_hbond.range_2_label_atom_id |
| _pdbx_struct_sheet_hbond.range_2_label_comp_id |
| _pdbx_struct_sheet_hbond.range_2_label_asym_id |
| _pdbx_struct_sheet_hbond.range_2_label_seq_id |
| _pdbx_struct_sheet_hbond.range_2_PDB_ins_code |
| _pdbx_struct_sheet_hbond.range_2_auth_atom_id |
| _pdbx_struct_sheet_hbond.range_2_auth_comp_id |
| _pdbx_struct_sheet_hbond.range_2_auth_asym_id |
| _pdbx_struct_sheet_hbond.range_2_auth_seq_id |
| AA1 1 2 N VAL A 35 ? N VAL A 396 O VAL A 42 ? O VAL A 403 |
| AA1 2 3 N TYR A 43 ? N TYR A 404 O LYS A 58 ? O LYS A 419 |
| AA1 3 4 N ALA A 59 ? N ALA A 420 O TYR A 192 ? O TYR A 553 |
| AA1 4 5 O ASN A 197 ? O ASN A 558 N LYS A 161 ? N LYS A 522 |
| AA1 5 6 O CYS A 168 ? O CYS A 529 N TRP A 139 ? N TRP A 500 |
| AA1 6 7 O THR A 138 ? O THR A 499 N ILE A 128 ? N ILE A 489 |
| AA1 7 8 O TYR A 121 ? O TYR A 482 N ILE A 104 ? N ILE A 465 |
| AA1 8 9 O TYR A 105 ? O TYR A 466 N HIS A 92 ? N HIS A 453 |
| AA2 1 2 N VAL A 35 ? N VAL A 396 O VAL A 42 ? O VAL A 403 |
| AA2 2 3 N TYR A 43 ? N TYR A 404 O LYS A 58 ? O LYS A 419 |
| AA2 3 4 N ALA A 59 ? N ALA A 420 O TYR A 192 ? O TYR A 553 |
| AA2 4 5 O ASN A 197 ? O ASN A 558 N LYS A 161 ? N LYS A 522 |
| AA2 5 6 O CYS A 168 ? O CYS A 529 N TRP A 139 ? N TRP A 500 |
| AA2 6 7 O THR A 138 ? O THR A 499 N ILE A 128 ? N ILE A 489 |
| AA2 7 8 N GLN A 116 ? N GLN A 477 O VAL A 158 ? O VAL A 519 |
| AA3 1 2 N GLU A 49 ? N GLU A 410 O ILE A 52 ? O ILE A 413 |
| |
| _struct_site.id AC1 |
| _struct_site.pdbx_evidence_code Software |
| _struct_site.pdbx_auth_asym_id A |
| _struct_site.pdbx_auth_comp_id 9N0 |
| _struct_site.pdbx_auth_seq_id 600 |
| _struct_site.pdbx_auth_ins_code ? |
| _struct_site.pdbx_num_residues 10 |
| _struct_site.details 'binding site for residue 9N0 A 600' |
| |
| loop_ |
| _struct_site_gen.id |
| _struct_site_gen.site_id |
| _struct_site_gen.pdbx_num_res |
| _struct_site_gen.label_comp_id |
| _struct_site_gen.label_asym_id |
| _struct_site_gen.label_seq_id |
| _struct_site_gen.pdbx_auth_ins_code |
| _struct_site_gen.auth_comp_id |
| _struct_site_gen.auth_asym_id |
| _struct_site_gen.auth_seq_id |
| _struct_site_gen.label_atom_id |
| _struct_site_gen.label_alt_id |
| _struct_site_gen.symmetry |
| _struct_site_gen.details |
| 1 AC1 10 PHE A 75 ? PHE A 436 . ? 1_555 ? |
| 2 AC1 10 GLU A 85 ? GLU A 446 . ? 1_555 ? |
| 3 AC1 10 GLN A 106 ? GLN A 467 . ? 1_555 ? |
| 4 AC1 10 VAL A 111 ? VAL A 472 . ? 1_555 ? |
| 5 AC1 10 ARG A 117 ? ARG A 478 . ? 1_555 ? |
| 6 AC1 10 ASN A 143 ? ASN A 504 . ? 1_555 ? |
| 7 AC1 10 VAL A 164 ? VAL A 525 . ? 1_555 ? |
| 8 AC1 10 TYR A 192 ? TYR A 553 . ? 1_555 ? |
| 9 AC1 10 TYR A 215 ? TYR A 576 . ? 1_555 ? |
| 10 AC1 10 HOH C . ? HOH A 702 . ? 1_555 ? |
| |
| loop_ |
| _pdbx_validate_close_contact.id |
| _pdbx_validate_close_contact.PDB_model_num |
| _pdbx_validate_close_contact.auth_atom_id_1 |
| _pdbx_validate_close_contact.auth_asym_id_1 |
| _pdbx_validate_close_contact.auth_comp_id_1 |
| _pdbx_validate_close_contact.auth_seq_id_1 |
| _pdbx_validate_close_contact.PDB_ins_code_1 |
| _pdbx_validate_close_contact.label_alt_id_1 |
| _pdbx_validate_close_contact.auth_atom_id_2 |
| _pdbx_validate_close_contact.auth_asym_id_2 |
| _pdbx_validate_close_contact.auth_comp_id_2 |
| _pdbx_validate_close_contact.auth_seq_id_2 |
| _pdbx_validate_close_contact.PDB_ins_code_2 |
| _pdbx_validate_close_contact.label_alt_id_2 |
| _pdbx_validate_close_contact.dist |
| 1 1 OE1 A GLU 410 ? ? O A HOH 701 ? ? 1.99 |
| 2 1 N1 A 9N0 600 ? ? O A HOH 702 ? ? 2.19 |
| |
| _pdbx_validate_rmsd_angle.id 1 |
| _pdbx_validate_rmsd_angle.PDB_model_num 1 |
| _pdbx_validate_rmsd_angle.auth_atom_id_1 CB |
| _pdbx_validate_rmsd_angle.auth_asym_id_1 A |
| _pdbx_validate_rmsd_angle.auth_comp_id_1 LYS |
| _pdbx_validate_rmsd_angle.auth_seq_id_1 594 |
| _pdbx_validate_rmsd_angle.PDB_ins_code_1 ? |
| _pdbx_validate_rmsd_angle.label_alt_id_1 ? |
| _pdbx_validate_rmsd_angle.auth_atom_id_2 CA |
| _pdbx_validate_rmsd_angle.auth_asym_id_2 A |
| _pdbx_validate_rmsd_angle.auth_comp_id_2 LYS |
| _pdbx_validate_rmsd_angle.auth_seq_id_2 594 |
| _pdbx_validate_rmsd_angle.PDB_ins_code_2 ? |
| _pdbx_validate_rmsd_angle.label_alt_id_2 ? |
| _pdbx_validate_rmsd_angle.auth_atom_id_3 C |
| _pdbx_validate_rmsd_angle.auth_asym_id_3 A |
| _pdbx_validate_rmsd_angle.auth_comp_id_3 LYS |
| _pdbx_validate_rmsd_angle.auth_seq_id_3 594 |
| _pdbx_validate_rmsd_angle.PDB_ins_code_3 ? |
| _pdbx_validate_rmsd_angle.label_alt_id_3 ? |
| _pdbx_validate_rmsd_angle.angle_value 124.20 |
| _pdbx_validate_rmsd_angle.angle_target_value 110.40 |
| _pdbx_validate_rmsd_angle.angle_deviation 13.80 |
| _pdbx_validate_rmsd_angle.angle_standard_deviation 2.00 |
| _pdbx_validate_rmsd_angle.linker_flag N |
| |
| loop_ |
| _pdbx_validate_torsion.id |
| _pdbx_validate_torsion.PDB_model_num |
| _pdbx_validate_torsion.auth_comp_id |
| _pdbx_validate_torsion.auth_asym_id |
| _pdbx_validate_torsion.auth_seq_id |
| _pdbx_validate_torsion.PDB_ins_code |
| _pdbx_validate_torsion.label_alt_id |
| _pdbx_validate_torsion.phi |
| _pdbx_validate_torsion.psi |
| 1 1 ASP A 416 ? ? -23.29 105.92 |
| 2 1 ALA A 459 ? ? -171.41 -178.89 |
| |
| _pdbx_entry_details.compound_details ? |
| _pdbx_entry_details.entry_id 5ZYH |
| _pdbx_entry_details.nonpolymer_details ? |
| _pdbx_entry_details.sequence_details |
| ;Two residues GLY362A and PRO363A are originated from protease site after N-terminal affinity tag. |
|
|
| THIS SEQUENCE CORRESPONDS TO THE ISOFORM 2 FOUND IN UNP Q9Y5P4. |
| ; |
| _pdbx_entry_details.source_details ? |
| _pdbx_entry_details.has_ligand_of_interest ? |
| |
| loop_ |
| _pdbx_unobs_or_zero_occ_residues.id |
| _pdbx_unobs_or_zero_occ_residues.PDB_model_num |
| _pdbx_unobs_or_zero_occ_residues.polymer_flag |
| _pdbx_unobs_or_zero_occ_residues.occupancy_flag |
| _pdbx_unobs_or_zero_occ_residues.auth_asym_id |
| _pdbx_unobs_or_zero_occ_residues.auth_comp_id |
| _pdbx_unobs_or_zero_occ_residues.auth_seq_id |
| _pdbx_unobs_or_zero_occ_residues.PDB_ins_code |
| _pdbx_unobs_or_zero_occ_residues.label_asym_id |
| _pdbx_unobs_or_zero_occ_residues.label_comp_id |
| _pdbx_unobs_or_zero_occ_residues.label_seq_id |
| 1 1 Y 1 A GLY 362 ? A GLY 1 |
| 2 1 Y 1 A PRO 363 ? A PRO 2 |
| 3 1 Y 1 A GLY 387 ? A GLY 26 |
| 4 1 Y 1 A PRO 535 ? A PRO 174 |
| 5 1 Y 1 A PRO 536 ? A PRO 175 |
| 6 1 Y 1 A GLU 537 ? A GLU 176 |
| 7 1 Y 1 A GLY 538 ? A GLY 177 |
| 8 1 Y 1 A ASN 539 ? A ASN 178 |
| 9 1 Y 1 A GLN 540 ? A GLN 179 |
| |
| loop_ |
| _chem_comp_atom.comp_id |
| _chem_comp_atom.atom_id |
| _chem_comp_atom.type_symbol |
| _chem_comp_atom.pdbx_aromatic_flag |
| _chem_comp_atom.pdbx_stereo_config |
| _chem_comp_atom.pdbx_ordinal |
| 9N0 C5 C Y N 1 |
| 9N0 C4 C Y N 2 |
| 9N0 C3 C Y N 3 |
| 9N0 C6 C Y N 4 |
| 9N0 C11 C Y N 5 |
| 9N0 C10 C Y N 6 |
| 9N0 C1 C Y N 7 |
| 9N0 C8 C Y N 8 |
| 9N0 C12 C Y N 9 |
| 9N0 O1 O N N 10 |
| 9N0 S1 S N N 11 |
| 9N0 O2 O N N 12 |
| 9N0 C20 C N N 13 |
| 9N0 C21 C N N 14 |
| 9N0 O3 O N N 15 |
| 9N0 C7 C Y N 16 |
| 9N0 C9 C Y N 17 |
| 9N0 C23 C Y N 18 |
| 9N0 C24 C N N 19 |
| 9N0 C27 C N N 20 |
| 9N0 C26 C N N 21 |
| 9N0 C25 C N N 22 |
| 9N0 C13 C N R 23 |
| 9N0 C22 C N N 24 |
| 9N0 C14 C N S 25 |
| 9N0 C18 C Y N 26 |
| 9N0 N1 N Y N 27 |
| 9N0 C19 C Y N 28 |
| 9N0 C15 C Y N 29 |
| 9N0 C16 C Y N 30 |
| 9N0 C17 C Y N 31 |
| 9N0 H1 H N N 32 |
| 9N0 H2 H N N 33 |
| 9N0 H3 H N N 34 |
| 9N0 H4 H N N 35 |
| 9N0 H5 H N N 36 |
| 9N0 H6 H N N 37 |
| 9N0 H7 H N N 38 |
| 9N0 H8 H N N 39 |
| 9N0 H9 H N N 40 |
| 9N0 H10 H N N 41 |
| 9N0 H11 H N N 42 |
| 9N0 H12 H N N 43 |
| 9N0 H13 H N N 44 |
| 9N0 H14 H N N 45 |
| 9N0 H15 H N N 46 |
| 9N0 H16 H N N 47 |
| 9N0 H17 H N N 48 |
| 9N0 H18 H N N 49 |
| 9N0 H19 H N N 50 |
| 9N0 H20 H N N 51 |
| 9N0 H21 H N N 52 |
| 9N0 H22 H N N 53 |
| 9N0 H23 H N N 54 |
| 9N0 H24 H N N 55 |
| 9N0 H25 H N N 56 |
| 9N0 H26 H N N 57 |
| 9N0 H27 H N N 58 |
| 9N0 H28 H N N 59 |
| 9N0 H29 H N N 60 |
| ALA N N N N 61 |
| ALA CA C N S 62 |
| ALA C C N N 63 |
| ALA O O N N 64 |
| ALA CB C N N 65 |
| ALA OXT O N N 66 |
| ALA H H N N 67 |
| ALA H2 H N N 68 |
| ALA HA H N N 69 |
| ALA HB1 H N N 70 |
| ALA HB2 H N N 71 |
| ALA HB3 H N N 72 |
| ALA HXT H N N 73 |
| ARG N N N N 74 |
| ARG CA C N S 75 |
| ARG C C N N 76 |
| ARG O O N N 77 |
| ARG CB C N N 78 |
| ARG CG C N N 79 |
| ARG CD C N N 80 |
| ARG NE N N N 81 |
| ARG CZ C N N 82 |
| ARG NH1 N N N 83 |
| ARG NH2 N N N 84 |
| ARG OXT O N N 85 |
| ARG H H N N 86 |
| ARG H2 H N N 87 |
| ARG HA H N N 88 |
| ARG HB2 H N N 89 |
| ARG HB3 H N N 90 |
| ARG HG2 H N N 91 |
| ARG HG3 H N N 92 |
| ARG HD2 H N N 93 |
| ARG HD3 H N N 94 |
| ARG HE H N N 95 |
| ARG HH11 H N N 96 |
| ARG HH12 H N N 97 |
| ARG HH21 H N N 98 |
| ARG HH22 H N N 99 |
| ARG HXT H N N 100 |
| ASN N N N N 101 |
| ASN CA C N S 102 |
| ASN C C N N 103 |
| ASN O O N N 104 |
| ASN CB C N N 105 |
| ASN CG C N N 106 |
| ASN OD1 O N N 107 |
| ASN ND2 N N N 108 |
| ASN OXT O N N 109 |
| ASN H H N N 110 |
| ASN H2 H N N 111 |
| ASN HA H N N 112 |
| ASN HB2 H N N 113 |
| ASN HB3 H N N 114 |
| ASN HD21 H N N 115 |
| ASN HD22 H N N 116 |
| ASN HXT H N N 117 |
| ASP N N N N 118 |
| ASP CA C N S 119 |
| ASP C C N N 120 |
| ASP O O N N 121 |
| ASP CB C N N 122 |
| ASP CG C N N 123 |
| ASP OD1 O N N 124 |
| ASP OD2 O N N 125 |
| ASP OXT O N N 126 |
| ASP H H N N 127 |
| ASP H2 H N N 128 |
| ASP HA H N N 129 |
| ASP HB2 H N N 130 |
| ASP HB3 H N N 131 |
| ASP HD2 H N N 132 |
| ASP HXT H N N 133 |
| CYS N N N N 134 |
| CYS CA C N R 135 |
| CYS C C N N 136 |
| CYS O O N N 137 |
| CYS CB C N N 138 |
| CYS SG S N N 139 |
| CYS OXT O N N 140 |
| CYS H H N N 141 |
| CYS H2 H N N 142 |
| CYS HA H N N 143 |
| CYS HB2 H N N 144 |
| CYS HB3 H N N 145 |
| CYS HG H N N 146 |
| CYS HXT H N N 147 |
| GLN N N N N 148 |
| GLN CA C N S 149 |
| GLN C C N N 150 |
| GLN O O N N 151 |
| GLN CB C N N 152 |
| GLN CG C N N 153 |
| GLN CD C N N 154 |
| GLN OE1 O N N 155 |
| GLN NE2 N N N 156 |
| GLN OXT O N N 157 |
| GLN H H N N 158 |
| GLN H2 H N N 159 |
| GLN HA H N N 160 |
| GLN HB2 H N N 161 |
| GLN HB3 H N N 162 |
| GLN HG2 H N N 163 |
| GLN HG3 H N N 164 |
| GLN HE21 H N N 165 |
| GLN HE22 H N N 166 |
| GLN HXT H N N 167 |
| GLU N N N N 168 |
| GLU CA C N S 169 |
| GLU C C N N 170 |
| GLU O O N N 171 |
| GLU CB C N N 172 |
| GLU CG C N N 173 |
| GLU CD C N N 174 |
| GLU OE1 O N N 175 |
| GLU OE2 O N N 176 |
| GLU OXT O N N 177 |
| GLU H H N N 178 |
| GLU H2 H N N 179 |
| GLU HA H N N 180 |
| GLU HB2 H N N 181 |
| GLU HB3 H N N 182 |
| GLU HG2 H N N 183 |
| GLU HG3 H N N 184 |
| GLU HE2 H N N 185 |
| GLU HXT H N N 186 |
| GLY N N N N 187 |
| GLY CA C N N 188 |
| GLY C C N N 189 |
| GLY O O N N 190 |
| GLY OXT O N N 191 |
| GLY H H N N 192 |
| GLY H2 H N N 193 |
| GLY HA2 H N N 194 |
| GLY HA3 H N N 195 |
| GLY HXT H N N 196 |
| HIS N N N N 197 |
| HIS CA C N S 198 |
| HIS C C N N 199 |
| HIS O O N N 200 |
| HIS CB C N N 201 |
| HIS CG C Y N 202 |
| HIS ND1 N Y N 203 |
| HIS CD2 C Y N 204 |
| HIS CE1 C Y N 205 |
| HIS NE2 N Y N 206 |
| HIS OXT O N N 207 |
| HIS H H N N 208 |
| HIS H2 H N N 209 |
| HIS HA H N N 210 |
| HIS HB2 H N N 211 |
| HIS HB3 H N N 212 |
| HIS HD1 H N N 213 |
| HIS HD2 H N N 214 |
| HIS HE1 H N N 215 |
| HIS HE2 H N N 216 |
| HIS HXT H N N 217 |
| HOH O O N N 218 |
| HOH H1 H N N 219 |
| HOH H2 H N N 220 |
| ILE N N N N 221 |
| ILE CA C N S 222 |
| ILE C C N N 223 |
| ILE O O N N 224 |
| ILE CB C N S 225 |
| ILE CG1 C N N 226 |
| ILE CG2 C N N 227 |
| ILE CD1 C N N 228 |
| ILE OXT O N N 229 |
| ILE H H N N 230 |
| ILE H2 H N N 231 |
| ILE HA H N N 232 |
| ILE HB H N N 233 |
| ILE HG12 H N N 234 |
| ILE HG13 H N N 235 |
| ILE HG21 H N N 236 |
| ILE HG22 H N N 237 |
| ILE HG23 H N N 238 |
| ILE HD11 H N N 239 |
| ILE HD12 H N N 240 |
| ILE HD13 H N N 241 |
| ILE HXT H N N 242 |
| LEU N N N N 243 |
| LEU CA C N S 244 |
| LEU C C N N 245 |
| LEU O O N N 246 |
| LEU CB C N N 247 |
| LEU CG C N N 248 |
| LEU CD1 C N N 249 |
| LEU CD2 C N N 250 |
| LEU OXT O N N 251 |
| LEU H H N N 252 |
| LEU H2 H N N 253 |
| LEU HA H N N 254 |
| LEU HB2 H N N 255 |
| LEU HB3 H N N 256 |
| LEU HG H N N 257 |
| LEU HD11 H N N 258 |
| LEU HD12 H N N 259 |
| LEU HD13 H N N 260 |
| LEU HD21 H N N 261 |
| LEU HD22 H N N 262 |
| LEU HD23 H N N 263 |
| LEU HXT H N N 264 |
| LYS N N N N 265 |
| LYS CA C N S 266 |
| LYS C C N N 267 |
| LYS O O N N 268 |
| LYS CB C N N 269 |
| LYS CG C N N 270 |
| LYS CD C N N 271 |
| LYS CE C N N 272 |
| LYS NZ N N N 273 |
| LYS OXT O N N 274 |
| LYS H H N N 275 |
| LYS H2 H N N 276 |
| LYS HA H N N 277 |
| LYS HB2 H N N 278 |
| LYS HB3 H N N 279 |
| LYS HG2 H N N 280 |
| LYS HG3 H N N 281 |
| LYS HD2 H N N 282 |
| LYS HD3 H N N 283 |
| LYS HE2 H N N 284 |
| LYS HE3 H N N 285 |
| LYS HZ1 H N N 286 |
| LYS HZ2 H N N 287 |
| LYS HZ3 H N N 288 |
| LYS HXT H N N 289 |
| MET N N N N 290 |
| MET CA C N S 291 |
| MET C C N N 292 |
| MET O O N N 293 |
| MET CB C N N 294 |
| MET CG C N N 295 |
| MET SD S N N 296 |
| MET CE C N N 297 |
| MET OXT O N N 298 |
| MET H H N N 299 |
| MET H2 H N N 300 |
| MET HA H N N 301 |
| MET HB2 H N N 302 |
| MET HB3 H N N 303 |
| MET HG2 H N N 304 |
| MET HG3 H N N 305 |
| MET HE1 H N N 306 |
| MET HE2 H N N 307 |
| MET HE3 H N N 308 |
| MET HXT H N N 309 |
| PHE N N N N 310 |
| PHE CA C N S 311 |
| PHE C C N N 312 |
| PHE O O N N 313 |
| PHE CB C N N 314 |
| PHE CG C Y N 315 |
| PHE CD1 C Y N 316 |
| PHE CD2 C Y N 317 |
| PHE CE1 C Y N 318 |
| PHE CE2 C Y N 319 |
| PHE CZ C Y N 320 |
| PHE OXT O N N 321 |
| PHE H H N N 322 |
| PHE H2 H N N 323 |
| PHE HA H N N 324 |
| PHE HB2 H N N 325 |
| PHE HB3 H N N 326 |
| PHE HD1 H N N 327 |
| PHE HD2 H N N 328 |
| PHE HE1 H N N 329 |
| PHE HE2 H N N 330 |
| PHE HZ H N N 331 |
| PHE HXT H N N 332 |
| PRO N N N N 333 |
| PRO CA C N S 334 |
| PRO C C N N 335 |
| PRO O O N N 336 |
| PRO CB C N N 337 |
| PRO CG C N N 338 |
| PRO CD C N N 339 |
| PRO OXT O N N 340 |
| PRO H H N N 341 |
| PRO HA H N N 342 |
| PRO HB2 H N N 343 |
| PRO HB3 H N N 344 |
| PRO HG2 H N N 345 |
| PRO HG3 H N N 346 |
| PRO HD2 H N N 347 |
| PRO HD3 H N N 348 |
| PRO HXT H N N 349 |
| SER N N N N 350 |
| SER CA C N S 351 |
| SER C C N N 352 |
| SER O O N N 353 |
| SER CB C N N 354 |
| SER OG O N N 355 |
| SER OXT O N N 356 |
| SER H H N N 357 |
| SER H2 H N N 358 |
| SER HA H N N 359 |
| SER HB2 H N N 360 |
| SER HB3 H N N 361 |
| SER HG H N N 362 |
| SER HXT H N N 363 |
| THR N N N N 364 |
| THR CA C N S 365 |
| THR C C N N 366 |
| THR O O N N 367 |
| THR CB C N R 368 |
| THR OG1 O N N 369 |
| THR CG2 C N N 370 |
| THR OXT O N N 371 |
| THR H H N N 372 |
| THR H2 H N N 373 |
| THR HA H N N 374 |
| THR HB H N N 375 |
| THR HG1 H N N 376 |
| THR HG21 H N N 377 |
| THR HG22 H N N 378 |
| THR HG23 H N N 379 |
| THR HXT H N N 380 |
| TRP N N N N 381 |
| TRP CA C N S 382 |
| TRP C C N N 383 |
| TRP O O N N 384 |
| TRP CB C N N 385 |
| TRP CG C Y N 386 |
| TRP CD1 C Y N 387 |
| TRP CD2 C Y N 388 |
| TRP NE1 N Y N 389 |
| TRP CE2 C Y N 390 |
| TRP CE3 C Y N 391 |
| TRP CZ2 C Y N 392 |
| TRP CZ3 C Y N 393 |
| TRP CH2 C Y N 394 |
| TRP OXT O N N 395 |
| TRP H H N N 396 |
| TRP H2 H N N 397 |
| TRP HA H N N 398 |
| TRP HB2 H N N 399 |
| TRP HB3 H N N 400 |
| TRP HD1 H N N 401 |
| TRP HE1 H N N 402 |
| TRP HE3 H N N 403 |
| TRP HZ2 H N N 404 |
| TRP HZ3 H N N 405 |
| TRP HH2 H N N 406 |
| TRP HXT H N N 407 |
| TYR N N N N 408 |
| TYR CA C N S 409 |
| TYR C C N N 410 |
| TYR O O N N 411 |
| TYR CB C N N 412 |
| TYR CG C Y N 413 |
| TYR CD1 C Y N 414 |
| TYR CD2 C Y N 415 |
| TYR CE1 C Y N 416 |
| TYR CE2 C Y N 417 |
| TYR CZ C Y N 418 |
| TYR OH O N N 419 |
| TYR OXT O N N 420 |
| TYR H H N N 421 |
| TYR H2 H N N 422 |
| TYR HA H N N 423 |
| TYR HB2 H N N 424 |
| TYR HB3 H N N 425 |
| TYR HD1 H N N 426 |
| TYR HD2 H N N 427 |
| TYR HE1 H N N 428 |
| TYR HE2 H N N 429 |
| TYR HH H N N 430 |
| TYR HXT H N N 431 |
| VAL N N N N 432 |
| VAL CA C N S 433 |
| VAL C C N N 434 |
| VAL O O N N 435 |
| VAL CB C N N 436 |
| VAL CG1 C N N 437 |
| VAL CG2 C N N 438 |
| VAL OXT O N N 439 |
| VAL H H N N 440 |
| VAL H2 H N N 441 |
| VAL HA H N N 442 |
| VAL HB H N N 443 |
| VAL HG11 H N N 444 |
| VAL HG12 H N N 445 |
| VAL HG13 H N N 446 |
| VAL HG21 H N N 447 |
| VAL HG22 H N N 448 |
| VAL HG23 H N N 449 |
| VAL HXT H N N 450 |
| |
| loop_ |
| _chem_comp_bond.comp_id |
| _chem_comp_bond.atom_id_1 |
| _chem_comp_bond.atom_id_2 |
| _chem_comp_bond.value_order |
| _chem_comp_bond.pdbx_aromatic_flag |
| _chem_comp_bond.pdbx_stereo_config |
| _chem_comp_bond.pdbx_ordinal |
| 9N0 C17 C16 doub Y N 1 |
| 9N0 C17 C18 sing Y N 2 |
| 9N0 C14 C18 sing N N 3 |
| 9N0 C14 C22 sing N N 4 |
| 9N0 C14 C13 sing N N 5 |
| 9N0 C16 C15 sing Y N 6 |
| 9N0 C18 N1 doub Y N 7 |
| 9N0 C22 C13 sing N N 8 |
| 9N0 C13 C4 sing N N 9 |
| 9N0 C15 C19 doub Y N 10 |
| 9N0 N1 C19 sing Y N 11 |
| 9N0 O3 C21 sing N N 12 |
| 9N0 C21 C20 sing N N 13 |
| 9N0 C4 C5 doub Y N 14 |
| 9N0 C4 C3 sing Y N 15 |
| 9N0 C5 C6 sing Y N 16 |
| 9N0 C11 C12 doub Y N 17 |
| 9N0 C11 C10 sing Y N 18 |
| 9N0 C12 C7 sing Y N 19 |
| 9N0 C3 C23 doub Y N 20 |
| 9N0 C20 S1 sing N N 21 |
| 9N0 O2 S1 doub N N 22 |
| 9N0 C6 C10 sing N N 23 |
| 9N0 C6 C1 doub Y N 24 |
| 9N0 C10 C9 doub Y N 25 |
| 9N0 C7 S1 sing N N 26 |
| 9N0 C7 C8 doub Y N 27 |
| 9N0 S1 O1 doub N N 28 |
| 9N0 C23 C1 sing Y N 29 |
| 9N0 C23 C24 sing N N 30 |
| 9N0 C9 C8 sing Y N 31 |
| 9N0 C26 C24 sing N N 32 |
| 9N0 C24 C27 sing N N 33 |
| 9N0 C24 C25 sing N N 34 |
| 9N0 C5 H1 sing N N 35 |
| 9N0 C3 H2 sing N N 36 |
| 9N0 C11 H3 sing N N 37 |
| 9N0 C1 H4 sing N N 38 |
| 9N0 C8 H5 sing N N 39 |
| 9N0 C12 H6 sing N N 40 |
| 9N0 C20 H7 sing N N 41 |
| 9N0 C20 H8 sing N N 42 |
| 9N0 C21 H9 sing N N 43 |
| 9N0 C21 H10 sing N N 44 |
| 9N0 O3 H11 sing N N 45 |
| 9N0 C9 H12 sing N N 46 |
| 9N0 C27 H13 sing N N 47 |
| 9N0 C27 H14 sing N N 48 |
| 9N0 C27 H15 sing N N 49 |
| 9N0 C26 H16 sing N N 50 |
| 9N0 C26 H17 sing N N 51 |
| 9N0 C26 H18 sing N N 52 |
| 9N0 C25 H19 sing N N 53 |
| 9N0 C25 H20 sing N N 54 |
| 9N0 C25 H21 sing N N 55 |
| 9N0 C13 H22 sing N N 56 |
| 9N0 C22 H23 sing N N 57 |
| 9N0 C22 H24 sing N N 58 |
| 9N0 C14 H25 sing N N 59 |
| 9N0 C19 H26 sing N N 60 |
| 9N0 C15 H27 sing N N 61 |
| 9N0 C16 H28 sing N N 62 |
| 9N0 C17 H29 sing N N 63 |
| ALA N CA sing N N 64 |
| ALA N H sing N N 65 |
| ALA N H2 sing N N 66 |
| ALA CA C sing N N 67 |
| ALA CA CB sing N N 68 |
| ALA CA HA sing N N 69 |
| ALA C O doub N N 70 |
| ALA C OXT sing N N 71 |
| ALA CB HB1 sing N N 72 |
| ALA CB HB2 sing N N 73 |
| ALA CB HB3 sing N N 74 |
| ALA OXT HXT sing N N 75 |
| ARG N CA sing N N 76 |
| ARG N H sing N N 77 |
| ARG N H2 sing N N 78 |
| ARG CA C sing N N 79 |
| ARG CA CB sing N N 80 |
| ARG CA HA sing N N 81 |
| ARG C O doub N N 82 |
| ARG C OXT sing N N 83 |
| ARG CB CG sing N N 84 |
| ARG CB HB2 sing N N 85 |
| ARG CB HB3 sing N N 86 |
| ARG CG CD sing N N 87 |
| ARG CG HG2 sing N N 88 |
| ARG CG HG3 sing N N 89 |
| ARG CD NE sing N N 90 |
| ARG CD HD2 sing N N 91 |
| ARG CD HD3 sing N N 92 |
| ARG NE CZ sing N N 93 |
| ARG NE HE sing N N 94 |
| ARG CZ NH1 sing N N 95 |
| ARG CZ NH2 doub N N 96 |
| ARG NH1 HH11 sing N N 97 |
| ARG NH1 HH12 sing N N 98 |
| ARG NH2 HH21 sing N N 99 |
| ARG NH2 HH22 sing N N 100 |
| ARG OXT HXT sing N N 101 |
| ASN N CA sing N N 102 |
| ASN N H sing N N 103 |
| ASN N H2 sing N N 104 |
| ASN CA C sing N N 105 |
| ASN CA CB sing N N 106 |
| ASN CA HA sing N N 107 |
| ASN C O doub N N 108 |
| ASN C OXT sing N N 109 |
| ASN CB CG sing N N 110 |
| ASN CB HB2 sing N N 111 |
| ASN CB HB3 sing N N 112 |
| ASN CG OD1 doub N N 113 |
| ASN CG ND2 sing N N 114 |
| ASN ND2 HD21 sing N N 115 |
| ASN ND2 HD22 sing N N 116 |
| ASN OXT HXT sing N N 117 |
| ASP N CA sing N N 118 |
| ASP N H sing N N 119 |
| ASP N H2 sing N N 120 |
| ASP CA C sing N N 121 |
| ASP CA CB sing N N 122 |
| ASP CA HA sing N N 123 |
| ASP C O doub N N 124 |
| ASP C OXT sing N N 125 |
| ASP CB CG sing N N 126 |
| ASP CB HB2 sing N N 127 |
| ASP CB HB3 sing N N 128 |
| ASP CG OD1 doub N N 129 |
| ASP CG OD2 sing N N 130 |
| ASP OD2 HD2 sing N N 131 |
| ASP OXT HXT sing N N 132 |
| CYS N CA sing N N 133 |
| CYS N H sing N N 134 |
| CYS N H2 sing N N 135 |
| CYS CA C sing N N 136 |
| CYS CA CB sing N N 137 |
| CYS CA HA sing N N 138 |
| CYS C O doub N N 139 |
| CYS C OXT sing N N 140 |
| CYS CB SG sing N N 141 |
| CYS CB HB2 sing N N 142 |
| CYS CB HB3 sing N N 143 |
| CYS SG HG sing N N 144 |
| CYS OXT HXT sing N N 145 |
| GLN N CA sing N N 146 |
| GLN N H sing N N 147 |
| GLN N H2 sing N N 148 |
| GLN CA C sing N N 149 |
| GLN CA CB sing N N 150 |
| GLN CA HA sing N N 151 |
| GLN C O doub N N 152 |
| GLN C OXT sing N N 153 |
| GLN CB CG sing N N 154 |
| GLN CB HB2 sing N N 155 |
| GLN CB HB3 sing N N 156 |
| GLN CG CD sing N N 157 |
| GLN CG HG2 sing N N 158 |
| GLN CG HG3 sing N N 159 |
| GLN CD OE1 doub N N 160 |
| GLN CD NE2 sing N N 161 |
| GLN NE2 HE21 sing N N 162 |
| GLN NE2 HE22 sing N N 163 |
| GLN OXT HXT sing N N 164 |
| GLU N CA sing N N 165 |
| GLU N H sing N N 166 |
| GLU N H2 sing N N 167 |
| GLU CA C sing N N 168 |
| GLU CA CB sing N N 169 |
| GLU CA HA sing N N 170 |
| GLU C O doub N N 171 |
| GLU C OXT sing N N 172 |
| GLU CB CG sing N N 173 |
| GLU CB HB2 sing N N 174 |
| GLU CB HB3 sing N N 175 |
| GLU CG CD sing N N 176 |
| GLU CG HG2 sing N N 177 |
| GLU CG HG3 sing N N 178 |
| GLU CD OE1 doub N N 179 |
| GLU CD OE2 sing N N 180 |
| GLU OE2 HE2 sing N N 181 |
| GLU OXT HXT sing N N 182 |
| GLY N CA sing N N 183 |
| GLY N H sing N N 184 |
| GLY N H2 sing N N 185 |
| GLY CA C sing N N 186 |
| GLY CA HA2 sing N N 187 |
| GLY CA HA3 sing N N 188 |
| GLY C O doub N N 189 |
| GLY C OXT sing N N 190 |
| GLY OXT HXT sing N N 191 |
| HIS N CA sing N N 192 |
| HIS N H sing N N 193 |
| HIS N H2 sing N N 194 |
| HIS CA C sing N N 195 |
| HIS CA CB sing N N 196 |
| HIS CA HA sing N N 197 |
| HIS C O doub N N 198 |
| HIS C OXT sing N N 199 |
| HIS CB CG sing N N 200 |
| HIS CB HB2 sing N N 201 |
| HIS CB HB3 sing N N 202 |
| HIS CG ND1 sing Y N 203 |
| HIS CG CD2 doub Y N 204 |
| HIS ND1 CE1 doub Y N 205 |
| HIS ND1 HD1 sing N N 206 |
| HIS CD2 NE2 sing Y N 207 |
| HIS CD2 HD2 sing N N 208 |
| HIS CE1 NE2 sing Y N 209 |
| HIS CE1 HE1 sing N N 210 |
| HIS NE2 HE2 sing N N 211 |
| HIS OXT HXT sing N N 212 |
| HOH O H1 sing N N 213 |
| HOH O H2 sing N N 214 |
| ILE N CA sing N N 215 |
| ILE N H sing N N 216 |
| ILE N H2 sing N N 217 |
| ILE CA C sing N N 218 |
| ILE CA CB sing N N 219 |
| ILE CA HA sing N N 220 |
| ILE C O doub N N 221 |
| ILE C OXT sing N N 222 |
| ILE CB CG1 sing N N 223 |
| ILE CB CG2 sing N N 224 |
| ILE CB HB sing N N 225 |
| ILE CG1 CD1 sing N N 226 |
| ILE CG1 HG12 sing N N 227 |
| ILE CG1 HG13 sing N N 228 |
| ILE CG2 HG21 sing N N 229 |
| ILE CG2 HG22 sing N N 230 |
| ILE CG2 HG23 sing N N 231 |
| ILE CD1 HD11 sing N N 232 |
| ILE CD1 HD12 sing N N 233 |
| ILE CD1 HD13 sing N N 234 |
| ILE OXT HXT sing N N 235 |
| LEU N CA sing N N 236 |
| LEU N H sing N N 237 |
| LEU N H2 sing N N 238 |
| LEU CA C sing N N 239 |
| LEU CA CB sing N N 240 |
| LEU CA HA sing N N 241 |
| LEU C O doub N N 242 |
| LEU C OXT sing N N 243 |
| LEU CB CG sing N N 244 |
| LEU CB HB2 sing N N 245 |
| LEU CB HB3 sing N N 246 |
| LEU CG CD1 sing N N 247 |
| LEU CG CD2 sing N N 248 |
| LEU CG HG sing N N 249 |
| LEU CD1 HD11 sing N N 250 |
| LEU CD1 HD12 sing N N 251 |
| LEU CD1 HD13 sing N N 252 |
| LEU CD2 HD21 sing N N 253 |
| LEU CD2 HD22 sing N N 254 |
| LEU CD2 HD23 sing N N 255 |
| LEU OXT HXT sing N N 256 |
| LYS N CA sing N N 257 |
| LYS N H sing N N 258 |
| LYS N H2 sing N N 259 |
| LYS CA C sing N N 260 |
| LYS CA CB sing N N 261 |
| LYS CA HA sing N N 262 |
| LYS C O doub N N 263 |
| LYS C OXT sing N N 264 |
| LYS CB CG sing N N 265 |
| LYS CB HB2 sing N N 266 |
| LYS CB HB3 sing N N 267 |
| LYS CG CD sing N N 268 |
| LYS CG HG2 sing N N 269 |
| LYS CG HG3 sing N N 270 |
| LYS CD CE sing N N 271 |
| LYS CD HD2 sing N N 272 |
| LYS CD HD3 sing N N 273 |
| LYS CE NZ sing N N 274 |
| LYS CE HE2 sing N N 275 |
| LYS CE HE3 sing N N 276 |
| LYS NZ HZ1 sing N N 277 |
| LYS NZ HZ2 sing N N 278 |
| LYS NZ HZ3 sing N N 279 |
| LYS OXT HXT sing N N 280 |
| MET N CA sing N N 281 |
| MET N H sing N N 282 |
| MET N H2 sing N N 283 |
| MET CA C sing N N 284 |
| MET CA CB sing N N 285 |
| MET CA HA sing N N 286 |
| MET C O doub N N 287 |
| MET C OXT sing N N 288 |
| MET CB CG sing N N 289 |
| MET CB HB2 sing N N 290 |
| MET CB HB3 sing N N 291 |
| MET CG SD sing N N 292 |
| MET CG HG2 sing N N 293 |
| MET CG HG3 sing N N 294 |
| MET SD CE sing N N 295 |
| MET CE HE1 sing N N 296 |
| MET CE HE2 sing N N 297 |
| MET CE HE3 sing N N 298 |
| MET OXT HXT sing N N 299 |
| PHE N CA sing N N 300 |
| PHE N H sing N N 301 |
| PHE N H2 sing N N 302 |
| PHE CA C sing N N 303 |
| PHE CA CB sing N N 304 |
| PHE CA HA sing N N 305 |
| PHE C O doub N N 306 |
| PHE C OXT sing N N 307 |
| PHE CB CG sing N N 308 |
| PHE CB HB2 sing N N 309 |
| PHE CB HB3 sing N N 310 |
| PHE CG CD1 doub Y N 311 |
| PHE CG CD2 sing Y N 312 |
| PHE CD1 CE1 sing Y N 313 |
| PHE CD1 HD1 sing N N 314 |
| PHE CD2 CE2 doub Y N 315 |
| PHE CD2 HD2 sing N N 316 |
| PHE CE1 CZ doub Y N 317 |
| PHE CE1 HE1 sing N N 318 |
| PHE CE2 CZ sing Y N 319 |
| PHE CE2 HE2 sing N N 320 |
| PHE CZ HZ sing N N 321 |
| PHE OXT HXT sing N N 322 |
| PRO N CA sing N N 323 |
| PRO N CD sing N N 324 |
| PRO N H sing N N 325 |
| PRO CA C sing N N 326 |
| PRO CA CB sing N N 327 |
| PRO CA HA sing N N 328 |
| PRO C O doub N N 329 |
| PRO C OXT sing N N 330 |
| PRO CB CG sing N N 331 |
| PRO CB HB2 sing N N 332 |
| PRO CB HB3 sing N N 333 |
| PRO CG CD sing N N 334 |
| PRO CG HG2 sing N N 335 |
| PRO CG HG3 sing N N 336 |
| PRO CD HD2 sing N N 337 |
| PRO CD HD3 sing N N 338 |
| PRO OXT HXT sing N N 339 |
| SER N CA sing N N 340 |
| SER N H sing N N 341 |
| SER N H2 sing N N 342 |
| SER CA C sing N N 343 |
| SER CA CB sing N N 344 |
| SER CA HA sing N N 345 |
| SER C O doub N N 346 |
| SER C OXT sing N N 347 |
| SER CB OG sing N N 348 |
| SER CB HB2 sing N N 349 |
| SER CB HB3 sing N N 350 |
| SER OG HG sing N N 351 |
| SER OXT HXT sing N N 352 |
| THR N CA sing N N 353 |
| THR N H sing N N 354 |
| THR N H2 sing N N 355 |
| THR CA C sing N N 356 |
| THR CA CB sing N N 357 |
| THR CA HA sing N N 358 |
| THR C O doub N N 359 |
| THR C OXT sing N N 360 |
| THR CB OG1 sing N N 361 |
| THR CB CG2 sing N N 362 |
| THR CB HB sing N N 363 |
| THR OG1 HG1 sing N N 364 |
| THR CG2 HG21 sing N N 365 |
| THR CG2 HG22 sing N N 366 |
| THR CG2 HG23 sing N N 367 |
| THR OXT HXT sing N N 368 |
| TRP N CA sing N N 369 |
| TRP N H sing N N 370 |
| TRP N H2 sing N N 371 |
| TRP CA C sing N N 372 |
| TRP CA CB sing N N 373 |
| TRP CA HA sing N N 374 |
| TRP C O doub N N 375 |
| TRP C OXT sing N N 376 |
| TRP CB CG sing N N 377 |
| TRP CB HB2 sing N N 378 |
| TRP CB HB3 sing N N 379 |
| TRP CG CD1 doub Y N 380 |
| TRP CG CD2 sing Y N 381 |
| TRP CD1 NE1 sing Y N 382 |
| TRP CD1 HD1 sing N N 383 |
| TRP CD2 CE2 doub Y N 384 |
| TRP CD2 CE3 sing Y N 385 |
| TRP NE1 CE2 sing Y N 386 |
| TRP NE1 HE1 sing N N 387 |
| TRP CE2 CZ2 sing Y N 388 |
| TRP CE3 CZ3 doub Y N 389 |
| TRP CE3 HE3 sing N N 390 |
| TRP CZ2 CH2 doub Y N 391 |
| TRP CZ2 HZ2 sing N N 392 |
| TRP CZ3 CH2 sing Y N 393 |
| TRP CZ3 HZ3 sing N N 394 |
| TRP CH2 HH2 sing N N 395 |
| TRP OXT HXT sing N N 396 |
| TYR N CA sing N N 397 |
| TYR N H sing N N 398 |
| TYR N H2 sing N N 399 |
| TYR CA C sing N N 400 |
| TYR CA CB sing N N 401 |
| TYR CA HA sing N N 402 |
| TYR C O doub N N 403 |
| TYR C OXT sing N N 404 |
| TYR CB CG sing N N 405 |
| TYR CB HB2 sing N N 406 |
| TYR CB HB3 sing N N 407 |
| TYR CG CD1 doub Y N 408 |
| TYR CG CD2 sing Y N 409 |
| TYR CD1 CE1 sing Y N 410 |
| TYR CD1 HD1 sing N N 411 |
| TYR CD2 CE2 doub Y N 412 |
| TYR CD2 HD2 sing N N 413 |
| TYR CE1 CZ doub Y N 414 |
| TYR CE1 HE1 sing N N 415 |
| TYR CE2 CZ sing Y N 416 |
| TYR CE2 HE2 sing N N 417 |
| TYR CZ OH sing N N 418 |
| TYR OH HH sing N N 419 |
| TYR OXT HXT sing N N 420 |
| VAL N CA sing N N 421 |
| VAL N H sing N N 422 |
| VAL N H2 sing N N 423 |
| VAL CA C sing N N 424 |
| VAL CA CB sing N N 425 |
| VAL CA HA sing N N 426 |
| VAL C O doub N N 427 |
| VAL C OXT sing N N 428 |
| VAL CB CG1 sing N N 429 |
| VAL CB CG2 sing N N 430 |
| VAL CB HB sing N N 431 |
| VAL CG1 HG11 sing N N 432 |
| VAL CG1 HG12 sing N N 433 |
| VAL CG1 HG13 sing N N 434 |
| VAL CG2 HG21 sing N N 435 |
| VAL CG2 HG22 sing N N 436 |
| VAL CG2 HG23 sing N N 437 |
| VAL OXT HXT sing N N 438 |
| |
| _pdbx_entity_instance_feature.ordinal 1 |
| _pdbx_entity_instance_feature.comp_id 9N0 |
| _pdbx_entity_instance_feature.asym_id ? |
| _pdbx_entity_instance_feature.seq_num ? |
| _pdbx_entity_instance_feature.auth_comp_id 9N0 |
| _pdbx_entity_instance_feature.auth_asym_id ? |
| _pdbx_entity_instance_feature.auth_seq_num ? |
| _pdbx_entity_instance_feature.feature_type 'SUBJECT OF INVESTIGATION' |
| _pdbx_entity_instance_feature.details ? |
| |
| _atom_sites.entry_id 5ZYH |
| _atom_sites.fract_transf_matrix[1][1] 0.016642 |
| _atom_sites.fract_transf_matrix[1][2] 0.000000 |
| _atom_sites.fract_transf_matrix[1][3] 0.000000 |
| _atom_sites.fract_transf_matrix[2][1] -0.000000 |
| _atom_sites.fract_transf_matrix[2][2] 0.016642 |
| _atom_sites.fract_transf_matrix[2][3] 0.000000 |
| _atom_sites.fract_transf_matrix[3][1] 0.000000 |
| _atom_sites.fract_transf_matrix[3][2] -0.000000 |
| _atom_sites.fract_transf_matrix[3][3] 0.006503 |
| _atom_sites.fract_transf_vector[1] 0.000000 |
| _atom_sites.fract_transf_vector[2] 0.000000 |
| _atom_sites.fract_transf_vector[3] 0.000000 |
| |
| loop_ |
| _atom_type.symbol |
| C |
| N |
| O |
| S |
| |
| 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.pdbx_formal_charge |
| _atom_site.auth_seq_id |
| _atom_site.auth_comp_id |
| _atom_site.auth_asym_id |
| _atom_site.auth_atom_id |
| _atom_site.pdbx_PDB_model_num |
| ATOM 1 N N . THR A 1 3 ? -16.809 26.768 -13.584 1.00 53.82 ? 364 THR A N 1 |
| ATOM 2 C CA . THR A 1 3 ? -18.143 27.405 -13.355 1.00 59.79 ? 364 THR A CA 1 |
| ATOM 3 C C . THR A 1 3 ? -19.084 27.056 -14.504 1.00 62.68 ? 364 THR A C 1 |
| ATOM 4 O O . THR A 1 3 ? -19.366 27.896 -15.354 1.00 74.58 ? 364 THR A O 1 |
| ATOM 5 C CB . THR A 1 3 ? -18.036 28.928 -13.194 1.00 68.90 ? 364 THR A CB 1 |
| ATOM 6 O OG1 . THR A 1 3 ? -17.214 29.149 -12.050 1.00 84.71 ? 364 THR A OG1 1 |
| ATOM 7 C CG2 . THR A 1 3 ? -19.363 29.628 -12.976 1.00 69.51 ? 364 THR A CG2 1 |
| ATOM 8 N N . HIS A 1 4 ? -19.579 25.812 -14.498 1.00 49.51 ? 365 HIS A N 1 |
| ATOM 9 C CA . HIS A 1 4 ? -20.555 25.296 -15.447 1.00 39.65 ? 365 HIS A CA 1 |
| ATOM 10 C C . HIS A 1 4 ? -21.950 25.838 -15.125 1.00 36.81 ? 365 HIS A C 1 |
| ATOM 11 O O . HIS A 1 4 ? -22.140 26.527 -14.127 1.00 36.24 ? 365 HIS A O 1 |
| ATOM 12 C CB . HIS A 1 4 ? -20.578 23.771 -15.309 1.00 35.70 ? 365 HIS A CB 1 |
| ATOM 13 C CG . HIS A 1 4 ? -20.756 23.344 -13.885 1.00 32.75 ? 365 HIS A CG 1 |
| ATOM 14 N ND1 . HIS A 1 4 ? -21.991 23.352 -13.257 1.00 31.19 ? 365 HIS A ND1 1 |
| ATOM 15 C CD2 . HIS A 1 4 ? -19.871 22.886 -12.969 1.00 35.73 ? 365 HIS A CD2 1 |
| ATOM 16 C CE1 . HIS A 1 4 ? -21.851 22.922 -12.017 1.00 32.11 ? 365 HIS A CE1 1 |
| ATOM 17 N NE2 . HIS A 1 4 ? -20.570 22.626 -11.818 1.00 35.56 ? 365 HIS A NE2 1 |
| ATOM 18 N N . ARG A 1 5 ? -22.942 25.470 -15.943 1.00 32.42 ? 366 ARG A N 1 |
| ATOM 19 C CA . ARG A 1 5 ? -24.241 26.107 -15.888 1.00 28.48 ? 366 ARG A CA 1 |
| ATOM 20 C C . ARG A 1 5 ? -25.050 25.648 -14.677 1.00 30.43 ? 366 ARG A C 1 |
| ATOM 21 O O . ARG A 1 5 ? -26.165 26.105 -14.484 1.00 31.21 ? 366 ARG A O 1 |
| ATOM 22 C CB . ARG A 1 5 ? -25.024 25.822 -17.167 1.00 34.97 ? 366 ARG A CB 1 |
| ATOM 23 C CG . ARG A 1 5 ? -25.345 24.351 -17.376 1.00 37.01 ? 366 ARG A CG 1 |
| ATOM 24 C CD . ARG A 1 5 ? -25.945 24.149 -18.760 1.00 41.10 ? 366 ARG A CD 1 |
| ATOM 25 N NE . ARG A 1 5 ? -26.350 22.790 -19.125 1.00 38.15 ? 366 ARG A NE 1 |
| ATOM 26 C CZ . ARG A 1 5 ? -25.521 21.780 -19.379 1.00 32.08 ? 366 ARG A CZ 1 |
| ATOM 27 N NH1 . ARG A 1 5 ? -24.221 21.991 -19.411 1.00 32.79 ? 366 ARG A NH1 1 |
| ATOM 28 N NH2 . ARG A 1 5 ? -25.992 20.558 -19.581 1.00 31.28 ? 366 ARG A NH2 1 |
| ATOM 29 N N . PHE A 1 6 ? -24.523 24.709 -13.889 1.00 29.42 ? 367 PHE A N 1 |
| ATOM 30 C CA . PHE A 1 6 ? -25.292 24.139 -12.788 1.00 34.60 ? 367 PHE A CA 1 |
| ATOM 31 C C . PHE A 1 6 ? -24.748 24.583 -11.415 1.00 33.79 ? 367 PHE A C 1 |
| ATOM 32 O O . PHE A 1 6 ? -25.155 24.050 -10.380 1.00 26.21 ? 367 PHE A O 1 |
| ATOM 33 C CB . PHE A 1 6 ? -25.322 22.601 -12.919 1.00 26.82 ? 367 PHE A CB 1 |
| ATOM 34 C CG . PHE A 1 6 ? -26.316 22.069 -13.925 1.00 27.04 ? 367 PHE A CG 1 |
| ATOM 35 C CD1 . PHE A 1 6 ? -27.677 22.037 -13.630 1.00 27.54 ? 367 PHE A CD1 1 |
| ATOM 36 C CD2 . PHE A 1 6 ? -25.899 21.587 -15.161 1.00 27.00 ? 367 PHE A CD2 1 |
| ATOM 37 C CE1 . PHE A 1 6 ? -28.598 21.534 -14.544 1.00 30.72 ? 367 PHE A CE1 1 |
| ATOM 38 C CE2 . PHE A 1 6 ? -26.815 21.079 -16.082 1.00 29.95 ? 367 PHE A CE2 1 |
| ATOM 39 C CZ . PHE A 1 6 ? -28.169 21.044 -15.770 1.00 26.51 ? 367 PHE A CZ 1 |
| ATOM 40 N N . VAL A 1 7 ? -23.820 25.547 -11.378 1.00 34.01 ? 368 VAL A N 1 |
| ATOM 41 C CA . VAL A 1 7 ? -23.135 25.808 -10.120 1.00 30.97 ? 368 VAL A CA 1 |
| ATOM 42 C C . VAL A 1 7 ? -24.123 26.290 -9.054 1.00 29.55 ? 368 VAL A C 1 |
| ATOM 43 O O . VAL A 1 7 ? -24.069 25.861 -7.897 1.00 31.74 ? 368 VAL A O 1 |
| ATOM 44 C CB . VAL A 1 7 ? -21.929 26.748 -10.315 1.00 35.09 ? 368 VAL A CB 1 |
| ATOM 45 C CG1 . VAL A 1 7 ? -21.687 27.630 -9.094 1.00 37.78 ? 368 VAL A CG1 1 |
| ATOM 46 C CG2 . VAL A 1 7 ? -20.677 25.960 -10.655 1.00 28.93 ? 368 VAL A CG2 1 |
| ATOM 47 N N . GLN A 1 8 ? -25.089 27.115 -9.443 1.00 28.51 ? 369 GLN A N 1 |
| ATOM 48 C CA . GLN A 1 8 ? -25.969 27.716 -8.456 1.00 33.58 ? 369 GLN A CA 1 |
| ATOM 49 C C . GLN A 1 8 ? -26.976 26.680 -7.934 1.00 29.75 ? 369 GLN A C 1 |
| ATOM 50 O O . GLN A 1 8 ? -27.307 26.648 -6.752 1.00 30.53 ? 369 GLN A O 1 |
| ATOM 51 C CB . GLN A 1 8 ? -26.698 28.905 -9.084 1.00 34.48 ? 369 GLN A CB 1 |
| ATOM 52 C CG . GLN A 1 8 ? -28.128 29.029 -8.579 1.00 37.48 ? 369 GLN A CG 1 |
| ATOM 53 N N . LYS A 1 9 ? -27.474 25.833 -8.837 1.00 30.34 ? 370 LYS A N 1 |
| ATOM 54 C CA . LYS A 1 9 ? -28.385 24.753 -8.473 1.00 30.69 ? 370 LYS A CA 1 |
| ATOM 55 C C . LYS A 1 9 ? -27.679 23.735 -7.559 1.00 27.76 ? 370 LYS A C 1 |
| ATOM 56 O O . LYS A 1 9 ? -28.223 23.297 -6.550 1.00 31.38 ? 370 LYS A O 1 |
| ATOM 57 C CB . LYS A 1 9 ? -28.983 24.132 -9.744 1.00 28.60 ? 370 LYS A CB 1 |
| ATOM 58 C CG . LYS A 1 9 ? -30.002 23.032 -9.499 1.00 32.47 ? 370 LYS A CG 1 |
| ATOM 59 C CD . LYS A 1 9 ? -31.209 23.548 -8.750 1.00 38.45 ? 370 LYS A CD 1 |
| ATOM 60 C CE . LYS A 1 9 ? -32.202 22.463 -8.400 1.00 44.07 ? 370 LYS A CE 1 |
| ATOM 61 N NZ . LYS A 1 9 ? -33.545 23.041 -8.139 1.00 46.98 ? 370 LYS A NZ 1 |
| ATOM 62 N N . VAL A 1 10 ? -26.451 23.361 -7.906 1.00 24.99 ? 371 VAL A N 1 |
| ATOM 63 C CA . VAL A 1 10 ? -25.657 22.501 -7.056 1.00 25.61 ? 371 VAL A CA 1 |
| ATOM 64 C C . VAL A 1 10 ? -25.577 23.111 -5.669 1.00 29.73 ? 371 VAL A C 1 |
| ATOM 65 O O . VAL A 1 10 ? -25.892 22.443 -4.670 1.00 26.72 ? 371 VAL A O 1 |
| ATOM 66 C CB . VAL A 1 10 ? -24.244 22.255 -7.614 1.00 23.90 ? 371 VAL A CB 1 |
| ATOM 67 C CG1 . VAL A 1 10 ? -23.314 21.761 -6.518 1.00 23.82 ? 371 VAL A CG1 1 |
| ATOM 68 C CG2 . VAL A 1 10 ? -24.284 21.258 -8.774 1.00 20.89 ? 371 VAL A CG2 1 |
| ATOM 69 N N . GLU A 1 11 ? -25.148 24.379 -5.616 1.00 26.48 ? 372 GLU A N 1 |
| ATOM 70 C CA . GLU A 1 11 ? -25.010 25.023 -4.314 1.00 27.64 ? 372 GLU A CA 1 |
| ATOM 71 C C . GLU A 1 11 ? -26.296 24.913 -3.498 1.00 22.42 ? 372 GLU A C 1 |
| ATOM 72 O O . GLU A 1 11 ? -26.279 24.663 -2.299 1.00 22.65 ? 372 GLU A O 1 |
| ATOM 73 C CB . GLU A 1 11 ? -24.688 26.511 -4.479 1.00 32.60 ? 372 GLU A CB 1 |
| ATOM 74 C CG . GLU A 1 11 ? -24.425 27.170 -3.148 1.00 33.51 ? 372 GLU A CG 1 |
| ATOM 75 C CD . GLU A 1 11 ? -23.216 26.527 -2.503 1.00 38.85 ? 372 GLU A CD 1 |
| ATOM 76 O OE1 . GLU A 1 11 ? -23.102 26.586 -1.262 1.00 46.56 ? 372 GLU A OE1 1 |
| ATOM 77 O OE2 . GLU A 1 11 ? -22.405 25.950 -3.243 1.00 39.68 ? 372 GLU A OE2 1 |
| ATOM 78 N N . GLU A 1 12 ? -27.438 25.142 -4.140 1.00 26.17 ? 373 GLU A N 1 |
| ATOM 79 C CA . GLU A 1 12 ? -28.678 25.102 -3.402 1.00 25.53 ? 373 GLU A CA 1 |
| ATOM 80 C C . GLU A 1 12 ? -29.013 23.681 -2.910 1.00 28.07 ? 373 GLU A C 1 |
| ATOM 81 O O . GLU A 1 12 ? -29.612 23.533 -1.836 1.00 26.77 ? 373 GLU A O 1 |
| ATOM 82 C CB . GLU A 1 12 ? -29.794 25.673 -4.278 1.00 29.44 ? 373 GLU A CB 1 |
| ATOM 83 C CG . GLU A 1 12 ? -31.171 25.382 -3.715 1.00 31.25 ? 373 GLU A CG 1 |
| ATOM 84 C CD . GLU A 1 12 ? -32.224 25.324 -4.804 1.00 39.60 ? 373 GLU A CD 1 |
| ATOM 85 O OE1 . GLU A 1 12 ? -31.869 24.962 -5.950 1.00 40.55 ? 373 GLU A OE1 1 |
| ATOM 86 O OE2 . GLU A 1 12 ? -33.382 25.665 -4.519 1.00 38.54 ? 373 GLU A OE2 1 |
| ATOM 87 N N . MET A 1 13 ? -28.733 22.645 -3.731 1.00 23.51 ? 374 MET A N 1 |
| ATOM 88 C CA . MET A 1 13 ? -29.108 21.278 -3.351 1.00 22.51 ? 374 MET A CA 1 |
| ATOM 89 C C . MET A 1 13 ? -28.233 20.856 -2.190 1.00 20.85 ? 374 MET A C 1 |
| ATOM 90 O O . MET A 1 13 ? -28.698 20.274 -1.220 1.00 23.13 ? 374 MET A O 1 |
| ATOM 91 C CB . MET A 1 13 ? -28.881 20.267 -4.484 1.00 22.16 ? 374 MET A CB 1 |
| ATOM 92 C CG . MET A 1 13 ? -29.727 20.535 -5.696 1.00 22.28 ? 374 MET A CG 1 |
| ATOM 93 S SD . MET A 1 13 ? -31.517 20.528 -5.367 1.00 29.74 ? 374 MET A SD 1 |
| ATOM 94 C CE . MET A 1 13 ? -31.734 18.834 -4.820 1.00 33.95 ? 374 MET A CE 1 |
| ATOM 95 N N . VAL A 1 14 ? -26.962 21.201 -2.291 1.00 19.82 ? 375 VAL A N 1 |
| ATOM 96 C CA . VAL A 1 14 ? -25.985 20.832 -1.277 1.00 24.00 ? 375 VAL A CA 1 |
| ATOM 97 C C . VAL A 1 14 ? -26.321 21.467 0.078 1.00 25.90 ? 375 VAL A C 1 |
| ATOM 98 O O . VAL A 1 14 ? -26.276 20.803 1.131 1.00 23.32 ? 375 VAL A O 1 |
| ATOM 99 C CB . VAL A 1 14 ? -24.571 21.169 -1.776 1.00 24.59 ? 375 VAL A CB 1 |
| ATOM 100 C CG1 . VAL A 1 14 ? -23.537 21.259 -0.670 1.00 23.56 ? 375 VAL A CG1 1 |
| ATOM 101 C CG2 . VAL A 1 14 ? -24.123 20.186 -2.835 1.00 26.30 ? 375 VAL A CG2 1 |
| ATOM 102 N N . GLN A 1 15 ? -26.689 22.751 0.037 1.00 27.19 ? 376 GLN A N 1 |
| ATOM 103 C CA . GLN A 1 15 ? -26.951 23.514 1.251 1.00 27.46 ? 376 GLN A CA 1 |
| ATOM 104 C C . GLN A 1 15 ? -28.249 23.038 1.902 1.00 23.56 ? 376 GLN A C 1 |
| ATOM 105 O O . GLN A 1 15 ? -28.313 22.969 3.122 1.00 22.43 ? 376 GLN A O 1 |
| ATOM 106 C CB . GLN A 1 15 ? -27.064 25.025 0.959 1.00 35.98 ? 376 GLN A CB 1 |
| ATOM 107 C CG . GLN A 1 15 ? -25.735 25.716 0.663 1.00 39.97 ? 376 GLN A CG 1 |
| ATOM 108 C CD . GLN A 1 15 ? -24.628 25.285 1.600 1.00 46.99 ? 376 GLN A CD 1 |
| ATOM 109 O OE1 . GLN A 1 15 ? -23.465 25.170 1.206 1.00 46.30 ? 376 GLN A OE1 1 |
| ATOM 110 N NE2 . GLN A 1 15 ? -24.976 25.027 2.855 1.00 47.32 ? 376 GLN A NE2 1 |
| ATOM 111 N N . ASN A 1 16 ? -29.271 22.698 1.106 1.00 22.49 ? 377 ASN A N 1 |
| ATOM 112 C CA . ASN A 1 16 ? -30.498 22.156 1.682 1.00 23.23 ? 377 ASN A CA 1 |
| ATOM 113 C C . ASN A 1 16 ? -30.177 20.846 2.404 1.00 25.19 ? 377 ASN A C 1 |
| ATOM 114 O O . ASN A 1 16 ? -30.732 20.547 3.457 1.00 25.32 ? 377 ASN A O 1 |
| ATOM 115 C CB . ASN A 1 16 ? -31.594 21.940 0.629 1.00 22.30 ? 377 ASN A CB 1 |
| ATOM 116 C CG A ASN A 1 16 ? -32.309 23.212 0.259 0.50 20.92 ? 377 ASN A CG 1 |
| ATOM 117 C CG B ASN A 1 16 ? -32.598 20.848 0.946 0.50 28.72 ? 377 ASN A CG 1 |
| ATOM 118 O OD1 A ASN A 1 16 ? -32.212 24.208 0.967 0.50 18.61 ? 377 ASN A OD1 1 |
| ATOM 119 O OD1 B ASN A 1 16 ? -33.338 20.922 1.923 0.50 33.13 ? 377 ASN A OD1 1 |
| ATOM 120 N ND2 A ASN A 1 16 ? -33.072 23.155 -0.813 0.50 19.13 ? 377 ASN A ND2 1 |
| ATOM 121 N ND2 B ASN A 1 16 ? -32.676 19.838 0.096 0.50 34.97 ? 377 ASN A ND2 1 |
| ATOM 122 N N . HIS A 1 17 ? -29.309 20.027 1.808 1.00 23.46 ? 378 HIS A N 1 |
| ATOM 123 C CA . HIS A 1 17 ? -28.905 18.806 2.478 1.00 23.27 ? 378 HIS A CA 1 |
| ATOM 124 C C . HIS A 1 17 ? -28.181 19.134 3.782 1.00 23.91 ? 378 HIS A C 1 |
| ATOM 125 O O . HIS A 1 17 ? -28.421 18.482 4.793 1.00 21.74 ? 378 HIS A O 1 |
| ATOM 126 C CB . HIS A 1 17 ? -28.062 17.944 1.536 1.00 22.01 ? 378 HIS A CB 1 |
| ATOM 127 C CG . HIS A 1 17 ? -28.916 17.162 0.609 1.00 21.99 ? 378 HIS A CG 1 |
| ATOM 128 N ND1 . HIS A 1 17 ? -29.874 16.258 1.073 1.00 20.49 ? 378 HIS A ND1 1 |
| ATOM 129 C CD2 . HIS A 1 17 ? -29.004 17.183 -0.736 1.00 21.82 ? 378 HIS A CD2 1 |
| ATOM 130 C CE1 . HIS A 1 17 ? -30.468 15.714 0.045 1.00 21.59 ? 378 HIS A CE1 1 |
| ATOM 131 N NE2 . HIS A 1 17 ? -29.934 16.262 -1.084 1.00 21.69 ? 378 HIS A NE2 1 |
| ATOM 132 N N . MET A 1 18 ? -27.265 20.111 3.741 1.00 25.54 ? 379 MET A N 1 |
| ATOM 133 C CA . MET A 1 18 ? -26.516 20.400 4.953 1.00 24.82 ? 379 MET A CA 1 |
| ATOM 134 C C . MET A 1 18 ? -27.456 20.951 6.020 1.00 26.92 ? 379 MET A C 1 |
| ATOM 135 O O . MET A 1 18 ? -27.277 20.624 7.188 1.00 30.15 ? 379 MET A O 1 |
| ATOM 136 C CB . MET A 1 18 ? -25.334 21.344 4.725 1.00 28.05 ? 379 MET A CB 1 |
| ATOM 137 C CG . MET A 1 18 ? -24.287 20.759 3.832 1.00 27.83 ? 379 MET A CG 1 |
| ATOM 138 S SD . MET A 1 18 ? -23.456 19.338 4.575 1.00 31.79 ? 379 MET A SD 1 |
| ATOM 139 C CE . MET A 1 18 ? -22.674 20.180 5.957 1.00 29.24 ? 379 MET A CE 1 |
| ATOM 140 N N . THR A 1 19 ? -28.492 21.703 5.613 1.00 26.69 ? 380 THR A N 1 |
| ATOM 141 C CA . THR A 1 19 ? -29.447 22.243 6.574 1.00 32.13 ? 380 THR A CA 1 |
| ATOM 142 C C . THR A 1 19 ? -30.442 21.195 7.055 1.00 30.92 ? 380 THR A C 1 |
| ATOM 143 O O . THR A 1 19 ? -30.804 21.212 8.218 1.00 37.45 ? 380 THR A O 1 |
| ATOM 144 C CB . THR A 1 19 ? -30.298 23.383 6.013 1.00 32.62 ? 380 THR A CB 1 |
| ATOM 145 O OG1 . THR A 1 19 ? -29.360 24.344 5.542 1.00 32.50 ? 380 THR A OG1 1 |
| ATOM 146 C CG2 . THR A 1 19 ? -31.209 23.975 7.068 1.00 34.71 ? 380 THR A CG2 1 |
| ATOM 147 N N . TYR A 1 20 ? -30.911 20.296 6.186 1.00 26.30 ? 381 TYR A N 1 |
| ATOM 148 C CA . TYR A 1 20 ? -32.064 19.495 6.564 1.00 26.57 ? 381 TYR A CA 1 |
| ATOM 149 C C . TYR A 1 20 ? -31.735 18.026 6.752 1.00 26.59 ? 381 TYR A C 1 |
| ATOM 150 O O . TYR A 1 20 ? -32.294 17.366 7.632 1.00 26.93 ? 381 TYR A O 1 |
| ATOM 151 C CB . TYR A 1 20 ? -33.175 19.665 5.532 1.00 29.94 ? 381 TYR A CB 1 |
| ATOM 152 C CG . TYR A 1 20 ? -33.744 21.049 5.645 1.00 38.32 ? 381 TYR A CG 1 |
| ATOM 153 C CD1 . TYR A 1 20 ? -34.493 21.395 6.765 1.00 42.24 ? 381 TYR A CD1 1 |
| ATOM 154 C CD2 . TYR A 1 20 ? -33.444 22.030 4.714 1.00 38.65 ? 381 TYR A CD2 1 |
| ATOM 155 C CE1 . TYR A 1 20 ? -34.998 22.675 6.917 1.00 49.66 ? 381 TYR A CE1 1 |
| ATOM 156 C CE2 . TYR A 1 20 ? -33.948 23.313 4.848 1.00 44.08 ? 381 TYR A CE2 1 |
| ATOM 157 C CZ . TYR A 1 20 ? -34.718 23.635 5.955 1.00 49.64 ? 381 TYR A CZ 1 |
| ATOM 158 O OH . TYR A 1 20 ? -35.215 24.896 6.106 1.00 55.60 ? 381 TYR A OH 1 |
| ATOM 159 N N . SER A 1 21 ? -30.871 17.517 5.876 1.00 23.96 ? 382 SER A N 1 |
| ATOM 160 C CA . SER A 1 21 ? -30.650 16.086 5.813 1.00 23.31 ? 382 SER A CA 1 |
| ATOM 161 C C . SER A 1 21 ? -29.829 15.613 7.010 1.00 23.50 ? 382 SER A C 1 |
| ATOM 162 O O . SER A 1 21 ? -30.024 14.497 7.487 1.00 23.54 ? 382 SER A O 1 |
| ATOM 163 C CB . SER A 1 21 ? -29.991 15.735 4.500 1.00 20.59 ? 382 SER A CB 1 |
| ATOM 164 O OG . SER A 1 21 ? -30.963 15.913 3.488 1.00 18.93 ? 382 SER A OG 1 |
| ATOM 165 N N . LEU A 1 22 ? -28.962 16.493 7.518 1.00 27.55 ? 383 LEU A N 1 |
| ATOM 166 C CA . LEU A 1 22 ? -28.018 16.172 8.585 1.00 33.39 ? 383 LEU A CA 1 |
| ATOM 167 C C . LEU A 1 22 ? -28.656 16.194 9.977 1.00 39.57 ? 383 LEU A C 1 |
| ATOM 168 O O . LEU A 1 22 ? -28.075 15.668 10.927 1.00 41.52 ? 383 LEU A O 1 |
| ATOM 169 C CB . LEU A 1 22 ? -26.889 17.195 8.523 1.00 31.73 ? 383 LEU A CB 1 |
| ATOM 170 C CG . LEU A 1 22 ? -25.654 16.663 7.829 1.00 32.59 ? 383 LEU A CG 1 |
| ATOM 171 C CD1 . LEU A 1 22 ? -24.430 17.464 8.230 1.00 31.84 ? 383 LEU A CD1 1 |
| ATOM 172 C CD2 . LEU A 1 22 ? -25.469 15.213 8.206 1.00 28.37 ? 383 LEU A CD2 1 |
| ATOM 173 N N . GLN A 1 23 ? -29.838 16.816 10.101 1.00 34.51 ? 384 GLN A N 1 |
| ATOM 174 C CA . GLN A 1 23 ? -30.498 16.921 11.390 1.00 41.95 ? 384 GLN A CA 1 |
| ATOM 175 C C . GLN A 1 23 ? -30.853 15.542 11.932 1.00 42.33 ? 384 GLN A C 1 |
| ATOM 176 O O . GLN A 1 23 ? -31.238 14.643 11.182 1.00 41.38 ? 384 GLN A O 1 |
| ATOM 177 C CB . GLN A 1 23 ? -31.797 17.705 11.257 1.00 40.04 ? 384 GLN A CB 1 |
| ATOM 178 C CG . GLN A 1 23 ? -31.553 19.159 10.914 1.00 49.80 ? 384 GLN A CG 1 |
| ATOM 179 C CD . GLN A 1 23 ? -32.854 19.918 10.998 1.00 61.83 ? 384 GLN A CD 1 |
| ATOM 180 O OE1 . GLN A 1 23 ? -33.857 19.394 11.477 1.00 64.83 ? 384 GLN A OE1 1 |
| ATOM 181 N NE2 . GLN A 1 23 ? -32.854 21.155 10.521 1.00 68.47 ? 384 GLN A NE2 1 |
| ATOM 182 N N . ASP A 1 24 ? -30.756 15.397 13.257 1.00 43.36 ? 385 ASP A N 1 |
| ATOM 183 C CA . ASP A 1 24 ? -31.044 14.121 13.895 1.00 43.06 ? 385 ASP A CA 1 |
| ATOM 184 C C . ASP A 1 24 ? -32.556 13.873 13.870 1.00 43.42 ? 385 ASP A C 1 |
| ATOM 185 O O . ASP A 1 24 ? -33.338 14.816 13.945 1.00 45.44 ? 385 ASP A O 1 |
| ATOM 186 C CB . ASP A 1 24 ? -30.460 14.088 15.311 1.00 50.65 ? 385 ASP A CB 1 |
| ATOM 187 C CG . ASP A 1 24 ? -31.012 12.954 16.165 1.00 61.37 ? 385 ASP A CG 1 |
| ATOM 188 O OD1 . ASP A 1 24 ? -30.472 11.839 16.061 1.00 52.79 ? 385 ASP A OD1 1 |
| ATOM 189 O OD2 . ASP A 1 24 ? -32.005 13.186 16.918 1.00 68.86 ? 385 ASP A OD2 1 |
| ATOM 190 N N . VAL A 1 25 ? -32.962 12.598 13.769 1.00 41.89 ? 386 VAL A N 1 |
| ATOM 191 C CA . VAL A 1 25 ? -34.364 12.206 13.678 1.00 42.08 ? 386 VAL A CA 1 |
| ATOM 192 C C . VAL A 1 25 ? -34.688 11.194 14.777 1.00 46.74 ? 386 VAL A C 1 |
| ATOM 193 O O . VAL A 1 25 ? -33.787 10.580 15.298 1.00 58.03 ? 386 VAL A O 1 |
| ATOM 194 C CB . VAL A 1 25 ? -34.676 11.580 12.310 1.00 43.14 ? 386 VAL A CB 1 |
| ATOM 195 C CG1 . VAL A 1 25 ? -34.513 12.591 11.169 1.00 41.28 ? 386 VAL A CG1 1 |
| ATOM 196 C CG2 . VAL A 1 25 ? -33.852 10.311 12.063 1.00 38.59 ? 386 VAL A CG2 1 |
| ATOM 197 N N . GLY A 1 27 ? -36.028 10.556 18.175 1.00 59.51 ? 388 GLY A N 1 |
| ATOM 198 C CA . GLY A 1 27 ? -36.271 11.985 18.531 1.00 73.50 ? 388 GLY A CA 1 |
| ATOM 199 C C . GLY A 1 27 ? -37.456 12.613 17.787 1.00 74.88 ? 388 GLY A C 1 |
| ATOM 200 O O . GLY A 1 27 ? -38.378 13.133 18.414 1.00 63.97 ? 388 GLY A O 1 |
| ATOM 201 N N . ASP A 1 28 ? -37.407 12.558 16.445 1.00 76.60 ? 389 ASP A N 1 |
| ATOM 202 C CA . ASP A 1 28 ? -38.443 12.988 15.503 1.00 71.89 ? 389 ASP A CA 1 |
| ATOM 203 C C . ASP A 1 28 ? -39.361 11.806 15.155 1.00 63.65 ? 389 ASP A C 1 |
| ATOM 204 O O . ASP A 1 28 ? -38.971 10.955 14.333 1.00 39.42 ? 389 ASP A O 1 |
| ATOM 205 C CB . ASP A 1 28 ? -37.771 13.520 14.226 1.00 72.15 ? 389 ASP A CB 1 |
| ATOM 206 C CG . ASP A 1 28 ? -38.636 14.198 13.167 1.00 68.24 ? 389 ASP A CG 1 |
| ATOM 207 O OD1 . ASP A 1 28 ? -39.839 13.848 13.025 1.00 56.96 ? 389 ASP A OD1 1 |
| ATOM 208 O OD2 . ASP A 1 28 ? -38.081 15.072 12.466 1.00 60.23 ? 389 ASP A OD2 1 |
| ATOM 209 N N . ALA A 1 29 ? -40.575 11.778 15.765 1.00 62.94 ? 390 ALA A N 1 |
| ATOM 210 C CA . ALA A 1 29 ? -41.560 10.709 15.568 1.00 53.83 ? 390 ALA A CA 1 |
| ATOM 211 C C . ALA A 1 29 ? -42.118 10.743 14.144 1.00 56.67 ? 390 ALA A C 1 |
| ATOM 212 O O . ALA A 1 29 ? -42.796 9.807 13.731 1.00 56.34 ? 390 ALA A O 1 |
| ATOM 213 C CB . ALA A 1 29 ? -42.668 10.719 16.612 1.00 45.10 ? 390 ALA A CB 1 |
| ATOM 214 N N . ASN A 1 30 ? -41.815 11.817 13.400 1.00 50.58 ? 391 ASN A N 1 |
| ATOM 215 C CA . ASN A 1 30 ? -42.092 11.912 11.971 1.00 56.87 ? 391 ASN A CA 1 |
| ATOM 216 C C . ASN A 1 30 ? -41.508 10.717 11.224 1.00 46.73 ? 391 ASN A C 1 |
| ATOM 217 O O . ASN A 1 30 ? -42.156 10.082 10.386 1.00 45.38 ? 391 ASN A O 1 |
| ATOM 218 C CB . ASN A 1 30 ? -41.343 13.092 11.356 1.00 61.27 ? 391 ASN A CB 1 |
| ATOM 219 C CG . ASN A 1 30 ? -42.284 14.179 10.912 1.00 77.82 ? 391 ASN A CG 1 |
| ATOM 220 O OD1 . ASN A 1 30 ? -43.498 13.979 10.917 1.00 84.13 ? 391 ASN A OD1 1 |
| ATOM 221 N ND2 . ASN A 1 30 ? -41.726 15.314 10.524 1.00 82.01 ? 391 ASN A ND2 1 |
| ATOM 222 N N . TRP A 1 31 ? -40.236 10.471 11.510 1.00 33.66 ? 392 TRP A N 1 |
| ATOM 223 C CA . TRP A 1 31 ? -39.504 9.387 10.892 1.00 27.53 ? 392 TRP A CA 1 |
| ATOM 224 C C . TRP A 1 31 ? -39.883 8.078 11.557 1.00 26.12 ? 392 TRP A C 1 |
| ATOM 225 O O . TRP A 1 31 ? -39.815 7.937 12.771 1.00 29.46 ? 392 TRP A O 1 |
| ATOM 226 C CB . TRP A 1 31 ? -38.000 9.677 10.988 1.00 26.12 ? 392 TRP A CB 1 |
| ATOM 227 C CG . TRP A 1 31 ? -37.562 10.759 10.053 1.00 27.45 ? 392 TRP A CG 1 |
| ATOM 228 C CD1 . TRP A 1 31 ? -37.324 12.072 10.350 1.00 30.65 ? 392 TRP A CD1 1 |
| ATOM 229 C CD2 . TRP A 1 31 ? -37.307 10.613 8.641 1.00 25.62 ? 392 TRP A CD2 1 |
| ATOM 230 N NE1 . TRP A 1 31 ? -36.936 12.749 9.223 1.00 30.64 ? 392 TRP A NE1 1 |
| ATOM 231 C CE2 . TRP A 1 31 ? -36.937 11.885 8.152 1.00 27.19 ? 392 TRP A CE2 1 |
| ATOM 232 C CE3 . TRP A 1 31 ? -37.428 9.548 7.738 1.00 25.62 ? 392 TRP A CE3 1 |
| ATOM 233 C CZ2 . TRP A 1 31 ? -36.619 12.105 6.809 1.00 24.04 ? 392 TRP A CZ2 1 |
| ATOM 234 C CZ3 . TRP A 1 31 ? -37.110 9.757 6.412 1.00 23.77 ? 392 TRP A CZ3 1 |
| ATOM 235 C CH2 . TRP A 1 31 ? -36.713 11.019 5.961 1.00 26.32 ? 392 TRP A CH2 1 |
| ATOM 236 N N . GLN A 1 32 ? -40.310 7.123 10.756 1.00 23.98 ? 393 GLN A N 1 |
| ATOM 237 C CA . GLN A 1 32 ? -40.546 5.805 11.276 1.00 24.34 ? 393 GLN A CA 1 |
| ATOM 238 C C . GLN A 1 32 ? -39.234 5.047 11.121 1.00 26.54 ? 393 GLN A C 1 |
| ATOM 239 O O . GLN A 1 32 ? -38.699 4.951 10.011 1.00 21.78 ? 393 GLN A O 1 |
| ATOM 240 C CB . GLN A 1 32 ? -41.685 5.173 10.481 1.00 29.63 ? 393 GLN A CB 1 |
| ATOM 241 C CG . GLN A 1 32 ? -41.958 3.724 10.845 1.00 34.76 ? 393 GLN A CG 1 |
| ATOM 242 C CD . GLN A 1 32 ? -42.803 3.000 9.817 1.00 36.02 ? 393 GLN A CD 1 |
| ATOM 243 O OE1 . GLN A 1 32 ? -43.392 3.612 8.935 1.00 36.04 ? 393 GLN A OE1 1 |
| ATOM 244 N NE2 . GLN A 1 32 ? -42.840 1.675 9.913 1.00 40.11 ? 393 GLN A NE2 1 |
| ATOM 245 N N . LEU A 1 33 ? -38.712 4.534 12.243 1.00 23.91 ? 394 LEU A N 1 |
| ATOM 246 C CA . LEU A 1 33 ? -37.570 3.639 12.221 1.00 21.48 ? 394 LEU A CA 1 |
| ATOM 247 C C . LEU A 1 33 ? -38.087 2.285 11.700 1.00 22.23 ? 394 LEU A C 1 |
| ATOM 248 O O . LEU A 1 33 ? -38.907 1.639 12.355 1.00 24.74 ? 394 LEU A O 1 |
| ATOM 249 C CB . LEU A 1 33 ? -36.970 3.557 13.641 1.00 22.03 ? 394 LEU A CB 1 |
| ATOM 250 C CG . LEU A 1 33 ? -35.822 2.542 13.844 1.00 25.29 ? 394 LEU A CG 1 |
| ATOM 251 C CD1 . LEU A 1 33 ? -34.700 2.737 12.838 1.00 24.48 ? 394 LEU A CD1 1 |
| ATOM 252 C CD2 . LEU A 1 33 ? -35.221 2.577 15.258 1.00 24.70 ? 394 LEU A CD2 1 |
| ATOM 253 N N . VAL A 1 34 ? -37.570 1.830 10.545 1.00 18.77 ? 395 VAL A N 1 |
| ATOM 254 C CA . VAL A 1 34 ? -38.035 0.661 9.804 1.00 21.57 ? 395 VAL A CA 1 |
| ATOM 255 C C . VAL A 1 34 ? -37.145 -0.547 10.074 1.00 22.17 ? 395 VAL A C 1 |
| ATOM 256 O O . VAL A 1 34 ? -37.667 -1.648 10.276 1.00 22.52 ? 395 VAL A O 1 |
| ATOM 257 C CB . VAL A 1 34 ? -38.000 0.933 8.284 1.00 25.12 ? 395 VAL A CB 1 |
| ATOM 258 C CG1 . VAL A 1 34 ? -38.197 -0.340 7.488 1.00 28.89 ? 395 VAL A CG1 1 |
| ATOM 259 C CG2 . VAL A 1 34 ? -39.016 1.975 7.874 1.00 27.70 ? 395 VAL A CG2 1 |
| ATOM 260 N N . VAL A 1 35 ? -35.817 -0.354 9.989 1.00 20.73 ? 396 VAL A N 1 |
| ATOM 261 C CA . VAL A 1 35 ? -34.832 -1.427 10.103 1.00 25.87 ? 396 VAL A CA 1 |
| ATOM 262 C C . VAL A 1 35 ? -33.641 -0.912 10.936 1.00 29.68 ? 396 VAL A C 1 |
| ATOM 263 O O . VAL A 1 35 ? -33.191 0.224 10.743 1.00 26.12 ? 396 VAL A O 1 |
| ATOM 264 C CB . VAL A 1 35 ? -34.330 -1.912 8.725 1.00 29.94 ? 396 VAL A CB 1 |
| ATOM 265 C CG1 . VAL A 1 35 ? -33.114 -2.822 8.839 1.00 36.72 ? 396 VAL A CG1 1 |
| ATOM 266 C CG2 . VAL A 1 35 ? -35.399 -2.603 7.906 1.00 34.49 ? 396 VAL A CG2 1 |
| ATOM 267 N N . GLU A 1 36 ? -33.115 -1.732 11.866 1.00 29.39 ? 397 GLU A N 1 |
| ATOM 268 C CA . GLU A 1 36 ? -31.873 -1.406 12.579 1.00 27.51 ? 397 GLU A CA 1 |
| ATOM 269 C C . GLU A 1 36 ? -31.001 -2.650 12.610 1.00 28.18 ? 397 GLU A C 1 |
| ATOM 270 O O . GLU A 1 36 ? -31.450 -3.683 13.072 1.00 24.66 ? 397 GLU A O 1 |
| ATOM 271 C CB . GLU A 1 36 ? -32.112 -0.848 13.990 1.00 25.70 ? 397 GLU A CB 1 |
| ATOM 272 C CG . GLU A 1 36 ? -30.825 -0.528 14.779 1.00 29.42 ? 397 GLU A CG 1 |
| ATOM 273 C CD . GLU A 1 36 ? -31.038 0.157 16.129 1.00 34.00 ? 397 GLU A CD 1 |
| ATOM 274 O OE1 . GLU A 1 36 ? -32.194 0.507 16.429 1.00 32.78 ? 397 GLU A OE1 1 |
| ATOM 275 O OE2 . GLU A 1 36 ? -30.060 0.328 16.909 1.00 36.89 ? 397 GLU A OE2 1 |
| ATOM 276 N N . GLU A 1 37 ? -29.816 -2.579 12.006 1.00 30.02 ? 398 GLU A N 1 |
| ATOM 277 C CA . GLU A 1 37 ? -28.859 -3.671 12.056 1.00 34.67 ? 398 GLU A CA 1 |
| ATOM 278 C C . GLU A 1 37 ? -27.537 -3.099 12.558 1.00 41.92 ? 398 GLU A C 1 |
| ATOM 279 O O . GLU A 1 37 ? -26.745 -2.601 11.759 1.00 44.54 ? 398 GLU A O 1 |
| ATOM 280 C CB . GLU A 1 37 ? -28.510 -4.184 10.664 1.00 40.04 ? 398 GLU A CB 1 |
| ATOM 281 C CG . GLU A 1 37 ? -29.646 -4.792 9.871 1.00 50.46 ? 398 GLU A CG 1 |
| ATOM 282 C CD . GLU A 1 37 ? -29.070 -5.467 8.633 1.00 61.58 ? 398 GLU A CD 1 |
| ATOM 283 O OE1 . GLU A 1 37 ? -27.960 -6.032 8.768 1.00 65.40 ? 398 GLU A OE1 1 |
| ATOM 284 O OE2 . GLU A 1 37 ? -29.705 -5.407 7.536 1.00 53.47 ? 398 GLU A OE2 1 |
| ATOM 285 N N . GLY A 1 38 ? -27.328 -3.123 13.876 1.00 44.19 ? 399 GLY A N 1 |
| ATOM 286 C CA . GLY A 1 38 ? -26.043 -2.722 14.417 1.00 43.75 ? 399 GLY A CA 1 |
| ATOM 287 C C . GLY A 1 38 ? -25.901 -1.211 14.366 1.00 39.53 ? 399 GLY A C 1 |
| ATOM 288 O O . GLY A 1 38 ? -26.706 -0.476 14.949 1.00 45.53 ? 399 GLY A O 1 |
| ATOM 289 N N . GLU A 1 39 ? -24.881 -0.761 13.630 1.00 41.55 ? 400 GLU A N 1 |
| ATOM 290 C CA . GLU A 1 39 ? -24.621 0.665 13.511 1.00 39.13 ? 400 GLU A CA 1 |
| ATOM 291 C C . GLU A 1 39 ? -25.660 1.319 12.585 1.00 29.89 ? 400 GLU A C 1 |
| ATOM 292 O O . GLU A 1 39 ? -25.925 2.522 12.677 1.00 28.35 ? 400 GLU A O 1 |
| ATOM 293 C CB . GLU A 1 39 ? -23.161 0.906 13.090 1.00 40.80 ? 400 GLU A CB 1 |
| ATOM 294 C CG . GLU A 1 39 ? -22.177 1.007 14.264 1.00 47.98 ? 400 GLU A CG 1 |
| ATOM 295 C CD . GLU A 1 39 ? -22.794 1.610 15.521 1.00 55.40 ? 400 GLU A CD 1 |
| ATOM 296 O OE1 . GLU A 1 39 ? -23.483 2.655 15.438 1.00 67.16 ? 400 GLU A OE1 1 |
| ATOM 297 O OE2 . GLU A 1 39 ? -22.629 1.017 16.582 1.00 63.96 ? 400 GLU A OE2 1 |
| ATOM 298 N N . MET A 1 40 ? -26.252 0.523 11.689 1.00 27.92 ? 401 MET A N 1 |
| ATOM 299 C CA . MET A 1 40 ? -27.094 1.094 10.643 1.00 24.06 ? 401 MET A CA 1 |
| ATOM 300 C C . MET A 1 40 ? -28.557 1.200 11.094 1.00 23.51 ? 401 MET A C 1 |
| ATOM 301 O O . MET A 1 40 ? -29.160 0.216 11.530 1.00 26.31 ? 401 MET A O 1 |
| ATOM 302 C CB . MET A 1 40 ? -27.024 0.244 9.381 1.00 25.52 ? 401 MET A CB 1 |
| ATOM 303 C CG . MET A 1 40 ? -27.879 0.819 8.272 1.00 27.17 ? 401 MET A CG 1 |
| ATOM 304 S SD . MET A 1 40 ? -27.889 -0.339 6.884 1.00 32.98 ? 401 MET A SD 1 |
| ATOM 305 C CE . MET A 1 40 ? -27.805 -1.895 7.759 1.00 38.63 ? 401 MET A CE 1 |
| ATOM 306 N N . LYS A 1 41 ? -29.126 2.402 10.970 1.00 18.31 ? 402 LYS A N 1 |
| ATOM 307 C CA . LYS A 1 41 ? -30.525 2.675 11.244 1.00 19.24 ? 402 LYS A CA 1 |
| ATOM 308 C C . LYS A 1 41 ? -31.186 3.229 9.980 1.00 17.97 ? 402 LYS A C 1 |
| ATOM 309 O O . LYS A 1 41 ? -30.664 4.183 9.397 1.00 18.68 ? 402 LYS A O 1 |
| ATOM 310 C CB . LYS A 1 41 ? -30.585 3.734 12.344 1.00 22.21 ? 402 LYS A CB 1 |
| ATOM 311 C CG . LYS A 1 41 ? -30.160 3.225 13.723 1.00 27.66 ? 402 LYS A CG 1 |
| ATOM 312 C CD . LYS A 1 41 ? -30.494 4.258 14.781 1.00 30.06 ? 402 LYS A CD 1 |
| ATOM 313 C CE . LYS A 1 41 ? -29.280 5.025 15.228 1.00 36.10 ? 402 LYS A CE 1 |
| ATOM 314 N NZ . LYS A 1 41 ? -28.265 4.088 15.760 1.00 31.97 ? 402 LYS A NZ 1 |
| ATOM 315 N N . VAL A 1 42 ? -32.332 2.664 9.580 1.00 14.99 ? 403 VAL A N 1 |
| ATOM 316 C CA . VAL A 1 42 ? -32.977 3.087 8.357 1.00 14.61 ? 403 VAL A CA 1 |
| ATOM 317 C C . VAL A 1 42 ? -34.394 3.557 8.686 1.00 17.43 ? 403 VAL A C 1 |
| ATOM 318 O O . VAL A 1 42 ? -35.169 2.804 9.282 1.00 18.02 ? 403 VAL A O 1 |
| ATOM 319 C CB . VAL A 1 42 ? -33.000 1.942 7.331 1.00 15.56 ? 403 VAL A CB 1 |
| ATOM 320 C CG1 . VAL A 1 42 ? -33.843 2.325 6.126 1.00 16.18 ? 403 VAL A CG1 1 |
| ATOM 321 C CG2 . VAL A 1 42 ? -31.602 1.503 6.926 1.00 16.78 ? 403 VAL A CG2 1 |
| ATOM 322 N N . TYR A 1 43 ? -34.725 4.805 8.304 1.00 17.07 ? 404 TYR A N 1 |
| ATOM 323 C CA . TYR A 1 43 ? -36.048 5.396 8.523 1.00 16.72 ? 404 TYR A CA 1 |
| ATOM 324 C C . TYR A 1 43 ? -36.751 5.751 7.207 1.00 18.11 ? 404 TYR A C 1 |
| ATOM 325 O O . TYR A 1 43 ? -36.128 5.970 6.162 1.00 15.36 ? 404 TYR A O 1 |
| ATOM 326 C CB . TYR A 1 43 ? -35.914 6.721 9.275 1.00 17.51 ? 404 TYR A CB 1 |
| ATOM 327 C CG . TYR A 1 43 ? -35.006 6.697 10.489 1.00 19.49 ? 404 TYR A CG 1 |
| ATOM 328 C CD1 . TYR A 1 43 ? -33.632 6.751 10.340 1.00 19.27 ? 404 TYR A CD1 1 |
| ATOM 329 C CD2 . TYR A 1 43 ? -35.522 6.620 11.785 1.00 16.91 ? 404 TYR A CD2 1 |
| ATOM 330 C CE1 . TYR A 1 43 ? -32.795 6.752 11.438 1.00 18.05 ? 404 TYR A CE1 1 |
| ATOM 331 C CE2 . TYR A 1 43 ? -34.693 6.633 12.904 1.00 19.25 ? 404 TYR A CE2 1 |
| ATOM 332 C CZ . TYR A 1 43 ? -33.323 6.695 12.719 1.00 21.51 ? 404 TYR A CZ 1 |
| ATOM 333 O OH . TYR A 1 43 ? -32.482 6.660 13.790 1.00 20.43 ? 404 TYR A OH 1 |
| ATOM 334 N N . ARG A 1 44 ? -38.079 5.856 7.266 1.00 18.35 ? 405 ARG A N 1 |
| ATOM 335 C CA . ARG A 1 44 ? -38.859 6.305 6.123 1.00 20.16 ? 405 ARG A CA 1 |
| ATOM 336 C C . ARG A 1 44 ? -40.003 7.178 6.623 1.00 21.74 ? 405 ARG A C 1 |
| ATOM 337 O O . ARG A 1 44 ? -40.340 7.118 7.814 1.00 23.11 ? 405 ARG A O 1 |
| ATOM 338 C CB . ARG A 1 44 ? -39.446 5.111 5.366 1.00 20.42 ? 405 ARG A CB 1 |
| ATOM 339 C CG . ARG A 1 44 ? -40.749 4.602 5.970 1.00 25.53 ? 405 ARG A CG 1 |
| ATOM 340 C CD . ARG A 1 44 ? -41.336 3.330 5.331 1.00 32.06 ? 405 ARG A CD 1 |
| ATOM 341 N NE . ARG A 1 44 ? -42.541 2.785 5.990 1.00 36.25 ? 405 ARG A NE 1 |
| ATOM 342 C CZ . ARG A 1 44 ? -43.827 2.984 5.613 1.00 45.01 ? 405 ARG A CZ 1 |
| ATOM 343 N NH1 . ARG A 1 44 ? -44.141 3.614 4.486 1.00 37.07 ? 405 ARG A NH1 1 |
| ATOM 344 N NH2 . ARG A 1 44 ? -44.816 2.530 6.368 1.00 43.15 ? 405 ARG A NH2 1 |
| ATOM 345 N N . ARG A 1 45 ? -40.569 7.999 5.724 1.00 19.87 ? 406 ARG A N 1 |
| ATOM 346 C CA . ARG A 1 45 ? -41.871 8.605 5.945 1.00 21.44 ? 406 ARG A CA 1 |
| ATOM 347 C C . ARG A 1 45 ? -42.799 8.044 4.880 1.00 20.19 ? 406 ARG A C 1 |
| ATOM 348 O O . ARG A 1 45 ? -42.367 7.756 3.778 1.00 17.90 ? 406 ARG A O 1 |
| ATOM 349 C CB . ARG A 1 45 ? -41.830 10.130 5.832 1.00 24.10 ? 406 ARG A CB 1 |
| ATOM 350 C CG . ARG A 1 45 ? -40.596 10.764 6.448 1.00 32.75 ? 406 ARG A CG 1 |
| ATOM 351 C CD . ARG A 1 45 ? -40.865 12.001 7.287 1.00 39.61 ? 406 ARG A CD 1 |
| ATOM 352 N NE . ARG A 1 45 ? -41.572 13.040 6.561 1.00 48.08 ? 406 ARG A NE 1 |
| ATOM 353 C CZ . ARG A 1 45 ? -41.010 13.786 5.609 1.00 55.99 ? 406 ARG A CZ 1 |
| ATOM 354 N NH1 . ARG A 1 45 ? -41.748 14.576 4.843 1.00 56.28 ? 406 ARG A NH1 1 |
| ATOM 355 N NH2 . ARG A 1 45 ? -39.708 13.709 5.397 1.00 52.40 ? 406 ARG A NH2 1 |
| ATOM 356 N N . GLU A 1 46 ? -44.061 7.866 5.224 1.00 18.46 ? 407 GLU A N 1 |
| ATOM 357 C CA . GLU A 1 46 ? -44.990 7.269 4.299 1.00 20.40 ? 407 GLU A CA 1 |
| ATOM 358 C C . GLU A 1 46 ? -45.618 8.447 3.557 1.00 20.20 ? 407 GLU A C 1 |
| ATOM 359 O O . GLU A 1 46 ? -46.214 9.303 4.190 1.00 20.07 ? 407 GLU A O 1 |
| ATOM 360 C CB . GLU A 1 46 ? -45.957 6.378 5.097 1.00 26.33 ? 407 GLU A CB 1 |
| ATOM 361 C CG . GLU A 1 46 ? -47.204 6.029 4.313 1.00 35.18 ? 407 GLU A CG 1 |
| ATOM 362 C CD . GLU A 1 46 ? -48.428 5.566 5.096 1.00 47.57 ? 407 GLU A CD 1 |
| ATOM 363 O OE1 . GLU A 1 46 ? -48.420 5.655 6.359 1.00 49.29 ? 407 GLU A OE1 1 |
| ATOM 364 O OE2 . GLU A 1 46 ? -49.399 5.120 4.435 1.00 51.90 ? 407 GLU A OE2 1 |
| ATOM 365 N N . VAL A 1 47 ? -45.351 8.564 2.253 1.00 18.60 ? 408 VAL A N 1 |
| ATOM 366 C CA . VAL A 1 47 ? -45.835 9.690 1.471 1.00 16.53 ? 408 VAL A CA 1 |
| ATOM 367 C C . VAL A 1 47 ? -46.238 9.138 0.113 1.00 16.28 ? 408 VAL A C 1 |
| ATOM 368 O O . VAL A 1 47 ? -45.488 8.358 -0.466 1.00 14.01 ? 408 VAL A O 1 |
| ATOM 369 C CB . VAL A 1 47 ? -44.733 10.746 1.259 1.00 15.88 ? 408 VAL A CB 1 |
| ATOM 370 C CG1 . VAL A 1 47 ? -45.191 11.881 0.346 1.00 13.74 ? 408 VAL A CG1 1 |
| ATOM 371 C CG2 . VAL A 1 47 ? -44.197 11.308 2.569 1.00 16.58 ? 408 VAL A CG2 1 |
| ATOM 372 N N . GLU A 1 48 ? -47.417 9.529 -0.355 1.00 16.68 ? 409 GLU A N 1 |
| ATOM 373 C CA . GLU A 1 48 ? -47.893 9.231 -1.702 1.00 18.97 ? 409 GLU A CA 1 |
| ATOM 374 C C . GLU A 1 48 ? -48.297 10.531 -2.379 1.00 19.23 ? 409 GLU A C 1 |
| ATOM 375 O O . GLU A 1 48 ? -48.974 11.369 -1.774 1.00 17.25 ? 409 GLU A O 1 |
| ATOM 376 C CB . GLU A 1 48 ? -49.130 8.339 -1.644 1.00 24.27 ? 409 GLU A CB 1 |
| ATOM 377 C CG . GLU A 1 48 ? -48.701 6.956 -1.167 1.00 37.63 ? 409 GLU A CG 1 |
| ATOM 378 C CD . GLU A 1 48 ? -49.733 6.078 -0.476 1.00 46.95 ? 409 GLU A CD 1 |
| ATOM 379 O OE1 . GLU A 1 48 ? -50.880 6.056 -0.998 1.00 53.47 ? 409 GLU A OE1 1 |
| ATOM 380 O OE2 . GLU A 1 48 ? -49.393 5.420 0.573 1.00 48.87 ? 409 GLU A OE2 1 |
| ATOM 381 N N . GLU A 1 49 ? -47.917 10.668 -3.653 1.00 21.18 ? 410 GLU A N 1 |
| ATOM 382 C CA . GLU A 1 49 ? -48.433 11.781 -4.450 1.00 23.55 ? 410 GLU A CA 1 |
| ATOM 383 C C . GLU A 1 49 ? -49.097 11.222 -5.701 1.00 27.27 ? 410 GLU A C 1 |
| ATOM 384 O O . GLU A 1 49 ? -48.500 10.381 -6.382 1.00 25.17 ? 410 GLU A O 1 |
| ATOM 385 C CB . GLU A 1 49 ? -47.333 12.765 -4.831 1.00 28.45 ? 410 GLU A CB 1 |
| ATOM 386 C CG . GLU A 1 49 ? -47.766 13.606 -6.022 1.00 35.94 ? 410 GLU A CG 1 |
| ATOM 387 C CD . GLU A 1 49 ? -47.103 14.960 -6.161 1.00 39.45 ? 410 GLU A CD 1 |
| ATOM 388 O OE1 . GLU A 1 49 ? -46.046 15.140 -5.527 1.00 41.04 ? 410 GLU A OE1 1 |
| ATOM 389 O OE2 . GLU A 1 49 ? -47.679 15.845 -6.879 1.00 50.15 ? 410 GLU A OE2 1 |
| ATOM 390 N N . ASN A 1 50 ? -50.338 11.659 -5.945 1.00 27.16 ? 411 ASN A N 1 |
| ATOM 391 C CA . ASN A 1 50 ? -51.135 11.182 -7.063 1.00 33.77 ? 411 ASN A CA 1 |
| ATOM 392 C C . ASN A 1 50 ? -51.212 9.665 -6.994 1.00 32.93 ? 411 ASN A C 1 |
| ATOM 393 O O . ASN A 1 50 ? -51.020 9.023 -8.015 1.00 34.08 ? 411 ASN A O 1 |
| ATOM 394 C CB . ASN A 1 50 ? -50.499 11.516 -8.426 1.00 36.08 ? 411 ASN A CB 1 |
| ATOM 395 C CG . ASN A 1 50 ? -50.171 12.985 -8.665 1.00 43.41 ? 411 ASN A CG 1 |
| ATOM 396 O OD1 . ASN A 1 50 ? -50.888 13.898 -8.231 1.00 50.45 ? 411 ASN A OD1 1 |
| ATOM 397 N ND2 . ASN A 1 50 ? -49.068 13.241 -9.356 1.00 54.35 ? 411 ASN A ND2 1 |
| ATOM 398 N N . GLY A 1 51 ? -51.336 9.115 -5.784 1.00 30.01 ? 412 GLY A N 1 |
| ATOM 399 C CA . GLY A 1 51 ? -51.393 7.677 -5.581 1.00 27.59 ? 412 GLY A CA 1 |
| ATOM 400 C C . GLY A 1 51 ? -50.075 6.947 -5.864 1.00 31.65 ? 412 GLY A C 1 |
| ATOM 401 O O . GLY A 1 51 ? -50.035 5.727 -5.971 1.00 37.20 ? 412 GLY A O 1 |
| ATOM 402 N N . ILE A 1 52 ? -48.951 7.651 -5.937 1.00 24.90 ? 413 ILE A N 1 |
| ATOM 403 C CA . ILE A 1 52 ? -47.700 6.938 -6.151 1.00 25.37 ? 413 ILE A CA 1 |
| ATOM 404 C C . ILE A 1 52 ? -46.811 7.061 -4.901 1.00 23.68 ? 413 ILE A C 1 |
| ATOM 405 O O . ILE A 1 52 ? -46.635 8.165 -4.376 1.00 18.95 ? 413 ILE A O 1 |
| ATOM 406 C CB . ILE A 1 52 ? -47.035 7.543 -7.395 1.00 28.17 ? 413 ILE A CB 1 |
| ATOM 407 C CG1 . ILE A 1 52 ? -47.832 7.134 -8.643 1.00 33.52 ? 413 ILE A CG1 1 |
| ATOM 408 C CG2 . ILE A 1 52 ? -45.570 7.152 -7.479 1.00 27.19 ? 413 ILE A CG2 1 |
| ATOM 409 C CD1 . ILE A 1 52 ? -47.547 7.955 -9.879 1.00 36.82 ? 413 ILE A CD1 1 |
| ATOM 410 N N . VAL A 1 53 ? -46.163 5.959 -4.490 1.00 19.83 ? 414 VAL A N 1 |
| ATOM 411 C CA . VAL A 1 53 ? -45.316 5.967 -3.289 1.00 20.86 ? 414 VAL A CA 1 |
| ATOM 412 C C . VAL A 1 53 ? -44.057 6.820 -3.504 1.00 17.55 ? 414 VAL A C 1 |
| ATOM 413 O O . VAL A 1 53 ? -43.320 6.628 -4.466 1.00 17.95 ? 414 VAL A O 1 |
| ATOM 414 C CB . VAL A 1 53 ? -44.962 4.529 -2.851 1.00 20.37 ? 414 VAL A CB 1 |
| ATOM 415 C CG1 . VAL A 1 53 ? -43.956 4.482 -1.703 1.00 18.61 ? 414 VAL A CG1 1 |
| ATOM 416 C CG2 . VAL A 1 53 ? -46.223 3.733 -2.528 1.00 24.55 ? 414 VAL A CG2 1 |
| ATOM 417 N N . LEU A 1 54 ? -43.822 7.796 -2.617 1.00 16.48 ? 415 LEU A N 1 |
| ATOM 418 C CA . LEU A 1 54 ? -42.657 8.661 -2.707 1.00 17.81 ? 415 LEU A CA 1 |
| ATOM 419 C C . LEU A 1 54 ? -41.760 8.482 -1.481 1.00 18.90 ? 415 LEU A C 1 |
| ATOM 420 O O . LEU A 1 54 ? -40.714 9.130 -1.432 1.00 22.13 ? 415 LEU A O 1 |
| ATOM 421 C CB . LEU A 1 54 ? -43.047 10.150 -2.753 1.00 19.55 ? 415 LEU A CB 1 |
| ATOM 422 C CG . LEU A 1 54 ? -43.857 10.676 -3.930 1.00 21.52 ? 415 LEU A CG 1 |
| ATOM 423 C CD1 . LEU A 1 54 ? -43.751 12.198 -4.026 1.00 25.67 ? 415 LEU A CD1 1 |
| ATOM 424 C CD2 . LEU A 1 54 ? -43.478 10.004 -5.251 1.00 21.60 ? 415 LEU A CD2 1 |
| ATOM 425 N N . ASP A 1 55 ? -42.182 7.641 -0.513 1.00 17.11 ? 416 ASP A N 1 |
| ATOM 426 C CA . ASP A 1 55 ? -41.631 7.524 0.838 1.00 15.83 ? 416 ASP A CA 1 |
| ATOM 427 C C . ASP A 1 55 ? -40.180 8.020 0.926 1.00 15.58 ? 416 ASP A C 1 |
| ATOM 428 O O . ASP A 1 55 ? -39.263 7.303 0.540 1.00 16.49 ? 416 ASP A O 1 |
| ATOM 429 C CB . ASP A 1 55 ? -41.606 6.045 1.294 1.00 16.40 ? 416 ASP A CB 1 |
| ATOM 430 C CG . ASP A 1 55 ? -42.984 5.421 1.539 1.00 19.80 ? 416 ASP A CG 1 |
| ATOM 431 O OD1 . ASP A 1 55 ? -44.021 6.093 1.255 1.00 18.15 ? 416 ASP A OD1 1 |
| ATOM 432 O OD2 . ASP A 1 55 ? -43.023 4.264 2.004 1.00 17.88 ? 416 ASP A OD2 1 |
| ATOM 433 N N . PRO A 1 56 ? -39.899 9.205 1.518 1.00 13.63 ? 417 PRO A N 1 |
| ATOM 434 C CA . PRO A 1 56 ? -38.522 9.632 1.782 1.00 14.93 ? 417 PRO A CA 1 |
| ATOM 435 C C . PRO A 1 56 ? -37.841 8.562 2.613 1.00 18.04 ? 417 PRO A C 1 |
| ATOM 436 O O . PRO A 1 56 ? -38.491 7.923 3.447 1.00 18.08 ? 417 PRO A O 1 |
| ATOM 437 C CB . PRO A 1 56 ? -38.723 10.943 2.579 1.00 13.78 ? 417 PRO A CB 1 |
| ATOM 438 C CG . PRO A 1 56 ? -40.027 11.492 2.012 1.00 13.32 ? 417 PRO A CG 1 |
| ATOM 439 C CD . PRO A 1 56 ? -40.876 10.238 1.845 1.00 11.84 ? 417 PRO A CD 1 |
| ATOM 440 N N . LEU A 1 57 ? -36.552 8.344 2.330 1.00 16.07 ? 418 LEU A N 1 |
| ATOM 441 C CA . LEU A 1 57 ? -35.756 7.368 3.048 1.00 16.47 ? 418 LEU A CA 1 |
| ATOM 442 C C . LEU A 1 57 ? -34.583 8.107 3.675 1.00 18.20 ? 418 LEU A C 1 |
| ATOM 443 O O . LEU A 1 57 ? -33.978 9.001 3.040 1.00 15.84 ? 418 LEU A O 1 |
| ATOM 444 C CB . LEU A 1 57 ? -35.198 6.362 2.039 1.00 21.34 ? 418 LEU A CB 1 |
| ATOM 445 C CG . LEU A 1 57 ? -34.245 5.370 2.687 1.00 27.51 ? 418 LEU A CG 1 |
| ATOM 446 C CD1 . LEU A 1 57 ? -34.763 3.938 2.598 1.00 29.44 ? 418 LEU A CD1 1 |
| ATOM 447 C CD2 . LEU A 1 57 ? -32.752 5.595 2.377 1.00 28.34 ? 418 LEU A CD2 1 |
| ATOM 448 N N . LYS A 1 58 ? -34.257 7.723 4.922 1.00 16.13 ? 419 LYS A N 1 |
| ATOM 449 C CA . LYS A 1 58 ? -33.092 8.290 5.579 1.00 17.07 ? 419 LYS A CA 1 |
| ATOM 450 C C . LYS A 1 58 ? -32.414 7.187 6.375 1.00 19.32 ? 419 LYS A C 1 |
| ATOM 451 O O . LYS A 1 58 ? -33.081 6.390 7.052 1.00 18.93 ? 419 LYS A O 1 |
| ATOM 452 C CB . LYS A 1 58 ? -33.516 9.376 6.570 1.00 18.93 ? 419 LYS A CB 1 |
| ATOM 453 C CG . LYS A 1 58 ? -32.369 10.028 7.350 1.00 20.92 ? 419 LYS A CG 1 |
| ATOM 454 C CD . LYS A 1 58 ? -32.867 11.339 7.980 1.00 24.15 ? 419 LYS A CD 1 |
| ATOM 455 C CE . LYS A 1 58 ? -31.863 12.160 8.784 1.00 22.46 ? 419 LYS A CE 1 |
| ATOM 456 N NZ . LYS A 1 58 ? -32.201 13.595 8.600 1.00 24.97 ? 419 LYS A NZ 1 |
| ATOM 457 N N . ALA A 1 59 ? -31.098 7.077 6.209 1.00 17.06 ? 420 ALA A N 1 |
| ATOM 458 C CA . ALA A 1 59 ? -30.354 6.076 6.955 1.00 18.54 ? 420 ALA A CA 1 |
| ATOM 459 C C . ALA A 1 59 ? -29.180 6.790 7.606 1.00 18.35 ? 420 ALA A C 1 |
| ATOM 460 O O . ALA A 1 59 ? -28.699 7.804 7.078 1.00 18.88 ? 420 ALA A O 1 |
| ATOM 461 C CB . ALA A 1 59 ? -29.899 4.950 6.060 1.00 14.99 ? 420 ALA A CB 1 |
| ATOM 462 N N . THR A 1 60 ? -28.759 6.263 8.758 1.00 17.61 ? 421 THR A N 1 |
| ATOM 463 C CA . THR A 1 60 ? -27.524 6.664 9.411 1.00 16.56 ? 421 THR A CA 1 |
| ATOM 464 C C . THR A 1 60 ? -26.700 5.412 9.639 1.00 18.55 ? 421 THR A C 1 |
| ATOM 465 O O . THR A 1 60 ? -27.218 4.304 9.804 1.00 14.73 ? 421 THR A O 1 |
| ATOM 466 C CB . THR A 1 60 ? -27.750 7.412 10.727 1.00 19.02 ? 421 THR A CB 1 |
| ATOM 467 O OG1 . THR A 1 60 ? -28.519 6.542 11.577 1.00 18.37 ? 421 THR A OG1 1 |
| ATOM 468 C CG2 . THR A 1 60 ? -28.453 8.743 10.544 1.00 20.00 ? 421 THR A CG2 1 |
| ATOM 469 N N . HIS A 1 61 ? -25.380 5.613 9.629 1.00 20.29 ? 422 HIS A N 1 |
| ATOM 470 C CA . HIS A 1 61 ? -24.468 4.485 9.737 1.00 21.54 ? 422 HIS A CA 1 |
| ATOM 471 C C . HIS A 1 61 ? -23.121 4.973 10.290 1.00 23.36 ? 422 HIS A C 1 |
| ATOM 472 O O . HIS A 1 61 ? -22.825 6.173 10.232 1.00 22.11 ? 422 HIS A O 1 |
| ATOM 473 C CB . HIS A 1 61 ? -24.321 3.809 8.382 1.00 22.88 ? 422 HIS A CB 1 |
| ATOM 474 C CG . HIS A 1 61 ? -23.831 2.417 8.527 1.00 26.83 ? 422 HIS A CG 1 |
| ATOM 475 N ND1 . HIS A 1 61 ? -23.829 1.786 9.749 1.00 27.91 ? 422 HIS A ND1 1 |
| ATOM 476 C CD2 . HIS A 1 61 ? -23.321 1.547 7.635 1.00 26.90 ? 422 HIS A CD2 1 |
| ATOM 477 C CE1 . HIS A 1 61 ? -23.319 0.581 9.619 1.00 25.10 ? 422 HIS A CE1 1 |
| ATOM 478 N NE2 . HIS A 1 61 ? -23.013 0.419 8.340 1.00 25.22 ? 422 HIS A NE2 1 |
| ATOM 479 N N . ALA A 1 62 ? -22.360 4.053 10.894 1.00 24.32 ? 423 ALA A N 1 |
| ATOM 480 C CA . ALA A 1 62 ? -21.058 4.370 11.482 1.00 25.44 ? 423 ALA A CA 1 |
| ATOM 481 C C . ALA A 1 62 ? -20.087 3.268 11.065 1.00 28.45 ? 423 ALA A C 1 |
| ATOM 482 O O . ALA A 1 62 ? -20.345 2.095 11.339 1.00 27.99 ? 423 ALA A O 1 |
| ATOM 483 C CB . ALA A 1 62 ? -21.207 4.505 12.975 1.00 25.17 ? 423 ALA A CB 1 |
| ATOM 484 N N . VAL A 1 63 ? -19.085 3.624 10.249 1.00 26.43 ? 424 VAL A N 1 |
| ATOM 485 C CA . VAL A 1 63 ? -18.256 2.630 9.584 1.00 28.21 ? 424 VAL A CA 1 |
| ATOM 486 C C . VAL A 1 63 ? -16.823 2.832 10.059 1.00 29.39 ? 424 VAL A C 1 |
| ATOM 487 O O . VAL A 1 63 ? -16.279 3.923 9.896 1.00 29.83 ? 424 VAL A O 1 |
| ATOM 488 C CB . VAL A 1 63 ? -18.296 2.797 8.057 1.00 27.37 ? 424 VAL A CB 1 |
| ATOM 489 C CG1 . VAL A 1 63 ? -17.502 1.710 7.342 1.00 27.39 ? 424 VAL A CG1 1 |
| ATOM 490 C CG2 . VAL A 1 63 ? -19.720 2.858 7.515 1.00 31.35 ? 424 VAL A CG2 1 |
| ATOM 491 N N . LYS A 1 64 ? -16.197 1.774 10.576 1.00 31.21 ? 425 LYS A N 1 |
| ATOM 492 C CA . LYS A 1 64 ? -14.855 1.906 11.141 1.00 32.09 ? 425 LYS A CA 1 |
| ATOM 493 C C . LYS A 1 64 ? -13.841 1.846 10.010 1.00 29.70 ? 425 LYS A C 1 |
| ATOM 494 O O . LYS A 1 64 ? -13.995 1.050 9.100 1.00 29.66 ? 425 LYS A O 1 |
| ATOM 495 C CB . LYS A 1 64 ? -14.514 0.691 12.012 1.00 34.95 ? 425 LYS A CB 1 |
| ATOM 496 C CG . LYS A 1 64 ? -15.143 0.661 13.398 1.00 41.83 ? 425 LYS A CG 1 |
| ATOM 497 C CD . LYS A 1 64 ? -15.135 -0.760 13.954 1.00 43.96 ? 425 LYS A CD 1 |
| ATOM 498 C CE . LYS A 1 64 ? -14.491 -0.870 15.324 1.00 54.55 ? 425 LYS A CE 1 |
| ATOM 499 N NZ . LYS A 1 64 ? -15.447 -0.547 16.413 1.00 52.90 ? 425 LYS A NZ 1 |
| ATOM 500 N N . GLY A 1 65 ? -12.761 2.633 10.108 1.00 28.13 ? 426 GLY A N 1 |
| ATOM 501 C CA . GLY A 1 65 ? -11.631 2.383 9.240 1.00 25.12 ? 426 GLY A CA 1 |
| ATOM 502 C C . GLY A 1 65 ? -11.664 3.102 7.891 1.00 28.38 ? 426 GLY A C 1 |
| ATOM 503 O O . GLY A 1 65 ? -10.816 2.803 7.056 1.00 28.65 ? 426 GLY A O 1 |
| ATOM 504 N N . VAL A 1 66 ? -12.634 4.015 7.659 1.00 25.67 ? 427 VAL A N 1 |
| ATOM 505 C CA . VAL A 1 66 ? -12.638 4.787 6.420 1.00 25.60 ? 427 VAL A CA 1 |
| ATOM 506 C C . VAL A 1 66 ? -12.876 6.255 6.748 1.00 20.54 ? 427 VAL A C 1 |
| ATOM 507 O O . VAL A 1 66 ? -13.450 6.574 7.785 1.00 23.91 ? 427 VAL A O 1 |
| ATOM 508 C CB . VAL A 1 66 ? -13.694 4.301 5.404 1.00 28.76 ? 427 VAL A CB 1 |
| ATOM 509 C CG1 . VAL A 1 66 ? -13.350 2.922 4.851 1.00 28.21 ? 427 VAL A CG1 1 |
| ATOM 510 C CG2 . VAL A 1 66 ? -15.097 4.332 6.013 1.00 23.77 ? 427 VAL A CG2 1 |
| ATOM 511 N N . THR A 1 67 ? -12.514 7.135 5.822 1.00 19.67 ? 428 THR A N 1 |
| ATOM 512 C CA . THR A 1 67 ? -12.880 8.525 6.007 1.00 20.98 ? 428 THR A CA 1 |
| ATOM 513 C C . THR A 1 67 ? -14.074 8.855 5.120 1.00 19.98 ? 428 THR A C 1 |
| ATOM 514 O O . THR A 1 67 ? -14.387 8.133 4.178 1.00 21.36 ? 428 THR A O 1 |
| ATOM 515 C CB . THR A 1 67 ? -11.692 9.429 5.664 1.00 19.58 ? 428 THR A CB 1 |
| ATOM 516 O OG1 . THR A 1 67 ? -11.594 9.389 4.230 1.00 20.51 ? 428 THR A OG1 1 |
| ATOM 517 C CG2 . THR A 1 67 ? -10.416 8.937 6.316 1.00 20.75 ? 428 THR A CG2 1 |
| ATOM 518 N N . GLY A 1 68 ? -14.662 10.015 5.378 1.00 19.80 ? 429 GLY A N 1 |
| ATOM 519 C CA . GLY A 1 68 ? -15.744 10.513 4.554 1.00 17.84 ? 429 GLY A CA 1 |
| ATOM 520 C C . GLY A 1 68 ? -15.257 10.834 3.158 1.00 20.76 ? 429 GLY A C 1 |
| ATOM 521 O O . GLY A 1 68 ? -15.969 10.640 2.181 1.00 17.80 ? 429 GLY A O 1 |
| ATOM 522 N N . HIS A 1 69 ? -14.003 11.287 3.065 1.00 20.67 ? 430 HIS A N 1 |
| ATOM 523 C CA . HIS A 1 69 ? -13.452 11.591 1.753 1.00 20.60 ? 430 HIS A CA 1 |
| ATOM 524 C C . HIS A 1 69 ? -13.376 10.315 0.909 1.00 20.64 ? 430 HIS A C 1 |
| ATOM 525 O O . HIS A 1 69 ? -13.728 10.290 -0.278 1.00 19.47 ? 430 HIS A O 1 |
| ATOM 526 C CB . HIS A 1 69 ? -12.084 12.294 1.912 1.00 21.21 ? 430 HIS A CB 1 |
| ATOM 527 C CG . HIS A 1 69 ? -11.585 12.910 0.647 1.00 23.66 ? 430 HIS A CG 1 |
| ATOM 528 N ND1 . HIS A 1 69 ? -10.329 13.492 0.550 1.00 26.09 ? 430 HIS A ND1 1 |
| ATOM 529 C CD2 . HIS A 1 69 ? -12.132 12.985 -0.588 1.00 24.24 ? 430 HIS A CD2 1 |
| ATOM 530 C CE1 . HIS A 1 69 ? -10.128 13.929 -0.683 1.00 23.74 ? 430 HIS A CE1 1 |
| ATOM 531 N NE2 . HIS A 1 69 ? -11.234 13.637 -1.406 1.00 23.47 ? 430 HIS A NE2 1 |
| ATOM 532 N N . GLU A 1 70 ? -12.894 9.248 1.524 1.00 19.12 ? 431 GLU A N 1 |
| ATOM 533 C CA . GLU A 1 70 ? -12.836 7.950 0.874 1.00 20.97 ? 431 GLU A CA 1 |
| ATOM 534 C C . GLU A 1 70 ? -14.238 7.483 0.468 1.00 19.98 ? 431 GLU A C 1 |
| ATOM 535 O O . GLU A 1 70 ? -14.461 7.149 -0.684 1.00 22.26 ? 431 GLU A O 1 |
| ATOM 536 C CB . GLU A 1 70 ? -12.125 6.965 1.802 1.00 19.85 ? 431 GLU A CB 1 |
| ATOM 537 C CG . GLU A 1 70 ? -10.639 7.302 1.951 1.00 21.68 ? 431 GLU A CG 1 |
| ATOM 538 C CD . GLU A 1 70 ? -9.884 6.470 2.970 1.00 23.96 ? 431 GLU A CD 1 |
| ATOM 539 O OE1 . GLU A 1 70 ? -10.503 5.974 3.970 1.00 23.01 ? 431 GLU A OE1 1 |
| ATOM 540 O OE2 . GLU A 1 70 ? -8.662 6.276 2.750 1.00 25.40 ? 431 GLU A OE2 1 |
| ATOM 541 N N . VAL A 1 71 ? -15.179 7.490 1.419 1.00 19.36 ? 432 VAL A N 1 |
| ATOM 542 C CA . VAL A 1 71 ? -16.522 6.995 1.159 1.00 19.31 ? 432 VAL A CA 1 |
| ATOM 543 C C . VAL A 1 71 ? -17.090 7.780 -0.023 1.00 20.91 ? 432 VAL A C 1 |
| ATOM 544 O O . VAL A 1 71 ? -17.611 7.186 -0.976 1.00 22.31 ? 432 VAL A O 1 |
| ATOM 545 C CB . VAL A 1 71 ? -17.382 7.076 2.441 1.00 17.85 ? 432 VAL A CB 1 |
| ATOM 546 C CG1 . VAL A 1 71 ? -18.846 6.764 2.150 1.00 16.88 ? 432 VAL A CG1 1 |
| ATOM 547 C CG2 . VAL A 1 71 ? -16.860 6.089 3.459 1.00 18.62 ? 432 VAL A CG2 1 |
| ATOM 548 N N . CYS A 1 72 ? -16.927 9.113 -0.010 1.00 16.76 ? 433 CYS A N 1 |
| ATOM 549 C CA . CYS A 1 72 ? -17.568 9.899 -1.050 1.00 17.46 ? 433 CYS A CA 1 |
| ATOM 550 C C . CYS A 1 72 ? -16.909 9.663 -2.412 1.00 19.59 ? 433 CYS A C 1 |
| ATOM 551 O O . CYS A 1 72 ? -17.595 9.649 -3.448 1.00 18.02 ? 433 CYS A O 1 |
| ATOM 552 C CB . CYS A 1 72 ? -17.657 11.386 -0.703 1.00 17.23 ? 433 CYS A CB 1 |
| ATOM 553 S SG . CYS A 1 72 ? -18.903 11.778 0.564 1.00 20.03 ? 433 CYS A SG 1 |
| ATOM 554 N N . ASN A 1 73 ? -15.571 9.487 -2.422 1.00 21.03 ? 434 ASN A N 1 |
| ATOM 555 C CA . ASN A 1 73 ? -14.878 9.259 -3.681 1.00 21.69 ? 434 ASN A CA 1 |
| ATOM 556 C C . ASN A 1 73 ? -15.425 7.970 -4.297 1.00 20.47 ? 434 ASN A C 1 |
| ATOM 557 O O . ASN A 1 73 ? -15.666 7.892 -5.506 1.00 19.75 ? 434 ASN A O 1 |
| ATOM 558 C CB . ASN A 1 73 ? -13.354 9.091 -3.516 1.00 22.19 ? 434 ASN A CB 1 |
| ATOM 559 C CG . ASN A 1 73 ? -12.611 10.393 -3.293 1.00 25.67 ? 434 ASN A CG 1 |
| ATOM 560 O OD1 . ASN A 1 73 ? -11.470 10.376 -2.822 1.00 33.61 ? 434 ASN A OD1 1 |
| ATOM 561 N ND2 . ASN A 1 73 ? -13.220 11.516 -3.619 1.00 22.25 ? 434 ASN A ND2 1 |
| ATOM 562 N N . TYR A 1 74 ? -15.531 6.943 -3.450 1.00 20.44 ? 435 TYR A N 1 |
| ATOM 563 C CA . TYR A 1 74 ? -15.931 5.658 -3.998 1.00 24.88 ? 435 TYR A CA 1 |
| ATOM 564 C C . TYR A 1 74 ? -17.375 5.710 -4.456 1.00 24.99 ? 435 TYR A C 1 |
| ATOM 565 O O . TYR A 1 74 ? -17.718 4.992 -5.393 1.00 27.29 ? 435 TYR A O 1 |
| ATOM 566 C CB . TYR A 1 74 ? -15.739 4.548 -2.981 1.00 25.64 ? 435 TYR A CB 1 |
| ATOM 567 C CG . TYR A 1 74 ? -14.323 4.049 -3.022 1.00 33.32 ? 435 TYR A CG 1 |
| ATOM 568 C CD1 . TYR A 1 74 ? -13.910 3.146 -3.992 1.00 34.85 ? 435 TYR A CD1 1 |
| ATOM 569 C CD2 . TYR A 1 74 ? -13.377 4.530 -2.126 1.00 34.21 ? 435 TYR A CD2 1 |
| ATOM 570 C CE1 . TYR A 1 74 ? -12.598 2.684 -4.040 1.00 34.08 ? 435 TYR A CE1 1 |
| ATOM 571 C CE2 . TYR A 1 74 ? -12.072 4.073 -2.152 1.00 34.55 ? 435 TYR A CE2 1 |
| ATOM 572 C CZ . TYR A 1 74 ? -11.686 3.159 -3.116 1.00 36.56 ? 435 TYR A CZ 1 |
| ATOM 573 O OH . TYR A 1 74 ? -10.406 2.716 -3.128 1.00 36.97 ? 435 TYR A OH 1 |
| ATOM 574 N N . PHE A 1 75 ? -18.203 6.538 -3.790 1.00 21.13 ? 436 PHE A N 1 |
| ATOM 575 C CA . PHE A 1 75 ? -19.612 6.609 -4.152 1.00 19.83 ? 436 PHE A CA 1 |
| ATOM 576 C C . PHE A 1 75 ? -19.739 7.402 -5.447 1.00 19.67 ? 436 PHE A C 1 |
| ATOM 577 O O . PHE A 1 75 ? -20.631 7.146 -6.252 1.00 21.10 ? 436 PHE A O 1 |
| ATOM 578 C CB . PHE A 1 75 ? -20.450 7.140 -2.981 1.00 18.59 ? 436 PHE A CB 1 |
| ATOM 579 C CG . PHE A 1 75 ? -21.945 7.276 -3.224 1.00 19.65 ? 436 PHE A CG 1 |
| ATOM 580 C CD1 . PHE A 1 75 ? -22.769 6.154 -3.270 1.00 17.75 ? 436 PHE A CD1 1 |
| ATOM 581 C CD2 . PHE A 1 75 ? -22.541 8.530 -3.353 1.00 17.11 ? 436 PHE A CD2 1 |
| ATOM 582 C CE1 . PHE A 1 75 ? -24.154 6.295 -3.401 1.00 16.53 ? 436 PHE A CE1 1 |
| ATOM 583 C CE2 . PHE A 1 75 ? -23.911 8.672 -3.541 1.00 18.28 ? 436 PHE A CE2 1 |
| ATOM 584 C CZ . PHE A 1 75 ? -24.728 7.545 -3.546 1.00 15.56 ? 436 PHE A CZ 1 |
| ATOM 585 N N . TRP A 1 76 ? -18.797 8.329 -5.676 1.00 18.21 ? 437 TRP A N 1 |
| ATOM 586 C CA . TRP A 1 76 ? -18.949 9.250 -6.779 1.00 19.66 ? 437 TRP A CA 1 |
| ATOM 587 C C . TRP A 1 76 ? -18.254 8.735 -8.035 1.00 21.84 ? 437 TRP A C 1 |
| ATOM 588 O O . TRP A 1 76 ? -18.645 9.076 -9.166 1.00 22.50 ? 437 TRP A O 1 |
| ATOM 589 C CB . TRP A 1 76 ? -18.372 10.616 -6.439 1.00 15.67 ? 437 TRP A CB 1 |
| ATOM 590 C CG . TRP A 1 76 ? -18.557 11.601 -7.543 1.00 17.49 ? 437 TRP A CG 1 |
| ATOM 591 C CD1 . TRP A 1 76 ? -19.698 12.284 -7.865 1.00 17.80 ? 437 TRP A CD1 1 |
| ATOM 592 C CD2 . TRP A 1 76 ? -17.565 12.017 -8.490 1.00 18.33 ? 437 TRP A CD2 1 |
| ATOM 593 N NE1 . TRP A 1 76 ? -19.478 13.114 -8.932 1.00 19.90 ? 437 TRP A NE1 1 |
| ATOM 594 C CE2 . TRP A 1 76 ? -18.164 13.000 -9.314 1.00 19.68 ? 437 TRP A CE2 1 |
| ATOM 595 C CE3 . TRP A 1 76 ? -16.208 11.699 -8.661 1.00 21.32 ? 437 TRP A CE3 1 |
| ATOM 596 C CZ2 . TRP A 1 76 ? -17.474 13.650 -10.341 1.00 18.68 ? 437 TRP A CZ2 1 |
| ATOM 597 C CZ3 . TRP A 1 76 ? -15.537 12.336 -9.683 1.00 23.96 ? 437 TRP A CZ3 1 |
| ATOM 598 C CH2 . TRP A 1 76 ? -16.166 13.284 -10.508 1.00 22.07 ? 437 TRP A CH2 1 |
| ATOM 599 N N . ASN A 1 77 ? -17.174 7.998 -7.828 1.00 24.79 ? 438 ASN A N 1 |
| ATOM 600 C CA . ASN A 1 77 ? -16.257 7.764 -8.939 1.00 30.16 ? 438 ASN A CA 1 |
| ATOM 601 C C . ASN A 1 77 ? -16.847 6.736 -9.924 1.00 23.16 ? 438 ASN A C 1 |
| ATOM 602 O O . ASN A 1 77 ? -16.996 5.587 -9.567 1.00 28.41 ? 438 ASN A O 1 |
| ATOM 603 C CB . ASN A 1 77 ? -14.886 7.483 -8.310 1.00 35.46 ? 438 ASN A CB 1 |
| ATOM 604 C CG . ASN A 1 77 ? -13.906 6.835 -9.253 1.00 49.79 ? 438 ASN A CG 1 |
| ATOM 605 O OD1 . ASN A 1 77 ? -13.854 7.191 -10.433 1.00 52.22 ? 438 ASN A OD1 1 |
| ATOM 606 N ND2 . ASN A 1 77 ? -13.137 5.888 -8.731 1.00 49.80 ? 438 ASN A ND2 1 |
| ATOM 607 N N . VAL A 1 78 ? -17.224 7.121 -11.158 1.00 26.68 ? 439 VAL A N 1 |
| ATOM 608 C CA . VAL A 1 78 ? -17.930 6.187 -12.051 1.00 28.04 ? 439 VAL A CA 1 |
| ATOM 609 C C . VAL A 1 78 ? -17.055 4.977 -12.414 1.00 33.04 ? 439 VAL A C 1 |
| ATOM 610 O O . VAL A 1 78 ? -17.574 3.927 -12.766 1.00 33.61 ? 439 VAL A O 1 |
| ATOM 611 C CB . VAL A 1 78 ? -18.499 6.829 -13.334 1.00 27.24 ? 439 VAL A CB 1 |
| ATOM 612 C CG1 . VAL A 1 78 ? -19.570 7.868 -13.044 1.00 32.24 ? 439 VAL A CG1 1 |
| ATOM 613 C CG2 . VAL A 1 78 ? -17.440 7.434 -14.227 1.00 25.21 ? 439 VAL A CG2 1 |
| ATOM 614 N N . ASP A 1 79 ? -15.739 5.095 -12.232 1.00 33.22 ? 440 ASP A N 1 |
| ATOM 615 C CA . ASP A 1 79 ? -14.779 4.085 -12.654 1.00 40.23 ? 440 ASP A CA 1 |
| ATOM 616 C C . ASP A 1 79 ? -14.911 2.820 -11.823 1.00 43.10 ? 440 ASP A C 1 |
| ATOM 617 O O . ASP A 1 79 ? -14.454 1.774 -12.252 1.00 45.06 ? 440 ASP A O 1 |
| ATOM 618 C CB . ASP A 1 79 ? -13.336 4.571 -12.518 1.00 43.02 ? 440 ASP A CB 1 |
| ATOM 619 C CG . ASP A 1 79 ? -12.966 5.530 -13.623 1.00 52.17 ? 440 ASP A CG 1 |
| ATOM 620 O OD1 . ASP A 1 79 ? -13.547 5.391 -14.716 1.00 53.44 ? 440 ASP A OD1 1 |
| ATOM 621 O OD2 . ASP A 1 79 ? -12.110 6.407 -13.379 1.00 61.95 ? 440 ASP A OD2 1 |
| ATOM 622 N N . VAL A 1 80 ? -15.475 2.924 -10.617 1.00 33.42 ? 441 VAL A N 1 |
| ATOM 623 C CA . VAL A 1 80 ? -15.637 1.754 -9.762 1.00 31.75 ? 441 VAL A CA 1 |
| ATOM 624 C C . VAL A 1 80 ? -17.134 1.504 -9.577 1.00 31.98 ? 441 VAL A C 1 |
| ATOM 625 O O . VAL A 1 80 ? -17.539 0.625 -8.813 1.00 32.25 ? 441 VAL A O 1 |
| ATOM 626 C CB . VAL A 1 80 ? -14.926 1.966 -8.403 1.00 33.60 ? 441 VAL A CB 1 |
| ATOM 627 C CG1 . VAL A 1 80 ? -13.471 2.413 -8.600 1.00 29.83 ? 441 VAL A CG1 1 |
| ATOM 628 C CG2 . VAL A 1 80 ? -15.657 2.994 -7.544 1.00 38.07 ? 441 VAL A CG2 1 |
| ATOM 629 N N . ARG A 1 81 ? -17.952 2.313 -10.273 1.00 35.84 ? 442 ARG A N 1 |
| ATOM 630 C CA . ARG A 1 81 ? -19.399 2.237 -10.121 1.00 36.77 ? 442 ARG A CA 1 |
| ATOM 631 C C . ARG A 1 81 ? -19.862 0.788 -10.272 1.00 38.10 ? 442 ARG A C 1 |
| ATOM 632 O O . ARG A 1 81 ? -20.655 0.299 -9.465 1.00 35.37 ? 442 ARG A O 1 |
| ATOM 633 C CB . ARG A 1 81 ? -20.104 3.227 -11.055 1.00 37.06 ? 442 ARG A CB 1 |
| ATOM 634 C CG . ARG A 1 81 ? -21.627 3.193 -10.946 1.00 41.13 ? 442 ARG A CG 1 |
| ATOM 635 C CD . ARG A 1 81 ? -22.251 3.709 -9.641 1.00 34.22 ? 442 ARG A CD 1 |
| ATOM 636 N NE . ARG A 1 81 ? -21.714 4.985 -9.185 1.00 32.54 ? 442 ARG A NE 1 |
| ATOM 637 C CZ . ARG A 1 81 ? -22.127 6.186 -9.580 1.00 32.63 ? 442 ARG A CZ 1 |
| ATOM 638 N NH1 . ARG A 1 81 ? -21.474 7.269 -9.192 1.00 33.14 ? 442 ARG A NH1 1 |
| ATOM 639 N NH2 . ARG A 1 81 ? -23.198 6.321 -10.342 1.00 31.61 ? 442 ARG A NH2 1 |
| ATOM 640 N N . ASN A 1 82 ? -19.302 0.063 -11.258 1.00 44.32 ? 443 ASN A N 1 |
| ATOM 641 C CA . ASN A 1 82 ? -19.792 -1.281 -11.524 1.00 42.48 ? 443 ASN A CA 1 |
| ATOM 642 C C . ASN A 1 82 ? -19.340 -2.295 -10.471 1.00 44.99 ? 443 ASN A C 1 |
| ATOM 643 O O . ASN A 1 82 ? -19.886 -3.396 -10.437 1.00 48.95 ? 443 ASN A O 1 |
| ATOM 644 C CB . ASN A 1 82 ? -19.574 -1.737 -12.973 1.00 46.06 ? 443 ASN A CB 1 |
| ATOM 645 C CG . ASN A 1 82 ? -20.473 -1.019 -13.964 1.00 46.60 ? 443 ASN A CG 1 |
| ATOM 646 O OD1 . ASN A 1 82 ? -19.990 -0.496 -14.961 1.00 47.93 ? 443 ASN A OD1 1 |
| ATOM 647 N ND2 . ASN A 1 82 ? -21.772 -0.954 -13.701 1.00 42.74 ? 443 ASN A ND2 1 |
| ATOM 648 N N . ASP A 1 83 ? -18.406 -1.950 -9.573 1.00 40.13 ? 444 ASP A N 1 |
| ATOM 649 C CA . ASP A 1 83 ? -17.979 -2.966 -8.620 1.00 37.65 ? 444 ASP A CA 1 |
| ATOM 650 C C . ASP A 1 83 ? -18.955 -3.123 -7.473 1.00 41.54 ? 444 ASP A C 1 |
| ATOM 651 O O . ASP A 1 83 ? -19.061 -4.202 -6.919 1.00 47.29 ? 444 ASP A O 1 |
| ATOM 652 C CB . ASP A 1 83 ? -16.707 -2.627 -7.843 1.00 50.20 ? 444 ASP A CB 1 |
| ATOM 653 C CG . ASP A 1 83 ? -15.497 -2.326 -8.699 1.00 44.93 ? 444 ASP A CG 1 |
| ATOM 654 O OD1 . ASP A 1 83 ? -15.645 -2.301 -9.922 1.00 51.48 ? 444 ASP A OD1 1 |
| ATOM 655 O OD2 . ASP A 1 83 ? -14.430 -2.077 -8.114 1.00 53.72 ? 444 ASP A OD2 1 |
| ATOM 656 N N . TRP A 1 84 ? -19.601 -2.041 -7.039 1.00 37.60 ? 445 TRP A N 1 |
| ATOM 657 C CA . TRP A 1 84 ? -20.386 -2.195 -5.830 1.00 38.77 ? 445 TRP A CA 1 |
| ATOM 658 C C . TRP A 1 84 ? -21.874 -2.130 -6.172 1.00 35.62 ? 445 TRP A C 1 |
| ATOM 659 O O . TRP A 1 84 ? -22.720 -2.542 -5.380 1.00 40.72 ? 445 TRP A O 1 |
| ATOM 660 C CB . TRP A 1 84 ? -19.980 -1.147 -4.777 1.00 40.38 ? 445 TRP A CB 1 |
| ATOM 661 C CG . TRP A 1 84 ? -19.989 0.258 -5.295 1.00 36.20 ? 445 TRP A CG 1 |
| ATOM 662 C CD1 . TRP A 1 84 ? -18.943 0.958 -5.831 1.00 38.66 ? 445 TRP A CD1 1 |
| ATOM 663 C CD2 . TRP A 1 84 ? -21.129 1.135 -5.355 1.00 34.57 ? 445 TRP A CD2 1 |
| ATOM 664 N NE1 . TRP A 1 84 ? -19.347 2.213 -6.219 1.00 33.26 ? 445 TRP A NE1 1 |
| ATOM 665 C CE2 . TRP A 1 84 ? -20.678 2.356 -5.910 1.00 32.80 ? 445 TRP A CE2 1 |
| ATOM 666 C CE3 . TRP A 1 84 ? -22.464 1.021 -4.944 1.00 32.80 ? 445 TRP A CE3 1 |
| ATOM 667 C CZ2 . TRP A 1 84 ? -21.533 3.437 -6.104 1.00 31.65 ? 445 TRP A CZ2 1 |
| ATOM 668 C CZ3 . TRP A 1 84 ? -23.308 2.094 -5.141 1.00 30.09 ? 445 TRP A CZ3 1 |
| ATOM 669 C CH2 . TRP A 1 84 ? -22.847 3.279 -5.715 1.00 29.95 ? 445 TRP A CH2 1 |
| ATOM 670 N N . GLU A 1 85 ? -22.179 -1.560 -7.339 1.00 34.90 ? 446 GLU A N 1 |
| ATOM 671 C CA . GLU A 1 85 ? -23.552 -1.187 -7.635 1.00 36.32 ? 446 GLU A CA 1 |
| ATOM 672 C C . GLU A 1 85 ? -24.299 -2.482 -7.958 1.00 37.19 ? 446 GLU A C 1 |
| ATOM 673 O O . GLU A 1 85 ? -23.740 -3.317 -8.671 1.00 31.41 ? 446 GLU A O 1 |
| ATOM 674 C CB . GLU A 1 85 ? -23.539 -0.189 -8.784 1.00 43.28 ? 446 GLU A CB 1 |
| ATOM 675 C CG . GLU A 1 85 ? -24.913 0.059 -9.355 1.00 57.07 ? 446 GLU A CG 1 |
| ATOM 676 C CD . GLU A 1 85 ? -25.847 0.938 -8.541 1.00 51.24 ? 446 GLU A CD 1 |
| ATOM 677 O OE1 . GLU A 1 85 ? -25.719 2.178 -8.651 1.00 47.38 ? 446 GLU A OE1 1 |
| ATOM 678 O OE2 . GLU A 1 85 ? -26.732 0.385 -7.846 1.00 51.29 ? 446 GLU A OE2 1 |
| ATOM 679 N N . THR A 1 86 ? -25.474 -2.717 -7.351 1.00 33.37 ? 447 THR A N 1 |
| ATOM 680 C CA . THR A 1 86 ? -26.264 -3.882 -7.744 1.00 36.74 ? 447 THR A CA 1 |
| ATOM 681 C C . THR A 1 86 ? -27.612 -3.498 -8.353 1.00 40.10 ? 447 THR A C 1 |
| ATOM 682 O O . THR A 1 86 ? -28.321 -4.375 -8.828 1.00 43.55 ? 447 THR A O 1 |
| ATOM 683 C CB . THR A 1 86 ? -26.460 -4.931 -6.642 1.00 39.71 ? 447 THR A CB 1 |
| ATOM 684 O OG1 . THR A 1 86 ? -27.242 -4.382 -5.583 1.00 40.20 ? 447 THR A OG1 1 |
| ATOM 685 C CG2 . THR A 1 86 ? -25.164 -5.546 -6.147 1.00 38.42 ? 447 THR A CG2 1 |
| ATOM 686 N N . THR A 1 87 ? -27.929 -2.201 -8.431 1.00 35.15 ? 448 THR A N 1 |
| ATOM 687 C CA . THR A 1 87 ? -29.268 -1.809 -8.840 1.00 34.07 ? 448 THR A CA 1 |
| ATOM 688 C C . THR A 1 87 ? -29.385 -1.427 -10.318 1.00 28.95 ? 448 THR A C 1 |
| ATOM 689 O O . THR A 1 87 ? -30.496 -1.231 -10.794 1.00 29.10 ? 448 THR A O 1 |
| ATOM 690 C CB . THR A 1 87 ? -29.781 -0.653 -7.977 1.00 30.97 ? 448 THR A CB 1 |
| ATOM 691 O OG1 . THR A 1 87 ? -29.120 0.553 -8.381 1.00 35.99 ? 448 THR A OG1 1 |
| ATOM 692 C CG2 . THR A 1 87 ? -29.540 -0.910 -6.501 1.00 42.00 ? 448 THR A CG2 1 |
| ATOM 693 N N . ILE A 1 88 ? -28.281 -1.294 -11.060 1.00 24.92 ? 449 ILE A N 1 |
| ATOM 694 C CA . ILE A 1 88 ? -28.418 -0.773 -12.412 1.00 25.51 ? 449 ILE A CA 1 |
| ATOM 695 C C . ILE A 1 88 ? -28.074 -1.848 -13.438 1.00 25.51 ? 449 ILE A C 1 |
| ATOM 696 O O . ILE A 1 88 ? -27.259 -2.715 -13.195 1.00 26.30 ? 449 ILE A O 1 |
| ATOM 697 C CB . ILE A 1 88 ? -27.487 0.435 -12.625 1.00 26.61 ? 449 ILE A CB 1 |
| ATOM 698 C CG1 . ILE A 1 88 ? -26.054 0.026 -12.313 1.00 26.06 ? 449 ILE A CG1 1 |
| ATOM 699 C CG2 . ILE A 1 88 ? -27.898 1.638 -11.773 1.00 26.21 ? 449 ILE A CG2 1 |
| ATOM 700 C CD1 . ILE A 1 88 ? -25.051 0.986 -12.914 1.00 34.45 ? 449 ILE A CD1 1 |
| ATOM 701 N N . GLU A 1 89 ? -28.659 -1.722 -14.617 1.00 25.64 ? 450 GLU A N 1 |
| ATOM 702 C CA . GLU A 1 89 ? -28.244 -2.561 -15.717 1.00 29.24 ? 450 GLU A CA 1 |
| ATOM 703 C C . GLU A 1 89 ? -27.170 -1.844 -16.522 1.00 29.49 ? 450 GLU A C 1 |
| ATOM 704 O O . GLU A 1 89 ? -26.255 -2.514 -16.951 1.00 31.26 ? 450 GLU A O 1 |
| ATOM 705 C CB . GLU A 1 89 ? -29.385 -2.735 -16.707 1.00 34.56 ? 450 GLU A CB 1 |
| ATOM 706 C CG . GLU A 1 89 ? -30.602 -3.300 -16.042 1.00 45.01 ? 450 GLU A CG 1 |
| ATOM 707 C CD . GLU A 1 89 ? -31.198 -4.397 -16.885 1.00 55.58 ? 450 GLU A CD 1 |
| ATOM 708 O OE1 . GLU A 1 89 ? -31.420 -4.138 -18.112 1.00 60.90 ? 450 GLU A OE1 1 |
| ATOM 709 O OE2 . GLU A 1 89 ? -31.404 -5.497 -16.317 1.00 58.09 ? 450 GLU A OE2 1 |
| ATOM 710 N N . ASN A 1 90 ? -27.328 -0.524 -16.755 1.00 23.18 ? 451 ASN A N 1 |
| ATOM 711 C CA . ASN A 1 90 ? -26.382 0.238 -17.562 1.00 25.93 ? 451 ASN A CA 1 |
| ATOM 712 C C . ASN A 1 90 ? -26.342 1.674 -17.025 1.00 23.70 ? 451 ASN A C 1 |
| ATOM 713 O O . ASN A 1 90 ? -27.371 2.213 -16.606 1.00 22.22 ? 451 ASN A O 1 |
| ATOM 714 C CB . ASN A 1 90 ? -26.779 0.305 -19.058 1.00 23.71 ? 451 ASN A CB 1 |
| ATOM 715 C CG . ASN A 1 90 ? -25.767 1.101 -19.886 1.00 33.58 ? 451 ASN A CG 1 |
| ATOM 716 O OD1 . ASN A 1 90 ? -24.557 0.839 -19.840 1.00 31.13 ? 451 ASN A OD1 1 |
| ATOM 717 N ND2 . ASN A 1 90 ? -26.214 2.107 -20.636 1.00 32.01 ? 451 ASN A ND2 1 |
| ATOM 718 N N . PHE A 1 91 ? -25.176 2.326 -17.129 1.00 23.23 ? 452 PHE A N 1 |
| ATOM 719 C CA . PHE A 1 91 ? -25.166 3.778 -17.035 1.00 23.33 ? 452 PHE A CA 1 |
| ATOM 720 C C . PHE A 1 91 ? -24.234 4.349 -18.107 1.00 22.23 ? 452 PHE A C 1 |
| ATOM 721 O O . PHE A 1 91 ? -23.342 3.658 -18.587 1.00 23.79 ? 452 PHE A O 1 |
| ATOM 722 C CB . PHE A 1 91 ? -24.752 4.263 -15.645 1.00 20.03 ? 452 PHE A CB 1 |
| ATOM 723 C CG . PHE A 1 91 ? -23.269 4.131 -15.408 1.00 23.85 ? 452 PHE A CG 1 |
| ATOM 724 C CD1 . PHE A 1 91 ? -22.743 2.943 -14.922 1.00 23.90 ? 452 PHE A CD1 1 |
| ATOM 725 C CD2 . PHE A 1 91 ? -22.407 5.182 -15.690 1.00 23.49 ? 452 PHE A CD2 1 |
| ATOM 726 C CE1 . PHE A 1 91 ? -21.381 2.812 -14.706 1.00 29.81 ? 452 PHE A CE1 1 |
| ATOM 727 C CE2 . PHE A 1 91 ? -21.037 5.043 -15.474 1.00 27.93 ? 452 PHE A CE2 1 |
| ATOM 728 C CZ . PHE A 1 91 ? -20.533 3.866 -14.969 1.00 25.02 ? 452 PHE A CZ 1 |
| ATOM 729 N N . HIS A 1 92 ? -24.494 5.596 -18.490 1.00 23.53 ? 453 HIS A N 1 |
| ATOM 730 C CA . HIS A 1 92 ? -23.651 6.272 -19.463 1.00 22.35 ? 453 HIS A CA 1 |
| ATOM 731 C C . HIS A 1 92 ? -23.386 7.666 -18.917 1.00 20.46 ? 453 HIS A C 1 |
| ATOM 732 O O . HIS A 1 92 ? -24.329 8.353 -18.550 1.00 20.83 ? 453 HIS A O 1 |
| ATOM 733 C CB . HIS A 1 92 ? -24.403 6.312 -20.805 1.00 22.34 ? 453 HIS A CB 1 |
| ATOM 734 C CG . HIS A 1 92 ? -23.619 7.030 -21.859 1.00 24.73 ? 453 HIS A CG 1 |
| ATOM 735 N ND1 . HIS A 1 92 ? -22.405 6.526 -22.338 1.00 27.34 ? 453 HIS A ND1 1 |
| ATOM 736 C CD2 . HIS A 1 92 ? -23.813 8.220 -22.478 1.00 22.16 ? 453 HIS A CD2 1 |
| ATOM 737 C CE1 . HIS A 1 92 ? -21.901 7.362 -23.244 1.00 27.18 ? 453 HIS A CE1 1 |
| ATOM 738 N NE2 . HIS A 1 92 ? -22.736 8.422 -23.333 1.00 24.30 ? 453 HIS A NE2 1 |
| ATOM 739 N N . VAL A 1 93 ? -22.131 8.103 -18.875 1.00 19.82 ? 454 VAL A N 1 |
| ATOM 740 C CA . VAL A 1 93 ? -21.906 9.513 -18.566 1.00 22.59 ? 454 VAL A CA 1 |
| ATOM 741 C C . VAL A 1 93 ? -22.354 10.405 -19.725 1.00 23.86 ? 454 VAL A C 1 |
| ATOM 742 O O . VAL A 1 93 ? -21.775 10.364 -20.822 1.00 25.91 ? 454 VAL A O 1 |
| ATOM 743 C CB . VAL A 1 93 ? -20.412 9.760 -18.277 1.00 24.44 ? 454 VAL A CB 1 |
| ATOM 744 C CG1 . VAL A 1 93 ? -20.133 11.235 -17.956 1.00 21.24 ? 454 VAL A CG1 1 |
| ATOM 745 C CG2 . VAL A 1 93 ? -19.867 8.825 -17.221 1.00 24.80 ? 454 VAL A CG2 1 |
| ATOM 746 N N . VAL A 1 94 ? -23.354 11.259 -19.506 1.00 21.49 ? 455 VAL A N 1 |
| ATOM 747 C CA . VAL A 1 94 ? -23.871 12.128 -20.553 1.00 21.21 ? 455 VAL A CA 1 |
| ATOM 748 C C . VAL A 1 94 ? -22.967 13.350 -20.779 1.00 28.01 ? 455 VAL A C 1 |
| ATOM 749 O O . VAL A 1 94 ? -22.820 13.847 -21.903 1.00 24.16 ? 455 VAL A O 1 |
| ATOM 750 C CB . VAL A 1 94 ? -25.324 12.528 -20.255 1.00 21.57 ? 455 VAL A CB 1 |
| ATOM 751 C CG1 . VAL A 1 94 ? -25.857 13.563 -21.233 1.00 19.44 ? 455 VAL A CG1 1 |
| ATOM 752 C CG2 . VAL A 1 94 ? -26.188 11.281 -20.267 1.00 20.47 ? 455 VAL A CG2 1 |
| ATOM 753 N N . GLU A 1 95 ? -22.421 13.914 -19.700 1.00 24.78 ? 456 GLU A N 1 |
| ATOM 754 C CA . GLU A 1 95 ? -21.777 15.220 -19.820 1.00 25.04 ? 456 GLU A CA 1 |
| ATOM 755 C C . GLU A 1 95 ? -20.848 15.363 -18.628 1.00 28.97 ? 456 GLU A C 1 |
| ATOM 756 O O . GLU A 1 95 ? -21.231 14.991 -17.509 1.00 20.57 ? 456 GLU A O 1 |
| ATOM 757 C CB . GLU A 1 95 ? -22.769 16.402 -19.852 1.00 25.32 ? 456 GLU A CB 1 |
| ATOM 758 C CG . GLU A 1 95 ? -22.061 17.723 -20.084 1.00 26.15 ? 456 GLU A CG 1 |
| ATOM 759 C CD . GLU A 1 95 ? -22.930 18.948 -20.197 1.00 30.64 ? 456 GLU A CD 1 |
| ATOM 760 O OE1 . GLU A 1 95 ? -24.170 18.777 -20.263 1.00 30.62 ? 456 GLU A OE1 1 |
| ATOM 761 O OE2 . GLU A 1 95 ? -22.367 20.096 -20.188 1.00 27.79 ? 456 GLU A OE2 1 |
| ATOM 762 N N . THR A 1 96 ? -19.616 15.828 -18.883 1.00 28.36 ? 457 THR A N 1 |
| ATOM 763 C CA . THR A 1 96 ? -18.737 16.182 -17.782 1.00 30.39 ? 457 THR A CA 1 |
| ATOM 764 C C . THR A 1 96 ? -18.863 17.675 -17.530 1.00 32.91 ? 457 THR A C 1 |
| ATOM 765 O O . THR A 1 96 ? -18.610 18.489 -18.412 1.00 35.70 ? 457 THR A O 1 |
| ATOM 766 C CB . THR A 1 96 ? -17.272 15.848 -18.037 1.00 31.41 ? 457 THR A CB 1 |
| ATOM 767 O OG1 . THR A 1 96 ? -17.291 14.431 -18.180 1.00 30.49 ? 457 THR A OG1 1 |
| ATOM 768 C CG2 . THR A 1 96 ? -16.397 16.273 -16.875 1.00 32.02 ? 457 THR A CG2 1 |
| ATOM 769 N N . LEU A 1 97 ? -19.272 18.040 -16.323 1.00 29.19 ? 458 LEU A N 1 |
| ATOM 770 C CA . LEU A 1 97 ? -19.496 19.447 -16.080 1.00 27.72 ? 458 LEU A CA 1 |
| ATOM 771 C C . LEU A 1 97 ? -18.239 20.082 -15.483 1.00 31.39 ? 458 LEU A C 1 |
| ATOM 772 O O . LEU A 1 97 ? -17.997 21.268 -15.714 1.00 35.66 ? 458 LEU A O 1 |
| ATOM 773 C CB . LEU A 1 97 ? -20.680 19.624 -15.135 1.00 25.28 ? 458 LEU A CB 1 |
| ATOM 774 C CG . LEU A 1 97 ? -22.040 19.205 -15.671 1.00 30.53 ? 458 LEU A CG 1 |
| ATOM 775 C CD1 . LEU A 1 97 ? -23.066 19.257 -14.543 1.00 26.34 ? 458 LEU A CD1 1 |
| ATOM 776 C CD2 . LEU A 1 97 ? -22.478 20.094 -16.844 1.00 30.40 ? 458 LEU A CD2 1 |
| ATOM 777 N N . ALA A 1 98 ? -17.480 19.315 -14.699 1.00 26.94 ? 459 ALA A N 1 |
| ATOM 778 C CA . ALA A 1 98 ? -16.331 19.825 -13.978 1.00 27.03 ? 459 ALA A CA 1 |
| ATOM 779 C C . ALA A 1 98 ? -15.591 18.640 -13.369 1.00 25.57 ? 459 ALA A C 1 |
| ATOM 780 O O . ALA A 1 98 ? -15.973 17.479 -13.511 1.00 22.74 ? 459 ALA A O 1 |
| ATOM 781 C CB . ALA A 1 98 ? -16.757 20.846 -12.918 1.00 25.57 ? 459 ALA A CB 1 |
| ATOM 782 N N . ASP A 1 99 ? -14.515 18.904 -12.646 1.00 24.91 ? 460 ASP A N 1 |
| ATOM 783 C CA . ASP A 1 99 ? -13.770 17.753 -12.152 1.00 30.75 ? 460 ASP A CA 1 |
| ATOM 784 C C . ASP A 1 99 ? -14.529 17.082 -10.987 1.00 29.09 ? 460 ASP A C 1 |
| ATOM 785 O O . ASP A 1 99 ? -14.145 16.017 -10.498 1.00 29.12 ? 460 ASP A O 1 |
| ATOM 786 C CB . ASP A 1 99 ? -12.311 18.127 -11.854 1.00 43.31 ? 460 ASP A CB 1 |
| ATOM 787 C CG . ASP A 1 99 ? -12.101 18.781 -10.495 1.00 60.57 ? 460 ASP A CG 1 |
| ATOM 788 O OD1 . ASP A 1 99 ? -12.945 19.616 -10.088 1.00 64.88 ? 460 ASP A OD1 1 |
| ATOM 789 O OD2 . ASP A 1 99 ? -11.101 18.432 -9.835 1.00 76.38 ? 460 ASP A OD2 1 |
| ATOM 790 N N . ASN A 1 100 ? -15.616 17.705 -10.526 1.00 27.46 ? 461 ASN A N 1 |
| ATOM 791 C CA . ASN A 1 100 ? -16.355 17.147 -9.398 1.00 26.82 ? 461 ASN A CA 1 |
| ATOM 792 C C . ASN A 1 100 ? -17.827 16.964 -9.784 1.00 24.06 ? 461 ASN A C 1 |
| ATOM 793 O O . ASN A 1 100 ? -18.649 16.686 -8.913 1.00 23.67 ? 461 ASN A O 1 |
| ATOM 794 C CB . ASN A 1 100 ? -16.210 18.054 -8.164 1.00 22.57 ? 461 ASN A CB 1 |
| ATOM 795 C CG . ASN A 1 100 ? -16.865 19.407 -8.364 1.00 24.73 ? 461 ASN A CG 1 |
| ATOM 796 O OD1 . ASN A 1 100 ? -17.029 19.861 -9.482 1.00 32.85 ? 461 ASN A OD1 1 |
| ATOM 797 N ND2 . ASN A 1 100 ? -17.313 20.073 -7.310 1.00 29.46 ? 461 ASN A ND2 1 |
| ATOM 798 N N . ALA A 1 101 ? -18.178 17.145 -11.069 1.00 19.88 ? 462 ALA A N 1 |
| ATOM 799 C CA . ALA A 1 101 ? -19.578 17.114 -11.463 1.00 20.17 ? 462 ALA A CA 1 |
| ATOM 800 C C . ALA A 1 101 ? -19.769 16.555 -12.869 1.00 24.83 ? 462 ALA A C 1 |
| ATOM 801 O O . ALA A 1 101 ? -19.142 17.020 -13.838 1.00 21.86 ? 462 ALA A O 1 |
| ATOM 802 C CB . ALA A 1 101 ? -20.231 18.465 -11.359 1.00 18.57 ? 462 ALA A CB 1 |
| ATOM 803 N N . ILE A 1 102 ? -20.675 15.571 -12.950 1.00 22.97 ? 463 ILE A N 1 |
| ATOM 804 C CA . ILE A 1 102 ? -21.003 14.904 -14.199 1.00 19.67 ? 463 ILE A CA 1 |
| ATOM 805 C C . ILE A 1 102 ? -22.522 14.707 -14.231 1.00 21.03 ? 463 ILE A C 1 |
| ATOM 806 O O . ILE A 1 102 ? -23.194 14.840 -13.200 1.00 18.38 ? 463 ILE A O 1 |
| ATOM 807 C CB . ILE A 1 102 ? -20.247 13.579 -14.251 1.00 22.31 ? 463 ILE A CB 1 |
| ATOM 808 C CG1 . ILE A 1 102 ? -20.624 12.695 -13.056 1.00 23.80 ? 463 ILE A CG1 1 |
| ATOM 809 C CG2 . ILE A 1 102 ? -18.722 13.815 -14.309 1.00 22.08 ? 463 ILE A CG2 1 |
| ATOM 810 C CD1 . ILE A 1 102 ? -19.993 11.307 -13.117 1.00 26.51 ? 463 ILE A CD1 1 |
| ATOM 811 N N . ILE A 1 103 ? -23.064 14.425 -15.424 1.00 17.18 ? 464 ILE A N 1 |
| ATOM 812 C CA . ILE A 1 103 ? -24.479 14.116 -15.592 1.00 19.53 ? 464 ILE A CA 1 |
| ATOM 813 C C . ILE A 1 103 ? -24.520 12.700 -16.142 1.00 21.04 ? 464 ILE A C 1 |
| ATOM 814 O O . ILE A 1 103 ? -23.742 12.359 -17.063 1.00 18.45 ? 464 ILE A O 1 |
| ATOM 815 C CB . ILE A 1 103 ? -25.149 15.100 -16.545 1.00 19.71 ? 464 ILE A CB 1 |
| ATOM 816 C CG1 . ILE A 1 103 ? -25.083 16.529 -16.005 1.00 18.67 ? 464 ILE A CG1 1 |
| ATOM 817 C CG2 . ILE A 1 103 ? -26.555 14.640 -16.956 1.00 18.40 ? 464 ILE A CG2 1 |
| ATOM 818 C CD1 . ILE A 1 103 ? -25.966 17.529 -16.718 1.00 19.06 ? 464 ILE A CD1 1 |
| ATOM 819 N N . ILE A 1 104 ? -25.303 11.862 -15.445 1.00 19.50 ? 465 ILE A N 1 |
| ATOM 820 C CA . ILE A 1 104 ? -25.352 10.425 -15.689 1.00 17.38 ? 465 ILE A CA 1 |
| ATOM 821 C C . ILE A 1 104 ? -26.756 10.053 -16.141 1.00 17.58 ? 465 ILE A C 1 |
| ATOM 822 O O . ILE A 1 104 ? -27.736 10.546 -15.588 1.00 14.93 ? 465 ILE A O 1 |
| ATOM 823 C CB . ILE A 1 104 ? -24.940 9.632 -14.428 1.00 18.19 ? 465 ILE A CB 1 |
| ATOM 824 C CG1 . ILE A 1 104 ? -23.505 9.985 -14.030 1.00 17.46 ? 465 ILE A CG1 1 |
| ATOM 825 C CG2 . ILE A 1 104 ? -25.104 8.106 -14.648 1.00 19.51 ? 465 ILE A CG2 1 |
| ATOM 826 C CD1 . ILE A 1 104 ? -22.998 9.248 -12.780 1.00 17.73 ? 465 ILE A CD1 1 |
| ATOM 827 N N . TYR A 1 105 ? -26.815 9.132 -17.129 1.00 17.55 ? 466 TYR A N 1 |
| ATOM 828 C CA . TYR A 1 105 ? -28.027 8.407 -17.473 1.00 17.34 ? 466 TYR A CA 1 |
| ATOM 829 C C . TYR A 1 105 ? -27.863 6.959 -17.031 1.00 16.15 ? 466 TYR A C 1 |
| ATOM 830 O O . TYR A 1 105 ? -26.815 6.379 -17.231 1.00 18.65 ? 466 TYR A O 1 |
| ATOM 831 C CB . TYR A 1 105 ? -28.190 8.407 -18.994 1.00 18.62 ? 466 TYR A CB 1 |
| ATOM 832 C CG . TYR A 1 105 ? -29.333 7.542 -19.435 1.00 17.85 ? 466 TYR A CG 1 |
| ATOM 833 C CD1 . TYR A 1 105 ? -30.640 8.004 -19.346 1.00 19.73 ? 466 TYR A CD1 1 |
| ATOM 834 C CD2 . TYR A 1 105 ? -29.097 6.246 -19.864 1.00 17.88 ? 466 TYR A CD2 1 |
| ATOM 835 C CE1 . TYR A 1 105 ? -31.724 7.188 -19.671 1.00 20.73 ? 466 TYR A CE1 1 |
| ATOM 836 C CE2 . TYR A 1 105 ? -30.164 5.441 -20.236 1.00 19.29 ? 466 TYR A CE2 1 |
| ATOM 837 C CZ . TYR A 1 105 ? -31.467 5.903 -20.124 1.00 20.03 ? 466 TYR A CZ 1 |
| ATOM 838 O OH . TYR A 1 105 ? -32.487 5.079 -20.480 1.00 20.69 ? 466 TYR A OH 1 |
| ATOM 839 N N . GLN A 1 106 ? -28.862 6.353 -16.379 1.00 16.99 ? 467 GLN A N 1 |
| ATOM 840 C CA . GLN A 1 106 ? -28.725 4.938 -16.050 1.00 15.62 ? 467 GLN A CA 1 |
| ATOM 841 C C . GLN A 1 106 ? -30.091 4.263 -16.120 1.00 16.53 ? 467 GLN A C 1 |
| ATOM 842 O O . GLN A 1 106 ? -31.128 4.909 -15.973 1.00 15.19 ? 467 GLN A O 1 |
| ATOM 843 C CB . GLN A 1 106 ? -28.073 4.670 -14.690 1.00 17.83 ? 467 GLN A CB 1 |
| ATOM 844 C CG . GLN A 1 106 ? -28.881 5.225 -13.529 1.00 17.33 ? 467 GLN A CG 1 |
| ATOM 845 C CD . GLN A 1 106 ? -28.149 5.240 -12.205 1.00 18.83 ? 467 GLN A CD 1 |
| ATOM 846 O OE1 . GLN A 1 106 ? -26.925 5.386 -12.144 1.00 19.69 ? 467 GLN A OE1 1 |
| ATOM 847 N NE2 . GLN A 1 106 ? -28.902 5.140 -11.115 1.00 16.20 ? 467 GLN A NE2 1 |
| ATOM 848 N N . THR A 1 107 ? -30.059 2.949 -16.349 1.00 17.23 ? 468 THR A N 1 |
| ATOM 849 C CA . THR A 1 107 ? -31.273 2.163 -16.360 1.00 19.92 ? 468 THR A CA 1 |
| ATOM 850 C C . THR A 1 107 ? -31.150 1.201 -15.198 1.00 19.31 ? 468 THR A C 1 |
| ATOM 851 O O . THR A 1 107 ? -30.068 0.738 -14.905 1.00 22.06 ? 468 THR A O 1 |
| ATOM 852 C CB . THR A 1 107 ? -31.409 1.341 -17.652 1.00 22.26 ? 468 THR A CB 1 |
| ATOM 853 O OG1 . THR A 1 107 ? -30.261 0.505 -17.746 1.00 23.05 ? 468 THR A OG1 1 |
| ATOM 854 C CG2 . THR A 1 107 ? -31.482 2.222 -18.863 1.00 21.95 ? 468 THR A CG2 1 |
| ATOM 855 N N . HIS A 1 108 ? -32.251 1.020 -14.469 1.00 20.67 ? 469 HIS A N 1 |
| ATOM 856 C CA . HIS A 1 108 ? -32.241 0.170 -13.305 1.00 21.52 ? 469 HIS A CA 1 |
| ATOM 857 C C . HIS A 1 108 ? -32.706 -1.238 -13.660 1.00 21.32 ? 469 HIS A C 1 |
| ATOM 858 O O . HIS A 1 108 ? -33.463 -1.403 -14.593 1.00 22.08 ? 469 HIS A O 1 |
| ATOM 859 C CB . HIS A 1 108 ? -33.177 0.800 -12.268 1.00 24.06 ? 469 HIS A CB 1 |
| ATOM 860 C CG . HIS A 1 108 ? -32.442 1.833 -11.485 1.00 23.72 ? 469 HIS A CG 1 |
| ATOM 861 N ND1 . HIS A 1 108 ? -31.453 1.503 -10.579 1.00 24.75 ? 469 HIS A ND1 1 |
| ATOM 862 C CD2 . HIS A 1 108 ? -32.475 3.178 -11.535 1.00 23.87 ? 469 HIS A CD2 1 |
| ATOM 863 C CE1 . HIS A 1 108 ? -30.934 2.607 -10.056 1.00 24.33 ? 469 HIS A CE1 1 |
| ATOM 864 N NE2 . HIS A 1 108 ? -31.539 3.651 -10.647 1.00 26.43 ? 469 HIS A NE2 1 |
| ATOM 865 N N . LYS A 1 109 ? -32.295 -2.246 -12.887 1.00 23.54 ? 470 LYS A N 1 |
| ATOM 866 C CA . LYS A 1 109 ? -32.837 -3.581 -13.086 1.00 27.41 ? 470 LYS A CA 1 |
| ATOM 867 C C . LYS A 1 109 ? -34.350 -3.543 -12.858 1.00 27.37 ? 470 LYS A C 1 |
| ATOM 868 O O . LYS A 1 109 ? -34.849 -2.720 -12.091 1.00 26.18 ? 470 LYS A O 1 |
| ATOM 869 C CB . LYS A 1 109 ? -32.122 -4.525 -12.127 1.00 31.62 ? 470 LYS A CB 1 |
| ATOM 870 C CG . LYS A 1 109 ? -30.697 -4.837 -12.561 1.00 37.37 ? 470 LYS A CG 1 |
| ATOM 871 C CD . LYS A 1 109 ? -29.850 -5.577 -11.542 1.00 36.97 ? 470 LYS A CD 1 |
| ATOM 872 C CE . LYS A 1 109 ? -28.491 -5.867 -12.139 1.00 40.10 ? 470 LYS A CE 1 |
| ATOM 873 N NZ . LYS A 1 109 ? -27.566 -6.513 -11.182 1.00 46.02 ? 470 LYS A NZ 1 |
| ATOM 874 N N . ARG A 1 110 ? -35.092 -4.376 -13.596 1.00 29.91 ? 471 ARG A N 1 |
| ATOM 875 C CA . ARG A 1 110 ? -36.541 -4.429 -13.506 1.00 31.67 ? 471 ARG A CA 1 |
| ATOM 876 C C . ARG A 1 110 ? -36.943 -5.070 -12.181 1.00 32.69 ? 471 ARG A C 1 |
| ATOM 877 O O . ARG A 1 110 ? -36.298 -6.020 -11.780 1.00 35.31 ? 471 ARG A O 1 |
| ATOM 878 C CB . ARG A 1 110 ? -37.007 -5.343 -14.631 1.00 42.95 ? 471 ARG A CB 1 |
| ATOM 879 C CG . ARG A 1 110 ? -38.348 -4.983 -15.245 1.00 55.25 ? 471 ARG A CG 1 |
| ATOM 880 C CD . ARG A 1 110 ? -38.019 -5.021 -16.718 1.00 69.36 ? 471 ARG A CD 1 |
| ATOM 881 N NE . ARG A 1 110 ? -39.124 -5.438 -17.558 1.00 82.40 ? 471 ARG A NE 1 |
| ATOM 882 C CZ . ARG A 1 110 ? -39.196 -5.148 -18.851 1.00 91.50 ? 471 ARG A CZ 1 |
| ATOM 883 N NH1 . ARG A 1 110 ? -38.351 -4.275 -19.374 1.00 85.53 ? 471 ARG A NH1 1 |
| ATOM 884 N NH2 . ARG A 1 110 ? -40.102 -5.736 -19.615 1.00 98.78 ? 471 ARG A NH2 1 |
| ATOM 885 N N . VAL A 1 111 ? -37.968 -4.548 -11.484 1.00 29.02 ? 472 VAL A N 1 |
| ATOM 886 C CA . VAL A 1 111 ? -38.513 -5.228 -10.315 1.00 28.71 ? 472 VAL A CA 1 |
| ATOM 887 C C . VAL A 1 111 ? -39.955 -5.659 -10.614 1.00 26.44 ? 472 VAL A C 1 |
| ATOM 888 O O . VAL A 1 111 ? -40.842 -4.837 -10.680 1.00 24.11 ? 472 VAL A O 1 |
| ATOM 889 C CB . VAL A 1 111 ? -38.426 -4.361 -9.042 1.00 31.63 ? 472 VAL A CB 1 |
| ATOM 890 C CG1 . VAL A 1 111 ? -39.156 -4.999 -7.881 1.00 30.80 ? 472 VAL A CG1 1 |
| ATOM 891 C CG2 . VAL A 1 111 ? -36.975 -4.123 -8.630 1.00 35.42 ? 472 VAL A CG2 1 |
| ATOM 892 N N . TRP A 1 112 ? -40.183 -6.951 -10.837 1.00 27.07 ? 473 TRP A N 1 |
| ATOM 893 C CA . TRP A 1 112 ? -41.497 -7.459 -11.223 1.00 27.90 ? 473 TRP A CA 1 |
| ATOM 894 C C . TRP A 1 112 ? -42.575 -7.007 -10.227 1.00 26.04 ? 473 TRP A C 1 |
| ATOM 895 O O . TRP A 1 112 ? -42.314 -7.001 -9.030 1.00 27.80 ? 473 TRP A O 1 |
| ATOM 896 C CB . TRP A 1 112 ? -41.405 -8.983 -11.350 1.00 33.76 ? 473 TRP A CB 1 |
| ATOM 897 C CG . TRP A 1 112 ? -42.721 -9.609 -11.700 1.00 40.39 ? 473 TRP A CG 1 |
| ATOM 898 C CD1 . TRP A 1 112 ? -43.239 -9.836 -12.943 1.00 38.90 ? 473 TRP A CD1 1 |
| ATOM 899 C CD2 . TRP A 1 112 ? -43.721 -10.027 -10.758 1.00 42.37 ? 473 TRP A CD2 1 |
| ATOM 900 N NE1 . TRP A 1 112 ? -44.487 -10.388 -12.833 1.00 40.76 ? 473 TRP A NE1 1 |
| ATOM 901 C CE2 . TRP A 1 112 ? -44.808 -10.515 -11.509 1.00 41.96 ? 473 TRP A CE2 1 |
| ATOM 902 C CE3 . TRP A 1 112 ? -43.784 -10.054 -9.357 1.00 45.14 ? 473 TRP A CE3 1 |
| ATOM 903 C CZ2 . TRP A 1 112 ? -45.944 -11.036 -10.894 1.00 46.93 ? 473 TRP A CZ2 1 |
| ATOM 904 C CZ3 . TRP A 1 112 ? -44.916 -10.549 -8.746 1.00 45.52 ? 473 TRP A CZ3 1 |
| ATOM 905 C CH2 . TRP A 1 112 ? -45.976 -11.036 -9.515 1.00 45.33 ? 473 TRP A CH2 1 |
| ATOM 906 N N . PRO A 1 113 ? -43.759 -6.541 -10.683 1.00 24.42 ? 474 PRO A N 1 |
| ATOM 907 C CA . PRO A 1 113 ? -44.133 -6.427 -12.081 1.00 25.46 ? 474 PRO A CA 1 |
| ATOM 908 C C . PRO A 1 113 ? -44.115 -4.996 -12.617 1.00 25.27 ? 474 PRO A C 1 |
| ATOM 909 O O . PRO A 1 113 ? -44.848 -4.672 -13.534 1.00 27.36 ? 474 PRO A O 1 |
| ATOM 910 C CB . PRO A 1 113 ? -45.601 -6.898 -12.003 1.00 25.39 ? 474 PRO A CB 1 |
| ATOM 911 C CG . PRO A 1 113 ? -46.127 -6.155 -10.785 1.00 25.85 ? 474 PRO A CG 1 |
| ATOM 912 C CD . PRO A 1 113 ? -44.939 -6.218 -9.851 1.00 24.24 ? 474 PRO A CD 1 |
| ATOM 913 N N . ALA A 1 114 ? -43.280 -4.125 -12.053 1.00 24.62 ? 475 ALA A N 1 |
| ATOM 914 C CA . ALA A 1 114 ? -43.310 -2.732 -12.464 1.00 24.33 ? 475 ALA A CA 1 |
| ATOM 915 C C . ALA A 1 114 ? -42.446 -2.579 -13.717 1.00 21.76 ? 475 ALA A C 1 |
| ATOM 916 O O . ALA A 1 114 ? -41.504 -3.350 -13.896 1.00 25.45 ? 475 ALA A O 1 |
| ATOM 917 C CB . ALA A 1 114 ? -42.751 -1.893 -11.344 1.00 25.93 ? 475 ALA A CB 1 |
| ATOM 918 N N . SER A 1 115 ? -42.761 -1.587 -14.554 1.00 25.16 ? 476 SER A N 1 |
| ATOM 919 C CA . SER A 1 115 ? -41.907 -1.245 -15.698 1.00 26.33 ? 476 SER A CA 1 |
| ATOM 920 C C . SER A 1 115 ? -40.510 -0.913 -15.202 1.00 23.50 ? 476 SER A C 1 |
| ATOM 921 O O . SER A 1 115 ? -40.319 -0.423 -14.091 1.00 23.34 ? 476 SER A O 1 |
| ATOM 922 C CB . SER A 1 115 ? -42.357 -0.026 -16.478 1.00 29.24 ? 476 SER A CB 1 |
| ATOM 923 O OG . SER A 1 115 ? -43.664 -0.143 -16.979 1.00 35.39 ? 476 SER A OG 1 |
| ATOM 924 N N . GLN A 1 116 ? -39.549 -1.077 -16.102 1.00 23.36 ? 477 GLN A N 1 |
| ATOM 925 C CA . GLN A 1 116 ? -38.200 -0.656 -15.816 1.00 24.06 ? 477 GLN A CA 1 |
| ATOM 926 C C . GLN A 1 116 ? -38.206 0.871 -15.692 1.00 20.90 ? 477 GLN A C 1 |
| ATOM 927 O O . GLN A 1 116 ? -38.999 1.564 -16.343 1.00 19.36 ? 477 GLN A O 1 |
| ATOM 928 C CB . GLN A 1 116 ? -37.301 -1.124 -16.959 1.00 25.23 ? 477 GLN A CB 1 |
| ATOM 929 C CG . GLN A 1 116 ? -35.835 -1.086 -16.579 1.00 26.86 ? 477 GLN A CG 1 |
| ATOM 930 C CD . GLN A 1 116 ? -34.961 -1.595 -17.704 1.00 29.94 ? 477 GLN A CD 1 |
| ATOM 931 O OE1 . GLN A 1 116 ? -35.353 -1.580 -18.854 1.00 33.62 ? 477 GLN A OE1 1 |
| ATOM 932 N NE2 . GLN A 1 116 ? -33.758 -2.023 -17.377 1.00 30.01 ? 477 GLN A NE2 1 |
| ATOM 933 N N . ARG A 1 117 ? -37.327 1.370 -14.824 1.00 19.78 ? 478 ARG A N 1 |
| ATOM 934 C CA . ARG A 1 117 ? -37.129 2.808 -14.699 1.00 19.70 ? 478 ARG A CA 1 |
| ATOM 935 C C . ARG A 1 117 ? -35.745 3.195 -15.237 1.00 18.59 ? 478 ARG A C 1 |
| ATOM 936 O O . ARG A 1 117 ? -34.785 2.432 -15.080 1.00 18.88 ? 478 ARG A O 1 |
| ATOM 937 C CB . ARG A 1 117 ? -37.198 3.242 -13.226 1.00 17.66 ? 478 ARG A CB 1 |
| ATOM 938 C CG . ARG A 1 117 ? -38.573 3.744 -12.812 1.00 19.23 ? 478 ARG A CG 1 |
| ATOM 939 C CD . ARG A 1 117 ? -39.627 2.629 -12.897 1.00 20.58 ? 478 ARG A CD 1 |
| ATOM 940 N NE . ARG A 1 117 ? -40.868 3.248 -12.518 1.00 18.88 ? 478 ARG A NE 1 |
| ATOM 941 C CZ . ARG A 1 117 ? -42.084 2.741 -12.657 1.00 18.78 ? 478 ARG A CZ 1 |
| ATOM 942 N NH1 . ARG A 1 117 ? -42.272 1.500 -13.065 1.00 21.01 ? 478 ARG A NH1 1 |
| ATOM 943 N NH2 . ARG A 1 117 ? -43.116 3.509 -12.377 1.00 19.79 ? 478 ARG A NH2 1 |
| ATOM 944 N N . ASP A 1 118 ? -35.658 4.438 -15.748 1.00 18.52 ? 479 ASP A N 1 |
| ATOM 945 C CA . ASP A 1 118 ? -34.382 5.086 -16.049 1.00 18.58 ? 479 ASP A CA 1 |
| ATOM 946 C C . ASP A 1 118 ? -34.328 6.421 -15.281 1.00 16.10 ? 479 ASP A C 1 |
| ATOM 947 O O . ASP A 1 118 ? -35.339 6.896 -14.773 1.00 16.60 ? 479 ASP A O 1 |
| ATOM 948 C CB . ASP A 1 118 ? -34.094 5.143 -17.570 1.00 18.31 ? 479 ASP A CB 1 |
| ATOM 949 C CG . ASP A 1 118 ? -35.012 6.017 -18.407 1.00 22.44 ? 479 ASP A CG 1 |
| ATOM 950 O OD1 . ASP A 1 118 ? -35.888 6.675 -17.824 1.00 21.14 ? 479 ASP A OD1 1 |
| ATOM 951 O OD2 . ASP A 1 118 ? -34.836 6.051 -19.678 1.00 26.01 ? 479 ASP A OD2 1 |
| ATOM 952 N N . VAL A 1 119 ? -33.141 7.019 -15.165 1.00 15.28 ? 480 VAL A N 1 |
| ATOM 953 C CA . VAL A 1 119 ? -32.945 8.243 -14.408 1.00 16.30 ? 480 VAL A CA 1 |
| ATOM 954 C C . VAL A 1 119 ? -31.807 9.014 -15.073 1.00 16.73 ? 480 VAL A C 1 |
| ATOM 955 O O . VAL A 1 119 ? -30.945 8.416 -15.712 1.00 18.52 ? 480 VAL A O 1 |
| ATOM 956 C CB . VAL A 1 119 ? -32.567 7.941 -12.938 1.00 16.09 ? 480 VAL A CB 1 |
| ATOM 957 C CG1 A VAL A 1 119 ? -31.349 7.050 -12.857 0.50 15.74 ? 480 VAL A CG1 1 |
| ATOM 958 C CG1 B VAL A 1 119 ? -32.809 9.143 -12.032 0.50 16.28 ? 480 VAL A CG1 1 |
| ATOM 959 C CG2 A VAL A 1 119 ? -32.338 9.217 -12.134 0.50 16.36 ? 480 VAL A CG2 1 |
| ATOM 960 C CG2 B VAL A 1 119 ? -33.346 6.752 -12.429 0.50 15.07 ? 480 VAL A CG2 1 |
| ATOM 961 N N . LEU A 1 120 ? -31.875 10.340 -14.949 1.00 18.17 ? 481 LEU A N 1 |
| ATOM 962 C CA . LEU A 1 120 ? -30.910 11.243 -15.563 1.00 18.01 ? 481 LEU A CA 1 |
| ATOM 963 C C . LEU A 1 120 ? -30.558 12.267 -14.498 1.00 14.95 ? 481 LEU A C 1 |
| ATOM 964 O O . LEU A 1 120 ? -31.420 13.033 -14.105 1.00 15.68 ? 481 LEU A O 1 |
| ATOM 965 C CB . LEU A 1 120 ? -31.590 11.932 -16.757 1.00 16.36 ? 481 LEU A CB 1 |
| ATOM 966 C CG . LEU A 1 120 ? -30.768 12.978 -17.515 1.00 20.14 ? 481 LEU A CG 1 |
| ATOM 967 C CD1 . LEU A 1 120 ? -29.483 12.370 -18.073 1.00 19.62 ? 481 LEU A CD1 1 |
| ATOM 968 C CD2 . LEU A 1 120 ? -31.635 13.551 -18.640 1.00 22.15 ? 481 LEU A CD2 1 |
| ATOM 969 N N . TYR A 1 121 ? -29.314 12.253 -14.032 1.00 15.99 ? 482 TYR A N 1 |
| ATOM 970 C CA . TYR A 1 121 ? -29.063 13.069 -12.861 1.00 16.51 ? 482 TYR A CA 1 |
| ATOM 971 C C . TYR A 1 121 ? -27.657 13.673 -12.919 1.00 15.29 ? 482 TYR A C 1 |
| ATOM 972 O O . TYR A 1 121 ? -26.732 13.088 -13.462 1.00 14.95 ? 482 TYR A O 1 |
| ATOM 973 C CB . TYR A 1 121 ? -29.224 12.231 -11.580 1.00 14.86 ? 482 TYR A CB 1 |
| ATOM 974 C CG . TYR A 1 121 ? -28.297 11.041 -11.432 1.00 12.72 ? 482 TYR A CG 1 |
| ATOM 975 C CD1 . TYR A 1 121 ? -28.575 9.845 -12.081 1.00 13.81 ? 482 TYR A CD1 1 |
| ATOM 976 C CD2 . TYR A 1 121 ? -27.169 11.075 -10.624 1.00 12.45 ? 482 TYR A CD2 1 |
| ATOM 977 C CE1 . TYR A 1 121 ? -27.784 8.712 -11.921 1.00 12.10 ? 482 TYR A CE1 1 |
| ATOM 978 C CE2 . TYR A 1 121 ? -26.364 9.959 -10.463 1.00 12.84 ? 482 TYR A CE2 1 |
| ATOM 979 C CZ . TYR A 1 121 ? -26.660 8.770 -11.128 1.00 12.51 ? 482 TYR A CZ 1 |
| ATOM 980 O OH . TYR A 1 121 ? -25.902 7.641 -10.981 1.00 13.85 ? 482 TYR A OH 1 |
| ATOM 981 N N . LEU A 1 122 ? -27.531 14.814 -12.256 1.00 15.99 ? 483 LEU A N 1 |
| ATOM 982 C CA . LEU A 1 122 ? -26.249 15.416 -11.940 1.00 15.04 ? 483 LEU A CA 1 |
| ATOM 983 C C . LEU A 1 122 ? -25.735 14.825 -10.632 1.00 14.57 ? 483 LEU A C 1 |
| ATOM 984 O O . LEU A 1 122 ? -26.447 14.732 -9.606 1.00 15.22 ? 483 LEU A O 1 |
| ATOM 985 C CB . LEU A 1 122 ? -26.485 16.934 -11.855 1.00 15.55 ? 483 LEU A CB 1 |
| ATOM 986 C CG . LEU A 1 122 ? -25.252 17.840 -11.809 1.00 17.24 ? 483 LEU A CG 1 |
| ATOM 987 C CD1 . LEU A 1 122 ? -25.698 19.267 -12.047 1.00 16.74 ? 483 LEU A CD1 1 |
| ATOM 988 C CD2 . LEU A 1 122 ? -24.561 17.773 -10.434 1.00 21.89 ? 483 LEU A CD2 1 |
| ATOM 989 N N . SER A 1 123 ? -24.470 14.428 -10.681 1.00 14.40 ? 484 SER A N 1 |
| ATOM 990 C CA . SER A 1 123 ? -23.799 13.847 -9.557 1.00 16.11 ? 484 SER A CA 1 |
| ATOM 991 C C . SER A 1 123 ? -22.589 14.714 -9.250 1.00 18.51 ? 484 SER A C 1 |
| ATOM 992 O O . SER A 1 123 ? -21.751 14.936 -10.138 1.00 19.26 ? 484 SER A O 1 |
| ATOM 993 C CB . SER A 1 123 ? -23.435 12.442 -9.845 1.00 14.69 ? 484 SER A CB 1 |
| ATOM 994 O OG . SER A 1 123 ? -22.652 11.860 -8.822 1.00 13.79 ? 484 SER A OG 1 |
| ATOM 995 N N . VAL A 1 124 ? -22.557 15.259 -8.013 1.00 17.31 ? 485 VAL A N 1 |
| ATOM 996 C CA . VAL A 1 124 ? -21.495 16.190 -7.611 1.00 18.87 ? 485 VAL A CA 1 |
| ATOM 997 C C . VAL A 1 124 ? -20.905 15.765 -6.265 1.00 21.69 ? 485 VAL A C 1 |
| ATOM 998 O O . VAL A 1 124 ? -21.622 15.317 -5.396 1.00 17.03 ? 485 VAL A O 1 |
| ATOM 999 C CB . VAL A 1 124 ? -21.982 17.651 -7.549 1.00 21.98 ? 485 VAL A CB 1 |
| ATOM 1000 C CG1 . VAL A 1 124 ? -23.205 17.842 -6.646 1.00 23.74 ? 485 VAL A CG1 1 |
| ATOM 1001 C CG2 . VAL A 1 124 ? -20.859 18.571 -7.092 1.00 22.11 ? 485 VAL A CG2 1 |
| ATOM 1002 N N . ILE A 1 125 ? -19.575 15.827 -6.118 1.00 20.59 ? 486 ILE A N 1 |
| ATOM 1003 C CA . ILE A 1 125 ? -18.930 15.565 -4.851 1.00 19.36 ? 486 ILE A CA 1 |
| ATOM 1004 C C . ILE A 1 125 ? -18.364 16.897 -4.319 1.00 23.73 ? 486 ILE A C 1 |
| ATOM 1005 O O . ILE A 1 125 ? -17.821 17.688 -5.091 1.00 22.17 ? 486 ILE A O 1 |
| ATOM 1006 C CB . ILE A 1 125 ? -17.858 14.473 -5.021 1.00 16.63 ? 486 ILE A CB 1 |
| ATOM 1007 C CG1 . ILE A 1 125 ? -17.137 14.211 -3.705 1.00 15.59 ? 486 ILE A CG1 1 |
| ATOM 1008 C CG2 . ILE A 1 125 ? -16.898 14.732 -6.202 1.00 18.15 ? 486 ILE A CG2 1 |
| ATOM 1009 C CD1 . ILE A 1 125 ? -16.186 13.035 -3.712 1.00 15.73 ? 486 ILE A CD1 1 |
| ATOM 1010 N N . ARG A 1 126 ? -18.511 17.184 -3.019 1.00 20.76 ? 487 ARG A N 1 |
| ATOM 1011 C CA . ARG A 1 126 ? -18.170 18.519 -2.513 1.00 23.87 ? 487 ARG A CA 1 |
| ATOM 1012 C C . ARG A 1 126 ? -17.639 18.371 -1.087 1.00 24.64 ? 487 ARG A C 1 |
| ATOM 1013 O O . ARG A 1 126 ? -18.149 17.526 -0.337 1.00 17.70 ? 487 ARG A O 1 |
| ATOM 1014 C CB . ARG A 1 126 ? -19.392 19.431 -2.397 1.00 30.52 ? 487 ARG A CB 1 |
| ATOM 1015 C CG . ARG A 1 126 ? -19.814 20.103 -3.693 1.00 39.62 ? 487 ARG A CG 1 |
| ATOM 1016 C CD . ARG A 1 126 ? -18.994 21.308 -4.155 1.00 38.27 ? 487 ARG A CD 1 |
| ATOM 1017 N NE . ARG A 1 126 ? -19.083 22.380 -3.180 1.00 41.53 ? 487 ARG A NE 1 |
| ATOM 1018 C CZ . ARG A 1 126 ? -20.056 23.284 -3.132 1.00 41.43 ? 487 ARG A CZ 1 |
| ATOM 1019 N NH1 . ARG A 1 126 ? -20.124 24.093 -2.093 1.00 40.74 ? 487 ARG A NH1 1 |
| ATOM 1020 N NH2 . ARG A 1 126 ? -20.939 23.400 -4.114 1.00 37.95 ? 487 ARG A NH2 1 |
| ATOM 1021 N N . LYS A 1 127 ? -16.596 19.143 -0.731 1.00 21.57 ? 488 LYS A N 1 |
| ATOM 1022 C CA . LYS A 1 127 ? -16.155 19.233 0.662 1.00 23.21 ? 488 LYS A CA 1 |
| ATOM 1023 C C . LYS A 1 127 ? -16.712 20.504 1.306 1.00 23.26 ? 488 LYS A C 1 |
| ATOM 1024 O O . LYS A 1 127 ? -16.652 21.574 0.707 1.00 20.74 ? 488 LYS A O 1 |
| ATOM 1025 C CB . LYS A 1 127 ? -14.637 19.158 0.805 1.00 24.84 ? 488 LYS A CB 1 |
| ATOM 1026 C CG . LYS A 1 127 ? -14.180 19.306 2.252 1.00 28.49 ? 488 LYS A CG 1 |
| ATOM 1027 C CD . LYS A 1 127 ? -12.674 19.350 2.360 1.00 32.25 ? 488 LYS A CD 1 |
| ATOM 1028 C CE . LYS A 1 127 ? -12.131 20.700 1.952 1.00 36.89 ? 488 LYS A CE 1 |
| ATOM 1029 N NZ . LYS A 1 127 ? -10.730 20.865 2.428 1.00 42.02 ? 488 LYS A NZ 1 |
| ATOM 1030 N N . ILE A 1 128 ? -17.321 20.369 2.494 1.00 23.34 ? 489 ILE A N 1 |
| ATOM 1031 C CA . ILE A 1 128 ? -17.907 21.515 3.185 1.00 29.73 ? 489 ILE A CA 1 |
| ATOM 1032 C C . ILE A 1 128 ? -17.009 21.778 4.381 1.00 33.19 ? 489 ILE A C 1 |
| ATOM 1033 O O . ILE A 1 128 ? -17.006 20.966 5.309 1.00 30.79 ? 489 ILE A O 1 |
| ATOM 1034 C CB . ILE A 1 128 ? -19.331 21.225 3.699 1.00 30.55 ? 489 ILE A CB 1 |
| ATOM 1035 C CG1 . ILE A 1 128 ? -20.256 20.705 2.592 1.00 31.31 ? 489 ILE A CG1 1 |
| ATOM 1036 C CG2 . ILE A 1 128 ? -19.899 22.465 4.394 1.00 31.25 ? 489 ILE A CG2 1 |
| ATOM 1037 C CD1 . ILE A 1 128 ? -20.323 21.644 1.412 1.00 36.44 ? 489 ILE A CD1 1 |
| ATOM 1038 N N . PRO A 1 129 ? -16.161 22.837 4.363 1.00 35.18 ? 490 PRO A N 1 |
| ATOM 1039 C CA . PRO A 1 129 ? -15.189 23.031 5.439 1.00 35.77 ? 490 PRO A CA 1 |
| ATOM 1040 C C . PRO A 1 129 ? -15.896 23.169 6.778 1.00 34.43 ? 490 PRO A C 1 |
| ATOM 1041 O O . PRO A 1 129 ? -17.041 23.611 6.847 1.00 32.05 ? 490 PRO A O 1 |
| ATOM 1042 C CB . PRO A 1 129 ? -14.401 24.285 5.012 1.00 36.55 ? 490 PRO A CB 1 |
| ATOM 1043 C CG . PRO A 1 129 ? -14.552 24.303 3.497 1.00 39.58 ? 490 PRO A CG 1 |
| ATOM 1044 C CD . PRO A 1 129 ? -15.977 23.803 3.266 1.00 35.65 ? 490 PRO A CD 1 |
| ATOM 1045 N N . ALA A 1 130 ? -15.180 22.795 7.842 1.00 44.64 ? 491 ALA A N 1 |
| ATOM 1046 C CA . ALA A 1 130 ? -15.671 22.965 9.201 1.00 52.40 ? 491 ALA A CA 1 |
| ATOM 1047 C C . ALA A 1 130 ? -16.178 24.397 9.397 1.00 59.48 ? 491 ALA A C 1 |
| ATOM 1048 O O . ALA A 1 130 ? -15.472 25.364 9.104 1.00 52.94 ? 491 ALA A O 1 |
| ATOM 1049 C CB . ALA A 1 130 ? -14.578 22.587 10.181 1.00 55.29 ? 491 ALA A CB 1 |
| ATOM 1050 N N . LEU A 1 131 ? -17.435 24.506 9.850 1.00 69.07 ? 492 LEU A N 1 |
| ATOM 1051 C CA . LEU A 1 131 ? -18.102 25.781 10.049 1.00 81.19 ? 492 LEU A CA 1 |
| ATOM 1052 C C . LEU A 1 131 ? -17.361 26.589 11.122 1.00 95.81 ? 492 LEU A C 1 |
| ATOM 1053 O O . LEU A 1 131 ? -17.072 27.767 10.912 1.00 97.69 ? 492 LEU A O 1 |
| ATOM 1054 C CB . LEU A 1 131 ? -19.573 25.503 10.395 1.00 81.88 ? 492 LEU A CB 1 |
| ATOM 1055 C CG . LEU A 1 131 ? -20.380 26.670 10.969 1.00 85.74 ? 492 LEU A CG 1 |
| ATOM 1056 C CD1 . LEU A 1 131 ? -21.628 26.948 10.134 1.00 75.25 ? 492 LEU A CD1 1 |
| ATOM 1057 C CD2 . LEU A 1 131 ? -20.737 26.430 12.437 1.00 77.43 ? 492 LEU A CD2 1 |
| ATOM 1058 N N . THR A 1 132 ? -17.032 25.934 12.251 1.00 93.29 ? 493 THR A N 1 |
| ATOM 1059 C CA . THR A 1 132 ? -16.190 26.449 13.327 1.00 88.24 ? 493 THR A CA 1 |
| ATOM 1060 C C . THR A 1 132 ? -15.035 25.463 13.532 1.00 84.05 ? 493 THR A C 1 |
| ATOM 1061 O O . THR A 1 132 ? -15.052 24.392 12.938 1.00 93.30 ? 493 THR A O 1 |
| ATOM 1062 C CB . THR A 1 132 ? -16.998 26.500 14.628 1.00 82.41 ? 493 THR A CB 1 |
| ATOM 1063 O OG1 . THR A 1 132 ? -17.323 25.139 14.898 1.00 83.34 ? 493 THR A OG1 1 |
| ATOM 1064 C CG2 . THR A 1 132 ? -18.286 27.284 14.498 1.00 79.75 ? 493 THR A CG2 1 |
| ATOM 1065 N N . GLU A 1 133 ? -14.050 25.773 14.386 1.00 71.85 ? 494 GLU A N 1 |
| ATOM 1066 C CA . GLU A 1 133 ? -12.971 24.812 14.605 1.00 62.49 ? 494 GLU A CA 1 |
| ATOM 1067 C C . GLU A 1 133 ? -13.430 23.651 15.489 1.00 63.83 ? 494 GLU A C 1 |
| ATOM 1068 O O . GLU A 1 133 ? -12.682 22.695 15.673 1.00 58.96 ? 494 GLU A O 1 |
| ATOM 1069 C CB . GLU A 1 133 ? -11.713 25.446 15.201 1.00 61.61 ? 494 GLU A CB 1 |
| ATOM 1070 N N . ASN A 1 134 ? -14.651 23.736 16.039 1.00 70.83 ? 495 ASN A N 1 |
| ATOM 1071 C CA . ASN A 1 134 ? -15.241 22.637 16.793 1.00 81.44 ? 495 ASN A CA 1 |
| ATOM 1072 C C . ASN A 1 134 ? -15.870 21.641 15.828 1.00 77.21 ? 495 ASN A C 1 |
| ATOM 1073 O O . ASN A 1 134 ? -15.703 20.432 15.966 1.00 76.04 ? 495 ASN A O 1 |
| ATOM 1074 C CB . ASN A 1 134 ? -16.418 23.070 17.672 1.00 86.93 ? 495 ASN A CB 1 |
| ATOM 1075 C CG . ASN A 1 134 ? -16.077 24.122 18.706 1.00 91.07 ? 495 ASN A CG 1 |
| ATOM 1076 O OD1 . ASN A 1 134 ? -14.961 24.160 19.221 1.00 90.63 ? 495 ASN A OD1 1 |
| ATOM 1077 N ND2 . ASN A 1 134 ? -17.041 24.972 19.021 1.00 87.31 ? 495 ASN A ND2 1 |
| ATOM 1078 N N . ASP A 1 135 ? -16.618 22.194 14.872 1.00 73.87 ? 496 ASP A N 1 |
| ATOM 1079 C CA . ASP A 1 135 ? -17.449 21.422 13.966 1.00 76.41 ? 496 ASP A CA 1 |
| ATOM 1080 C C . ASP A 1 135 ? -16.564 20.595 13.049 1.00 68.59 ? 496 ASP A C 1 |
| ATOM 1081 O O . ASP A 1 135 ? -15.460 21.020 12.710 1.00 72.85 ? 496 ASP A O 1 |
| ATOM 1082 C CB . ASP A 1 135 ? -18.388 22.334 13.174 1.00 84.76 ? 496 ASP A CB 1 |
| ATOM 1083 C CG . ASP A 1 135 ? -19.520 22.815 14.059 1.00 93.16 ? 496 ASP A CG 1 |
| ATOM 1084 O OD1 . ASP A 1 135 ? -19.555 22.351 15.221 1.00 89.61 ? 496 ASP A OD1 1 |
| ATOM 1085 O OD2 . ASP A 1 135 ? -20.347 23.639 13.596 1.00 87.94 ? 496 ASP A OD2 1 |
| ATOM 1086 N N . PRO A 1 136 ? -17.017 19.390 12.630 1.00 64.05 ? 497 PRO A N 1 |
| ATOM 1087 C CA . PRO A 1 136 ? -16.246 18.563 11.700 1.00 55.96 ? 497 PRO A CA 1 |
| ATOM 1088 C C . PRO A 1 136 ? -16.438 19.077 10.277 1.00 43.98 ? 497 PRO A C 1 |
| ATOM 1089 O O . PRO A 1 136 ? -17.436 19.722 9.963 1.00 41.96 ? 497 PRO A O 1 |
| ATOM 1090 C CB . PRO A 1 136 ? -16.863 17.171 11.886 1.00 53.55 ? 497 PRO A CB 1 |
| ATOM 1091 C CG . PRO A 1 136 ? -18.302 17.474 12.220 1.00 56.67 ? 497 PRO A CG 1 |
| ATOM 1092 C CD . PRO A 1 136 ? -18.269 18.744 13.051 1.00 60.96 ? 497 PRO A CD 1 |
| ATOM 1093 N N . GLU A 1 137 ? -15.459 18.830 9.412 1.00 37.75 ? 498 GLU A N 1 |
| ATOM 1094 C CA . GLU A 1 137 ? -15.787 19.058 8.017 1.00 35.97 ? 498 GLU A CA 1 |
| ATOM 1095 C C . GLU A 1 137 ? -16.646 17.897 7.510 1.00 31.83 ? 498 GLU A C 1 |
| ATOM 1096 O O . GLU A 1 137 ? -16.702 16.831 8.123 1.00 33.38 ? 498 GLU A O 1 |
| ATOM 1097 C CB . GLU A 1 137 ? -14.541 19.239 7.171 1.00 38.69 ? 498 GLU A CB 1 |
| ATOM 1098 C CG . GLU A 1 137 ? -13.567 18.117 7.356 1.00 45.88 ? 498 GLU A CG 1 |
| ATOM 1099 C CD . GLU A 1 137 ? -12.621 17.998 6.171 1.00 50.37 ? 498 GLU A CD 1 |
| ATOM 1100 O OE1 . GLU A 1 137 ? -12.202 19.039 5.642 1.00 43.52 ? 498 GLU A OE1 1 |
| ATOM 1101 O OE2 . GLU A 1 137 ? -12.315 16.856 5.782 1.00 52.19 ? 498 GLU A OE2 1 |
| ATOM 1102 N N . THR A 1 138 ? -17.326 18.124 6.390 1.00 26.43 ? 499 THR A N 1 |
| ATOM 1103 C CA . THR A 1 138 ? -18.250 17.155 5.812 1.00 22.95 ? 499 THR A CA 1 |
| ATOM 1104 C C . THR A 1 138 ? -17.883 16.961 4.346 1.00 21.91 ? 499 THR A C 1 |
| ATOM 1105 O O . THR A 1 138 ? -17.519 17.927 3.672 1.00 22.57 ? 499 THR A O 1 |
| ATOM 1106 C CB . THR A 1 138 ? -19.687 17.696 5.853 1.00 24.09 ? 499 THR A CB 1 |
| ATOM 1107 O OG1 . THR A 1 138 ? -19.950 18.019 7.211 1.00 27.15 ? 499 THR A OG1 1 |
| ATOM 1108 C CG2 . THR A 1 138 ? -20.743 16.726 5.351 1.00 21.86 ? 499 THR A CG2 1 |
| ATOM 1109 N N . TRP A 1 139 ? -17.911 15.711 3.889 1.00 17.97 ? 500 TRP A N 1 |
| ATOM 1110 C CA . TRP A 1 139 ? -17.913 15.437 2.462 1.00 17.05 ? 500 TRP A CA 1 |
| ATOM 1111 C C . TRP A 1 139 ? -19.311 14.953 2.068 1.00 17.10 ? 500 TRP A C 1 |
| ATOM 1112 O O . TRP A 1 139 ? -19.915 14.140 2.783 1.00 16.18 ? 500 TRP A O 1 |
| ATOM 1113 C CB . TRP A 1 139 ? -16.888 14.346 2.189 1.00 18.47 ? 500 TRP A CB 1 |
| ATOM 1114 C CG . TRP A 1 139 ? -15.479 14.858 2.067 1.00 19.49 ? 500 TRP A CG 1 |
| ATOM 1115 C CD1 . TRP A 1 139 ? -14.533 14.927 3.047 1.00 19.34 ? 500 TRP A CD1 1 |
| ATOM 1116 C CD2 . TRP A 1 139 ? -14.848 15.302 0.856 1.00 19.16 ? 500 TRP A CD2 1 |
| ATOM 1117 N NE1 . TRP A 1 139 ? -13.356 15.420 2.538 1.00 20.71 ? 500 TRP A NE1 1 |
| ATOM 1118 C CE2 . TRP A 1 139 ? -13.533 15.680 1.195 1.00 20.75 ? 500 TRP A CE2 1 |
| ATOM 1119 C CE3 . TRP A 1 139 ? -15.297 15.483 -0.463 1.00 20.30 ? 500 TRP A CE3 1 |
| ATOM 1120 C CZ2 . TRP A 1 139 ? -12.637 16.156 0.238 1.00 19.79 ? 500 TRP A CZ2 1 |
| ATOM 1121 C CZ3 . TRP A 1 139 ? -14.426 15.986 -1.398 1.00 20.57 ? 500 TRP A CZ3 1 |
| ATOM 1122 C CH2 . TRP A 1 139 ? -13.115 16.327 -1.038 1.00 21.51 ? 500 TRP A CH2 1 |
| ATOM 1123 N N . ILE A 1 140 ? -19.824 15.458 0.948 1.00 15.98 ? 501 ILE A N 1 |
| ATOM 1124 C CA . ILE A 1 140 ? -21.152 15.082 0.508 1.00 16.54 ? 501 ILE A CA 1 |
| ATOM 1125 C C . ILE A 1 140 ? -21.136 14.730 -0.981 1.00 17.07 ? 501 ILE A C 1 |
| ATOM 1126 O O . ILE A 1 140 ? -20.471 15.396 -1.786 1.00 17.88 ? 501 ILE A O 1 |
| ATOM 1127 C CB . ILE A 1 140 ? -22.154 16.207 0.831 1.00 14.93 ? 501 ILE A CB 1 |
| ATOM 1128 C CG1 . ILE A 1 140 ? -23.535 15.881 0.288 1.00 16.17 ? 501 ILE A CG1 1 |
| ATOM 1129 C CG2 . ILE A 1 140 ? -21.657 17.537 0.318 1.00 16.24 ? 501 ILE A CG2 1 |
| ATOM 1130 C CD1 . ILE A 1 140 ? -24.598 16.875 0.771 1.00 19.12 ? 501 ILE A CD1 1 |
| ATOM 1131 N N . VAL A 1 141 ? -21.817 13.636 -1.346 1.00 15.48 ? 502 VAL A N 1 |
| ATOM 1132 C CA . VAL A 1 141 ? -22.175 13.465 -2.742 1.00 13.72 ? 502 VAL A CA 1 |
| ATOM 1133 C C . VAL A 1 141 ? -23.677 13.669 -2.906 1.00 15.38 ? 502 VAL A C 1 |
| ATOM 1134 O O . VAL A 1 141 ? -24.484 13.046 -2.179 1.00 14.05 ? 502 VAL A O 1 |
| ATOM 1135 C CB . VAL A 1 141 ? -21.768 12.088 -3.293 1.00 14.73 ? 502 VAL A CB 1 |
| ATOM 1136 C CG1 . VAL A 1 141 ? -22.245 11.954 -4.722 1.00 13.69 ? 502 VAL A CG1 1 |
| ATOM 1137 C CG2 . VAL A 1 141 ? -20.257 11.861 -3.200 1.00 16.07 ? 502 VAL A CG2 1 |
| ATOM 1138 N N . CYS A 1 142 ? -24.031 14.490 -3.898 1.00 14.94 ? 503 CYS A N 1 |
| ATOM 1139 C CA . CYS A 1 142 ? -25.430 14.696 -4.212 1.00 17.24 ? 503 CYS A CA 1 |
| ATOM 1140 C C . CYS A 1 142 ? -25.704 14.246 -5.641 1.00 16.93 ? 503 CYS A C 1 |
| ATOM 1141 O O . CYS A 1 142 ? -25.056 14.693 -6.587 1.00 14.80 ? 503 CYS A O 1 |
| ATOM 1142 C CB . CYS A 1 142 ? -25.869 16.156 -4.183 1.00 15.53 ? 503 CYS A CB 1 |
| ATOM 1143 S SG A CYS A 1 142 ? -27.674 16.326 -4.087 0.70 19.82 ? 503 CYS A SG 1 |
| ATOM 1144 S SG B CYS A 1 142 ? -25.785 16.945 -2.577 0.30 18.77 ? 503 CYS A SG 1 |
| ATOM 1145 N N . ASN A 1 143 ? -26.772 13.459 -5.788 1.00 18.26 ? 504 ASN A N 1 |
| ATOM 1146 C CA . ASN A 1 143 ? -27.241 12.983 -7.077 1.00 17.39 ? 504 ASN A CA 1 |
| ATOM 1147 C C . ASN A 1 143 ? -28.659 13.521 -7.206 1.00 16.86 ? 504 ASN A C 1 |
| ATOM 1148 O O . ASN A 1 143 ? -29.522 13.122 -6.436 1.00 16.53 ? 504 ASN A O 1 |
| ATOM 1149 C CB . ASN A 1 143 ? -27.255 11.447 -7.116 1.00 16.05 ? 504 ASN A CB 1 |
| ATOM 1150 C CG . ASN A 1 143 ? -25.855 10.880 -7.077 1.00 17.51 ? 504 ASN A CG 1 |
| ATOM 1151 O OD1 . ASN A 1 143 ? -24.929 11.544 -7.513 1.00 16.59 ? 504 ASN A OD1 1 |
| ATOM 1152 N ND2 . ASN A 1 143 ? -25.698 9.648 -6.602 1.00 15.07 ? 504 ASN A ND2 1 |
| ATOM 1153 N N . PHE A 1 144 ? -28.907 14.441 -8.142 1.00 15.28 ? 505 PHE A N 1 |
| ATOM 1154 C CA . PHE A 1 144 ? -30.272 14.902 -8.280 1.00 16.35 ? 505 PHE A CA 1 |
| ATOM 1155 C C . PHE A 1 144 ? -30.648 15.025 -9.752 1.00 17.50 ? 505 PHE A C 1 |
| ATOM 1156 O O . PHE A 1 144 ? -29.816 15.373 -10.585 1.00 15.52 ? 505 PHE A O 1 |
| ATOM 1157 C CB . PHE A 1 144 ? -30.477 16.225 -7.528 1.00 16.62 ? 505 PHE A CB 1 |
| ATOM 1158 C CG . PHE A 1 144 ? -29.580 17.343 -8.000 1.00 18.75 ? 505 PHE A CG 1 |
| ATOM 1159 C CD1 . PHE A 1 144 ? -28.292 17.464 -7.509 1.00 19.09 ? 505 PHE A CD1 1 |
| ATOM 1160 C CD2 . PHE A 1 144 ? -30.038 18.287 -8.908 1.00 19.05 ? 505 PHE A CD2 1 |
| ATOM 1161 C CE1 . PHE A 1 144 ? -27.477 18.513 -7.904 1.00 20.94 ? 505 PHE A CE1 1 |
| ATOM 1162 C CE2 . PHE A 1 144 ? -29.205 19.319 -9.337 1.00 20.47 ? 505 PHE A CE2 1 |
| ATOM 1163 C CZ . PHE A 1 144 ? -27.920 19.428 -8.848 1.00 21.77 ? 505 PHE A CZ 1 |
| ATOM 1164 N N . SER A 1 145 ? -31.938 14.793 -10.062 1.00 17.36 ? 506 SER A N 1 |
| ATOM 1165 C CA . SER A 1 145 ? -32.357 14.719 -11.447 1.00 16.52 ? 506 SER A CA 1 |
| ATOM 1166 C C . SER A 1 145 ? -32.257 16.103 -12.086 1.00 19.47 ? 506 SER A C 1 |
| ATOM 1167 O O . SER A 1 145 ? -32.576 17.097 -11.438 1.00 17.33 ? 506 SER A O 1 |
| ATOM 1168 C CB . SER A 1 145 ? -33.762 14.255 -11.531 1.00 16.22 ? 506 SER A CB 1 |
| ATOM 1169 O OG . SER A 1 145 ? -33.733 12.854 -11.351 1.00 16.26 ? 506 SER A OG 1 |
| ATOM 1170 N N . VAL A 1 146 ? -31.872 16.108 -13.366 1.00 16.93 ? 507 VAL A N 1 |
| ATOM 1171 C CA . VAL A 1 146 ? -31.819 17.291 -14.213 1.00 21.42 ? 507 VAL A CA 1 |
| ATOM 1172 C C . VAL A 1 146 ? -32.340 16.902 -15.598 1.00 24.64 ? 507 VAL A C 1 |
| ATOM 1173 O O . VAL A 1 146 ? -32.430 15.715 -15.935 1.00 23.01 ? 507 VAL A O 1 |
| ATOM 1174 C CB . VAL A 1 146 ? -30.408 17.903 -14.339 1.00 20.79 ? 507 VAL A CB 1 |
| ATOM 1175 C CG1 . VAL A 1 146 ? -29.921 18.508 -13.025 1.00 20.50 ? 507 VAL A CG1 1 |
| ATOM 1176 C CG2 . VAL A 1 146 ? -29.410 16.924 -14.894 1.00 17.67 ? 507 VAL A CG2 1 |
| ATOM 1177 N N . ASP A 1 147 ? -32.664 17.934 -16.388 1.00 25.52 ? 508 ASP A N 1 |
| ATOM 1178 C CA . ASP A 1 147 ? -33.048 17.790 -17.782 1.00 26.84 ? 508 ASP A CA 1 |
| ATOM 1179 C C . ASP A 1 147 ? -31.793 17.891 -18.645 1.00 25.89 ? 508 ASP A C 1 |
| ATOM 1180 O O . ASP A 1 147 ? -30.842 18.584 -18.295 1.00 26.86 ? 508 ASP A O 1 |
| ATOM 1181 C CB . ASP A 1 147 ? -34.062 18.871 -18.142 1.00 26.33 ? 508 ASP A CB 1 |
| ATOM 1182 C CG . ASP A 1 147 ? -35.384 18.581 -17.470 1.00 35.69 ? 508 ASP A CG 1 |
| ATOM 1183 O OD1 . ASP A 1 147 ? -35.776 17.409 -17.447 1.00 42.46 ? 508 ASP A OD1 1 |
| ATOM 1184 O OD2 . ASP A 1 147 ? -35.976 19.501 -16.951 1.00 38.07 ? 508 ASP A OD2 1 |
| ATOM 1185 N N . HIS A 1 148 ? -31.787 17.186 -19.773 1.00 22.70 ? 509 HIS A N 1 |
| ATOM 1186 C CA . HIS A 1 148 ? -30.663 17.300 -20.688 1.00 28.35 ? 509 HIS A CA 1 |
| ATOM 1187 C C . HIS A 1 148 ? -31.078 16.927 -22.111 1.00 32.81 ? 509 HIS A C 1 |
| ATOM 1188 O O . HIS A 1 148 ? -31.794 15.955 -22.317 1.00 32.45 ? 509 HIS A O 1 |
| ATOM 1189 C CB . HIS A 1 148 ? -29.505 16.410 -20.261 1.00 30.03 ? 509 HIS A CB 1 |
| ATOM 1190 C CG . HIS A 1 148 ? -28.208 16.740 -20.923 1.00 28.83 ? 509 HIS A CG 1 |
| ATOM 1191 N ND1 . HIS A 1 148 ? -28.025 16.639 -22.294 1.00 32.34 ? 509 HIS A ND1 1 |
| ATOM 1192 C CD2 . HIS A 1 148 ? -27.018 17.119 -20.406 1.00 30.07 ? 509 HIS A CD2 1 |
| ATOM 1193 C CE1 . HIS A 1 148 ? -26.776 16.963 -22.605 1.00 32.52 ? 509 HIS A CE1 1 |
| ATOM 1194 N NE2 . HIS A 1 148 ? -26.123 17.245 -21.450 1.00 29.57 ? 509 HIS A NE2 1 |
| ATOM 1195 N N . ASP A 1 149 ? -30.577 17.702 -23.079 1.00 38.54 ? 510 ASP A N 1 |
| ATOM 1196 C CA . ASP A 1 149 ? -30.946 17.573 -24.479 1.00 45.06 ? 510 ASP A CA 1 |
| ATOM 1197 C C . ASP A 1 149 ? -30.488 16.230 -25.015 1.00 39.71 ? 510 ASP A C 1 |
| ATOM 1198 O O . ASP A 1 149 ? -31.137 15.689 -25.894 1.00 46.52 ? 510 ASP A O 1 |
| ATOM 1199 C CB . ASP A 1 149 ? -30.282 18.654 -25.337 1.00 50.11 ? 510 ASP A CB 1 |
| ATOM 1200 C CG . ASP A 1 149 ? -30.841 20.048 -25.119 1.00 59.78 ? 510 ASP A CG 1 |
| ATOM 1201 O OD1 . ASP A 1 149 ? -32.061 20.171 -24.898 1.00 64.34 ? 510 ASP A OD1 1 |
| ATOM 1202 O OD2 . ASP A 1 149 ? -30.048 21.001 -25.169 1.00 70.56 ? 510 ASP A OD2 1 |
| ATOM 1203 N N . SER A 1 150 ? -29.356 15.711 -24.530 1.00 39.67 ? 511 SER A N 1 |
| ATOM 1204 C CA . SER A 1 150 ? -28.859 14.459 -25.086 1.00 39.83 ? 511 SER A CA 1 |
| ATOM 1205 C C . SER A 1 150 ? -29.407 13.255 -24.316 1.00 45.64 ? 511 SER A C 1 |
| ATOM 1206 O O . SER A 1 150 ? -28.758 12.193 -24.270 1.00 44.42 ? 511 SER A O 1 |
| ATOM 1207 C CB . SER A 1 150 ? -27.363 14.432 -25.093 1.00 43.16 ? 511 SER A CB 1 |
| ATOM 1208 O OG . SER A 1 150 ? -26.853 15.525 -25.833 1.00 46.17 ? 511 SER A OG 1 |
| ATOM 1209 N N . ALA A 1 151 ? -30.587 13.436 -23.689 1.00 41.24 ? 512 ALA A N 1 |
| ATOM 1210 C CA . ALA A 1 151 ? -31.208 12.352 -22.930 1.00 38.08 ? 512 ALA A CA 1 |
| ATOM 1211 C C . ALA A 1 151 ? -31.477 11.203 -23.905 1.00 33.53 ? 512 ALA A C 1 |
| ATOM 1212 O O . ALA A 1 151 ? -32.180 11.410 -24.883 1.00 31.12 ? 512 ALA A O 1 |
| ATOM 1213 C CB . ALA A 1 151 ? -32.513 12.822 -22.287 1.00 27.10 ? 512 ALA A CB 1 |
| ATOM 1214 N N . PRO A 1 152 ? -31.007 9.960 -23.657 1.00 38.08 ? 513 PRO A N 1 |
| ATOM 1215 C CA . PRO A 1 152 ? -31.377 8.808 -24.494 1.00 36.29 ? 513 PRO A CA 1 |
| ATOM 1216 C C . PRO A 1 152 ? -32.879 8.526 -24.619 1.00 37.01 ? 513 PRO A C 1 |
| ATOM 1217 O O . PRO A 1 152 ? -33.661 8.814 -23.704 1.00 29.94 ? 513 PRO A O 1 |
| ATOM 1218 C CB . PRO A 1 152 ? -30.775 7.611 -23.748 1.00 41.79 ? 513 PRO A CB 1 |
| ATOM 1219 C CG . PRO A 1 152 ? -29.664 8.213 -22.912 1.00 44.84 ? 513 PRO A CG 1 |
| ATOM 1220 C CD . PRO A 1 152 ? -30.081 9.624 -22.569 1.00 40.90 ? 513 PRO A CD 1 |
| ATOM 1221 N N . LEU A 1 153 ? -33.269 7.921 -25.753 1.00 38.64 ? 514 LEU A N 1 |
| ATOM 1222 C CA . LEU A 1 153 ? -34.608 7.376 -25.945 1.00 37.51 ? 514 LEU A CA 1 |
| ATOM 1223 C C . LEU A 1 153 ? -34.640 5.917 -25.478 1.00 36.83 ? 514 LEU A C 1 |
| ATOM 1224 O O . LEU A 1 153 ? -33.837 5.111 -25.957 1.00 28.44 ? 514 LEU A O 1 |
| ATOM 1225 C CB . LEU A 1 153 ? -35.008 7.457 -27.422 1.00 37.92 ? 514 LEU A CB 1 |
| ATOM 1226 C CG . LEU A 1 153 ? -36.352 6.796 -27.721 1.00 43.24 ? 514 LEU A CG 1 |
| ATOM 1227 C CD1 . LEU A 1 153 ? -37.498 7.640 -27.185 1.00 44.99 ? 514 LEU A CD1 1 |
| ATOM 1228 C CD2 . LEU A 1 153 ? -36.527 6.520 -29.206 1.00 44.15 ? 514 LEU A CD2 1 |
| ATOM 1229 N N . ASN A 1 154 ? -35.569 5.600 -24.545 1.00 29.32 ? 515 ASN A N 1 |
| ATOM 1230 C CA . ASN A 1 154 ? -35.690 4.260 -23.978 1.00 32.73 ? 515 ASN A CA 1 |
| ATOM 1231 C C . ASN A 1 154 ? -37.171 4.004 -23.667 1.00 33.61 ? 515 ASN A C 1 |
| ATOM 1232 O O . ASN A 1 154 ? -37.646 4.233 -22.555 1.00 34.44 ? 515 ASN A O 1 |
| ATOM 1233 C CB . ASN A 1 154 ? -34.711 4.048 -22.817 1.00 25.39 ? 515 ASN A CB 1 |
| ATOM 1234 C CG . ASN A 1 154 ? -34.581 2.620 -22.336 1.00 27.99 ? 515 ASN A CG 1 |
| ATOM 1235 O OD1 . ASN A 1 154 ? -35.422 1.755 -22.623 1.00 26.36 ? 515 ASN A OD1 1 |
| ATOM 1236 N ND2 . ASN A 1 154 ? -33.515 2.347 -21.586 1.00 28.61 ? 515 ASN A ND2 1 |
| ATOM 1237 N N . ASN A 1 155 ? -37.872 3.532 -24.698 1.00 39.39 ? 516 ASN A N 1 |
| ATOM 1238 C CA . ASN A 1 155 ? -39.303 3.292 -24.711 1.00 42.52 ? 516 ASN A CA 1 |
| ATOM 1239 C C . ASN A 1 155 ? -39.719 2.274 -23.651 1.00 41.62 ? 516 ASN A C 1 |
| ATOM 1240 O O . ASN A 1 155 ? -40.874 2.321 -23.235 1.00 43.05 ? 516 ASN A O 1 |
| ATOM 1241 C CB . ASN A 1 155 ? -39.746 2.784 -26.087 1.00 44.21 ? 516 ASN A CB 1 |
| ATOM 1242 C CG . ASN A 1 155 ? -39.622 3.869 -27.127 1.00 50.16 ? 516 ASN A CG 1 |
| ATOM 1243 O OD1 . ASN A 1 155 ? -39.664 5.048 -26.772 1.00 55.97 ? 516 ASN A OD1 1 |
| ATOM 1244 N ND2 . ASN A 1 155 ? -39.445 3.485 -28.383 1.00 41.17 ? 516 ASN A ND2 1 |
| ATOM 1245 N N . ARG A 1 156 ? -38.818 1.344 -23.252 1.00 34.94 ? 517 ARG A N 1 |
| ATOM 1246 C CA . ARG A 1 156 ? -39.175 0.345 -22.233 1.00 42.61 ? 517 ARG A CA 1 |
| ATOM 1247 C C . ARG A 1 156 ? -39.200 0.944 -20.820 1.00 33.84 ? 517 ARG A C 1 |
| ATOM 1248 O O . ARG A 1 156 ? -39.730 0.320 -19.898 1.00 35.82 ? 517 ARG A O 1 |
| ATOM 1249 C CB . ARG A 1 156 ? -38.208 -0.846 -22.170 1.00 39.76 ? 517 ARG A CB 1 |
| ATOM 1250 C CG . ARG A 1 156 ? -38.238 -1.747 -23.394 1.00 49.35 ? 517 ARG A CG 1 |
| ATOM 1251 C CD . ARG A 1 156 ? -36.807 -2.120 -23.688 1.00 49.17 ? 517 ARG A CD 1 |
| ATOM 1252 N NE . ARG A 1 156 ? -36.754 -3.196 -24.662 1.00 65.66 ? 517 ARG A NE 1 |
| ATOM 1253 C CZ . ARG A 1 156 ? -36.492 -4.472 -24.373 1.00 67.34 ? 517 ARG A CZ 1 |
| ATOM 1254 N NH1 . ARG A 1 156 ? -36.303 -4.846 -23.117 1.00 63.49 ? 517 ARG A NH1 1 |
| ATOM 1255 N NH2 . ARG A 1 156 ? -36.407 -5.367 -25.345 1.00 72.29 ? 517 ARG A NH2 1 |
| ATOM 1256 N N . CYS A 1 157 ? -38.589 2.119 -20.643 1.00 28.80 ? 518 CYS A N 1 |
| ATOM 1257 C CA . CYS A 1 157 ? -38.322 2.673 -19.313 1.00 30.81 ? 518 CYS A CA 1 |
| ATOM 1258 C C . CYS A 1 157 ? -39.240 3.856 -18.980 1.00 27.79 ? 518 CYS A C 1 |
| ATOM 1259 O O . CYS A 1 157 ? -39.487 4.679 -19.844 1.00 27.74 ? 518 CYS A O 1 |
| ATOM 1260 C CB . CYS A 1 157 ? -36.863 3.121 -19.237 1.00 27.66 ? 518 CYS A CB 1 |
| ATOM 1261 S SG . CYS A 1 157 ? -35.747 1.741 -18.874 1.00 31.49 ? 518 CYS A SG 1 |
| ATOM 1262 N N . VAL A 1 158 ? -39.705 3.948 -17.707 1.00 27.83 ? 519 VAL A N 1 |
| ATOM 1263 C CA . VAL A 1 158 ? -40.357 5.117 -17.121 1.00 21.86 ? 519 VAL A CA 1 |
| ATOM 1264 C C . VAL A 1 158 ? -39.286 5.958 -16.442 1.00 19.92 ? 519 VAL A C 1 |
| ATOM 1265 O O . VAL A 1 158 ? -38.455 5.421 -15.717 1.00 18.65 ? 519 VAL A O 1 |
| ATOM 1266 C CB . VAL A 1 158 ? -41.369 4.687 -16.039 1.00 22.63 ? 519 VAL A CB 1 |
| ATOM 1267 C CG1 . VAL A 1 158 ? -42.038 5.864 -15.333 1.00 22.80 ? 519 VAL A CG1 1 |
| ATOM 1268 C CG2 . VAL A 1 158 ? -42.382 3.698 -16.576 1.00 24.23 ? 519 VAL A CG2 1 |
| ATOM 1269 N N . ARG A 1 159 ? -39.335 7.280 -16.634 1.00 18.46 ? 520 ARG A N 1 |
| ATOM 1270 C CA . ARG A 1 159 ? -38.295 8.122 -16.065 1.00 19.37 ? 520 ARG A CA 1 |
| ATOM 1271 C C . ARG A 1 159 ? -38.562 8.429 -14.585 1.00 18.26 ? 520 ARG A C 1 |
| ATOM 1272 O O . ARG A 1 159 ? -39.549 9.096 -14.248 1.00 16.69 ? 520 ARG A O 1 |
| ATOM 1273 C CB . ARG A 1 159 ? -38.214 9.426 -16.885 1.00 20.66 ? 520 ARG A CB 1 |
| ATOM 1274 C CG . ARG A 1 159 ? -37.194 10.436 -16.378 1.00 24.04 ? 520 ARG A CG 1 |
| ATOM 1275 C CD . ARG A 1 159 ? -35.771 10.010 -16.645 1.00 22.01 ? 520 ARG A CD 1 |
| ATOM 1276 N NE . ARG A 1 159 ? -35.571 9.414 -17.964 1.00 27.64 ? 520 ARG A NE 1 |
| ATOM 1277 C CZ . ARG A 1 159 ? -35.198 10.059 -19.062 1.00 29.68 ? 520 ARG A CZ 1 |
| ATOM 1278 N NH1 . ARG A 1 159 ? -35.017 11.367 -19.019 1.00 32.85 ? 520 ARG A NH1 1 |
| ATOM 1279 N NH2 . ARG A 1 159 ? -34.976 9.390 -20.186 1.00 32.42 ? 520 ARG A NH2 1 |
| ATOM 1280 N N . ALA A 1 160 ? -37.664 7.942 -13.709 1.00 15.92 ? 521 ALA A N 1 |
| ATOM 1281 C CA . ALA A 1 160 ? -37.757 8.304 -12.306 1.00 16.41 ? 521 ALA A CA 1 |
| ATOM 1282 C C . ALA A 1 160 ? -37.053 9.641 -12.091 1.00 19.11 ? 521 ALA A C 1 |
| ATOM 1283 O O . ALA A 1 160 ? -36.210 10.034 -12.912 1.00 18.62 ? 521 ALA A O 1 |
| ATOM 1284 C CB . ALA A 1 160 ? -37.125 7.219 -11.473 1.00 16.80 ? 521 ALA A CB 1 |
| ATOM 1285 N N . LYS A 1 161 ? -37.392 10.326 -10.987 1.00 17.02 ? 522 LYS A N 1 |
| ATOM 1286 C CA . LYS A 1 161 ? -36.605 11.469 -10.541 1.00 18.00 ? 522 LYS A CA 1 |
| ATOM 1287 C C . LYS A 1 161 ? -36.106 11.221 -9.117 1.00 19.37 ? 522 LYS A C 1 |
| ATOM 1288 O O . LYS A 1 161 ? -36.890 10.782 -8.266 1.00 18.59 ? 522 LYS A O 1 |
| ATOM 1289 C CB . LYS A 1 161 ? -37.468 12.734 -10.641 1.00 19.79 ? 522 LYS A CB 1 |
| ATOM 1290 C CG . LYS A 1 161 ? -37.639 13.194 -12.081 1.00 30.01 ? 522 LYS A CG 1 |
| ATOM 1291 C CD . LYS A 1 161 ? -38.981 13.824 -12.407 1.00 40.36 ? 522 LYS A CD 1 |
| ATOM 1292 C CE . LYS A 1 161 ? -38.975 14.428 -13.805 1.00 46.37 ? 522 LYS A CE 1 |
| ATOM 1293 N NZ . LYS A 1 161 ? -39.977 15.514 -13.981 1.00 63.52 ? 522 LYS A NZ 1 |
| ATOM 1294 N N . ILE A 1 162 ? -34.847 11.594 -8.864 1.00 17.96 ? 523 ILE A N 1 |
| ATOM 1295 C CA . ILE A 1 162 ? -34.152 11.293 -7.624 1.00 16.13 ? 523 ILE A CA 1 |
| ATOM 1296 C C . ILE A 1 162 ? -33.509 12.557 -7.059 1.00 15.64 ? 523 ILE A C 1 |
| ATOM 1297 O O . ILE A 1 162 ? -33.206 13.510 -7.784 1.00 13.36 ? 523 ILE A O 1 |
| ATOM 1298 C CB . ILE A 1 162 ? -33.132 10.159 -7.812 1.00 18.86 ? 523 ILE A CB 1 |
| ATOM 1299 C CG1 . ILE A 1 162 ? -31.896 10.607 -8.614 1.00 16.68 ? 523 ILE A CG1 1 |
| ATOM 1300 C CG2 . ILE A 1 162 ? -33.835 8.929 -8.410 1.00 17.91 ? 523 ILE A CG2 1 |
| ATOM 1301 C CD1 . ILE A 1 162 ? -30.737 9.650 -8.547 1.00 17.72 ? 523 ILE A CD1 1 |
| ATOM 1302 N N . ASN A 1 163 ? -33.405 12.588 -5.718 1.00 13.61 ? 524 ASN A N 1 |
| ATOM 1303 C CA . ASN A 1 163 ? -32.541 13.490 -4.998 1.00 14.91 ? 524 ASN A CA 1 |
| ATOM 1304 C C . ASN A 1 163 ? -31.934 12.670 -3.863 1.00 14.07 ? 524 ASN A C 1 |
| ATOM 1305 O O . ASN A 1 163 ? -32.649 12.270 -2.944 1.00 13.55 ? 524 ASN A O 1 |
| ATOM 1306 C CB . ASN A 1 163 ? -33.348 14.693 -4.503 1.00 15.73 ? 524 ASN A CB 1 |
| ATOM 1307 C CG . ASN A 1 163 ? -32.499 15.623 -3.674 1.00 20.32 ? 524 ASN A CG 1 |
| ATOM 1308 O OD1 . ASN A 1 163 ? -31.297 15.415 -3.478 1.00 21.91 ? 524 ASN A OD1 1 |
| ATOM 1309 N ND2 . ASN A 1 163 ? -33.140 16.641 -3.134 1.00 27.90 ? 524 ASN A ND2 1 |
| ATOM 1310 N N . VAL A 1 164 ? -30.659 12.328 -3.994 1.00 14.11 ? 525 VAL A N 1 |
| ATOM 1311 C CA . VAL A 1 164 ? -29.990 11.413 -3.084 1.00 14.96 ? 525 VAL A CA 1 |
| ATOM 1312 C C . VAL A 1 164 ? -28.760 12.164 -2.589 1.00 17.30 ? 525 VAL A C 1 |
| ATOM 1313 O O . VAL A 1 164 ? -28.155 12.867 -3.379 1.00 17.22 ? 525 VAL A O 1 |
| ATOM 1314 C CB . VAL A 1 164 ? -29.611 10.117 -3.813 1.00 15.27 ? 525 VAL A CB 1 |
| ATOM 1315 C CG1 . VAL A 1 164 ? -28.562 9.280 -3.081 1.00 14.86 ? 525 VAL A CG1 1 |
| ATOM 1316 C CG2 . VAL A 1 164 ? -30.852 9.299 -4.181 1.00 15.02 ? 525 VAL A CG2 1 |
| ATOM 1317 N N . ALA A 1 165 ? -28.439 12.055 -1.292 1.00 16.13 ? 526 ALA A N 1 |
| ATOM 1318 C CA . ALA A 1 165 ? -27.187 12.533 -0.737 1.00 15.38 ? 526 ALA A CA 1 |
| ATOM 1319 C C . ALA A 1 165 ? -26.581 11.470 0.170 1.00 16.66 ? 526 ALA A C 1 |
| ATOM 1320 O O . ALA A 1 165 ? -27.256 10.773 0.953 1.00 16.21 ? 526 ALA A O 1 |
| ATOM 1321 C CB . ALA A 1 165 ? -27.391 13.862 -0.031 1.00 14.50 ? 526 ALA A CB 1 |
| ATOM 1322 N N . MET A 1 166 ? -25.274 11.289 0.001 1.00 16.09 ? 527 MET A N 1 |
| ATOM 1323 C CA . MET A 1 166 ? -24.415 10.537 0.893 1.00 15.70 ? 527 MET A CA 1 |
| ATOM 1324 C C . MET A 1 166 ? -23.533 11.556 1.629 1.00 17.43 ? 527 MET A C 1 |
| ATOM 1325 O O . MET A 1 166 ? -22.733 12.287 1.005 1.00 17.29 ? 527 MET A O 1 |
| ATOM 1326 C CB . MET A 1 166 ? -23.555 9.618 0.008 1.00 17.54 ? 527 MET A CB 1 |
| ATOM 1327 C CG . MET A 1 166 ? -22.435 8.849 0.689 1.00 20.47 ? 527 MET A CG 1 |
| ATOM 1328 S SD . MET A 1 166 ? -22.976 7.444 1.637 1.00 27.39 ? 527 MET A SD 1 |
| ATOM 1329 C CE . MET A 1 166 ? -23.502 6.353 0.309 1.00 19.43 ? 527 MET A CE 1 |
| ATOM 1330 N N . ILE A 1 167 ? -23.752 11.696 2.941 1.00 15.98 ? 528 ILE A N 1 |
| ATOM 1331 C CA . ILE A 1 167 ? -23.168 12.815 3.665 1.00 18.00 ? 528 ILE A CA 1 |
| ATOM 1332 C C . ILE A 1 167 ? -22.295 12.257 4.772 1.00 20.50 ? 528 ILE A C 1 |
| ATOM 1333 O O . ILE A 1 167 ? -22.799 11.507 5.583 1.00 20.13 ? 528 ILE A O 1 |
| ATOM 1334 C CB . ILE A 1 167 ? -24.240 13.719 4.287 1.00 19.49 ? 528 ILE A CB 1 |
| ATOM 1335 C CG1 . ILE A 1 167 ? -25.353 14.107 3.314 1.00 20.15 ? 528 ILE A CG1 1 |
| ATOM 1336 C CG2 . ILE A 1 167 ? -23.585 14.941 4.922 1.00 19.95 ? 528 ILE A CG2 1 |
| ATOM 1337 C CD1 . ILE A 1 167 ? -26.588 14.740 3.971 1.00 17.48 ? 528 ILE A CD1 1 |
| ATOM 1338 N N . CYS A 1 168 ? -21.008 12.648 4.831 1.00 16.95 ? 529 CYS A N 1 |
| ATOM 1339 C CA . CYS A 1 168 ? -20.094 11.901 5.671 1.00 18.56 ? 529 CYS A CA 1 |
| ATOM 1340 C C . CYS A 1 168 ? -19.312 12.834 6.594 1.00 20.89 ? 529 CYS A C 1 |
| ATOM 1341 O O . CYS A 1 168 ? -18.795 13.822 6.104 1.00 18.78 ? 529 CYS A O 1 |
| ATOM 1342 C CB . CYS A 1 168 ? -19.067 11.216 4.789 1.00 17.71 ? 529 CYS A CB 1 |
| ATOM 1343 S SG . CYS A 1 168 ? -19.823 9.901 3.790 1.00 20.95 ? 529 CYS A SG 1 |
| ATOM 1344 N N . GLN A 1 169 ? -19.248 12.516 7.903 1.00 21.05 ? 530 GLN A N 1 |
| ATOM 1345 C CA . GLN A 1 169 ? -18.355 13.221 8.813 1.00 24.67 ? 530 GLN A CA 1 |
| ATOM 1346 C C . GLN A 1 169 ? -17.400 12.213 9.431 1.00 28.91 ? 530 GLN A C 1 |
| ATOM 1347 O O . GLN A 1 169 ? -17.772 11.066 9.649 1.00 29.97 ? 530 GLN A O 1 |
| ATOM 1348 C CB . GLN A 1 169 ? -19.149 14.033 9.838 1.00 23.58 ? 530 GLN A CB 1 |
| ATOM 1349 C CG . GLN A 1 169 ? -19.912 15.143 9.136 1.00 26.59 ? 530 GLN A CG 1 |
| ATOM 1350 C CD . GLN A 1 169 ? -20.728 16.015 10.044 1.00 30.95 ? 530 GLN A CD 1 |
| ATOM 1351 O OE1 . GLN A 1 169 ? -21.269 15.560 11.044 1.00 33.02 ? 530 GLN A OE1 1 |
| ATOM 1352 N NE2 . GLN A 1 169 ? -20.807 17.283 9.698 1.00 31.73 ? 530 GLN A NE2 1 |
| ATOM 1353 N N . THR A 1 170 ? -16.145 12.629 9.637 1.00 24.29 ? 531 THR A N 1 |
| ATOM 1354 C CA . THR A 1 170 ? -15.116 11.697 10.078 1.00 23.22 ? 531 THR A CA 1 |
| ATOM 1355 C C . THR A 1 170 ? -14.617 12.025 11.490 1.00 26.49 ? 531 THR A C 1 |
| ATOM 1356 O O . THR A 1 170 ? -14.326 13.177 11.817 1.00 24.33 ? 531 THR A O 1 |
| ATOM 1357 C CB . THR A 1 170 ? -13.951 11.661 9.083 1.00 23.04 ? 531 THR A CB 1 |
| ATOM 1358 O OG1 . THR A 1 170 ? -14.509 11.478 7.785 1.00 25.60 ? 531 THR A OG1 1 |
| ATOM 1359 C CG2 . THR A 1 170 ? -12.945 10.563 9.362 1.00 21.97 ? 531 THR A CG2 1 |
| ATOM 1360 N N . LEU A 1 171 ? -14.532 10.995 12.334 1.00 27.59 ? 532 LEU A N 1 |
| ATOM 1361 C CA . LEU A 1 171 ? -14.058 11.148 13.705 1.00 29.62 ? 532 LEU A CA 1 |
| ATOM 1362 C C . LEU A 1 171 ? -12.715 10.450 13.774 1.00 31.54 ? 532 LEU A C 1 |
| ATOM 1363 O O . LEU A 1 171 ? -12.620 9.351 13.249 1.00 30.69 ? 532 LEU A O 1 |
| ATOM 1364 C CB . LEU A 1 171 ? -15.061 10.449 14.629 1.00 28.71 ? 532 LEU A CB 1 |
| ATOM 1365 C CG . LEU A 1 171 ? -16.417 11.151 14.639 1.00 34.74 ? 532 LEU A CG 1 |
| ATOM 1366 C CD1 . LEU A 1 171 ? -17.439 10.429 15.520 1.00 35.91 ? 532 LEU A CD1 1 |
| ATOM 1367 C CD2 . LEU A 1 171 ? -16.259 12.621 15.015 1.00 35.05 ? 532 LEU A CD2 1 |
| ATOM 1368 N N . VAL A 1 172 ? -11.689 11.088 14.365 1.00 34.35 ? 533 VAL A N 1 |
| ATOM 1369 C CA . VAL A 1 172 ? -10.420 10.409 14.595 1.00 33.80 ? 533 VAL A CA 1 |
| ATOM 1370 C C . VAL A 1 172 ? -10.183 10.407 16.103 1.00 37.85 ? 533 VAL A C 1 |
| ATOM 1371 O O . VAL A 1 172 ? -10.416 11.418 16.745 1.00 39.14 ? 533 VAL A O 1 |
| ATOM 1372 C CB . VAL A 1 172 ? -9.251 11.095 13.870 1.00 36.74 ? 533 VAL A CB 1 |
| ATOM 1373 C CG1 . VAL A 1 172 ? -9.384 11.037 12.358 1.00 39.46 ? 533 VAL A CG1 1 |
| ATOM 1374 C CG2 . VAL A 1 172 ? -9.137 12.535 14.321 1.00 42.78 ? 533 VAL A CG2 1 |
| ATOM 1375 N N . SER A 1 173 ? -9.756 9.277 16.672 1.00 39.30 ? 534 SER A N 1 |
| ATOM 1376 C CA . SER A 1 173 ? -9.658 9.158 18.118 1.00 48.37 ? 534 SER A CA 1 |
| ATOM 1377 C C . SER A 1 173 ? -8.327 9.757 18.592 1.00 50.12 ? 534 SER A C 1 |
| ATOM 1378 O O . SER A 1 173 ? -8.056 10.962 18.478 1.00 51.15 ? 534 SER A O 1 |
| ATOM 1379 C CB . SER A 1 173 ? -9.659 7.724 18.493 1.00 51.28 ? 534 SER A CB 1 |
| ATOM 1380 O OG . SER A 1 173 ? -8.344 7.242 18.247 1.00 54.52 ? 534 SER A OG 1 |
| ATOM 1381 N N . GLU A 1 180 ? 0.772 9.009 15.202 1.00 45.41 ? 541 GLU A N 1 |
| ATOM 1382 C CA . GLU A 1 180 ? 0.522 8.587 13.814 1.00 50.97 ? 541 GLU A CA 1 |
| ATOM 1383 C C . GLU A 1 180 ? -0.816 7.842 13.664 1.00 56.60 ? 541 GLU A C 1 |
| ATOM 1384 O O . GLU A 1 180 ? -1.022 6.790 14.261 1.00 63.54 ? 541 GLU A O 1 |
| ATOM 1385 C CB . GLU A 1 180 ? 1.601 7.649 13.284 1.00 43.02 ? 541 GLU A CB 1 |
| ATOM 1386 C CG . GLU A 1 180 ? 0.990 6.727 12.252 1.00 48.86 ? 541 GLU A CG 1 |
| ATOM 1387 C CD . GLU A 1 180 ? 1.832 6.422 11.036 1.00 61.38 ? 541 GLU A CD 1 |
| ATOM 1388 O OE1 . GLU A 1 180 ? 3.064 6.557 11.145 1.00 75.65 ? 541 GLU A OE1 1 |
| ATOM 1389 O OE2 . GLU A 1 180 ? 1.252 6.047 9.983 1.00 65.76 ? 541 GLU A OE2 1 |
| ATOM 1390 N N . ILE A 1 181 ? -1.682 8.324 12.761 1.00 55.99 ? 542 ILE A N 1 |
| ATOM 1391 C CA . ILE A 1 181 ? -3.084 7.932 12.748 1.00 45.91 ? 542 ILE A CA 1 |
| ATOM 1392 C C . ILE A 1 181 ? -3.287 6.631 11.987 1.00 38.93 ? 542 ILE A C 1 |
| ATOM 1393 O O . ILE A 1 181 ? -2.838 6.452 10.859 1.00 41.53 ? 542 ILE A O 1 |
| ATOM 1394 C CB . ILE A 1 181 ? -4.011 9.055 12.249 1.00 40.88 ? 542 ILE A CB 1 |
| ATOM 1395 C CG1 . ILE A 1 181 ? -4.007 10.241 13.215 1.00 42.15 ? 542 ILE A CG1 1 |
| ATOM 1396 C CG2 . ILE A 1 181 ? -5.415 8.504 12.059 1.00 42.63 ? 542 ILE A CG2 1 |
| ATOM 1397 C CD1 . ILE A 1 181 ? -4.513 11.553 12.620 1.00 40.14 ? 542 ILE A CD1 1 |
| ATOM 1398 N N . SER A 1 182 ? -4.018 5.750 12.657 1.00 38.10 ? 543 SER A N 1 |
| ATOM 1399 C CA . SER A 1 182 ? -4.288 4.385 12.244 1.00 43.50 ? 543 SER A CA 1 |
| ATOM 1400 C C . SER A 1 182 ? -5.752 4.223 11.784 1.00 40.48 ? 543 SER A C 1 |
| ATOM 1401 O O . SER A 1 182 ? -6.653 4.860 12.326 1.00 35.29 ? 543 SER A O 1 |
| ATOM 1402 C CB . SER A 1 182 ? -3.993 3.526 13.455 1.00 39.28 ? 543 SER A CB 1 |
| ATOM 1403 O OG . SER A 1 182 ? -4.415 2.190 13.251 1.00 49.34 ? 543 SER A OG 1 |
| ATOM 1404 N N . ARG A 1 183 ? -6.011 3.304 10.840 1.00 36.96 ? 544 ARG A N 1 |
| ATOM 1405 C CA . ARG A 1 183 ? -7.384 2.984 10.469 1.00 36.12 ? 544 ARG A CA 1 |
| ATOM 1406 C C . ARG A 1 183 ? -8.204 2.581 11.701 1.00 39.77 ? 544 ARG A C 1 |
| ATOM 1407 O O . ARG A 1 183 ? -9.360 2.984 11.832 1.00 41.06 ? 544 ARG A O 1 |
| ATOM 1408 C CB . ARG A 1 183 ? -7.445 2.098 9.216 1.00 29.65 ? 544 ARG A CB 1 |
| ATOM 1409 C CG . ARG A 1 183 ? -7.152 2.862 7.935 1.00 26.53 ? 544 ARG A CG 1 |
| ATOM 1410 C CD . ARG A 1 183 ? -7.436 2.041 6.691 1.00 27.84 ? 544 ARG A CD 1 |
| ATOM 1411 N NE . ARG A 1 183 ? -6.922 2.730 5.520 1.00 28.77 ? 544 ARG A NE 1 |
| ATOM 1412 C CZ . ARG A 1 183 ? -7.563 3.688 4.854 1.00 28.80 ? 544 ARG A CZ 1 |
| ATOM 1413 N NH1 . ARG A 1 183 ? -8.760 4.103 5.243 1.00 28.00 ? 544 ARG A NH1 1 |
| ATOM 1414 N NH2 . ARG A 1 183 ? -7.024 4.201 3.772 1.00 26.17 ? 544 ARG A NH2 1 |
| ATOM 1415 N N . ASP A 1 184 ? -7.601 1.840 12.642 1.00 39.91 ? 545 ASP A N 1 |
| ATOM 1416 C CA . ASP A 1 184 ? -8.256 1.497 13.902 1.00 41.26 ? 545 ASP A CA 1 |
| ATOM 1417 C C . ASP A 1 184 ? -8.863 2.725 14.577 1.00 37.43 ? 545 ASP A C 1 |
| ATOM 1418 O O . ASP A 1 184 ? -9.840 2.620 15.311 1.00 40.69 ? 545 ASP A O 1 |
| ATOM 1419 C CB . ASP A 1 184 ? -7.297 0.847 14.902 1.00 42.98 ? 545 ASP A CB 1 |
| ATOM 1420 C CG . ASP A 1 184 ? -7.051 -0.624 14.631 1.00 54.10 ? 545 ASP A CG 1 |
| ATOM 1421 O OD1 . ASP A 1 184 ? -7.771 -1.202 13.801 1.00 58.79 ? 545 ASP A OD1 1 |
| ATOM 1422 O OD2 . ASP A 1 184 ? -6.142 -1.180 15.255 1.00 58.99 ? 545 ASP A OD2 1 |
| ATOM 1423 N N . ASN A 1 185 ? -8.297 3.902 14.315 1.00 39.12 ? 546 ASN A N 1 |
| ATOM 1424 C CA . ASN A 1 185 ? -8.639 5.086 15.077 1.00 38.93 ? 546 ASN A CA 1 |
| ATOM 1425 C C . ASN A 1 185 ? -9.642 5.959 14.347 1.00 38.10 ? 546 ASN A C 1 |
| ATOM 1426 O O . ASN A 1 185 ? -9.912 7.065 14.814 1.00 33.10 ? 546 ASN A O 1 |
| ATOM 1427 C CB . ASN A 1 185 ? -7.419 5.985 15.224 1.00 49.70 ? 546 ASN A CB 1 |
| ATOM 1428 C CG . ASN A 1 185 ? -6.395 5.247 16.040 1.00 58.35 ? 546 ASN A CG 1 |
| ATOM 1429 O OD1 . ASN A 1 185 ? -5.310 4.924 15.548 1.00 60.84 ? 546 ASN A OD1 1 |
| ATOM 1430 N ND2 . ASN A 1 185 ? -6.812 4.880 17.242 1.00 59.19 ? 546 ASN A ND2 1 |
| ATOM 1431 N N . ILE A 1 186 ? -10.137 5.502 13.189 1.00 35.41 ? 547 ILE A N 1 |
| ATOM 1432 C CA . ILE A 1 186 ? -11.017 6.410 12.456 1.00 39.10 ? 547 ILE A CA 1 |
| ATOM 1433 C C . ILE A 1 186 ? -12.429 5.829 12.272 1.00 34.92 ? 547 ILE A C 1 |
| ATOM 1434 O O . ILE A 1 186 ? -12.602 4.639 12.015 1.00 33.50 ? 547 ILE A O 1 |
| ATOM 1435 C CB . ILE A 1 186 ? -10.380 6.934 11.148 1.00 35.64 ? 547 ILE A CB 1 |
| ATOM 1436 C CG1 . ILE A 1 186 ? -10.411 5.894 10.034 1.00 36.03 ? 547 ILE A CG1 1 |
| ATOM 1437 C CG2 . ILE A 1 186 ? -8.955 7.424 11.355 1.00 33.73 ? 547 ILE A CG2 1 |
| ATOM 1438 C CD1 . ILE A 1 186 ? -9.628 6.350 8.853 1.00 29.44 ? 547 ILE A CD1 1 |
| ATOM 1439 N N . LEU A 1 187 ? -13.427 6.715 12.368 1.00 33.62 ? 548 LEU A N 1 |
| ATOM 1440 C CA . LEU A 1 187 ? -14.832 6.362 12.254 1.00 31.62 ? 548 LEU A CA 1 |
| ATOM 1441 C C . LEU A 1 187 ? -15.510 7.322 11.275 1.00 30.09 ? 548 LEU A C 1 |
| ATOM 1442 O O . LEU A 1 187 ? -15.413 8.533 11.432 1.00 31.46 ? 548 LEU A O 1 |
| ATOM 1443 C CB . LEU A 1 187 ? -15.466 6.471 13.637 1.00 29.22 ? 548 LEU A CB 1 |
| ATOM 1444 C CG . LEU A 1 187 ? -16.893 5.948 13.707 1.00 34.06 ? 548 LEU A CG 1 |
| ATOM 1445 C CD1 . LEU A 1 187 ? -16.898 4.487 13.294 1.00 36.32 ? 548 LEU A CD1 1 |
| ATOM 1446 C CD2 . LEU A 1 187 ? -17.484 6.139 15.106 1.00 30.29 ? 548 LEU A CD2 1 |
| ATOM 1447 N N . CYS A 1 188 ? -16.189 6.776 10.253 1.00 24.67 ? 549 CYS A N 1 |
| ATOM 1448 C CA . CYS A 1 188 ? -16.950 7.617 9.351 1.00 23.51 ? 549 CYS A CA 1 |
| ATOM 1449 C C . CYS A 1 188 ? -18.435 7.519 9.706 1.00 22.12 ? 549 CYS A C 1 |
| ATOM 1450 O O . CYS A 1 188 ? -19.010 6.433 9.621 1.00 24.38 ? 549 CYS A O 1 |
| ATOM 1451 C CB . CYS A 1 188 ? -16.742 7.182 7.907 1.00 20.04 ? 549 CYS A CB 1 |
| ATOM 1452 S SG . CYS A 1 188 ? -17.674 8.179 6.732 1.00 25.35 ? 549 CYS A SG 1 |
| ATOM 1453 N N . LYS A 1 189 ? -19.031 8.663 10.048 1.00 21.37 ? 550 LYS A N 1 |
| ATOM 1454 C CA . LYS A 1 189 ? -20.471 8.742 10.310 1.00 22.33 ? 550 LYS A CA 1 |
| ATOM 1455 C C . LYS A 1 189 ? -21.203 9.202 9.052 1.00 20.46 ? 550 LYS A C 1 |
| ATOM 1456 O O . LYS A 1 189 ? -20.976 10.318 8.572 1.00 18.55 ? 550 LYS A O 1 |
| ATOM 1457 C CB . LYS A 1 189 ? -20.799 9.780 11.388 1.00 24.37 ? 550 LYS A CB 1 |
| ATOM 1458 C CG . LYS A 1 189 ? -19.884 9.801 12.602 1.00 30.87 ? 550 LYS A CG 1 |
| ATOM 1459 C CD . LYS A 1 189 ? -20.457 9.055 13.747 1.00 38.07 ? 550 LYS A CD 1 |
| ATOM 1460 C CE . LYS A 1 189 ? -21.677 9.743 14.306 1.00 43.83 ? 550 LYS A CE 1 |
| ATOM 1461 N NZ . LYS A 1 189 ? -22.646 8.709 14.739 1.00 45.20 ? 550 LYS A NZ 1 |
| ATOM 1462 N N . ILE A 1 190 ? -22.127 8.353 8.571 1.00 19.48 ? 551 ILE A N 1 |
| ATOM 1463 C CA . ILE A 1 190 ? -22.819 8.587 7.320 1.00 17.29 ? 551 ILE A CA 1 |
| ATOM 1464 C C . ILE A 1 190 ? -24.284 8.880 7.605 1.00 18.92 ? 551 ILE A C 1 |
| ATOM 1465 O O . ILE A 1 190 ? -24.963 8.203 8.410 1.00 16.15 ? 551 ILE A O 1 |
| ATOM 1466 C CB . ILE A 1 190 ? -22.690 7.366 6.403 1.00 17.08 ? 551 ILE A CB 1 |
| ATOM 1467 C CG1 . ILE A 1 190 ? -21.239 6.979 6.135 1.00 17.03 ? 551 ILE A CG1 1 |
| ATOM 1468 C CG2 . ILE A 1 190 ? -23.492 7.518 5.129 1.00 16.53 ? 551 ILE A CG2 1 |
| ATOM 1469 C CD1 . ILE A 1 190 ? -21.148 5.569 5.508 1.00 20.65 ? 551 ILE A CD1 1 |
| ATOM 1470 N N . THR A 1 191 ? -24.749 9.931 6.934 1.00 16.60 ? 552 THR A N 1 |
| ATOM 1471 C CA . THR A 1 191 ? -26.172 10.079 6.762 1.00 16.08 ? 552 THR A CA 1 |
| ATOM 1472 C C . THR A 1 191 ? -26.448 9.948 5.273 1.00 20.58 ? 552 THR A C 1 |
| ATOM 1473 O O . THR A 1 191 ? -25.824 10.661 4.473 1.00 17.69 ? 552 THR A O 1 |
| ATOM 1474 C CB . THR A 1 191 ? -26.618 11.468 7.206 1.00 16.65 ? 552 THR A CB 1 |
| ATOM 1475 O OG1 . THR A 1 191 ? -26.225 11.600 8.560 1.00 19.50 ? 552 THR A OG1 1 |
| ATOM 1476 C CG2 . THR A 1 191 ? -28.114 11.665 7.068 1.00 15.13 ? 552 THR A CG2 1 |
| ATOM 1477 N N . TYR A 1 192 ? -27.365 9.034 4.916 1.00 17.32 ? 553 TYR A N 1 |
| ATOM 1478 C CA . TYR A 1 192 ? -27.697 8.831 3.518 1.00 17.33 ? 553 TYR A CA 1 |
| ATOM 1479 C C . TYR A 1 192 ? -29.198 9.051 3.324 1.00 20.00 ? 553 TYR A C 1 |
| ATOM 1480 O O . TYR A 1 192 ? -30.003 8.503 4.096 1.00 20.90 ? 553 TYR A O 1 |
| ATOM 1481 C CB . TYR A 1 192 ? -27.278 7.408 3.178 1.00 19.59 ? 553 TYR A CB 1 |
| ATOM 1482 C CG . TYR A 1 192 ? -27.732 6.965 1.819 1.00 27.47 ? 553 TYR A CG 1 |
| ATOM 1483 C CD1 . TYR A 1 192 ? -29.016 6.469 1.643 1.00 33.23 ? 553 TYR A CD1 1 |
| ATOM 1484 C CD2 . TYR A 1 192 ? -26.916 7.098 0.704 1.00 25.82 ? 553 TYR A CD2 1 |
| ATOM 1485 C CE1 . TYR A 1 192 ? -29.447 6.067 0.392 1.00 37.51 ? 553 TYR A CE1 1 |
| ATOM 1486 C CE2 . TYR A 1 192 ? -27.328 6.692 -0.559 1.00 26.53 ? 553 TYR A CE2 1 |
| ATOM 1487 C CZ . TYR A 1 192 ? -28.598 6.159 -0.706 1.00 33.43 ? 553 TYR A CZ 1 |
| ATOM 1488 O OH . TYR A 1 192 ? -29.051 5.750 -1.934 1.00 33.74 ? 553 TYR A OH 1 |
| ATOM 1489 N N . VAL A 1 193 ? -29.592 9.898 2.352 1.00 15.28 ? 554 VAL A N 1 |
| ATOM 1490 C CA . VAL A 1 193 ? -31.004 10.209 2.166 1.00 14.91 ? 554 VAL A CA 1 |
| ATOM 1491 C C . VAL A 1 193 ? -31.362 9.962 0.699 1.00 13.21 ? 554 VAL A C 1 |
| ATOM 1492 O O . VAL A 1 193 ? -30.514 10.139 -0.169 1.00 13.08 ? 554 VAL A O 1 |
| ATOM 1493 C CB . VAL A 1 193 ? -31.336 11.646 2.607 1.00 16.08 ? 554 VAL A CB 1 |
| ATOM 1494 C CG1 . VAL A 1 193 ? -31.250 11.790 4.128 1.00 17.44 ? 554 VAL A CG1 1 |
| ATOM 1495 C CG2 . VAL A 1 193 ? -30.421 12.688 1.934 1.00 16.96 ? 554 VAL A CG2 1 |
| ATOM 1496 N N . ALA A 1 194 ? -32.596 9.502 0.426 1.00 13.49 ? 555 ALA A N 1 |
| ATOM 1497 C CA . ALA A 1 194 ? -32.987 9.305 -0.957 1.00 11.70 ? 555 ALA A CA 1 |
| ATOM 1498 C C . ALA A 1 194 ? -34.469 9.619 -1.030 1.00 13.05 ? 555 ALA A C 1 |
| ATOM 1499 O O . ALA A 1 194 ? -35.284 9.065 -0.249 1.00 12.44 ? 555 ALA A O 1 |
| ATOM 1500 C CB . ALA A 1 194 ? -32.699 7.859 -1.313 1.00 11.47 ? 555 ALA A CB 1 |
| ATOM 1501 N N . ASN A 1 195 ? -34.768 10.554 -1.929 1.00 12.38 ? 556 ASN A N 1 |
| ATOM 1502 C CA . ASN A 1 195 ? -36.117 10.923 -2.276 1.00 14.82 ? 556 ASN A CA 1 |
| ATOM 1503 C C . ASN A 1 195 ? -36.281 10.561 -3.743 1.00 17.25 ? 556 ASN A C 1 |
| ATOM 1504 O O . ASN A 1 195 ? -35.706 11.224 -4.599 1.00 17.43 ? 556 ASN A O 1 |
| ATOM 1505 C CB . ASN A 1 195 ? -36.405 12.400 -2.014 1.00 16.24 ? 556 ASN A CB 1 |
| ATOM 1506 C CG . ASN A 1 195 ? -36.480 12.692 -0.519 1.00 21.46 ? 556 ASN A CG 1 |
| ATOM 1507 O OD1 . ASN A 1 195 ? -37.497 13.141 -0.005 1.00 26.53 ? 556 ASN A OD1 1 |
| ATOM 1508 N ND2 . ASN A 1 195 ? -35.427 12.459 0.206 1.00 18.93 ? 556 ASN A ND2 1 |
| ATOM 1509 N N . VAL A 1 196 ? -37.071 9.517 -3.987 1.00 14.71 ? 557 VAL A N 1 |
| ATOM 1510 C CA . VAL A 1 196 ? -37.186 8.939 -5.294 1.00 15.69 ? 557 VAL A CA 1 |
| ATOM 1511 C C . VAL A 1 196 ? -38.643 9.059 -5.686 1.00 16.83 ? 557 VAL A C 1 |
| ATOM 1512 O O . VAL A 1 196 ? -39.557 8.617 -4.970 1.00 16.59 ? 557 VAL A O 1 |
| ATOM 1513 C CB . VAL A 1 196 ? -36.723 7.468 -5.301 1.00 15.21 ? 557 VAL A CB 1 |
| ATOM 1514 C CG1 . VAL A 1 196 ? -36.941 6.870 -6.713 1.00 16.72 ? 557 VAL A CG1 1 |
| ATOM 1515 C CG2 . VAL A 1 196 ? -35.241 7.413 -4.958 1.00 16.45 ? 557 VAL A CG2 1 |
| ATOM 1516 N N . ASN A 1 197 ? -38.838 9.615 -6.881 1.00 15.16 ? 558 ASN A N 1 |
| ATOM 1517 C CA . ASN A 1 197 ? -40.135 9.620 -7.509 1.00 14.72 ? 558 ASN A CA 1 |
| ATOM 1518 C C . ASN A 1 197 ? -40.111 8.604 -8.654 1.00 17.33 ? 558 ASN A C 1 |
| ATOM 1519 O O . ASN A 1 197 ? -39.427 8.806 -9.654 1.00 16.86 ? 558 ASN A O 1 |
| ATOM 1520 C CB . ASN A 1 197 ? -40.468 11.049 -7.952 1.00 16.10 ? 558 ASN A CB 1 |
| ATOM 1521 C CG . ASN A 1 197 ? -41.823 11.120 -8.603 1.00 22.29 ? 558 ASN A CG 1 |
| ATOM 1522 O OD1 . ASN A 1 197 ? -42.269 10.180 -9.239 1.00 22.92 ? 558 ASN A OD1 1 |
| ATOM 1523 N ND2 . ASN A 1 197 ? -42.522 12.215 -8.387 1.00 31.53 ? 558 ASN A ND2 1 |
| ATOM 1524 N N . PRO A 1 198 ? -40.850 7.475 -8.542 1.00 18.84 ? 559 PRO A N 1 |
| ATOM 1525 C CA . PRO A 1 198 ? -40.806 6.403 -9.540 1.00 21.05 ? 559 PRO A CA 1 |
| ATOM 1526 C C . PRO A 1 198 ? -41.347 6.830 -10.911 1.00 20.63 ? 559 PRO A C 1 |
| ATOM 1527 O O . PRO A 1 198 ? -41.111 6.143 -11.903 1.00 18.08 ? 559 PRO A O 1 |
| ATOM 1528 C CB . PRO A 1 198 ? -41.663 5.266 -8.938 1.00 21.89 ? 559 PRO A CB 1 |
| ATOM 1529 C CG . PRO A 1 198 ? -41.776 5.618 -7.462 1.00 23.62 ? 559 PRO A CG 1 |
| ATOM 1530 C CD . PRO A 1 198 ? -41.672 7.130 -7.370 1.00 19.76 ? 559 PRO A CD 1 |
| ATOM 1531 N N . GLY A 1 199 ? -42.065 7.963 -10.951 1.00 23.52 ? 560 GLY A N 1 |
| ATOM 1532 C CA . GLY A 1 199 ? -42.242 8.721 -12.182 1.00 30.16 ? 560 GLY A CA 1 |
| ATOM 1533 C C . GLY A 1 199 ? -43.422 8.233 -13.019 1.00 40.71 ? 560 GLY A C 1 |
| ATOM 1534 O O . GLY A 1 199 ? -43.585 8.598 -14.192 1.00 44.95 ? 560 GLY A O 1 |
| ATOM 1535 N N . GLY A 1 200 ? -44.262 7.416 -12.394 1.00 32.75 ? 561 GLY A N 1 |
| ATOM 1536 C CA . GLY A 1 200 ? -45.453 6.891 -13.019 1.00 31.81 ? 561 GLY A CA 1 |
| ATOM 1537 C C . GLY A 1 200 ? -45.894 5.810 -12.062 1.00 33.40 ? 561 GLY A C 1 |
| ATOM 1538 O O . GLY A 1 200 ? -45.178 5.592 -11.075 1.00 32.55 ? 561 GLY A O 1 |
| ATOM 1539 N N . TRP A 1 201 ? -46.991 5.128 -12.373 1.00 26.19 ? 562 TRP A N 1 |
| ATOM 1540 C CA . TRP A 1 201 ? -47.527 4.112 -11.461 1.00 34.29 ? 562 TRP A CA 1 |
| ATOM 1541 C C . TRP A 1 201 ? -46.602 2.912 -11.228 1.00 29.53 ? 562 TRP A C 1 |
| ATOM 1542 O O . TRP A 1 201 ? -45.931 2.428 -12.130 1.00 30.02 ? 562 TRP A O 1 |
| ATOM 1543 C CB . TRP A 1 201 ? -48.931 3.656 -11.874 1.00 40.74 ? 562 TRP A CB 1 |
| ATOM 1544 C CG . TRP A 1 201 ? -49.542 2.720 -10.869 1.00 51.36 ? 562 TRP A CG 1 |
| ATOM 1545 C CD1 . TRP A 1 201 ? -50.292 3.043 -9.767 1.00 52.47 ? 562 TRP A CD1 1 |
| ATOM 1546 C CD2 . TRP A 1 201 ? -49.417 1.283 -10.870 1.00 52.55 ? 562 TRP A CD2 1 |
| ATOM 1547 N NE1 . TRP A 1 201 ? -50.656 1.904 -9.094 1.00 53.22 ? 562 TRP A NE1 1 |
| ATOM 1548 C CE2 . TRP A 1 201 ? -50.139 0.810 -9.749 1.00 54.07 ? 562 TRP A CE2 1 |
| ATOM 1549 C CE3 . TRP A 1 201 ? -48.761 0.365 -11.703 1.00 50.15 ? 562 TRP A CE3 1 |
| ATOM 1550 C CZ2 . TRP A 1 201 ? -50.225 -0.550 -9.455 1.00 51.33 ? 562 TRP A CZ2 1 |
| ATOM 1551 C CZ3 . TRP A 1 201 ? -48.846 -0.977 -11.405 1.00 49.06 ? 562 TRP A CZ3 1 |
| ATOM 1552 C CH2 . TRP A 1 201 ? -49.565 -1.420 -10.296 1.00 50.13 ? 562 TRP A CH2 1 |
| ATOM 1553 N N . ALA A 1 202 ? -46.523 2.477 -9.966 1.00 26.48 ? 563 ALA A N 1 |
| ATOM 1554 C CA . ALA A 1 202 ? -45.824 1.260 -9.587 1.00 25.99 ? 563 ALA A CA 1 |
| ATOM 1555 C C . ALA A 1 202 ? -46.533 0.749 -8.344 1.00 28.82 ? 563 ALA A C 1 |
| ATOM 1556 O O . ALA A 1 202 ? -47.073 1.552 -7.576 1.00 27.09 ? 563 ALA A O 1 |
| ATOM 1557 C CB . ALA A 1 202 ? -44.381 1.542 -9.284 1.00 29.13 ? 563 ALA A CB 1 |
| ATOM 1558 N N . PRO A 1 203 ? -46.645 -0.576 -8.094 1.00 27.39 ? 564 PRO A N 1 |
| ATOM 1559 C CA . PRO A 1 203 ? -47.441 -1.003 -6.944 1.00 26.87 ? 564 PRO A CA 1 |
| ATOM 1560 C C . PRO A 1 203 ? -46.762 -0.534 -5.661 1.00 24.92 ? 564 PRO A C 1 |
| ATOM 1561 O O . PRO A 1 203 ? -45.565 -0.740 -5.442 1.00 24.83 ? 564 PRO A O 1 |
| ATOM 1562 C CB . PRO A 1 203 ? -47.506 -2.534 -7.066 1.00 31.40 ? 564 PRO A CB 1 |
| ATOM 1563 C CG . PRO A 1 203 ? -47.114 -2.778 -8.533 1.00 33.60 ? 564 PRO A CG 1 |
| ATOM 1564 C CD . PRO A 1 203 ? -46.093 -1.700 -8.867 1.00 31.11 ? 564 PRO A CD 1 |
| ATOM 1565 N N . ALA A 1 204 ? -47.577 0.042 -4.786 1.00 23.07 ? 565 ALA A N 1 |
| ATOM 1566 C CA . ALA A 1 204 ? -47.118 0.534 -3.512 1.00 22.94 ? 565 ALA A CA 1 |
| ATOM 1567 C C . ALA A 1 204 ? -46.384 -0.556 -2.726 1.00 25.37 ? 565 ALA A C 1 |
| ATOM 1568 O O . ALA A 1 204 ? -45.298 -0.302 -2.181 1.00 21.98 ? 565 ALA A O 1 |
| ATOM 1569 C CB . ALA A 1 204 ? -48.307 1.094 -2.775 1.00 24.19 ? 565 ALA A CB 1 |
| ATOM 1570 N N . SER A 1 205 ? -46.959 -1.778 -2.672 1.00 23.70 ? 566 SER A N 1 |
| ATOM 1571 C CA . SER A 1 205 ? -46.405 -2.795 -1.785 1.00 25.63 ? 566 SER A CA 1 |
| ATOM 1572 C C . SER A 1 205 ? -44.990 -3.136 -2.239 1.00 24.32 ? 566 SER A C 1 |
| ATOM 1573 O O . SER A 1 205 ? -44.096 -3.391 -1.410 1.00 24.38 ? 566 SER A O 1 |
| ATOM 1574 C CB . SER A 1 205 ? -47.305 -4.046 -1.692 1.00 25.84 ? 566 SER A CB 1 |
| ATOM 1575 O OG . SER A 1 205 ? -47.415 -4.676 -2.969 1.00 28.89 ? 566 SER A OG 1 |
| ATOM 1576 N N . VAL A 1 206 ? -44.814 -3.139 -3.565 1.00 23.83 ? 567 VAL A N 1 |
| ATOM 1577 C CA . VAL A 1 206 ? -43.535 -3.480 -4.181 1.00 28.20 ? 567 VAL A CA 1 |
| ATOM 1578 C C . VAL A 1 206 ? -42.455 -2.449 -3.834 1.00 27.57 ? 567 VAL A C 1 |
| ATOM 1579 O O . VAL A 1 206 ? -41.384 -2.809 -3.337 1.00 28.10 ? 567 VAL A O 1 |
| ATOM 1580 C CB . VAL A 1 206 ? -43.727 -3.700 -5.690 1.00 30.35 ? 567 VAL A CB 1 |
| ATOM 1581 C CG1 . VAL A 1 206 ? -42.420 -3.936 -6.454 1.00 35.81 ? 567 VAL A CG1 1 |
| ATOM 1582 C CG2 . VAL A 1 206 ? -44.706 -4.852 -5.912 1.00 31.59 ? 567 VAL A CG2 1 |
| ATOM 1583 N N . LEU A 1 207 ? -42.764 -1.158 -4.063 1.00 28.07 ? 568 LEU A N 1 |
| ATOM 1584 C CA . LEU A 1 207 ? -41.827 -0.096 -3.740 1.00 24.30 ? 568 LEU A CA 1 |
| ATOM 1585 C C . LEU A 1 207 ? -41.414 -0.194 -2.281 1.00 22.55 ? 568 LEU A C 1 |
| ATOM 1586 O O . LEU A 1 207 ? -40.257 -0.017 -1.980 1.00 22.54 ? 568 LEU A O 1 |
| ATOM 1587 C CB . LEU A 1 207 ? -42.471 1.257 -4.033 1.00 24.01 ? 568 LEU A CB 1 |
| ATOM 1588 C CG . LEU A 1 207 ? -42.463 1.578 -5.513 1.00 28.14 ? 568 LEU A CG 1 |
| ATOM 1589 C CD1 . LEU A 1 207 ? -43.468 2.657 -5.853 1.00 26.44 ? 568 LEU A CD1 1 |
| ATOM 1590 C CD2 . LEU A 1 207 ? -41.057 1.980 -5.918 1.00 29.80 ? 568 LEU A CD2 1 |
| ATOM 1591 N N . ARG A 1 208 ? -42.350 -0.471 -1.374 1.00 19.68 ? 569 ARG A N 1 |
| ATOM 1592 C CA . ARG A 1 208 ? -42.039 -0.418 0.044 1.00 21.96 ? 569 ARG A CA 1 |
| ATOM 1593 C C . ARG A 1 208 ? -41.213 -1.623 0.457 1.00 22.89 ? 569 ARG A C 1 |
| ATOM 1594 O O . ARG A 1 208 ? -40.267 -1.475 1.218 1.00 24.93 ? 569 ARG A O 1 |
| ATOM 1595 C CB . ARG A 1 208 ? -43.301 -0.245 0.894 1.00 24.39 ? 569 ARG A CB 1 |
| ATOM 1596 C CG . ARG A 1 208 ? -44.057 1.007 0.495 1.00 26.25 ? 569 ARG A CG 1 |
| ATOM 1597 C CD . ARG A 1 208 ? -45.012 1.569 1.506 1.00 26.50 ? 569 ARG A CD 1 |
| ATOM 1598 N NE . ARG A 1 208 ? -45.232 3.010 1.276 1.00 24.11 ? 569 ARG A NE 1 |
| ATOM 1599 C CZ . ARG A 1 208 ? -46.419 3.570 1.106 1.00 23.70 ? 569 ARG A CZ 1 |
| ATOM 1600 N NH1 . ARG A 1 208 ? -47.493 2.815 0.873 1.00 20.35 ? 569 ARG A NH1 1 |
| ATOM 1601 N NH2 . ARG A 1 208 ? -46.525 4.883 1.168 1.00 22.02 ? 569 ARG A NH2 1 |
| ATOM 1602 N N . ALA A 1 209 ? -41.515 -2.798 -0.093 1.00 24.90 ? 570 ALA A N 1 |
| ATOM 1603 C CA . ALA A 1 209 ? -40.739 -3.978 0.266 1.00 24.02 ? 570 ALA A CA 1 |
| ATOM 1604 C C . ALA A 1 209 ? -39.300 -3.845 -0.252 1.00 26.30 ? 570 ALA A C 1 |
| ATOM 1605 O O . ALA A 1 209 ? -38.347 -4.129 0.472 1.00 26.05 ? 570 ALA A O 1 |
| ATOM 1606 C CB . ALA A 1 209 ? -41.422 -5.176 -0.343 1.00 24.27 ? 570 ALA A CB 1 |
| ATOM 1607 N N . VAL A 1 210 ? -39.164 -3.379 -1.504 1.00 26.33 ? 571 VAL A N 1 |
| ATOM 1608 C CA . VAL A 1 210 ? -37.875 -3.141 -2.117 1.00 26.71 ? 571 VAL A CA 1 |
| ATOM 1609 C C . VAL A 1 210 ? -37.076 -2.195 -1.229 1.00 28.27 ? 571 VAL A C 1 |
| ATOM 1610 O O . VAL A 1 210 ? -35.945 -2.505 -0.837 1.00 29.05 ? 571 VAL A O 1 |
| ATOM 1611 C CB . VAL A 1 210 ? -38.037 -2.603 -3.551 1.00 27.86 ? 571 VAL A CB 1 |
| ATOM 1612 C CG1 . VAL A 1 210 ? -36.753 -1.966 -4.084 1.00 33.25 ? 571 VAL A CG1 1 |
| ATOM 1613 C CG2 . VAL A 1 210 ? -38.542 -3.665 -4.498 1.00 29.57 ? 571 VAL A CG2 1 |
| ATOM 1614 N N . ALA A 1 211 ? -37.641 -1.015 -0.947 1.00 24.99 ? 572 ALA A N 1 |
| ATOM 1615 C CA . ALA A 1 211 ? -36.940 -0.093 -0.082 1.00 23.06 ? 572 ALA A CA 1 |
| ATOM 1616 C C . ALA A 1 211 ? -36.515 -0.812 1.196 1.00 25.04 ? 572 ALA A C 1 |
| ATOM 1617 O O . ALA A 1 211 ? -35.352 -0.792 1.577 1.00 26.35 ? 572 ALA A O 1 |
| ATOM 1618 C CB . ALA A 1 211 ? -37.809 1.099 0.228 1.00 20.36 ? 572 ALA A CB 1 |
| ATOM 1619 N N . LYS A 1 212 ? -37.473 -1.409 1.911 1.00 23.93 ? 573 LYS A N 1 |
| ATOM 1620 C CA . LYS A 1 212 ? -37.169 -1.947 3.228 1.00 25.04 ? 573 LYS A CA 1 |
| ATOM 1621 C C . LYS A 1 212 ? -36.099 -3.050 3.159 1.00 28.69 ? 573 LYS A C 1 |
| ATOM 1622 O O . LYS A 1 212 ? -35.298 -3.181 4.078 1.00 25.84 ? 573 LYS A O 1 |
| ATOM 1623 C CB . LYS A 1 212 ? -38.457 -2.414 3.916 1.00 26.57 ? 573 LYS A CB 1 |
| ATOM 1624 C CG . LYS A 1 212 ? -38.311 -3.443 5.020 1.00 31.06 ? 573 LYS A CG 1 |
| ATOM 1625 C CD . LYS A 1 212 ? -39.646 -3.698 5.672 1.00 36.97 ? 573 LYS A CD 1 |
| ATOM 1626 C CE . LYS A 1 212 ? -39.508 -4.099 7.124 1.00 42.12 ? 573 LYS A CE 1 |
| ATOM 1627 N NZ . LYS A 1 212 ? -40.768 -4.702 7.620 1.00 39.68 ? 573 LYS A NZ 1 |
| ATOM 1628 N N . ARG A 1 213 ? -36.079 -3.840 2.083 1.00 25.77 ? 574 ARG A N 1 |
| ATOM 1629 C CA . ARG A 1 213 ? -35.102 -4.920 1.996 1.00 34.89 ? 574 ARG A CA 1 |
| ATOM 1630 C C . ARG A 1 213 ? -33.765 -4.456 1.400 1.00 29.67 ? 574 ARG A C 1 |
| ATOM 1631 O O . ARG A 1 213 ? -32.703 -4.845 1.885 1.00 30.23 ? 574 ARG A O 1 |
| ATOM 1632 C CB . ARG A 1 213 ? -35.668 -6.079 1.170 1.00 35.79 ? 574 ARG A CB 1 |
| ATOM 1633 C CG . ARG A 1 213 ? -34.607 -7.046 0.668 1.00 42.42 ? 574 ARG A CG 1 |
| ATOM 1634 C CD . ARG A 1 213 ? -35.169 -8.009 -0.365 1.00 45.67 ? 574 ARG A CD 1 |
| ATOM 1635 N NE . ARG A 1 213 ? -35.223 -7.485 -1.737 1.00 45.73 ? 574 ARG A NE 1 |
| ATOM 1636 C CZ . ARG A 1 213 ? -36.331 -7.268 -2.463 1.00 48.51 ? 574 ARG A CZ 1 |
| ATOM 1637 N NH1 . ARG A 1 213 ? -37.526 -7.263 -1.889 1.00 49.49 ? 574 ARG A NH1 1 |
| ATOM 1638 N NH2 . ARG A 1 213 ? -36.238 -7.061 -3.766 1.00 45.52 ? 574 ARG A NH2 1 |
| ATOM 1639 N N . GLU A 1 214 ? -33.821 -3.654 0.334 1.00 28.68 ? 575 GLU A N 1 |
| ATOM 1640 C CA . GLU A 1 214 ? -32.682 -3.381 -0.510 1.00 26.71 ? 575 GLU A CA 1 |
| ATOM 1641 C C . GLU A 1 214 ? -31.850 -2.197 -0.030 1.00 26.34 ? 575 GLU A C 1 |
| ATOM 1642 O O . GLU A 1 214 ? -30.669 -2.137 -0.338 1.00 27.42 ? 575 GLU A O 1 |
| ATOM 1643 C CB . GLU A 1 214 ? -33.149 -3.123 -1.930 1.00 34.89 ? 575 GLU A CB 1 |
| ATOM 1644 C CG . GLU A 1 214 ? -33.676 -4.384 -2.578 1.00 44.78 ? 575 GLU A CG 1 |
| ATOM 1645 C CD . GLU A 1 214 ? -32.606 -5.460 -2.694 1.00 58.74 ? 575 GLU A CD 1 |
| ATOM 1646 O OE1 . GLU A 1 214 ? -31.478 -5.138 -3.146 1.00 55.74 ? 575 GLU A OE1 1 |
| ATOM 1647 O OE2 . GLU A 1 214 ? -32.885 -6.612 -2.310 1.00 62.87 ? 575 GLU A OE2 1 |
| ATOM 1648 N N . TYR A 1 215 ? -32.418 -1.240 0.696 1.00 23.45 ? 576 TYR A N 1 |
| ATOM 1649 C CA . TYR A 1 215 ? -31.578 -0.120 1.113 1.00 23.57 ? 576 TYR A CA 1 |
| ATOM 1650 C C . TYR A 1 215 ? -30.547 -0.558 2.145 1.00 22.86 ? 576 TYR A C 1 |
| ATOM 1651 O O . TYR A 1 215 ? -29.367 -0.194 2.018 1.00 22.11 ? 576 TYR A O 1 |
| ATOM 1652 C CB . TYR A 1 215 ? -32.323 1.039 1.770 1.00 28.27 ? 576 TYR A CB 1 |
| ATOM 1653 C CG . TYR A 1 215 ? -32.721 2.086 0.772 1.00 40.08 ? 576 TYR A CG 1 |
| ATOM 1654 C CD1 . TYR A 1 215 ? -31.832 3.028 0.275 1.00 42.26 ? 576 TYR A CD1 1 |
| ATOM 1655 C CD2 . TYR A 1 215 ? -34.008 2.064 0.255 1.00 49.68 ? 576 TYR A CD2 1 |
| ATOM 1656 C CE1 . TYR A 1 215 ? -32.243 3.937 -0.695 1.00 51.71 ? 576 TYR A CE1 1 |
| ATOM 1657 C CE2 . TYR A 1 215 ? -34.433 2.963 -0.710 1.00 54.90 ? 576 TYR A CE2 1 |
| ATOM 1658 C CZ . TYR A 1 215 ? -33.546 3.903 -1.202 1.00 58.21 ? 576 TYR A CZ 1 |
| ATOM 1659 O OH . TYR A 1 215 ? -34.063 4.759 -2.154 1.00 49.45 ? 576 TYR A OH 1 |
| ATOM 1660 N N . PRO A 1 216 ? -30.938 -1.321 3.189 1.00 21.44 ? 577 PRO A N 1 |
| ATOM 1661 C CA . PRO A 1 216 ? -29.968 -1.788 4.174 1.00 23.95 ? 577 PRO A CA 1 |
| ATOM 1662 C C . PRO A 1 216 ? -28.887 -2.633 3.492 1.00 23.52 ? 577 PRO A C 1 |
| ATOM 1663 O O . PRO A 1 216 ? -27.728 -2.520 3.831 1.00 28.55 ? 577 PRO A O 1 |
| ATOM 1664 C CB . PRO A 1 216 ? -30.797 -2.551 5.235 1.00 22.31 ? 577 PRO A CB 1 |
| ATOM 1665 C CG . PRO A 1 216 ? -32.236 -2.117 4.979 1.00 20.53 ? 577 PRO A CG 1 |
| ATOM 1666 C CD . PRO A 1 216 ? -32.317 -1.759 3.504 1.00 21.88 ? 577 PRO A CD 1 |
| ATOM 1667 N N . LYS A 1 217 ? -29.245 -3.403 2.477 1.00 24.46 ? 578 LYS A N 1 |
| ATOM 1668 C CA . LYS A 1 217 ? -28.274 -4.269 1.839 1.00 27.76 ? 578 LYS A CA 1 |
| ATOM 1669 C C . LYS A 1 217 ? -27.346 -3.414 1.005 1.00 29.23 ? 578 LYS A C 1 |
| ATOM 1670 O O . LYS A 1 217 ? -26.143 -3.664 0.909 1.00 27.28 ? 578 LYS A O 1 |
| ATOM 1671 C CB . LYS A 1 217 ? -28.943 -5.214 0.831 1.00 32.40 ? 578 LYS A CB 1 |
| ATOM 1672 C CG . LYS A 1 217 ? -29.486 -6.489 1.460 1.00 45.07 ? 578 LYS A CG 1 |
| ATOM 1673 C CD . LYS A 1 217 ? -30.333 -7.389 0.550 1.00 44.06 ? 578 LYS A CD 1 |
| ATOM 1674 C CE . LYS A 1 217 ? -30.950 -8.541 1.338 1.00 56.68 ? 578 LYS A CE 1 |
| ATOM 1675 N NZ . LYS A 1 217 ? -31.861 -9.421 0.552 1.00 49.23 ? 578 LYS A NZ 1 |
| ATOM 1676 N N . PHE A 1 218 ? -27.943 -2.473 0.286 1.00 27.60 ? 579 PHE A N 1 |
| ATOM 1677 C CA . PHE A 1 218 ? -27.127 -1.640 -0.575 1.00 30.81 ? 579 PHE A CA 1 |
| ATOM 1678 C C . PHE A 1 218 ? -26.074 -0.924 0.273 1.00 32.93 ? 579 PHE A C 1 |
| ATOM 1679 O O . PHE A 1 218 ? -24.892 -0.881 -0.076 1.00 28.82 ? 579 PHE A O 1 |
| ATOM 1680 C CB . PHE A 1 218 ? -28.006 -0.664 -1.348 1.00 34.86 ? 579 PHE A CB 1 |
| ATOM 1681 C CG . PHE A 1 218 ? -27.320 0.632 -1.684 1.00 48.97 ? 579 PHE A CG 1 |
| ATOM 1682 C CD1 . PHE A 1 218 ? -27.080 1.584 -0.698 1.00 53.31 ? 579 PHE A CD1 1 |
| ATOM 1683 C CD2 . PHE A 1 218 ? -26.943 0.905 -2.992 1.00 61.29 ? 579 PHE A CD2 1 |
| ATOM 1684 C CE1 . PHE A 1 218 ? -26.446 2.779 -1.004 1.00 59.92 ? 579 PHE A CE1 1 |
| ATOM 1685 C CE2 . PHE A 1 218 ? -26.332 2.110 -3.305 1.00 67.72 ? 579 PHE A CE2 1 |
| ATOM 1686 C CZ . PHE A 1 218 ? -26.076 3.033 -2.309 1.00 67.74 ? 579 PHE A CZ 1 |
| ATOM 1687 N N . LEU A 1 219 ? -26.512 -0.389 1.415 1.00 31.28 ? 580 LEU A N 1 |
| ATOM 1688 C CA . LEU A 1 219 ? -25.631 0.388 2.260 1.00 33.05 ? 580 LEU A CA 1 |
| ATOM 1689 C C . LEU A 1 219 ? -24.601 -0.499 2.974 1.00 38.96 ? 580 LEU A C 1 |
| ATOM 1690 O O . LEU A 1 219 ? -23.424 -0.147 3.056 1.00 39.99 ? 580 LEU A O 1 |
| ATOM 1691 C CB . LEU A 1 219 ? -26.487 1.144 3.270 1.00 34.16 ? 580 LEU A CB 1 |
| ATOM 1692 C CG . LEU A 1 219 ? -25.833 2.358 3.924 1.00 39.55 ? 580 LEU A CG 1 |
| ATOM 1693 C CD1 . LEU A 1 219 ? -25.212 3.277 2.879 1.00 46.59 ? 580 LEU A CD1 1 |
| ATOM 1694 C CD2 . LEU A 1 219 ? -26.870 3.132 4.710 1.00 39.02 ? 580 LEU A CD2 1 |
| ATOM 1695 N N . LYS A 1 220 ? -25.017 -1.618 3.563 1.00 33.02 ? 581 LYS A N 1 |
| ATOM 1696 C CA . LYS A 1 220 ? -23.982 -2.428 4.174 1.00 32.96 ? 581 LYS A CA 1 |
| ATOM 1697 C C . LYS A 1 220 ? -23.010 -2.919 3.107 1.00 30.63 ? 581 LYS A C 1 |
| ATOM 1698 O O . LYS A 1 220 ? -21.810 -2.985 3.336 1.00 32.18 ? 581 LYS A O 1 |
| ATOM 1699 C CB . LYS A 1 220 ? -24.562 -3.541 5.040 1.00 40.75 ? 581 LYS A CB 1 |
| ATOM 1700 C CG . LYS A 1 220 ? -23.597 -4.672 5.358 1.00 51.46 ? 581 LYS A CG 1 |
| ATOM 1701 C CD . LYS A 1 220 ? -24.393 -5.905 5.705 1.00 59.86 ? 581 LYS A CD 1 |
| ATOM 1702 C CE . LYS A 1 220 ? -25.794 -5.517 6.135 1.00 64.17 ? 581 LYS A CE 1 |
| ATOM 1703 N NZ . LYS A 1 220 ? -26.825 -6.133 5.262 1.00 66.06 ? 581 LYS A NZ 1 |
| ATOM 1704 N N . ARG A 1 221 ? -23.514 -3.272 1.933 1.00 28.32 ? 582 ARG A N 1 |
| ATOM 1705 C CA . ARG A 1 221 ? -22.638 -3.780 0.899 1.00 28.88 ? 582 ARG A CA 1 |
| ATOM 1706 C C . ARG A 1 221 ? -21.640 -2.717 0.423 1.00 35.23 ? 582 ARG A C 1 |
| ATOM 1707 O O . ARG A 1 221 ? -20.432 -2.960 0.353 1.00 28.85 ? 582 ARG A O 1 |
| ATOM 1708 C CB . ARG A 1 221 ? -23.476 -4.253 -0.282 1.00 37.82 ? 582 ARG A CB 1 |
| ATOM 1709 C CG . ARG A 1 221 ? -22.637 -4.901 -1.368 1.00 43.51 ? 582 ARG A CG 1 |
| ATOM 1710 C CD . ARG A 1 221 ? -23.474 -5.180 -2.589 1.00 59.68 ? 582 ARG A CD 1 |
| ATOM 1711 N NE . ARG A 1 221 ? -22.614 -5.154 -3.761 1.00 73.34 ? 582 ARG A NE 1 |
| ATOM 1712 C CZ . ARG A 1 221 ? -22.096 -6.240 -4.329 1.00 80.74 ? 582 ARG A CZ 1 |
| ATOM 1713 N NH1 . ARG A 1 221 ? -21.409 -6.139 -5.456 1.00 82.25 ? 582 ARG A NH1 1 |
| ATOM 1714 N NH2 . ARG A 1 221 ? -22.289 -7.426 -3.776 1.00 72.64 ? 582 ARG A NH2 1 |
| ATOM 1715 N N . PHE A 1 222 ? -22.166 -1.570 -0.026 1.00 29.52 ? 583 PHE A N 1 |
| ATOM 1716 C CA . PHE A 1 222 ? -21.332 -0.428 -0.388 1.00 28.97 ? 583 PHE A CA 1 |
| ATOM 1717 C C . PHE A 1 222 ? -20.273 -0.114 0.689 1.00 26.19 ? 583 PHE A C 1 |
| ATOM 1718 O O . PHE A 1 222 ? -19.099 -0.024 0.372 1.00 26.34 ? 583 PHE A O 1 |
| ATOM 1719 C CB . PHE A 1 222 ? -22.164 0.809 -0.742 1.00 26.07 ? 583 PHE A CB 1 |
| ATOM 1720 C CG . PHE A 1 222 ? -21.276 2.006 -1.001 1.00 27.36 ? 583 PHE A CG 1 |
| ATOM 1721 C CD1 . PHE A 1 222 ? -20.458 2.033 -2.120 1.00 24.71 ? 583 PHE A CD1 1 |
| ATOM 1722 C CD2 . PHE A 1 222 ? -21.204 3.058 -0.095 1.00 24.90 ? 583 PHE A CD2 1 |
| ATOM 1723 C CE1 . PHE A 1 222 ? -19.615 3.116 -2.357 1.00 25.98 ? 583 PHE A CE1 1 |
| ATOM 1724 C CE2 . PHE A 1 222 ? -20.364 4.142 -0.342 1.00 27.24 ? 583 PHE A CE2 1 |
| ATOM 1725 C CZ . PHE A 1 222 ? -19.560 4.153 -1.463 1.00 22.63 ? 583 PHE A CZ 1 |
| ATOM 1726 N N . THR A 1 223 ? -20.636 -0.002 1.967 1.00 23.08 ? 584 THR A N 1 |
| ATOM 1727 C CA . THR A 1 223 ? -19.639 0.456 2.919 1.00 28.41 ? 584 THR A CA 1 |
| ATOM 1728 C C . THR A 1 223 ? -18.587 -0.626 3.170 1.00 33.06 ? 584 THR A C 1 |
| ATOM 1729 O O . THR A 1 223 ? -17.454 -0.298 3.531 1.00 29.38 ? 584 THR A O 1 |
| ATOM 1730 C CB . THR A 1 223 ? -20.257 0.975 4.225 1.00 26.55 ? 584 THR A CB 1 |
| ATOM 1731 O OG1 . THR A 1 223 ? -21.026 -0.061 4.815 1.00 25.10 ? 584 THR A OG1 1 |
| ATOM 1732 C CG2 . THR A 1 223 ? -21.159 2.164 4.020 1.00 25.54 ? 584 THR A CG2 1 |
| ATOM 1733 N N . SER A 1 224 ? -18.975 -1.902 2.998 1.00 33.13 ? 585 SER A N 1 |
| ATOM 1734 C CA . SER A 1 224 ? -18.077 -3.030 3.209 1.00 31.59 ? 585 SER A CA 1 |
| ATOM 1735 C C . SER A 1 224 ? -17.054 -3.027 2.091 1.00 31.99 ? 585 SER A C 1 |
| ATOM 1736 O O . SER A 1 224 ? -15.872 -3.285 2.319 1.00 32.01 ? 585 SER A O 1 |
| ATOM 1737 C CB . SER A 1 224 ? -18.804 -4.345 3.165 1.00 32.38 ? 585 SER A CB 1 |
| ATOM 1738 O OG . SER A 1 224 ? -19.355 -4.614 4.424 1.00 30.17 ? 585 SER A OG 1 |
| ATOM 1739 N N . TYR A 1 225 ? -17.541 -2.731 0.886 1.00 26.12 ? 586 TYR A N 1 |
| ATOM 1740 C CA . TYR A 1 225 ? -16.624 -2.546 -0.224 1.00 30.56 ? 586 TYR A CA 1 |
| ATOM 1741 C C . TYR A 1 225 ? -15.642 -1.401 0.024 1.00 30.85 ? 586 TYR A C 1 |
| ATOM 1742 O O . TYR A 1 225 ? -14.488 -1.502 -0.384 1.00 28.59 ? 586 TYR A O 1 |
| ATOM 1743 C CB . TYR A 1 225 ? -17.397 -2.372 -1.525 1.00 29.28 ? 586 TYR A CB 1 |
| ATOM 1744 C CG . TYR A 1 225 ? -16.627 -1.796 -2.688 1.00 31.28 ? 586 TYR A CG 1 |
| ATOM 1745 C CD1 . TYR A 1 225 ? -15.973 -2.604 -3.608 1.00 30.71 ? 586 TYR A CD1 1 |
| ATOM 1746 C CD2 . TYR A 1 225 ? -16.656 -0.436 -2.932 1.00 31.61 ? 586 TYR A CD2 1 |
| ATOM 1747 C CE1 . TYR A 1 225 ? -15.313 -2.071 -4.709 1.00 36.97 ? 586 TYR A CE1 1 |
| ATOM 1748 C CE2 . TYR A 1 225 ? -15.989 0.117 -4.010 1.00 40.61 ? 586 TYR A CE2 1 |
| ATOM 1749 C CZ . TYR A 1 225 ? -15.314 -0.698 -4.904 1.00 42.13 ? 586 TYR A CZ 1 |
| ATOM 1750 O OH . TYR A 1 225 ? -14.666 -0.106 -5.951 1.00 43.37 ? 586 TYR A OH 1 |
| ATOM 1751 N N . VAL A 1 226 ? -16.072 -0.310 0.677 1.00 28.23 ? 587 VAL A N 1 |
| ATOM 1752 C CA . VAL A 1 226 ? -15.135 0.790 0.858 1.00 29.06 ? 587 VAL A CA 1 |
| ATOM 1753 C C . VAL A 1 226 ? -14.036 0.342 1.841 1.00 26.55 ? 587 VAL A C 1 |
| ATOM 1754 O O . VAL A 1 226 ? -12.841 0.544 1.614 1.00 28.70 ? 587 VAL A O 1 |
| ATOM 1755 C CB . VAL A 1 226 ? -15.853 2.119 1.221 1.00 26.78 ? 587 VAL A CB 1 |
| ATOM 1756 C CG1 . VAL A 1 226 ? -14.887 3.243 1.629 1.00 28.08 ? 587 VAL A CG1 1 |
| ATOM 1757 C CG2 . VAL A 1 226 ? -16.719 2.605 0.060 1.00 24.59 ? 587 VAL A CG2 1 |
| ATOM 1758 N N . GLN A 1 227 ? -14.440 -0.324 2.914 1.00 28.27 ? 588 GLN A N 1 |
| ATOM 1759 C CA . GLN A 1 227 ? -13.504 -0.783 3.918 1.00 30.44 ? 588 GLN A CA 1 |
| ATOM 1760 C C . GLN A 1 227 ? -12.481 -1.712 3.264 1.00 38.35 ? 588 GLN A C 1 |
| ATOM 1761 O O . GLN A 1 227 ? -11.297 -1.705 3.628 1.00 35.84 ? 588 GLN A O 1 |
| ATOM 1762 C CB . GLN A 1 227 ? -14.240 -1.551 5.001 1.00 28.11 ? 588 GLN A CB 1 |
| ATOM 1763 C CG . GLN A 1 227 ? -14.863 -0.665 6.061 1.00 31.13 ? 588 GLN A CG 1 |
| ATOM 1764 C CD . GLN A 1 227 ? -15.792 -1.462 6.942 1.00 34.37 ? 588 GLN A CD 1 |
| ATOM 1765 O OE1 . GLN A 1 227 ? -16.522 -2.324 6.470 1.00 35.42 ? 588 GLN A OE1 1 |
| ATOM 1766 N NE2 . GLN A 1 227 ? -15.783 -1.174 8.237 1.00 34.96 ? 588 GLN A NE2 1 |
| ATOM 1767 N N . GLU A 1 228 ? -12.958 -2.524 2.314 1.00 34.58 ? 589 GLU A N 1 |
| ATOM 1768 C CA . GLU A 1 228 ? -12.118 -3.523 1.695 1.00 33.21 ? 589 GLU A CA 1 |
| ATOM 1769 C C . GLU A 1 228 ? -11.138 -2.845 0.739 1.00 37.54 ? 589 GLU A C 1 |
| ATOM 1770 O O . GLU A 1 228 ? -9.944 -3.076 0.853 1.00 41.17 ? 589 GLU A O 1 |
| ATOM 1771 C CB . GLU A 1 228 ? -12.988 -4.583 1.043 1.00 40.16 ? 589 GLU A CB 1 |
| ATOM 1772 C CG . GLU A 1 228 ? -12.211 -5.803 0.633 1.00 51.04 ? 589 GLU A CG 1 |
| ATOM 1773 C CD . GLU A 1 228 ? -12.456 -6.192 -0.814 1.00 60.03 ? 589 GLU A CD 1 |
| ATOM 1774 O OE1 . GLU A 1 228 ? -13.629 -6.143 -1.250 1.00 58.70 ? 589 GLU A OE1 1 |
| ATOM 1775 O OE2 . GLU A 1 228 ? -11.470 -6.530 -1.506 1.00 66.28 ? 589 GLU A OE2 1 |
| ATOM 1776 N N . LYS A 1 229 ? -11.618 -1.971 -0.159 1.00 33.72 ? 590 LYS A N 1 |
| ATOM 1777 C CA . LYS A 1 229 ? -10.736 -1.309 -1.114 1.00 35.76 ? 590 LYS A CA 1 |
| ATOM 1778 C C . LYS A 1 229 ? -9.639 -0.470 -0.436 1.00 36.34 ? 590 LYS A C 1 |
| ATOM 1779 O O . LYS A 1 229 ? -8.607 -0.204 -1.040 1.00 31.78 ? 590 LYS A O 1 |
| ATOM 1780 C CB . LYS A 1 229 ? -11.481 -0.408 -2.101 1.00 34.24 ? 590 LYS A CB 1 |
| ATOM 1781 C CG . LYS A 1 229 ? -12.085 -1.103 -3.313 1.00 41.52 ? 590 LYS A CG 1 |
| ATOM 1782 C CD . LYS A 1 229 ? -11.106 -2.003 -4.057 1.00 45.02 ? 590 LYS A CD 1 |
| ATOM 1783 C CE . LYS A 1 229 ? -11.632 -3.412 -4.207 1.00 43.97 ? 590 LYS A CE 1 |
| ATOM 1784 N NZ . LYS A 1 229 ? -11.305 -3.955 -5.547 1.00 47.20 ? 590 LYS A NZ 1 |
| ATOM 1785 N N . THR A 1 230 ? -9.874 -0.013 0.791 1.00 32.83 ? 591 THR A N 1 |
| ATOM 1786 C CA . THR A 1 230 ? -9.026 1.011 1.367 1.00 32.52 ? 591 THR A CA 1 |
| ATOM 1787 C C . THR A 1 230 ? -8.071 0.412 2.397 1.00 31.81 ? 591 THR A C 1 |
| ATOM 1788 O O . THR A 1 230 ? -7.104 1.075 2.787 1.00 28.73 ? 591 THR A O 1 |
| ATOM 1789 C CB . THR A 1 230 ? -9.836 2.144 2.024 1.00 30.03 ? 591 THR A CB 1 |
| ATOM 1790 O OG1 . THR A 1 230 ? -10.731 1.639 3.021 1.00 29.66 ? 591 THR A OG1 1 |
| ATOM 1791 C CG2 . THR A 1 230 ? -10.593 2.989 1.023 1.00 31.10 ? 591 THR A CG2 1 |
| ATOM 1792 N N . ALA A 1 231 ? -8.363 -0.813 2.859 1.00 34.99 ? 592 ALA A N 1 |
| ATOM 1793 C CA . ALA A 1 231 ? -7.624 -1.360 3.988 1.00 39.74 ? 592 ALA A CA 1 |
| ATOM 1794 C C . ALA A 1 231 ? -6.171 -1.503 3.538 1.00 45.03 ? 592 ALA A C 1 |
| ATOM 1795 O O . ALA A 1 231 ? -5.925 -1.806 2.364 1.00 41.23 ? 592 ALA A O 1 |
| ATOM 1796 C CB . ALA A 1 231 ? -8.232 -2.651 4.512 1.00 36.26 ? 592 ALA A CB 1 |
| ATOM 1797 N N . GLY A 1 232 ? -5.242 -1.139 4.443 1.00 47.90 ? 593 GLY A N 1 |
| ATOM 1798 C CA . GLY A 1 232 ? -3.811 -1.097 4.173 1.00 50.49 ? 593 GLY A CA 1 |
| ATOM 1799 C C . GLY A 1 232 ? -3.466 -0.229 2.963 1.00 56.60 ? 593 GLY A C 1 |
| ATOM 1800 O O . GLY A 1 232 ? -2.614 -0.582 2.150 1.00 60.11 ? 593 GLY A O 1 |
| ATOM 1801 N N . LYS A 1 233 ? -4.141 0.911 2.821 1.00 47.66 ? 594 LYS A N 1 |
| ATOM 1802 C CA . LYS A 1 233 ? -3.681 1.861 1.825 1.00 43.39 ? 594 LYS A CA 1 |
| ATOM 1803 C C . LYS A 1 233 ? -3.615 3.216 2.543 1.00 47.96 ? 594 LYS A C 1 |
| ATOM 1804 O O . LYS A 1 233 ? -4.343 3.396 3.513 1.00 44.12 ? 594 LYS A O 1 |
| ATOM 1805 C CB . LYS A 1 233 ? -4.420 1.621 0.494 1.00 36.08 ? 594 LYS A CB 1 |
| ATOM 1806 C CG . LYS A 1 233 ? -5.437 2.653 0.052 1.00 28.72 ? 594 LYS A CG 1 |
| ATOM 1807 N N . PRO A 1 234 ? -2.674 4.156 2.238 1.00 47.59 ? 595 PRO A N 1 |
| ATOM 1808 C CA . PRO A 1 234 ? -2.629 5.441 2.945 1.00 45.70 ? 595 PRO A CA 1 |
| ATOM 1809 C C . PRO A 1 234 ? -4.015 6.073 3.137 1.00 36.72 ? 595 PRO A C 1 |
| ATOM 1810 O O . PRO A 1 234 ? -4.824 6.080 2.202 1.00 30.53 ? 595 PRO A O 1 |
| ATOM 1811 C CB . PRO A 1 234 ? -1.738 6.351 2.071 1.00 44.48 ? 595 PRO A CB 1 |
| ATOM 1812 C CG . PRO A 1 234 ? -1.253 5.480 0.909 1.00 48.10 ? 595 PRO A CG 1 |
| ATOM 1813 C CD . PRO A 1 234 ? -1.589 4.041 1.252 1.00 50.07 ? 595 PRO A CD 1 |
| ATOM 1814 N N . ILE A 1 235 ? -4.256 6.625 4.337 1.00 30.87 ? 596 ILE A N 1 |
| ATOM 1815 C CA . ILE A 1 235 ? -5.526 7.249 4.668 1.00 31.15 ? 596 ILE A CA 1 |
| ATOM 1816 C C . ILE A 1 235 ? -5.670 8.566 3.911 1.00 34.44 ? 596 ILE A C 1 |
| ATOM 1817 O O . ILE A 1 235 ? -4.870 9.491 4.054 1.00 30.08 ? 596 ILE A O 1 |
| ATOM 1818 C CB . ILE A 1 235 ? -5.696 7.446 6.184 1.00 31.83 ? 596 ILE A CB 1 |
| ATOM 1819 C CG1 . ILE A 1 235 ? -5.562 6.122 6.936 1.00 30.04 ? 596 ILE A CG1 1 |
| ATOM 1820 C CG2 . ILE A 1 235 ? -7.026 8.126 6.465 1.00 34.05 ? 596 ILE A CG2 1 |
| ATOM 1821 C CD1 . ILE A 1 235 ? -5.541 6.287 8.432 1.00 28.39 ? 596 ILE A CD1 1 |
| ATOM 1822 N N . LEU A 1 236 ? -6.714 8.631 3.084 1.00 28.75 ? 597 LEU A N 1 |
| ATOM 1823 C CA . LEU A 1 236 ? -6.998 9.866 2.380 1.00 30.60 ? 597 LEU A CA 1 |
| ATOM 1824 C C . LEU A 1 236 ? -8.037 10.630 3.203 1.00 31.42 ? 597 LEU A C 1 |
| ATOM 1825 O O . LEU A 1 236 ? -9.237 10.377 3.080 1.00 21.66 ? 597 LEU A O 1 |
| ATOM 1826 C CB . LEU A 1 236 ? -7.494 9.510 0.975 1.00 28.09 ? 597 LEU A CB 1 |
| ATOM 1827 C CG . LEU A 1 236 ? -8.010 10.683 0.154 1.00 32.78 ? 597 LEU A CG 1 |
| ATOM 1828 C CD1 . LEU A 1 236 ? -6.880 11.635 -0.180 1.00 35.68 ? 597 LEU A CD1 1 |
| ATOM 1829 C CD2 . LEU A 1 236 ? -8.650 10.194 -1.137 1.00 35.82 ? 597 LEU A CD2 1 |
| ATOM 1830 N N . PHE A 1 237 ? -7.575 11.558 4.052 1.00 26.62 ? 598 PHE A N 1 |
| ATOM 1831 C CA . PHE A 1 237 ? -8.503 12.396 4.791 1.00 27.88 ? 598 PHE A CA 1 |
| ATOM 1832 C C . PHE A 1 237 ? -9.138 13.452 3.882 1.00 27.78 ? 598 PHE A C 1 |
| ATOM 1833 O O . PHE A 1 237 ? -8.729 13.664 2.713 1.00 26.18 ? 598 PHE A O 1 |
| ATOM 1834 C CB . PHE A 1 237 ? -7.826 13.090 5.971 1.00 29.31 ? 598 PHE A CB 1 |
| ATOM 1835 C CG . PHE A 1 237 ? -7.365 12.134 7.032 1.00 27.20 ? 598 PHE A CG 1 |
| ATOM 1836 C CD1 . PHE A 1 237 ? -6.116 11.563 6.948 1.00 28.27 ? 598 PHE A CD1 1 |
| ATOM 1837 C CD2 . PHE A 1 237 ? -8.195 11.789 8.085 1.00 31.11 ? 598 PHE A CD2 1 |
| ATOM 1838 C CE1 . PHE A 1 237 ? -5.681 10.708 7.942 1.00 27.68 ? 598 PHE A CE1 1 |
| ATOM 1839 C CE2 . PHE A 1 237 ? -7.769 10.904 9.066 1.00 27.59 ? 598 PHE A CE2 1 |
| ATOM 1840 C CZ . PHE A 1 237 ? -6.514 10.364 8.974 1.00 28.08 ? 598 PHE A CZ 1 |
| ATOM 1841 O OXT . PHE A 1 237 ? -10.121 14.102 4.325 1.00 26.80 ? 598 PHE A OXT 1 |
| HETATM 1842 C C5 . 9N0 B 2 . ? -33.917 3.714 -7.507 1.00 40.01 ? 600 9N0 A C5 1 |
| HETATM 1843 C C4 . 9N0 B 2 . ? -35.228 3.231 -7.697 1.00 43.02 ? 600 9N0 A C4 1 |
| HETATM 1844 C C3 . 9N0 B 2 . ? -36.054 2.950 -6.572 1.00 44.25 ? 600 9N0 A C3 1 |
| HETATM 1845 C C6 . 9N0 B 2 . ? -33.352 3.887 -6.210 1.00 37.74 ? 600 9N0 A C6 1 |
| HETATM 1846 C C11 . 9N0 B 2 . ? -31.592 5.477 -6.924 1.00 35.76 ? 600 9N0 A C11 1 |
| HETATM 1847 C C10 . 9N0 B 2 . ? -31.982 4.395 -6.073 1.00 35.08 ? 600 9N0 A C10 1 |
| HETATM 1848 C C1 . 9N0 B 2 . ? -34.179 3.586 -5.058 1.00 43.26 ? 600 9N0 A C1 1 |
| HETATM 1849 C C8 . 9N0 B 2 . ? -29.762 4.342 -5.016 1.00 32.97 ? 600 9N0 A C8 1 |
| HETATM 1850 C C12 . 9N0 B 2 . ? -30.277 6.005 -6.836 1.00 30.50 ? 600 9N0 A C12 1 |
| HETATM 1851 O O1 . 9N0 B 2 . ? -27.604 5.944 -4.228 1.00 27.05 ? 600 9N0 A O1 1 |
| HETATM 1852 S S1 . 9N0 B 2 . ? -27.742 6.158 -5.741 1.00 44.95 ? 600 9N0 A S1 1 |
| HETATM 1853 O O2 . 9N0 B 2 . ? -27.881 7.590 -6.372 1.00 26.65 ? 600 9N0 A O2 1 |
| HETATM 1854 C C20 . 9N0 B 2 . ? -26.395 5.186 -6.561 1.00 39.99 ? 600 9N0 A C20 1 |
| HETATM 1855 C C21 . 9N0 B 2 . ? -26.394 5.352 -8.089 1.00 45.48 ? 600 9N0 A C21 1 |
| HETATM 1856 O O3 . 9N0 B 2 . ? -27.580 4.739 -8.577 1.00 43.32 ? 600 9N0 A O3 1 |
| HETATM 1857 C C7 . 9N0 B 2 . ? -29.391 5.416 -5.889 1.00 39.40 ? 600 9N0 A C7 1 |
| HETATM 1858 C C9 . 9N0 B 2 . ? -31.057 3.825 -5.150 1.00 34.96 ? 600 9N0 A C9 1 |
| HETATM 1859 C C23 . 9N0 B 2 . ? -35.539 3.114 -5.241 1.00 44.26 ? 600 9N0 A C23 1 |
| HETATM 1860 C C24 . 9N0 B 2 . ? -36.406 2.793 -4.004 1.00 48.93 ? 600 9N0 A C24 1 |
| HETATM 1861 C C27 . 9N0 B 2 . ? -36.855 4.064 -3.225 1.00 42.11 ? 600 9N0 A C27 1 |
| HETATM 1862 C C26 . 9N0 B 2 . ? -37.654 1.938 -4.371 1.00 50.18 ? 600 9N0 A C26 1 |
| HETATM 1863 C C25 . 9N0 B 2 . ? -35.481 1.931 -3.152 1.00 47.59 ? 600 9N0 A C25 1 |
| HETATM 1864 C C13 . 9N0 B 2 . ? -35.672 3.125 -9.103 1.00 43.74 ? 600 9N0 A C13 1 |
| HETATM 1865 C C22 . 9N0 B 2 . ? -36.991 3.843 -9.264 1.00 42.98 ? 600 9N0 A C22 1 |
| HETATM 1866 C C14 . 9N0 B 2 . ? -36.808 2.440 -9.820 1.00 58.14 ? 600 9N0 A C14 1 |
| HETATM 1867 C C18 . 9N0 B 2 . ? -37.724 1.270 -9.502 1.00 66.13 ? 600 9N0 A C18 1 |
| HETATM 1868 N N1 . 9N0 B 2 . ? -37.188 0.196 -8.898 1.00 67.09 ? 600 9N0 A N1 1 |
| HETATM 1869 C C19 . 9N0 B 2 . ? -38.020 -0.841 -8.639 1.00 73.95 ? 600 9N0 A C19 1 |
| HETATM 1870 C C15 . 9N0 B 2 . ? -39.384 -0.902 -8.985 1.00 71.31 ? 600 9N0 A C15 1 |
| HETATM 1871 C C16 . 9N0 B 2 . ? -39.937 0.199 -9.637 1.00 65.78 ? 600 9N0 A C16 1 |
| HETATM 1872 C C17 . 9N0 B 2 . ? -39.083 1.285 -9.891 1.00 70.54 ? 600 9N0 A C17 1 |
| HETATM 1873 O O . HOH C 3 . ? -45.156 14.959 -3.759 1.00 36.73 ? 701 HOH A O 1 |
| HETATM 1874 O O . HOH C 3 . ? -35.087 -0.404 -8.708 1.00 41.63 ? 702 HOH A O 1 |
| HETATM 1875 O O . HOH C 3 . ? -26.715 25.133 4.264 1.00 38.19 ? 703 HOH A O 1 |
| HETATM 1876 O O . HOH C 3 . ? -26.937 4.511 12.952 1.00 31.88 ? 704 HOH A O 1 |
| HETATM 1877 O O . HOH C 3 . ? -28.197 2.979 -19.913 1.00 55.11 ? 705 HOH A O 1 |
| HETATM 1878 O O . HOH C 3 . ? -26.004 -3.274 -11.272 1.00 30.39 ? 706 HOH A O 1 |
| HETATM 1879 O O . HOH C 3 . ? -38.063 9.895 17.162 1.00 64.73 ? 707 HOH A O 1 |
| HETATM 1880 O O . HOH C 3 . ? -31.240 18.989 -1.634 1.00 23.67 ? 708 HOH A O 1 |
| HETATM 1881 O O . HOH C 3 . ? -25.131 4.189 -10.958 1.00 31.19 ? 709 HOH A O 1 |
| HETATM 1882 O O . HOH C 3 . ? -33.440 20.503 -2.173 1.00 30.61 ? 710 HOH A O 1 |
| HETATM 1883 O O . HOH C 3 . ? -29.572 -3.172 -2.349 1.00 32.16 ? 711 HOH A O 1 |
| HETATM 1884 O O . HOH C 3 . ? -34.564 -0.619 -22.840 1.00 52.12 ? 712 HOH A O 1 |
| HETATM 1885 O O . HOH C 3 . ? -21.360 2.080 -18.546 1.00 38.32 ? 713 HOH A O 1 |
| HETATM 1886 O O . HOH C 3 . ? -15.014 15.244 9.156 1.00 29.27 ? 714 HOH A O 1 |
| HETATM 1887 O O . HOH C 3 . ? -10.444 0.303 5.161 1.00 35.85 ? 715 HOH A O 1 |
| HETATM 1888 O O . HOH C 3 . ? -18.970 4.952 -8.091 1.00 27.32 ? 716 HOH A O 1 |
| HETATM 1889 O O . HOH C 3 . ? -30.306 7.969 13.532 1.00 23.32 ? 717 HOH A O 1 |
| HETATM 1890 O O . HOH C 3 . ? -40.870 2.891 2.046 1.00 25.78 ? 718 HOH A O 1 |
| HETATM 1891 O O . HOH C 3 . ? -46.720 2.486 4.658 1.00 34.32 ? 719 HOH A O 1 |
| HETATM 1892 O O . HOH C 3 . ? -21.571 9.763 -9.876 1.00 29.79 ? 720 HOH A O 1 |
| HETATM 1893 O O . HOH C 3 . ? -11.079 16.359 3.496 1.00 29.49 ? 721 HOH A O 1 |
| HETATM 1894 O O . HOH C 3 . ? -39.663 11.326 -2.326 1.00 28.51 ? 722 HOH A O 1 |
| HETATM 1895 O O . HOH C 3 . ? -17.849 23.740 -0.159 1.00 33.30 ? 723 HOH A O 1 |
| HETATM 1896 O O . HOH C 3 . ? -46.849 11.150 -8.295 1.00 43.95 ? 724 HOH A O 1 |
| HETATM 1897 O O . HOH C 3 . ? -22.229 24.507 -18.298 1.00 41.62 ? 725 HOH A O 1 |
| HETATM 1898 O O . HOH C 3 . ? -41.270 8.308 -18.144 1.00 29.53 ? 726 HOH A O 1 |
| HETATM 1899 O O . HOH C 3 . ? -30.885 -1.559 -19.311 1.00 41.78 ? 727 HOH A O 1 |
| HETATM 1900 O O . HOH C 3 . ? -11.964 13.998 -3.943 1.00 30.99 ? 728 HOH A O 1 |
| HETATM 1901 O O . HOH C 3 . ? -39.040 -2.257 -12.327 1.00 29.39 ? 729 HOH A O 1 |
| HETATM 1902 O O . HOH C 3 . ? -15.272 -5.426 3.792 1.00 39.58 ? 730 HOH A O 1 |
| HETATM 1903 O O . HOH C 3 . ? -28.564 19.874 -19.399 1.00 43.18 ? 731 HOH A O 1 |
| HETATM 1904 O O . HOH C 3 . ? -24.692 -2.323 -3.594 1.00 39.67 ? 732 HOH A O 1 |
| HETATM 1905 O O . HOH C 3 . ? -34.192 11.605 -13.684 1.00 14.78 ? 733 HOH A O 1 |
| HETATM 1906 O O . HOH C 3 . ? -13.552 14.680 6.719 1.00 32.38 ? 734 HOH A O 1 |
| HETATM 1907 O O . HOH C 3 . ? -33.013 13.435 -0.415 1.00 21.10 ? 735 HOH A O 1 |
| HETATM 1908 O O . HOH C 3 . ? -19.299 -5.181 -0.665 1.00 41.53 ? 736 HOH A O 1 |
| HETATM 1909 O O . HOH C 3 . ? -23.452 12.552 -24.180 1.00 27.25 ? 737 HOH A O 1 |
| HETATM 1910 O O . HOH C 3 . ? -6.121 10.018 20.108 1.00 41.55 ? 738 HOH A O 1 |
| HETATM 1911 O O . HOH C 3 . ? -12.145 13.735 14.720 1.00 41.70 ? 739 HOH A O 1 |
| HETATM 1912 O O . HOH C 3 . ? -34.941 11.531 2.824 1.00 18.03 ? 740 HOH A O 1 |
| HETATM 1913 O O . HOH C 3 . ? -21.760 24.852 -6.852 1.00 30.09 ? 741 HOH A O 1 |
| HETATM 1914 O O . HOH C 3 . ? -33.910 15.504 -20.165 1.00 37.35 ? 742 HOH A O 1 |
| HETATM 1915 O O . HOH C 3 . ? -33.728 6.453 16.220 1.00 30.56 ? 743 HOH A O 1 |
| HETATM 1916 O O . HOH C 3 . ? -28.939 19.116 8.904 1.00 39.71 ? 744 HOH A O 1 |
| HETATM 1917 O O . HOH C 3 . ? -44.651 -3.943 1.224 1.00 27.19 ? 745 HOH A O 1 |
| HETATM 1918 O O . HOH C 3 . ? -15.913 13.377 6.373 1.00 26.75 ? 746 HOH A O 1 |
| HETATM 1919 O O . HOH C 3 . ? -3.921 2.513 6.091 1.00 41.32 ? 747 HOH A O 1 |
| HETATM 1920 O O . HOH C 3 . ? -40.510 2.538 -0.968 1.00 26.63 ? 748 HOH A O 1 |
| HETATM 1921 O O . HOH C 3 . ? -33.912 14.954 6.906 1.00 45.62 ? 749 HOH A O 1 |
| HETATM 1922 O O . HOH C 3 . ? -37.847 8.023 -1.791 1.00 24.86 ? 750 HOH A O 1 |
| HETATM 1923 O O . HOH C 3 . ? -40.462 4.477 14.405 1.00 25.80 ? 751 HOH A O 1 |
| HETATM 1924 O O . HOH C 3 . ? -19.025 16.472 -21.525 1.00 28.18 ? 752 HOH A O 1 |
| HETATM 1925 O O . HOH C 3 . ? -6.294 14.938 2.257 1.00 34.45 ? 753 HOH A O 1 |
| HETATM 1926 O O . HOH C 3 . ? -22.938 12.296 8.657 1.00 28.38 ? 754 HOH A O 1 |
| HETATM 1927 O O . HOH C 3 . ? -36.529 -0.535 -12.565 1.00 25.47 ? 755 HOH A O 1 |
| HETATM 1928 O O . HOH C 3 . ? -42.797 -7.942 -6.440 1.00 32.27 ? 756 HOH A O 1 |
| HETATM 1929 O O . HOH C 3 . ? -27.426 26.580 -11.543 1.00 34.60 ? 757 HOH A O 1 |
| HETATM 1930 O O . HOH C 3 . ? -37.099 7.387 -23.009 1.00 26.75 ? 758 HOH A O 1 |
| HETATM 1931 O O . HOH C 3 . ? -23.326 7.745 -6.776 1.00 19.84 ? 759 HOH A O 1 |
| HETATM 1932 O O . HOH C 3 . ? -29.003 23.437 -18.460 1.00 38.86 ? 760 HOH A O 1 |
| HETATM 1933 O O . HOH C 3 . ? -37.241 13.307 -5.710 1.00 30.98 ? 761 HOH A O 1 |
| HETATM 1934 O O . HOH C 3 . ? -47.273 3.465 -5.517 1.00 23.77 ? 762 HOH A O 1 |
| HETATM 1935 O O . HOH C 3 . ? -40.176 -2.187 -18.615 1.00 29.93 ? 763 HOH A O 1 |
| HETATM 1936 O O . HOH C 3 . ? -32.612 20.553 -15.323 1.00 28.33 ? 764 HOH A O 1 |
| HETATM 1937 O O . HOH C 3 . ? -2.230 10.200 3.329 1.00 30.30 ? 765 HOH A O 1 |
| HETATM 1938 O O . HOH C 3 . ? -18.915 20.634 7.547 1.00 25.43 ? 766 HOH A O 1 |
| HETATM 1939 O O . HOH C 3 . ? -37.698 6.874 -20.099 1.00 31.50 ? 767 HOH A O 1 |
| HETATM 1940 O O . HOH C 3 . ? -27.671 28.590 -4.702 1.00 44.93 ? 768 HOH A O 1 |
| HETATM 1941 O O . HOH C 3 . ? -44.802 -0.017 -13.082 1.00 25.22 ? 769 HOH A O 1 |
| HETATM 1942 O O . HOH C 3 . ? -34.401 13.768 -15.217 1.00 22.02 ? 770 HOH A O 1 |
| HETATM 1943 O O . HOH C 3 . ? -28.848 19.878 -22.394 1.00 35.47 ? 771 HOH A O 1 |
| HETATM 1944 O O . HOH C 3 . ? -30.926 10.889 12.695 1.00 35.10 ? 772 HOH A O 1 |
| HETATM 1945 O O . HOH C 3 . ? -24.084 8.514 11.393 1.00 40.25 ? 773 HOH A O 1 |
| HETATM 1946 O O . HOH C 3 . ? -40.575 0.533 3.310 1.00 26.32 ? 774 HOH A O 1 |
| HETATM 1947 O O . HOH C 3 . ? -41.507 13.951 -6.263 1.00 32.32 ? 775 HOH A O 1 |
| HETATM 1948 O O . HOH C 3 . ? -41.483 -6.273 -14.333 1.00 46.24 ? 776 HOH A O 1 |
| HETATM 1949 O O . HOH C 3 . ? -39.632 5.204 -1.529 1.00 25.09 ? 777 HOH A O 1 |
| HETATM 1950 O O . HOH C 3 . ? -51.583 10.454 -2.860 1.00 36.69 ? 778 HOH A O 1 |
| HETATM 1951 O O . HOH C 3 . ? -14.952 18.504 -4.769 1.00 28.79 ? 779 HOH A O 1 |
| HETATM 1952 O O . HOH C 3 . ? -12.546 12.696 5.423 1.00 22.24 ? 780 HOH A O 1 |
| HETATM 1953 O O . HOH C 3 . ? -40.393 5.921 -3.884 1.00 25.96 ? 781 HOH A O 1 |
| HETATM 1954 O O . HOH C 3 . ? -13.747 16.966 11.090 1.00 35.96 ? 782 HOH A O 1 |
| HETATM 1955 O O . HOH C 3 . ? -13.289 21.680 -12.805 1.00 39.22 ? 783 HOH A O 1 |
| HETATM 1956 O O . HOH C 3 . ? -10.590 7.477 -2.343 1.00 44.88 ? 784 HOH A O 1 |
| HETATM 1957 O O . HOH C 3 . ? -12.998 2.806 14.471 1.00 46.76 ? 785 HOH A O 1 |
| HETATM 1958 O O . HOH C 3 . ? -35.513 11.136 -22.685 1.00 39.44 ? 786 HOH A O 1 |
| HETATM 1959 O O . HOH C 3 . ? -8.938 11.925 -3.702 1.00 38.55 ? 787 HOH A O 1 |
| HETATM 1960 O O . HOH C 3 . ? -33.084 -0.684 -21.021 1.00 41.05 ? 788 HOH A O 1 |
| HETATM 1961 O O . HOH C 3 . ? -36.227 2.439 -27.109 1.00 32.50 ? 789 HOH A O 1 |
| HETATM 1962 O O . HOH C 3 . ? -44.987 -10.112 -15.909 1.00 42.55 ? 790 HOH A O 1 |
| HETATM 1963 O O . HOH C 3 . ? -17.140 10.243 -11.676 1.00 29.77 ? 791 HOH A O 1 |
| HETATM 1964 O O . HOH C 3 . ? -0.358 2.449 3.653 1.00 54.96 ? 792 HOH A O 1 |
| HETATM 1965 O O . HOH C 3 . ? -39.832 6.621 -23.981 1.00 42.63 ? 793 HOH A O 1 |
| HETATM 1966 O O . HOH C 3 . ? -42.672 -3.635 2.785 1.00 37.85 ? 794 HOH A O 1 |
| HETATM 1967 O O . HOH C 3 . ? -29.138 25.182 -15.350 1.00 37.66 ? 795 HOH A O 1 |
| HETATM 1968 O O . HOH C 3 . ? -32.629 19.758 -21.649 1.00 42.49 ? 796 HOH A O 1 |
| HETATM 1969 O O . HOH C 3 . ? -48.048 -0.444 0.699 1.00 33.68 ? 797 HOH A O 1 |
| HETATM 1970 O O . HOH C 3 . ? -12.955 7.414 16.089 1.00 41.75 ? 798 HOH A O 1 |
| HETATM 1971 O O . HOH C 3 . ? -35.664 15.967 -14.341 1.00 48.42 ? 799 HOH A O 1 |
| HETATM 1972 O O . HOH C 3 . ? -33.726 16.030 0.256 1.00 34.97 ? 800 HOH A O 1 |
| HETATM 1973 O O . HOH C 3 . ? -50.107 -1.551 -0.798 1.00 29.37 ? 801 HOH A O 1 |
| HETATM 1974 O O . HOH C 3 . ? -39.606 12.569 -4.609 1.00 32.96 ? 802 HOH A O 1 |
| HETATM 1975 O O . HOH C 3 . ? -36.970 15.606 -3.455 1.00 32.73 ? 803 HOH A O 1 |
| HETATM 1976 O O . HOH C 3 . ? -34.971 13.600 4.153 1.00 27.25 ? 804 HOH A O 1 |
| HETATM 1977 O O . HOH C 3 . ? -45.589 -1.034 4.144 1.00 42.09 ? 805 HOH A O 1 |
| HETATM 1978 O O . HOH C 3 . ? -42.599 -6.878 -3.851 1.00 41.07 ? 806 HOH A O 1 |
| HETATM 1979 O O . HOH C 3 . ? -46.536 -2.213 1.973 1.00 37.25 ? 807 HOH A O 1 |
| HETATM 1980 O O . HOH C 3 . ? -6.277 13.079 -3.133 1.00 50.15 ? 808 HOH A O 1 |
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