data_ma-t3vr3-776 _entry.id ma-t3vr3-776 _entry.ma_collection_id ma-t3vr3 _struct.entry_id ma-t3vr3-776 _struct.pdbx_model_details ;Predicted interaction between Histone deacetylase 1 (residue 1 - 392) and CREB-binding protein (residue 2347 - 2442). Model generated using AlphaFold2 with a 200 residue separation between the chains starting from a paired Multiple Sequence Alignment(pMSA). ; _struct.pdbx_structure_determination_methodology computational _struct.title 'Predicted interaction between HDAC1 (1-392) and CREBBP (2347-2442)' _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/ba728c4/archive/mmcif_ma-v1.4.5.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Computed cancer interactome explains the effects of somatic mutations in cancers.' 'Protein Sci' 31 e4479 . 2022 36261849 10.1002/pro.4479 2 'Highly accurate protein structure prediction with AlphaFold.' Nature 596 583 589 2021 34265844 10.1038/s41586-021-03819-2 loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Zhang, J.' 1 primary 'Pei, J.' 2 primary 'Durham, J.' 3 primary 'Bos, T.' 4 primary 'Cong, Q.' 5 2 'Jumper, J.' 6 2 'Evans, R.' 7 2 'Pritzel, A.' 8 2 'Green, T.' 9 2 'Figurnov, M.' 10 2 'Ronneberger, O.' 11 2 'Tunyasuvunakool, K.' 12 2 'Bates, R.' 13 2 'Zidek, A.' 14 2 'Potapenko, A.' 15 2 'Bridgland, A.' 16 2 'Meyer, C.' 17 2 'Kohl, S.A.A.' 18 2 'Ballard, A.J.' 19 2 'Cowie, A.' 20 2 'Romera-Paredes, B.' 21 2 'Nikolov, S.' 22 2 'Jain, R.' 23 2 'Adler, J.' 24 2 'Back, T.' 25 2 'Petersen, S.' 26 2 'Reiman, D.' 27 2 'Clancy, E.' 28 2 'Zielinski, M.' 29 2 'Steinegger, M.' 30 2 'Pacholska, M.' 31 2 'Berghammer, T.' 32 2 'Bodenstein, S.' 33 2 'Silver, D.' 34 2 'Vinyals, O.' 35 2 'Senior, A.W.' 36 2 'Kavukcuoglu, K.' 37 2 'Kohli, P.' 38 2 'Hassabis, D.' 39 loop_ _software.pdbx_ordinal _software.name _software.classification _software.description _software.version _software.type _software.location _software.citation_id 1 AlphaFold 'model building' 'Structure prediction' 2.0.0 package https://github.com/deepmind/alphafold 2 loop_ _ma_software_group.ordinal_id _ma_software_group.group_id _ma_software_group.software_id _ma_software_group.parameter_group_id 1 1 1 . loop_ _audit_author.name _audit_author.pdbx_ordinal 'Zhang, J.' 1 'Pei, J.' 2 'Durham, J.' 3 'Bos, T.' 4 'Cong, Q.' 5 loop_ _chem_comp.id _chem_comp.type _chem_comp.name _chem_comp.formula _chem_comp.formula_weight _chem_comp.ma_provenance ALA 'L-peptide linking' ALANINE 'C3 H7 N O2' 89.094 'CCD Core' ARG 'L-peptide linking' ARGININE 'C6 H15 N4 O2 1' 175.212 'CCD Core' ASN 'L-peptide linking' ASPARAGINE 'C4 H8 N2 O3' 132.119 'CCD Core' ASP 'L-peptide linking' 'ASPARTIC ACID' 'C4 H7 N O4' 133.103 'CCD Core' CYS 'L-peptide linking' CYSTEINE 'C3 H7 N O2 S' 121.154 'CCD Core' GLN 'L-peptide linking' GLUTAMINE 'C5 H10 N2 O3' 146.146 'CCD Core' GLU 'L-peptide linking' 'GLUTAMIC ACID' 'C5 H9 N O4' 147.130 'CCD Core' GLY 'peptide linking' GLYCINE 'C2 H5 N O2' 75.067 'CCD Core' HIS 'L-peptide linking' HISTIDINE 'C6 H10 N3 O2 1' 156.165 'CCD Core' ILE 'L-peptide linking' ISOLEUCINE 'C6 H13 N O2' 131.175 'CCD Core' LEU 'L-peptide linking' LEUCINE 'C6 H13 N O2' 131.175 'CCD Core' LYS 'L-peptide linking' LYSINE 'C6 H15 N2 O2 1' 147.198 'CCD Core' MET 'L-peptide linking' METHIONINE 'C5 H11 N O2 S' 149.208 'CCD Core' PHE 'L-peptide linking' PHENYLALANINE 'C9 H11 N O2' 165.192 'CCD Core' PRO 'L-peptide linking' PROLINE 'C5 H9 N O2' 115.132 'CCD Core' SER 'L-peptide linking' SERINE 'C3 H7 N O3' 105.093 'CCD Core' THR 'L-peptide linking' THREONINE 'C4 H9 N O3' 119.120 'CCD Core' TRP 'L-peptide linking' TRYPTOPHAN 'C11 H12 N2 O2' 204.229 'CCD Core' TYR 'L-peptide linking' TYROSINE 'C9 H11 N O3' 181.191 'CCD Core' VAL 'L-peptide linking' VALINE 'C5 H11 N O2' 117.148 'CCD Core' loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.details 1 polymer nat 'Homo sapiens (Human) HDAC1 (Q13547; 1 - 392)' 51954.343 1 . 2 polymer nat 'Homo sapiens (Human) CREBBP (Q92793; 2347 - 2442)' 11722.572 1 . loop_ _entity_src_nat.entity_id _entity_src_nat.pdbx_src_id _entity_src_nat.pdbx_ncbi_taxonomy_id _entity_src_nat.pdbx_organism_scientific _entity_src_nat.common_name _entity_src_nat.strain 1 1 9606 'Homo sapiens (Human)' . . 2 2 9606 'Homo sapiens (Human)' . . loop_ _ma_target_ref_db_details.target_entity_id _ma_target_ref_db_details.db_name _ma_target_ref_db_details.db_name_other_details _ma_target_ref_db_details.db_code _ma_target_ref_db_details.db_accession _ma_target_ref_db_details.seq_db_isoform _ma_target_ref_db_details.seq_db_align_begin _ma_target_ref_db_details.seq_db_align_end _ma_target_ref_db_details.ncbi_taxonomy_id _ma_target_ref_db_details.organism_scientific _ma_target_ref_db_details.seq_db_sequence_version_date _ma_target_ref_db_details.seq_db_sequence_checksum 1 UNP . HDAC1_HUMAN Q13547 . 1 392 9606 'Homo sapiens (Human)' 1997-11-01 4D35B7C1ED7838D6 2 UNP . CBP_HUMAN Q92793 . 2347 2442 9606 'Homo sapiens (Human)' 2006-10-17 3BEA9B8558BA1A5E loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_strand_id _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can 1 polypeptide(L) no no A ;MAQTQGTRRKVCYYYDGDVGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKANAEEMTKYHSD DYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVASAVKLNKQQTDIAVNWAGGLH HAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGD LRDIGAGKGKYYAVNYPLRDGIDDESYEAIFKPVMSKVMEMFQPSAVVLQCGSDSLSGDRLGCFNLTIKG HAKCVEFVKSFNLPMLMLGGGGYTIRNVARCWTYETAVALDTEIPNELPYNDYFEYFGPDFKLHISPSNM TNQNTNEYLEKIKQRLFENLRMLPHAPGVQMQAIPEDAIPEE ; ;MAQTQGTRRKVCYYYDGDVGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKANAEEMTKYHSD DYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVASAVKLNKQQTDIAVNWAGGLH HAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGD LRDIGAGKGKYYAVNYPLRDGIDDESYEAIFKPVMSKVMEMFQPSAVVLQCGSDSLSGDRLGCFNLTIKG HAKCVEFVKSFNLPMLMLGGGGYTIRNVARCWTYETAVALDTEIPNELPYNDYFEYFGPDFKLHISPSNM TNQNTNEYLEKIKQRLFENLRMLPHAPGVQMQAIPEDAIPEE ; 2 polypeptide(L) no no B ;APVQSPRPQSQPPHSSPSPRIQPQPSPHHVSPQTGSPHPGLAVTMASSIDQGHLGNPEQSAMLPQLNTPS RSALSSELSLVGDTTGDTLEKFVEGL ; ;APVQSPRPQSQPPHSSPSPRIQPQPSPHHVSPQTGSPHPGLAVTMASSIDQGHLGNPEQSAMLPQLNTPS RSALSSELSLVGDTTGDTLEKFVEGL ; loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 MET . 1 2 ALA . 1 3 GLN . 1 4 THR . 1 5 GLN . 1 6 GLY . 1 7 THR . 1 8 ARG . 1 9 ARG . 1 10 LYS . 1 11 VAL . 1 12 CYS . 1 13 TYR . 1 14 TYR . 1 15 TYR . 1 16 ASP . 1 17 GLY . 1 18 ASP . 1 19 VAL . 1 20 GLY . 1 21 ASN . 1 22 TYR . 1 23 TYR . 1 24 TYR . 1 25 GLY . 1 26 GLN . 1 27 GLY . 1 28 HIS . 1 29 PRO . 1 30 MET . 1 31 LYS . 1 32 PRO . 1 33 HIS . 1 34 ARG . 1 35 ILE . 1 36 ARG . 1 37 MET . 1 38 THR . 1 39 HIS . 1 40 ASN . 1 41 LEU . 1 42 LEU . 1 43 LEU . 1 44 ASN . 1 45 TYR . 1 46 GLY . 1 47 LEU . 1 48 TYR . 1 49 ARG . 1 50 LYS . 1 51 MET . 1 52 GLU . 1 53 ILE . 1 54 TYR . 1 55 ARG . 1 56 PRO . 1 57 HIS . 1 58 LYS . 1 59 ALA . 1 60 ASN . 1 61 ALA . 1 62 GLU . 1 63 GLU . 1 64 MET . 1 65 THR . 1 66 LYS . 1 67 TYR . 1 68 HIS . 1 69 SER . 1 70 ASP . 1 71 ASP . 1 72 TYR . 1 73 ILE . 1 74 LYS . 1 75 PHE . 1 76 LEU . 1 77 ARG . 1 78 SER . 1 79 ILE . 1 80 ARG . 1 81 PRO . 1 82 ASP . 1 83 ASN . 1 84 MET . 1 85 SER . 1 86 GLU . 1 87 TYR . 1 88 SER . 1 89 LYS . 1 90 GLN . 1 91 MET . 1 92 GLN . 1 93 ARG . 1 94 PHE . 1 95 ASN . 1 96 VAL . 1 97 GLY . 1 98 GLU . 1 99 ASP . 1 100 CYS . 1 101 PRO . 1 102 VAL . 1 103 PHE . 1 104 ASP . 1 105 GLY . 1 106 LEU . 1 107 PHE . 1 108 GLU . 1 109 PHE . 1 110 CYS . 1 111 GLN . 1 112 LEU . 1 113 SER . 1 114 THR . 1 115 GLY . 1 116 GLY . 1 117 SER . 1 118 VAL . 1 119 ALA . 1 120 SER . 1 121 ALA . 1 122 VAL . 1 123 LYS . 1 124 LEU . 1 125 ASN . 1 126 LYS . 1 127 GLN . 1 128 GLN . 1 129 THR . 1 130 ASP . 1 131 ILE . 1 132 ALA . 1 133 VAL . 1 134 ASN . 1 135 TRP . 1 136 ALA . 1 137 GLY . 1 138 GLY . 1 139 LEU . 1 140 HIS . 1 141 HIS . 1 142 ALA . 1 143 LYS . 1 144 LYS . 1 145 SER . 1 146 GLU . 1 147 ALA . 1 148 SER . 1 149 GLY . 1 150 PHE . 1 151 CYS . 1 152 TYR . 1 153 VAL . 1 154 ASN . 1 155 ASP . 1 156 ILE . 1 157 VAL . 1 158 LEU . 1 159 ALA . 1 160 ILE . 1 161 LEU . 1 162 GLU . 1 163 LEU . 1 164 LEU . 1 165 LYS . 1 166 TYR . 1 167 HIS . 1 168 GLN . 1 169 ARG . 1 170 VAL . 1 171 LEU . 1 172 TYR . 1 173 ILE . 1 174 ASP . 1 175 ILE . 1 176 ASP . 1 177 ILE . 1 178 HIS . 1 179 HIS . 1 180 GLY . 1 181 ASP . 1 182 GLY . 1 183 VAL . 1 184 GLU . 1 185 GLU . 1 186 ALA . 1 187 PHE . 1 188 TYR . 1 189 THR . 1 190 THR . 1 191 ASP . 1 192 ARG . 1 193 VAL . 1 194 MET . 1 195 THR . 1 196 VAL . 1 197 SER . 1 198 PHE . 1 199 HIS . 1 200 LYS . 1 201 TYR . 1 202 GLY . 1 203 GLU . 1 204 TYR . 1 205 PHE . 1 206 PRO . 1 207 GLY . 1 208 THR . 1 209 GLY . 1 210 ASP . 1 211 LEU . 1 212 ARG . 1 213 ASP . 1 214 ILE . 1 215 GLY . 1 216 ALA . 1 217 GLY . 1 218 LYS . 1 219 GLY . 1 220 LYS . 1 221 TYR . 1 222 TYR . 1 223 ALA . 1 224 VAL . 1 225 ASN . 1 226 TYR . 1 227 PRO . 1 228 LEU . 1 229 ARG . 1 230 ASP . 1 231 GLY . 1 232 ILE . 1 233 ASP . 1 234 ASP . 1 235 GLU . 1 236 SER . 1 237 TYR . 1 238 GLU . 1 239 ALA . 1 240 ILE . 1 241 PHE . 1 242 LYS . 1 243 PRO . 1 244 VAL . 1 245 MET . 1 246 SER . 1 247 LYS . 1 248 VAL . 1 249 MET . 1 250 GLU . 1 251 MET . 1 252 PHE . 1 253 GLN . 1 254 PRO . 1 255 SER . 1 256 ALA . 1 257 VAL . 1 258 VAL . 1 259 LEU . 1 260 GLN . 1 261 CYS . 1 262 GLY . 1 263 SER . 1 264 ASP . 1 265 SER . 1 266 LEU . 1 267 SER . 1 268 GLY . 1 269 ASP . 1 270 ARG . 1 271 LEU . 1 272 GLY . 1 273 CYS . 1 274 PHE . 1 275 ASN . 1 276 LEU . 1 277 THR . 1 278 ILE . 1 279 LYS . 1 280 GLY . 1 281 HIS . 1 282 ALA . 1 283 LYS . 1 284 CYS . 1 285 VAL . 1 286 GLU . 1 287 PHE . 1 288 VAL . 1 289 LYS . 1 290 SER . 1 291 PHE . 1 292 ASN . 1 293 LEU . 1 294 PRO . 1 295 MET . 1 296 LEU . 1 297 MET . 1 298 LEU . 1 299 GLY . 1 300 GLY . 1 301 GLY . 1 302 GLY . 1 303 TYR . 1 304 THR . 1 305 ILE . 1 306 ARG . 1 307 ASN . 1 308 VAL . 1 309 ALA . 1 310 ARG . 1 311 CYS . 1 312 TRP . 1 313 THR . 1 314 TYR . 1 315 GLU . 1 316 THR . 1 317 ALA . 1 318 VAL . 1 319 ALA . 1 320 LEU . 1 321 ASP . 1 322 THR . 1 323 GLU . 1 324 ILE . 1 325 PRO . 1 326 ASN . 1 327 GLU . 1 328 LEU . 1 329 PRO . 1 330 TYR . 1 331 ASN . 1 332 ASP . 1 333 TYR . 1 334 PHE . 1 335 GLU . 1 336 TYR . 1 337 PHE . 1 338 GLY . 1 339 PRO . 1 340 ASP . 1 341 PHE . 1 342 LYS . 1 343 LEU . 1 344 HIS . 1 345 ILE . 1 346 SER . 1 347 PRO . 1 348 SER . 1 349 ASN . 1 350 MET . 1 351 THR . 1 352 ASN . 1 353 GLN . 1 354 ASN . 1 355 THR . 1 356 ASN . 1 357 GLU . 1 358 TYR . 1 359 LEU . 1 360 GLU . 1 361 LYS . 1 362 ILE . 1 363 LYS . 1 364 GLN . 1 365 ARG . 1 366 LEU . 1 367 PHE . 1 368 GLU . 1 369 ASN . 1 370 LEU . 1 371 ARG . 1 372 MET . 1 373 LEU . 1 374 PRO . 1 375 HIS . 1 376 ALA . 1 377 PRO . 1 378 GLY . 1 379 VAL . 1 380 GLN . 1 381 MET . 1 382 GLN . 1 383 ALA . 1 384 ILE . 1 385 PRO . 1 386 GLU . 1 387 ASP . 1 388 ALA . 1 389 ILE . 1 390 PRO . 1 391 GLU . 1 392 GLU . 2 1 ALA . 2 2 PRO . 2 3 VAL . 2 4 GLN . 2 5 SER . 2 6 PRO . 2 7 ARG . 2 8 PRO . 2 9 GLN . 2 10 SER . 2 11 GLN . 2 12 PRO . 2 13 PRO . 2 14 HIS . 2 15 SER . 2 16 SER . 2 17 PRO . 2 18 SER . 2 19 PRO . 2 20 ARG . 2 21 ILE . 2 22 GLN . 2 23 PRO . 2 24 GLN . 2 25 PRO . 2 26 SER . 2 27 PRO . 2 28 HIS . 2 29 HIS . 2 30 VAL . 2 31 SER . 2 32 PRO . 2 33 GLN . 2 34 THR . 2 35 GLY . 2 36 SER . 2 37 PRO . 2 38 HIS . 2 39 PRO . 2 40 GLY . 2 41 LEU . 2 42 ALA . 2 43 VAL . 2 44 THR . 2 45 MET . 2 46 ALA . 2 47 SER . 2 48 SER . 2 49 ILE . 2 50 ASP . 2 51 GLN . 2 52 GLY . 2 53 HIS . 2 54 LEU . 2 55 GLY . 2 56 ASN . 2 57 PRO . 2 58 GLU . 2 59 GLN . 2 60 SER . 2 61 ALA . 2 62 MET . 2 63 LEU . 2 64 PRO . 2 65 GLN . 2 66 LEU . 2 67 ASN . 2 68 THR . 2 69 PRO . 2 70 SER . 2 71 ARG . 2 72 SER . 2 73 ALA . 2 74 LEU . 2 75 SER . 2 76 SER . 2 77 GLU . 2 78 LEU . 2 79 SER . 2 80 LEU . 2 81 VAL . 2 82 GLY . 2 83 ASP . 2 84 THR . 2 85 THR . 2 86 GLY . 2 87 ASP . 2 88 THR . 2 89 LEU . 2 90 GLU . 2 91 LYS . 2 92 PHE . 2 93 VAL . 2 94 GLU . 2 95 GLY . 2 96 LEU . loop_ _struct_asym.id _struct_asym.entity_id _struct_asym.details A 1 . B 2 . 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.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 A 1 1 MET 1 1 MET MET A . A 1 2 ALA 2 2 ALA ALA A . A 1 3 GLN 3 3 GLN GLN A . A 1 4 THR 4 4 THR THR A . A 1 5 GLN 5 5 GLN GLN A . A 1 6 GLY 6 6 GLY GLY A . A 1 7 THR 7 7 THR THR A . A 1 8 ARG 8 8 ARG ARG A . A 1 9 ARG 9 9 ARG ARG A . A 1 10 LYS 10 10 LYS LYS A . A 1 11 VAL 11 11 VAL VAL A . A 1 12 CYS 12 12 CYS CYS A . A 1 13 TYR 13 13 TYR TYR A . A 1 14 TYR 14 14 TYR TYR A . A 1 15 TYR 15 15 TYR TYR A . A 1 16 ASP 16 16 ASP ASP A . A 1 17 GLY 17 17 GLY GLY A . A 1 18 ASP 18 18 ASP ASP A . A 1 19 VAL 19 19 VAL VAL A . A 1 20 GLY 20 20 GLY GLY A . A 1 21 ASN 21 21 ASN ASN A . A 1 22 TYR 22 22 TYR TYR A . A 1 23 TYR 23 23 TYR TYR A . A 1 24 TYR 24 24 TYR TYR A . A 1 25 GLY 25 25 GLY GLY A . A 1 26 GLN 26 26 GLN GLN A . A 1 27 GLY 27 27 GLY GLY A . A 1 28 HIS 28 28 HIS HIS A . A 1 29 PRO 29 29 PRO PRO A . A 1 30 MET 30 30 MET MET A . A 1 31 LYS 31 31 LYS LYS A . A 1 32 PRO 32 32 PRO PRO A . A 1 33 HIS 33 33 HIS HIS A . A 1 34 ARG 34 34 ARG ARG A . A 1 35 ILE 35 35 ILE ILE A . A 1 36 ARG 36 36 ARG ARG A . A 1 37 MET 37 37 MET MET A . A 1 38 THR 38 38 THR THR A . A 1 39 HIS 39 39 HIS HIS A . A 1 40 ASN 40 40 ASN ASN A . A 1 41 LEU 41 41 LEU LEU A . A 1 42 LEU 42 42 LEU LEU A . A 1 43 LEU 43 43 LEU LEU A . A 1 44 ASN 44 44 ASN ASN A . A 1 45 TYR 45 45 TYR TYR A . A 1 46 GLY 46 46 GLY GLY A . A 1 47 LEU 47 47 LEU LEU A . A 1 48 TYR 48 48 TYR TYR A . A 1 49 ARG 49 49 ARG ARG A . A 1 50 LYS 50 50 LYS LYS A . A 1 51 MET 51 51 MET MET A . A 1 52 GLU 52 52 GLU GLU A . A 1 53 ILE 53 53 ILE ILE A . A 1 54 TYR 54 54 TYR TYR A . A 1 55 ARG 55 55 ARG ARG A . A 1 56 PRO 56 56 PRO PRO A . A 1 57 HIS 57 57 HIS HIS A . A 1 58 LYS 58 58 LYS LYS A . A 1 59 ALA 59 59 ALA ALA A . A 1 60 ASN 60 60 ASN ASN A . A 1 61 ALA 61 61 ALA ALA A . A 1 62 GLU 62 62 GLU GLU A . A 1 63 GLU 63 63 GLU GLU A . A 1 64 MET 64 64 MET MET A . A 1 65 THR 65 65 THR THR A . A 1 66 LYS 66 66 LYS LYS A . A 1 67 TYR 67 67 TYR TYR A . A 1 68 HIS 68 68 HIS HIS A . A 1 69 SER 69 69 SER SER A . A 1 70 ASP 70 70 ASP ASP A . A 1 71 ASP 71 71 ASP ASP A . A 1 72 TYR 72 72 TYR TYR A . A 1 73 ILE 73 73 ILE ILE A . A 1 74 LYS 74 74 LYS LYS A . A 1 75 PHE 75 75 PHE PHE A . A 1 76 LEU 76 76 LEU LEU A . A 1 77 ARG 77 77 ARG ARG A . A 1 78 SER 78 78 SER SER A . A 1 79 ILE 79 79 ILE ILE A . A 1 80 ARG 80 80 ARG ARG A . A 1 81 PRO 81 81 PRO PRO A . A 1 82 ASP 82 82 ASP ASP A . A 1 83 ASN 83 83 ASN ASN A . A 1 84 MET 84 84 MET MET A . A 1 85 SER 85 85 SER SER A . A 1 86 GLU 86 86 GLU GLU A . A 1 87 TYR 87 87 TYR TYR A . A 1 88 SER 88 88 SER SER A . A 1 89 LYS 89 89 LYS LYS A . A 1 90 GLN 90 90 GLN GLN A . A 1 91 MET 91 91 MET MET A . A 1 92 GLN 92 92 GLN GLN A . A 1 93 ARG 93 93 ARG ARG A . A 1 94 PHE 94 94 PHE PHE A . A 1 95 ASN 95 95 ASN ASN A . A 1 96 VAL 96 96 VAL VAL A . A 1 97 GLY 97 97 GLY GLY A . A 1 98 GLU 98 98 GLU GLU A . A 1 99 ASP 99 99 ASP ASP A . A 1 100 CYS 100 100 CYS CYS A . A 1 101 PRO 101 101 PRO PRO A . A 1 102 VAL 102 102 VAL VAL A . A 1 103 PHE 103 103 PHE PHE A . A 1 104 ASP 104 104 ASP ASP A . A 1 105 GLY 105 105 GLY GLY A . A 1 106 LEU 106 106 LEU LEU A . A 1 107 PHE 107 107 PHE PHE A . A 1 108 GLU 108 108 GLU GLU A . A 1 109 PHE 109 109 PHE PHE A . A 1 110 CYS 110 110 CYS CYS A . A 1 111 GLN 111 111 GLN GLN A . A 1 112 LEU 112 112 LEU LEU A . A 1 113 SER 113 113 SER SER A . A 1 114 THR 114 114 THR THR A . A 1 115 GLY 115 115 GLY GLY A . A 1 116 GLY 116 116 GLY GLY A . A 1 117 SER 117 117 SER SER A . A 1 118 VAL 118 118 VAL VAL A . A 1 119 ALA 119 119 ALA ALA A . A 1 120 SER 120 120 SER SER A . A 1 121 ALA 121 121 ALA ALA A . A 1 122 VAL 122 122 VAL VAL A . A 1 123 LYS 123 123 LYS LYS A . A 1 124 LEU 124 124 LEU LEU A . A 1 125 ASN 125 125 ASN ASN A . A 1 126 LYS 126 126 LYS LYS A . A 1 127 GLN 127 127 GLN GLN A . A 1 128 GLN 128 128 GLN GLN A . A 1 129 THR 129 129 THR THR A . A 1 130 ASP 130 130 ASP ASP A . A 1 131 ILE 131 131 ILE ILE A . A 1 132 ALA 132 132 ALA ALA A . A 1 133 VAL 133 133 VAL VAL A . A 1 134 ASN 134 134 ASN ASN A . A 1 135 TRP 135 135 TRP TRP A . A 1 136 ALA 136 136 ALA ALA A . A 1 137 GLY 137 137 GLY GLY A . A 1 138 GLY 138 138 GLY GLY A . A 1 139 LEU 139 139 LEU LEU A . A 1 140 HIS 140 140 HIS HIS A . A 1 141 HIS 141 141 HIS HIS A . A 1 142 ALA 142 142 ALA ALA A . A 1 143 LYS 143 143 LYS LYS A . A 1 144 LYS 144 144 LYS LYS A . A 1 145 SER 145 145 SER SER A . A 1 146 GLU 146 146 GLU GLU A . A 1 147 ALA 147 147 ALA ALA A . A 1 148 SER 148 148 SER SER A . A 1 149 GLY 149 149 GLY GLY A . A 1 150 PHE 150 150 PHE PHE A . A 1 151 CYS 151 151 CYS CYS A . A 1 152 TYR 152 152 TYR TYR A . A 1 153 VAL 153 153 VAL VAL A . A 1 154 ASN 154 154 ASN ASN A . A 1 155 ASP 155 155 ASP ASP A . A 1 156 ILE 156 156 ILE ILE A . A 1 157 VAL 157 157 VAL VAL A . A 1 158 LEU 158 158 LEU LEU A . A 1 159 ALA 159 159 ALA ALA A . A 1 160 ILE 160 160 ILE ILE A . A 1 161 LEU 161 161 LEU LEU A . A 1 162 GLU 162 162 GLU GLU A . A 1 163 LEU 163 163 LEU LEU A . A 1 164 LEU 164 164 LEU LEU A . A 1 165 LYS 165 165 LYS LYS A . A 1 166 TYR 166 166 TYR TYR A . A 1 167 HIS 167 167 HIS HIS A . A 1 168 GLN 168 168 GLN GLN A . A 1 169 ARG 169 169 ARG ARG A . A 1 170 VAL 170 170 VAL VAL A . A 1 171 LEU 171 171 LEU LEU A . A 1 172 TYR 172 172 TYR TYR A . A 1 173 ILE 173 173 ILE ILE A . A 1 174 ASP 174 174 ASP ASP A . A 1 175 ILE 175 175 ILE ILE A . A 1 176 ASP 176 176 ASP ASP A . A 1 177 ILE 177 177 ILE ILE A . A 1 178 HIS 178 178 HIS HIS A . A 1 179 HIS 179 179 HIS HIS A . A 1 180 GLY 180 180 GLY GLY A . A 1 181 ASP 181 181 ASP ASP A . A 1 182 GLY 182 182 GLY GLY A . A 1 183 VAL 183 183 VAL VAL A . A 1 184 GLU 184 184 GLU GLU A . A 1 185 GLU 185 185 GLU GLU A . A 1 186 ALA 186 186 ALA ALA A . A 1 187 PHE 187 187 PHE PHE A . A 1 188 TYR 188 188 TYR TYR A . A 1 189 THR 189 189 THR THR A . A 1 190 THR 190 190 THR THR A . A 1 191 ASP 191 191 ASP ASP A . A 1 192 ARG 192 192 ARG ARG A . A 1 193 VAL 193 193 VAL VAL A . A 1 194 MET 194 194 MET MET A . A 1 195 THR 195 195 THR THR A . A 1 196 VAL 196 196 VAL VAL A . A 1 197 SER 197 197 SER SER A . A 1 198 PHE 198 198 PHE PHE A . A 1 199 HIS 199 199 HIS HIS A . A 1 200 LYS 200 200 LYS LYS A . A 1 201 TYR 201 201 TYR TYR A . A 1 202 GLY 202 202 GLY GLY A . A 1 203 GLU 203 203 GLU GLU A . A 1 204 TYR 204 204 TYR TYR A . A 1 205 PHE 205 205 PHE PHE A . A 1 206 PRO 206 206 PRO PRO A . A 1 207 GLY 207 207 GLY GLY A . A 1 208 THR 208 208 THR THR A . A 1 209 GLY 209 209 GLY GLY A . A 1 210 ASP 210 210 ASP ASP A . A 1 211 LEU 211 211 LEU LEU A . A 1 212 ARG 212 212 ARG ARG A . A 1 213 ASP 213 213 ASP ASP A . A 1 214 ILE 214 214 ILE ILE A . A 1 215 GLY 215 215 GLY GLY A . A 1 216 ALA 216 216 ALA ALA A . A 1 217 GLY 217 217 GLY GLY A . A 1 218 LYS 218 218 LYS LYS A . A 1 219 GLY 219 219 GLY GLY A . A 1 220 LYS 220 220 LYS LYS A . A 1 221 TYR 221 221 TYR TYR A . A 1 222 TYR 222 222 TYR TYR A . A 1 223 ALA 223 223 ALA ALA A . A 1 224 VAL 224 224 VAL VAL A . A 1 225 ASN 225 225 ASN ASN A . A 1 226 TYR 226 226 TYR TYR A . A 1 227 PRO 227 227 PRO PRO A . A 1 228 LEU 228 228 LEU LEU A . A 1 229 ARG 229 229 ARG ARG A . A 1 230 ASP 230 230 ASP ASP A . A 1 231 GLY 231 231 GLY GLY A . A 1 232 ILE 232 232 ILE ILE A . A 1 233 ASP 233 233 ASP ASP A . A 1 234 ASP 234 234 ASP ASP A . A 1 235 GLU 235 235 GLU GLU A . A 1 236 SER 236 236 SER SER A . A 1 237 TYR 237 237 TYR TYR A . A 1 238 GLU 238 238 GLU GLU A . A 1 239 ALA 239 239 ALA ALA A . A 1 240 ILE 240 240 ILE ILE A . A 1 241 PHE 241 241 PHE PHE A . A 1 242 LYS 242 242 LYS LYS A . A 1 243 PRO 243 243 PRO PRO A . A 1 244 VAL 244 244 VAL VAL A . A 1 245 MET 245 245 MET MET A . A 1 246 SER 246 246 SER SER A . A 1 247 LYS 247 247 LYS LYS A . A 1 248 VAL 248 248 VAL VAL A . A 1 249 MET 249 249 MET MET A . A 1 250 GLU 250 250 GLU GLU A . A 1 251 MET 251 251 MET MET A . A 1 252 PHE 252 252 PHE PHE A . A 1 253 GLN 253 253 GLN GLN A . A 1 254 PRO 254 254 PRO PRO A . A 1 255 SER 255 255 SER SER A . A 1 256 ALA 256 256 ALA ALA A . A 1 257 VAL 257 257 VAL VAL A . A 1 258 VAL 258 258 VAL VAL A . A 1 259 LEU 259 259 LEU LEU A . A 1 260 GLN 260 260 GLN GLN A . A 1 261 CYS 261 261 CYS CYS A . A 1 262 GLY 262 262 GLY GLY A . A 1 263 SER 263 263 SER SER A . A 1 264 ASP 264 264 ASP ASP A . A 1 265 SER 265 265 SER SER A . A 1 266 LEU 266 266 LEU LEU A . A 1 267 SER 267 267 SER SER A . A 1 268 GLY 268 268 GLY GLY A . A 1 269 ASP 269 269 ASP ASP A . A 1 270 ARG 270 270 ARG ARG A . A 1 271 LEU 271 271 LEU LEU A . A 1 272 GLY 272 272 GLY GLY A . A 1 273 CYS 273 273 CYS CYS A . A 1 274 PHE 274 274 PHE PHE A . A 1 275 ASN 275 275 ASN ASN A . A 1 276 LEU 276 276 LEU LEU A . A 1 277 THR 277 277 THR THR A . A 1 278 ILE 278 278 ILE ILE A . A 1 279 LYS 279 279 LYS LYS A . A 1 280 GLY 280 280 GLY GLY A . A 1 281 HIS 281 281 HIS HIS A . A 1 282 ALA 282 282 ALA ALA A . A 1 283 LYS 283 283 LYS LYS A . A 1 284 CYS 284 284 CYS CYS A . A 1 285 VAL 285 285 VAL VAL A . A 1 286 GLU 286 286 GLU GLU A . A 1 287 PHE 287 287 PHE PHE A . A 1 288 VAL 288 288 VAL VAL A . A 1 289 LYS 289 289 LYS LYS A . A 1 290 SER 290 290 SER SER A . A 1 291 PHE 291 291 PHE PHE A . A 1 292 ASN 292 292 ASN ASN A . A 1 293 LEU 293 293 LEU LEU A . A 1 294 PRO 294 294 PRO PRO A . A 1 295 MET 295 295 MET MET A . A 1 296 LEU 296 296 LEU LEU A . A 1 297 MET 297 297 MET MET A . A 1 298 LEU 298 298 LEU LEU A . A 1 299 GLY 299 299 GLY GLY A . A 1 300 GLY 300 300 GLY GLY A . A 1 301 GLY 301 301 GLY GLY A . A 1 302 GLY 302 302 GLY GLY A . A 1 303 TYR 303 303 TYR TYR A . A 1 304 THR 304 304 THR THR A . A 1 305 ILE 305 305 ILE ILE A . A 1 306 ARG 306 306 ARG ARG A . A 1 307 ASN 307 307 ASN ASN A . A 1 308 VAL 308 308 VAL VAL A . A 1 309 ALA 309 309 ALA ALA A . A 1 310 ARG 310 310 ARG ARG A . A 1 311 CYS 311 311 CYS CYS A . A 1 312 TRP 312 312 TRP TRP A . A 1 313 THR 313 313 THR THR A . A 1 314 TYR 314 314 TYR TYR A . A 1 315 GLU 315 315 GLU GLU A . A 1 316 THR 316 316 THR THR A . A 1 317 ALA 317 317 ALA ALA A . A 1 318 VAL 318 318 VAL VAL A . A 1 319 ALA 319 319 ALA ALA A . A 1 320 LEU 320 320 LEU LEU A . A 1 321 ASP 321 321 ASP ASP A . A 1 322 THR 322 322 THR THR A . A 1 323 GLU 323 323 GLU GLU A . A 1 324 ILE 324 324 ILE ILE A . A 1 325 PRO 325 325 PRO PRO A . A 1 326 ASN 326 326 ASN ASN A . A 1 327 GLU 327 327 GLU GLU A . A 1 328 LEU 328 328 LEU LEU A . A 1 329 PRO 329 329 PRO PRO A . A 1 330 TYR 330 330 TYR TYR A . A 1 331 ASN 331 331 ASN ASN A . A 1 332 ASP 332 332 ASP ASP A . A 1 333 TYR 333 333 TYR TYR A . A 1 334 PHE 334 334 PHE PHE A . A 1 335 GLU 335 335 GLU GLU A . A 1 336 TYR 336 336 TYR TYR A . A 1 337 PHE 337 337 PHE PHE A . A 1 338 GLY 338 338 GLY GLY A . A 1 339 PRO 339 339 PRO PRO A . A 1 340 ASP 340 340 ASP ASP A . A 1 341 PHE 341 341 PHE PHE A . A 1 342 LYS 342 342 LYS LYS A . A 1 343 LEU 343 343 LEU LEU A . A 1 344 HIS 344 344 HIS HIS A . A 1 345 ILE 345 345 ILE ILE A . A 1 346 SER 346 346 SER SER A . A 1 347 PRO 347 347 PRO PRO A . A 1 348 SER 348 348 SER SER A . A 1 349 ASN 349 349 ASN ASN A . A 1 350 MET 350 350 MET MET A . A 1 351 THR 351 351 THR THR A . A 1 352 ASN 352 352 ASN ASN A . A 1 353 GLN 353 353 GLN GLN A . A 1 354 ASN 354 354 ASN ASN A . A 1 355 THR 355 355 THR THR A . A 1 356 ASN 356 356 ASN ASN A . A 1 357 GLU 357 357 GLU GLU A . A 1 358 TYR 358 358 TYR TYR A . A 1 359 LEU 359 359 LEU LEU A . A 1 360 GLU 360 360 GLU GLU A . A 1 361 LYS 361 361 LYS LYS A . A 1 362 ILE 362 362 ILE ILE A . A 1 363 LYS 363 363 LYS LYS A . A 1 364 GLN 364 364 GLN GLN A . A 1 365 ARG 365 365 ARG ARG A . A 1 366 LEU 366 366 LEU LEU A . A 1 367 PHE 367 367 PHE PHE A . A 1 368 GLU 368 368 GLU GLU A . A 1 369 ASN 369 369 ASN ASN A . A 1 370 LEU 370 370 LEU LEU A . A 1 371 ARG 371 371 ARG ARG A . A 1 372 MET 372 372 MET MET A . A 1 373 LEU 373 373 LEU LEU A . A 1 374 PRO 374 374 PRO PRO A . A 1 375 HIS 375 375 HIS HIS A . A 1 376 ALA 376 376 ALA ALA A . A 1 377 PRO 377 377 PRO PRO A . A 1 378 GLY 378 378 GLY GLY A . A 1 379 VAL 379 379 VAL VAL A . A 1 380 GLN 380 380 GLN GLN A . A 1 381 MET 381 381 MET MET A . A 1 382 GLN 382 382 GLN GLN A . A 1 383 ALA 383 383 ALA ALA A . A 1 384 ILE 384 384 ILE ILE A . A 1 385 PRO 385 385 PRO PRO A . A 1 386 GLU 386 386 GLU GLU A . A 1 387 ASP 387 387 ASP ASP A . A 1 388 ALA 388 388 ALA ALA A . A 1 389 ILE 389 389 ILE ILE A . A 1 390 PRO 390 390 PRO PRO A . A 1 391 GLU 391 391 GLU GLU A . A 1 392 GLU 392 392 GLU GLU A . B 2 1 ALA 2347 2347 ALA ALA B . B 2 2 PRO 2348 2348 PRO PRO B . B 2 3 VAL 2349 2349 VAL VAL B . B 2 4 GLN 2350 2350 GLN GLN B . B 2 5 SER 2351 2351 SER SER B . B 2 6 PRO 2352 2352 PRO PRO B . B 2 7 ARG 2353 2353 ARG ARG B . B 2 8 PRO 2354 2354 PRO PRO B . B 2 9 GLN 2355 2355 GLN GLN B . B 2 10 SER 2356 2356 SER SER B . B 2 11 GLN 2357 2357 GLN GLN B . B 2 12 PRO 2358 2358 PRO PRO B . B 2 13 PRO 2359 2359 PRO PRO B . B 2 14 HIS 2360 2360 HIS HIS B . B 2 15 SER 2361 2361 SER SER B . B 2 16 SER 2362 2362 SER SER B . B 2 17 PRO 2363 2363 PRO PRO B . B 2 18 SER 2364 2364 SER SER B . B 2 19 PRO 2365 2365 PRO PRO B . B 2 20 ARG 2366 2366 ARG ARG B . B 2 21 ILE 2367 2367 ILE ILE B . B 2 22 GLN 2368 2368 GLN GLN B . B 2 23 PRO 2369 2369 PRO PRO B . B 2 24 GLN 2370 2370 GLN GLN B . B 2 25 PRO 2371 2371 PRO PRO B . B 2 26 SER 2372 2372 SER SER B . B 2 27 PRO 2373 2373 PRO PRO B . B 2 28 HIS 2374 2374 HIS HIS B . B 2 29 HIS 2375 2375 HIS HIS B . B 2 30 VAL 2376 2376 VAL VAL B . B 2 31 SER 2377 2377 SER SER B . B 2 32 PRO 2378 2378 PRO PRO B . B 2 33 GLN 2379 2379 GLN GLN B . B 2 34 THR 2380 2380 THR THR B . B 2 35 GLY 2381 2381 GLY GLY B . B 2 36 SER 2382 2382 SER SER B . B 2 37 PRO 2383 2383 PRO PRO B . B 2 38 HIS 2384 2384 HIS HIS B . B 2 39 PRO 2385 2385 PRO PRO B . B 2 40 GLY 2386 2386 GLY GLY B . B 2 41 LEU 2387 2387 LEU LEU B . B 2 42 ALA 2388 2388 ALA ALA B . B 2 43 VAL 2389 2389 VAL VAL B . B 2 44 THR 2390 2390 THR THR B . B 2 45 MET 2391 2391 MET MET B . B 2 46 ALA 2392 2392 ALA ALA B . B 2 47 SER 2393 2393 SER SER B . B 2 48 SER 2394 2394 SER SER B . B 2 49 ILE 2395 2395 ILE ILE B . B 2 50 ASP 2396 2396 ASP ASP B . B 2 51 GLN 2397 2397 GLN GLN B . B 2 52 GLY 2398 2398 GLY GLY B . B 2 53 HIS 2399 2399 HIS HIS B . B 2 54 LEU 2400 2400 LEU LEU B . B 2 55 GLY 2401 2401 GLY GLY B . B 2 56 ASN 2402 2402 ASN ASN B . B 2 57 PRO 2403 2403 PRO PRO B . B 2 58 GLU 2404 2404 GLU GLU B . B 2 59 GLN 2405 2405 GLN GLN B . B 2 60 SER 2406 2406 SER SER B . B 2 61 ALA 2407 2407 ALA ALA B . B 2 62 MET 2408 2408 MET MET B . B 2 63 LEU 2409 2409 LEU LEU B . B 2 64 PRO 2410 2410 PRO PRO B . B 2 65 GLN 2411 2411 GLN GLN B . B 2 66 LEU 2412 2412 LEU LEU B . B 2 67 ASN 2413 2413 ASN ASN B . B 2 68 THR 2414 2414 THR THR B . B 2 69 PRO 2415 2415 PRO PRO B . B 2 70 SER 2416 2416 SER SER B . B 2 71 ARG 2417 2417 ARG ARG B . B 2 72 SER 2418 2418 SER SER B . B 2 73 ALA 2419 2419 ALA ALA B . B 2 74 LEU 2420 2420 LEU LEU B . B 2 75 SER 2421 2421 SER SER B . B 2 76 SER 2422 2422 SER SER B . B 2 77 GLU 2423 2423 GLU GLU B . B 2 78 LEU 2424 2424 LEU LEU B . B 2 79 SER 2425 2425 SER SER B . B 2 80 LEU 2426 2426 LEU LEU B . B 2 81 VAL 2427 2427 VAL VAL B . B 2 82 GLY 2428 2428 GLY GLY B . B 2 83 ASP 2429 2429 ASP ASP B . B 2 84 THR 2430 2430 THR THR B . B 2 85 THR 2431 2431 THR THR B . B 2 86 GLY 2432 2432 GLY GLY B . B 2 87 ASP 2433 2433 ASP ASP B . B 2 88 THR 2434 2434 THR THR B . B 2 89 LEU 2435 2435 LEU LEU B . B 2 90 GLU 2436 2436 GLU GLU B . B 2 91 LYS 2437 2437 LYS LYS B . B 2 92 PHE 2438 2438 PHE PHE B . B 2 93 VAL 2439 2439 VAL VAL B . B 2 94 GLU 2440 2440 GLU GLU B . B 2 95 GLY 2441 2441 GLY GLY B . B 2 96 LEU 2442 2442 LEU LEU B . loop_ _ma_data.id _ma_data.name _ma_data.content_type 1 'Homo sapiens (Human) HDAC1 (Q13547; 1 - 392)' target 2 'Homo sapiens (Human) CREBBP (Q92793; 2347 - 2442)' target 3 'Model 3' 'model coordinates' 4 'Paired MSA for the dimer' 'coevolution MSA' loop_ _ma_data_group.ordinal_id _ma_data_group.group_id _ma_data_group.data_id 1 1 1 2 1 2 3 2 1 4 2 2 5 2 4 6 3 4 7 4 3 loop_ _ma_target_entity.entity_id _ma_target_entity.data_id _ma_target_entity.origin 1 1 'reference database' 2 2 'reference database' loop_ _ma_target_entity_instance.asym_id _ma_target_entity_instance.entity_id _ma_target_entity_instance.details A 1 . B 2 . loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type _ma_protocol_step.step_name _ma_protocol_step.details _ma_protocol_step.software_group_id _ma_protocol_step.input_data_group_id _ma_protocol_step.output_data_group_id 1 1 1 'coevolution MSA' . 'Create paired MSAs for the dimers' . 1 3 2 1 2 modeling . "Model using AlphaFold ('model 3' parameters; pTM monomer version) with a 200 residue gap between the two chains, without templates and without model relaxation" 1 2 4 loop_ _ma_model_list.ordinal_id _ma_model_list.model_id _ma_model_list.model_group_id _ma_model_list.model_name _ma_model_list.model_group_name _ma_model_list.data_id _ma_model_list.model_type _ma_model_list.model_type_other_details 1 1 1 'Model 3' . 3 'Ab initio model' . 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_seq_id _atom_site.auth_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.label_asym_id _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.label_entity_id _atom_site.auth_asym_id _atom_site.B_iso_or_equiv _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET 1 1 ? A -9.540 25.775 3.297 1.000 1 A 40.955 1 ATOM 2 C CA . MET 1 1 ? A -9.104 24.981 2.152 1.000 1 A 40.955 1 ATOM 3 C C . MET 1 1 ? A -8.263 25.820 1.196 1.000 1 A 40.955 1 ATOM 4 O O . MET 1 1 ? A -8.767 26.762 0.582 1.000 1 A 40.955 1 ATOM 5 C CB . MET 1 1 ? A -10.309 24.397 1.412 1.000 1 A 40.955 1 ATOM 6 C CG . MET 1 1 ? A -11.020 23.291 2.176 1.000 1 A 40.955 1 ATOM 7 S SD . MET 1 1 ? A -11.408 21.843 1.118 1.000 1 A 40.955 1 ATOM 8 C CE . MET 1 1 ? A -12.466 20.896 2.247 1.000 1 A 40.955 1 ATOM 9 N N . ALA 2 2 ? A -7.164 26.454 1.676 1.000 1 A 35.983 1 ATOM 10 C CA . ALA 2 2 ? A -6.242 27.223 0.845 1.000 1 A 35.983 1 ATOM 11 C C . ALA 2 2 ? A -5.930 26.485 -0.454 1.000 1 A 35.983 1 ATOM 12 O O . ALA 2 2 ? A -5.484 25.336 -0.431 1.000 1 A 35.983 1 ATOM 13 C CB . ALA 2 2 ? A -4.953 27.515 1.610 1.000 1 A 35.983 1 ATOM 14 N N . GLN 3 3 ? A -6.863 26.395 -1.402 1.000 1 A 35.883 1 ATOM 15 C CA . GLN 3 3 ? A -6.794 26.312 -2.857 1.000 1 A 35.883 1 ATOM 16 C C . GLN 3 3 ? A -5.418 26.731 -3.367 1.000 1 A 35.883 1 ATOM 17 O O . GLN 3 3 ? A -5.023 27.889 -3.223 1.000 1 A 35.883 1 ATOM 18 C CB . GLN 3 3 ? A -7.878 27.181 -3.496 1.000 1 A 35.883 1 ATOM 19 C CG . GLN 3 3 ? A -9.226 26.485 -3.627 1.000 1 A 35.883 1 ATOM 20 C CD . GLN 3 3 ? A -10.288 27.375 -4.244 1.000 1 A 35.883 1 ATOM 21 O OE1 . GLN 3 3 ? A -10.036 28.545 -4.550 1.000 1 A 35.883 1 ATOM 22 N NE2 . GLN 3 3 ? A -11.485 26.829 -4.430 1.000 1 A 35.883 1 ATOM 23 N N . THR 4 4 ? A -4.283 26.093 -3.066 1.000 1 A 40.954 1 ATOM 24 C CA . THR 4 4 ? A -3.173 26.501 -3.919 1.000 1 A 40.954 1 ATOM 25 C C . THR 4 4 ? A -3.452 26.144 -5.376 1.000 1 A 40.954 1 ATOM 26 O O . THR 4 4 ? A -3.572 24.966 -5.720 1.000 1 A 40.954 1 ATOM 27 C CB . THR 4 4 ? A -1.853 25.847 -3.471 1.000 1 A 40.954 1 ATOM 28 O OG1 . THR 4 4 ? A -2.058 24.439 -3.301 1.000 1 A 40.954 1 ATOM 29 C CG2 . THR 4 4 ? A -1.366 26.441 -2.153 1.000 1 A 40.954 1 ATOM 30 N N . GLN 5 5 ? A -4.454 26.633 -5.964 1.000 1 A 36.774 1 ATOM 31 C CA . GLN 5 5 ? A -4.601 26.894 -7.392 1.000 1 A 36.774 1 ATOM 32 C C . GLN 5 5 ? A -3.275 27.326 -8.012 1.000 1 A 36.774 1 ATOM 33 O O . GLN 5 5 ? A -2.714 28.357 -7.633 1.000 1 A 36.774 1 ATOM 34 C CB . GLN 5 5 ? A -5.668 27.962 -7.636 1.000 1 A 36.774 1 ATOM 35 C CG . GLN 5 5 ? A -7.071 27.400 -7.818 1.000 1 A 36.774 1 ATOM 36 C CD . GLN 5 5 ? A -8.091 28.468 -8.165 1.000 1 A 36.774 1 ATOM 37 O OE1 . GLN 5 5 ? A -7.745 29.638 -8.353 1.000 1 A 36.774 1 ATOM 38 N NE2 . GLN 5 5 ? A -9.357 28.073 -8.251 1.000 1 A 36.774 1 ATOM 39 N N . GLY 6 6 ? A -2.205 26.497 -7.962 1.000 1 A 49.489 1 ATOM 40 C CA . GLY 6 6 ? A -1.142 26.776 -8.914 1.000 1 A 49.489 1 ATOM 41 C C . GLY 6 6 ? A 0.176 26.122 -8.546 1.000 1 A 49.489 1 ATOM 42 O O . GLY 6 6 ? A 1.141 26.183 -9.311 1.000 1 A 49.489 1 ATOM 43 N N . THR 7 7 ? A 0.232 25.373 -7.434 1.000 1 A 59.867 1 ATOM 44 C CA . THR 7 7 ? A 1.534 24.748 -7.228 1.000 1 A 59.867 1 ATOM 45 C C . THR 7 7 ? A 1.476 23.258 -7.551 1.000 1 A 59.867 1 ATOM 46 O O . THR 7 7 ? A 0.490 22.587 -7.239 1.000 1 A 59.867 1 ATOM 47 C CB . THR 7 7 ? A 2.024 24.943 -5.781 1.000 1 A 59.867 1 ATOM 48 O OG1 . THR 7 7 ? A 1.033 24.443 -4.875 1.000 1 A 59.867 1 ATOM 49 C CG2 . THR 7 7 ? A 2.275 26.417 -5.479 1.000 1 A 59.867 1 ATOM 50 N N . ARG 8 8 ? A 1.965 22.951 -8.663 1.000 1 A 75.385 1 ATOM 51 C CA . ARG 8 8 ? A 2.179 21.558 -9.041 1.000 1 A 75.385 1 ATOM 52 C C . ARG 8 8 ? A 2.493 20.701 -7.820 1.000 1 A 75.385 1 ATOM 53 O O . ARG 8 8 ? A 3.257 21.114 -6.945 1.000 1 A 75.385 1 ATOM 54 C CB . ARG 8 8 ? A 3.310 21.446 -10.065 1.000 1 A 75.385 1 ATOM 55 C CG . ARG 8 8 ? A 3.381 20.095 -10.760 1.000 1 A 75.385 1 ATOM 56 C CD . ARG 8 8 ? A 4.452 20.073 -11.842 1.000 1 A 75.385 1 ATOM 57 N NE . ARG 8 8 ? A 4.584 18.749 -12.443 1.000 1 A 75.385 1 ATOM 58 C CZ . ARG 8 8 ? A 5.407 18.449 -13.444 1.000 1 A 75.385 1 ATOM 59 N NH1 . ARG 8 8 ? A 6.191 19.378 -13.978 1.000 1 A 75.385 1 ATOM 60 N NH2 . ARG 8 8 ? A 5.447 17.211 -13.914 1.000 1 A 75.385 1 ATOM 61 N N . ARG 9 9 ? A 1.661 19.758 -7.545 1.000 1 A 89.105 1 ATOM 62 C CA . ARG 9 9 ? A 1.882 18.813 -6.455 1.000 1 A 89.105 1 ATOM 63 C C . ARG 9 9 ? A 3.298 18.249 -6.498 1.000 1 A 89.105 1 ATOM 64 O O . ARG 9 9 ? A 3.803 17.906 -7.569 1.000 1 A 89.105 1 ATOM 65 C CB . ARG 9 9 ? A 0.862 17.674 -6.515 1.000 1 A 89.105 1 ATOM 66 C CG . ARG 9 9 ? A -0.542 18.082 -6.097 1.000 1 A 89.105 1 ATOM 67 C CD . ARG 9 9 ? A -1.441 16.872 -5.886 1.000 1 A 89.105 1 ATOM 68 N NE . ARG 9 9 ? A -2.319 16.646 -7.031 1.000 1 A 89.105 1 ATOM 69 C CZ . ARG 9 9 ? A -3.306 15.756 -7.065 1.000 1 A 89.105 1 ATOM 70 N NH1 . ARG 9 9 ? A -3.563 14.987 -6.013 1.000 1 A 89.105 1 ATOM 71 N NH2 . ARG 9 9 ? A -4.044 15.633 -8.159 1.000 1 A 89.105 1 ATOM 72 N N . LYS 10 10 ? A 3.895 18.213 -5.353 1.000 1 A 97.177 1 ATOM 73 C CA . LYS 10 10 ? A 5.218 17.610 -5.210 1.000 1 A 97.177 1 ATOM 74 C C . LYS 10 10 ? A 5.117 16.098 -5.035 1.000 1 A 97.177 1 ATOM 75 O O . LYS 10 10 ? A 4.438 15.617 -4.126 1.000 1 A 97.177 1 ATOM 76 C CB . LYS 10 10 ? A 5.963 18.226 -4.025 1.000 1 A 97.177 1 ATOM 77 C CG . LYS 10 10 ? A 6.270 19.708 -4.189 1.000 1 A 97.177 1 ATOM 78 C CD . LYS 10 10 ? A 6.983 20.270 -2.967 1.000 1 A 97.177 1 ATOM 79 C CE . LYS 10 10 ? A 7.185 21.775 -3.078 1.000 1 A 97.177 1 ATOM 80 N NZ . LYS 10 10 ? A 7.816 22.342 -1.850 1.000 1 A 97.177 1 ATOM 81 N N . VAL 11 11 ? A 5.746 15.414 -5.959 1.000 1 A 98.470 1 ATOM 82 C CA . VAL 11 11 ? A 5.709 13.956 -5.934 1.000 1 A 98.470 1 ATOM 83 C C . VAL 11 11 ? A 7.115 13.407 -5.701 1.000 1 A 98.470 1 ATOM 84 O O . VAL 11 11 ? A 8.079 13.871 -6.314 1.000 1 A 98.470 1 ATOM 85 C CB . VAL 11 11 ? A 5.123 13.381 -7.243 1.000 1 A 98.470 1 ATOM 86 C CG1 . VAL 11 11 ? A 5.120 11.853 -7.208 1.000 1 A 98.470 1 ATOM 87 C CG2 . VAL 11 11 ? A 3.712 13.916 -7.476 1.000 1 A 98.470 1 ATOM 88 N N . CYS 12 12 ? A 7.248 12.502 -4.755 1.000 1 A 98.473 1 ATOM 89 C CA . CYS 12 12 ? A 8.508 11.785 -4.597 1.000 1 A 98.473 1 ATOM 90 C C . CYS 12 12 ? A 8.311 10.286 -4.791 1.000 1 A 98.473 1 ATOM 91 O O . CYS 12 12 ? A 7.199 9.777 -4.638 1.000 1 A 98.473 1 ATOM 92 C CB . CYS 12 12 ? A 9.110 12.055 -3.218 1.000 1 A 98.473 1 ATOM 93 S SG . CYS 12 12 ? A 8.193 11.292 -1.862 1.000 1 A 98.473 1 ATOM 94 N N . TYR 13 13 ? A 9.370 9.621 -5.223 1.000 1 A 98.742 1 ATOM 95 C CA . TYR 13 13 ? A 9.413 8.194 -5.523 1.000 1 A 98.742 1 ATOM 96 C C . TYR 13 13 ? A 10.616 7.533 -4.862 1.000 1 A 98.742 1 ATOM 97 O O . TYR 13 13 ? A 11.756 7.956 -5.069 1.000 1 A 98.742 1 ATOM 98 C CB . TYR 13 13 ? A 9.457 7.965 -7.037 1.000 1 A 98.742 1 ATOM 99 C CG . TYR 13 13 ? A 9.699 6.526 -7.426 1.000 1 A 98.742 1 ATOM 100 C CD1 . TYR 13 13 ? A 10.553 6.203 -8.478 1.000 1 A 98.742 1 ATOM 101 C CD2 . TYR 13 13 ? A 9.074 5.488 -6.743 1.000 1 A 98.742 1 ATOM 102 C CE1 . TYR 13 13 ? A 10.777 4.879 -8.842 1.000 1 A 98.742 1 ATOM 103 C CE2 . TYR 13 13 ? A 9.291 4.161 -7.098 1.000 1 A 98.742 1 ATOM 104 C CZ . TYR 13 13 ? A 10.143 3.867 -8.146 1.000 1 A 98.742 1 ATOM 105 O OH . TYR 13 13 ? A 10.362 2.554 -8.502 1.000 1 A 98.742 1 ATOM 106 N N . TYR 14 14 ? A 10.399 6.489 -4.053 1.000 1 A 98.508 1 ATOM 107 C CA . TYR 14 14 ? A 11.467 5.730 -3.412 1.000 1 A 98.508 1 ATOM 108 C C . TYR 14 14 ? A 11.771 4.454 -4.187 1.000 1 A 98.508 1 ATOM 109 O O . TYR 14 14 ? A 10.879 3.636 -4.423 1.000 1 A 98.508 1 ATOM 110 C CB . TYR 14 14 ? A 11.091 5.386 -1.968 1.000 1 A 98.508 1 ATOM 111 C CG . TYR 14 14 ? A 11.230 6.546 -1.011 1.000 1 A 98.508 1 ATOM 112 C CD1 . TYR 14 14 ? A 12.376 6.699 -0.234 1.000 1 A 98.508 1 ATOM 113 C CD2 . TYR 14 14 ? A 10.217 7.489 -0.882 1.000 1 A 98.508 1 ATOM 114 C CE1 . TYR 14 14 ? A 12.509 7.765 0.650 1.000 1 A 98.508 1 ATOM 115 C CE2 . TYR 14 14 ? A 10.338 8.559 -0.001 1.000 1 A 98.508 1 ATOM 116 C CZ . TYR 14 14 ? A 11.486 8.689 0.759 1.000 1 A 98.508 1 ATOM 117 O OH . TYR 14 14 ? A 11.611 9.746 1.632 1.000 1 A 98.508 1 ATOM 118 N N . TYR 15 15 ? A 13.035 4.310 -4.530 1.000 1 A 98.497 1 ATOM 119 C CA . TYR 15 15 ? A 13.486 3.170 -5.320 1.000 1 A 98.497 1 ATOM 120 C C . TYR 15 15 ? A 14.913 2.781 -4.951 1.000 1 A 98.497 1 ATOM 121 O O . TYR 15 15 ? A 15.789 3.642 -4.843 1.000 1 A 98.497 1 ATOM 122 C CB . TYR 15 15 ? A 13.401 3.485 -6.816 1.000 1 A 98.497 1 ATOM 123 C CG . TYR 15 15 ? A 14.001 2.416 -7.697 1.000 1 A 98.497 1 ATOM 124 C CD1 . TYR 15 15 ? A 15.240 2.601 -8.305 1.000 1 A 98.497 1 ATOM 125 C CD2 . TYR 15 15 ? A 13.330 1.219 -7.923 1.000 1 A 98.497 1 ATOM 126 C CE1 . TYR 15 15 ? A 15.796 1.620 -9.119 1.000 1 A 98.497 1 ATOM 127 C CE2 . TYR 15 15 ? A 13.876 0.231 -8.735 1.000 1 A 98.497 1 ATOM 128 C CZ . TYR 15 15 ? A 15.108 0.439 -9.327 1.000 1 A 98.497 1 ATOM 129 O OH . TYR 15 15 ? A 15.653 -0.536 -10.132 1.000 1 A 98.497 1 ATOM 130 N N . ASP 16 16 ? A 15.086 1.483 -4.712 1.000 1 A 97.407 1 ATOM 131 C CA . ASP 16 16 ? A 16.412 0.901 -4.522 1.000 1 A 97.407 1 ATOM 132 C C . ASP 16 16 ? A 16.744 -0.084 -5.640 1.000 1 A 97.407 1 ATOM 133 O O . ASP 16 16 ? A 15.942 -0.965 -5.957 1.000 1 A 97.407 1 ATOM 134 C CB . ASP 16 16 ? A 16.503 0.205 -3.163 1.000 1 A 97.407 1 ATOM 135 C CG . ASP 16 16 ? A 17.921 -0.199 -2.798 1.000 1 A 97.407 1 ATOM 136 O OD1 . ASP 16 16 ? A 18.465 -1.139 -3.417 1.000 1 A 97.407 1 ATOM 137 O OD2 . ASP 16 16 ? A 18.497 0.426 -1.882 1.000 1 A 97.407 1 ATOM 138 N N . GLY 17 17 ? A 17.947 0.049 -6.251 1.000 1 A 96.381 1 ATOM 139 C CA . GLY 17 17 ? A 18.380 -0.741 -7.393 1.000 1 A 96.381 1 ATOM 140 C C . GLY 17 17 ? A 18.491 -2.222 -7.086 1.000 1 A 96.381 1 ATOM 141 O O . GLY 17 17 ? A 18.445 -3.055 -7.994 1.000 1 A 96.381 1 ATOM 142 N N . ASP 18 18 ? A 18.456 -2.648 -5.810 1.000 1 A 96.019 1 ATOM 143 C CA . ASP 18 18 ? A 18.623 -4.049 -5.437 1.000 1 A 96.019 1 ATOM 144 C C . ASP 18 18 ? A 17.272 -4.748 -5.305 1.000 1 A 96.019 1 ATOM 145 O O . ASP 18 18 ? A 17.194 -5.976 -5.367 1.000 1 A 96.019 1 ATOM 146 C CB . ASP 18 18 ? A 19.405 -4.165 -4.126 1.000 1 A 96.019 1 ATOM 147 C CG . ASP 18 18 ? A 20.885 -3.867 -4.290 1.000 1 A 96.019 1 ATOM 148 O OD1 . ASP 18 18 ? A 21.418 -4.021 -5.411 1.000 1 A 96.019 1 ATOM 149 O OD2 . ASP 18 18 ? A 21.525 -3.476 -3.290 1.000 1 A 96.019 1 ATOM 150 N N . VAL 19 19 ? A 16.209 -3.971 -5.113 1.000 1 A 95.772 1 ATOM 151 C CA . VAL 19 19 ? A 14.913 -4.507 -4.711 1.000 1 A 95.772 1 ATOM 152 C C . VAL 19 19 ? A 14.392 -5.459 -5.784 1.000 1 A 95.772 1 ATOM 153 O O . VAL 19 19 ? A 13.714 -6.442 -5.475 1.000 1 A 95.772 1 ATOM 154 C CB . VAL 19 19 ? A 13.888 -3.380 -4.455 1.000 1 A 95.772 1 ATOM 155 C CG1 . VAL 19 19 ? A 13.505 -2.691 -5.763 1.000 1 A 95.772 1 ATOM 156 C CG2 . VAL 19 19 ? A 12.648 -3.935 -3.757 1.000 1 A 95.772 1 ATOM 157 N N . GLY 20 20 ? A 14.714 -5.266 -7.041 1.000 1 A 95.836 1 ATOM 158 C CA . GLY 20 20 ? A 14.238 -6.088 -8.142 1.000 1 A 95.836 1 ATOM 159 C C . GLY 20 20 ? A 15.073 -7.336 -8.358 1.000 1 A 95.836 1 ATOM 160 O O . GLY 20 20 ? A 14.737 -8.177 -9.195 1.000 1 A 95.836 1 ATOM 161 N N . ASN 21 21 ? A 16.126 -7.578 -7.545 1.000 1 A 96.174 1 ATOM 162 C CA . ASN 21 21 ? A 17.066 -8.677 -7.739 1.000 1 A 96.174 1 ATOM 163 C C . ASN 21 21 ? A 16.729 -9.867 -6.844 1.000 1 A 96.174 1 ATOM 164 O O . ASN 21 21 ? A 17.323 -10.938 -6.979 1.000 1 A 96.174 1 ATOM 165 C CB . ASN 21 21 ? A 18.500 -8.209 -7.483 1.000 1 A 96.174 1 ATOM 166 C CG . ASN 21 21 ? A 18.988 -7.225 -8.528 1.000 1 A 96.174 1 ATOM 167 O OD1 . ASN 21 21 ? A 18.687 -7.362 -9.716 1.000 1 A 96.174 1 ATOM 168 N ND2 . ASN 21 21 ? A 19.744 -6.224 -8.092 1.000 1 A 96.174 1 ATOM 169 N N . TYR 22 22 ? A 15.732 -9.653 -6.020 1.000 1 A 96.968 1 ATOM 170 C CA . TYR 22 22 ? A 15.384 -10.754 -5.128 1.000 1 A 96.968 1 ATOM 171 C C . TYR 22 22 ? A 14.489 -11.766 -5.832 1.000 1 A 96.968 1 ATOM 172 O O . TYR 22 22 ? A 13.753 -11.415 -6.758 1.000 1 A 96.968 1 ATOM 173 C CB . TYR 22 22 ? A 14.686 -10.226 -3.871 1.000 1 A 96.968 1 ATOM 174 C CG . TYR 22 22 ? A 15.560 -9.337 -3.019 1.000 1 A 96.968 1 ATOM 175 C CD1 . TYR 22 22 ? A 16.514 -9.881 -2.162 1.000 1 A 96.968 1 ATOM 176 C CD2 . TYR 22 22 ? A 15.432 -7.953 -3.068 1.000 1 A 96.968 1 ATOM 177 C CE1 . TYR 22 22 ? A 17.320 -9.066 -1.373 1.000 1 A 96.968 1 ATOM 178 C CE2 . TYR 22 22 ? A 16.233 -7.129 -2.284 1.000 1 A 96.968 1 ATOM 179 C CZ . TYR 22 22 ? A 17.173 -7.693 -1.442 1.000 1 A 96.968 1 ATOM 180 O OH . TYR 22 22 ? A 17.968 -6.882 -0.664 1.000 1 A 96.968 1 ATOM 181 N N . TYR 23 23 ? A 14.663 -13.061 -5.393 1.000 1 A 95.698 1 ATOM 182 C CA . TYR 23 23 ? A 14.031 -14.197 -6.055 1.000 1 A 95.698 1 ATOM 183 C C . TYR 23 23 ? A 13.375 -15.125 -5.039 1.000 1 A 95.698 1 ATOM 184 O O . TYR 23 23 ? A 14.064 -15.811 -4.280 1.000 1 A 95.698 1 ATOM 185 C CB . TYR 23 23 ? A 15.058 -14.975 -6.885 1.000 1 A 95.698 1 ATOM 186 C CG . TYR 23 23 ? A 14.482 -16.181 -7.587 1.000 1 A 95.698 1 ATOM 187 C CD1 . TYR 23 23 ? A 14.958 -17.462 -7.315 1.000 1 A 95.698 1 ATOM 188 C CD2 . TYR 23 23 ? A 13.463 -16.042 -8.522 1.000 1 A 95.698 1 ATOM 189 C CE1 . TYR 23 23 ? A 14.432 -18.576 -7.961 1.000 1 A 95.698 1 ATOM 190 C CE2 . TYR 23 23 ? A 12.930 -17.150 -9.174 1.000 1 A 95.698 1 ATOM 191 C CZ . TYR 23 23 ? A 13.420 -18.410 -8.887 1.000 1 A 95.698 1 ATOM 192 O OH . TYR 23 23 ? A 12.896 -19.510 -9.529 1.000 1 A 95.698 1 ATOM 193 N N . TYR 24 24 ? A 11.984 -15.063 -4.978 1.000 1 A 94.462 1 ATOM 194 C CA . TYR 24 24 ? A 11.223 -15.830 -3.998 1.000 1 A 94.462 1 ATOM 195 C C . TYR 24 24 ? A 11.492 -17.322 -4.145 1.000 1 A 94.462 1 ATOM 196 O O . TYR 24 24 ? A 11.529 -18.054 -3.153 1.000 1 A 94.462 1 ATOM 197 C CB . TYR 24 24 ? A 9.724 -15.552 -4.144 1.000 1 A 94.462 1 ATOM 198 C CG . TYR 24 24 ? A 9.245 -14.368 -3.340 1.000 1 A 94.462 1 ATOM 199 C CD1 . TYR 24 24 ? A 8.089 -14.448 -2.566 1.000 1 A 94.462 1 ATOM 200 C CD2 . TYR 24 24 ? A 9.945 -13.166 -3.353 1.000 1 A 94.462 1 ATOM 201 C CE1 . TYR 24 24 ? A 7.642 -13.359 -1.825 1.000 1 A 94.462 1 ATOM 202 C CE2 . TYR 24 24 ? A 9.508 -12.071 -2.616 1.000 1 A 94.462 1 ATOM 203 C CZ . TYR 24 24 ? A 8.358 -12.177 -1.856 1.000 1 A 94.462 1 ATOM 204 O OH . TYR 24 24 ? A 7.920 -11.095 -1.124 1.000 1 A 94.462 1 ATOM 205 N N . GLY 25 25 ? A 11.767 -17.750 -5.284 1.000 1 A 93.866 1 ATOM 206 C CA . GLY 25 25 ? A 11.985 -19.166 -5.534 1.000 1 A 93.866 1 ATOM 207 C C . GLY 25 25 ? A 11.441 -19.625 -6.874 1.000 1 A 93.866 1 ATOM 208 O O . GLY 25 25 ? A 10.671 -18.908 -7.516 1.000 1 A 93.866 1 ATOM 209 N N . GLN 26 26 ? A 11.942 -20.693 -7.276 1.000 1 A 93.835 1 ATOM 210 C CA . GLN 26 26 ? A 11.551 -21.273 -8.556 1.000 1 A 93.835 1 ATOM 211 C C . GLN 26 26 ? A 10.045 -21.507 -8.617 1.000 1 A 93.835 1 ATOM 212 O O . GLN 26 26 ? A 9.471 -22.126 -7.718 1.000 1 A 93.835 1 ATOM 213 C CB . GLN 26 26 ? A 12.297 -22.585 -8.803 1.000 1 A 93.835 1 ATOM 214 C CG . GLN 26 26 ? A 12.089 -23.158 -10.198 1.000 1 A 93.835 1 ATOM 215 C CD . GLN 26 26 ? A 13.057 -24.280 -10.522 1.000 1 A 93.835 1 ATOM 216 O OE1 . GLN 26 26 ? A 13.611 -24.920 -9.623 1.000 1 A 93.835 1 ATOM 217 N NE2 . GLN 26 26 ? A 13.270 -24.525 -11.811 1.000 1 A 93.835 1 ATOM 218 N N . GLY 27 27 ? A 9.387 -20.937 -9.655 1.000 1 A 93.381 1 ATOM 219 C CA . GLY 27 27 ? A 7.977 -21.182 -9.913 1.000 1 A 93.381 1 ATOM 220 C C . GLY 27 27 ? A 7.057 -20.316 -9.074 1.000 1 A 93.381 1 ATOM 221 O O . GLY 27 27 ? A 5.835 -20.371 -9.226 1.000 1 A 93.381 1 ATOM 222 N N . HIS 28 28 ? A 7.691 -19.565 -8.143 1.000 1 A 95.995 1 ATOM 223 C CA . HIS 28 28 ? A 6.861 -18.672 -7.343 1.000 1 A 95.995 1 ATOM 224 C C . HIS 28 28 ? A 6.301 -17.533 -8.189 1.000 1 A 95.995 1 ATOM 225 O O . HIS 28 28 ? A 7.015 -16.958 -9.013 1.000 1 A 95.995 1 ATOM 226 C CB . HIS 28 28 ? A 7.660 -18.108 -6.166 1.000 1 A 95.995 1 ATOM 227 C CG . HIS 28 28 ? A 6.805 -17.534 -5.081 1.000 1 A 95.995 1 ATOM 228 N ND1 . HIS 28 28 ? A 6.214 -16.293 -5.177 1.000 1 A 95.995 1 ATOM 229 C CD2 . HIS 28 28 ? A 6.441 -18.035 -3.877 1.000 1 A 95.995 1 ATOM 230 C CE1 . HIS 28 28 ? A 5.522 -16.055 -4.076 1.000 1 A 95.995 1 ATOM 231 N NE2 . HIS 28 28 ? A 5.644 -17.097 -3.271 1.000 1 A 95.995 1 ATOM 232 N N . PRO 29 29 ? A 5.010 -17.263 -7.961 1.000 1 A 96.091 1 ATOM 233 C CA . PRO 29 29 ? A 4.374 -16.259 -8.817 1.000 1 A 96.091 1 ATOM 234 C C . PRO 29 29 ? A 4.848 -14.839 -8.514 1.000 1 A 96.091 1 ATOM 235 O O . PRO 29 29 ? A 4.783 -13.964 -9.381 1.000 1 A 96.091 1 ATOM 236 C CB . PRO 29 29 ? A 2.885 -16.416 -8.499 1.000 1 A 96.091 1 ATOM 237 C CG . PRO 29 29 ? A 2.848 -17.046 -7.144 1.000 1 A 96.091 1 ATOM 238 C CD . PRO 29 29 ? A 4.029 -17.963 -7.012 1.000 1 A 96.091 1 ATOM 239 N N . MET 30 30 ? A 5.256 -14.499 -7.325 1.000 1 A 96.729 1 ATOM 240 C CA . MET 30 30 ? A 5.719 -13.163 -6.964 1.000 1 A 96.729 1 ATOM 241 C C . MET 30 30 ? A 7.146 -12.931 -7.448 1.000 1 A 96.729 1 ATOM 242 O O . MET 30 30 ? A 8.078 -13.593 -6.987 1.000 1 A 96.729 1 ATOM 243 C CB . MET 30 30 ? A 5.640 -12.957 -5.450 1.000 1 A 96.729 1 ATOM 244 C CG . MET 30 30 ? A 6.037 -11.561 -4.999 1.000 1 A 96.729 1 ATOM 245 S SD . MET 30 30 ? A 4.872 -10.273 -5.592 1.000 1 A 96.729 1 ATOM 246 C CE . MET 30 30 ? A 3.547 -10.451 -4.365 1.000 1 A 96.729 1 ATOM 247 N N . LYS 31 31 ? A 7.225 -11.899 -8.302 1.000 1 A 97.632 1 ATOM 248 C CA . LYS 31 31 ? A 8.535 -11.575 -8.861 1.000 1 A 97.632 1 ATOM 249 C C . LYS 31 31 ? A 8.873 -10.102 -8.652 1.000 1 A 97.632 1 ATOM 250 O O . LYS 31 31 ? A 8.348 -9.233 -9.352 1.000 1 A 97.632 1 ATOM 251 C CB . LYS 31 31 ? A 8.582 -11.917 -10.351 1.000 1 A 97.632 1 ATOM 252 C CG . LYS 31 31 ? A 8.164 -13.344 -10.673 1.000 1 A 97.632 1 ATOM 253 C CD . LYS 31 31 ? A 9.201 -14.352 -10.195 1.000 1 A 97.632 1 ATOM 254 C CE . LYS 31 31 ? A 8.844 -15.769 -10.622 1.000 1 A 97.632 1 ATOM 255 N NZ . LYS 31 31 ? A 9.809 -16.771 -10.079 1.000 1 A 97.632 1 ATOM 256 N N . PRO 32 32 ? A 9.844 -9.858 -7.691 1.000 1 A 97.595 1 ATOM 257 C CA . PRO 32 32 ? A 10.249 -8.470 -7.457 1.000 1 A 97.595 1 ATOM 258 C C . PRO 32 32 ? A 10.823 -7.804 -8.706 1.000 1 A 97.595 1 ATOM 259 O O . PRO 32 32 ? A 10.870 -6.574 -8.788 1.000 1 A 97.595 1 ATOM 260 C CB . PRO 32 32 ? A 11.314 -8.592 -6.365 1.000 1 A 97.595 1 ATOM 261 C CG . PRO 32 32 ? A 10.920 -9.802 -5.581 1.000 1 A 97.595 1 ATOM 262 C CD . PRO 32 32 ? A 10.399 -10.839 -6.534 1.000 1 A 97.595 1 ATOM 263 N N . HIS 33 33 ? A 11.135 -8.557 -9.691 1.000 1 A 98.100 1 ATOM 264 C CA . HIS 33 33 ? A 11.628 -8.063 -10.972 1.000 1 A 98.100 1 ATOM 265 C C . HIS 33 33 ? A 10.684 -7.020 -11.561 1.000 1 A 98.100 1 ATOM 266 O O . HIS 33 33 ? A 11.123 -6.102 -12.257 1.000 1 A 98.100 1 ATOM 267 C CB . HIS 33 33 ? A 11.812 -9.219 -11.957 1.000 1 A 98.100 1 ATOM 268 C CG . HIS 33 33 ? A 12.599 -8.851 -13.174 1.000 1 A 98.100 1 ATOM 269 N ND1 . HIS 33 33 ? A 13.935 -8.515 -13.123 1.000 1 A 98.100 1 ATOM 270 C CD2 . HIS 33 33 ? A 12.237 -8.769 -14.476 1.000 1 A 98.100 1 ATOM 271 C CE1 . HIS 33 33 ? A 14.360 -8.240 -14.345 1.000 1 A 98.100 1 ATOM 272 N NE2 . HIS 33 33 ? A 13.350 -8.388 -15.184 1.000 1 A 98.100 1 ATOM 273 N N . ARG 34 34 ? A 9.377 -7.109 -11.291 1.000 1 A 98.211 1 ATOM 274 C CA . ARG 34 34 ? A 8.371 -6.181 -11.797 1.000 1 A 98.211 1 ATOM 275 C C . ARG 34 34 ? A 8.667 -4.754 -11.346 1.000 1 A 98.211 1 ATOM 276 O O . ARG 34 34 ? A 8.303 -3.794 -12.028 1.000 1 A 98.211 1 ATOM 277 C CB . ARG 34 34 ? A 6.973 -6.598 -11.336 1.000 1 A 98.211 1 ATOM 278 C CG . ARG 34 34 ? A 6.791 -6.575 -9.826 1.000 1 A 98.211 1 ATOM 279 C CD . ARG 34 34 ? A 5.435 -7.132 -9.414 1.000 1 A 98.211 1 ATOM 280 N NE . ARG 34 34 ? A 5.218 -7.012 -7.975 1.000 1 A 98.211 1 ATOM 281 C CZ . ARG 34 34 ? A 4.538 -7.883 -7.235 1.000 1 A 98.211 1 ATOM 282 N NH1 . ARG 34 34 ? A 3.992 -8.961 -7.787 1.000 1 A 98.211 1 ATOM 283 N NH2 . ARG 34 34 ? A 4.401 -7.676 -5.934 1.000 1 A 98.211 1 ATOM 284 N N . ILE 35 35 ? A 9.315 -4.543 -10.168 1.000 1 A 98.434 1 ATOM 285 C CA . ILE 35 35 ? A 9.643 -3.230 -9.622 1.000 1 A 98.434 1 ATOM 286 C C . ILE 35 35 ? A 10.750 -2.587 -10.454 1.000 1 A 98.434 1 ATOM 287 O O . ILE 35 35 ? A 10.686 -1.397 -10.769 1.000 1 A 98.434 1 ATOM 288 C CB . ILE 35 35 ? A 10.071 -3.326 -8.141 1.000 1 A 98.434 1 ATOM 289 C CG1 . ILE 35 35 ? A 8.927 -3.887 -7.289 1.000 1 A 98.434 1 ATOM 290 C CG2 . ILE 35 35 ? A 10.523 -1.958 -7.620 1.000 1 A 98.434 1 ATOM 291 C CD1 . ILE 35 35 ? A 9.373 -4.443 -5.943 1.000 1 A 98.434 1 ATOM 292 N N . ARG 36 36 ? A 11.696 -3.330 -10.844 1.000 1 A 98.013 1 ATOM 293 C CA . ARG 36 36 ? A 12.788 -2.795 -11.651 1.000 1 A 98.013 1 ATOM 294 C C . ARG 36 36 ? A 12.321 -2.491 -13.071 1.000 1 A 98.013 1 ATOM 295 O O . ARG 36 36 ? A 12.778 -1.526 -13.687 1.000 1 A 98.013 1 ATOM 296 C CB . ARG 36 36 ? A 13.963 -3.775 -11.684 1.000 1 A 98.013 1 ATOM 297 C CG . ARG 36 36 ? A 15.190 -3.241 -12.405 1.000 1 A 98.013 1 ATOM 298 C CD . ARG 36 36 ? A 16.346 -4.230 -12.359 1.000 1 A 98.013 1 ATOM 299 N NE . ARG 36 36 ? A 16.237 -5.235 -13.413 1.000 1 A 98.013 1 ATOM 300 C CZ . ARG 36 36 ? A 17.114 -6.213 -13.621 1.000 1 A 98.013 1 ATOM 301 N NH1 . ARG 36 36 ? A 18.187 -6.338 -12.848 1.000 1 A 98.013 1 ATOM 302 N NH2 . ARG 36 36 ? A 16.918 -7.074 -14.609 1.000 1 A 98.013 1 ATOM 303 N N . MET 37 37 ? A 11.458 -3.304 -13.582 1.000 1 A 98.594 1 ATOM 304 C CA . MET 37 37 ? A 10.876 -3.030 -14.893 1.000 1 A 98.594 1 ATOM 305 C C . MET 37 37 ? A 10.079 -1.730 -14.873 1.000 1 A 98.594 1 ATOM 306 O O . MET 37 37 ? A 10.153 -0.937 -15.814 1.000 1 A 98.594 1 ATOM 307 C CB . MET 37 37 ? A 9.978 -4.187 -15.336 1.000 1 A 98.594 1 ATOM 308 C CG . MET 37 37 ? A 10.741 -5.454 -15.689 1.000 1 A 98.594 1 ATOM 309 S SD . MET 37 37 ? A 9.628 -6.879 -16.004 1.000 1 A 98.594 1 ATOM 310 C CE . MET 37 37 ? A 8.778 -6.296 -17.498 1.000 1 A 98.594 1 ATOM 311 N N . THR 38 38 ? A 9.321 -1.522 -13.818 1.000 1 A 98.756 1 ATOM 312 C CA . THR 38 38 ? A 8.572 -0.282 -13.648 1.000 1 A 98.756 1 ATOM 313 C C . THR 38 38 ? A 9.511 0.920 -13.631 1.000 1 A 98.756 1 ATOM 314 O O . THR 38 38 ? A 9.281 1.904 -14.337 1.000 1 A 98.756 1 ATOM 315 C CB . THR 38 38 ? A 7.740 -0.306 -12.352 1.000 1 A 98.756 1 ATOM 316 O OG1 . THR 38 38 ? A 6.774 -1.362 -12.430 1.000 1 A 98.756 1 ATOM 317 C CG2 . THR 38 38 ? A 7.013 1.018 -12.142 1.000 1 A 98.756 1 ATOM 318 N N . HIS 39 39 ? A 10.546 0.864 -12.769 1.000 1 A 98.693 1 ATOM 319 C CA . HIS 39 39 ? A 11.510 1.955 -12.677 1.000 1 A 98.693 1 ATOM 320 C C . HIS 39 39 ? A 12.127 2.261 -14.037 1.000 1 A 98.693 1 ATOM 321 O O . HIS 39 39 ? A 12.273 3.427 -14.410 1.000 1 A 98.693 1 ATOM 322 C CB . HIS 39 39 ? A 12.608 1.616 -11.667 1.000 1 A 98.693 1 ATOM 323 C CG . HIS 39 39 ? A 13.607 2.712 -11.476 1.000 1 A 98.693 1 ATOM 324 N ND1 . HIS 39 39 ? A 13.305 3.888 -10.823 1.000 1 A 98.693 1 ATOM 325 C CD2 . HIS 39 39 ? A 14.904 2.808 -11.851 1.000 1 A 98.693 1 ATOM 326 C CE1 . HIS 39 39 ? A 14.378 4.662 -10.805 1.000 1 A 98.693 1 ATOM 327 N NE2 . HIS 39 39 ? A 15.361 4.030 -11.422 1.000 1 A 98.693 1 ATOM 328 N N . ASN 40 40 ? A 12.516 1.254 -14.820 1.000 1 A 98.558 1 ATOM 329 C CA . ASN 40 40 ? A 13.114 1.435 -16.139 1.000 1 A 98.558 1 ATOM 330 C C . ASN 40 40 ? A 12.162 2.150 -17.093 1.000 1 A 98.558 1 ATOM 331 O O . ASN 40 40 ? A 12.580 3.022 -17.857 1.000 1 A 98.558 1 ATOM 332 C CB . ASN 40 40 ? A 13.541 0.088 -16.725 1.000 1 A 98.558 1 ATOM 333 C CG . ASN 40 40 ? A 14.452 0.236 -17.927 1.000 1 A 98.558 1 ATOM 334 O OD1 . ASN 40 40 ? A 13.995 0.219 -19.073 1.000 1 A 98.558 1 ATOM 335 N ND2 . ASN 40 40 ? A 15.747 0.385 -17.675 1.000 1 A 98.558 1 ATOM 336 N N . LEU 41 41 ? A 10.853 1.824 -17.027 1.000 1 A 98.709 1 ATOM 337 C CA . LEU 41 41 ? A 9.862 2.518 -17.841 1.000 1 A 98.709 1 ATOM 338 C C . LEU 41 41 ? A 9.747 3.982 -17.428 1.000 1 A 98.709 1 ATOM 339 O O . LEU 41 41 ? A 9.640 4.866 -18.281 1.000 1 A 98.709 1 ATOM 340 C CB . LEU 41 41 ? A 8.497 1.834 -17.723 1.000 1 A 98.709 1 ATOM 341 C CG . LEU 41 41 ? A 8.319 0.535 -18.511 1.000 1 A 98.709 1 ATOM 342 C CD1 . LEU 41 41 ? A 6.942 -0.063 -18.243 1.000 1 A 98.709 1 ATOM 343 C CD2 . LEU 41 41 ? A 8.521 0.781 -20.002 1.000 1 A 98.709 1 ATOM 344 N N . LEU 42 42 ? A 9.720 4.186 -16.128 1.000 1 A 98.767 1 ATOM 345 C CA . LEU 42 42 ? A 9.650 5.560 -15.644 1.000 1 A 98.767 1 ATOM 346 C C . LEU 42 42 ? A 10.795 6.394 -16.210 1.000 1 A 98.767 1 ATOM 347 O O . LEU 42 42 ? A 10.589 7.536 -16.628 1.000 1 A 98.767 1 ATOM 348 C CB . LEU 42 42 ? A 9.686 5.593 -14.114 1.000 1 A 98.767 1 ATOM 349 C CG . LEU 42 42 ? A 8.526 4.905 -13.394 1.000 1 A 98.767 1 ATOM 350 C CD1 . LEU 42 42 ? A 8.643 5.107 -11.887 1.000 1 A 98.767 1 ATOM 351 C CD2 . LEU 42 42 ? A 7.190 5.432 -13.907 1.000 1 A 98.767 1 ATOM 352 N N . LEU 43 43 ? A 11.999 5.848 -16.273 1.000 1 A 98.497 1 ATOM 353 C CA . LEU 43 43 ? A 13.169 6.539 -16.805 1.000 1 A 98.497 1 ATOM 354 C C . LEU 43 43 ? A 13.001 6.824 -18.294 1.000 1 A 98.497 1 ATOM 355 O O . LEU 43 43 ? A 13.269 7.937 -18.751 1.000 1 A 98.497 1 ATOM 356 C CB . LEU 43 43 ? A 14.434 5.708 -16.572 1.000 1 A 98.497 1 ATOM 357 C CG . LEU 43 43 ? A 14.848 5.498 -15.115 1.000 1 A 98.497 1 ATOM 358 C CD1 . LEU 43 43 ? A 16.117 4.656 -15.040 1.000 1 A 98.497 1 ATOM 359 C CD2 . LEU 43 43 ? A 15.048 6.839 -14.417 1.000 1 A 98.497 1 ATOM 360 N N . ASN 44 44 ? A 12.482 5.927 -18.989 1.000 1 A 98.588 1 ATOM 361 C CA . ASN 44 44 ? A 12.473 6.020 -20.445 1.000 1 A 98.588 1 ATOM 362 C C . ASN 44 44 ? A 11.274 6.820 -20.948 1.000 1 A 98.588 1 ATOM 363 O O . ASN 44 44 ? A 11.315 7.386 -22.042 1.000 1 A 98.588 1 ATOM 364 C CB . ASN 44 44 ? A 12.481 4.625 -21.073 1.000 1 A 98.588 1 ATOM 365 C CG . ASN 44 44 ? A 13.838 3.954 -20.987 1.000 1 A 98.588 1 ATOM 366 O OD1 . ASN 44 44 ? A 14.754 4.278 -21.747 1.000 1 A 98.588 1 ATOM 367 N ND2 . ASN 44 44 ? A 13.977 3.014 -20.059 1.000 1 A 98.588 1 ATOM 368 N N . TYR 45 45 ? A 10.241 6.907 -20.128 1.000 1 A 98.621 1 ATOM 369 C CA . TYR 45 45 ? A 9.151 7.823 -20.443 1.000 1 A 98.621 1 ATOM 370 C C . TYR 45 45 ? A 9.499 9.248 -20.028 1.000 1 A 98.621 1 ATOM 371 O O . TYR 45 45 ? A 8.780 10.192 -20.365 1.000 1 A 98.621 1 ATOM 372 C CB . TYR 45 45 ? A 7.859 7.378 -19.752 1.000 1 A 98.621 1 ATOM 373 C CG . TYR 45 45 ? A 7.023 6.432 -20.579 1.000 1 A 98.621 1 ATOM 374 C CD1 . TYR 45 45 ? A 6.301 6.889 -21.680 1.000 1 A 98.621 1 ATOM 375 C CD2 . TYR 45 45 ? A 6.951 5.080 -20.262 1.000 1 A 98.621 1 ATOM 376 C CE1 . TYR 45 45 ? A 5.528 6.022 -22.444 1.000 1 A 98.621 1 ATOM 377 C CE2 . TYR 45 45 ? A 6.181 4.203 -21.019 1.000 1 A 98.621 1 ATOM 378 C CZ . TYR 45 45 ? A 5.475 4.682 -22.107 1.000 1 A 98.621 1 ATOM 379 O OH . TYR 45 45 ? A 4.711 3.819 -22.859 1.000 1 A 98.621 1 ATOM 380 N N . GLY 46 46 ? A 10.551 9.426 -19.243 1.000 1 A 98.466 1 ATOM 381 C CA . GLY 46 46 ? A 11.010 10.736 -18.809 1.000 1 A 98.466 1 ATOM 382 C C . GLY 46 46 ? A 10.273 11.252 -17.587 1.000 1 A 98.466 1 ATOM 383 O O . GLY 46 46 ? A 10.314 12.447 -17.290 1.000 1 A 98.466 1 ATOM 384 N N . LEU 47 47 ? A 9.572 10.375 -16.873 1.000 1 A 98.488 1 ATOM 385 C CA . LEU 47 47 ? A 8.769 10.780 -15.724 1.000 1 A 98.488 1 ATOM 386 C C . LEU 47 47 ? A 9.659 11.182 -14.553 1.000 1 A 98.488 1 ATOM 387 O O . LEU 47 47 ? A 9.243 11.956 -13.688 1.000 1 A 98.488 1 ATOM 388 C CB . LEU 47 47 ? A 7.829 9.648 -15.301 1.000 1 A 98.488 1 ATOM 389 C CG . LEU 47 47 ? A 6.737 9.264 -16.300 1.000 1 A 98.488 1 ATOM 390 C CD1 . LEU 47 47 ? A 5.910 8.102 -15.760 1.000 1 A 98.488 1 ATOM 391 C CD2 . LEU 47 47 ? A 5.847 10.464 -16.607 1.000 1 A 98.488 1 ATOM 392 N N . TYR 48 48 ? A 10.910 10.712 -14.486 1.000 1 A 97.771 1 ATOM 393 C CA . TYR 48 48 ? A 11.838 11.009 -13.401 1.000 1 A 97.771 1 ATOM 394 C C . TYR 48 48 ? A 12.118 12.505 -13.317 1.000 1 A 97.771 1 ATOM 395 O O . TYR 48 48 ? A 12.503 13.012 -12.260 1.000 1 A 97.771 1 ATOM 396 C CB . TYR 48 48 ? A 13.150 10.242 -13.590 1.000 1 A 97.771 1 ATOM 397 C CG . TYR 48 48 ? A 14.018 10.789 -14.698 1.000 1 A 97.771 1 ATOM 398 C CD1 . TYR 48 48 ? A 13.804 10.420 -16.024 1.000 1 A 97.771 1 ATOM 399 C CD2 . TYR 48 48 ? A 15.055 11.674 -14.420 1.000 1 A 97.771 1 ATOM 400 C CE1 . TYR 48 48 ? A 14.602 10.920 -17.047 1.000 1 A 97.771 1 ATOM 401 C CE2 . TYR 48 48 ? A 15.860 12.179 -15.436 1.000 1 A 97.771 1 ATOM 402 C CZ . TYR 48 48 ? A 15.626 11.798 -16.744 1.000 1 A 97.771 1 ATOM 403 O OH . TYR 48 48 ? A 16.419 12.296 -17.753 1.000 1 A 97.771 1 ATOM 404 N N . ARG 49 49 ? A 11.944 13.227 -14.399 1.000 1 A 97.604 1 ATOM 405 C CA . ARG 49 49 ? A 12.219 14.659 -14.472 1.000 1 A 97.604 1 ATOM 406 C C . ARG 49 49 ? A 11.145 15.460 -13.743 1.000 1 A 97.604 1 ATOM 407 O O . ARG 49 49 ? A 11.342 16.638 -13.439 1.000 1 A 97.604 1 ATOM 408 C CB . ARG 49 49 ? A 12.314 15.115 -15.930 1.000 1 A 97.604 1 ATOM 409 C CG . ARG 49 49 ? A 13.490 14.517 -16.686 1.000 1 A 97.604 1 ATOM 410 C CD . ARG 49 49 ? A 13.500 14.950 -18.146 1.000 1 A 97.604 1 ATOM 411 N NE . ARG 49 49 ? A 14.533 14.254 -18.907 1.000 1 A 97.604 1 ATOM 412 C CZ . ARG 49 49 ? A 14.732 14.390 -20.215 1.000 1 A 97.604 1 ATOM 413 N NH1 . ARG 49 49 ? A 13.969 15.204 -20.936 1.000 1 A 97.604 1 ATOM 414 N NH2 . ARG 49 49 ? A 15.701 13.708 -20.808 1.000 1 A 97.604 1 ATOM 415 N N . LYS 50 50 ? A 10.057 14.793 -13.359 1.000 1 A 97.902 1 ATOM 416 C CA . LYS 50 50 ? A 8.919 15.510 -12.791 1.000 1 A 97.902 1 ATOM 417 C C . LYS 50 50 ? A 8.662 15.079 -11.349 1.000 1 A 97.902 1 ATOM 418 O O . LYS 50 50 ? A 7.611 15.385 -10.783 1.000 1 A 97.902 1 ATOM 419 C CB . LYS 50 50 ? A 7.665 15.283 -13.637 1.000 1 A 97.902 1 ATOM 420 C CG . LYS 50 50 ? A 7.782 15.796 -15.065 1.000 1 A 97.902 1 ATOM 421 C CD . LYS 50 50 ? A 6.469 15.643 -15.822 1.000 1 A 97.902 1 ATOM 422 C CE . LYS 50 50 ? A 6.553 16.248 -17.217 1.000 1 A 97.902 1 ATOM 423 N NZ . LYS 50 50 ? A 5.249 16.159 -17.939 1.000 1 A 97.902 1 ATOM 424 N N . MET 51 51 ? A 9.588 14.268 -10.813 1.000 1 A 98.016 1 ATOM 425 C CA . MET 51 51 ? A 9.483 13.825 -9.425 1.000 1 A 98.016 1 ATOM 426 C C . MET 51 51 ? A 10.861 13.736 -8.777 1.000 1 A 98.016 1 ATOM 427 O O . MET 51 51 ? A 11.881 13.789 -9.467 1.000 1 A 98.016 1 ATOM 428 C CB . MET 51 51 ? A 8.779 12.470 -9.345 1.000 1 A 98.016 1 ATOM 429 C CG . MET 51 51 ? A 9.530 11.346 -10.041 1.000 1 A 98.016 1 ATOM 430 S SD . MET 51 51 ? A 8.603 9.763 -10.020 1.000 1 A 98.016 1 ATOM 431 C CE . MET 51 51 ? A 9.731 8.719 -10.984 1.000 1 A 98.016 1 ATOM 432 N N . GLU 52 52 ? A 10.899 13.686 -7.546 1.000 1 A 98.063 1 ATOM 433 C CA . GLU 52 52 ? A 12.126 13.435 -6.795 1.000 1 A 98.063 1 ATOM 434 C C . GLU 52 52 ? A 12.278 11.952 -6.468 1.000 1 A 98.063 1 ATOM 435 O O . GLU 52 52 ? A 11.366 11.336 -5.914 1.000 1 A 98.063 1 ATOM 436 C CB . GLU 52 52 ? A 12.146 14.262 -5.507 1.000 1 A 98.063 1 ATOM 437 C CG . GLU 52 52 ? A 12.156 15.765 -5.741 1.000 1 A 98.063 1 ATOM 438 C CD . GLU 52 52 ? A 12.086 16.574 -4.456 1.000 1 A 98.063 1 ATOM 439 O OE1 . GLU 52 52 ? A 12.381 17.790 -4.487 1.000 1 A 98.063 1 ATOM 440 O OE2 . GLU 52 52 ? A 11.734 15.986 -3.409 1.000 1 A 98.063 1 ATOM 441 N N . ILE 53 53 ? A 13.425 11.399 -6.805 1.000 1 A 98.375 1 ATOM 442 C CA . ILE 53 53 ? A 13.679 9.982 -6.570 1.000 1 A 98.375 1 ATOM 443 C C . ILE 53 53 ? A 14.711 9.821 -5.456 1.000 1 A 98.375 1 ATOM 444 O O . ILE 53 53 ? A 15.785 10.426 -5.503 1.000 1 A 98.375 1 ATOM 445 C CB . ILE 53 53 ? A 14.162 9.274 -7.855 1.000 1 A 98.375 1 ATOM 446 C CG1 . ILE 53 53 ? A 13.130 9.439 -8.976 1.000 1 A 98.375 1 ATOM 447 C CG2 . ILE 53 53 ? A 14.443 7.793 -7.583 1.000 1 A 98.375 1 ATOM 448 C CD1 . ILE 53 53 ? A 13.559 8.834 -10.306 1.000 1 A 98.375 1 ATOM 449 N N . TYR 54 54 ? A 14.309 8.991 -4.524 1.000 1 A 98.190 1 ATOM 450 C CA . TYR 54 54 ? A 15.171 8.757 -3.371 1.000 1 A 98.190 1 ATOM 451 C C . TYR 54 54 ? A 15.476 7.273 -3.210 1.000 1 A 98.190 1 ATOM 452 O O . TYR 54 54 ? A 14.672 6.422 -3.596 1.000 1 A 98.190 1 ATOM 453 C CB . TYR 54 54 ? A 14.519 9.297 -2.094 1.000 1 A 98.190 1 ATOM 454 C CG . TYR 54 54 ? A 14.295 10.790 -2.112 1.000 1 A 98.190 1 ATOM 455 C CD1 . TYR 54 54 ? A 15.325 11.673 -1.795 1.000 1 A 98.190 1 ATOM 456 C CD2 . TYR 54 54 ? A 13.053 11.320 -2.445 1.000 1 A 98.190 1 ATOM 457 C CE1 . TYR 54 54 ? A 15.122 13.049 -1.808 1.000 1 A 98.190 1 ATOM 458 C CE2 . TYR 54 54 ? A 12.839 12.694 -2.461 1.000 1 A 98.190 1 ATOM 459 C CZ . TYR 54 54 ? A 13.878 13.549 -2.142 1.000 1 A 98.190 1 ATOM 460 O OH . TYR 54 54 ? A 13.671 14.911 -2.157 1.000 1 A 98.190 1 ATOM 461 N N . ARG 55 55 ? A 16.584 7.132 -2.709 1.000 1 A 97.150 1 ATOM 462 C CA . ARG 55 55 ? A 16.902 5.798 -2.211 1.000 1 A 97.150 1 ATOM 463 C C . ARG 55 55 ? A 16.432 5.624 -0.771 1.000 1 A 97.150 1 ATOM 464 O O . ARG 55 55 ? A 16.754 6.441 0.095 1.000 1 A 97.150 1 ATOM 465 C CB . ARG 55 55 ? A 18.405 5.531 -2.309 1.000 1 A 97.150 1 ATOM 466 C CG . ARG 55 55 ? A 18.791 4.082 -2.056 1.000 1 A 97.150 1 ATOM 467 C CD . ARG 55 55 ? A 20.277 3.845 -2.289 1.000 1 A 97.150 1 ATOM 468 N NE . ARG 55 55 ? A 20.645 2.453 -2.048 1.000 1 A 97.150 1 ATOM 469 C CZ . ARG 55 55 ? A 21.832 1.923 -2.332 1.000 1 A 97.150 1 ATOM 470 N NH1 . ARG 55 55 ? A 22.792 2.662 -2.875 1.000 1 A 97.150 1 ATOM 471 N NH2 . ARG 55 55 ? A 22.060 0.644 -2.072 1.000 1 A 97.150 1 ATOM 472 N N . PRO 56 56 ? A 15.649 4.522 -0.508 1.000 1 A 89.538 1 ATOM 473 C CA . PRO 56 56 ? A 15.125 4.344 0.848 1.000 1 A 89.538 1 ATOM 474 C C . PRO 56 56 ? A 16.212 3.986 1.859 1.000 1 A 89.538 1 ATOM 475 O O . PRO 56 56 ? A 17.188 3.317 1.511 1.000 1 A 89.538 1 ATOM 476 C CB . PRO 56 56 ? A 14.125 3.196 0.692 1.000 1 A 89.538 1 ATOM 477 C CG . PRO 56 56 ? A 14.635 2.400 -0.465 1.000 1 A 89.538 1 ATOM 478 C CD . PRO 56 56 ? A 15.315 3.334 -1.424 1.000 1 A 89.538 1 ATOM 479 N N . HIS 57 57 ? A 16.072 4.531 3.067 1.000 1 A 93.324 1 ATOM 480 C CA . HIS 57 57 ? A 16.889 3.942 4.122 1.000 1 A 93.324 1 ATOM 481 C C . HIS 57 57 ? A 16.420 2.530 4.459 1.000 1 A 93.324 1 ATOM 482 O O . HIS 57 57 ? A 15.240 2.209 4.297 1.000 1 A 93.324 1 ATOM 483 C CB . HIS 57 57 ? A 16.860 4.818 5.375 1.000 1 A 93.324 1 ATOM 484 C CG . HIS 57 57 ? A 15.584 4.715 6.150 1.000 1 A 93.324 1 ATOM 485 N ND1 . HIS 57 57 ? A 14.454 5.431 5.819 1.000 1 A 93.324 1 ATOM 486 C CD2 . HIS 57 57 ? A 15.262 3.977 7.238 1.000 1 A 93.324 1 ATOM 487 C CE1 . HIS 57 57 ? A 13.488 5.137 6.674 1.000 1 A 93.324 1 ATOM 488 N NE2 . HIS 57 57 ? A 13.953 4.257 7.545 1.000 1 A 93.324 1 ATOM 489 N N . LYS 58 58 ? A 17.328 1.706 4.830 1.000 1 A 97.250 1 ATOM 490 C CA . LYS 58 58 ? A 16.968 0.352 5.240 1.000 1 A 97.250 1 ATOM 491 C C . LYS 58 58 ? A 16.334 0.347 6.628 1.000 1 A 97.250 1 ATOM 492 O O . LYS 58 58 ? A 16.929 0.838 7.589 1.000 1 A 97.250 1 ATOM 493 C CB . LYS 58 58 ? A 18.196 -0.560 5.221 1.000 1 A 97.250 1 ATOM 494 C CG . LYS 58 58 ? A 18.781 -0.783 3.834 1.000 1 A 97.250 1 ATOM 495 C CD . LYS 58 58 ? A 19.983 -1.718 3.878 1.000 1 A 97.250 1 ATOM 496 C CE . LYS 58 58 ? A 20.581 -1.926 2.493 1.000 1 A 97.250 1 ATOM 497 N NZ . LYS 58 58 ? A 21.777 -2.819 2.535 1.000 1 A 97.250 1 ATOM 498 N N . ALA 59 59 ? A 15.122 -0.119 6.708 1.000 1 A 98.013 1 ATOM 499 C CA . ALA 59 59 ? A 14.461 -0.206 8.008 1.000 1 A 98.013 1 ATOM 500 C C . ALA 59 59 ? A 15.230 -1.124 8.954 1.000 1 A 98.013 1 ATOM 501 O O . ALA 59 59 ? A 15.613 -2.234 8.576 1.000 1 A 98.013 1 ATOM 502 C CB . ALA 59 59 ? A 13.026 -0.698 7.843 1.000 1 A 98.013 1 ATOM 503 N N . ASN 60 60 ? A 15.502 -0.570 10.086 1.000 1 A 97.459 1 ATOM 504 C CA . ASN 60 60 ? A 16.160 -1.425 11.070 1.000 1 A 97.459 1 ATOM 505 C C . ASN 60 60 ? A 15.148 -2.233 11.876 1.000 1 A 97.459 1 ATOM 506 O O . ASN 60 60 ? A 13.939 -2.070 11.705 1.000 1 A 97.459 1 ATOM 507 C CB . ASN 60 60 ? A 17.039 -0.590 12.004 1.000 1 A 97.459 1 ATOM 508 C CG . ASN 60 60 ? A 16.250 0.456 12.767 1.000 1 A 97.459 1 ATOM 509 O OD1 . ASN 60 60 ? A 15.163 0.179 13.281 1.000 1 A 97.459 1 ATOM 510 N ND2 . ASN 60 60 ? A 16.792 1.665 12.848 1.000 1 A 97.459 1 ATOM 511 N N . ALA 61 61 ? A 15.606 -3.182 12.657 1.000 1 A 97.264 1 ATOM 512 C CA . ALA 61 61 ? A 14.762 -4.092 13.427 1.000 1 A 97.264 1 ATOM 513 C C . ALA 61 61 ? A 13.853 -3.322 14.381 1.000 1 A 97.264 1 ATOM 514 O O . ALA 61 61 ? A 12.695 -3.695 14.582 1.000 1 A 97.264 1 ATOM 515 C CB . ALA 61 61 ? A 15.622 -5.086 14.204 1.000 1 A 97.264 1 ATOM 516 N N . GLU 62 62 ? A 14.411 -2.214 14.867 1.000 1 A 96.137 1 ATOM 517 C CA . GLU 62 62 ? A 13.636 -1.408 15.805 1.000 1 A 96.137 1 ATOM 518 C C . GLU 62 62 ? A 12.413 -0.796 15.127 1.000 1 A 96.137 1 ATOM 519 O O . GLU 62 62 ? A 11.322 -0.779 15.700 1.000 1 A 96.137 1 ATOM 520 C CB . GLU 62 62 ? A 14.506 -0.305 16.413 1.000 1 A 96.137 1 ATOM 521 C CG . GLU 62 62 ? A 13.807 0.503 17.496 1.000 1 A 96.137 1 ATOM 522 C CD . GLU 62 62 ? A 14.686 1.589 18.097 1.000 1 A 96.137 1 ATOM 523 O OE1 . GLU 62 62 ? A 14.196 2.364 18.949 1.000 1 A 96.137 1 ATOM 524 O OE2 . GLU 62 62 ? A 15.873 1.666 17.710 1.000 1 A 96.137 1 ATOM 525 N N . GLU 63 63 ? A 12.639 -0.375 13.954 1.000 1 A 97.088 1 ATOM 526 C CA . GLU 63 63 ? A 11.530 0.192 13.193 1.000 1 A 97.088 1 ATOM 527 C C . GLU 63 63 ? A 10.476 -0.867 12.881 1.000 1 A 97.088 1 ATOM 528 O O . GLU 63 63 ? A 9.276 -0.613 13.009 1.000 1 A 97.088 1 ATOM 529 C CB . GLU 63 63 ? A 12.037 0.827 11.896 1.000 1 A 97.088 1 ATOM 530 C CG . GLU 63 63 ? A 12.835 2.105 12.108 1.000 1 A 97.088 1 ATOM 531 C CD . GLU 63 63 ? A 13.462 2.640 10.830 1.000 1 A 97.088 1 ATOM 532 O OE1 . GLU 63 63 ? A 13.095 3.755 10.395 1.000 1 A 97.088 1 ATOM 533 O OE2 . GLU 63 63 ? A 14.325 1.938 10.258 1.000 1 A 97.088 1 ATOM 534 N N . MET 64 64 ? A 10.860 -2.049 12.510 1.000 1 A 98.381 1 ATOM 535 C CA . MET 64 64 ? A 9.939 -3.111 12.116 1.000 1 A 98.381 1 ATOM 536 C C . MET 64 64 ? A 9.168 -3.637 13.322 1.000 1 A 98.381 1 ATOM 537 O O . MET 64 64 ? A 8.010 -4.039 13.196 1.000 1 A 98.381 1 ATOM 538 C CB . MET 64 64 ? A 10.695 -4.256 11.439 1.000 1 A 98.381 1 ATOM 539 C CG . MET 64 64 ? A 11.248 -3.899 10.069 1.000 1 A 98.381 1 ATOM 540 S SD . MET 64 64 ? A 12.123 -5.304 9.277 1.000 1 A 98.381 1 ATOM 541 C CE . MET 64 64 ? A 12.823 -4.468 7.826 1.000 1 A 98.381 1 ATOM 542 N N . THR 65 65 ? A 9.816 -3.522 14.509 1.000 1 A 98.144 1 ATOM 543 C CA . THR 65 65 ? A 9.201 -4.087 15.704 1.000 1 A 98.144 1 ATOM 544 C C . THR 65 65 ? A 8.220 -3.098 16.328 1.000 1 A 98.144 1 ATOM 545 O O . THR 65 65 ? A 7.615 -3.385 17.362 1.000 1 A 98.144 1 ATOM 546 C CB . THR 65 65 ? A 10.264 -4.484 16.745 1.000 1 A 98.144 1 ATOM 547 O OG1 . THR 65 65 ? A 11.105 -3.355 17.015 1.000 1 A 98.144 1 ATOM 548 C CG2 . THR 65 65 ? A 11.127 -5.635 16.238 1.000 1 A 98.144 1 ATOM 549 N N . LYS 66 66 ? A 8.035 -1.938 15.702 1.000 1 A 97.158 1 ATOM 550 C CA . LYS 66 66 ? A 6.947 -1.068 16.138 1.000 1 A 97.158 1 ATOM 551 C C . LYS 66 66 ? A 5.594 -1.754 15.974 1.000 1 A 97.158 1 ATOM 552 O O . LYS 66 66 ? A 4.647 -1.453 16.703 1.000 1 A 97.158 1 ATOM 553 C CB . LYS 66 66 ? A 6.966 0.247 15.358 1.000 1 A 97.158 1 ATOM 554 C CG . LYS 66 66 ? A 8.088 1.192 15.763 1.000 1 A 97.158 1 ATOM 555 C CD . LYS 66 66 ? A 8.038 2.492 14.971 1.000 1 A 97.158 1 ATOM 556 C CE . LYS 66 66 ? A 9.184 3.421 15.346 1.000 1 A 97.158 1 ATOM 557 N NZ . LYS 66 66 ? A 9.246 4.615 14.451 1.000 1 A 97.158 1 ATOM 558 N N . TYR 67 67 ? A 5.515 -2.656 15.072 1.000 1 A 97.961 1 ATOM 559 C CA . TYR 67 67 ? A 4.302 -3.447 14.897 1.000 1 A 97.961 1 ATOM 560 C C . TYR 67 67 ? A 4.586 -4.932 15.088 1.000 1 A 97.961 1 ATOM 561 O O . TYR 67 67 ? A 3.903 -5.606 15.862 1.000 1 A 97.961 1 ATOM 562 C CB . TYR 67 67 ? A 3.698 -3.205 13.510 1.000 1 A 97.961 1 ATOM 563 C CG . TYR 67 67 ? A 2.602 -4.177 13.147 1.000 1 A 97.961 1 ATOM 564 C CD1 . TYR 67 67 ? A 2.747 -5.049 12.071 1.000 1 A 97.961 1 ATOM 565 C CD2 . TYR 67 67 ? A 1.421 -4.226 13.879 1.000 1 A 97.961 1 ATOM 566 C CE1 . TYR 67 67 ? A 1.739 -5.946 11.731 1.000 1 A 97.961 1 ATOM 567 C CE2 . TYR 67 67 ? A 0.406 -5.118 13.548 1.000 1 A 97.961 1 ATOM 568 C CZ . TYR 67 67 ? A 0.575 -5.973 12.475 1.000 1 A 97.961 1 ATOM 569 O OH . TYR 67 67 ? A -0.426 -6.859 12.143 1.000 1 A 97.961 1 ATOM 570 N N . HIS 68 68 ? A 5.530 -5.457 14.478 1.000 1 A 98.358 1 ATOM 571 C CA . HIS 68 68 ? A 5.787 -6.892 14.512 1.000 1 A 98.358 1 ATOM 572 C C . HIS 68 68 ? A 6.445 -7.303 15.825 1.000 1 A 98.358 1 ATOM 573 O O . HIS 68 68 ? A 7.123 -6.495 16.464 1.000 1 A 98.358 1 ATOM 574 C CB . HIS 68 68 ? A 6.667 -7.307 13.332 1.000 1 A 98.358 1 ATOM 575 C CG . HIS 68 68 ? A 5.975 -7.221 12.009 1.000 1 A 98.358 1 ATOM 576 N ND1 . HIS 68 68 ? A 5.001 -8.113 11.619 1.000 1 A 98.358 1 ATOM 577 C CD2 . HIS 68 68 ? A 6.117 -6.344 10.987 1.000 1 A 98.358 1 ATOM 578 C CE1 . HIS 68 68 ? A 4.573 -7.789 10.410 1.000 1 A 98.358 1 ATOM 579 N NE2 . HIS 68 68 ? A 5.234 -6.718 10.004 1.000 1 A 98.358 1 ATOM 580 N N . SER 69 69 ? A 6.225 -8.555 16.254 1.000 1 A 98.120 1 ATOM 581 C CA . SER 69 69 ? A 6.827 -9.042 17.491 1.000 1 A 98.120 1 ATOM 582 C C . SER 69 69 ? A 8.342 -9.156 17.360 1.000 1 A 98.120 1 ATOM 583 O O . SER 69 69 ? A 8.859 -9.420 16.273 1.000 1 A 98.120 1 ATOM 584 C CB . SER 69 69 ? A 6.237 -10.398 17.878 1.000 1 A 98.120 1 ATOM 585 O OG . SER 69 69 ? A 6.635 -11.401 16.958 1.000 1 A 98.120 1 ATOM 586 N N . ASP 70 70 ? A 9.021 -8.956 18.454 1.000 1 A 97.987 1 ATOM 587 C CA . ASP 70 70 ? A 10.480 -8.997 18.496 1.000 1 A 97.987 1 ATOM 588 C C . ASP 70 70 ? A 11.005 -10.350 18.022 1.000 1 A 97.987 1 ATOM 589 O O . ASP 70 70 ? A 11.940 -10.414 17.221 1.000 1 A 97.987 1 ATOM 590 C CB . ASP 70 70 ? A 10.985 -8.703 19.910 1.000 1 A 97.987 1 ATOM 591 C CG . ASP 70 70 ? A 10.707 -7.278 20.354 1.000 1 A 97.987 1 ATOM 592 O OD1 . ASP 70 70 ? A 10.866 -6.343 19.540 1.000 1 A 97.987 1 ATOM 593 O OD2 . ASP 70 70 ? A 10.328 -7.088 21.530 1.000 1 A 97.987 1 ATOM 594 N N . ASP 71 71 ? A 10.355 -11.461 18.496 1.000 1 A 98.265 1 ATOM 595 C CA . ASP 71 71 ? A 10.842 -12.795 18.157 1.000 1 A 98.265 1 ATOM 596 C C . ASP 71 71 ? A 10.656 -13.086 16.670 1.000 1 A 98.265 1 ATOM 597 O O . ASP 71 71 ? A 11.513 -13.712 16.043 1.000 1 A 98.265 1 ATOM 598 C CB . ASP 71 71 ? A 10.125 -13.856 18.995 1.000 1 A 98.265 1 ATOM 599 C CG . ASP 71 71 ? A 8.612 -13.756 18.910 1.000 1 A 98.265 1 ATOM 600 O OD1 . ASP 71 71 ? A 8.095 -12.723 18.434 1.000 1 A 98.265 1 ATOM 601 O OD2 . ASP 71 71 ? A 7.931 -14.718 19.327 1.000 1 A 98.265 1 ATOM 602 N N . TYR 72 72 ? A 9.704 -12.570 16.109 1.000 1 A 98.548 1 ATOM 603 C CA . TYR 72 72 ? A 9.440 -12.777 14.690 1.000 1 A 98.548 1 ATOM 604 C C . TYR 72 72 ? A 10.483 -12.071 13.832 1.000 1 A 98.548 1 ATOM 605 O O . TYR 72 72 ? A 11.067 -12.677 12.931 1.000 1 A 98.548 1 ATOM 606 C CB . TYR 72 72 ? A 8.038 -12.277 14.325 1.000 1 A 98.548 1 ATOM 607 C CG . TYR 72 72 ? A 7.721 -12.381 12.853 1.000 1 A 98.548 1 ATOM 608 C CD1 . TYR 72 72 ? A 7.253 -11.279 12.142 1.000 1 A 98.548 1 ATOM 609 C CD2 . TYR 72 72 ? A 7.887 -13.582 12.171 1.000 1 A 98.548 1 ATOM 610 C CE1 . TYR 72 72 ? A 6.958 -11.370 10.786 1.000 1 A 98.548 1 ATOM 611 C CE2 . TYR 72 72 ? A 7.595 -13.685 10.815 1.000 1 A 98.548 1 ATOM 612 C CZ . TYR 72 72 ? A 7.132 -12.576 10.132 1.000 1 A 98.548 1 ATOM 613 O OH . TYR 72 72 ? A 6.841 -12.672 8.789 1.000 1 A 98.548 1 ATOM 614 N N . ILE 73 73 ? A 10.750 -10.784 14.134 1.000 1 A 98.623 1 ATOM 615 C CA . ILE 73 73 ? A 11.720 -10.012 13.365 1.000 1 A 98.623 1 ATOM 616 C C . ILE 73 73 ? A 13.118 -10.593 13.566 1.000 1 A 98.623 1 ATOM 617 O O . ILE 73 73 ? A 13.906 -10.671 12.621 1.000 1 A 98.623 1 ATOM 618 C CB . ILE 73 73 ? A 11.697 -8.519 13.764 1.000 1 A 98.623 1 ATOM 619 C CG1 . ILE 73 73 ? A 10.344 -7.892 13.409 1.000 1 A 98.623 1 ATOM 620 C CG2 . ILE 73 73 ? A 12.845 -7.763 13.089 1.000 1 A 98.623 1 ATOM 621 C CD1 . ILE 73 73 ? A 9.954 -8.048 11.946 1.000 1 A 98.623 1 ATOM 622 N N . LYS 74 74 ? A 13.393 -11.034 14.759 1.000 1 A 98.348 1 ATOM 623 C CA . LYS 74 74 ? A 14.666 -11.701 15.017 1.000 1 A 98.348 1 ATOM 624 C C . LYS 74 74 ? A 14.810 -12.960 14.167 1.000 1 A 98.348 1 ATOM 625 O O . LYS 74 74 ? A 15.886 -13.235 13.632 1.000 1 A 98.348 1 ATOM 626 C CB . LYS 74 74 ? A 14.797 -12.052 16.500 1.000 1 A 98.348 1 ATOM 627 C CG . LYS 74 74 ? A 16.234 -12.141 16.991 1.000 1 A 98.348 1 ATOM 628 C CD . LYS 74 74 ? A 16.298 -12.454 18.480 1.000 1 A 98.348 1 ATOM 629 C CE . LYS 74 74 ? A 17.734 -12.480 18.986 1.000 1 A 98.348 1 ATOM 630 N NZ . LYS 74 74 ? A 17.796 -12.635 20.470 1.000 1 A 98.348 1 ATOM 631 N N . PHE 75 75 ? A 13.751 -13.720 14.083 1.000 1 A 98.388 1 ATOM 632 C CA . PHE 75 75 ? A 13.721 -14.906 13.235 1.000 1 A 98.388 1 ATOM 633 C C . PHE 75 75 ? A 14.002 -14.539 11.783 1.000 1 A 98.388 1 ATOM 634 O O . PHE 75 75 ? A 14.848 -15.158 11.133 1.000 1 A 98.388 1 ATOM 635 C CB . PHE 75 75 ? A 12.367 -15.614 13.345 1.000 1 A 98.388 1 ATOM 636 C CG . PHE 75 75 ? A 12.110 -16.606 12.244 1.000 1 A 98.388 1 ATOM 637 C CD1 . PHE 75 75 ? A 11.227 -16.309 11.213 1.000 1 A 98.388 1 ATOM 638 C CD2 . PHE 75 75 ? A 12.752 -17.838 12.239 1.000 1 A 98.388 1 ATOM 639 C CE1 . PHE 75 75 ? A 10.986 -17.225 10.192 1.000 1 A 98.388 1 ATOM 640 C CE2 . PHE 75 75 ? A 12.517 -18.759 11.222 1.000 1 A 98.388 1 ATOM 641 C CZ . PHE 75 75 ? A 11.633 -18.451 10.200 1.000 1 A 98.388 1 ATOM 642 N N . LEU 76 76 ? A 13.292 -13.560 11.194 1.000 1 A 98.404 1 ATOM 643 C CA . LEU 76 76 ? A 13.453 -13.158 9.801 1.000 1 A 98.404 1 ATOM 644 C C . LEU 76 76 ? A 14.884 -12.707 9.527 1.000 1 A 98.404 1 ATOM 645 O O . LEU 76 76 ? A 15.414 -12.936 8.437 1.000 1 A 98.404 1 ATOM 646 C CB . LEU 76 76 ? A 12.475 -12.034 9.451 1.000 1 A 98.404 1 ATOM 647 C CG . LEU 76 76 ? A 10.997 -12.419 9.379 1.000 1 A 98.404 1 ATOM 648 C CD1 . LEU 76 76 ? A 10.153 -11.212 8.982 1.000 1 A 98.404 1 ATOM 649 C CD2 . LEU 76 76 ? A 10.790 -13.568 8.398 1.000 1 A 98.404 1 ATOM 650 N N . ARG 77 77 ? A 15.453 -12.070 10.558 1.000 1 A 98.001 1 ATOM 651 C CA . ARG 77 77 ? A 16.824 -11.587 10.431 1.000 1 A 98.001 1 ATOM 652 C C . ARG 77 77 ? A 17.811 -12.749 10.371 1.000 1 A 98.001 1 ATOM 653 O O . ARG 77 77 ? A 18.843 -12.660 9.704 1.000 1 A 98.001 1 ATOM 654 C CB . ARG 77 77 ? A 17.178 -10.659 11.595 1.000 1 A 98.001 1 ATOM 655 C CG . ARG 77 77 ? A 18.529 -9.977 11.451 1.000 1 A 98.001 1 ATOM 656 C CD . ARG 77 77 ? A 18.746 -8.923 12.528 1.000 1 A 98.001 1 ATOM 657 N NE . ARG 77 77 ? A 18.740 -9.510 13.865 1.000 1 A 98.001 1 ATOM 658 C CZ . ARG 77 77 ? A 18.605 -8.821 14.995 1.000 1 A 98.001 1 ATOM 659 N NH1 . ARG 77 77 ? A 18.463 -7.500 14.971 1.000 1 A 98.001 1 ATOM 660 N NH2 . ARG 77 77 ? A 18.613 -9.456 16.158 1.000 1 A 98.001 1 ATOM 661 N N . SER 78 78 ? A 17.470 -13.854 10.949 1.000 1 A 97.920 1 ATOM 662 C CA . SER 78 78 ? A 18.409 -14.954 11.150 1.000 1 A 97.920 1 ATOM 663 C C . SER 78 78 ? A 18.248 -16.021 10.073 1.000 1 A 97.920 1 ATOM 664 O O . SER 78 78 ? A 19.232 -16.620 9.634 1.000 1 A 97.920 1 ATOM 665 C CB . SER 78 78 ? A 18.214 -15.579 12.532 1.000 1 A 97.920 1 ATOM 666 O OG . SER 78 78 ? A 18.497 -14.638 13.554 1.000 1 A 97.920 1 ATOM 667 N N . ILE 79 79 ? A 17.064 -16.193 9.576 1.000 1 A 98.129 1 ATOM 668 C CA . ILE 79 79 ? A 16.762 -17.350 8.741 1.000 1 A 98.129 1 ATOM 669 C C . ILE 79 79 ? A 17.362 -17.153 7.351 1.000 1 A 98.129 1 ATOM 670 O O . ILE 79 79 ? A 17.272 -16.065 6.777 1.000 1 A 98.129 1 ATOM 671 C CB . ILE 79 79 ? A 15.239 -17.592 8.639 1.000 1 A 98.129 1 ATOM 672 C CG1 . ILE 79 79 ? A 14.956 -18.894 7.882 1.000 1 A 98.129 1 ATOM 673 C CG2 . ILE 79 79 ? A 14.548 -16.404 7.964 1.000 1 A 98.129 1 ATOM 674 C CD1 . ILE 79 79 ? A 15.201 -20.153 8.702 1.000 1 A 98.129 1 ATOM 675 N N . ARG 80 80 ? A 18.080 -18.237 6.879 1.000 1 A 97.193 1 ATOM 676 C CA . ARG 80 80 ? A 18.652 -18.367 5.543 1.000 1 A 97.193 1 ATOM 677 C C . ARG 80 80 ? A 18.392 -19.755 4.969 1.000 1 A 97.193 1 ATOM 678 O O . ARG 80 80 ? A 18.092 -20.693 5.710 1.000 1 A 97.193 1 ATOM 679 C CB . ARG 80 80 ? A 20.156 -18.086 5.573 1.000 1 A 97.193 1 ATOM 680 C CG . ARG 80 80 ? A 20.521 -16.746 6.191 1.000 1 A 97.193 1 ATOM 681 C CD . ARG 80 80 ? A 20.196 -15.587 5.259 1.000 1 A 97.193 1 ATOM 682 N NE . ARG 80 80 ? A 20.746 -14.328 5.751 1.000 1 A 97.193 1 ATOM 683 C CZ . ARG 80 80 ? A 20.197 -13.584 6.707 1.000 1 A 97.193 1 ATOM 684 N NH1 . ARG 80 80 ? A 19.067 -13.959 7.295 1.000 1 A 97.193 1 ATOM 685 N NH2 . ARG 80 80 ? A 20.783 -12.454 7.079 1.000 1 A 97.193 1 ATOM 686 N N . PRO 81 81 ? A 18.494 -19.808 3.612 1.000 1 A 96.586 1 ATOM 687 C CA . PRO 81 81 ? A 18.281 -21.137 3.033 1.000 1 A 96.586 1 ATOM 688 C C . PRO 81 81 ? A 19.197 -22.198 3.638 1.000 1 A 96.586 1 ATOM 689 O O . PRO 81 81 ? A 18.782 -23.345 3.824 1.000 1 A 96.586 1 ATOM 690 C CB . PRO 81 81 ? A 18.592 -20.929 1.548 1.000 1 A 96.586 1 ATOM 691 C CG . PRO 81 81 ? A 18.207 -19.511 1.273 1.000 1 A 96.586 1 ATOM 692 C CD . PRO 81 81 ? A 18.592 -18.673 2.458 1.000 1 A 96.586 1 ATOM 693 N N . ASP 82 82 ? A 20.367 -21.927 4.050 1.000 1 A 97.106 1 ATOM 694 C CA . ASP 82 82 ? A 21.359 -22.902 4.490 1.000 1 A 97.106 1 ATOM 695 C C . ASP 82 82 ? A 21.147 -23.278 5.955 1.000 1 A 97.106 1 ATOM 696 O O . ASP 82 82 ? A 21.752 -24.231 6.451 1.000 1 A 97.106 1 ATOM 697 C CB . ASP 82 82 ? A 22.774 -22.357 4.287 1.000 1 A 97.106 1 ATOM 698 C CG . ASP 82 82 ? A 23.011 -21.039 5.005 1.000 1 A 97.106 1 ATOM 699 O OD1 . ASP 82 82 ? A 22.028 -20.353 5.359 1.000 1 A 97.106 1 ATOM 700 O OD2 . ASP 82 82 ? A 24.190 -20.683 5.215 1.000 1 A 97.106 1 ATOM 701 N N . ASN 83 83 ? A 20.319 -22.568 6.704 1.000 1 A 97.266 1 ATOM 702 C CA . ASN 83 83 ? A 20.132 -22.918 8.108 1.000 1 A 97.266 1 ATOM 703 C C . ASN 83 83 ? A 18.675 -23.255 8.412 1.000 1 A 97.266 1 ATOM 704 O O . ASN 83 83 ? A 18.248 -23.201 9.567 1.000 1 A 97.266 1 ATOM 705 C CB . ASN 83 83 ? A 20.614 -21.782 9.013 1.000 1 A 97.266 1 ATOM 706 C CG . ASN 83 83 ? A 19.819 -20.505 8.820 1.000 1 A 97.266 1 ATOM 707 O OD1 . ASN 83 83 ? A 18.862 -20.466 8.043 1.000 1 A 97.266 1 ATOM 708 N ND2 . ASN 83 83 ? A 20.210 -19.451 9.528 1.000 1 A 97.266 1 ATOM 709 N N . MET 84 84 ? A 17.830 -23.515 7.468 1.000 1 A 96.184 1 ATOM 710 C CA . MET 84 84 ? A 16.394 -23.749 7.589 1.000 1 A 96.184 1 ATOM 711 C C . MET 84 84 ? A 16.112 -24.947 8.490 1.000 1 A 96.184 1 ATOM 712 O O . MET 84 84 ? A 15.147 -24.938 9.257 1.000 1 A 96.184 1 ATOM 713 C CB . MET 84 84 ? A 15.766 -23.971 6.212 1.000 1 A 96.184 1 ATOM 714 C CG . MET 84 84 ? A 15.650 -22.705 5.380 1.000 1 A 96.184 1 ATOM 715 S SD . MET 84 84 ? A 15.026 -23.032 3.685 1.000 1 A 96.184 1 ATOM 716 C CE . MET 84 84 ? A 13.335 -23.568 4.065 1.000 1 A 96.184 1 ATOM 717 N N . SER 85 85 ? A 16.958 -25.944 8.412 1.000 1 A 96.193 1 ATOM 718 C CA . SER 85 85 ? A 16.750 -27.172 9.173 1.000 1 A 96.193 1 ATOM 719 C C . SER 85 85 ? A 16.818 -26.911 10.674 1.000 1 A 96.193 1 ATOM 720 O O . SER 85 85 ? A 16.163 -27.599 11.460 1.000 1 A 96.193 1 ATOM 721 C CB . SER 85 85 ? A 17.786 -28.227 8.783 1.000 1 A 96.193 1 ATOM 722 O OG . SER 85 85 ? A 19.101 -27.740 8.990 1.000 1 A 96.193 1 ATOM 723 N N . GLU 86 86 ? A 17.537 -25.885 11.056 1.000 1 A 97.070 1 ATOM 724 C CA . GLU 86 86 ? A 17.709 -25.516 12.458 1.000 1 A 97.070 1 ATOM 725 C C . GLU 86 86 ? A 16.531 -24.685 12.958 1.000 1 A 97.070 1 ATOM 726 O O . GLU 86 86 ? A 16.380 -24.476 14.164 1.000 1 A 97.070 1 ATOM 727 C CB . GLU 86 86 ? A 19.018 -24.746 12.654 1.000 1 A 97.070 1 ATOM 728 C CG . GLU 86 86 ? A 20.261 -25.541 12.281 1.000 1 A 97.070 1 ATOM 729 C CD . GLU 86 86 ? A 21.536 -24.714 12.322 1.000 1 A 97.070 1 ATOM 730 O OE1 . GLU 86 86 ? A 22.558 -25.146 11.742 1.000 1 A 97.070 1 ATOM 731 O OE2 . GLU 86 86 ? A 21.513 -23.626 12.939 1.000 1 A 97.070 1 ATOM 732 N N . TYR 87 87 ? A 15.640 -24.151 12.032 1.000 1 A 97.014 1 ATOM 733 C CA . TYR 87 87 ? A 14.544 -23.257 12.389 1.000 1 A 97.014 1 ATOM 734 C C . TYR 87 87 ? A 13.197 -23.882 12.046 1.000 1 A 97.014 1 ATOM 735 O O . TYR 87 87 ? A 12.215 -23.171 11.823 1.000 1 A 97.014 1 ATOM 736 C CB . TYR 87 87 ? A 14.693 -21.912 11.672 1.000 1 A 97.014 1 ATOM 737 C CG . TYR 87 87 ? A 15.783 -21.037 12.242 1.000 1 A 97.014 1 ATOM 738 C CD1 . TYR 87 87 ? A 15.532 -20.192 13.321 1.000 1 A 97.014 1 ATOM 739 C CD2 . TYR 87 87 ? A 17.065 -21.053 11.704 1.000 1 A 97.014 1 ATOM 740 C CE1 . TYR 87 87 ? A 16.532 -19.383 13.849 1.000 1 A 97.014 1 ATOM 741 C CE2 . TYR 87 87 ? A 18.073 -20.248 12.223 1.000 1 A 97.014 1 ATOM 742 C CZ . TYR 87 87 ? A 17.798 -19.418 13.294 1.000 1 A 97.014 1 ATOM 743 O OH . TYR 87 87 ? A 18.792 -18.619 13.813 1.000 1 A 97.014 1 ATOM 744 N N . SER 88 88 ? A 13.095 -25.237 12.022 1.000 1 A 96.146 1 ATOM 745 C CA . SER 88 88 ? A 11.882 -25.909 11.568 1.000 1 A 96.146 1 ATOM 746 C C . SER 88 88 ? A 10.686 -25.539 12.439 1.000 1 A 96.146 1 ATOM 747 O O . SER 88 88 ? A 9.602 -25.254 11.925 1.000 1 A 96.146 1 ATOM 748 C CB . SER 88 88 ? A 12.075 -27.425 11.570 1.000 1 A 96.146 1 ATOM 749 O OG . SER 88 88 ? A 13.048 -27.810 10.613 1.000 1 A 96.146 1 ATOM 750 N N . LYS 89 89 ? A 10.888 -25.484 13.742 1.000 1 A 97.109 1 ATOM 751 C CA . LYS 89 89 ? A 9.806 -25.149 14.665 1.000 1 A 97.109 1 ATOM 752 C C . LYS 89 89 ? A 9.356 -23.702 14.483 1.000 1 A 97.109 1 ATOM 753 O O . LYS 89 89 ? A 8.157 -23.416 14.474 1.000 1 A 97.109 1 ATOM 754 C CB . LYS 89 89 ? A 10.242 -25.384 16.112 1.000 1 A 97.109 1 ATOM 755 C CG . LYS 89 89 ? A 10.377 -26.853 16.487 1.000 1 A 97.109 1 ATOM 756 C CD . LYS 89 89 ? A 10.721 -27.024 17.961 1.000 1 A 97.109 1 ATOM 757 C CE . LYS 89 89 ? A 10.936 -28.488 18.319 1.000 1 A 97.109 1 ATOM 758 N NZ . LYS 89 89 ? A 11.354 -28.654 19.744 1.000 1 A 97.109 1 ATOM 759 N N . GLN 90 90 ? A 10.275 -22.802 14.328 1.000 1 A 97.754 1 ATOM 760 C CA . GLN 90 90 ? A 9.966 -21.386 14.151 1.000 1 A 97.754 1 ATOM 761 C C . GLN 90 90 ? A 9.287 -21.135 12.808 1.000 1 A 97.754 1 ATOM 762 O O . GLN 90 90 ? A 8.389 -20.297 12.707 1.000 1 A 97.754 1 ATOM 763 C CB . GLN 90 90 ? A 11.236 -20.542 14.264 1.000 1 A 97.754 1 ATOM 764 C CG . GLN 90 90 ? A 11.841 -20.523 15.661 1.000 1 A 97.754 1 ATOM 765 C CD . GLN 90 90 ? A 12.827 -21.653 15.889 1.000 1 A 97.754 1 ATOM 766 O OE1 . GLN 90 90 ? A 12.815 -22.659 15.173 1.000 1 A 97.754 1 ATOM 767 N NE2 . GLN 90 90 ? A 13.688 -21.495 16.889 1.000 1 A 97.754 1 ATOM 768 N N . MET 91 91 ? A 9.752 -21.864 11.768 1.000 1 A 97.657 1 ATOM 769 C CA . MET 91 91 ? A 9.134 -21.730 10.452 1.000 1 A 97.657 1 ATOM 770 C C . MET 91 91 ? A 7.653 -22.089 10.506 1.000 1 A 97.657 1 ATOM 771 O O . MET 91 91 ? A 6.825 -21.422 9.885 1.000 1 A 97.657 1 ATOM 772 C CB . MET 91 91 ? A 9.850 -22.614 9.429 1.000 1 A 97.657 1 ATOM 773 C CG . MET 91 91 ? A 11.223 -22.100 9.028 1.000 1 A 97.657 1 ATOM 774 S SD . MET 91 91 ? A 12.048 -23.185 7.799 1.000 1 A 97.657 1 ATOM 775 C CE . MET 91 91 ? A 10.928 -22.979 6.387 1.000 1 A 97.657 1 ATOM 776 N N . GLN 92 92 ? A 7.334 -23.125 11.213 1.000 1 A 96.995 1 ATOM 777 C CA . GLN 92 92 ? A 5.937 -23.504 11.392 1.000 1 A 96.995 1 ATOM 778 C C . GLN 92 92 ? A 5.183 -22.457 12.207 1.000 1 A 96.995 1 ATOM 779 O O . GLN 92 92 ? A 4.070 -22.066 11.847 1.000 1 A 96.995 1 ATOM 780 C CB . GLN 92 92 ? A 5.833 -24.871 12.070 1.000 1 A 96.995 1 ATOM 781 C CG . GLN 92 92 ? A 6.214 -26.036 11.166 1.000 1 A 96.995 1 ATOM 782 C CD . GLN 92 92 ? A 6.200 -27.369 11.890 1.000 1 A 96.995 1 ATOM 783 O OE1 . GLN 92 92 ? A 5.848 -27.445 13.071 1.000 1 A 96.995 1 ATOM 784 N NE2 . GLN 92 92 ? A 6.583 -28.429 11.187 1.000 1 A 96.995 1 ATOM 785 N N . ARG 93 93 ? A 5.834 -22.033 13.267 1.000 1 A 97.337 1 ATOM 786 C CA . ARG 93 93 ? A 5.227 -21.047 14.157 1.000 1 A 97.337 1 ATOM 787 C C . ARG 93 93 ? A 4.930 -19.749 13.414 1.000 1 A 97.337 1 ATOM 788 O O . ARG 93 93 ? A 3.866 -19.154 13.595 1.000 1 A 97.337 1 ATOM 789 C CB . ARG 93 93 ? A 6.139 -20.770 15.354 1.000 1 A 97.337 1 ATOM 790 C CG . ARG 93 93 ? A 5.609 -19.702 16.297 1.000 1 A 97.337 1 ATOM 791 C CD . ARG 93 93 ? A 6.570 -19.438 17.448 1.000 1 A 97.337 1 ATOM 792 N NE . ARG 93 93 ? A 6.139 -18.305 18.262 1.000 1 A 97.337 1 ATOM 793 C CZ . ARG 93 93 ? A 6.767 -17.872 19.351 1.000 1 A 97.337 1 ATOM 794 N NH1 . ARG 93 93 ? A 7.871 -18.472 19.781 1.000 1 A 97.337 1 ATOM 795 N NH2 . ARG 93 93 ? A 6.288 -16.831 20.017 1.000 1 A 97.337 1 ATOM 796 N N . PHE 94 94 ? A 5.821 -19.224 12.579 1.000 1 A 98.068 1 ATOM 797 C CA . PHE 94 94 ? A 5.755 -17.901 11.969 1.000 1 A 98.068 1 ATOM 798 C C . PHE 94 94 ? A 5.218 -17.987 10.546 1.000 1 A 98.068 1 ATOM 799 O O . PHE 94 94 ? A 5.207 -16.991 9.819 1.000 1 A 98.068 1 ATOM 800 C CB . PHE 94 94 ? A 7.136 -17.238 11.970 1.000 1 A 98.068 1 ATOM 801 C CG . PHE 94 94 ? A 7.645 -16.897 13.345 1.000 1 A 98.068 1 ATOM 802 C CD1 . PHE 94 94 ? A 6.820 -16.269 14.270 1.000 1 A 98.068 1 ATOM 803 C CD2 . PHE 94 94 ? A 8.949 -17.203 13.711 1.000 1 A 98.068 1 ATOM 804 C CE1 . PHE 94 94 ? A 7.288 -15.952 15.543 1.000 1 A 98.068 1 ATOM 805 C CE2 . PHE 94 94 ? A 9.424 -16.889 14.981 1.000 1 A 98.068 1 ATOM 806 C CZ . PHE 94 94 ? A 8.592 -16.263 15.896 1.000 1 A 98.068 1 ATOM 807 N N . ASN 95 95 ? A 4.785 -19.217 10.163 1.000 1 A 97.380 1 ATOM 808 C CA . ASN 95 95 ? A 4.146 -19.469 8.876 1.000 1 A 97.380 1 ATOM 809 C C . ASN 95 95 ? A 5.064 -19.102 7.713 1.000 1 A 97.380 1 ATOM 810 O O . ASN 95 95 ? A 4.634 -18.457 6.756 1.000 1 A 97.380 1 ATOM 811 C CB . ASN 95 95 ? A 2.826 -18.703 8.772 1.000 1 A 97.380 1 ATOM 812 C CG . ASN 95 95 ? A 1.950 -19.200 7.639 1.000 1 A 97.380 1 ATOM 813 O OD1 . ASN 95 95 ? A 1.982 -20.382 7.286 1.000 1 A 97.380 1 ATOM 814 N ND2 . ASN 95 95 ? A 1.160 -18.302 7.062 1.000 1 A 97.380 1 ATOM 815 N N . VAL 96 96 ? A 6.305 -19.435 7.751 1.000 1 A 97.107 1 ATOM 816 C CA . VAL 96 96 ? A 7.293 -19.266 6.690 1.000 1 A 97.107 1 ATOM 817 C C . VAL 96 96 ? A 7.619 -20.622 6.068 1.000 1 A 97.107 1 ATOM 818 O O . VAL 96 96 ? A 8.169 -21.502 6.734 1.000 1 A 97.107 1 ATOM 819 C CB . VAL 96 96 ? A 8.582 -18.598 7.217 1.000 1 A 97.107 1 ATOM 820 C CG1 . VAL 96 96 ? A 9.629 -18.497 6.109 1.000 1 A 97.107 1 ATOM 821 C CG2 . VAL 96 96 ? A 8.271 -17.216 7.789 1.000 1 A 97.107 1 ATOM 822 N N . GLY 97 97 ? A 7.248 -20.787 4.704 1.000 1 A 92.572 1 ATOM 823 C CA . GLY 97 97 ? A 7.490 -22.049 4.023 1.000 1 A 92.572 1 ATOM 824 C C . GLY 97 97 ? A 6.760 -22.161 2.697 1.000 1 A 92.572 1 ATOM 825 O O . GLY 97 97 ? A 7.380 -22.095 1.634 1.000 1 A 92.572 1 ATOM 826 N N . GLU 98 98 ? A 5.523 -22.381 2.689 1.000 1 A 89.925 1 ATOM 827 C CA . GLU 98 98 ? A 4.755 -22.627 1.472 1.000 1 A 89.925 1 ATOM 828 C C . GLU 98 98 ? A 4.660 -21.369 0.615 1.000 1 A 89.925 1 ATOM 829 O O . GLU 98 98 ? A 5.521 -21.121 -0.231 1.000 1 A 89.925 1 ATOM 830 C CB . GLU 98 98 ? A 3.353 -23.138 1.815 1.000 1 A 89.925 1 ATOM 831 C CG . GLU 98 98 ? A 3.340 -24.517 2.458 1.000 1 A 89.925 1 ATOM 832 C CD . GLU 98 98 ? A 1.938 -25.048 2.712 1.000 1 A 89.925 1 ATOM 833 O OE1 . GLU 98 98 ? A 1.802 -26.186 3.215 1.000 1 A 89.925 1 ATOM 834 O OE2 . GLU 98 98 ? A 0.968 -24.320 2.404 1.000 1 A 89.925 1 ATOM 835 N N . ASP 99 99 ? A 3.737 -20.476 1.049 1.000 1 A 93.276 1 ATOM 836 C CA . ASP 99 99 ? A 3.478 -19.263 0.279 1.000 1 A 93.276 1 ATOM 837 C C . ASP 99 99 ? A 4.563 -18.216 0.521 1.000 1 A 93.276 1 ATOM 838 O O . ASP 99 99 ? A 4.750 -17.309 -0.293 1.000 1 A 93.276 1 ATOM 839 C CB . ASP 99 99 ? A 2.104 -18.688 0.631 1.000 1 A 93.276 1 ATOM 840 C CG . ASP 99 99 ? A 0.956 -19.547 0.132 1.000 1 A 93.276 1 ATOM 841 O OD1 . ASP 99 99 ? A 1.138 -20.298 -0.850 1.000 1 A 93.276 1 ATOM 842 O OD2 . ASP 99 99 ? A -0.142 -19.470 0.725 1.000 1 A 93.276 1 ATOM 843 N N . CYS 100 100 ? A 5.331 -18.429 1.542 1.000 1 A 97.190 1 ATOM 844 C CA . CYS 100 100 ? A 6.397 -17.514 1.933 1.000 1 A 97.190 1 ATOM 845 C C . CYS 100 100 ? A 7.716 -18.257 2.110 1.000 1 A 97.190 1 ATOM 846 O O . CYS 100 100 ? A 8.131 -18.534 3.237 1.000 1 A 97.190 1 ATOM 847 C CB . CYS 100 100 ? A 6.033 -16.788 3.227 1.000 1 A 97.190 1 ATOM 848 S SG . CYS 100 100 ? A 4.532 -15.789 3.104 1.000 1 A 97.190 1 ATOM 849 N N . PRO 101 101 ? A 8.366 -18.562 1.018 1.000 1 A 97.231 1 ATOM 850 C CA . PRO 101 101 ? A 9.614 -19.326 1.094 1.000 1 A 97.231 1 ATOM 851 C C . PRO 101 101 ? A 10.769 -18.514 1.676 1.000 1 A 97.231 1 ATOM 852 O O . PRO 101 101 ? A 10.719 -17.281 1.685 1.000 1 A 97.231 1 ATOM 853 C CB . PRO 101 101 ? A 9.889 -19.697 -0.366 1.000 1 A 97.231 1 ATOM 854 C CG . PRO 101 101 ? A 9.321 -18.566 -1.161 1.000 1 A 97.231 1 ATOM 855 C CD . PRO 101 101 ? A 8.058 -18.102 -0.496 1.000 1 A 97.231 1 ATOM 856 N N . VAL 102 102 ? A 11.731 -19.279 2.155 1.000 1 A 97.797 1 ATOM 857 C CA . VAL 102 102 ? A 12.977 -18.652 2.584 1.000 1 A 97.797 1 ATOM 858 C C . VAL 102 102 ? A 13.901 -18.463 1.384 1.000 1 A 97.797 1 ATOM 859 O O . VAL 102 102 ? A 14.148 -19.405 0.628 1.000 1 A 97.797 1 ATOM 860 C CB . VAL 102 102 ? A 13.685 -19.485 3.676 1.000 1 A 97.797 1 ATOM 861 C CG1 . VAL 102 102 ? A 14.970 -18.797 4.132 1.000 1 A 97.797 1 ATOM 862 C CG2 . VAL 102 102 ? A 12.749 -19.715 4.862 1.000 1 A 97.797 1 ATOM 863 N N . PHE 103 103 ? A 14.390 -17.242 1.121 1.000 1 A 96.922 1 ATOM 864 C CA . PHE 103 103 ? A 15.343 -16.978 0.049 1.000 1 A 96.922 1 ATOM 865 C C . PHE 103 103 ? A 16.485 -16.100 0.544 1.000 1 A 96.922 1 ATOM 866 O O . PHE 103 103 ? A 16.396 -15.502 1.619 1.000 1 A 96.922 1 ATOM 867 C CB . PHE 103 103 ? A 14.644 -16.311 -1.140 1.000 1 A 96.922 1 ATOM 868 C CG . PHE 103 103 ? A 13.932 -15.033 -0.787 1.000 1 A 96.922 1 ATOM 869 C CD1 . PHE 103 103 ? A 12.579 -15.040 -0.470 1.000 1 A 96.922 1 ATOM 870 C CD2 . PHE 103 103 ? A 14.616 -13.825 -0.771 1.000 1 A 96.922 1 ATOM 871 C CE1 . PHE 103 103 ? A 11.917 -13.859 -0.142 1.000 1 A 96.922 1 ATOM 872 C CE2 . PHE 103 103 ? A 13.961 -12.640 -0.445 1.000 1 A 96.922 1 ATOM 873 C CZ . PHE 103 103 ? A 12.612 -12.660 -0.132 1.000 1 A 96.922 1 ATOM 874 N N . ASP 104 104 ? A 17.575 -16.180 -0.193 1.000 1 A 96.331 1 ATOM 875 C CA . ASP 104 104 ? A 18.731 -15.354 0.142 1.000 1 A 96.331 1 ATOM 876 C C . ASP 104 104 ? A 18.368 -13.870 0.127 1.000 1 A 96.331 1 ATOM 877 O O . ASP 104 104 ? A 17.801 -13.374 -0.848 1.000 1 A 96.331 1 ATOM 878 C CB . ASP 104 104 ? A 19.882 -15.623 -0.829 1.000 1 A 96.331 1 ATOM 879 C CG . ASP 104 104 ? A 21.205 -15.047 -0.355 1.000 1 A 96.331 1 ATOM 880 O OD1 . ASP 104 104 ? A 21.446 -15.000 0.870 1.000 1 A 96.331 1 ATOM 881 O OD2 . ASP 104 104 ? A 22.012 -14.633 -1.215 1.000 1 A 96.331 1 ATOM 882 N N . GLY 105 105 ? A 18.693 -13.183 1.299 1.000 1 A 97.162 1 ATOM 883 C CA . GLY 105 105 ? A 18.454 -11.752 1.388 1.000 1 A 97.162 1 ATOM 884 C C . GLY 105 105 ? A 17.036 -11.408 1.803 1.000 1 A 97.162 1 ATOM 885 O O . GLY 105 105 ? A 16.576 -10.284 1.590 1.000 1 A 97.162 1 ATOM 886 N N . LEU 106 106 ? A 16.279 -12.393 2.327 1.000 1 A 97.750 1 ATOM 887 C CA . LEU 106 106 ? A 14.890 -12.203 2.731 1.000 1 A 97.750 1 ATOM 888 C C . LEU 106 106 ? A 14.747 -10.974 3.622 1.000 1 A 97.750 1 ATOM 889 O O . LEU 106 106 ? A 13.898 -10.115 3.370 1.000 1 A 97.750 1 ATOM 890 C CB . LEU 106 106 ? A 14.372 -13.443 3.465 1.000 1 A 97.750 1 ATOM 891 C CG . LEU 106 106 ? A 12.981 -13.327 4.092 1.000 1 A 97.750 1 ATOM 892 C CD1 . LEU 106 106 ? A 11.920 -13.185 3.006 1.000 1 A 97.750 1 ATOM 893 C CD2 . LEU 106 106 ? A 12.691 -14.535 4.976 1.000 1 A 97.750 1 ATOM 894 N N . PHE 107 107 ? A 15.566 -10.905 4.695 1.000 1 A 98.160 1 ATOM 895 C CA . PHE 107 107 ? A 15.466 -9.786 5.625 1.000 1 A 98.160 1 ATOM 896 C C . PHE 107 107 ? A 15.824 -8.475 4.935 1.000 1 A 98.160 1 ATOM 897 O O . PHE 107 107 ? A 15.175 -7.452 5.161 1.000 1 A 98.160 1 ATOM 898 C CB . PHE 107 107 ? A 16.379 -10.008 6.835 1.000 1 A 98.160 1 ATOM 899 C CG . PHE 107 107 ? A 16.203 -8.985 7.924 1.000 1 A 98.160 1 ATOM 900 C CD1 . PHE 107 107 ? A 17.238 -8.119 8.257 1.000 1 A 98.160 1 ATOM 901 C CD2 . PHE 107 107 ? A 15.003 -8.889 8.616 1.000 1 A 98.160 1 ATOM 902 C CE1 . PHE 107 107 ? A 17.078 -7.170 9.264 1.000 1 A 98.160 1 ATOM 903 C CE2 . PHE 107 107 ? A 14.836 -7.944 9.624 1.000 1 A 98.160 1 ATOM 904 C CZ . PHE 107 107 ? A 15.875 -7.086 9.947 1.000 1 A 98.160 1 ATOM 905 N N . GLU 108 108 ? A 16.825 -8.472 4.074 1.000 1 A 98.048 1 ATOM 906 C CA . GLU 108 108 ? A 17.209 -7.278 3.326 1.000 1 A 98.048 1 ATOM 907 C C . GLU 108 108 ? A 16.072 -6.801 2.427 1.000 1 A 98.048 1 ATOM 908 O O . GLU 108 108 ? A 15.851 -5.597 2.283 1.000 1 A 98.048 1 ATOM 909 C CB . GLU 108 108 ? A 18.462 -7.548 2.489 1.000 1 A 98.048 1 ATOM 910 C CG . GLU 108 108 ? A 19.734 -7.684 3.314 1.000 1 A 98.048 1 ATOM 911 C CD . GLU 108 108 ? A 19.902 -9.061 3.936 1.000 1 A 98.048 1 ATOM 912 O OE1 . GLU 108 108 ? A 20.889 -9.277 4.675 1.000 1 A 98.048 1 ATOM 913 O OE2 . GLU 108 108 ? A 19.040 -9.932 3.680 1.000 1 A 98.048 1 ATOM 914 N N . PHE 109 109 ? A 15.402 -7.753 1.831 1.000 1 A 97.991 1 ATOM 915 C CA . PHE 109 109 ? A 14.237 -7.410 1.024 1.000 1 A 97.991 1 ATOM 916 C C . PHE 109 109 ? A 13.191 -6.686 1.864 1.000 1 A 97.991 1 ATOM 917 O O . PHE 109 109 ? A 12.653 -5.659 1.444 1.000 1 A 97.991 1 ATOM 918 C CB . PHE 109 109 ? A 13.627 -8.668 0.397 1.000 1 A 97.991 1 ATOM 919 C CG . PHE 109 109 ? A 12.335 -8.417 -0.333 1.000 1 A 97.991 1 ATOM 920 C CD1 . PHE 109 109 ? A 11.118 -8.767 0.239 1.000 1 A 97.991 1 ATOM 921 C CD2 . PHE 109 109 ? A 12.337 -7.830 -1.592 1.000 1 A 97.991 1 ATOM 922 C CE1 . PHE 109 109 ? A 9.921 -8.536 -0.434 1.000 1 A 97.991 1 ATOM 923 C CE2 . PHE 109 109 ? A 11.145 -7.596 -2.270 1.000 1 A 97.991 1 ATOM 924 C CZ . PHE 109 109 ? A 9.938 -7.950 -1.690 1.000 1 A 97.991 1 ATOM 925 N N . CYS 110 110 ? A 12.956 -7.177 3.057 1.000 1 A 98.258 1 ATOM 926 C CA . CYS 110 110 ? A 11.989 -6.564 3.960 1.000 1 A 98.258 1 ATOM 927 C C . CYS 110 110 ? A 12.449 -5.176 4.391 1.000 1 A 98.258 1 ATOM 928 O O . CYS 110 110 ? A 11.637 -4.256 4.505 1.000 1 A 98.258 1 ATOM 929 C CB . CYS 110 110 ? A 11.773 -7.445 5.191 1.000 1 A 98.258 1 ATOM 930 S SG . CYS 110 110 ? A 10.975 -9.023 4.825 1.000 1 A 98.258 1 ATOM 931 N N . GLN 111 111 ? A 13.729 -5.023 4.573 1.000 1 A 98.482 1 ATOM 932 C CA . GLN 111 111 ? A 14.286 -3.732 4.963 1.000 1 A 98.482 1 ATOM 933 C C . GLN 111 111 ? A 14.021 -2.673 3.896 1.000 1 A 98.482 1 ATOM 934 O O . GLN 111 111 ? A 13.588 -1.563 4.210 1.000 1 A 98.482 1 ATOM 935 C CB . GLN 111 111 ? A 15.788 -3.851 5.224 1.000 1 A 98.482 1 ATOM 936 C CG . GLN 111 111 ? A 16.133 -4.586 6.512 1.000 1 A 98.482 1 ATOM 937 C CD . GLN 111 111 ? A 17.626 -4.638 6.777 1.000 1 A 98.482 1 ATOM 938 O OE1 . GLN 111 111 ? A 18.366 -5.351 6.092 1.000 1 A 98.482 1 ATOM 939 N NE2 . GLN 111 111 ? A 18.078 -3.885 7.773 1.000 1 A 98.482 1 ATOM 940 N N . LEU 112 112 ? A 14.221 -3.037 2.695 1.000 1 A 98.035 1 ATOM 941 C CA . LEU 112 112 ? A 14.102 -2.090 1.592 1.000 1 A 98.035 1 ATOM 942 C C . LEU 112 112 ? A 12.648 -1.685 1.377 1.000 1 A 98.035 1 ATOM 943 O O . LEU 112 112 ? A 12.344 -0.498 1.240 1.000 1 A 98.035 1 ATOM 944 C CB . LEU 112 112 ? A 14.672 -2.693 0.305 1.000 1 A 98.035 1 ATOM 945 C CG . LEU 112 112 ? A 16.176 -2.969 0.293 1.000 1 A 98.035 1 ATOM 946 C CD1 . LEU 112 112 ? A 16.587 -3.611 -1.028 1.000 1 A 98.035 1 ATOM 947 C CD2 . LEU 112 112 ? A 16.958 -1.682 0.534 1.000 1 A 98.035 1 ATOM 948 N N . SER 113 113 ? A 11.778 -2.722 1.302 1.000 1 A 97.593 1 ATOM 949 C CA . SER 113 113 ? A 10.372 -2.407 1.074 1.000 1 A 97.593 1 ATOM 950 C C . SER 113 113 ? A 9.795 -1.588 2.224 1.000 1 A 97.593 1 ATOM 951 O O . SER 113 113 ? A 9.117 -0.583 1.999 1.000 1 A 97.593 1 ATOM 952 C CB . SER 113 113 ? A 9.558 -3.688 0.891 1.000 1 A 97.593 1 ATOM 953 O OG . SER 113 113 ? A 9.633 -4.501 2.050 1.000 1 A 97.593 1 ATOM 954 N N . THR 114 114 ? A 10.112 -1.905 3.462 1.000 1 A 98.477 1 ATOM 955 C CA . THR 114 114 ? A 9.604 -1.229 4.651 1.000 1 A 98.477 1 ATOM 956 C C . THR 114 114 ? A 10.226 0.157 4.793 1.000 1 A 98.477 1 ATOM 957 O O . THR 114 114 ? A 9.527 1.130 5.080 1.000 1 A 98.477 1 ATOM 958 C CB . THR 114 114 ? A 9.883 -2.052 5.923 1.000 1 A 98.477 1 ATOM 959 O OG1 . THR 114 114 ? A 9.263 -3.338 5.798 1.000 1 A 98.477 1 ATOM 960 C CG2 . THR 114 114 ? A 9.332 -1.353 7.161 1.000 1 A 98.477 1 ATOM 961 N N . GLY 115 115 ? A 11.492 0.235 4.580 1.000 1 A 98.433 1 ATOM 962 C CA . GLY 115 115 ? A 12.170 1.520 4.657 1.000 1 A 98.433 1 ATOM 963 C C . GLY 115 115 ? A 11.584 2.560 3.720 1.000 1 A 98.433 1 ATOM 964 O O . GLY 115 115 ? A 11.409 3.719 4.103 1.000 1 A 98.433 1 ATOM 965 N N . GLY 116 116 ? A 11.319 2.185 2.491 1.000 1 A 98.445 1 ATOM 966 C CA . GLY 116 116 ? A 10.701 3.079 1.524 1.000 1 A 98.445 1 ATOM 967 C C . GLY 116 116 ? A 9.349 3.601 1.974 1.000 1 A 98.445 1 ATOM 968 O O . GLY 116 116 ? A 9.073 4.798 1.867 1.000 1 A 98.445 1 ATOM 969 N N . SER 117 117 ? A 8.471 2.688 2.488 1.000 1 A 98.730 1 ATOM 970 C CA . SER 117 117 ? A 7.132 3.074 2.918 1.000 1 A 98.730 1 ATOM 971 C C . SER 117 117 ? A 7.185 4.003 4.126 1.000 1 A 98.730 1 ATOM 972 O O . SER 117 117 ? A 6.490 5.021 4.164 1.000 1 A 98.730 1 ATOM 973 C CB . SER 117 117 ? A 6.299 1.836 3.254 1.000 1 A 98.730 1 ATOM 974 O OG . SER 117 117 ? A 6.093 1.040 2.099 1.000 1 A 98.730 1 ATOM 975 N N . VAL 118 118 ? A 8.050 3.722 5.095 1.000 1 A 98.618 1 ATOM 976 C CA . VAL 118 118 ? A 8.165 4.537 6.300 1.000 1 A 98.618 1 ATOM 977 C C . VAL 118 118 ? A 8.771 5.894 5.950 1.000 1 A 98.618 1 ATOM 978 O O . VAL 118 118 ? A 8.290 6.933 6.410 1.000 1 A 98.618 1 ATOM 979 C CB . VAL 118 118 ? A 9.018 3.835 7.380 1.000 1 A 98.618 1 ATOM 980 C CG1 . VAL 118 118 ? A 9.330 4.794 8.528 1.000 1 A 98.618 1 ATOM 981 C CG2 . VAL 118 118 ? A 8.301 2.590 7.900 1.000 1 A 98.618 1 ATOM 982 N N . ALA 119 119 ? A 9.795 5.904 5.125 1.000 1 A 98.418 1 ATOM 983 C CA . ALA 119 119 ? A 10.405 7.161 4.701 1.000 1 A 98.418 1 ATOM 984 C C . ALA 119 119 ? A 9.405 8.027 3.940 1.000 1 A 98.418 1 ATOM 985 O O . ALA 119 119 ? A 9.389 9.250 4.096 1.000 1 A 98.418 1 ATOM 986 C CB . ALA 119 119 ? A 11.635 6.891 3.838 1.000 1 A 98.418 1 ATOM 987 N N . SER 120 120 ? A 8.612 7.386 3.126 1.000 1 A 98.592 1 ATOM 988 C CA . SER 120 120 ? A 7.556 8.101 2.417 1.000 1 A 98.592 1 ATOM 989 C C . SER 120 120 ? A 6.596 8.777 3.391 1.000 1 A 98.592 1 ATOM 990 O O . SER 120 120 ? A 6.259 9.951 3.224 1.000 1 A 98.592 1 ATOM 991 C CB . SER 120 120 ? A 6.782 7.149 1.505 1.000 1 A 98.592 1 ATOM 992 O OG . SER 120 120 ? A 7.616 6.654 0.471 1.000 1 A 98.592 1 ATOM 993 N N . ALA 121 121 ? A 6.182 8.025 4.419 1.000 1 A 98.688 1 ATOM 994 C CA . ALA 121 121 ? A 5.270 8.568 5.423 1.000 1 A 98.688 1 ATOM 995 C C . ALA 121 121 ? A 5.906 9.739 6.165 1.000 1 A 98.688 1 ATOM 996 O O . ALA 121 121 ? A 5.242 10.741 6.444 1.000 1 A 98.688 1 ATOM 997 C CB . ALA 121 121 ? A 4.856 7.479 6.409 1.000 1 A 98.688 1 ATOM 998 N N . VAL 122 122 ? A 7.154 9.666 6.441 1.000 1 A 98.308 1 ATOM 999 C CA . VAL 122 122 ? A 7.885 10.726 7.127 1.000 1 A 98.308 1 ATOM 1000 C C . VAL 122 122 ? A 7.886 11.991 6.272 1.000 1 A 98.308 1 ATOM 1001 O O . VAL 122 122 ? A 7.623 13.087 6.773 1.000 1 A 98.308 1 ATOM 1002 C CB . VAL 122 122 ? A 9.335 10.299 7.449 1.000 1 A 98.308 1 ATOM 1003 C CG1 . VAL 122 122 ? A 10.158 11.496 7.921 1.000 1 A 98.308 1 ATOM 1004 C CG2 . VAL 122 122 ? A 9.343 9.192 8.501 1.000 1 A 98.308 1 ATOM 1005 N N . LYS 123 123 ? A 8.128 11.882 5.015 1.000 1 A 98.017 1 ATOM 1006 C CA . LYS 123 123 ? A 8.151 13.043 4.129 1.000 1 A 98.017 1 ATOM 1007 C C . LYS 123 123 ? A 6.774 13.695 4.042 1.000 1 A 98.017 1 ATOM 1008 O O . LYS 123 123 ? A 6.664 14.923 4.018 1.000 1 A 98.017 1 ATOM 1009 C CB . LYS 123 123 ? A 8.630 12.643 2.733 1.000 1 A 98.017 1 ATOM 1010 C CG . LYS 123 123 ? A 10.144 12.632 2.578 1.000 1 A 98.017 1 ATOM 1011 C CD . LYS 123 123 ? A 10.565 13.043 1.172 1.000 1 A 98.017 1 ATOM 1012 C CE . LYS 123 123 ? A 12.046 13.390 1.110 1.000 1 A 98.017 1 ATOM 1013 N NZ . LYS 123 123 ? A 12.558 13.382 -0.292 1.000 1 A 98.017 1 ATOM 1014 N N . LEU 124 124 ? A 5.786 12.830 4.009 1.000 1 A 98.525 1 ATOM 1015 C CA . LEU 124 124 ? A 4.428 13.361 4.002 1.000 1 A 98.525 1 ATOM 1016 C C . LEU 124 124 ? A 4.131 14.110 5.298 1.000 1 A 98.525 1 ATOM 1017 O O . LEU 124 124 ? A 3.565 15.205 5.271 1.000 1 A 98.525 1 ATOM 1018 C CB . LEU 124 124 ? A 3.412 12.233 3.807 1.000 1 A 98.525 1 ATOM 1019 C CG . LEU 124 124 ? A 3.360 11.601 2.415 1.000 1 A 98.525 1 ATOM 1020 C CD1 . LEU 124 124 ? A 2.558 10.304 2.452 1.000 1 A 98.525 1 ATOM 1021 C CD2 . LEU 124 124 ? A 2.763 12.576 1.406 1.000 1 A 98.525 1 ATOM 1022 N N . ASN 125 125 ? A 4.508 13.574 6.426 1.000 1 A 98.403 1 ATOM 1023 C CA . ASN 125 125 ? A 4.280 14.197 7.726 1.000 1 A 98.403 1 ATOM 1024 C C . ASN 125 125 ? A 4.980 15.549 7.830 1.000 1 A 98.403 1 ATOM 1025 O O . ASN 125 125 ? A 4.465 16.473 8.462 1.000 1 A 98.403 1 ATOM 1026 C CB . ASN 125 125 ? A 4.743 13.272 8.853 1.000 1 A 98.403 1 ATOM 1027 C CG . ASN 125 125 ? A 3.719 12.205 9.190 1.000 1 A 98.403 1 ATOM 1028 O OD1 . ASN 125 125 ? A 2.559 12.289 8.779 1.000 1 A 98.403 1 ATOM 1029 N ND2 . ASN 125 125 ? A 4.141 11.194 9.940 1.000 1 A 98.403 1 ATOM 1030 N N . LYS 126 126 ? A 6.130 15.644 7.115 1.000 1 A 97.602 1 ATOM 1031 C CA . LYS 126 126 ? A 6.915 16.874 7.169 1.000 1 A 97.602 1 ATOM 1032 C C . LYS 126 126 ? A 6.491 17.846 6.072 1.000 1 A 97.602 1 ATOM 1033 O O . LYS 126 126 ? A 7.116 18.892 5.887 1.000 1 A 97.602 1 ATOM 1034 C CB . LYS 126 126 ? A 8.407 16.564 7.047 1.000 1 A 97.602 1 ATOM 1035 C CG . LYS 126 126 ? A 8.985 15.820 8.243 1.000 1 A 97.602 1 ATOM 1036 C CD . LYS 126 126 ? A 10.492 15.640 8.113 1.000 1 A 97.602 1 ATOM 1037 C CE . LYS 126 126 ? A 11.089 15.001 9.360 1.000 1 A 97.602 1 ATOM 1038 N NZ . LYS 126 126 ? A 12.557 14.772 9.217 1.000 1 A 97.602 1 ATOM 1039 N N . GLN 127 127 ? A 5.530 17.379 5.276 1.000 1 A 97.281 1 ATOM 1040 C CA . GLN 127 127 ? A 4.965 18.185 4.199 1.000 1 A 97.281 1 ATOM 1041 C C . GLN 127 127 ? A 6.025 18.532 3.158 1.000 1 A 97.281 1 ATOM 1042 O O . GLN 127 127 ? A 6.051 19.651 2.640 1.000 1 A 97.281 1 ATOM 1043 C CB . GLN 127 127 ? A 4.338 19.464 4.757 1.000 1 A 97.281 1 ATOM 1044 C CG . GLN 127 127 ? A 3.166 19.215 5.697 1.000 1 A 97.281 1 ATOM 1045 C CD . GLN 127 127 ? A 2.597 20.496 6.277 1.000 1 A 97.281 1 ATOM 1046 O OE1 . GLN 127 127 ? A 3.265 21.535 6.297 1.000 1 A 97.281 1 ATOM 1047 N NE2 . GLN 127 127 ? A 1.358 20.432 6.753 1.000 1 A 97.281 1 ATOM 1048 N N . GLN 128 128 ? A 6.956 17.692 2.970 1.000 1 A 97.534 1 ATOM 1049 C CA . GLN 128 128 ? A 8.005 17.859 1.969 1.000 1 A 97.534 1 ATOM 1050 C C . GLN 128 128 ? A 7.557 17.333 0.609 1.000 1 A 97.534 1 ATOM 1051 O O . GLN 128 128 ? A 8.247 17.525 -0.395 1.000 1 A 97.534 1 ATOM 1052 C CB . GLN 128 128 ? A 9.286 17.150 2.410 1.000 1 A 97.534 1 ATOM 1053 C CG . GLN 128 128 ? A 9.936 17.763 3.643 1.000 1 A 97.534 1 ATOM 1054 C CD . GLN 128 128 ? A 11.131 16.968 4.135 1.000 1 A 97.534 1 ATOM 1055 O OE1 . GLN 128 128 ? A 11.336 15.819 3.731 1.000 1 A 97.534 1 ATOM 1056 N NE2 . GLN 128 128 ? A 11.926 17.573 5.010 1.000 1 A 97.534 1 ATOM 1057 N N . THR 129 129 ? A 6.503 16.555 0.610 1.000 1 A 98.062 1 ATOM 1058 C CA . THR 129 129 ? A 5.885 16.051 -0.611 1.000 1 A 98.062 1 ATOM 1059 C C . THR 129 129 ? A 4.376 15.907 -0.434 1.000 1 A 98.062 1 ATOM 1060 O O . THR 129 129 ? A 3.887 15.777 0.690 1.000 1 A 98.062 1 ATOM 1061 C CB . THR 129 129 ? A 6.487 14.695 -1.023 1.000 1 A 98.062 1 ATOM 1062 O OG1 . THR 129 129 ? A 6.074 14.381 -2.359 1.000 1 A 98.062 1 ATOM 1063 C CG2 . THR 129 129 ? A 6.028 13.582 -0.087 1.000 1 A 98.062 1 ATOM 1064 N N . ASP 130 130 ? A 3.595 16.000 -1.526 1.000 1 A 98.368 1 ATOM 1065 C CA . ASP 130 130 ? A 2.145 15.835 -1.477 1.000 1 A 98.368 1 ATOM 1066 C C . ASP 130 130 ? A 1.748 14.385 -1.744 1.000 1 A 98.368 1 ATOM 1067 O O . ASP 130 130 ? A 0.785 13.882 -1.160 1.000 1 A 98.368 1 ATOM 1068 C CB . ASP 130 130 ? A 1.466 16.761 -2.488 1.000 1 A 98.368 1 ATOM 1069 C CG . ASP 130 130 ? A 1.778 18.228 -2.251 1.000 1 A 98.368 1 ATOM 1070 O OD1 . ASP 130 130 ? A 1.525 18.733 -1.136 1.000 1 A 98.368 1 ATOM 1071 O OD2 . ASP 130 130 ? A 2.278 18.886 -3.189 1.000 1 A 98.368 1 ATOM 1072 N N . ILE 131 131 ? A 2.519 13.702 -2.664 1.000 1 A 98.782 1 ATOM 1073 C CA . ILE 131 131 ? A 2.331 12.297 -3.010 1.000 1 A 98.782 1 ATOM 1074 C C . ILE 131 131 ? A 3.669 11.565 -2.944 1.000 1 A 98.782 1 ATOM 1075 O O . ILE 131 131 ? A 4.654 12.004 -3.542 1.000 1 A 98.782 1 ATOM 1076 C CB . ILE 131 131 ? A 1.702 12.140 -4.413 1.000 1 A 98.782 1 ATOM 1077 C CG1 . ILE 131 131 ? A 0.337 12.835 -4.467 1.000 1 A 98.782 1 ATOM 1078 C CG2 . ILE 131 131 ? A 1.579 10.660 -4.787 1.000 1 A 98.782 1 ATOM 1079 C CD1 . ILE 131 131 ? A -0.301 12.837 -5.850 1.000 1 A 98.782 1 ATOM 1080 N N . ALA 132 132 ? A 3.713 10.564 -2.137 1.000 1 A 98.824 1 ATOM 1081 C CA . ALA 132 132 ? A 4.888 9.700 -2.075 1.000 1 A 98.824 1 ATOM 1082 C C . ALA 132 132 ? A 4.592 8.328 -2.673 1.000 1 A 98.824 1 ATOM 1083 O O . ALA 132 132 ? A 3.559 7.724 -2.376 1.000 1 A 98.824 1 ATOM 1084 C CB . ALA 132 132 ? A 5.368 9.556 -0.633 1.000 1 A 98.824 1 ATOM 1085 N N . VAL 133 133 ? A 5.525 7.820 -3.531 1.000 1 A 98.882 1 ATOM 1086 C CA . VAL 133 133 ? A 5.338 6.542 -4.211 1.000 1 A 98.882 1 ATOM 1087 C C . VAL 133 133 ? A 6.420 5.559 -3.769 1.000 1 A 98.882 1 ATOM 1088 O O . VAL 133 133 ? A 7.604 5.901 -3.741 1.000 1 A 98.882 1 ATOM 1089 C CB . VAL 133 133 ? A 5.363 6.707 -5.747 1.000 1 A 98.882 1 ATOM 1090 C CG1 . VAL 133 133 ? A 5.172 5.358 -6.438 1.000 1 A 98.882 1 ATOM 1091 C CG2 . VAL 133 133 ? A 4.289 7.697 -6.194 1.000 1 A 98.882 1 ATOM 1092 N N . ASN 134 134 ? A 5.991 4.347 -3.421 1.000 1 A 98.781 1 ATOM 1093 C CA . ASN 134 134 ? A 6.870 3.214 -3.151 1.000 1 A 98.781 1 ATOM 1094 C C . ASN 134 134 ? A 6.297 1.914 -3.709 1.000 1 A 98.781 1 ATOM 1095 O O . ASN 134 134 ? A 5.539 1.222 -3.028 1.000 1 A 98.781 1 ATOM 1096 C CB . ASN 134 134 ? A 7.126 3.078 -1.649 1.000 1 A 98.781 1 ATOM 1097 C CG . ASN 134 134 ? A 8.081 1.948 -1.318 1.000 1 A 98.781 1 ATOM 1098 O OD1 . ASN 134 134 ? A 8.963 1.613 -2.112 1.000 1 A 98.781 1 ATOM 1099 N ND2 . ASN 134 134 ? A 7.912 1.354 -0.143 1.000 1 A 98.781 1 ATOM 1100 N N . TRP 135 135 ? A 6.697 1.541 -4.934 1.000 1 A 98.770 1 ATOM 1101 C CA . TRP 135 135 ? A 6.119 0.393 -5.625 1.000 1 A 98.770 1 ATOM 1102 C C . TRP 135 135 ? A 6.636 -0.914 -5.034 1.000 1 A 98.770 1 ATOM 1103 O O . TRP 135 135 ? A 6.023 -1.969 -5.214 1.000 1 A 98.770 1 ATOM 1104 C CB . TRP 135 135 ? A 6.434 0.451 -7.122 1.000 1 A 98.770 1 ATOM 1105 C CG . TRP 135 135 ? A 5.829 1.627 -7.827 1.000 1 A 98.770 1 ATOM 1106 C CD1 . TRP 135 135 ? A 6.472 2.526 -8.632 1.000 1 A 98.770 1 ATOM 1107 C CD2 . TRP 135 135 ? A 4.458 2.035 -7.786 1.000 1 A 98.770 1 ATOM 1108 N NE1 . TRP 135 135 ? A 5.582 3.468 -9.094 1.000 1 A 98.770 1 ATOM 1109 C CE2 . TRP 135 135 ? A 4.341 3.190 -8.590 1.000 1 A 98.770 1 ATOM 1110 C CE3 . TRP 135 135 ? A 3.316 1.534 -7.146 1.000 1 A 98.770 1 ATOM 1111 C CZ2 . TRP 135 135 ? A 3.125 3.853 -8.772 1.000 1 A 98.770 1 ATOM 1112 C CZ3 . TRP 135 135 ? A 2.107 2.196 -7.329 1.000 1 A 98.770 1 ATOM 1113 C CH2 . TRP 135 135 ? A 2.023 3.342 -8.136 1.000 1 A 98.770 1 ATOM 1114 N N . ALA 136 136 ? A 7.752 -0.888 -4.232 1.000 1 A 98.100 1 ATOM 1115 C CA . ALA 136 136 ? A 8.291 -2.082 -3.586 1.000 1 A 98.100 1 ATOM 1116 C C . ALA 136 136 ? A 7.456 -2.472 -2.370 1.000 1 A 98.100 1 ATOM 1117 O O . ALA 136 136 ? A 7.572 -3.590 -1.861 1.000 1 A 98.100 1 ATOM 1118 C CB . ALA 136 136 ? A 9.745 -1.857 -3.179 1.000 1 A 98.100 1 ATOM 1119 N N . GLY 137 137 ? A 6.629 -1.553 -1.924 1.000 1 A 98.147 1 ATOM 1120 C CA . GLY 137 137 ? A 5.804 -1.779 -0.748 1.000 1 A 98.147 1 ATOM 1121 C C . GLY 137 137 ? A 4.413 -2.284 -1.084 1.000 1 A 98.147 1 ATOM 1122 O O . GLY 137 137 ? A 4.177 -2.783 -2.186 1.000 1 A 98.147 1 ATOM 1123 N N . GLY 138 138 ? A 3.521 -2.252 -0.162 1.000 1 A 98.144 1 ATOM 1124 C CA . GLY 138 138 ? A 2.144 -2.675 -0.364 1.000 1 A 98.144 1 ATOM 1125 C C . GLY 138 138 ? A 1.903 -4.124 0.014 1.000 1 A 98.144 1 ATOM 1126 O O . GLY 138 138 ? A 0.964 -4.752 -0.479 1.000 1 A 98.144 1 ATOM 1127 N N . LEU 139 139 ? A 2.799 -4.692 0.858 1.000 1 A 97.565 1 ATOM 1128 C CA . LEU 139 139 ? A 2.678 -6.075 1.307 1.000 1 A 97.565 1 ATOM 1129 C C . LEU 139 139 ? A 1.733 -6.178 2.500 1.000 1 A 97.565 1 ATOM 1130 O O . LEU 139 139 ? A 2.149 -5.984 3.644 1.000 1 A 97.565 1 ATOM 1131 C CB . LEU 139 139 ? A 4.051 -6.641 1.678 1.000 1 A 97.565 1 ATOM 1132 C CG . LEU 139 139 ? A 5.124 -6.584 0.589 1.000 1 A 97.565 1 ATOM 1133 C CD1 . LEU 139 139 ? A 6.472 -7.025 1.150 1.000 1 A 97.565 1 ATOM 1134 C CD2 . LEU 139 139 ? A 4.725 -7.449 -0.601 1.000 1 A 97.565 1 ATOM 1135 N N . HIS 140 140 ? A 0.479 -6.567 2.224 1.000 1 A 97.560 1 ATOM 1136 C CA . HIS 140 140 ? A -0.605 -6.207 3.132 1.000 1 A 97.560 1 ATOM 1137 C C . HIS 140 140 ? A -1.125 -7.430 3.880 1.000 1 A 97.560 1 ATOM 1138 O O . HIS 140 140 ? A -2.109 -7.340 4.618 1.000 1 A 97.560 1 ATOM 1139 C CB . HIS 140 140 ? A -1.746 -5.537 2.364 1.000 1 A 97.560 1 ATOM 1140 C CG . HIS 140 140 ? A -2.386 -6.425 1.344 1.000 1 A 97.560 1 ATOM 1141 N ND1 . HIS 140 140 ? A -3.477 -6.035 0.599 1.000 1 A 97.560 1 ATOM 1142 C CD2 . HIS 140 140 ? A -2.083 -7.683 0.945 1.000 1 A 97.560 1 ATOM 1143 C CE1 . HIS 140 140 ? A -3.820 -7.019 -0.216 1.000 1 A 97.560 1 ATOM 1144 N NE2 . HIS 140 140 ? A -2.989 -8.030 -0.026 1.000 1 A 97.560 1 ATOM 1145 N N . HIS 141 141 ? A -0.486 -8.553 3.797 1.000 1 A 97.184 1 ATOM 1146 C CA . HIS 141 141 ? A -1.042 -9.762 4.396 1.000 1 A 97.184 1 ATOM 1147 C C . HIS 141 141 ? A -0.364 -10.080 5.724 1.000 1 A 97.184 1 ATOM 1148 O O . HIS 141 141 ? A -0.966 -10.708 6.598 1.000 1 A 97.184 1 ATOM 1149 C CB . HIS 141 141 ? A -0.902 -10.946 3.438 1.000 1 A 97.184 1 ATOM 1150 C CG . HIS 141 141 ? A -1.810 -10.869 2.252 1.000 1 A 97.184 1 ATOM 1151 N ND1 . HIS 141 141 ? A -3.182 -10.803 2.367 1.000 1 A 97.184 1 ATOM 1152 C CD2 . HIS 141 141 ? A -1.539 -10.845 0.926 1.000 1 A 97.184 1 ATOM 1153 C CE1 . HIS 141 141 ? A -3.717 -10.742 1.159 1.000 1 A 97.184 1 ATOM 1154 N NE2 . HIS 141 141 ? A -2.742 -10.765 0.267 1.000 1 A 97.184 1 ATOM 1155 N N . ALA 142 142 ? A 0.923 -9.714 5.871 1.000 1 A 97.482 1 ATOM 1156 C CA . ALA 142 142 ? A 1.686 -10.106 7.053 1.000 1 A 97.482 1 ATOM 1157 C C . ALA 142 142 ? A 0.985 -9.657 8.332 1.000 1 A 97.482 1 ATOM 1158 O O . ALA 142 142 ? A 0.430 -8.557 8.390 1.000 1 A 97.482 1 ATOM 1159 C CB . ALA 142 142 ? A 3.097 -9.528 6.992 1.000 1 A 97.482 1 ATOM 1160 N N . LYS 143 143 ? A 0.964 -10.574 9.336 1.000 1 A 96.637 1 ATOM 1161 C CA . LYS 143 143 ? A 0.398 -10.284 10.650 1.000 1 A 96.637 1 ATOM 1162 C C . LYS 143 143 ? A 1.493 -9.948 11.659 1.000 1 A 96.637 1 ATOM 1163 O O . LYS 143 143 ? A 2.670 -9.869 11.302 1.000 1 A 96.637 1 ATOM 1164 C CB . LYS 143 143 ? A -0.430 -11.468 11.151 1.000 1 A 96.637 1 ATOM 1165 C CG . LYS 143 143 ? A -1.413 -12.014 10.126 1.000 1 A 96.637 1 ATOM 1166 C CD . LYS 143 143 ? A -2.448 -10.968 9.732 1.000 1 A 96.637 1 ATOM 1167 C CE . LYS 143 143 ? A -3.474 -11.533 8.759 1.000 1 A 96.637 1 ATOM 1168 N NZ . LYS 143 143 ? A -4.445 -10.491 8.310 1.000 1 A 96.637 1 ATOM 1169 N N . LYS 144 144 ? A 1.066 -9.680 12.888 1.000 1 A 96.663 1 ATOM 1170 C CA . LYS 144 144 ? A 2.006 -9.211 13.902 1.000 1 A 96.663 1 ATOM 1171 C C . LYS 144 144 ? A 3.164 -10.191 14.073 1.000 1 A 96.663 1 ATOM 1172 O O . LYS 144 144 ? A 4.322 -9.780 14.170 1.000 1 A 96.663 1 ATOM 1173 C CB . LYS 144 144 ? A 1.295 -9.003 15.240 1.000 1 A 96.663 1 ATOM 1174 C CG . LYS 144 144 ? A 2.178 -8.403 16.324 1.000 1 A 96.663 1 ATOM 1175 C CD . LYS 144 144 ? A 1.375 -8.059 17.572 1.000 1 A 96.663 1 ATOM 1176 C CE . LYS 144 144 ? A 2.251 -7.427 18.645 1.000 1 A 96.663 1 ATOM 1177 N NZ . LYS 144 144 ? A 1.455 -7.025 19.843 1.000 1 A 96.663 1 ATOM 1178 N N . SER 145 145 ? A 2.907 -11.455 14.039 1.000 1 A 97.492 1 ATOM 1179 C CA . SER 145 145 ? A 3.952 -12.434 14.315 1.000 1 A 97.492 1 ATOM 1180 C C . SER 145 145 ? A 3.961 -13.544 13.269 1.000 1 A 97.492 1 ATOM 1181 O O . SER 145 145 ? A 4.322 -14.684 13.569 1.000 1 A 97.492 1 ATOM 1182 C CB . SER 145 145 ? A 3.768 -13.037 15.709 1.000 1 A 97.492 1 ATOM 1183 O OG . SER 145 145 ? A 3.907 -12.043 16.709 1.000 1 A 97.492 1 ATOM 1184 N N . GLU 146 146 ? A 3.514 -13.229 12.055 1.000 1 A 96.877 1 ATOM 1185 C CA . GLU 146 146 ? A 3.467 -14.289 11.053 1.000 1 A 96.877 1 ATOM 1186 C C . GLU 146 146 ? A 3.475 -13.713 9.640 1.000 1 A 96.877 1 ATOM 1187 O O . GLU 146 146 ? A 2.907 -12.646 9.396 1.000 1 A 96.877 1 ATOM 1188 C CB . GLU 146 146 ? A 2.230 -15.167 11.256 1.000 1 A 96.877 1 ATOM 1189 C CG . GLU 146 146 ? A 0.916 -14.454 10.972 1.000 1 A 96.877 1 ATOM 1190 C CD . GLU 146 146 ? A -0.304 -15.334 11.193 1.000 1 A 96.877 1 ATOM 1191 O OE1 . GLU 146 146 ? A -1.430 -14.908 10.849 1.000 1 A 96.877 1 ATOM 1192 O OE2 . GLU 146 146 ? A -0.132 -16.459 11.713 1.000 1 A 96.877 1 ATOM 1193 N N . ALA 147 147 ? A 4.216 -14.477 8.781 1.000 1 A 97.848 1 ATOM 1194 C CA . ALA 147 147 ? A 4.131 -14.206 7.349 1.000 1 A 97.848 1 ATOM 1195 C C . ALA 147 147 ? A 2.818 -14.725 6.770 1.000 1 A 97.848 1 ATOM 1196 O O . ALA 147 147 ? A 2.222 -15.662 7.308 1.000 1 A 97.848 1 ATOM 1197 C CB . ALA 147 147 ? A 5.315 -14.832 6.617 1.000 1 A 97.848 1 ATOM 1198 N N . SER 148 148 ? A 2.450 -14.100 5.725 1.000 1 A 95.733 1 ATOM 1199 C CA . SER 148 148 ? A 1.204 -14.514 5.088 1.000 1 A 95.733 1 ATOM 1200 C C . SER 148 148 ? A 1.097 -13.960 3.671 1.000 1 A 95.733 1 ATOM 1201 O O . SER 148 148 ? A 1.471 -12.813 3.417 1.000 1 A 95.733 1 ATOM 1202 C CB . SER 148 148 ? A 0.001 -14.057 5.915 1.000 1 A 95.733 1 ATOM 1203 O OG . SER 148 148 ? A -1.209 -14.523 5.343 1.000 1 A 95.733 1 ATOM 1204 N N . GLY 149 149 ? A 0.524 -14.709 2.738 1.000 1 A 92.254 1 ATOM 1205 C CA . GLY 149 149 ? A 0.205 -14.277 1.387 1.000 1 A 92.254 1 ATOM 1206 C C . GLY 149 149 ? A 1.368 -13.600 0.686 1.000 1 A 92.254 1 ATOM 1207 O O . GLY 149 149 ? A 1.197 -12.553 0.058 1.000 1 A 92.254 1 ATOM 1208 N N . PHE 150 150 ? A 2.519 -14.207 0.756 1.000 1 A 95.892 1 ATOM 1209 C CA . PHE 150 150 ? A 3.725 -13.740 0.082 1.000 1 A 95.892 1 ATOM 1210 C C . PHE 150 150 ? A 4.364 -12.589 0.851 1.000 1 A 95.892 1 ATOM 1211 O O . PHE 150 150 ? A 5.311 -11.964 0.369 1.000 1 A 95.892 1 ATOM 1212 C CB . PHE 150 150 ? A 3.406 -13.301 -1.351 1.000 1 A 95.892 1 ATOM 1213 C CG . PHE 150 150 ? A 2.712 -14.356 -2.169 1.000 1 A 95.892 1 ATOM 1214 C CD1 . PHE 150 150 ? A 2.724 -15.686 -1.767 1.000 1 A 95.892 1 ATOM 1215 C CD2 . PHE 150 150 ? A 2.046 -14.017 -3.340 1.000 1 A 95.892 1 ATOM 1216 C CE1 . PHE 150 150 ? A 2.082 -16.665 -2.522 1.000 1 A 95.892 1 ATOM 1217 C CE2 . PHE 150 150 ? A 1.402 -14.990 -4.100 1.000 1 A 95.892 1 ATOM 1218 C CZ . PHE 150 150 ? A 1.422 -16.313 -3.690 1.000 1 A 95.892 1 ATOM 1219 N N . CYS 151 151 ? A 3.788 -12.138 2.018 1.000 1 A 97.765 1 ATOM 1220 C CA . CYS 151 151 ? A 4.261 -10.962 2.739 1.000 1 A 97.765 1 ATOM 1221 C C . CYS 151 151 ? A 4.933 -11.359 4.048 1.000 1 A 97.765 1 ATOM 1222 O O . CYS 151 151 ? A 4.361 -12.108 4.841 1.000 1 A 97.765 1 ATOM 1223 C CB . CYS 151 151 ? A 3.105 -10.002 3.018 1.000 1 A 97.765 1 ATOM 1224 S SG . CYS 151 151 ? A 2.164 -9.548 1.545 1.000 1 A 97.765 1 ATOM 1225 N N . TYR 152 152 ? A 6.089 -10.766 4.347 1.000 1 A 98.413 1 ATOM 1226 C CA . TYR 152 152 ? A 6.860 -11.082 5.544 1.000 1 A 98.413 1 ATOM 1227 C C . TYR 152 152 ? A 6.739 -9.971 6.580 1.000 1 A 98.413 1 ATOM 1228 O O . TYR 152 152 ? A 6.635 -10.240 7.779 1.000 1 A 98.413 1 ATOM 1229 C CB . TYR 152 152 ? A 8.333 -11.307 5.190 1.000 1 A 98.413 1 ATOM 1230 C CG . TYR 152 152 ? A 8.563 -12.473 4.258 1.000 1 A 98.413 1 ATOM 1231 C CD1 . TYR 152 152 ? A 8.853 -13.741 4.756 1.000 1 A 98.413 1 ATOM 1232 C CD2 . TYR 152 152 ? A 8.490 -12.308 2.879 1.000 1 A 98.413 1 ATOM 1233 C CE1 . TYR 152 152 ? A 9.067 -14.817 3.901 1.000 1 A 98.413 1 ATOM 1234 C CE2 . TYR 152 152 ? A 8.702 -13.377 2.015 1.000 1 A 98.413 1 ATOM 1235 C CZ . TYR 152 152 ? A 8.989 -14.626 2.535 1.000 1 A 98.413 1 ATOM 1236 O OH . TYR 152 152 ? A 9.200 -15.688 1.684 1.000 1 A 98.413 1 ATOM 1237 N N . VAL 153 153 ? A 6.789 -8.700 6.125 1.000 1 A 98.579 1 ATOM 1238 C CA . VAL 153 153 ? A 6.634 -7.500 6.941 1.000 1 A 98.579 1 ATOM 1239 C C . VAL 153 153 ? A 5.526 -6.622 6.364 1.000 1 A 98.579 1 ATOM 1240 O O . VAL 153 153 ? A 5.468 -6.402 5.152 1.000 1 A 98.579 1 ATOM 1241 C CB . VAL 153 153 ? A 7.953 -6.701 7.033 1.000 1 A 98.579 1 ATOM 1242 C CG1 . VAL 153 153 ? A 7.727 -5.363 7.735 1.000 1 A 98.579 1 ATOM 1243 C CG2 . VAL 153 153 ? A 9.020 -7.516 7.762 1.000 1 A 98.579 1 ATOM 1244 N N . ASN 154 154 ? A 4.639 -6.182 7.299 1.000 1 A 98.671 1 ATOM 1245 C CA . ASN 154 154 ? A 3.561 -5.303 6.859 1.000 1 A 98.671 1 ATOM 1246 C C . ASN 154 154 ? A 4.004 -3.843 6.830 1.000 1 A 98.671 1 ATOM 1247 O O . ASN 154 154 ? A 3.890 -3.135 7.831 1.000 1 A 98.671 1 ATOM 1248 C CB . ASN 154 154 ? A 2.334 -5.467 7.759 1.000 1 A 98.671 1 ATOM 1249 C CG . ASN 154 154 ? A 1.061 -4.965 7.108 1.000 1 A 98.671 1 ATOM 1250 O OD1 . ASN 154 154 ? A 1.053 -3.915 6.459 1.000 1 A 98.671 1 ATOM 1251 N ND2 . ASN 154 154 ? A -0.025 -5.711 7.274 1.000 1 A 98.671 1 ATOM 1252 N N . ASP 155 155 ? A 4.540 -3.398 5.727 1.000 1 A 98.760 1 ATOM 1253 C CA . ASP 155 155 ? A 5.082 -2.049 5.591 1.000 1 A 98.760 1 ATOM 1254 C C . ASP 155 155 ? A 3.970 -1.004 5.627 1.000 1 A 98.760 1 ATOM 1255 O O . ASP 155 155 ? A 4.196 0.138 6.033 1.000 1 A 98.760 1 ATOM 1256 C CB . ASP 155 155 ? A 5.883 -1.921 4.294 1.000 1 A 98.760 1 ATOM 1257 C CG . ASP 155 155 ? A 5.044 -2.165 3.052 1.000 1 A 98.760 1 ATOM 1258 O OD1 . ASP 155 155 ? A 4.525 -3.289 2.878 1.000 1 A 98.760 1 ATOM 1259 O OD2 . ASP 155 155 ? A 4.903 -1.227 2.239 1.000 1 A 98.760 1 ATOM 1260 N N . ILE 156 156 ? A 2.800 -1.376 5.265 1.000 1 A 98.882 1 ATOM 1261 C CA . ILE 156 156 ? A 1.651 -0.477 5.246 1.000 1 A 98.882 1 ATOM 1262 C C . ILE 156 156 ? A 1.292 -0.067 6.672 1.000 1 A 98.882 1 ATOM 1263 O O . ILE 156 156 ? A 1.085 1.116 6.952 1.000 1 A 98.882 1 ATOM 1264 C CB . ILE 156 156 ? A 0.434 -1.131 4.554 1.000 1 A 98.882 1 ATOM 1265 C CG1 . ILE 156 156 ? A 0.801 -1.570 3.131 1.000 1 A 98.882 1 ATOM 1266 C CG2 . ILE 156 156 ? A -0.760 -0.171 4.540 1.000 1 A 98.882 1 ATOM 1267 C CD1 . ILE 156 156 ? A -0.190 -2.544 2.509 1.000 1 A 98.882 1 ATOM 1268 N N . VAL 157 157 ? A 1.279 -1.047 7.564 1.000 1 A 98.810 1 ATOM 1269 C CA . VAL 157 157 ? A 0.946 -0.787 8.961 1.000 1 A 98.810 1 ATOM 1270 C C . VAL 157 157 ? A 1.977 0.161 9.570 1.000 1 A 98.810 1 ATOM 1271 O O . VAL 157 157 ? A 1.617 1.125 10.250 1.000 1 A 98.810 1 ATOM 1272 C CB . VAL 157 157 ? A 0.876 -2.096 9.780 1.000 1 A 98.810 1 ATOM 1273 C CG1 . VAL 157 157 ? A 0.733 -1.793 11.270 1.000 1 A 98.810 1 ATOM 1274 C CG2 . VAL 157 157 ? A -0.282 -2.966 9.295 1.000 1 A 98.810 1 ATOM 1275 N N . LEU 158 158 ? A 3.183 -0.105 9.286 1.000 1 A 98.793 1 ATOM 1276 C CA . LEU 158 158 ? A 4.259 0.718 9.828 1.000 1 A 98.793 1 ATOM 1277 C C . LEU 158 158 ? A 4.185 2.139 9.280 1.000 1 A 98.793 1 ATOM 1278 O O . LEU 158 158 ? A 4.393 3.105 10.017 1.000 1 A 98.793 1 ATOM 1279 C CB . LEU 158 158 ? A 5.622 0.102 9.501 1.000 1 A 98.793 1 ATOM 1280 C CG . LEU 158 158 ? A 5.956 -1.217 10.200 1.000 1 A 98.793 1 ATOM 1281 C CD1 . LEU 158 158 ? A 7.183 -1.859 9.562 1.000 1 A 98.793 1 ATOM 1282 C CD2 . LEU 158 158 ? A 6.179 -0.990 11.692 1.000 1 A 98.793 1 ATOM 1283 N N . ALA 159 159 ? A 3.925 2.295 8.012 1.000 1 A 98.844 1 ATOM 1284 C CA . ALA 159 159 ? A 3.764 3.618 7.416 1.000 1 A 98.844 1 ATOM 1285 C C . ALA 159 159 ? A 2.588 4.363 8.041 1.000 1 A 98.844 1 ATOM 1286 O O . ALA 159 159 ? A 2.686 5.556 8.335 1.000 1 A 98.844 1 ATOM 1287 C CB . ALA 159 159 ? A 3.575 3.502 5.905 1.000 1 A 98.844 1 ATOM 1288 N N . ILE 160 160 ? A 1.463 3.663 8.261 1.000 1 A 98.862 1 ATOM 1289 C CA . ILE 160 160 ? A 0.282 4.282 8.852 1.000 1 A 98.862 1 ATOM 1290 C C . ILE 160 160 ? A 0.588 4.718 10.283 1.000 1 A 98.862 1 ATOM 1291 O O . ILE 160 160 ? A 0.202 5.812 10.701 1.000 1 A 98.862 1 ATOM 1292 C CB . ILE 160 160 ? A -0.929 3.323 8.832 1.000 1 A 98.862 1 ATOM 1293 C CG1 . ILE 160 160 ? A -1.448 3.147 7.400 1.000 1 A 98.862 1 ATOM 1294 C CG2 . ILE 160 160 ? A -2.038 3.832 9.757 1.000 1 A 98.862 1 ATOM 1295 C CD1 . ILE 160 160 ? A -2.528 2.084 7.258 1.000 1 A 98.862 1 ATOM 1296 N N . LEU 161 161 ? A 1.295 3.870 11.036 1.000 1 A 98.701 1 ATOM 1297 C CA . LEU 161 161 ? A 1.686 4.263 12.385 1.000 1 A 98.701 1 ATOM 1298 C C . LEU 161 161 ? A 2.501 5.552 12.361 1.000 1 A 98.701 1 ATOM 1299 O O . LEU 161 161 ? A 2.332 6.415 13.226 1.000 1 A 98.701 1 ATOM 1300 C CB . LEU 161 161 ? A 2.493 3.149 13.057 1.000 1 A 98.701 1 ATOM 1301 C CG . LEU 161 161 ? A 1.716 1.890 13.445 1.000 1 A 98.701 1 ATOM 1302 C CD1 . LEU 161 161 ? A 2.668 0.824 13.979 1.000 1 A 98.701 1 ATOM 1303 C CD2 . LEU 161 161 ? A 0.642 2.220 14.476 1.000 1 A 98.701 1 ATOM 1304 N N . GLU 162 162 ? A 3.365 5.679 11.332 1.000 1 A 98.457 1 ATOM 1305 C CA . GLU 162 162 ? A 4.145 6.904 11.179 1.000 1 A 98.457 1 ATOM 1306 C C . GLU 162 162 ? A 3.248 8.091 10.842 1.000 1 A 98.457 1 ATOM 1307 O O . GLU 162 162 ? A 3.399 9.172 11.416 1.000 1 A 98.457 1 ATOM 1308 C CB . GLU 162 162 ? A 5.214 6.729 10.096 1.000 1 A 98.457 1 ATOM 1309 C CG . GLU 162 162 ? A 6.063 7.970 9.864 1.000 1 A 98.457 1 ATOM 1310 C CD . GLU 162 162 ? A 6.891 8.366 11.077 1.000 1 A 98.457 1 ATOM 1311 O OE1 . GLU 162 162 ? A 7.224 9.564 11.219 1.000 1 A 98.457 1 ATOM 1312 O OE2 . GLU 162 162 ? A 7.209 7.470 11.891 1.000 1 A 98.457 1 ATOM 1313 N N . LEU 163 163 ? A 2.274 7.969 10.013 1.000 1 A 98.733 1 ATOM 1314 C CA . LEU 163 163 ? A 1.343 9.020 9.619 1.000 1 A 98.733 1 ATOM 1315 C C . LEU 163 163 ? A 0.503 9.475 10.808 1.000 1 A 98.733 1 ATOM 1316 O O . LEU 163 163 ? A 0.217 10.666 10.953 1.000 1 A 98.733 1 ATOM 1317 C CB . LEU 163 163 ? A 0.430 8.534 8.491 1.000 1 A 98.733 1 ATOM 1318 C CG . LEU 163 163 ? A 1.081 8.364 7.118 1.000 1 A 98.733 1 ATOM 1319 C CD1 . LEU 163 163 ? A 0.140 7.625 6.173 1.000 1 A 98.733 1 ATOM 1320 C CD2 . LEU 163 163 ? A 1.472 9.720 6.539 1.000 1 A 98.733 1 ATOM 1321 N N . LEU 164 164 ? A 0.144 8.551 11.669 1.000 1 A 98.365 1 ATOM 1322 C CA . LEU 164 164 ? A -0.739 8.813 12.800 1.000 1 A 98.365 1 ATOM 1323 C C . LEU 164 164 ? A -0.070 9.741 13.808 1.000 1 A 98.365 1 ATOM 1324 O O . LEU 164 164 ? A -0.729 10.263 14.711 1.000 1 A 98.365 1 ATOM 1325 C CB . LEU 164 164 ? A -1.138 7.502 13.482 1.000 1 A 98.365 1 ATOM 1326 C CG . LEU 164 164 ? A -2.166 6.641 12.747 1.000 1 A 98.365 1 ATOM 1327 C CD1 . LEU 164 164 ? A -2.323 5.293 13.443 1.000 1 A 98.365 1 ATOM 1328 C CD2 . LEU 164 164 ? A -3.506 7.363 12.661 1.000 1 A 98.365 1 ATOM 1329 N N . LYS 165 165 ? A 1.233 9.942 13.677 1.000 1 A 96.690 1 ATOM 1330 C CA . LYS 165 165 ? A 1.916 10.888 14.555 1.000 1 A 96.690 1 ATOM 1331 C C . LYS 165 165 ? A 1.420 12.312 14.321 1.000 1 A 96.690 1 ATOM 1332 O O . LYS 165 165 ? A 1.444 13.141 15.233 1.000 1 A 96.690 1 ATOM 1333 C CB . LYS 165 165 ? A 3.429 10.820 14.344 1.000 1 A 96.690 1 ATOM 1334 C CG . LYS 165 165 ? A 4.060 9.514 14.806 1.000 1 A 96.690 1 ATOM 1335 C CD . LYS 165 165 ? A 5.555 9.482 14.515 1.000 1 A 96.690 1 ATOM 1336 C CE . LYS 165 165 ? A 6.170 8.142 14.894 1.000 1 A 96.690 1 ATOM 1337 N NZ . LYS 165 165 ? A 7.613 8.068 14.516 1.000 1 A 96.690 1 ATOM 1338 N N . TYR 166 166 ? A 0.912 12.647 13.047 1.000 1 A 97.028 1 ATOM 1339 C CA . TYR 166 166 ? A 0.550 14.015 12.697 1.000 1 A 97.028 1 ATOM 1340 C C . TYR 166 166 ? A -0.865 14.078 12.136 1.000 1 A 97.028 1 ATOM 1341 O O . TYR 166 166 ? A -1.394 15.165 11.889 1.000 1 A 97.028 1 ATOM 1342 C CB . TYR 166 166 ? A 1.541 14.590 11.679 1.000 1 A 97.028 1 ATOM 1343 C CG . TYR 166 166 ? A 2.947 14.726 12.211 1.000 1 A 97.028 1 ATOM 1344 C CD1 . TYR 166 166 ? A 3.372 15.907 12.816 1.000 1 A 97.028 1 ATOM 1345 C CD2 . TYR 166 166 ? A 3.853 13.676 12.109 1.000 1 A 97.028 1 ATOM 1346 C CE1 . TYR 166 166 ? A 4.667 16.038 13.306 1.000 1 A 97.028 1 ATOM 1347 C CE2 . TYR 166 166 ? A 5.150 13.796 12.596 1.000 1 A 97.028 1 ATOM 1348 C CZ . TYR 166 166 ? A 5.548 14.979 13.192 1.000 1 A 97.028 1 ATOM 1349 O OH . TYR 166 166 ? A 6.831 15.103 13.675 1.000 1 A 97.028 1 ATOM 1350 N N . HIS 167 167 ? A -1.439 12.871 11.855 1.000 1 A 96.455 1 ATOM 1351 C CA . HIS 167 167 ? A -2.770 12.815 11.261 1.000 1 A 96.455 1 ATOM 1352 C C . HIS 167 167 ? A -3.749 12.081 12.170 1.000 1 A 96.455 1 ATOM 1353 O O . HIS 167 167 ? A -3.522 10.923 12.528 1.000 1 A 96.455 1 ATOM 1354 C CB . HIS 167 167 ? A -2.717 12.138 9.890 1.000 1 A 96.455 1 ATOM 1355 C CG . HIS 167 167 ? A -1.802 12.816 8.921 1.000 1 A 96.455 1 ATOM 1356 N ND1 . HIS 167 167 ? A -2.188 13.904 8.170 1.000 1 A 96.455 1 ATOM 1357 C CD2 . HIS 167 167 ? A -0.516 12.559 8.584 1.000 1 A 96.455 1 ATOM 1358 C CE1 . HIS 167 167 ? A -1.176 14.288 7.409 1.000 1 A 96.455 1 ATOM 1359 N NE2 . HIS 167 167 ? A -0.150 13.488 7.642 1.000 1 A 96.455 1 ATOM 1360 N N . GLN 168 168 ? A -4.824 12.696 12.433 1.000 1 A 94.942 1 ATOM 1361 C CA . GLN 168 168 ? A -5.814 12.158 13.360 1.000 1 A 94.942 1 ATOM 1362 C C . GLN 168 168 ? A -6.536 10.957 12.757 1.000 1 A 94.942 1 ATOM 1363 O O . GLN 168 168 ? A -6.872 10.007 13.467 1.000 1 A 94.942 1 ATOM 1364 C CB . GLN 168 168 ? A -6.825 13.236 13.753 1.000 1 A 94.942 1 ATOM 1365 C CG . GLN 168 168 ? A -7.813 12.792 14.823 1.000 1 A 94.942 1 ATOM 1366 C CD . GLN 168 168 ? A -7.138 12.437 16.134 1.000 1 A 94.942 1 ATOM 1367 O OE1 . GLN 168 168 ? A -6.420 13.254 16.719 1.000 1 A 94.942 1 ATOM 1368 N NE2 . GLN 168 168 ? A -7.363 11.215 16.606 1.000 1 A 94.942 1 ATOM 1369 N N . ARG 169 169 ? A -6.740 11.041 11.441 1.000 1 A 96.875 1 ATOM 1370 C CA . ARG 169 169 ? A -7.460 9.996 10.722 1.000 1 A 96.875 1 ATOM 1371 C C . ARG 169 169 ? A -6.739 9.623 9.431 1.000 1 A 96.875 1 ATOM 1372 O O . ARG 169 169 ? A -6.497 10.481 8.579 1.000 1 A 96.875 1 ATOM 1373 C CB . ARG 169 169 ? A -8.891 10.442 10.414 1.000 1 A 96.875 1 ATOM 1374 C CG . ARG 169 169 ? A -9.728 10.723 11.651 1.000 1 A 96.875 1 ATOM 1375 C CD . ARG 169 169 ? A -11.189 10.966 11.300 1.000 1 A 96.875 1 ATOM 1376 N NE . ARG 169 169 ? A -11.360 12.188 10.520 1.000 1 A 96.875 1 ATOM 1377 C CZ . ARG 169 169 ? A -11.540 13.400 11.039 1.000 1 A 96.875 1 ATOM 1378 N NH1 . ARG 169 169 ? A -11.578 13.575 12.355 1.000 1 A 96.875 1 ATOM 1379 N NH2 . ARG 169 169 ? A -11.685 14.444 10.236 1.000 1 A 96.875 1 ATOM 1380 N N . VAL 170 170 ? A -6.370 8.426 9.393 1.000 1 A 98.745 1 ATOM 1381 C CA . VAL 170 170 ? A -5.702 7.933 8.193 1.000 1 A 98.745 1 ATOM 1382 C C . VAL 170 170 ? A -6.605 6.935 7.472 1.000 1 A 98.745 1 ATOM 1383 O O . VAL 170 170 ? A -7.153 6.021 8.094 1.000 1 A 98.745 1 ATOM 1384 C CB . VAL 170 170 ? A -4.344 7.277 8.529 1.000 1 A 98.745 1 ATOM 1385 C CG1 . VAL 170 170 ? A -3.712 6.673 7.276 1.000 1 A 98.745 1 ATOM 1386 C CG2 . VAL 170 170 ? A -3.403 8.297 9.168 1.000 1 A 98.745 1 ATOM 1387 N N . LEU 171 171 ? A -6.836 7.139 6.164 1.000 1 A 98.887 1 ATOM 1388 C CA . LEU 171 171 ? A -7.638 6.254 5.326 1.000 1 A 98.887 1 ATOM 1389 C C . LEU 171 171 ? A -6.747 5.315 4.519 1.000 1 A 98.887 1 ATOM 1390 O O . LEU 171 171 ? A -5.886 5.767 3.762 1.000 1 A 98.887 1 ATOM 1391 C CB . LEU 171 171 ? A -8.526 7.070 4.382 1.000 1 A 98.887 1 ATOM 1392 C CG . LEU 171 171 ? A -9.370 6.272 3.387 1.000 1 A 98.887 1 ATOM 1393 C CD1 . LEU 171 171 ? A -10.347 5.365 4.128 1.000 1 A 98.887 1 ATOM 1394 C CD2 . LEU 171 171 ? A -10.114 7.210 2.443 1.000 1 A 98.887 1 ATOM 1395 N N . TYR 172 172 ? A -6.902 4.017 4.711 1.000 1 A 98.920 1 ATOM 1396 C CA . TYR 172 172 ? A -6.257 2.993 3.897 1.000 1 A 98.920 1 ATOM 1397 C C . TYR 172 172 ? A -7.218 2.442 2.850 1.000 1 A 98.920 1 ATOM 1398 O O . TYR 172 172 ? A -8.282 1.920 3.189 1.000 1 A 98.920 1 ATOM 1399 C CB . TYR 172 172 ? A -5.736 1.854 4.779 1.000 1 A 98.920 1 ATOM 1400 C CG . TYR 172 172 ? A -5.271 0.648 4.000 1.000 1 A 98.920 1 ATOM 1401 C CD1 . TYR 172 172 ? A -5.940 -0.570 4.099 1.000 1 A 98.920 1 ATOM 1402 C CD2 . TYR 172 172 ? A -4.161 0.723 3.165 1.000 1 A 98.920 1 ATOM 1403 C CE1 . TYR 172 172 ? A -5.513 -1.685 3.384 1.000 1 A 98.920 1 ATOM 1404 C CE2 . TYR 172 172 ? A -3.725 -0.386 2.447 1.000 1 A 98.920 1 ATOM 1405 C CZ . TYR 172 172 ? A -4.407 -1.583 2.562 1.000 1 A 98.920 1 ATOM 1406 O OH . TYR 172 172 ? A -3.981 -2.684 1.853 1.000 1 A 98.920 1 ATOM 1407 N N . ILE 173 173 ? A -6.822 2.566 1.596 1.000 1 A 98.923 1 ATOM 1408 C CA . ILE 173 173 ? A -7.617 2.067 0.479 1.000 1 A 98.923 1 ATOM 1409 C C . ILE 173 173 ? A -6.872 0.931 -0.217 1.000 1 A 98.923 1 ATOM 1410 O O . ILE 173 173 ? A -5.722 1.096 -0.632 1.000 1 A 98.923 1 ATOM 1411 C CB . ILE 173 173 ? A -7.943 3.191 -0.529 1.000 1 A 98.923 1 ATOM 1412 C CG1 . ILE 173 173 ? A -8.608 4.373 0.185 1.000 1 A 98.923 1 ATOM 1413 C CG2 . ILE 173 173 ? A -8.834 2.662 -1.658 1.000 1 A 98.923 1 ATOM 1414 C CD1 . ILE 173 173 ? A -8.680 5.642 -0.653 1.000 1 A 98.923 1 ATOM 1415 N N . ASP 174 174 ? A -7.584 -0.187 -0.413 1.000 1 A 98.805 1 ATOM 1416 C CA . ASP 174 174 ? A -6.969 -1.371 -1.006 1.000 1 A 98.805 1 ATOM 1417 C C . ASP 174 174 ? A -7.688 -1.779 -2.290 1.000 1 A 98.805 1 ATOM 1418 O O . ASP 174 174 ? A -8.806 -2.295 -2.244 1.000 1 A 98.805 1 ATOM 1419 C CB . ASP 174 174 ? A -6.970 -2.533 -0.010 1.000 1 A 98.805 1 ATOM 1420 C CG . ASP 174 174 ? A -6.173 -3.730 -0.495 1.000 1 A 98.805 1 ATOM 1421 O OD1 . ASP 174 174 ? A -5.960 -3.866 -1.720 1.000 1 A 98.805 1 ATOM 1422 O OD2 . ASP 174 174 ? A -5.756 -4.548 0.354 1.000 1 A 98.805 1 ATOM 1423 N N . ILE 175 175 ? A -6.975 -1.532 -3.476 1.000 1 A 98.588 1 ATOM 1424 C CA . ILE 175 175 ? A -7.582 -1.943 -4.737 1.000 1 A 98.588 1 ATOM 1425 C C . ILE 175 175 ? A -6.873 -3.186 -5.270 1.000 1 A 98.588 1 ATOM 1426 O O . ILE 175 175 ? A -6.949 -3.488 -6.463 1.000 1 A 98.588 1 ATOM 1427 C CB . ILE 175 175 ? A -7.535 -0.808 -5.784 1.000 1 A 98.588 1 ATOM 1428 C CG1 . ILE 175 175 ? A -6.089 -0.352 -6.011 1.000 1 A 98.588 1 ATOM 1429 C CG2 . ILE 175 175 ? A -8.418 0.365 -5.349 1.000 1 A 98.588 1 ATOM 1430 C CD1 . ILE 175 175 ? A -5.926 0.641 -7.153 1.000 1 A 98.588 1 ATOM 1431 N N . ASP 176 176 ? A -6.205 -3.934 -4.475 1.000 1 A 97.474 1 ATOM 1432 C CA . ASP 176 176 ? A -5.703 -5.287 -4.696 1.000 1 A 97.474 1 ATOM 1433 C C . ASP 176 176 ? A -6.836 -6.310 -4.633 1.000 1 A 97.474 1 ATOM 1434 O O . ASP 176 176 ? A -7.735 -6.198 -3.797 1.000 1 A 97.474 1 ATOM 1435 C CB . ASP 176 176 ? A -4.624 -5.634 -3.668 1.000 1 A 97.474 1 ATOM 1436 C CG . ASP 176 176 ? A -3.868 -6.906 -4.008 1.000 1 A 97.474 1 ATOM 1437 O OD1 . ASP 176 176 ? A -4.481 -7.995 -4.022 1.000 1 A 97.474 1 ATOM 1438 O OD2 . ASP 176 176 ? A -2.647 -6.819 -4.262 1.000 1 A 97.474 1 ATOM 1439 N N . ILE 177 177 ? A -6.830 -7.303 -5.558 1.000 1 A 95.764 1 ATOM 1440 C CA . ILE 177 177 ? A -7.933 -8.257 -5.596 1.000 1 A 95.764 1 ATOM 1441 C C . ILE 177 177 ? A -7.990 -9.034 -4.283 1.000 1 A 95.764 1 ATOM 1442 O O . ILE 177 177 ? A -9.049 -9.535 -3.896 1.000 1 A 95.764 1 ATOM 1443 C CB . ILE 177 177 ? A -7.798 -9.230 -6.789 1.000 1 A 95.764 1 ATOM 1444 C CG1 . ILE 177 177 ? A -9.101 -10.012 -6.991 1.000 1 A 95.764 1 ATOM 1445 C CG2 . ILE 177 177 ? A -6.615 -10.181 -6.579 1.000 1 A 95.764 1 ATOM 1446 C CD1 . ILE 177 177 ? A -9.107 -10.894 -8.233 1.000 1 A 95.764 1 ATOM 1447 N N . HIS 178 178 ? A -6.762 -9.176 -3.632 1.000 1 A 95.062 1 ATOM 1448 C CA . HIS 178 178 ? A -6.726 -9.848 -2.338 1.000 1 A 95.062 1 ATOM 1449 C C . HIS 178 178 ? A -7.055 -8.881 -1.206 1.000 1 A 95.062 1 ATOM 1450 O O . HIS 178 178 ? A -6.624 -7.726 -1.226 1.000 1 A 95.062 1 ATOM 1451 C CB . HIS 178 178 ? A -5.356 -10.486 -2.103 1.000 1 A 95.062 1 ATOM 1452 C CG . HIS 178 178 ? A -5.052 -11.615 -3.035 1.000 1 A 95.062 1 ATOM 1453 N ND1 . HIS 178 178 ? A -4.289 -11.457 -4.172 1.000 1 A 95.062 1 ATOM 1454 C CD2 . HIS 178 178 ? A -5.407 -12.921 -2.995 1.000 1 A 95.062 1 ATOM 1455 C CE1 . HIS 178 178 ? A -4.189 -12.621 -4.793 1.000 1 A 95.062 1 ATOM 1456 N NE2 . HIS 178 178 ? A -4.859 -13.526 -4.099 1.000 1 A 95.062 1 ATOM 1457 N N . HIS 179 179 ? A -7.784 -9.454 -0.280 1.000 1 A 94.319 1 ATOM 1458 C CA . HIS 179 179 ? A -8.192 -8.635 0.856 1.000 1 A 94.319 1 ATOM 1459 C C . HIS 179 179 ? A -6.986 -8.192 1.678 1.000 1 A 94.319 1 ATOM 1460 O O . HIS 179 179 ? A -6.065 -8.978 1.910 1.000 1 A 94.319 1 ATOM 1461 C CB . HIS 179 179 ? A -9.178 -9.399 1.741 1.000 1 A 94.319 1 ATOM 1462 C CG . HIS 179 179 ? A -9.680 -8.605 2.905 1.000 1 A 94.319 1 ATOM 1463 N ND1 . HIS 179 179 ? A -9.837 -9.146 4.163 1.000 1 A 94.319 1 ATOM 1464 C CD2 . HIS 179 179 ? A -10.058 -7.308 3.000 1.000 1 A 94.319 1 ATOM 1465 C CE1 . HIS 179 179 ? A -10.291 -8.213 4.983 1.000 1 A 94.319 1 ATOM 1466 N NE2 . HIS 179 179 ? A -10.434 -7.089 4.302 1.000 1 A 94.319 1 ATOM 1467 N N . GLY 180 180 ? A -6.897 -6.835 1.960 1.000 1 A 92.299 1 ATOM 1468 C CA . GLY 180 180 ? A -5.852 -6.334 2.838 1.000 1 A 92.299 1 ATOM 1469 C C . GLY 180 180 ? A -6.083 -6.677 4.297 1.000 1 A 92.299 1 ATOM 1470 O O . GLY 180 180 ? A -6.176 -5.786 5.143 1.000 1 A 92.299 1 ATOM 1471 N N . ASP 181 181 ? A -6.137 -7.990 4.625 1.000 1 A 96.086 1 ATOM 1472 C CA . ASP 181 181 ? A -6.531 -8.498 5.935 1.000 1 A 96.086 1 ATOM 1473 C C . ASP 181 181 ? A -5.495 -8.138 6.998 1.000 1 A 96.086 1 ATOM 1474 O O . ASP 181 181 ? A -5.843 -7.902 8.157 1.000 1 A 96.086 1 ATOM 1475 C CB . ASP 181 181 ? A -6.728 -10.014 5.886 1.000 1 A 96.086 1 ATOM 1476 C CG . ASP 181 181 ? A -5.504 -10.756 5.379 1.000 1 A 96.086 1 ATOM 1477 O OD1 . ASP 181 181 ? A -4.663 -10.142 4.687 1.000 1 A 96.086 1 ATOM 1478 O OD2 . ASP 181 181 ? A -5.381 -11.965 5.671 1.000 1 A 96.086 1 ATOM 1479 N N . GLY 182 182 ? A -4.228 -8.158 6.625 1.000 1 A 97.329 1 ATOM 1480 C CA . GLY 182 182 ? A -3.212 -7.794 7.600 1.000 1 A 97.329 1 ATOM 1481 C C . GLY 182 182 ? A -3.386 -6.390 8.147 1.000 1 A 97.329 1 ATOM 1482 O O . GLY 182 182 ? A -3.303 -6.176 9.358 1.000 1 A 97.329 1 ATOM 1483 N N . VAL 183 183 ? A -3.634 -5.453 7.213 1.000 1 A 98.535 1 ATOM 1484 C CA . VAL 183 183 ? A -3.804 -4.057 7.600 1.000 1 A 98.535 1 ATOM 1485 C C . VAL 183 183 ? A -5.112 -3.889 8.369 1.000 1 A 98.535 1 ATOM 1486 O O . VAL 183 183 ? A -5.150 -3.216 9.402 1.000 1 A 98.535 1 ATOM 1487 C CB . VAL 183 183 ? A -3.784 -3.121 6.370 1.000 1 A 98.535 1 ATOM 1488 C CG1 . VAL 183 183 ? A -3.930 -1.662 6.800 1.000 1 A 98.535 1 ATOM 1489 C CG2 . VAL 183 183 ? A -2.499 -3.319 5.570 1.000 1 A 98.535 1 ATOM 1490 N N . GLU 184 184 ? A -6.235 -4.505 7.829 1.000 1 A 98.011 1 ATOM 1491 C CA . GLU 184 184 ? A -7.531 -4.438 8.496 1.000 1 A 98.011 1 ATOM 1492 C C . GLU 184 184 ? A -7.446 -4.967 9.925 1.000 1 A 98.011 1 ATOM 1493 O O . GLU 184 184 ? A -7.950 -4.338 10.857 1.000 1 A 98.011 1 ATOM 1494 C CB . GLU 184 184 ? A -8.583 -5.221 7.707 1.000 1 A 98.011 1 ATOM 1495 C CG . GLU 184 184 ? A -9.977 -5.165 8.315 1.000 1 A 98.011 1 ATOM 1496 C CD . GLU 184 184 ? A -10.999 -5.991 7.551 1.000 1 A 98.011 1 ATOM 1497 O OE1 . GLU 184 184 ? A -11.239 -7.160 7.928 1.000 1 A 98.011 1 ATOM 1498 O OE2 . GLU 184 184 ? A -11.565 -5.464 6.566 1.000 1 A 98.011 1 ATOM 1499 N N . GLU 185 185 ? A -6.769 -6.085 10.073 1.000 1 A 96.997 1 ATOM 1500 C CA . GLU 185 185 ? A -6.626 -6.684 11.397 1.000 1 A 96.997 1 ATOM 1501 C C . GLU 185 185 ? A -5.867 -5.758 12.343 1.000 1 A 96.997 1 ATOM 1502 O O . GLU 185 185 ? A -6.228 -5.626 13.514 1.000 1 A 96.997 1 ATOM 1503 C CB . GLU 185 185 ? A -5.914 -8.036 11.302 1.000 1 A 96.997 1 ATOM 1504 C CG . GLU 185 185 ? A -5.760 -8.745 12.640 1.000 1 A 96.997 1 ATOM 1505 C CD . GLU 185 185 ? A -5.001 -10.059 12.538 1.000 1 A 96.997 1 ATOM 1506 O OE1 . GLU 185 185 ? A -4.253 -10.402 13.481 1.000 1 A 96.997 1 ATOM 1507 O OE2 . GLU 185 185 ? A -5.156 -10.751 11.507 1.000 1 A 96.997 1 ATOM 1508 N N . ALA 186 186 ? A -4.829 -5.144 11.901 1.000 1 A 98.050 1 ATOM 1509 C CA . ALA 186 186 ? A -3.985 -4.281 12.724 1.000 1 A 98.050 1 ATOM 1510 C C . ALA 186 186 ? A -4.778 -3.097 13.269 1.000 1 A 98.050 1 ATOM 1511 O O . ALA 186 186 ? A -4.526 -2.634 14.384 1.000 1 A 98.050 1 ATOM 1512 C CB . ALA 186 186 ? A -2.785 -3.788 11.919 1.000 1 A 98.050 1 ATOM 1513 N N . PHE 187 187 ? A -5.782 -2.684 12.564 1.000 1 A 98.171 1 ATOM 1514 C CA . PHE 187 187 ? A -6.484 -1.462 12.940 1.000 1 A 98.171 1 ATOM 1515 C C . PHE 187 187 ? A -7.970 -1.731 13.140 1.000 1 A 98.171 1 ATOM 1516 O O . PHE 187 187 ? A -8.794 -0.823 13.005 1.000 1 A 98.171 1 ATOM 1517 C CB . PHE 187 187 ? A -6.284 -0.377 11.876 1.000 1 A 98.171 1 ATOM 1518 C CG . PHE 187 187 ? A -4.854 0.064 11.721 1.000 1 A 98.171 1 ATOM 1519 C CD1 . PHE 187 187 ? A -4.204 0.738 12.748 1.000 1 A 98.171 1 ATOM 1520 C CD2 . PHE 187 187 ? A -4.160 -0.194 10.546 1.000 1 A 98.171 1 ATOM 1521 C CE1 . PHE 187 187 ? A -2.881 1.148 12.606 1.000 1 A 98.171 1 ATOM 1522 C CE2 . PHE 187 187 ? A -2.837 0.213 10.397 1.000 1 A 98.171 1 ATOM 1523 C CZ . PHE 187 187 ? A -2.200 0.885 11.428 1.000 1 A 98.171 1 ATOM 1524 N N . TYR 188 188 ? A -8.340 -2.963 13.402 1.000 1 A 97.331 1 ATOM 1525 C CA . TYR 188 188 ? A -9.705 -3.472 13.474 1.000 1 A 97.331 1 ATOM 1526 C C . TYR 188 188 ? A -10.470 -2.821 14.620 1.000 1 A 97.331 1 ATOM 1527 O O . TYR 188 188 ? A -11.693 -2.679 14.557 1.000 1 A 97.331 1 ATOM 1528 C CB . TYR 188 188 ? A -9.704 -4.994 13.645 1.000 1 A 97.331 1 ATOM 1529 C CG . TYR 188 188 ? A -11.020 -5.645 13.295 1.000 1 A 97.331 1 ATOM 1530 C CD1 . TYR 188 188 ? A -11.830 -6.200 14.284 1.000 1 A 97.331 1 ATOM 1531 C CD2 . TYR 188 188 ? A -11.456 -5.708 11.976 1.000 1 A 97.331 1 ATOM 1532 C CE1 . TYR 188 188 ? A -13.042 -6.803 13.966 1.000 1 A 97.331 1 ATOM 1533 C CE2 . TYR 188 188 ? A -12.666 -6.309 11.647 1.000 1 A 97.331 1 ATOM 1534 C CZ . TYR 188 188 ? A -13.452 -6.852 12.647 1.000 1 A 97.331 1 ATOM 1535 O OH . TYR 188 188 ? A -14.651 -7.448 12.327 1.000 1 A 97.331 1 ATOM 1536 N N . THR 189 189 ? A -9.753 -2.391 15.632 1.000 1 A 96.892 1 ATOM 1537 C CA . THR 189 189 ? A -10.451 -1.959 16.838 1.000 1 A 96.892 1 ATOM 1538 C C . THR 189 189 ? A -10.237 -0.468 17.082 1.000 1 A 96.892 1 ATOM 1539 O O . THR 189 189 ? A -10.511 0.033 18.175 1.000 1 A 96.892 1 ATOM 1540 C CB . THR 189 189 ? A -9.983 -2.757 18.070 1.000 1 A 96.892 1 ATOM 1541 O OG1 . THR 189 189 ? A -8.568 -2.596 18.227 1.000 1 A 96.892 1 ATOM 1542 C CG2 . THR 189 189 ? A -10.301 -4.241 17.918 1.000 1 A 96.892 1 ATOM 1543 N N . THR 190 190 ? A -9.647 0.314 16.168 1.000 1 A 95.963 1 ATOM 1544 C CA . THR 190 190 ? A -9.413 1.742 16.347 1.000 1 A 95.963 1 ATOM 1545 C C . THR 190 190 ? A -10.292 2.557 15.402 1.000 1 A 95.963 1 ATOM 1546 O O . THR 190 190 ? A -10.628 2.098 14.308 1.000 1 A 95.963 1 ATOM 1547 C CB . THR 190 190 ? A -7.934 2.100 16.112 1.000 1 A 95.963 1 ATOM 1548 O OG1 . THR 190 190 ? A -7.749 3.506 16.318 1.000 1 A 95.963 1 ATOM 1549 C CG2 . THR 190 190 ? A -7.500 1.745 14.694 1.000 1 A 95.963 1 ATOM 1550 N N . ASP 191 191 ? A -10.640 3.689 15.739 1.000 1 A 95.985 1 ATOM 1551 C CA . ASP 191 191 ? A -11.404 4.593 14.884 1.000 1 A 95.985 1 ATOM 1552 C C . ASP 191 191 ? A -10.491 5.618 14.215 1.000 1 A 95.985 1 ATOM 1553 O O . ASP 191 191 ? A -10.966 6.534 13.540 1.000 1 A 95.985 1 ATOM 1554 C CB . ASP 191 191 ? A -12.491 5.305 15.692 1.000 1 A 95.985 1 ATOM 1555 C CG . ASP 191 191 ? A -11.934 6.118 16.847 1.000 1 A 95.985 1 ATOM 1556 O OD1 . ASP 191 191 ? A -10.714 6.050 17.109 1.000 1 A 95.985 1 ATOM 1557 O OD2 . ASP 191 191 ? A -12.724 6.831 17.504 1.000 1 A 95.985 1 ATOM 1558 N N . ARG 192 192 ? A -9.199 5.529 14.409 1.000 1 A 97.592 1 ATOM 1559 C CA . ARG 192 192 ? A -8.263 6.493 13.838 1.000 1 A 97.592 1 ATOM 1560 C C . ARG 192 192 ? A -7.855 6.089 12.426 1.000 1 A 97.592 1 ATOM 1561 O O . ARG 192 192 ? A -7.309 6.901 11.676 1.000 1 A 97.592 1 ATOM 1562 C CB . ARG 192 192 ? A -7.023 6.627 14.724 1.000 1 A 97.592 1 ATOM 1563 C CG . ARG 192 192 ? A -7.307 7.218 16.096 1.000 1 A 97.592 1 ATOM 1564 C CD . ARG 192 192 ? A -6.030 7.668 16.792 1.000 1 A 97.592 1 ATOM 1565 N NE . ARG 192 192 ? A -5.383 8.763 16.074 1.000 1 A 97.592 1 ATOM 1566 C CZ . ARG 192 192 ? A -4.170 9.237 16.348 1.000 1 A 97.592 1 ATOM 1567 N NH1 . ARG 192 192 ? A -3.446 8.718 17.333 1.000 1 A 97.592 1 ATOM 1568 N NH2 . ARG 192 192 ? A -3.678 10.237 15.632 1.000 1 A 97.592 1 ATOM 1569 N N . VAL 193 193 ? A -8.093 4.853 12.149 1.000 1 A 98.499 1 ATOM 1570 C CA . VAL 193 193 ? A -7.802 4.333 10.817 1.000 1 A 98.499 1 ATOM 1571 C C . VAL 193 193 ? A -9.044 3.653 10.244 1.000 1 A 98.499 1 ATOM 1572 O O . VAL 193 193 ? A -9.669 2.825 10.912 1.000 1 A 98.499 1 ATOM 1573 C CB . VAL 193 193 ? A -6.616 3.343 10.841 1.000 1 A 98.499 1 ATOM 1574 C CG1 . VAL 193 193 ? A -6.323 2.818 9.437 1.000 1 A 98.499 1 ATOM 1575 C CG2 . VAL 193 193 ? A -5.376 4.011 11.434 1.000 1 A 98.499 1 ATOM 1576 N N . MET 194 194 ? A -9.444 4.057 9.066 1.000 1 A 98.692 1 ATOM 1577 C CA . MET 194 194 ? A -10.476 3.339 8.323 1.000 1 A 98.692 1 ATOM 1578 C C . MET 194 194 ? A -9.870 2.568 7.155 1.000 1 A 98.692 1 ATOM 1579 O O . MET 194 194 ? A -9.047 3.106 6.412 1.000 1 A 98.692 1 ATOM 1580 C CB . MET 194 194 ? A -11.544 4.307 7.812 1.000 1 A 98.692 1 ATOM 1581 C CG . MET 194 194 ? A -12.629 3.642 6.981 1.000 1 A 98.692 1 ATOM 1582 S SD . MET 194 194 ? A -13.919 4.825 6.431 1.000 1 A 98.692 1 ATOM 1583 C CE . MET 194 194 ? A -14.802 5.085 7.994 1.000 1 A 98.692 1 ATOM 1584 N N . THR 195 195 ? A -10.279 1.272 7.073 1.000 1 A 98.851 1 ATOM 1585 C CA . THR 195 195 ? A -9.824 0.465 5.947 1.000 1 A 98.851 1 ATOM 1586 C C . THR 195 195 ? A -10.959 0.235 4.953 1.000 1 A 98.851 1 ATOM 1587 O O . THR 195 195 ? A -12.100 -0.008 5.351 1.000 1 A 98.851 1 ATOM 1588 C CB . THR 195 195 ? A -9.270 -0.892 6.420 1.000 1 A 98.851 1 ATOM 1589 O OG1 . THR 195 195 ? A -10.323 -1.641 7.040 1.000 1 A 98.851 1 ATOM 1590 C CG2 . THR 195 195 ? A -8.137 -0.704 7.422 1.000 1 A 98.851 1 ATOM 1591 N N . VAL 196 196 ? A -10.660 0.398 3.714 1.000 1 A 98.855 1 ATOM 1592 C CA . VAL 196 196 ? A -11.595 0.138 2.625 1.000 1 A 98.855 1 ATOM 1593 C C . VAL 196 196 ? A -10.958 -0.809 1.611 1.000 1 A 98.855 1 ATOM 1594 O O . VAL 196 196 ? A -9.915 -0.496 1.031 1.000 1 A 98.855 1 ATOM 1595 C CB . VAL 196 196 ? A -12.036 1.446 1.931 1.000 1 A 98.855 1 ATOM 1596 C CG1 . VAL 196 196 ? A -13.134 1.169 0.905 1.000 1 A 98.855 1 ATOM 1597 C CG2 . VAL 196 196 ? A -12.511 2.464 2.965 1.000 1 A 98.855 1 ATOM 1598 N N . SER 197 197 ? A -11.593 -1.934 1.382 1.000 1 A 98.635 1 ATOM 1599 C CA . SER 197 197 ? A -11.031 -2.918 0.464 1.000 1 A 98.635 1 ATOM 1600 C C . SER 197 197 ? A -12.057 -3.353 -0.577 1.000 1 A 98.635 1 ATOM 1601 O O . SER 197 197 ? A -13.201 -3.664 -0.237 1.000 1 A 98.635 1 ATOM 1602 C CB . SER 197 197 ? A -10.523 -4.140 1.231 1.000 1 A 98.635 1 ATOM 1603 O OG . SER 197 197 ? A -9.899 -5.062 0.354 1.000 1 A 98.635 1 ATOM 1604 N N . PHE 198 198 ? A -11.673 -3.377 -1.822 1.000 1 A 98.578 1 ATOM 1605 C CA . PHE 198 198 ? A -12.410 -3.947 -2.944 1.000 1 A 98.578 1 ATOM 1606 C C . PHE 198 198 ? A -11.752 -5.234 -3.427 1.000 1 A 98.578 1 ATOM 1607 O O . PHE 198 198 ? A -10.736 -5.194 -4.124 1.000 1 A 98.578 1 ATOM 1608 C CB . PHE 198 198 ? A -12.501 -2.940 -4.095 1.000 1 A 98.578 1 ATOM 1609 C CG . PHE 198 198 ? A -13.118 -1.624 -3.703 1.000 1 A 98.578 1 ATOM 1610 C CD1 . PHE 198 198 ? A -14.445 -1.346 -4.005 1.000 1 A 98.578 1 ATOM 1611 C CD2 . PHE 198 198 ? A -12.370 -0.666 -3.032 1.000 1 A 98.578 1 ATOM 1612 C CE1 . PHE 198 198 ? A -15.019 -0.129 -3.644 1.000 1 A 98.578 1 ATOM 1613 C CE2 . PHE 198 198 ? A -12.936 0.552 -2.668 1.000 1 A 98.578 1 ATOM 1614 C CZ . PHE 198 198 ? A -14.260 0.819 -2.976 1.000 1 A 98.578 1 ATOM 1615 N N . HIS 199 199 ? A -12.398 -6.416 -3.053 1.000 1 A 97.731 1 ATOM 1616 C CA . HIS 199 199 ? A -11.640 -7.648 -3.241 1.000 1 A 97.731 1 ATOM 1617 C C . HIS 199 199 ? A -12.541 -8.783 -3.715 1.000 1 A 97.731 1 ATOM 1618 O O . HIS 199 199 ? A -13.765 -8.702 -3.594 1.000 1 A 97.731 1 ATOM 1619 C CB . HIS 199 199 ? A -10.935 -8.045 -1.942 1.000 1 A 97.731 1 ATOM 1620 C CG . HIS 199 199 ? A -11.858 -8.175 -0.773 1.000 1 A 97.731 1 ATOM 1621 N ND1 . HIS 199 199 ? A -12.213 -7.104 0.017 1.000 1 A 97.731 1 ATOM 1622 C CD2 . HIS 199 199 ? A -12.502 -9.252 -0.264 1.000 1 A 97.731 1 ATOM 1623 C CE1 . HIS 199 199 ? A -13.037 -7.518 0.965 1.000 1 A 97.731 1 ATOM 1624 N NE2 . HIS 199 199 ? A -13.228 -8.818 0.817 1.000 1 A 97.731 1 ATOM 1625 N N . LYS 200 200 ? A -11.857 -9.740 -4.305 1.000 1 A 96.327 1 ATOM 1626 C CA . LYS 200 200 ? A -12.557 -10.984 -4.610 1.000 1 A 96.327 1 ATOM 1627 C C . LYS 200 200 ? A -12.910 -11.744 -3.334 1.000 1 A 96.327 1 ATOM 1628 O O . LYS 200 200 ? A -12.048 -11.972 -2.483 1.000 1 A 96.327 1 ATOM 1629 C CB . LYS 200 200 ? A -11.708 -11.866 -5.527 1.000 1 A 96.327 1 ATOM 1630 C CG . LYS 200 200 ? A -12.350 -13.203 -5.867 1.000 1 A 96.327 1 ATOM 1631 C CD . LYS 200 200 ? A -12.966 -13.189 -7.261 1.000 1 A 96.327 1 ATOM 1632 C CE . LYS 200 200 ? A -13.560 -14.543 -7.624 1.000 1 A 96.327 1 ATOM 1633 N NZ . LYS 200 200 ? A -14.331 -15.133 -6.488 1.000 1 A 96.327 1 ATOM 1634 N N . TYR 201 201 ? A -14.095 -12.027 -3.124 1.000 1 A 92.817 1 ATOM 1635 C CA . TYR 201 201 ? A -14.547 -12.702 -1.912 1.000 1 A 92.817 1 ATOM 1636 C C . TYR 201 201 ? A -15.126 -14.074 -2.235 1.000 1 A 92.817 1 ATOM 1637 O O . TYR 201 201 ? A -15.684 -14.281 -3.316 1.000 1 A 92.817 1 ATOM 1638 C CB . TYR 201 201 ? A -15.593 -11.853 -1.183 1.000 1 A 92.817 1 ATOM 1639 C CG . TYR 201 201 ? A -16.073 -12.462 0.113 1.000 1 A 92.817 1 ATOM 1640 C CD1 . TYR 201 201 ? A -17.328 -13.060 0.201 1.000 1 A 92.817 1 ATOM 1641 C CD2 . TYR 201 201 ? A -15.273 -12.440 1.250 1.000 1 A 92.817 1 ATOM 1642 C CE1 . TYR 201 201 ? A -17.775 -13.621 1.393 1.000 1 A 92.817 1 ATOM 1643 C CE2 . TYR 201 201 ? A -15.709 -12.997 2.447 1.000 1 A 92.817 1 ATOM 1644 C CZ . TYR 201 201 ? A -16.959 -13.585 2.509 1.000 1 A 92.817 1 ATOM 1645 O OH . TYR 201 201 ? A -17.397 -14.139 3.692 1.000 1 A 92.817 1 ATOM 1646 N N . GLY 202 202 ? A -14.956 -14.999 -1.211 1.000 1 A 84.911 1 ATOM 1647 C CA . GLY 202 202 ? A -15.424 -16.372 -1.301 1.000 1 A 84.911 1 ATOM 1648 C C . GLY 202 202 ? A -14.305 -17.392 -1.205 1.000 1 A 84.911 1 ATOM 1649 O O . GLY 202 202 ? A -13.504 -17.356 -0.269 1.000 1 A 84.911 1 ATOM 1650 N N . GLU 203 203 ? A -14.151 -18.264 -2.046 1.000 1 A 73.635 1 ATOM 1651 C CA . GLU 203 203 ? A -13.197 -19.364 -1.947 1.000 1 A 73.635 1 ATOM 1652 C C . GLU 203 203 ? A -11.782 -18.900 -2.282 1.000 1 A 73.635 1 ATOM 1653 O O . GLU 203 203 ? A -10.815 -19.634 -2.069 1.000 1 A 73.635 1 ATOM 1654 C CB . GLU 203 203 ? A -13.605 -20.515 -2.871 1.000 1 A 73.635 1 ATOM 1655 C CG . GLU 203 203 ? A -14.904 -21.197 -2.467 1.000 1 A 73.635 1 ATOM 1656 C CD . GLU 203 203 ? A -15.211 -22.439 -3.289 1.000 1 A 73.635 1 ATOM 1657 O OE1 . GLU 203 203 ? A -16.154 -23.183 -2.935 1.000 1 A 73.635 1 ATOM 1658 O OE2 . GLU 203 203 ? A -14.502 -22.670 -4.294 1.000 1 A 73.635 1 ATOM 1659 N N . TYR 204 204 ? A -11.556 -17.699 -2.761 1.000 1 A 64.390 1 ATOM 1660 C CA . TYR 204 204 ? A -10.316 -17.115 -3.260 1.000 1 A 64.390 1 ATOM 1661 C C . TYR 204 204 ? A -9.329 -16.876 -2.124 1.000 1 A 64.390 1 ATOM 1662 O O . TYR 204 204 ? A -8.158 -17.248 -2.223 1.000 1 A 64.390 1 ATOM 1663 C CB . TYR 204 204 ? A -10.598 -15.800 -3.993 1.000 1 A 64.390 1 ATOM 1664 C CG . TYR 204 204 ? A -9.436 -15.306 -4.821 1.000 1 A 64.390 1 ATOM 1665 C CD1 . TYR 204 204 ? A -8.647 -14.244 -4.385 1.000 1 A 64.390 1 ATOM 1666 C CD2 . TYR 204 204 ? A -9.127 -15.898 -6.040 1.000 1 A 64.390 1 ATOM 1667 C CE1 . TYR 204 204 ? A -7.577 -13.784 -5.145 1.000 1 A 64.390 1 ATOM 1668 C CE2 . TYR 204 204 ? A -8.059 -15.446 -6.809 1.000 1 A 64.390 1 ATOM 1669 C CZ . TYR 204 204 ? A -7.291 -14.391 -6.354 1.000 1 A 64.390 1 ATOM 1670 O OH . TYR 204 204 ? A -6.233 -13.939 -7.111 1.000 1 A 64.390 1 ATOM 1671 N N . PHE 205 205 ? A -9.784 -16.674 -0.656 1.000 1 A 68.160 1 ATOM 1672 C CA . PHE 205 205 ? A -9.157 -16.509 0.650 1.000 1 A 68.160 1 ATOM 1673 C C . PHE 205 205 ? A -10.195 -16.593 1.763 1.000 1 A 68.160 1 ATOM 1674 O O . PHE 205 205 ? A -10.731 -15.571 2.198 1.000 1 A 68.160 1 ATOM 1675 C CB . PHE 205 205 ? A -8.414 -15.171 0.726 1.000 1 A 68.160 1 ATOM 1676 C CG . PHE 205 205 ? A -6.937 -15.311 0.980 1.000 1 A 68.160 1 ATOM 1677 C CD1 . PHE 205 205 ? A -6.433 -15.264 2.274 1.000 1 A 68.160 1 ATOM 1678 C CD2 . PHE 205 205 ? A -6.053 -15.491 -0.076 1.000 1 A 68.160 1 ATOM 1679 C CE1 . PHE 205 205 ? A -5.067 -15.393 2.512 1.000 1 A 68.160 1 ATOM 1680 C CE2 . PHE 205 205 ? A -4.686 -15.621 0.155 1.000 1 A 68.160 1 ATOM 1681 C CZ . PHE 205 205 ? A -4.195 -15.570 1.449 1.000 1 A 68.160 1 ATOM 1682 N N . PRO 206 206 ? A -10.452 -17.786 2.219 1.000 1 A 68.639 1 ATOM 1683 C CA . PRO 206 206 ? A -11.558 -17.958 3.163 1.000 1 A 68.639 1 ATOM 1684 C C . PRO 206 206 ? A -11.320 -17.239 4.489 1.000 1 A 68.639 1 ATOM 1685 O O . PRO 206 206 ? A -10.174 -17.106 4.926 1.000 1 A 68.639 1 ATOM 1686 C CB . PRO 206 206 ? A -11.615 -19.474 3.366 1.000 1 A 68.639 1 ATOM 1687 C CG . PRO 206 206 ? A -10.283 -19.972 2.904 1.000 1 A 68.639 1 ATOM 1688 C CD . PRO 206 206 ? A -9.667 -18.930 2.015 1.000 1 A 68.639 1 ATOM 1689 N N . GLY 207 207 ? A -12.327 -16.515 4.943 1.000 1 A 77.513 1 ATOM 1690 C CA . GLY 207 207 ? A -12.364 -16.134 6.346 1.000 1 A 77.513 1 ATOM 1691 C C . GLY 207 207 ? A -12.120 -14.654 6.569 1.000 1 A 77.513 1 ATOM 1692 O O . GLY 207 207 ? A -12.244 -14.161 7.692 1.000 1 A 77.513 1 ATOM 1693 N N . THR 208 208 ? A -11.766 -13.843 5.496 1.000 1 A 86.683 1 ATOM 1694 C CA . THR 208 208 ? A -11.559 -12.412 5.692 1.000 1 A 86.683 1 ATOM 1695 C C . THR 208 208 ? A -12.256 -11.610 4.597 1.000 1 A 86.683 1 ATOM 1696 O O . THR 208 208 ? A -12.567 -12.146 3.531 1.000 1 A 86.683 1 ATOM 1697 C CB . THR 208 208 ? A -10.060 -12.062 5.713 1.000 1 A 86.683 1 ATOM 1698 O OG1 . THR 208 208 ? A -9.493 -12.337 4.426 1.000 1 A 86.683 1 ATOM 1699 C CG2 . THR 208 208 ? A -9.319 -12.878 6.767 1.000 1 A 86.683 1 ATOM 1700 N N . GLY 209 209 ? A -12.690 -10.441 4.880 1.000 1 A 92.394 1 ATOM 1701 C CA . GLY 209 209 ? A -13.180 -9.520 3.867 1.000 1 A 92.394 1 ATOM 1702 C C . GLY 209 209 ? A -14.676 -9.628 3.636 1.000 1 A 92.394 1 ATOM 1703 O O . GLY 209 209 ? A -15.183 -9.186 2.603 1.000 1 A 92.394 1 ATOM 1704 N N . ASP 210 210 ? A -15.350 -10.392 4.561 1.000 1 A 94.733 1 ATOM 1705 C CA . ASP 210 210 ? A -16.805 -10.492 4.498 1.000 1 A 94.733 1 ATOM 1706 C C . ASP 210 210 ? A -17.460 -9.133 4.733 1.000 1 A 94.733 1 ATOM 1707 O O . ASP 210 210 ? A -16.961 -8.326 5.520 1.000 1 A 94.733 1 ATOM 1708 C CB . ASP 210 210 ? A -17.319 -11.508 5.521 1.000 1 A 94.733 1 ATOM 1709 C CG . ASP 210 210 ? A -18.784 -11.856 5.327 1.000 1 A 94.733 1 ATOM 1710 O OD1 . ASP 210 210 ? A -19.655 -11.002 5.601 1.000 1 A 94.733 1 ATOM 1711 O OD2 . ASP 210 210 ? A -19.071 -12.995 4.900 1.000 1 A 94.733 1 ATOM 1712 N N . LEU 211 211 ? A -18.619 -8.930 4.038 1.000 1 A 95.497 1 ATOM 1713 C CA . LEU 211 211 ? A -19.391 -7.700 4.171 1.000 1 A 95.497 1 ATOM 1714 C C . LEU 211 211 ? A -19.749 -7.437 5.630 1.000 1 A 95.497 1 ATOM 1715 O O . LEU 211 211 ? A -19.902 -6.283 6.037 1.000 1 A 95.497 1 ATOM 1716 C CB . LEU 211 211 ? A -20.666 -7.773 3.326 1.000 1 A 95.497 1 ATOM 1717 C CG . LEU 211 211 ? A -21.578 -6.546 3.367 1.000 1 A 95.497 1 ATOM 1718 C CD1 . LEU 211 211 ? A -20.840 -5.318 2.845 1.000 1 A 95.497 1 ATOM 1719 C CD2 . LEU 211 211 ? A -22.848 -6.796 2.561 1.000 1 A 95.497 1 ATOM 1720 N N . ARG 212 212 ? A -19.789 -8.460 6.467 1.000 1 A 95.714 1 ATOM 1721 C CA . ARG 212 212 ? A -20.196 -8.353 7.864 1.000 1 A 95.714 1 ATOM 1722 C C . ARG 212 212 ? A -19.007 -8.017 8.757 1.000 1 A 95.714 1 ATOM 1723 O O . ARG 212 212 ? A -19.178 -7.710 9.938 1.000 1 A 95.714 1 ATOM 1724 C CB . ARG 212 212 ? A -20.854 -9.652 8.334 1.000 1 A 95.714 1 ATOM 1725 C CG . ARG 212 212 ? A -22.175 -9.958 7.646 1.000 1 A 95.714 1 ATOM 1726 C CD . ARG 212 212 ? A -22.721 -11.319 8.053 1.000 1 A 95.714 1 ATOM 1727 N NE . ARG 212 212 ? A -21.849 -12.404 7.613 1.000 1 A 95.714 1 ATOM 1728 C CZ . ARG 212 212 ? A -22.083 -13.697 7.821 1.000 1 A 95.714 1 ATOM 1729 N NH1 . ARG 212 212 ? A -23.173 -14.093 8.469 1.000 1 A 95.714 1 ATOM 1730 N NH2 . ARG 212 212 ? A -21.222 -14.601 7.377 1.000 1 A 95.714 1 ATOM 1731 N N . ASP 213 213 ? A -17.880 -8.082 8.164 1.000 1 A 95.705 1 ATOM 1732 C CA . ASP 213 213 ? A -16.696 -7.659 8.906 1.000 1 A 95.705 1 ATOM 1733 C C . ASP 213 213 ? A -16.582 -6.137 8.936 1.000 1 A 95.705 1 ATOM 1734 O O . ASP 213 213 ? A -16.057 -5.529 8.002 1.000 1 A 95.705 1 ATOM 1735 C CB . ASP 213 213 ? A -15.433 -8.268 8.293 1.000 1 A 95.705 1 ATOM 1736 C CG . ASP 213 213 ? A -15.360 -9.776 8.463 1.000 1 A 95.705 1 ATOM 1737 O OD1 . ASP 213 213 ? A -16.022 -10.320 9.372 1.000 1 A 95.705 1 ATOM 1738 O OD2 . ASP 213 213 ? A -14.631 -10.425 7.681 1.000 1 A 95.705 1 ATOM 1739 N N . ILE 214 214 ? A -16.923 -5.520 10.090 1.000 1 A 97.677 1 ATOM 1740 C CA . ILE 214 214 ? A -17.128 -4.076 10.084 1.000 1 A 97.677 1 ATOM 1741 C C . ILE 214 214 ? A -16.267 -3.427 11.165 1.000 1 A 97.677 1 ATOM 1742 O O . ILE 214 214 ? A -16.414 -2.236 11.453 1.000 1 A 97.677 1 ATOM 1743 C CB . ILE 214 214 ? A -18.616 -3.716 10.296 1.000 1 A 97.677 1 ATOM 1744 C CG1 . ILE 214 214 ? A -19.133 -4.329 11.602 1.000 1 A 97.677 1 ATOM 1745 C CG2 . ILE 214 214 ? A -19.459 -4.178 9.103 1.000 1 A 97.677 1 ATOM 1746 C CD1 . ILE 214 214 ? A -20.513 -3.835 12.014 1.000 1 A 97.677 1 ATOM 1747 N N . GLY 215 215 ? A -15.393 -4.185 11.779 1.000 1 A 97.128 1 ATOM 1748 C CA . GLY 215 215 ? A -14.605 -3.695 12.898 1.000 1 A 97.128 1 ATOM 1749 C C . GLY 215 215 ? A -15.173 -4.091 14.248 1.000 1 A 97.128 1 ATOM 1750 O O . GLY 215 215 ? A -16.196 -4.775 14.320 1.000 1 A 97.128 1 ATOM 1751 N N . ALA 216 216 ? A -14.469 -3.759 15.332 1.000 1 A 97.263 1 ATOM 1752 C CA . ALA 216 216 ? A -14.875 -4.084 16.697 1.000 1 A 97.263 1 ATOM 1753 C C . ALA 216 216 ? A -14.493 -2.965 17.663 1.000 1 A 97.263 1 ATOM 1754 O O . ALA 216 216 ? A -13.596 -2.169 17.377 1.000 1 A 97.263 1 ATOM 1755 C CB . ALA 216 216 ? A -14.246 -5.403 17.140 1.000 1 A 97.263 1 ATOM 1756 N N . GLY 217 217 ? A -15.250 -2.865 18.733 1.000 1 A 95.417 1 ATOM 1757 C CA . GLY 217 217 ? A -14.972 -1.837 19.723 1.000 1 A 95.417 1 ATOM 1758 C C . GLY 217 217 ? A -15.060 -0.430 19.164 1.000 1 A 95.417 1 ATOM 1759 O O . GLY 217 217 ? A -16.040 -0.079 18.504 1.000 1 A 95.417 1 ATOM 1760 N N . LYS 218 218 ? A -14.037 0.377 19.420 1.000 1 A 94.933 1 ATOM 1761 C CA . LYS 218 218 ? A -14.015 1.748 18.919 1.000 1 A 94.933 1 ATOM 1762 C C . LYS 218 218 ? A -13.929 1.776 17.396 1.000 1 A 94.933 1 ATOM 1763 O O . LYS 218 218 ? A -14.301 2.768 16.766 1.000 1 A 94.933 1 ATOM 1764 C CB . LYS 218 218 ? A -12.842 2.522 19.524 1.000 1 A 94.933 1 ATOM 1765 C CG . LYS 218 218 ? A -13.011 2.848 21.001 1.000 1 A 94.933 1 ATOM 1766 C CD . LYS 218 218 ? A -11.859 3.698 21.521 1.000 1 A 94.933 1 ATOM 1767 C CE . LYS 218 218 ? A -12.026 4.023 22.999 1.000 1 A 94.933 1 ATOM 1768 N NZ . LYS 218 218 ? A -10.888 4.839 23.519 1.000 1 A 94.933 1 ATOM 1769 N N . GLY 219 219 ? A -13.480 0.680 16.875 1.000 1 A 96.295 1 ATOM 1770 C CA . GLY 219 219 ? A -13.285 0.593 15.436 1.000 1 A 96.295 1 ATOM 1771 C C . GLY 219 219 ? A -14.509 0.086 14.698 1.000 1 A 96.295 1 ATOM 1772 O O . GLY 219 219 ? A -14.470 -0.107 13.481 1.000 1 A 96.295 1 ATOM 1773 N N . LYS 220 220 ? A -15.618 -0.253 15.443 1.000 1 A 97.498 1 ATOM 1774 C CA . LYS 220 220 ? A -16.828 -0.740 14.788 1.000 1 A 97.498 1 ATOM 1775 C C . LYS 220 220 ? A -17.295 0.228 13.705 1.000 1 A 97.498 1 ATOM 1776 O O . LYS 220 220 ? A -17.394 1.434 13.944 1.000 1 A 97.498 1 ATOM 1777 C CB . LYS 220 220 ? A -17.942 -0.958 15.812 1.000 1 A 97.498 1 ATOM 1778 C CG . LYS 220 220 ? A -19.167 -1.668 15.253 1.000 1 A 97.498 1 ATOM 1779 C CD . LYS 220 220 ? A -20.180 -1.980 16.346 1.000 1 A 97.498 1 ATOM 1780 C CE . LYS 220 220 ? A -21.379 -2.742 15.798 1.000 1 A 97.498 1 ATOM 1781 N NZ . LYS 220 220 ? A -22.360 -3.079 16.872 1.000 1 A 97.498 1 ATOM 1782 N N . TYR 221 221 ? A -17.450 -0.259 12.401 1.000 1 A 98.005 1 ATOM 1783 C CA . TYR 221 221 ? A -17.917 0.441 11.210 1.000 1 A 98.005 1 ATOM 1784 C C . TYR 221 221 ? A -16.758 1.109 10.480 1.000 1 A 98.005 1 ATOM 1785 O O . TYR 221 221 ? A -16.966 1.829 9.500 1.000 1 A 98.005 1 ATOM 1786 C CB . TYR 221 221 ? A -18.973 1.487 11.581 1.000 1 A 98.005 1 ATOM 1787 C CG . TYR 221 221 ? A -20.254 0.893 12.115 1.000 1 A 98.005 1 ATOM 1788 C CD1 . TYR 221 221 ? A -21.035 0.048 11.328 1.000 1 A 98.005 1 ATOM 1789 C CD2 . TYR 221 221 ? A -20.687 1.175 13.406 1.000 1 A 98.005 1 ATOM 1790 C CE1 . TYR 221 221 ? A -22.217 -0.499 11.815 1.000 1 A 98.005 1 ATOM 1791 C CE2 . TYR 221 221 ? A -21.867 0.633 13.903 1.000 1 A 98.005 1 ATOM 1792 C CZ . TYR 221 221 ? A -22.624 -0.202 13.102 1.000 1 A 98.005 1 ATOM 1793 O OH . TYR 221 221 ? A -23.793 -0.742 13.590 1.000 1 A 98.005 1 ATOM 1794 N N . TYR 222 222 ? A -15.467 0.976 10.950 1.000 1 A 98.224 1 ATOM 1795 C CA . TYR 222 222 ? A -14.299 1.600 10.338 1.000 1 A 98.224 1 ATOM 1796 C C . TYR 222 222 ? A -13.554 0.611 9.450 1.000 1 A 98.224 1 ATOM 1797 O O . TYR 222 222 ? A -12.441 0.890 8.997 1.000 1 A 98.224 1 ATOM 1798 C CB . TYR 222 222 ? A -13.357 2.148 11.415 1.000 1 A 98.224 1 ATOM 1799 C CG . TYR 222 222 ? A -13.858 3.408 12.077 1.000 1 A 98.224 1 ATOM 1800 C CD1 . TYR 222 222 ? A -13.394 4.659 11.679 1.000 1 A 98.224 1 ATOM 1801 C CD2 . TYR 222 222 ? A -14.797 3.350 13.102 1.000 1 A 98.224 1 ATOM 1802 C CE1 . TYR 222 222 ? A -13.852 5.823 12.288 1.000 1 A 98.224 1 ATOM 1803 C CE2 . TYR 222 222 ? A -15.262 4.507 13.718 1.000 1 A 98.224 1 ATOM 1804 C CZ . TYR 222 222 ? A -14.785 5.737 13.304 1.000 1 A 98.224 1 ATOM 1805 O OH . TYR 222 222 ? A -15.242 6.886 13.910 1.000 1 A 98.224 1 ATOM 1806 N N . ALA 223 223 ? A -14.178 -0.557 9.250 1.000 1 A 98.448 1 ATOM 1807 C CA . ALA 223 223 ? A -13.749 -1.514 8.233 1.000 1 A 98.448 1 ATOM 1808 C C . ALA 223 223 ? A -14.800 -1.657 7.136 1.000 1 A 98.448 1 ATOM 1809 O O . ALA 223 223 ? A -15.881 -2.203 7.370 1.000 1 A 98.448 1 ATOM 1810 C CB . ALA 223 223 ? A -13.460 -2.872 8.869 1.000 1 A 98.448 1 ATOM 1811 N N . VAL 224 224 ? A -14.440 -1.181 5.987 1.000 1 A 98.583 1 ATOM 1812 C CA . VAL 224 224 ? A -15.349 -1.198 4.846 1.000 1 A 98.583 1 ATOM 1813 C C . VAL 224 224 ? A -14.870 -2.221 3.818 1.000 1 A 98.583 1 ATOM 1814 O O . VAL 224 224 ? A -13.790 -2.073 3.243 1.000 1 A 98.583 1 ATOM 1815 C CB . VAL 224 224 ? A -15.468 0.197 4.193 1.000 1 A 98.583 1 ATOM 1816 C CG1 . VAL 224 224 ? A -16.448 0.163 3.021 1.000 1 A 98.583 1 ATOM 1817 C CG2 . VAL 224 224 ? A -15.903 1.234 5.227 1.000 1 A 98.583 1 ATOM 1818 N N . ASN 225 225 ? A -15.690 -3.286 3.622 1.000 1 A 98.518 1 ATOM 1819 C CA . ASN 225 225 ? A -15.330 -4.363 2.706 1.000 1 A 98.518 1 ATOM 1820 C C . ASN 225 225 ? A -16.346 -4.500 1.576 1.000 1 A 98.518 1 ATOM 1821 O O . ASN 225 225 ? A -17.535 -4.705 1.826 1.000 1 A 98.518 1 ATOM 1822 C CB . ASN 225 225 ? A -15.194 -5.687 3.461 1.000 1 A 98.518 1 ATOM 1823 C CG . ASN 225 225 ? A -14.082 -5.660 4.491 1.000 1 A 98.518 1 ATOM 1824 O OD1 . ASN 225 225 ? A -12.905 -5.518 4.148 1.000 1 A 98.518 1 ATOM 1825 N ND2 . ASN 225 225 ? A -14.445 -5.795 5.761 1.000 1 A 98.518 1 ATOM 1826 N N . TYR 226 226 ? A -15.845 -4.419 0.357 1.000 1 A 98.348 1 ATOM 1827 C CA . TYR 226 226 ? A -16.671 -4.616 -0.829 1.000 1 A 98.348 1 ATOM 1828 C C . TYR 226 226 ? A -16.322 -5.927 -1.525 1.000 1 A 98.348 1 ATOM 1829 O O . TYR 226 226 ? A -15.387 -5.980 -2.328 1.000 1 A 98.348 1 ATOM 1830 C CB . TYR 226 226 ? A -16.501 -3.447 -1.803 1.000 1 A 98.348 1 ATOM 1831 C CG . TYR 226 226 ? A -17.713 -3.197 -2.669 1.000 1 A 98.348 1 ATOM 1832 C CD1 . TYR 226 226 ? A -18.203 -4.188 -3.516 1.000 1 A 98.348 1 ATOM 1833 C CD2 . TYR 226 226 ? A -18.368 -1.971 -2.641 1.000 1 A 98.348 1 ATOM 1834 C CE1 . TYR 226 226 ? A -19.318 -3.962 -4.317 1.000 1 A 98.348 1 ATOM 1835 C CE2 . TYR 226 226 ? A -19.484 -1.734 -3.438 1.000 1 A 98.348 1 ATOM 1836 C CZ . TYR 226 226 ? A -19.951 -2.734 -4.270 1.000 1 A 98.348 1 ATOM 1837 O OH . TYR 226 226 ? A -21.055 -2.505 -5.061 1.000 1 A 98.348 1 ATOM 1838 N N . PRO 227 227 ? A -17.085 -7.010 -1.193 1.000 1 A 97.368 1 ATOM 1839 C CA . PRO 227 227 ? A -16.812 -8.310 -1.810 1.000 1 A 97.368 1 ATOM 1840 C C . PRO 227 227 ? A -17.245 -8.372 -3.273 1.000 1 A 97.368 1 ATOM 1841 O O . PRO 227 227 ? A -18.415 -8.137 -3.584 1.000 1 A 97.368 1 ATOM 1842 C CB . PRO 227 227 ? A -17.629 -9.283 -0.957 1.000 1 A 97.368 1 ATOM 1843 C CG . PRO 227 227 ? A -18.777 -8.474 -0.447 1.000 1 A 97.368 1 ATOM 1844 C CD . PRO 227 227 ? A -18.306 -7.065 -0.224 1.000 1 A 97.368 1 ATOM 1845 N N . LEU 228 228 ? A -16.280 -8.646 -4.169 1.000 1 A 97.948 1 ATOM 1846 C CA . LEU 228 228 ? A -16.555 -8.654 -5.602 1.000 1 A 97.948 1 ATOM 1847 C C . LEU 228 228 ? A -16.429 -10.064 -6.171 1.000 1 A 97.948 1 ATOM 1848 O O . LEU 228 228 ? A -15.869 -10.951 -5.524 1.000 1 A 97.948 1 ATOM 1849 C CB . LEU 228 228 ? A -15.601 -7.708 -6.336 1.000 1 A 97.948 1 ATOM 1850 C CG . LEU 228 228 ? A -15.644 -6.239 -5.912 1.000 1 A 97.948 1 ATOM 1851 C CD1 . LEU 228 228 ? A -14.466 -5.480 -6.513 1.000 1 A 97.948 1 ATOM 1852 C CD2 . LEU 228 228 ? A -16.965 -5.601 -6.326 1.000 1 A 97.948 1 ATOM 1853 N N . ARG 229 229 ? A -16.952 -10.234 -7.351 1.000 1 A 97.209 1 ATOM 1854 C CA . ARG 229 229 ? A -16.904 -11.522 -8.037 1.000 1 A 97.209 1 ATOM 1855 C C . ARG 229 229 ? A -16.043 -11.441 -9.293 1.000 1 A 97.209 1 ATOM 1856 O O . ARG 229 229 ? A -15.569 -10.363 -9.659 1.000 1 A 97.209 1 ATOM 1857 C CB . ARG 229 229 ? A -18.314 -11.993 -8.398 1.000 1 A 97.209 1 ATOM 1858 C CG . ARG 229 229 ? A -19.210 -12.235 -7.193 1.000 1 A 97.209 1 ATOM 1859 C CD . ARG 229 229 ? A -20.602 -12.691 -7.608 1.000 1 A 97.209 1 ATOM 1860 N NE . ARG 229 229 ? A -21.446 -12.968 -6.449 1.000 1 A 97.209 1 ATOM 1861 C CZ . ARG 229 229 ? A -22.733 -13.297 -6.510 1.000 1 A 97.209 1 ATOM 1862 N NH1 . ARG 229 229 ? A -23.352 -13.398 -7.681 1.000 1 A 97.209 1 ATOM 1863 N NH2 . ARG 229 229 ? A -23.407 -13.528 -5.393 1.000 1 A 97.209 1 ATOM 1864 N N . ASP 230 230 ? A -15.802 -12.493 -9.928 1.000 1 A 97.356 1 ATOM 1865 C CA . ASP 230 230 ? A -14.941 -12.618 -11.100 1.000 1 A 97.356 1 ATOM 1866 C C . ASP 230 230 ? A -15.376 -11.658 -12.205 1.000 1 A 97.356 1 ATOM 1867 O O . ASP 230 230 ? A -16.571 -11.419 -12.393 1.000 1 A 97.356 1 ATOM 1868 C CB . ASP 230 230 ? A -14.948 -14.057 -11.620 1.000 1 A 97.356 1 ATOM 1869 C CG . ASP 230 230 ? A -14.271 -15.033 -10.674 1.000 1 A 97.356 1 ATOM 1870 O OD1 . ASP 230 230 ? A -13.972 -14.656 -9.521 1.000 1 A 97.356 1 ATOM 1871 O OD2 . ASP 230 230 ? A -14.033 -16.188 -11.087 1.000 1 A 97.356 1 ATOM 1872 N N . GLY 231 231 ? A -14.428 -11.131 -12.877 1.000 1 A 98.033 1 ATOM 1873 C CA . GLY 231 231 ? A -14.648 -10.508 -14.172 1.000 1 A 98.033 1 ATOM 1874 C C . GLY 231 231 ? A -15.111 -9.067 -14.070 1.000 1 A 98.033 1 ATOM 1875 O O . GLY 231 231 ? A -15.586 -8.490 -15.051 1.000 1 A 98.033 1 ATOM 1876 N N . ILE 232 232 ? A -15.044 -8.413 -12.852 1.000 1 A 98.655 1 ATOM 1877 C CA . ILE 232 232 ? A -15.471 -7.021 -12.761 1.000 1 A 98.655 1 ATOM 1878 C C . ILE 232 232 ? A -14.679 -6.172 -13.752 1.000 1 A 98.655 1 ATOM 1879 O O . ILE 232 232 ? A -13.457 -6.305 -13.855 1.000 1 A 98.655 1 ATOM 1880 C CB . ILE 232 232 ? A -15.300 -6.471 -11.327 1.000 1 A 98.655 1 ATOM 1881 C CG1 . ILE 232 232 ? A -15.952 -5.089 -11.205 1.000 1 A 98.655 1 ATOM 1882 C CG2 . ILE 232 232 ? A -13.819 -6.414 -10.943 1.000 1 A 98.655 1 ATOM 1883 C CD1 . ILE 232 232 ? A -16.240 -4.665 -9.771 1.000 1 A 98.655 1 ATOM 1884 N N . ASP 233 233 ? A -15.376 -5.366 -14.570 1.000 1 A 98.639 1 ATOM 1885 C CA . ASP 233 233 ? A -14.737 -4.569 -15.613 1.000 1 A 98.639 1 ATOM 1886 C C . ASP 233 233 ? A -14.588 -3.113 -15.178 1.000 1 A 98.639 1 ATOM 1887 O O . ASP 233 233 ? A -14.960 -2.752 -14.059 1.000 1 A 98.639 1 ATOM 1888 C CB . ASP 233 233 ? A -15.536 -4.650 -16.915 1.000 1 A 98.639 1 ATOM 1889 C CG . ASP 233 233 ? A -16.947 -4.105 -16.780 1.000 1 A 98.639 1 ATOM 1890 O OD1 . ASP 233 233 ? A -17.252 -3.449 -15.762 1.000 1 A 98.639 1 ATOM 1891 O OD2 . ASP 233 233 ? A -17.761 -4.337 -17.700 1.000 1 A 98.639 1 ATOM 1892 N N . ASP 234 234 ? A -14.009 -2.250 -15.975 1.000 1 A 98.618 1 ATOM 1893 C CA . ASP 234 234 ? A -13.707 -0.857 -15.662 1.000 1 A 98.618 1 ATOM 1894 C C . ASP 234 234 ? A -14.972 -0.095 -15.275 1.000 1 A 98.618 1 ATOM 1895 O O . ASP 234 234 ? A -14.991 0.618 -14.269 1.000 1 A 98.618 1 ATOM 1896 C CB . ASP 234 234 ? A -13.025 -0.175 -16.850 1.000 1 A 98.618 1 ATOM 1897 C CG . ASP 234 234 ? A -11.611 -0.674 -17.088 1.000 1 A 98.618 1 ATOM 1898 O OD1 . ASP 234 234 ? A -11.085 -1.439 -16.251 1.000 1 A 98.618 1 ATOM 1899 O OD2 . ASP 234 234 ? A -11.016 -0.296 -18.121 1.000 1 A 98.618 1 ATOM 1900 N N . GLU 235 235 ? A -16.014 -0.218 -16.133 1.000 1 A 98.423 1 ATOM 1901 C CA . GLU 235 235 ? A -17.246 0.544 -15.950 1.000 1 A 98.423 1 ATOM 1902 C C . GLU 235 235 ? A -17.895 0.229 -14.606 1.000 1 A 98.423 1 ATOM 1903 O O . GLU 235 235 ? A -18.236 1.138 -13.846 1.000 1 A 98.423 1 ATOM 1904 C CB . GLU 235 235 ? A -18.229 0.261 -17.089 1.000 1 A 98.423 1 ATOM 1905 C CG . GLU 235 235 ? A -17.760 0.766 -18.445 1.000 1 A 98.423 1 ATOM 1906 C CD . GLU 235 235 ? A -16.838 -0.206 -19.163 1.000 1 A 98.423 1 ATOM 1907 O OE1 . GLU 235 235 ? A -16.230 0.177 -20.188 1.000 1 A 98.423 1 ATOM 1908 O OE2 . GLU 235 235 ? A -16.723 -1.362 -18.696 1.000 1 A 98.423 1 ATOM 1909 N N . SER 236 236 ? A -18.055 -1.068 -14.291 1.000 1 A 98.644 1 ATOM 1910 C CA . SER 236 236 ? A -18.687 -1.482 -13.042 1.000 1 A 98.644 1 ATOM 1911 C C . SER 236 236 ? A -17.834 -1.100 -11.837 1.000 1 A 98.644 1 ATOM 1912 O O . SER 236 236 ? A -18.360 -0.661 -10.812 1.000 1 A 98.644 1 ATOM 1913 C CB . SER 236 236 ? A -18.936 -2.991 -13.043 1.000 1 A 98.644 1 ATOM 1914 O OG . SER 236 236 ? A -19.806 -3.357 -14.100 1.000 1 A 98.644 1 ATOM 1915 N N . TYR 237 237 ? A -16.491 -1.308 -11.965 1.000 1 A 98.753 1 ATOM 1916 C CA . TYR 237 237 ? A -15.588 -0.985 -10.866 1.000 1 A 98.753 1 ATOM 1917 C C . TYR 237 237 ? A -15.668 0.495 -10.513 1.000 1 A 98.753 1 ATOM 1918 O O . TYR 237 237 ? A -15.785 0.854 -9.339 1.000 1 A 98.753 1 ATOM 1919 C CB . TYR 237 237 ? A -14.148 -1.360 -11.226 1.000 1 A 98.753 1 ATOM 1920 C CG . TYR 237 237 ? A -13.242 -1.511 -10.028 1.000 1 A 98.753 1 ATOM 1921 C CD1 . TYR 237 237 ? A -12.466 -0.446 -9.578 1.000 1 A 98.753 1 ATOM 1922 C CD2 . TYR 237 237 ? A -13.161 -2.720 -9.344 1.000 1 A 98.753 1 ATOM 1923 C CE1 . TYR 237 237 ? A -11.629 -0.582 -8.475 1.000 1 A 98.753 1 ATOM 1924 C CE2 . TYR 237 237 ? A -12.328 -2.867 -8.240 1.000 1 A 98.753 1 ATOM 1925 C CZ . TYR 237 237 ? A -11.567 -1.794 -7.814 1.000 1 A 98.753 1 ATOM 1926 O OH . TYR 237 237 ? A -10.740 -1.934 -6.722 1.000 1 A 98.753 1 ATOM 1927 N N . GLU 238 238 ? A -15.629 1.357 -11.521 1.000 1 A 98.651 1 ATOM 1928 C CA . GLU 238 238 ? A -15.729 2.800 -11.321 1.000 1 A 98.651 1 ATOM 1929 C C . GLU 238 238 ? A -17.081 3.181 -10.724 1.000 1 A 98.651 1 ATOM 1930 O O . GLU 238 238 ? A -17.158 4.057 -9.859 1.000 1 A 98.651 1 ATOM 1931 C CB . GLU 238 238 ? A -15.509 3.542 -12.642 1.000 1 A 98.651 1 ATOM 1932 C CG . GLU 238 238 ? A -15.464 5.056 -12.496 1.000 1 A 98.651 1 ATOM 1933 C CD . GLU 238 238 ? A -15.119 5.774 -13.791 1.000 1 A 98.651 1 ATOM 1934 O OE1 . GLU 238 238 ? A -15.068 7.025 -13.796 1.000 1 A 98.651 1 ATOM 1935 O OE2 . GLU 238 238 ? A -14.900 5.080 -14.808 1.000 1 A 98.651 1 ATOM 1936 N N . ALA 239 239 ? A -18.156 2.567 -11.142 1.000 1 A 98.514 1 ATOM 1937 C CA . ALA 239 239 ? A -19.518 2.876 -10.712 1.000 1 A 98.514 1 ATOM 1938 C C . ALA 239 239 ? A -19.703 2.587 -9.226 1.000 1 A 98.514 1 ATOM 1939 O O . ALA 239 239 ? A -20.596 3.146 -8.585 1.000 1 A 98.514 1 ATOM 1940 C CB . ALA 239 239 ? A -20.529 2.082 -11.536 1.000 1 A 98.514 1 ATOM 1941 N N . ILE 240 240 ? A -18.851 1.728 -8.733 1.000 1 A 98.632 1 ATOM 1942 C CA . ILE 240 240 ? A -18.961 1.431 -7.309 1.000 1 A 98.632 1 ATOM 1943 C C . ILE 240 240 ? A -17.880 2.186 -6.539 1.000 1 A 98.632 1 ATOM 1944 O O . ILE 240 240 ? A -18.120 2.664 -5.428 1.000 1 A 98.632 1 ATOM 1945 C CB . ILE 240 240 ? A -18.851 -0.087 -7.038 1.000 1 A 98.632 1 ATOM 1946 C CG1 . ILE 240 240 ? A -17.475 -0.607 -7.471 1.000 1 A 98.632 1 ATOM 1947 C CG2 . ILE 240 240 ? A -19.973 -0.846 -7.752 1.000 1 A 98.632 1 ATOM 1948 C CD1 . ILE 240 240 ? A -17.190 -2.039 -7.036 1.000 1 A 98.632 1 ATOM 1949 N N . PHE 241 241 ? A -16.714 2.298 -7.010 1.000 1 A 98.835 1 ATOM 1950 C CA . PHE 241 241 ? A -15.572 2.900 -6.331 1.000 1 A 98.835 1 ATOM 1951 C C . PHE 241 241 ? A -15.853 4.358 -5.986 1.000 1 A 98.835 1 ATOM 1952 O O . PHE 241 241 ? A -15.689 4.772 -4.837 1.000 1 A 98.835 1 ATOM 1953 C CB . PHE 241 241 ? A -14.314 2.800 -7.201 1.000 1 A 98.835 1 ATOM 1954 C CG . PHE 241 241 ? A -13.065 3.291 -6.520 1.000 1 A 98.835 1 ATOM 1955 C CD1 . PHE 241 241 ? A -12.648 4.608 -6.668 1.000 1 A 98.835 1 ATOM 1956 C CD2 . PHE 241 241 ? A -12.308 2.434 -5.732 1.000 1 A 98.835 1 ATOM 1957 C CE1 . PHE 241 241 ? A -11.492 5.065 -6.039 1.000 1 A 98.835 1 ATOM 1958 C CE2 . PHE 241 241 ? A -11.152 2.884 -5.100 1.000 1 A 98.835 1 ATOM 1959 C CZ . PHE 241 241 ? A -10.745 4.199 -5.256 1.000 1 A 98.835 1 ATOM 1960 N N . LYS 242 242 ? A -16.331 5.121 -6.913 1.000 1 A 98.777 1 ATOM 1961 C CA . LYS 242 242 ? A -16.490 6.561 -6.738 1.000 1 A 98.777 1 ATOM 1962 C C . LYS 242 242 ? A -17.546 6.873 -5.681 1.000 1 A 98.777 1 ATOM 1963 O O . LYS 242 242 ? A -17.295 7.646 -4.754 1.000 1 A 98.777 1 ATOM 1964 C CB . LYS 242 242 ? A -16.863 7.226 -8.064 1.000 1 A 98.777 1 ATOM 1965 C CG . LYS 242 242 ? A -15.694 7.387 -9.025 1.000 1 A 98.777 1 ATOM 1966 C CD . LYS 242 242 ? A -16.084 8.212 -10.245 1.000 1 A 98.777 1 ATOM 1967 C CE . LYS 242 242 ? A -14.877 8.523 -11.120 1.000 1 A 98.777 1 ATOM 1968 N NZ . LYS 242 242 ? A -15.255 9.324 -12.322 1.000 1 A 98.777 1 ATOM 1969 N N . PRO 243 243 ? A -18.714 6.292 -5.814 1.000 1 A 98.647 1 ATOM 1970 C CA . PRO 243 243 ? A -19.710 6.616 -4.789 1.000 1 A 98.647 1 ATOM 1971 C C . PRO 243 243 ? A -19.291 6.157 -3.394 1.000 1 A 98.647 1 ATOM 1972 O O . PRO 243 243 ? A -19.497 6.880 -2.415 1.000 1 A 98.647 1 ATOM 1973 C CB . PRO 243 243 ? A -20.957 5.863 -5.259 1.000 1 A 98.647 1 ATOM 1974 C CG . PRO 243 243 ? A -20.783 5.721 -6.737 1.000 1 A 98.647 1 ATOM 1975 C CD . PRO 243 243 ? A -19.318 5.583 -7.034 1.000 1 A 98.647 1 ATOM 1976 N N . VAL 244 244 ? A -18.747 5.004 -3.251 1.000 1 A 98.778 1 ATOM 1977 C CA . VAL 244 244 ? A -18.315 4.500 -1.952 1.000 1 A 98.778 1 ATOM 1978 C C . VAL 244 244 ? A -17.232 5.411 -1.378 1.000 1 A 98.778 1 ATOM 1979 O O . VAL 244 244 ? A -17.311 5.826 -0.219 1.000 1 A 98.778 1 ATOM 1980 C CB . VAL 244 244 ? A -17.792 3.049 -2.051 1.000 1 A 98.778 1 ATOM 1981 C CG1 . VAL 244 244 ? A -17.069 2.646 -0.767 1.000 1 A 98.778 1 ATOM 1982 C CG2 . VAL 244 244 ? A -18.942 2.087 -2.345 1.000 1 A 98.778 1 ATOM 1983 N N . MET 245 245 ? A -16.280 5.709 -2.158 1.000 1 A 98.830 1 ATOM 1984 C CA . MET 245 245 ? A -15.176 6.533 -1.674 1.000 1 A 98.830 1 ATOM 1985 C C . MET 245 245 ? A -15.647 7.952 -1.374 1.000 1 A 98.830 1 ATOM 1986 O O . MET 245 245 ? A -15.148 8.593 -0.448 1.000 1 A 98.830 1 ATOM 1987 C CB . MET 245 245 ? A -14.039 6.564 -2.697 1.000 1 A 98.830 1 ATOM 1988 C CG . MET 245 245 ? A -13.282 5.251 -2.812 1.000 1 A 98.830 1 ATOM 1989 S SD . MET 245 245 ? A -12.763 4.593 -1.180 1.000 1 A 98.830 1 ATOM 1990 C CE . MET 245 245 ? A -11.737 5.969 -0.592 1.000 1 A 98.830 1 ATOM 1991 N N . SER 246 246 ? A -16.533 8.472 -2.169 1.000 1 A 98.639 1 ATOM 1992 C CA . SER 246 246 ? A -17.118 9.774 -1.866 1.000 1 A 98.639 1 ATOM 1993 C C . SER 246 246 ? A -17.788 9.774 -0.496 1.000 1 A 98.639 1 ATOM 1994 O O . SER 246 246 ? A -17.609 10.708 0.289 1.000 1 A 98.639 1 ATOM 1995 C CB . SER 246 246 ? A -18.134 10.169 -2.939 1.000 1 A 98.639 1 ATOM 1996 O OG . SER 246 246 ? A -17.493 10.377 -4.186 1.000 1 A 98.639 1 ATOM 1997 N N . LYS 247 247 ? A -18.546 8.750 -0.227 1.000 1 A 98.351 1 ATOM 1998 C CA . LYS 247 247 ? A -19.229 8.631 1.058 1.000 1 A 98.351 1 ATOM 1999 C C . LYS 247 247 ? A -18.229 8.463 2.198 1.000 1 A 98.351 1 ATOM 2000 O O . LYS 247 247 ? A -18.383 9.070 3.260 1.000 1 A 98.351 1 ATOM 2001 C CB . LYS 247 247 ? A -20.205 7.454 1.039 1.000 1 A 98.351 1 ATOM 2002 C CG . LYS 247 247 ? A -21.107 7.378 2.262 1.000 1 A 98.351 1 ATOM 2003 C CD . LYS 247 247 ? A -22.074 8.555 2.317 1.000 1 A 98.351 1 ATOM 2004 C CE . LYS 247 247 ? A -23.076 8.404 3.454 1.000 1 A 98.351 1 ATOM 2005 N NZ . LYS 247 247 ? A -24.026 9.555 3.512 1.000 1 A 98.351 1 ATOM 2006 N N . VAL 248 248 ? A -17.211 7.711 1.955 1.000 1 A 98.461 1 ATOM 2007 C CA . VAL 248 248 ? A -16.159 7.508 2.945 1.000 1 A 98.461 1 ATOM 2008 C C . VAL 248 248 ? A -15.494 8.842 3.274 1.000 1 A 98.461 1 ATOM 2009 O O . VAL 248 248 ? A -15.307 9.178 4.445 1.000 1 A 98.461 1 ATOM 2010 C CB . VAL 248 248 ? A -15.104 6.493 2.452 1.000 1 A 98.461 1 ATOM 2011 C CG1 . VAL 248 248 ? A -13.840 6.570 3.306 1.000 1 A 98.461 1 ATOM 2012 C CG2 . VAL 248 248 ? A -15.677 5.077 2.467 1.000 1 A 98.461 1 ATOM 2013 N N . MET 249 249 ? A -15.112 9.557 2.220 1.000 1 A 98.019 1 ATOM 2014 C CA . MET 249 249 ? A -14.471 10.855 2.415 1.000 1 A 98.019 1 ATOM 2015 C C . MET 249 249 ? A -15.379 11.800 3.194 1.000 1 A 98.019 1 ATOM 2016 O O . MET 249 249 ? A -14.911 12.553 4.049 1.000 1 A 98.019 1 ATOM 2017 C CB . MET 249 249 ? A -14.099 11.478 1.068 1.000 1 A 98.019 1 ATOM 2018 C CG . MET 249 249 ? A -13.015 10.720 0.320 1.000 1 A 98.019 1 ATOM 2019 S SD . MET 249 249 ? A -11.422 10.690 1.230 1.000 1 A 98.019 1 ATOM 2020 C CE . MET 249 249 ? A -10.377 9.833 0.019 1.000 1 A 98.019 1 ATOM 2021 N N . GLU 250 250 ? A -16.673 11.712 2.926 1.000 1 A 96.138 1 ATOM 2022 C CA . GLU 250 250 ? A -17.667 12.567 3.566 1.000 1 A 96.138 1 ATOM 2023 C C . GLU 250 250 ? A -17.833 12.213 5.041 1.000 1 A 96.138 1 ATOM 2024 O O . GLU 250 250 ? A -17.864 13.098 5.898 1.000 1 A 96.138 1 ATOM 2025 C CB . GLU 250 250 ? A -19.013 12.460 2.844 1.000 1 A 96.138 1 ATOM 2026 C CG . GLU 250 250 ? A -20.118 13.293 3.477 1.000 1 A 96.138 1 ATOM 2027 C CD . GLU 250 250 ? A -21.492 13.012 2.891 1.000 1 A 96.138 1 ATOM 2028 O OE1 . GLU 250 250 ? A -22.506 13.448 3.483 1.000 1 A 96.138 1 ATOM 2029 O OE2 . GLU 250 250 ? A -21.556 12.349 1.832 1.000 1 A 96.138 1 ATOM 2030 N N . MET 251 251 ? A -17.875 10.950 5.359 1.000 1 A 96.014 1 ATOM 2031 C CA . MET 251 251 ? A -18.251 10.504 6.697 1.000 1 A 96.014 1 ATOM 2032 C C . MET 251 251 ? A -17.024 10.381 7.595 1.000 1 A 96.014 1 ATOM 2033 O O . MET 251 251 ? A -17.055 10.792 8.756 1.000 1 A 96.014 1 ATOM 2034 C CB . MET 251 251 ? A -18.987 9.165 6.631 1.000 1 A 96.014 1 ATOM 2035 C CG . MET 251 251 ? A -20.298 9.223 5.863 1.000 1 A 96.014 1 ATOM 2036 S SD . MET 251 251 ? A -21.449 10.485 6.532 1.000 1 A 96.014 1 ATOM 2037 C CE . MET 251 251 ? A -21.873 9.720 8.122 1.000 1 A 96.014 1 ATOM 2038 N N . PHE 252 252 ? A -15.866 9.898 7.047 1.000 1 A 96.714 1 ATOM 2039 C CA . PHE 252 252 ? A -14.676 9.615 7.840 1.000 1 A 96.714 1 ATOM 2040 C C . PHE 252 252 ? A -13.789 10.850 7.946 1.000 1 A 96.714 1 ATOM 2041 O O . PHE 252 252 ? A -13.197 11.108 8.996 1.000 1 A 96.714 1 ATOM 2042 C CB . PHE 252 252 ? A -13.886 8.452 7.232 1.000 1 A 96.714 1 ATOM 2043 C CG . PHE 252 252 ? A -12.665 8.068 8.022 1.000 1 A 96.714 1 ATOM 2044 C CD1 . PHE 252 252 ? A -11.414 8.024 7.418 1.000 1 A 96.714 1 ATOM 2045 C CD2 . PHE 252 252 ? A -12.768 7.751 9.371 1.000 1 A 96.714 1 ATOM 2046 C CE1 . PHE 252 252 ? A -10.282 7.668 8.148 1.000 1 A 96.714 1 ATOM 2047 C CE2 . PHE 252 252 ? A -11.641 7.395 10.106 1.000 1 A 96.714 1 ATOM 2048 C CZ . PHE 252 252 ? A -10.399 7.353 9.492 1.000 1 A 96.714 1 ATOM 2049 N N . GLN 253 253 ? A -13.706 11.634 6.842 1.000 1 A 96.376 1 ATOM 2050 C CA . GLN 253 253 ? A -12.939 12.874 6.768 1.000 1 A 96.376 1 ATOM 2051 C C . GLN 253 253 ? A -11.477 12.639 7.137 1.000 1 A 96.376 1 ATOM 2052 O O . GLN 253 253 ? A -10.977 13.212 8.107 1.000 1 A 96.376 1 ATOM 2053 C CB . GLN 253 253 ? A -13.548 13.937 7.683 1.000 1 A 96.376 1 ATOM 2054 C CG . GLN 253 253 ? A -14.940 14.388 7.261 1.000 1 A 96.376 1 ATOM 2055 C CD . GLN 253 253 ? A -15.519 15.445 8.183 1.000 1 A 96.376 1 ATOM 2056 O OE1 . GLN 253 253 ? A -15.138 15.542 9.354 1.000 1 A 96.376 1 ATOM 2057 N NE2 . GLN 253 253 ? A -16.444 16.243 7.662 1.000 1 A 96.376 1 ATOM 2058 N N . PRO 254 254 ? A -10.785 11.843 6.423 1.000 1 A 97.651 1 ATOM 2059 C CA . PRO 254 254 ? A -9.368 11.595 6.698 1.000 1 A 97.651 1 ATOM 2060 C C . PRO 254 254 ? A -8.489 12.809 6.405 1.000 1 A 97.651 1 ATOM 2061 O O . PRO 254 254 ? A -8.872 13.679 5.619 1.000 1 A 97.651 1 ATOM 2062 C CB . PRO 254 254 ? A -9.025 10.435 5.760 1.000 1 A 97.651 1 ATOM 2063 C CG . PRO 254 254 ? A -9.885 10.648 4.557 1.000 1 A 97.651 1 ATOM 2064 C CD . PRO 254 254 ? A -11.220 11.164 5.010 1.000 1 A 97.651 1 ATOM 2065 N N . SER 255 255 ? A -7.249 12.845 7.051 1.000 1 A 98.132 1 ATOM 2066 C CA . SER 255 255 ? A -6.279 13.896 6.762 1.000 1 A 98.132 1 ATOM 2067 C C . SER 255 255 ? A -5.087 13.348 5.984 1.000 1 A 98.132 1 ATOM 2068 O O . SER 255 255 ? A -4.205 14.106 5.575 1.000 1 A 98.132 1 ATOM 2069 C CB . SER 255 255 ? A -5.796 14.552 8.056 1.000 1 A 98.132 1 ATOM 2070 O OG . SER 255 255 ? A -5.209 13.592 8.918 1.000 1 A 98.132 1 ATOM 2071 N N . ALA 256 256 ? A -5.008 12.033 5.763 1.000 1 A 98.728 1 ATOM 2072 C CA . ALA 256 256 ? A -4.022 11.363 4.920 1.000 1 A 98.728 1 ATOM 2073 C C . ALA 256 256 ? A -4.577 10.057 4.358 1.000 1 A 98.728 1 ATOM 2074 O O . ALA 256 256 ? A -5.431 9.420 4.980 1.000 1 A 98.728 1 ATOM 2075 C CB . ALA 256 256 ? A -2.741 11.098 5.706 1.000 1 A 98.728 1 ATOM 2076 N N . VAL 257 257 ? A -4.028 9.716 3.173 1.000 1 A 98.909 1 ATOM 2077 C CA . VAL 257 257 ? A -4.511 8.513 2.504 1.000 1 A 98.909 1 ATOM 2078 C C . VAL 257 257 ? A -3.332 7.608 2.153 1.000 1 A 98.909 1 ATOM 2079 O O . VAL 257 257 ? A -2.292 8.084 1.692 1.000 1 A 98.909 1 ATOM 2080 C CB . VAL 257 257 ? A -5.317 8.856 1.232 1.000 1 A 98.909 1 ATOM 2081 C CG1 . VAL 257 257 ? A -5.667 7.587 0.456 1.000 1 A 98.909 1 ATOM 2082 C CG2 . VAL 257 257 ? A -6.583 9.630 1.595 1.000 1 A 98.909 1 ATOM 2083 N N . VAL 258 258 ? A -3.455 6.323 2.485 1.000 1 A 98.951 1 ATOM 2084 C CA . VAL 258 258 ? A -2.574 5.280 1.968 1.000 1 A 98.951 1 ATOM 2085 C C . VAL 258 258 ? A -3.312 4.452 0.919 1.000 1 A 98.951 1 ATOM 2086 O O . VAL 258 258 ? A -4.312 3.798 1.226 1.000 1 A 98.951 1 ATOM 2087 C CB . VAL 258 258 ? A -2.052 4.366 3.100 1.000 1 A 98.951 1 ATOM 2088 C CG1 . VAL 258 258 ? A -1.111 3.300 2.542 1.000 1 A 98.951 1 ATOM 2089 C CG2 . VAL 258 258 ? A -1.350 5.194 4.174 1.000 1 A 98.951 1 ATOM 2090 N N . LEU 259 259 ? A -2.833 4.459 -0.342 1.000 1 A 98.895 1 ATOM 2091 C CA . LEU 259 259 ? A -3.488 3.776 -1.452 1.000 1 A 98.895 1 ATOM 2092 C C . LEU 259 259 ? A -2.646 2.601 -1.939 1.000 1 A 98.895 1 ATOM 2093 O O . LEU 259 259 ? A -1.599 2.797 -2.561 1.000 1 A 98.895 1 ATOM 2094 C CB . LEU 259 259 ? A -3.742 4.749 -2.606 1.000 1 A 98.895 1 ATOM 2095 C CG . LEU 259 259 ? A -4.405 4.163 -3.853 1.000 1 A 98.895 1 ATOM 2096 C CD1 . LEU 259 259 ? A -5.751 3.541 -3.496 1.000 1 A 98.895 1 ATOM 2097 C CD2 . LEU 259 259 ? A -4.575 5.237 -4.923 1.000 1 A 98.895 1 ATOM 2098 N N . GLN 260 260 ? A -3.049 1.368 -1.624 1.000 1 A 98.668 1 ATOM 2099 C CA . GLN 260 260 ? A -2.425 0.140 -2.107 1.000 1 A 98.668 1 ATOM 2100 C C . GLN 260 260 ? A -2.909 -0.207 -3.512 1.000 1 A 98.668 1 ATOM 2101 O O . GLN 260 260 ? A -4.098 -0.455 -3.721 1.000 1 A 98.668 1 ATOM 2102 C CB . GLN 260 260 ? A -2.712 -1.020 -1.151 1.000 1 A 98.668 1 ATOM 2103 C CG . GLN 260 260 ? A -1.882 -2.265 -1.429 1.000 1 A 98.668 1 ATOM 2104 C CD . GLN 260 260 ? A -2.536 -3.195 -2.434 1.000 1 A 98.668 1 ATOM 2105 O OE1 . GLN 260 260 ? A -3.761 -3.197 -2.591 1.000 1 A 98.668 1 ATOM 2106 N NE2 . GLN 260 260 ? A -1.725 -3.993 -3.120 1.000 1 A 98.668 1 ATOM 2107 N N . CYS 261 261 ? A -1.923 -0.280 -4.409 1.000 1 A 98.662 1 ATOM 2108 C CA . CYS 261 261 ? A -2.260 -0.347 -5.827 1.000 1 A 98.662 1 ATOM 2109 C C . CYS 261 261 ? A -1.873 -1.699 -6.415 1.000 1 A 98.662 1 ATOM 2110 O O . CYS 261 261 ? A -1.313 -1.766 -7.511 1.000 1 A 98.662 1 ATOM 2111 C CB . CYS 261 261 ? A -1.564 0.774 -6.597 1.000 1 A 98.662 1 ATOM 2112 S SG . CYS 261 261 ? A -2.146 2.427 -6.162 1.000 1 A 98.662 1 ATOM 2113 N N . GLY 262 262 ? A -2.220 -2.813 -5.677 1.000 1 A 98.200 1 ATOM 2114 C CA . GLY 262 262 ? A -1.980 -4.110 -6.290 1.000 1 A 98.200 1 ATOM 2115 C C . GLY 262 262 ? A -2.536 -4.218 -7.697 1.000 1 A 98.200 1 ATOM 2116 O O . GLY 262 262 ? A -3.688 -3.853 -7.944 1.000 1 A 98.200 1 ATOM 2117 N N . SER 263 263 ? A -1.744 -4.807 -8.640 1.000 1 A 98.244 1 ATOM 2118 C CA . SER 263 263 ? A -2.121 -4.813 -10.050 1.000 1 A 98.244 1 ATOM 2119 C C . SER 263 263 ? A -2.691 -6.165 -10.464 1.000 1 A 98.244 1 ATOM 2120 O O . SER 263 263 ? A -2.890 -6.423 -11.653 1.000 1 A 98.244 1 ATOM 2121 C CB . SER 263 263 ? A -0.919 -4.466 -10.928 1.000 1 A 98.244 1 ATOM 2122 O OG . SER 263 263 ? A 0.115 -5.422 -10.767 1.000 1 A 98.244 1 ATOM 2123 N N . ASP 264 264 ? A -2.951 -7.021 -9.442 1.000 1 A 97.938 1 ATOM 2124 C CA . ASP 264 264 ? A -3.490 -8.339 -9.764 1.000 1 A 97.938 1 ATOM 2125 C C . ASP 264 264 ? A -4.991 -8.268 -10.031 1.000 1 A 97.938 1 ATOM 2126 O O . ASP 264 264 ? A -5.643 -9.297 -10.220 1.000 1 A 97.938 1 ATOM 2127 C CB . ASP 264 264 ? A -3.203 -9.327 -8.631 1.000 1 A 97.938 1 ATOM 2128 C CG . ASP 264 264 ? A -3.531 -8.767 -7.258 1.000 1 A 97.938 1 ATOM 2129 O OD1 . ASP 264 264 ? A -3.920 -7.583 -7.160 1.000 1 A 97.938 1 ATOM 2130 O OD2 . ASP 264 264 ? A -3.396 -9.515 -6.266 1.000 1 A 97.938 1 ATOM 2131 N N . SER 265 265 ? A -5.569 -7.066 -10.160 1.000 1 A 98.042 1 ATOM 2132 C CA . SER 265 265 ? A -6.951 -6.859 -10.580 1.000 1 A 98.042 1 ATOM 2133 C C . SER 265 265 ? A -7.046 -6.663 -12.089 1.000 1 A 98.042 1 ATOM 2134 O O . SER 265 265 ? A -8.143 -6.654 -12.651 1.000 1 A 98.042 1 ATOM 2135 C CB . SER 265 265 ? A -7.555 -5.652 -9.862 1.000 1 A 98.042 1 ATOM 2136 O OG . SER 265 265 ? A -6.764 -4.495 -10.072 1.000 1 A 98.042 1 ATOM 2137 N N . LEU 266 266 ? A -5.858 -6.560 -12.732 1.000 1 A 98.538 1 ATOM 2138 C CA . LEU 266 266 ? A -5.797 -6.278 -14.162 1.000 1 A 98.538 1 ATOM 2139 C C . LEU 266 266 ? A -6.257 -7.483 -14.974 1.000 1 A 98.538 1 ATOM 2140 O O . LEU 266 266 ? A -6.121 -8.626 -14.529 1.000 1 A 98.538 1 ATOM 2141 C CB . LEU 266 266 ? A -4.374 -5.886 -14.570 1.000 1 A 98.538 1 ATOM 2142 C CG . LEU 266 266 ? A -3.821 -4.600 -13.952 1.000 1 A 98.538 1 ATOM 2143 C CD1 . LEU 266 266 ? A -2.375 -4.384 -14.385 1.000 1 A 98.538 1 ATOM 2144 C CD2 . LEU 266 266 ? A -4.686 -3.405 -14.340 1.000 1 A 98.538 1 ATOM 2145 N N . SER 267 267 ? A -6.770 -7.221 -16.139 1.000 1 A 98.072 1 ATOM 2146 C CA . SER 267 267 ? A -7.071 -8.250 -17.130 1.000 1 A 98.072 1 ATOM 2147 C C . SER 267 267 ? A -5.816 -9.022 -17.523 1.000 1 A 98.072 1 ATOM 2148 O O . SER 267 267 ? A -4.782 -8.423 -17.828 1.000 1 A 98.072 1 ATOM 2149 C CB . SER 267 267 ? A -7.707 -7.628 -18.373 1.000 1 A 98.072 1 ATOM 2150 O OG . SER 267 267 ? A -8.015 -8.624 -19.333 1.000 1 A 98.072 1 ATOM 2151 N N . GLY 268 268 ? A -5.910 -10.324 -17.412 1.000 1 A 96.344 1 ATOM 2152 C CA . GLY 268 268 ? A -4.808 -11.151 -17.877 1.000 1 A 96.344 1 ATOM 2153 C C . GLY 268 268 ? A -3.806 -11.479 -16.786 1.000 1 A 96.344 1 ATOM 2154 O O . GLY 268 268 ? A -2.751 -12.057 -17.057 1.000 1 A 96.344 1 ATOM 2155 N N . ASP 269 269 ? A -4.107 -11.033 -15.568 1.000 1 A 97.611 1 ATOM 2156 C CA . ASP 269 269 ? A -3.196 -11.405 -14.491 1.000 1 A 97.611 1 ATOM 2157 C C . ASP 269 269 ? A -3.184 -12.917 -14.279 1.000 1 A 97.611 1 ATOM 2158 O O . ASP 269 269 ? A -4.220 -13.575 -14.400 1.000 1 A 97.611 1 ATOM 2159 C CB . ASP 269 269 ? A -3.583 -10.695 -13.191 1.000 1 A 97.611 1 ATOM 2160 C CG . ASP 269 269 ? A -2.583 -10.921 -12.072 1.000 1 A 97.611 1 ATOM 2161 O OD1 . ASP 269 269 ? A -1.527 -10.252 -12.052 1.000 1 A 97.611 1 ATOM 2162 O OD2 . ASP 269 269 ? A -2.851 -11.779 -11.202 1.000 1 A 97.611 1 ATOM 2163 N N . ARG 270 270 ? A -2.050 -13.477 -13.913 1.000 1 A 96.347 1 ATOM 2164 C CA . ARG 270 270 ? A -1.854 -14.917 -13.781 1.000 1 A 96.347 1 ATOM 2165 C C . ARG 270 270 ? A -2.674 -15.477 -12.623 1.000 1 A 96.347 1 ATOM 2166 O O . ARG 270 270 ? A -3.232 -16.572 -12.724 1.000 1 A 96.347 1 ATOM 2167 C CB . ARG 270 270 ? A -0.372 -15.242 -13.579 1.000 1 A 96.347 1 ATOM 2168 C CG . ARG 270 270 ? A -0.058 -16.729 -13.609 1.000 1 A 96.347 1 ATOM 2169 C CD . ARG 270 270 ? A 1.439 -16.991 -13.518 1.000 1 A 96.347 1 ATOM 2170 N NE . ARG 270 270 ? A 1.735 -18.420 -13.488 1.000 1 A 96.347 1 ATOM 2171 C CZ . ARG 270 270 ? A 2.959 -18.940 -13.457 1.000 1 A 96.347 1 ATOM 2172 N NH1 . ARG 270 270 ? A 4.030 -18.155 -13.452 1.000 1 A 96.347 1 ATOM 2173 N NH2 . ARG 270 270 ? A 3.114 -20.256 -13.432 1.000 1 A 96.347 1 ATOM 2174 N N . LEU 271 271 ? A -2.801 -14.752 -11.538 1.000 1 A 95.010 1 ATOM 2175 C CA . LEU 271 271 ? A -3.511 -15.246 -10.364 1.000 1 A 95.010 1 ATOM 2176 C C . LEU 271 271 ? A -4.854 -14.540 -10.204 1.000 1 A 95.010 1 ATOM 2177 O O . LEU 271 271 ? A -5.823 -15.139 -9.732 1.000 1 A 95.010 1 ATOM 2178 C CB . LEU 271 271 ? A -2.665 -15.050 -9.103 1.000 1 A 95.010 1 ATOM 2179 C CG . LEU 271 271 ? A -1.417 -15.925 -8.981 1.000 1 A 95.010 1 ATOM 2180 C CD1 . LEU 271 271 ? A -0.781 -15.753 -7.606 1.000 1 A 95.010 1 ATOM 2181 C CD2 . LEU 271 271 ? A -1.763 -17.388 -9.237 1.000 1 A 95.010 1 ATOM 2182 N N . GLY 272 272 ? A -4.907 -13.261 -10.547 1.000 1 A 95.201 1 ATOM 2183 C CA . GLY 272 272 ? A -6.117 -12.472 -10.385 1.000 1 A 95.201 1 ATOM 2184 C C . GLY 272 272 ? A -7.210 -12.846 -11.368 1.000 1 A 95.201 1 ATOM 2185 O O . GLY 272 272 ? A -6.928 -13.369 -12.448 1.000 1 A 95.201 1 ATOM 2186 N N . CYS 273 273 ? A -8.437 -12.527 -10.974 1.000 1 A 96.074 1 ATOM 2187 C CA . CYS 273 273 ? A -9.548 -12.931 -11.829 1.000 1 A 96.074 1 ATOM 2188 C C . CYS 273 273 ? A -10.483 -11.757 -12.099 1.000 1 A 96.074 1 ATOM 2189 O O . CYS 273 273 ? A -11.667 -11.952 -12.376 1.000 1 A 96.074 1 ATOM 2190 C CB . CYS 273 273 ? A -10.328 -14.078 -11.189 1.000 1 A 96.074 1 ATOM 2191 S SG . CYS 273 273 ? A -10.866 -13.739 -9.498 1.000 1 A 96.074 1 ATOM 2192 N N . PHE 274 274 ? A -9.945 -10.552 -11.865 1.000 1 A 98.159 1 ATOM 2193 C CA . PHE 274 274 ? A -10.693 -9.377 -12.297 1.000 1 A 98.159 1 ATOM 2194 C C . PHE 274 274 ? A -10.375 -9.037 -13.748 1.000 1 A 98.159 1 ATOM 2195 O O . PHE 274 274 ? A -9.606 -9.743 -14.403 1.000 1 A 98.159 1 ATOM 2196 C CB . PHE 274 274 ? A -10.381 -8.178 -11.396 1.000 1 A 98.159 1 ATOM 2197 C CG . PHE 274 274 ? A -11.061 -8.234 -10.055 1.000 1 A 98.159 1 ATOM 2198 C CD1 . PHE 274 274 ? A -11.827 -9.336 -9.693 1.000 1 A 98.159 1 ATOM 2199 C CD2 . PHE 274 274 ? A -10.933 -7.184 -9.154 1.000 1 A 98.159 1 ATOM 2200 C CE1 . PHE 274 274 ? A -12.457 -9.390 -8.452 1.000 1 A 98.159 1 ATOM 2201 C CE2 . PHE 274 274 ? A -11.560 -7.232 -7.912 1.000 1 A 98.159 1 ATOM 2202 C CZ . PHE 274 274 ? A -12.322 -8.335 -7.564 1.000 1 A 98.159 1 ATOM 2203 N N . ASN 275 275 ? A -11.006 -8.029 -14.362 1.000 1 A 98.569 1 ATOM 2204 C CA . ASN 275 275 ? A -10.870 -7.720 -15.781 1.000 1 A 98.569 1 ATOM 2205 C C . ASN 275 275 ? A -10.668 -6.225 -16.013 1.000 1 A 98.569 1 ATOM 2206 O O . ASN 275 275 ? A -11.231 -5.656 -16.949 1.000 1 A 98.569 1 ATOM 2207 C CB . ASN 275 275 ? A -12.091 -8.217 -16.559 1.000 1 A 98.569 1 ATOM 2208 C CG . ASN 275 275 ? A -11.822 -8.349 -18.045 1.000 1 A 98.569 1 ATOM 2209 O OD1 . ASN 275 275 ? A -10.690 -8.600 -18.464 1.000 1 A 98.569 1 ATOM 2210 N ND2 . ASN 275 275 ? A -12.863 -8.182 -18.852 1.000 1 A 98.569 1 ATOM 2211 N N . LEU 276 276 ? A -9.873 -5.564 -15.189 1.000 1 A 98.731 1 ATOM 2212 C CA . LEU 276 276 ? A -9.625 -4.133 -15.324 1.000 1 A 98.731 1 ATOM 2213 C C . LEU 276 276 ? A -8.518 -3.866 -16.339 1.000 1 A 98.731 1 ATOM 2214 O O . LEU 276 276 ? A -7.584 -4.660 -16.467 1.000 1 A 98.731 1 ATOM 2215 C CB . LEU 276 276 ? A -9.251 -3.523 -13.971 1.000 1 A 98.731 1 ATOM 2216 C CG . LEU 276 276 ? A -10.267 -3.704 -12.842 1.000 1 A 98.731 1 ATOM 2217 C CD1 . LEU 276 276 ? A -9.814 -2.951 -11.595 1.000 1 A 98.731 1 ATOM 2218 C CD2 . LEU 276 276 ? A -11.648 -3.233 -13.284 1.000 1 A 98.731 1 ATOM 2219 N N . THR 277 277 ? A -8.710 -2.813 -17.084 1.000 1 A 98.767 1 ATOM 2220 C CA . THR 277 277 ? A -7.615 -2.263 -17.875 1.000 1 A 98.767 1 ATOM 2221 C C . THR 277 277 ? A -6.721 -1.373 -17.015 1.000 1 A 98.767 1 ATOM 2222 O O . THR 277 277 ? A -7.065 -1.056 -15.875 1.000 1 A 98.767 1 ATOM 2223 C CB . THR 277 277 ? A -8.143 -1.456 -19.076 1.000 1 A 98.767 1 ATOM 2224 O OG1 . THR 277 277 ? A -8.825 -0.290 -18.598 1.000 1 A 98.767 1 ATOM 2225 C CG2 . THR 277 277 ? A -9.108 -2.287 -19.914 1.000 1 A 98.767 1 ATOM 2226 N N . ILE 278 278 ? A -5.547 -0.982 -17.569 1.000 1 A 98.752 1 ATOM 2227 C CA . ILE 278 278 ? A -4.631 -0.082 -16.877 1.000 1 A 98.752 1 ATOM 2228 C C . ILE 278 278 ? A -5.316 1.260 -16.628 1.000 1 A 98.752 1 ATOM 2229 O O . ILE 278 278 ? A -5.236 1.810 -15.527 1.000 1 A 98.752 1 ATOM 2230 C CB . ILE 278 278 ? A -3.327 0.124 -17.680 1.000 1 A 98.752 1 ATOM 2231 C CG1 . ILE 278 278 ? A -2.503 -1.169 -17.699 1.000 1 A 98.752 1 ATOM 2232 C CG2 . ILE 278 278 ? A -2.512 1.283 -17.099 1.000 1 A 98.752 1 ATOM 2233 C CD1 . ILE 278 278 ? A -1.272 -1.105 -18.592 1.000 1 A 98.752 1 ATOM 2234 N N . LYS 279 279 ? A -6.060 1.724 -17.549 1.000 1 A 98.580 1 ATOM 2235 C CA . LYS 279 279 ? A -6.794 2.977 -17.398 1.000 1 A 98.580 1 ATOM 2236 C C . LYS 279 279 ? A -7.875 2.857 -16.328 1.000 1 A 98.580 1 ATOM 2237 O O . LYS 279 279 ? A -8.055 3.766 -15.515 1.000 1 A 98.580 1 ATOM 2238 C CB . LYS 279 279 ? A -7.419 3.397 -18.729 1.000 1 A 98.580 1 ATOM 2239 C CG . LYS 279 279 ? A -6.418 3.933 -19.742 1.000 1 A 98.580 1 ATOM 2240 C CD . LYS 279 279 ? A -7.109 4.410 -21.013 1.000 1 A 98.580 1 ATOM 2241 C CE . LYS 279 279 ? A -6.110 4.962 -22.020 1.000 1 A 98.580 1 ATOM 2242 N NZ . LYS 279 279 ? A -6.775 5.374 -23.292 1.000 1 A 98.580 1 ATOM 2243 N N . GLY 280 280 ? A -8.602 1.799 -16.400 1.000 1 A 98.575 1 ATOM 2244 C CA . GLY 280 280 ? A -9.633 1.573 -15.400 1.000 1 A 98.575 1 ATOM 2245 C C . GLY 280 280 ? A -9.091 1.527 -13.983 1.000 1 A 98.575 1 ATOM 2246 O O . GLY 280 280 ? A -9.676 2.112 -13.070 1.000 1 A 98.575 1 ATOM 2247 N N . HIS 281 281 ? A -7.958 0.811 -13.804 1.000 1 A 98.724 1 ATOM 2248 C CA . HIS 281 281 ? A -7.289 0.730 -12.511 1.000 1 A 98.724 1 ATOM 2249 C C . HIS 281 281 ? A -6.826 2.105 -12.042 1.000 1 A 98.724 1 ATOM 2250 O O . HIS 281 281 ? A -7.062 2.487 -10.894 1.000 1 A 98.724 1 ATOM 2251 C CB . HIS 281 281 ? A -6.099 -0.229 -12.583 1.000 1 A 98.724 1 ATOM 2252 C CG . HIS 281 281 ? A -5.578 -0.640 -11.242 1.000 1 A 98.724 1 ATOM 2253 N ND1 . HIS 281 281 ? A -4.681 0.124 -10.527 1.000 1 A 98.724 1 ATOM 2254 C CD2 . HIS 281 281 ? A -5.832 -1.735 -10.487 1.000 1 A 98.724 1 ATOM 2255 C CE1 . HIS 281 281 ? A -4.404 -0.487 -9.387 1.000 1 A 98.724 1 ATOM 2256 N NE2 . HIS 281 281 ? A -5.089 -1.616 -9.338 1.000 1 A 98.724 1 ATOM 2257 N N . ALA 282 282 ? A -6.285 2.968 -12.910 1.000 1 A 98.790 1 ATOM 2258 C CA . ALA 282 282 ? A -5.699 4.276 -12.628 1.000 1 A 98.790 1 ATOM 2259 C C . ALA 282 282 ? A -6.781 5.305 -12.313 1.000 1 A 98.790 1 ATOM 2260 O O . ALA 282 282 ? A -6.504 6.340 -11.702 1.000 1 A 98.790 1 ATOM 2261 C CB . ALA 282 282 ? A -4.850 4.744 -13.807 1.000 1 A 98.790 1 ATOM 2262 N N . LYS 283 283 ? A -8.046 4.983 -12.678 1.000 1 A 98.768 1 ATOM 2263 C CA . LYS 283 283 ? A -9.150 5.875 -12.335 1.000 1 A 98.768 1 ATOM 2264 C C . LYS 283 283 ? A -9.326 5.975 -10.823 1.000 1 A 98.768 1 ATOM 2265 O O . LYS 283 283 ? A -9.792 6.997 -10.314 1.000 1 A 98.768 1 ATOM 2266 C CB . LYS 283 283 ? A -10.449 5.394 -12.984 1.000 1 A 98.768 1 ATOM 2267 C CG . LYS 283 283 ? A -10.546 5.695 -14.472 1.000 1 A 98.768 1 ATOM 2268 C CD . LYS 283 283 ? A -11.907 5.304 -15.034 1.000 1 A 98.768 1 ATOM 2269 C CE . LYS 283 283 ? A -12.042 5.694 -16.499 1.000 1 A 98.768 1 ATOM 2270 N NZ . LYS 283 283 ? A -13.324 5.205 -17.088 1.000 1 A 98.768 1 ATOM 2271 N N . CYS 284 284 ? A -8.954 4.926 -10.172 1.000 1 A 98.809 1 ATOM 2272 C CA . CYS 284 284 ? A -8.983 4.973 -8.714 1.000 1 A 98.809 1 ATOM 2273 C C . CYS 284 284 ? A -7.973 5.981 -8.180 1.000 1 A 98.809 1 ATOM 2274 O O . CYS 284 284 ? A -8.286 6.765 -7.283 1.000 1 A 98.809 1 ATOM 2275 C CB . CYS 284 284 ? A -8.698 3.591 -8.127 1.000 1 A 98.809 1 ATOM 2276 S SG . CYS 284 284 ? A -9.921 2.341 -8.579 1.000 1 A 98.809 1 ATOM 2277 N N . VAL 285 285 ? A -6.781 5.948 -8.741 1.000 1 A 98.766 1 ATOM 2278 C CA . VAL 285 285 ? A -5.734 6.882 -8.340 1.000 1 A 98.766 1 ATOM 2279 C C . VAL 285 285 ? A -6.175 8.313 -8.638 1.000 1 A 98.766 1 ATOM 2280 O O . VAL 285 285 ? A -6.056 9.196 -7.786 1.000 1 A 98.766 1 ATOM 2281 C CB . VAL 285 285 ? A -4.398 6.576 -9.053 1.000 1 A 98.766 1 ATOM 2282 C CG1 . VAL 285 285 ? A -3.338 7.612 -8.682 1.000 1 A 98.766 1 ATOM 2283 C CG2 . VAL 285 285 ? A -3.917 5.168 -8.705 1.000 1 A 98.766 1 ATOM 2284 N N . GLU 286 286 ? A -6.739 8.524 -9.768 1.000 1 A 98.629 1 ATOM 2285 C CA . GLU 286 286 ? A -7.203 9.842 -10.190 1.000 1 A 98.629 1 ATOM 2286 C C . GLU 286 286 ? A -8.273 10.380 -9.244 1.000 1 A 98.629 1 ATOM 2287 O O . GLU 286 286 ? A -8.228 11.546 -8.846 1.000 1 A 98.629 1 ATOM 2288 C CB . GLU 286 286 ? A -7.745 9.789 -11.621 1.000 1 A 98.629 1 ATOM 2289 C CG . GLU 286 286 ? A -8.123 11.150 -12.186 1.000 1 A 98.629 1 ATOM 2290 C CD . GLU 286 286 ? A -8.562 11.095 -13.641 1.000 1 A 98.629 1 ATOM 2291 O OE1 . GLU 286 286 ? A -8.627 12.160 -14.296 1.000 1 A 98.629 1 ATOM 2292 O OE2 . GLU 286 286 ? A -8.843 9.978 -14.129 1.000 1 A 98.629 1 ATOM 2293 N N . PHE 287 287 ? A -9.187 9.559 -8.892 1.000 1 A 98.829 1 ATOM 2294 C CA . PHE 287 287 ? A -10.300 9.962 -8.041 1.000 1 A 98.829 1 ATOM 2295 C C . PHE 287 287 ? A -9.809 10.339 -6.649 1.000 1 A 98.829 1 ATOM 2296 O O . PHE 287 287 ? A -10.175 11.390 -6.119 1.000 1 A 98.829 1 ATOM 2297 C CB . PHE 287 287 ? A -11.339 8.841 -7.946 1.000 1 A 98.829 1 ATOM 2298 C CG . PHE 287 287 ? A -12.577 9.224 -7.180 1.000 1 A 98.829 1 ATOM 2299 C CD1 . PHE 287 287 ? A -12.829 8.686 -5.924 1.000 1 A 98.829 1 ATOM 2300 C CD2 . PHE 287 287 ? A -13.490 10.122 -7.717 1.000 1 A 98.829 1 ATOM 2301 C CE1 . PHE 287 287 ? A -13.974 9.038 -5.213 1.000 1 A 98.829 1 ATOM 2302 C CE2 . PHE 287 287 ? A -14.636 10.480 -7.013 1.000 1 A 98.829 1 ATOM 2303 C CZ . PHE 287 287 ? A -14.876 9.936 -5.762 1.000 1 A 98.829 1 ATOM 2304 N N . VAL 288 288 ? A -8.988 9.467 -6.118 1.000 1 A 98.770 1 ATOM 2305 C CA . VAL 288 288 ? A -8.487 9.692 -4.765 1.000 1 A 98.770 1 ATOM 2306 C C . VAL 288 288 ? A -7.609 10.940 -4.740 1.000 1 A 98.770 1 ATOM 2307 O O . VAL 288 288 ? A -7.684 11.741 -3.805 1.000 1 A 98.770 1 ATOM 2308 C CB . VAL 288 288 ? A -7.695 8.472 -4.244 1.000 1 A 98.770 1 ATOM 2309 C CG1 . VAL 288 288 ? A -7.031 8.792 -2.906 1.000 1 A 98.770 1 ATOM 2310 C CG2 . VAL 288 288 ? A -8.612 7.257 -4.112 1.000 1 A 98.770 1 ATOM 2311 N N . LYS 289 289 ? A -6.792 11.052 -5.739 1.000 1 A 98.196 1 ATOM 2312 C CA . LYS 289 289 ? A -5.907 12.206 -5.875 1.000 1 A 98.196 1 ATOM 2313 C C . LYS 289 289 ? A -6.703 13.508 -5.904 1.000 1 A 98.196 1 ATOM 2314 O O . LYS 289 289 ? A -6.231 14.540 -5.423 1.000 1 A 98.196 1 ATOM 2315 C CB . LYS 289 289 ? A -5.056 12.084 -7.140 1.000 1 A 98.196 1 ATOM 2316 C CG . LYS 289 289 ? A -4.059 13.217 -7.327 1.000 1 A 98.196 1 ATOM 2317 C CD . LYS 289 289 ? A -3.268 13.058 -8.619 1.000 1 A 98.196 1 ATOM 2318 C CE . LYS 289 289 ? A -3.332 14.318 -9.473 1.000 1 A 98.196 1 ATOM 2319 N NZ . LYS 289 289 ? A -2.710 14.109 -10.815 1.000 1 A 98.196 1 ATOM 2320 N N . SER 290 290 ? A -7.945 13.598 -6.273 1.000 1 A 98.070 1 ATOM 2321 C CA . SER 290 290 ? A -8.758 14.800 -6.434 1.000 1 A 98.070 1 ATOM 2322 C C . SER 290 290 ? A -9.167 15.375 -5.082 1.000 1 A 98.070 1 ATOM 2323 O O . SER 290 290 ? A -9.574 16.535 -4.992 1.000 1 A 98.070 1 ATOM 2324 C CB . SER 290 290 ? A -10.005 14.497 -7.266 1.000 1 A 98.070 1 ATOM 2325 O OG . SER 290 290 ? A -10.953 13.769 -6.505 1.000 1 A 98.070 1 ATOM 2326 N N . PHE 291 291 ? A -9.017 14.643 -4.010 1.000 1 A 98.094 1 ATOM 2327 C CA . PHE 291 291 ? A -9.404 15.096 -2.679 1.000 1 A 98.094 1 ATOM 2328 C C . PHE 291 291 ? A -8.294 15.924 -2.044 1.000 1 A 98.094 1 ATOM 2329 O O . PHE 291 291 ? A -8.466 16.471 -0.953 1.000 1 A 98.094 1 ATOM 2330 C CB . PHE 291 291 ? A -9.746 13.901 -1.782 1.000 1 A 98.094 1 ATOM 2331 C CG . PHE 291 291 ? A -11.049 13.234 -2.132 1.000 1 A 98.094 1 ATOM 2332 C CD1 . PHE 291 291 ? A -12.252 13.725 -1.640 1.000 1 A 98.094 1 ATOM 2333 C CD2 . PHE 291 291 ? A -11.070 12.114 -2.953 1.000 1 A 98.094 1 ATOM 2334 C CE1 . PHE 291 291 ? A -13.459 13.109 -1.962 1.000 1 A 98.094 1 ATOM 2335 C CE2 . PHE 291 291 ? A -12.272 11.493 -3.279 1.000 1 A 98.094 1 ATOM 2336 C CZ . PHE 291 291 ? A -13.465 11.991 -2.782 1.000 1 A 98.094 1 ATOM 2337 N N . ASN 292 292 ? A -7.120 15.972 -2.670 1.000 1 A 97.041 1 ATOM 2338 C CA . ASN 292 292 ? A -6.016 16.864 -2.331 1.000 1 A 97.041 1 ATOM 2339 C C . ASN 292 292 ? A -5.540 16.648 -0.897 1.000 1 A 97.041 1 ATOM 2340 O O . ASN 292 292 ? A -5.314 17.611 -0.162 1.000 1 A 97.041 1 ATOM 2341 C CB . ASN 292 292 ? A -6.423 18.324 -2.541 1.000 1 A 97.041 1 ATOM 2342 C CG . ASN 292 292 ? A -6.778 18.630 -3.983 1.000 1 A 97.041 1 ATOM 2343 O OD1 . ASN 292 292 ? A -6.005 18.343 -4.900 1.000 1 A 97.041 1 ATOM 2344 N ND2 . ASN 292 292 ? A -7.952 19.214 -4.193 1.000 1 A 97.041 1 ATOM 2345 N N . LEU 293 293 ? A -5.388 15.337 -0.491 1.000 1 A 98.182 1 ATOM 2346 C CA . LEU 293 293 ? A -4.809 14.939 0.788 1.000 1 A 98.182 1 ATOM 2347 C C . LEU 293 293 ? A -3.424 14.331 0.591 1.000 1 A 98.182 1 ATOM 2348 O O . LEU 293 293 ? A -3.129 13.780 -0.472 1.000 1 A 98.182 1 ATOM 2349 C CB . LEU 293 293 ? A -5.721 13.939 1.502 1.000 1 A 98.182 1 ATOM 2350 C CG . LEU 293 293 ? A -7.118 14.440 1.872 1.000 1 A 98.182 1 ATOM 2351 C CD1 . LEU 293 293 ? A -7.934 13.317 2.504 1.000 1 A 98.182 1 ATOM 2352 C CD2 . LEU 293 293 ? A -7.027 15.636 2.813 1.000 1 A 98.182 1 ATOM 2353 N N . PRO 294 294 ? A -2.543 14.546 1.628 1.000 1 A 98.639 1 ATOM 2354 C CA . PRO 294 294 ? A -1.310 13.762 1.520 1.000 1 A 98.639 1 ATOM 2355 C C . PRO 294 294 ? A -1.573 12.290 1.207 1.000 1 A 98.639 1 ATOM 2356 O O . PRO 294 294 ? A -2.421 11.661 1.844 1.000 1 A 98.639 1 ATOM 2357 C CB . PRO 294 294 ? A -0.670 13.919 2.902 1.000 1 A 98.639 1 ATOM 2358 C CG . PRO 294 294 ? A -1.229 15.198 3.438 1.000 1 A 98.639 1 ATOM 2359 C CD . PRO 294 294 ? A -2.653 15.326 2.979 1.000 1 A 98.639 1 ATOM 2360 N N . MET 295 295 ? A -0.869 11.802 0.203 1.000 1 A 98.797 1 ATOM 2361 C CA . MET 295 295 ? A -1.186 10.464 -0.287 1.000 1 A 98.797 1 ATOM 2362 C C . MET 295 295 ? A 0.081 9.631 -0.453 1.000 1 A 98.797 1 ATOM 2363 O O . MET 295 295 ? A 1.054 10.087 -1.056 1.000 1 A 98.797 1 ATOM 2364 C CB . MET 295 295 ? A -1.939 10.541 -1.616 1.000 1 A 98.797 1 ATOM 2365 C CG . MET 295 295 ? A -2.315 9.184 -2.188 1.000 1 A 98.797 1 ATOM 2366 S SD . MET 295 295 ? A -3.284 9.319 -3.740 1.000 1 A 98.797 1 ATOM 2367 C CE . MET 295 295 ? A -2.047 10.087 -4.823 1.000 1 A 98.797 1 ATOM 2368 N N . LEU 296 296 ? A 0.086 8.463 0.163 1.000 1 A 98.916 1 ATOM 2369 C CA . LEU 296 296 ? A 1.094 7.431 -0.053 1.000 1 A 98.916 1 ATOM 2370 C C . LEU 296 296 ? A 0.581 6.361 -1.011 1.000 1 A 98.916 1 ATOM 2371 O O . LEU 296 296 ? A -0.432 5.712 -0.738 1.000 1 A 98.916 1 ATOM 2372 C CB . LEU 296 296 ? A 1.499 6.790 1.277 1.000 1 A 98.916 1 ATOM 2373 C CG . LEU 296 296 ? A 2.445 5.591 1.192 1.000 1 A 98.916 1 ATOM 2374 C CD1 . LEU 296 296 ? A 3.722 5.975 0.451 1.000 1 A 98.916 1 ATOM 2375 C CD2 . LEU 296 296 ? A 2.768 5.064 2.586 1.000 1 A 98.916 1 ATOM 2376 N N . MET 297 297 ? A 1.280 6.156 -2.167 1.000 1 A 98.891 1 ATOM 2377 C CA . MET 297 297 ? A 0.942 5.116 -3.133 1.000 1 A 98.891 1 ATOM 2378 C C . MET 297 297 ? A 1.898 3.933 -3.017 1.000 1 A 98.891 1 ATOM 2379 O O . MET 297 297 ? A 3.115 4.102 -3.112 1.000 1 A 98.891 1 ATOM 2380 C CB . MET 297 297 ? A 0.971 5.674 -4.557 1.000 1 A 98.891 1 ATOM 2381 C CG . MET 297 297 ? A -0.049 6.774 -4.806 1.000 1 A 98.891 1 ATOM 2382 S SD . MET 297 297 ? A 0.165 7.574 -6.443 1.000 1 A 98.891 1 ATOM 2383 C CE . MET 297 297 ? A -0.208 6.174 -7.535 1.000 1 A 98.891 1 ATOM 2384 N N . LEU 298 298 ? A 1.292 2.777 -2.878 1.000 1 A 98.869 1 ATOM 2385 C CA . LEU 298 298 ? A 2.092 1.570 -2.702 1.000 1 A 98.869 1 ATOM 2386 C C . LEU 298 298 ? A 1.750 0.532 -3.766 1.000 1 A 98.869 1 ATOM 2387 O O . LEU 298 298 ? A 0.682 0.594 -4.379 1.000 1 A 98.869 1 ATOM 2388 C CB . LEU 298 298 ? A 1.873 0.979 -1.307 1.000 1 A 98.869 1 ATOM 2389 C CG . LEU 298 298 ? A 2.242 1.877 -0.125 1.000 1 A 98.869 1 ATOM 2390 C CD1 . LEU 298 298 ? A 1.626 1.339 1.162 1.000 1 A 98.869 1 ATOM 2391 C CD2 . LEU 298 298 ? A 3.757 1.992 0.008 1.000 1 A 98.869 1 ATOM 2392 N N . GLY 299 299 ? A 2.697 -0.365 -3.986 1.000 1 A 98.430 1 ATOM 2393 C CA . GLY 299 299 ? A 2.442 -1.487 -4.875 1.000 1 A 98.430 1 ATOM 2394 C C . GLY 299 299 ? A 1.502 -2.518 -4.280 1.000 1 A 98.430 1 ATOM 2395 O O . GLY 299 299 ? A 0.472 -2.167 -3.702 1.000 1 A 98.430 1 ATOM 2396 N N . GLY 300 300 ? A 1.779 -3.766 -4.397 1.000 1 A 97.202 1 ATOM 2397 C CA . GLY 300 300 ? A 0.992 -4.906 -3.955 1.000 1 A 97.202 1 ATOM 2398 C C . GLY 300 300 ? A 1.070 -6.088 -4.904 1.000 1 A 97.202 1 ATOM 2399 O O . GLY 300 300 ? A 2.137 -6.390 -5.441 1.000 1 A 97.202 1 ATOM 2400 N N . GLY 301 301 ? A -0.028 -6.866 -4.946 1.000 1 A 96.631 1 ATOM 2401 C CA . GLY 301 301 ? A -0.037 -8.031 -5.817 1.000 1 A 96.631 1 ATOM 2402 C C . GLY 301 301 ? A 0.053 -7.676 -7.290 1.000 1 A 96.631 1 ATOM 2403 O O . GLY 301 301 ? A -0.207 -6.534 -7.675 1.000 1 A 96.631 1 ATOM 2404 N N . GLY 302 302 ? A 0.269 -8.636 -8.144 1.000 1 A 97.726 1 ATOM 2405 C CA . GLY 302 302 ? A 0.509 -8.611 -9.578 1.000 1 A 97.726 1 ATOM 2406 C C . GLY 302 302 ? A 1.511 -9.654 -10.034 1.000 1 A 97.726 1 ATOM 2407 O O . GLY 302 302 ? A 2.697 -9.566 -9.710 1.000 1 A 97.726 1 ATOM 2408 N N . TYR 303 303 ? A 0.955 -10.537 -10.907 1.000 1 A 97.842 1 ATOM 2409 C CA . TYR 303 303 ? A 1.767 -11.726 -11.138 1.000 1 A 97.842 1 ATOM 2410 C C . TYR 303 303 ? A 2.019 -11.933 -12.627 1.000 1 A 97.842 1 ATOM 2411 O O . TYR 303 303 ? A 2.430 -13.017 -13.048 1.000 1 A 97.842 1 ATOM 2412 C CB . TYR 303 303 ? A 1.086 -12.965 -10.547 1.000 1 A 97.842 1 ATOM 2413 C CG . TYR 303 303 ? A 0.648 -12.790 -9.113 1.000 1 A 97.842 1 ATOM 2414 C CD1 . TYR 303 303 ? A 1.580 -12.773 -8.077 1.000 1 A 97.842 1 ATOM 2415 C CD2 . TYR 303 303 ? A -0.697 -12.643 -8.791 1.000 1 A 97.842 1 ATOM 2416 C CE1 . TYR 303 303 ? A 1.181 -12.615 -6.754 1.000 1 A 97.842 1 ATOM 2417 C CE2 . TYR 303 303 ? A -1.107 -12.484 -7.471 1.000 1 A 97.842 1 ATOM 2418 C CZ . TYR 303 303 ? A -0.162 -12.471 -6.461 1.000 1 A 97.842 1 ATOM 2419 O OH . TYR 303 303 ? A -0.563 -12.313 -5.153 1.000 1 A 97.842 1 ATOM 2420 N N . THR 304 304 ? A 1.662 -11.072 -13.376 1.000 1 A 98.021 1 ATOM 2421 C CA . THR 304 304 ? A 2.124 -10.843 -14.740 1.000 1 A 98.021 1 ATOM 2422 C C . THR 304 304 ? A 3.000 -9.596 -14.812 1.000 1 A 98.021 1 ATOM 2423 O O . THR 304 304 ? A 2.493 -8.482 -14.964 1.000 1 A 98.021 1 ATOM 2424 C CB . THR 304 304 ? A 0.940 -10.699 -15.714 1.000 1 A 98.021 1 ATOM 2425 O OG1 . THR 304 304 ? A 0.067 -11.826 -15.567 1.000 1 A 98.021 1 ATOM 2426 C CG2 . THR 304 304 ? A 1.422 -10.630 -17.160 1.000 1 A 98.021 1 ATOM 2427 N N . ILE 305 305 ? A 4.320 -9.779 -14.699 1.000 1 A 97.948 1 ATOM 2428 C CA . ILE 305 305 ? A 5.266 -8.723 -14.357 1.000 1 A 97.948 1 ATOM 2429 C C . ILE 305 305 ? A 5.213 -7.621 -15.413 1.000 1 A 97.948 1 ATOM 2430 O O . ILE 305 305 ? A 5.351 -6.438 -15.093 1.000 1 A 97.948 1 ATOM 2431 C CB . ILE 305 305 ? A 6.704 -9.272 -14.227 1.000 1 A 97.948 1 ATOM 2432 C CG1 . ILE 305 305 ? A 7.149 -9.920 -15.544 1.000 1 A 97.948 1 ATOM 2433 C CG2 . ILE 305 305 ? A 6.798 -10.269 -13.068 1.000 1 A 97.948 1 ATOM 2434 C CD1 . ILE 305 305 ? A 8.614 -10.336 -15.564 1.000 1 A 97.948 1 ATOM 2435 N N . ARG 306 306 ? A 4.967 -7.950 -16.667 1.000 1 A 97.916 1 ATOM 2436 C CA . ARG 306 306 ? A 4.929 -6.934 -17.713 1.000 1 A 97.916 1 ATOM 2437 C C . ARG 306 306 ? A 3.719 -6.021 -17.546 1.000 1 A 97.916 1 ATOM 2438 O O . ARG 306 306 ? A 3.804 -4.817 -17.797 1.000 1 A 97.916 1 ATOM 2439 C CB . ARG 306 306 ? A 4.906 -7.586 -19.097 1.000 1 A 97.916 1 ATOM 2440 C CG . ARG 306 306 ? A 3.670 -8.432 -19.359 1.000 1 A 97.916 1 ATOM 2441 C CD . ARG 306 306 ? A 3.730 -9.112 -20.719 1.000 1 A 97.916 1 ATOM 2442 N NE . ARG 306 306 ? A 2.543 -9.926 -20.968 1.000 1 A 97.916 1 ATOM 2443 C CZ . ARG 306 306 ? A 2.402 -11.194 -20.592 1.000 1 A 97.916 1 ATOM 2444 N NH1 . ARG 306 306 ? A 3.374 -11.821 -19.940 1.000 1 A 97.916 1 ATOM 2445 N NH2 . ARG 306 306 ? A 1.279 -11.841 -20.869 1.000 1 A 97.916 1 ATOM 2446 N N . ASN 307 307 ? A 2.593 -6.593 -17.136 1.000 1 A 98.265 1 ATOM 2447 C CA . ASN 307 307 ? A 1.404 -5.772 -16.936 1.000 1 A 98.265 1 ATOM 2448 C C . ASN 307 307 ? A 1.519 -4.915 -15.679 1.000 1 A 98.265 1 ATOM 2449 O O . ASN 307 307 ? A 1.032 -3.784 -15.646 1.000 1 A 98.265 1 ATOM 2450 C CB . ASN 307 307 ? A 0.152 -6.648 -16.869 1.000 1 A 98.265 1 ATOM 2451 C CG . ASN 307 307 ? A -0.196 -7.274 -18.205 1.000 1 A 98.265 1 ATOM 2452 O OD1 . ASN 307 307 ? A 0.339 -6.883 -19.245 1.000 1 A 98.265 1 ATOM 2453 N ND2 . ASN 307 307 ? A -1.095 -8.251 -18.186 1.000 1 A 98.265 1 ATOM 2454 N N . VAL 308 308 ? A 2.197 -5.441 -14.673 1.000 1 A 98.667 1 ATOM 2455 C CA . VAL 308 308 ? A 2.439 -4.673 -13.456 1.000 1 A 98.667 1 ATOM 2456 C C . VAL 308 308 ? A 3.253 -3.424 -13.786 1.000 1 A 98.667 1 ATOM 2457 O O . VAL 308 308 ? A 2.903 -2.319 -13.366 1.000 1 A 98.667 1 ATOM 2458 C CB . VAL 308 308 ? A 3.170 -5.519 -12.389 1.000 1 A 98.667 1 ATOM 2459 C CG1 . VAL 308 308 ? A 3.524 -4.664 -11.173 1.000 1 A 98.667 1 ATOM 2460 C CG2 . VAL 308 308 ? A 2.312 -6.713 -11.975 1.000 1 A 98.667 1 ATOM 2461 N N . ALA 309 309 ? A 4.318 -3.614 -14.505 1.000 1 A 98.735 1 ATOM 2462 C CA . ALA 309 309 ? A 5.212 -2.518 -14.867 1.000 1 A 98.735 1 ATOM 2463 C C . ALA 309 309 ? A 4.471 -1.443 -15.656 1.000 1 A 98.735 1 ATOM 2464 O O . ALA 309 309 ? A 4.641 -0.248 -15.400 1.000 1 A 98.735 1 ATOM 2465 C CB . ALA 309 309 ? A 6.397 -3.043 -15.674 1.000 1 A 98.735 1 ATOM 2466 N N . ARG 310 310 ? A 3.583 -1.883 -16.609 1.000 1 A 98.798 1 ATOM 2467 C CA . ARG 310 310 ? A 2.787 -0.936 -17.383 1.000 1 A 98.798 1 ATOM 2468 C C . ARG 310 310 ? A 1.842 -0.149 -16.481 1.000 1 A 98.798 1 ATOM 2469 O O . ARG 310 310 ? A 1.758 1.077 -16.580 1.000 1 A 98.798 1 ATOM 2470 C CB . ARG 310 310 ? A 1.990 -1.664 -18.468 1.000 1 A 98.798 1 ATOM 2471 C CG . ARG 310 310 ? A 2.851 -2.260 -19.570 1.000 1 A 98.798 1 ATOM 2472 C CD . ARG 310 310 ? A 2.009 -2.952 -20.632 1.000 1 A 98.798 1 ATOM 2473 N NE . ARG 310 310 ? A 2.841 -3.587 -21.650 1.000 1 A 98.798 1 ATOM 2474 C CZ . ARG 310 310 ? A 3.072 -4.895 -21.733 1.000 1 A 98.798 1 ATOM 2475 N NH1 . ARG 310 310 ? A 2.535 -5.735 -20.856 1.000 1 A 98.798 1 ATOM 2476 N NH2 . ARG 310 310 ? A 3.845 -5.366 -22.701 1.000 1 A 98.798 1 ATOM 2477 N N . CYS 311 311 ? A 1.191 -0.836 -15.620 1.000 1 A 98.866 1 ATOM 2478 C CA . CYS 311 311 ? A 0.188 -0.231 -14.751 1.000 1 A 98.866 1 ATOM 2479 C C . CYS 311 311 ? A 0.823 0.782 -13.807 1.000 1 A 98.866 1 ATOM 2480 O O . CYS 311 311 ? A 0.356 1.918 -13.703 1.000 1 A 98.866 1 ATOM 2481 C CB . CYS 311 311 ? A -0.541 -1.306 -13.945 1.000 1 A 98.866 1 ATOM 2482 S SG . CYS 311 311 ? A -1.810 -0.652 -12.839 1.000 1 A 98.866 1 ATOM 2483 N N . TRP 312 312 ? A 1.837 0.375 -13.101 1.000 1 A 98.874 1 ATOM 2484 C CA . TRP 312 312 ? A 2.469 1.254 -12.122 1.000 1 A 98.874 1 ATOM 2485 C C . TRP 312 312 ? A 3.122 2.450 -12.805 1.000 1 A 98.874 1 ATOM 2486 O O . TRP 312 312 ? A 3.176 3.544 -12.238 1.000 1 A 98.874 1 ATOM 2487 C CB . TRP 312 312 ? A 3.510 0.486 -11.303 1.000 1 A 98.874 1 ATOM 2488 C CG . TRP 312 312 ? A 2.921 -0.436 -10.279 1.000 1 A 98.874 1 ATOM 2489 C CD1 . TRP 312 312 ? A 1.602 -0.554 -9.938 1.000 1 A 98.874 1 ATOM 2490 C CD2 . TRP 312 312 ? A 3.632 -1.367 -9.457 1.000 1 A 98.874 1 ATOM 2491 N NE1 . TRP 312 312 ? A 1.450 -1.503 -8.954 1.000 1 A 98.874 1 ATOM 2492 C CE2 . TRP 312 312 ? A 2.680 -2.017 -8.641 1.000 1 A 98.874 1 ATOM 2493 C CE3 . TRP 312 312 ? A 4.984 -1.715 -9.332 1.000 1 A 98.874 1 ATOM 2494 C CZ2 . TRP 312 312 ? A 3.037 -2.997 -7.712 1.000 1 A 98.874 1 ATOM 2495 C CZ3 . TRP 312 312 ? A 5.337 -2.691 -8.407 1.000 1 A 98.874 1 ATOM 2496 C CH2 . TRP 312 312 ? A 4.366 -3.319 -7.610 1.000 1 A 98.874 1 ATOM 2497 N N . THR 313 313 ? A 3.606 2.311 -14.069 1.000 1 A 98.883 1 ATOM 2498 C CA . THR 313 313 ? A 4.121 3.429 -14.851 1.000 1 A 98.883 1 ATOM 2499 C C . THR 313 313 ? A 3.015 4.439 -15.145 1.000 1 A 98.883 1 ATOM 2500 O O . THR 313 313 ? A 3.196 5.641 -14.943 1.000 1 A 98.883 1 ATOM 2501 C CB . THR 313 313 ? A 4.743 2.945 -16.174 1.000 1 A 98.883 1 ATOM 2502 O OG1 . THR 313 313 ? A 5.852 2.084 -15.887 1.000 1 A 98.883 1 ATOM 2503 C CG2 . THR 313 313 ? A 5.232 4.121 -17.015 1.000 1 A 98.883 1 ATOM 2504 N N . TYR 314 314 ? A 1.887 3.925 -15.581 1.000 1 A 98.910 1 ATOM 2505 C CA . TYR 314 314 ? A 0.761 4.792 -15.909 1.000 1 A 98.910 1 ATOM 2506 C C . TYR 314 314 ? A 0.226 5.486 -14.662 1.000 1 A 98.910 1 ATOM 2507 O O . TYR 314 314 ? A -0.104 6.674 -14.699 1.000 1 A 98.910 1 ATOM 2508 C CB . TYR 314 314 ? A -0.358 3.990 -16.580 1.000 1 A 98.910 1 ATOM 2509 C CG . TYR 314 314 ? A -1.462 4.847 -17.150 1.000 1 A 98.910 1 ATOM 2510 C CD1 . TYR 314 314 ? A -2.739 4.832 -16.594 1.000 1 A 98.910 1 ATOM 2511 C CD2 . TYR 314 314 ? A -1.231 5.673 -18.245 1.000 1 A 98.910 1 ATOM 2512 C CE1 . TYR 314 314 ? A -3.761 5.618 -17.117 1.000 1 A 98.910 1 ATOM 2513 C CE2 . TYR 314 314 ? A -2.245 6.464 -18.776 1.000 1 A 98.910 1 ATOM 2514 C CZ . TYR 314 314 ? A -3.504 6.430 -18.205 1.000 1 A 98.910 1 ATOM 2515 O OH . TYR 314 314 ? A -4.511 7.211 -18.727 1.000 1 A 98.910 1 ATOM 2516 N N . GLU 315 315 ? A 0.172 4.788 -13.558 1.000 1 A 98.866 1 ATOM 2517 C CA . GLU 315 315 ? A -0.313 5.366 -12.308 1.000 1 A 98.866 1 ATOM 2518 C C . GLU 315 315 ? A 0.635 6.446 -11.795 1.000 1 A 98.866 1 ATOM 2519 O O . GLU 315 315 ? A 0.197 7.433 -11.201 1.000 1 A 98.866 1 ATOM 2520 C CB . GLU 315 315 ? A -0.493 4.278 -11.247 1.000 1 A 98.866 1 ATOM 2521 C CG . GLU 315 315 ? A -1.716 3.399 -11.468 1.000 1 A 98.866 1 ATOM 2522 C CD . GLU 315 315 ? A -1.850 2.286 -10.441 1.000 1 A 98.866 1 ATOM 2523 O OE1 . GLU 315 315 ? A -2.934 1.667 -10.355 1.000 1 A 98.866 1 ATOM 2524 O OE2 . GLU 315 315 ? A -0.862 2.033 -9.715 1.000 1 A 98.866 1 ATOM 2525 N N . THR 316 316 ? A 1.914 6.220 -11.999 1.000 1 A 98.836 1 ATOM 2526 C CA . THR 316 316 ? A 2.864 7.284 -11.694 1.000 1 A 98.836 1 ATOM 2527 C C . THR 316 316 ? A 2.588 8.517 -12.549 1.000 1 A 98.836 1 ATOM 2528 O O . THR 316 316 ? A 2.619 9.644 -12.051 1.000 1 A 98.836 1 ATOM 2529 C CB . THR 316 316 ? A 4.315 6.817 -11.914 1.000 1 A 98.836 1 ATOM 2530 O OG1 . THR 316 316 ? A 4.589 5.706 -11.051 1.000 1 A 98.836 1 ATOM 2531 C CG2 . THR 316 316 ? A 5.305 7.937 -11.612 1.000 1 A 98.836 1 ATOM 2532 N N . ALA 317 317 ? A 2.296 8.360 -13.833 1.000 1 A 98.767 1 ATOM 2533 C CA . ALA 317 317 ? A 1.959 9.466 -14.726 1.000 1 A 98.767 1 ATOM 2534 C C . ALA 317 317 ? A 0.716 10.205 -14.239 1.000 1 A 98.767 1 ATOM 2535 O O . ALA 317 317 ? A 0.666 11.437 -14.273 1.000 1 A 98.767 1 ATOM 2536 C CB . ALA 317 317 ? A 1.747 8.955 -16.149 1.000 1 A 98.767 1 ATOM 2537 N N . VAL 318 318 ? A -0.252 9.455 -13.755 1.000 1 A 98.650 1 ATOM 2538 C CA . VAL 318 318 ? A -1.471 10.044 -13.211 1.000 1 A 98.650 1 ATOM 2539 C C . VAL 318 318 ? A -1.135 10.880 -11.978 1.000 1 A 98.650 1 ATOM 2540 O O . VAL 318 318 ? A -1.609 12.010 -11.839 1.000 1 A 98.650 1 ATOM 2541 C CB . VAL 318 318 ? A -2.513 8.961 -12.853 1.000 1 A 98.650 1 ATOM 2542 C CG1 . VAL 318 318 ? A -3.684 9.571 -12.084 1.000 1 A 98.650 1 ATOM 2543 C CG2 . VAL 318 318 ? A -3.008 8.259 -14.116 1.000 1 A 98.650 1 ATOM 2544 N N . ALA 319 319 ? A -0.284 10.330 -11.116 1.000 1 A 98.540 1 ATOM 2545 C CA . ALA 319 319 ? A 0.132 11.046 -9.913 1.000 1 A 98.540 1 ATOM 2546 C C . ALA 319 319 ? A 0.842 12.350 -10.269 1.000 1 A 98.540 1 ATOM 2547 O O . ALA 319 319 ? A 0.717 13.347 -9.554 1.000 1 A 98.540 1 ATOM 2548 C CB . ALA 319 319 ? A 1.039 10.166 -9.057 1.000 1 A 98.540 1 ATOM 2549 N N . LEU 320 320 ? A 1.482 12.380 -11.421 1.000 1 A 98.390 1 ATOM 2550 C CA . LEU 320 320 ? A 2.290 13.510 -11.867 1.000 1 A 98.390 1 ATOM 2551 C C . LEU 320 320 ? A 1.473 14.446 -12.751 1.000 1 A 98.390 1 ATOM 2552 O O . LEU 320 320 ? A 1.988 15.457 -13.235 1.000 1 A 98.390 1 ATOM 2553 C CB . LEU 320 320 ? A 3.525 13.020 -12.628 1.000 1 A 98.390 1 ATOM 2554 C CG . LEU 320 320 ? A 4.584 12.289 -11.801 1.000 1 A 98.390 1 ATOM 2555 C CD1 . LEU 320 320 ? A 5.582 11.590 -12.718 1.000 1 A 98.390 1 ATOM 2556 C CD2 . LEU 320 320 ? A 5.298 13.260 -10.867 1.000 1 A 98.390 1 ATOM 2557 N N . ASP 321 321 ? A 0.182 14.092 -13.017 1.000 1 A 97.617 1 ATOM 2558 C CA . ASP 321 321 ? A -0.622 14.864 -13.958 1.000 1 A 97.617 1 ATOM 2559 C C . ASP 321 321 ? A 0.103 15.033 -15.291 1.000 1 A 97.617 1 ATOM 2560 O O . ASP 321 321 ? A 0.178 16.140 -15.828 1.000 1 A 97.617 1 ATOM 2561 C CB . ASP 321 321 ? A -0.968 16.234 -13.371 1.000 1 A 97.617 1 ATOM 2562 C CG . ASP 321 321 ? A -1.920 16.150 -12.191 1.000 1 A 97.617 1 ATOM 2563 O OD1 . ASP 321 321 ? A -2.930 15.418 -12.273 1.000 1 A 97.617 1 ATOM 2564 O OD2 . ASP 321 321 ? A -1.660 16.825 -11.171 1.000 1 A 97.617 1 ATOM 2565 N N . THR 322 322 ? A 0.684 13.877 -15.739 1.000 1 A 97.780 1 ATOM 2566 C CA . THR 322 322 ? A 1.431 13.873 -16.992 1.000 1 A 97.780 1 ATOM 2567 C C . THR 322 322 ? A 0.848 12.852 -17.965 1.000 1 A 97.780 1 ATOM 2568 O O . THR 322 322 ? A 0.699 11.677 -17.625 1.000 1 A 97.780 1 ATOM 2569 C CB . THR 322 322 ? A 2.921 13.566 -16.753 1.000 1 A 97.780 1 ATOM 2570 O OG1 . THR 322 322 ? A 3.474 14.560 -15.881 1.000 1 A 97.780 1 ATOM 2571 C CG2 . THR 322 322 ? A 3.700 13.567 -18.065 1.000 1 A 97.780 1 ATOM 2572 N N . GLU 323 323 ? A 0.545 13.361 -19.085 1.000 1 A 97.859 1 ATOM 2573 C CA . GLU 323 323 ? A 0.104 12.467 -20.152 1.000 1 A 97.859 1 ATOM 2574 C C . GLU 323 323 ? A 1.290 11.776 -20.818 1.000 1 A 97.859 1 ATOM 2575 O O . GLU 323 323 ? A 2.288 12.422 -21.146 1.000 1 A 97.859 1 ATOM 2576 C CB . GLU 323 323 ? A -0.711 13.235 -21.195 1.000 1 A 97.859 1 ATOM 2577 C CG . GLU 323 323 ? A -1.448 12.339 -22.181 1.000 1 A 97.859 1 ATOM 2578 C CD . GLU 323 323 ? A -2.297 13.114 -23.176 1.000 1 A 97.859 1 ATOM 2579 O OE1 . GLU 323 323 ? A -2.958 12.482 -24.031 1.000 1 A 97.859 1 ATOM 2580 O OE2 . GLU 323 323 ? A -2.300 14.363 -23.101 1.000 1 A 97.859 1 ATOM 2581 N N . ILE 324 324 ? A 1.215 10.504 -21.030 1.000 1 A 98.491 1 ATOM 2582 C CA . ILE 324 324 ? A 2.286 9.765 -21.690 1.000 1 A 98.491 1 ATOM 2583 C C . ILE 324 324 ? A 1.715 8.959 -22.855 1.000 1 A 98.491 1 ATOM 2584 O O . ILE 324 324 ? A 0.547 8.566 -22.832 1.000 1 A 98.491 1 ATOM 2585 C CB . ILE 324 324 ? A 3.021 8.832 -20.702 1.000 1 A 98.491 1 ATOM 2586 C CG1 . ILE 324 324 ? A 2.033 7.854 -20.055 1.000 1 A 98.491 1 ATOM 2587 C CG2 . ILE 324 324 ? A 3.761 9.647 -19.638 1.000 1 A 98.491 1 ATOM 2588 C CD1 . ILE 324 324 ? A 2.690 6.811 -19.161 1.000 1 A 98.491 1 ATOM 2589 N N . PRO 325 325 ? A 2.467 8.749 -23.898 1.000 1 A 98.303 1 ATOM 2590 C CA . PRO 325 325 ? A 1.988 8.010 -25.069 1.000 1 A 98.303 1 ATOM 2591 C C . PRO 325 325 ? A 1.773 6.525 -24.783 1.000 1 A 98.303 1 ATOM 2592 O O . PRO 325 325 ? A 2.390 5.974 -23.867 1.000 1 A 98.303 1 ATOM 2593 C CB . PRO 325 325 ? A 3.105 8.212 -26.095 1.000 1 A 98.303 1 ATOM 2594 C CG . PRO 325 325 ? A 4.332 8.463 -25.280 1.000 1 A 98.303 1 ATOM 2595 C CD . PRO 325 325 ? A 3.927 9.148 -24.006 1.000 1 A 98.303 1 ATOM 2596 N N . ASN 326 326 ? A 0.959 5.929 -25.583 1.000 1 A 98.478 1 ATOM 2597 C CA . ASN 326 326 ? A 0.677 4.502 -25.479 1.000 1 A 98.478 1 ATOM 2598 C C . ASN 326 326 ? A 1.829 3.661 -26.023 1.000 1 A 98.478 1 ATOM 2599 O O . ASN 326 326 ? A 2.011 2.513 -25.616 1.000 1 A 98.478 1 ATOM 2600 C CB . ASN 326 326 ? A -0.622 4.157 -26.211 1.000 1 A 98.478 1 ATOM 2601 C CG . ASN 326 326 ? A -1.115 2.758 -25.898 1.000 1 A 98.478 1 ATOM 2602 O OD1 . ASN 326 326 ? A -0.895 2.240 -24.801 1.000 1 A 98.478 1 ATOM 2603 N ND2 . ASN 326 326 ? A -1.787 2.137 -26.861 1.000 1 A 98.478 1 ATOM 2604 N N . GLU 327 327 ? A 2.642 4.247 -26.859 1.000 1 A 98.123 1 ATOM 2605 C CA . GLU 327 327 ? A 3.816 3.557 -27.385 1.000 1 A 98.123 1 ATOM 2606 C C . GLU 327 327 ? A 4.915 3.454 -26.330 1.000 1 A 98.123 1 ATOM 2607 O O . GLU 327 327 ? A 5.273 4.452 -25.701 1.000 1 A 98.123 1 ATOM 2608 C CB . GLU 327 327 ? A 4.347 4.272 -28.630 1.000 1 A 98.123 1 ATOM 2609 C CG . GLU 327 327 ? A 3.373 4.275 -29.799 1.000 1 A 98.123 1 ATOM 2610 C CD . GLU 327 327 ? A 3.117 2.890 -30.371 1.000 1 A 98.123 1 ATOM 2611 O OE1 . GLU 327 327 ? A 2.226 2.747 -31.239 1.000 1 A 98.123 1 ATOM 2612 O OE2 . GLU 327 327 ? A 3.812 1.940 -29.947 1.000 1 A 98.123 1 ATOM 2613 N N . LEU 328 328 ? A 5.379 2.163 -26.136 1.000 1 A 98.028 1 ATOM 2614 C CA . LEU 328 328 ? A 6.449 1.999 -25.158 1.000 1 A 98.028 1 ATOM 2615 C C . LEU 328 328 ? A 7.773 2.517 -25.708 1.000 1 A 98.028 1 ATOM 2616 O O . LEU 328 328 ? A 8.157 2.182 -26.831 1.000 1 A 98.028 1 ATOM 2617 C CB . LEU 328 328 ? A 6.589 0.528 -24.758 1.000 1 A 98.028 1 ATOM 2618 C CG . LEU 328 328 ? A 5.433 -0.071 -23.956 1.000 1 A 98.028 1 ATOM 2619 C CD1 . LEU 328 328 ? A 5.664 -1.560 -23.724 1.000 1 A 98.028 1 ATOM 2620 C CD2 . LEU 328 328 ? A 5.267 0.663 -22.629 1.000 1 A 98.028 1 ATOM 2621 N N . PRO 329 329 ? A 8.460 3.382 -24.966 1.000 1 A 97.837 1 ATOM 2622 C CA . PRO 329 329 ? A 9.823 3.745 -25.358 1.000 1 A 97.837 1 ATOM 2623 C C . PRO 329 329 ? A 10.799 2.575 -25.255 1.000 1 A 97.837 1 ATOM 2624 O O . PRO 329 329 ? A 10.551 1.624 -24.508 1.000 1 A 97.837 1 ATOM 2625 C CB . PRO 329 329 ? A 10.192 4.853 -24.368 1.000 1 A 97.837 1 ATOM 2626 C CG . PRO 329 329 ? A 9.395 4.549 -23.141 1.000 1 A 97.837 1 ATOM 2627 C CD . PRO 329 329 ? A 8.078 3.962 -23.560 1.000 1 A 97.837 1 ATOM 2628 N N . TYR 330 330 ? A 11.824 2.646 -26.131 1.000 1 A 97.164 1 ATOM 2629 C CA . TYR 330 330 ? A 12.871 1.643 -25.970 1.000 1 A 97.164 1 ATOM 2630 C C . TYR 330 330 ? A 13.416 1.649 -24.547 1.000 1 A 97.164 1 ATOM 2631 O O . TYR 330 330 ? A 13.601 2.712 -23.950 1.000 1 A 97.164 1 ATOM 2632 C CB . TYR 330 330 ? A 14.008 1.887 -26.966 1.000 1 A 97.164 1 ATOM 2633 C CG . TYR 330 330 ? A 15.028 0.775 -27.007 1.000 1 A 97.164 1 ATOM 2634 C CD1 . TYR 330 330 ? A 16.244 0.894 -26.338 1.000 1 A 97.164 1 ATOM 2635 C CD2 . TYR 330 330 ? A 14.779 -0.396 -27.714 1.000 1 A 97.164 1 ATOM 2636 C CE1 . TYR 330 330 ? A 17.188 -0.127 -26.374 1.000 1 A 97.164 1 ATOM 2637 C CE2 . TYR 330 330 ? A 15.715 -1.424 -27.757 1.000 1 A 97.164 1 ATOM 2638 C CZ . TYR 330 330 ? A 16.915 -1.280 -27.085 1.000 1 A 97.164 1 ATOM 2639 O OH . TYR 330 330 ? A 17.846 -2.294 -27.124 1.000 1 A 97.164 1 ATOM 2640 N N . ASN 331 331 ? A 13.505 0.429 -24.056 1.000 1 A 96.977 1 ATOM 2641 C CA . ASN 331 331 ? A 14.021 0.248 -22.704 1.000 1 A 96.977 1 ATOM 2642 C C . ASN 331 331 ? A 14.775 -1.072 -22.564 1.000 1 A 96.977 1 ATOM 2643 O O . ASN 331 331 ? A 14.806 -1.876 -23.497 1.000 1 A 96.977 1 ATOM 2644 C CB . ASN 331 331 ? A 12.886 0.322 -21.681 1.000 1 A 96.977 1 ATOM 2645 C CG . ASN 331 331 ? A 11.889 -0.811 -21.832 1.000 1 A 96.977 1 ATOM 2646 O OD1 . ASN 331 331 ? A 12.089 -1.905 -21.299 1.000 1 A 96.977 1 ATOM 2647 N ND2 . ASN 331 331 ? A 10.808 -0.556 -22.560 1.000 1 A 96.977 1 ATOM 2648 N N . ASP 332 332 ? A 15.357 -1.322 -21.425 1.000 1 A 97.625 1 ATOM 2649 C CA . ASP 332 332 ? A 16.200 -2.493 -21.207 1.000 1 A 97.625 1 ATOM 2650 C C . ASP 332 332 ? A 15.375 -3.777 -21.234 1.000 1 A 97.625 1 ATOM 2651 O O . ASP 332 332 ? A 15.912 -4.862 -21.467 1.000 1 A 97.625 1 ATOM 2652 C CB . ASP 332 332 ? A 16.948 -2.376 -19.877 1.000 1 A 97.625 1 ATOM 2653 C CG . ASP 332 332 ? A 18.037 -1.318 -19.899 1.000 1 A 97.625 1 ATOM 2654 O OD1 . ASP 332 332 ? A 18.424 -0.864 -20.998 1.000 1 A 97.625 1 ATOM 2655 O OD2 . ASP 332 332 ? A 18.514 -0.936 -18.809 1.000 1 A 97.625 1 ATOM 2656 N N . TYR 333 333 ? A 14.058 -3.631 -21.069 1.000 1 A 97.697 1 ATOM 2657 C CA . TYR 333 333 ? A 13.190 -4.798 -20.956 1.000 1 A 97.697 1 ATOM 2658 C C . TYR 333 333 ? A 12.186 -4.844 -22.101 1.000 1 A 97.697 1 ATOM 2659 O O . TYR 333 333 ? A 11.105 -5.422 -21.964 1.000 1 A 97.697 1 ATOM 2660 C CB . TYR 333 333 ? A 12.452 -4.791 -19.614 1.000 1 A 97.697 1 ATOM 2661 C CG . TYR 333 333 ? A 13.368 -4.703 -18.417 1.000 1 A 97.697 1 ATOM 2662 C CD1 . TYR 333 333 ? A 14.015 -5.835 -17.926 1.000 1 A 97.697 1 ATOM 2663 C CD2 . TYR 333 333 ? A 13.587 -3.489 -17.775 1.000 1 A 97.697 1 ATOM 2664 C CE1 . TYR 333 333 ? A 14.858 -5.759 -16.822 1.000 1 A 97.697 1 ATOM 2665 C CE2 . TYR 333 333 ? A 14.429 -3.401 -16.671 1.000 1 A 97.697 1 ATOM 2666 C CZ . TYR 333 333 ? A 15.059 -4.540 -16.203 1.000 1 A 97.697 1 ATOM 2667 O OH . TYR 333 333 ? A 15.893 -4.459 -15.110 1.000 1 A 97.697 1 ATOM 2668 N N . PHE 334 334 ? A 12.439 -4.148 -23.121 1.000 1 A 97.415 1 ATOM 2669 C CA . PHE 334 334 ? A 11.535 -3.895 -24.236 1.000 1 A 97.415 1 ATOM 2670 C C . PHE 334 334 ? A 10.913 -5.193 -24.735 1.000 1 A 97.415 1 ATOM 2671 O O . PHE 334 334 ? A 9.708 -5.253 -24.989 1.000 1 A 97.415 1 ATOM 2672 C CB . PHE 334 334 ? A 12.274 -3.193 -25.380 1.000 1 A 97.415 1 ATOM 2673 C CG . PHE 334 334 ? A 11.363 -2.649 -26.447 1.000 1 A 97.415 1 ATOM 2674 C CD1 . PHE 334 334 ? A 11.298 -3.250 -27.698 1.000 1 A 97.415 1 ATOM 2675 C CD2 . PHE 334 334 ? A 10.571 -1.535 -26.199 1.000 1 A 97.415 1 ATOM 2676 C CE1 . PHE 334 334 ? A 10.456 -2.748 -28.688 1.000 1 A 97.415 1 ATOM 2677 C CE2 . PHE 334 334 ? A 9.727 -1.028 -27.184 1.000 1 A 97.415 1 ATOM 2678 C CZ . PHE 334 334 ? A 9.672 -1.636 -28.427 1.000 1 A 97.415 1 ATOM 2679 N N . GLU 335 335 ? A 11.615 -6.239 -24.766 1.000 1 A 97.498 1 ATOM 2680 C CA . GLU 335 335 ? A 11.158 -7.500 -25.345 1.000 1 A 97.498 1 ATOM 2681 C C . GLU 335 335 ? A 10.133 -8.181 -24.443 1.000 1 A 97.498 1 ATOM 2682 O O . GLU 335 335 ? A 9.356 -9.021 -24.902 1.000 1 A 97.498 1 ATOM 2683 C CB . GLU 335 335 ? A 12.343 -8.436 -25.596 1.000 1 A 97.498 1 ATOM 2684 C CG . GLU 335 335 ? A 13.303 -7.940 -26.668 1.000 1 A 97.498 1 ATOM 2685 C CD . GLU 335 335 ? A 12.641 -7.746 -28.022 1.000 1 A 97.498 1 ATOM 2686 O OE1 . GLU 335 335 ? A 13.156 -6.952 -28.842 1.000 1 A 97.498 1 ATOM 2687 O OE2 . GLU 335 335 ? A 11.597 -8.392 -28.266 1.000 1 A 97.498 1 ATOM 2688 N N . TYR 336 336 ? A 10.138 -7.817 -23.213 1.000 1 A 97.253 1 ATOM 2689 C CA . TYR 336 336 ? A 9.159 -8.363 -22.280 1.000 1 A 97.253 1 ATOM 2690 C C . TYR 336 336 ? A 7.742 -7.975 -22.686 1.000 1 A 97.253 1 ATOM 2691 O O . TYR 336 336 ? A 6.776 -8.634 -22.297 1.000 1 A 97.253 1 ATOM 2692 C CB . TYR 336 336 ? A 9.445 -7.879 -20.856 1.000 1 A 97.253 1 ATOM 2693 C CG . TYR 336 336 ? A 10.484 -8.701 -20.132 1.000 1 A 97.253 1 ATOM 2694 C CD1 . TYR 336 336 ? A 10.112 -9.647 -19.180 1.000 1 A 97.253 1 ATOM 2695 C CD2 . TYR 336 336 ? A 11.839 -8.532 -20.398 1.000 1 A 97.253 1 ATOM 2696 C CE1 . TYR 336 336 ? A 11.066 -10.406 -18.509 1.000 1 A 97.253 1 ATOM 2697 C CE2 . TYR 336 336 ? A 12.801 -9.284 -19.733 1.000 1 A 97.253 1 ATOM 2698 C CZ . TYR 336 336 ? A 12.406 -10.218 -18.792 1.000 1 A 97.253 1 ATOM 2699 O OH . TYR 336 336 ? A 13.355 -10.965 -18.131 1.000 1 A 97.253 1 ATOM 2700 N N . PHE 337 337 ? A 7.604 -6.911 -23.484 1.000 1 A 97.657 1 ATOM 2701 C CA . PHE 337 337 ? A 6.294 -6.311 -23.708 1.000 1 A 97.657 1 ATOM 2702 C C . PHE 337 337 ? A 5.750 -6.695 -25.079 1.000 1 A 97.657 1 ATOM 2703 O O . PHE 337 337 ? A 4.739 -6.150 -25.526 1.000 1 A 97.657 1 ATOM 2704 C CB . PHE 337 337 ? A 6.371 -4.786 -23.582 1.000 1 A 97.657 1 ATOM 2705 C CG . PHE 337 337 ? A 6.834 -4.312 -22.231 1.000 1 A 97.657 1 ATOM 2706 C CD1 . PHE 337 337 ? A 5.961 -4.289 -21.150 1.000 1 A 97.657 1 ATOM 2707 C CD2 . PHE 337 337 ? A 8.143 -3.888 -22.042 1.000 1 A 97.657 1 ATOM 2708 C CE1 . PHE 337 337 ? A 6.387 -3.850 -19.899 1.000 1 A 97.657 1 ATOM 2709 C CE2 . PHE 337 337 ? A 8.576 -3.448 -20.794 1.000 1 A 97.657 1 ATOM 2710 C CZ . PHE 337 337 ? A 7.696 -3.429 -19.724 1.000 1 A 97.657 1 ATOM 2711 N N . GLY 338 338 ? A 6.439 -7.624 -25.787 1.000 1 A 94.678 1 ATOM 2712 C CA . GLY 338 338 ? A 5.908 -8.143 -27.037 1.000 1 A 94.678 1 ATOM 2713 C C . GLY 338 338 ? A 4.647 -8.966 -26.853 1.000 1 A 94.678 1 ATOM 2714 O O . GLY 338 338 ? A 4.333 -9.391 -25.739 1.000 1 A 94.678 1 ATOM 2715 N N . PRO 339 339 ? A 3.917 -8.944 -27.933 1.000 1 A 95.016 1 ATOM 2716 C CA . PRO 339 339 ? A 4.226 -8.502 -29.295 1.000 1 A 95.016 1 ATOM 2717 C C . PRO 339 339 ? A 3.703 -7.099 -29.594 1.000 1 A 95.016 1 ATOM 2718 O O . PRO 339 339 ? A 4.041 -6.517 -30.628 1.000 1 A 95.016 1 ATOM 2719 C CB . PRO 339 339 ? A 3.526 -9.544 -30.171 1.000 1 A 95.016 1 ATOM 2720 C CG . PRO 339 339 ? A 2.309 -9.938 -29.398 1.000 1 A 95.016 1 ATOM 2721 C CD . PRO 339 339 ? A 2.651 -9.933 -27.935 1.000 1 A 95.016 1 ATOM 2722 N N . ASP 340 340 ? A 2.918 -6.561 -28.743 1.000 1 A 94.372 1 ATOM 2723 C CA . ASP 340 340 ? A 2.209 -5.349 -29.142 1.000 1 A 94.372 1 ATOM 2724 C C . ASP 340 340 ? A 3.008 -4.100 -28.780 1.000 1 A 94.372 1 ATOM 2725 O O . ASP 340 340 ? A 2.865 -3.057 -29.421 1.000 1 A 94.372 1 ATOM 2726 C CB . ASP 340 340 ? A 0.826 -5.297 -28.489 1.000 1 A 94.372 1 ATOM 2727 C CG . ASP 340 340 ? A 0.877 -5.461 -26.980 1.000 1 A 94.372 1 ATOM 2728 O OD1 . ASP 340 340 ? A 1.920 -5.899 -26.449 1.000 1 A 94.372 1 ATOM 2729 O OD2 . ASP 340 340 ? A -0.136 -5.152 -26.316 1.000 1 A 94.372 1 ATOM 2730 N N . PHE 341 341 ? A 3.857 -4.108 -27.743 1.000 1 A 97.140 1 ATOM 2731 C CA . PHE 341 341 ? A 4.737 -3.027 -27.316 1.000 1 A 97.140 1 ATOM 2732 C C . PHE 341 341 ? A 3.938 -1.762 -27.025 1.000 1 A 97.140 1 ATOM 2733 O O . PHE 341 341 ? A 4.323 -0.668 -27.445 1.000 1 A 97.140 1 ATOM 2734 C CB . PHE 341 341 ? A 5.799 -2.744 -28.383 1.000 1 A 97.140 1 ATOM 2735 C CG . PHE 341 341 ? A 6.614 -3.950 -28.764 1.000 1 A 97.140 1 ATOM 2736 C CD1 . PHE 341 341 ? A 7.621 -4.418 -27.929 1.000 1 A 97.140 1 ATOM 2737 C CD2 . PHE 341 341 ? A 6.371 -4.618 -29.957 1.000 1 A 97.140 1 ATOM 2738 C CE1 . PHE 341 341 ? A 8.377 -5.535 -28.279 1.000 1 A 97.140 1 ATOM 2739 C CE2 . PHE 341 341 ? A 7.121 -5.734 -30.314 1.000 1 A 97.140 1 ATOM 2740 C CZ . PHE 341 341 ? A 8.125 -6.191 -29.474 1.000 1 A 97.140 1 ATOM 2741 N N . LYS 342 342 ? A 2.781 -1.948 -26.350 1.000 1 A 98.317 1 ATOM 2742 C CA . LYS 342 342 ? A 1.891 -0.867 -25.936 1.000 1 A 98.317 1 ATOM 2743 C C . LYS 342 342 ? A 1.796 -0.786 -24.415 1.000 1 A 98.317 1 ATOM 2744 O O . LYS 342 342 ? A 1.952 -1.794 -23.723 1.000 1 A 98.317 1 ATOM 2745 C CB . LYS 342 342 ? A 0.498 -1.058 -26.539 1.000 1 A 98.317 1 ATOM 2746 C CG . LYS 342 342 ? A 0.472 -1.025 -28.060 1.000 1 A 98.317 1 ATOM 2747 C CD . LYS 342 342 ? A 0.798 0.364 -28.595 1.000 1 A 98.317 1 ATOM 2748 C CE . LYS 342 342 ? A 0.677 0.422 -30.112 1.000 1 A 98.317 1 ATOM 2749 N NZ . LYS 342 342 ? A 1.046 1.767 -30.645 1.000 1 A 98.317 1 ATOM 2750 N N . LEU 343 343 ? A 1.543 0.434 -23.954 1.000 1 A 98.515 1 ATOM 2751 C CA . LEU 343 343 ? A 1.384 0.642 -22.519 1.000 1 A 98.515 1 ATOM 2752 C C . LEU 343 343 ? A 0.062 0.061 -22.029 1.000 1 A 98.515 1 ATOM 2753 O O . LEU 343 343 ? A 0.022 -0.625 -21.005 1.000 1 A 98.515 1 ATOM 2754 C CB . LEU 343 343 ? A 1.455 2.134 -22.182 1.000 1 A 98.515 1 ATOM 2755 C CG . LEU 343 343 ? A 1.332 2.501 -20.703 1.000 1 A 98.515 1 ATOM 2756 C CD1 . LEU 343 343 ? A 2.505 1.929 -19.915 1.000 1 A 98.515 1 ATOM 2757 C CD2 . LEU 343 343 ? A 1.254 4.015 -20.532 1.000 1 A 98.515 1 ATOM 2758 N N . HIS 344 344 ? A -0.958 0.250 -22.772 1.000 1 A 98.358 1 ATOM 2759 C CA . HIS 344 344 ? A -2.302 -0.126 -22.348 1.000 1 A 98.358 1 ATOM 2760 C C . HIS 344 344 ? A -2.656 -1.532 -22.821 1.000 1 A 98.358 1 ATOM 2761 O O . HIS 344 344 ? A -2.195 -1.971 -23.877 1.000 1 A 98.358 1 ATOM 2762 C CB . HIS 344 344 ? A -3.330 0.878 -22.874 1.000 1 A 98.358 1 ATOM 2763 C CG . HIS 344 344 ? A -3.160 2.257 -22.318 1.000 1 A 98.358 1 ATOM 2764 N ND1 . HIS 344 344 ? A -3.292 2.540 -20.976 1.000 1 A 98.358 1 ATOM 2765 C CD2 . HIS 344 344 ? A -2.866 3.430 -22.927 1.000 1 A 98.358 1 ATOM 2766 C CE1 . HIS 344 344 ? A -3.086 3.832 -20.783 1.000 1 A 98.358 1 ATOM 2767 N NE2 . HIS 344 344 ? A -2.826 4.395 -21.950 1.000 1 A 98.358 1 ATOM 2768 N N . ILE 345 345 ? A -3.418 -2.234 -21.921 1.000 1 A 97.398 1 ATOM 2769 C CA . ILE 345 345 ? A -3.874 -3.588 -22.219 1.000 1 A 97.398 1 ATOM 2770 C C . ILE 345 345 ? A -5.378 -3.578 -22.485 1.000 1 A 97.398 1 ATOM 2771 O O . ILE 345 345 ? A -6.079 -2.646 -22.086 1.000 1 A 97.398 1 ATOM 2772 C CB . ILE 345 345 ? A -3.539 -4.563 -21.068 1.000 1 A 97.398 1 ATOM 2773 C CG1 . ILE 345 345 ? A -4.206 -4.101 -19.766 1.000 1 A 97.398 1 ATOM 2774 C CG2 . ILE 345 345 ? A -2.023 -4.690 -20.892 1.000 1 A 97.398 1 ATOM 2775 C CD1 . ILE 345 345 ? A -4.008 -5.057 -18.597 1.000 1 A 97.398 1 ATOM 2776 N N . SER 346 346 ? A -5.793 -4.622 -23.213 1.000 1 A 96.463 1 ATOM 2777 C CA . SER 346 346 ? A -7.209 -4.744 -23.540 1.000 1 A 96.463 1 ATOM 2778 C C . SER 346 346 ? A -7.932 -5.641 -22.541 1.000 1 A 96.463 1 ATOM 2779 O O . SER 346 346 ? A -7.343 -6.581 -22.004 1.000 1 A 96.463 1 ATOM 2780 C CB . SER 346 346 ? A -7.387 -5.296 -24.955 1.000 1 A 96.463 1 ATOM 2781 O OG . SER 346 346 ? A -6.832 -4.411 -25.914 1.000 1 A 96.463 1 ATOM 2782 N N . PRO 347 347 ? A -9.153 -5.270 -22.282 1.000 1 A 96.221 1 ATOM 2783 C CA . PRO 347 347 ? A -9.932 -6.198 -21.458 1.000 1 A 96.221 1 ATOM 2784 C C . PRO 347 347 ? A -10.122 -7.560 -22.122 1.000 1 A 96.221 1 ATOM 2785 O O . PRO 347 347 ? A -10.064 -7.666 -23.350 1.000 1 A 96.221 1 ATOM 2786 C CB . PRO 347 347 ? A -11.274 -5.480 -21.292 1.000 1 A 96.221 1 ATOM 2787 C CG . PRO 347 347 ? A -11.364 -4.561 -22.468 1.000 1 A 96.221 1 ATOM 2788 C CD . PRO 347 347 ? A -9.973 -4.165 -22.872 1.000 1 A 96.221 1 ATOM 2789 N N . SER 348 348 ? A -10.311 -8.675 -21.308 1.000 1 A 95.407 1 ATOM 2790 C CA . SER 348 348 ? A -10.601 -10.006 -21.833 1.000 1 A 95.407 1 ATOM 2791 C C . SER 348 348 ? A -12.097 -10.195 -22.062 1.000 1 A 95.407 1 ATOM 2792 O O . SER 348 348 ? A -12.893 -9.302 -21.767 1.000 1 A 95.407 1 ATOM 2793 C CB . SER 348 348 ? A -10.082 -11.083 -20.880 1.000 1 A 95.407 1 ATOM 2794 O OG . SER 348 348 ? A -10.910 -11.182 -19.734 1.000 1 A 95.407 1 ATOM 2795 N N . ASN 349 349 ? A -12.522 -11.293 -22.689 1.000 1 A 95.610 1 ATOM 2796 C CA . ASN 349 349 ? A -13.928 -11.594 -22.935 1.000 1 A 95.610 1 ATOM 2797 C C . ASN 349 349 ? A -14.567 -12.299 -21.741 1.000 1 A 95.610 1 ATOM 2798 O O . ASN 349 349 ? A -15.635 -12.900 -21.869 1.000 1 A 95.610 1 ATOM 2799 C CB . ASN 349 349 ? A -14.082 -12.444 -24.198 1.000 1 A 95.610 1 ATOM 2800 C CG . ASN 349 349 ? A -13.356 -13.772 -24.101 1.000 1 A 95.610 1 ATOM 2801 O OD1 . ASN 349 349 ? A -12.590 -14.007 -23.162 1.000 1 A 95.610 1 ATOM 2802 N ND2 . ASN 349 349 ? A -13.592 -14.649 -25.069 1.000 1 A 95.610 1 ATOM 2803 N N . MET 350 350 ? A -13.945 -12.231 -20.555 1.000 1 A 96.297 1 ATOM 2804 C CA . MET 350 350 ? A -14.476 -12.844 -19.340 1.000 1 A 96.297 1 ATOM 2805 C C . MET 350 350 ? A -15.808 -12.213 -18.950 1.000 1 A 96.297 1 ATOM 2806 O O . MET 350 350 ? A -15.977 -10.997 -19.049 1.000 1 A 96.297 1 ATOM 2807 C CB . MET 350 350 ? A -13.477 -12.709 -18.190 1.000 1 A 96.297 1 ATOM 2808 C CG . MET 350 350 ? A -13.900 -13.436 -16.923 1.000 1 A 96.297 1 ATOM 2809 S SD . MET 350 350 ? A -12.653 -13.296 -15.583 1.000 1 A 96.297 1 ATOM 2810 C CE . MET 350 350 ? A -13.201 -14.641 -14.495 1.000 1 A 96.297 1 ATOM 2811 N N . THR 351 351 ? A -16.746 -13.033 -18.537 1.000 1 A 97.617 1 ATOM 2812 C CA . THR 351 351 ? A -18.058 -12.565 -18.104 1.000 1 A 97.617 1 ATOM 2813 C C . THR 351 351 ? A -17.959 -11.844 -16.763 1.000 1 A 97.617 1 ATOM 2814 O O . THR 351 351 ? A -17.324 -12.341 -15.830 1.000 1 A 97.617 1 ATOM 2815 C CB . THR 351 351 ? A -19.057 -13.732 -17.990 1.000 1 A 97.617 1 ATOM 2816 O OG1 . THR 351 351 ? A -19.167 -14.385 -19.260 1.000 1 A 97.617 1 ATOM 2817 C CG2 . THR 351 351 ? A -20.435 -13.235 -17.565 1.000 1 A 97.617 1 ATOM 2818 N N . ASN 352 352 ? A -18.546 -10.668 -16.744 1.000 1 A 98.337 1 ATOM 2819 C CA . ASN 352 352 ? A -18.654 -9.936 -15.487 1.000 1 A 98.337 1 ATOM 2820 C C . ASN 352 352 ? A -19.732 -10.528 -14.584 1.000 1 A 98.337 1 ATOM 2821 O O . ASN 352 352 ? A -20.925 -10.384 -14.857 1.000 1 A 98.337 1 ATOM 2822 C CB . ASN 352 352 ? A -18.937 -8.455 -15.751 1.000 1 A 98.337 1 ATOM 2823 C CG . ASN 352 352 ? A -18.837 -7.609 -14.498 1.000 1 A 98.337 1 ATOM 2824 O OD1 . ASN 352 352 ? A -18.815 -8.132 -13.381 1.000 1 A 98.337 1 ATOM 2825 N ND2 . ASN 352 352 ? A -18.776 -6.294 -14.673 1.000 1 A 98.337 1 ATOM 2826 N N . GLN 353 353 ? A -19.315 -11.189 -13.445 1.000 1 A 98.133 1 ATOM 2827 C CA . GLN 353 353 ? A -20.244 -11.882 -12.559 1.000 1 A 98.133 1 ATOM 2828 C C . GLN 353 353 ? A -20.794 -10.938 -11.493 1.000 1 A 98.133 1 ATOM 2829 O O . GLN 353 353 ? A -21.412 -11.382 -10.523 1.000 1 A 98.133 1 ATOM 2830 C CB . GLN 353 353 ? A -19.562 -13.081 -11.898 1.000 1 A 98.133 1 ATOM 2831 C CG . GLN 353 353 ? A -19.058 -14.124 -12.886 1.000 1 A 98.133 1 ATOM 2832 C CD . GLN 353 353 ? A -20.183 -14.888 -13.558 1.000 1 A 98.133 1 ATOM 2833 O OE1 . GLN 353 353 ? A -21.149 -14.293 -14.049 1.000 1 A 98.133 1 ATOM 2834 N NE2 . GLN 353 353 ? A -20.068 -16.211 -13.586 1.000 1 A 98.133 1 ATOM 2835 N N . ASN 354 354 ? A -20.546 -9.679 -11.650 1.000 1 A 98.190 1 ATOM 2836 C CA . ASN 354 354 ? A -21.007 -8.644 -10.731 1.000 1 A 98.190 1 ATOM 2837 C C . ASN 354 354 ? A -22.240 -7.924 -11.269 1.000 1 A 98.190 1 ATOM 2838 O O . ASN 354 354 ? A -22.141 -6.801 -11.767 1.000 1 A 98.190 1 ATOM 2839 C CB . ASN 354 354 ? A -19.887 -7.640 -10.449 1.000 1 A 98.190 1 ATOM 2840 C CG . ASN 354 354 ? A -18.656 -8.291 -9.849 1.000 1 A 98.190 1 ATOM 2841 O OD1 . ASN 354 354 ? A -18.541 -8.421 -8.628 1.000 1 A 98.190 1 ATOM 2842 N ND2 . ASN 354 354 ? A -17.728 -8.705 -10.703 1.000 1 A 98.190 1 ATOM 2843 N N . THR 355 355 ? A -23.400 -8.548 -11.087 1.000 1 A 98.166 1 ATOM 2844 C CA . THR 355 355 ? A -24.628 -7.947 -11.596 1.000 1 A 98.166 1 ATOM 2845 C C . THR 355 355 ? A -24.898 -6.608 -10.917 1.000 1 A 98.166 1 ATOM 2846 O O . THR 355 355 ? A -24.464 -6.381 -9.785 1.000 1 A 98.166 1 ATOM 2847 C CB . THR 355 355 ? A -25.834 -8.882 -11.391 1.000 1 A 98.166 1 ATOM 2848 O OG1 . THR 355 355 ? A -26.043 -9.082 -9.987 1.000 1 A 98.166 1 ATOM 2849 C CG2 . THR 355 355 ? A -25.601 -10.235 -12.055 1.000 1 A 98.166 1 ATOM 2850 N N . ASN 356 356 ? A -25.521 -5.732 -11.560 1.000 1 A 98.041 1 ATOM 2851 C CA . ASN 356 356 ? A -25.903 -4.446 -10.987 1.000 1 A 98.041 1 ATOM 2852 C C . ASN 356 356 ? A -26.675 -4.621 -9.682 1.000 1 A 98.041 1 ATOM 2853 O O . ASN 356 356 ? A -26.477 -3.861 -8.732 1.000 1 A 98.041 1 ATOM 2854 C CB . ASN 356 356 ? A -26.729 -3.636 -11.989 1.000 1 A 98.041 1 ATOM 2855 C CG . ASN 356 356 ? A -25.882 -3.034 -13.092 1.000 1 A 98.041 1 ATOM 2856 O OD1 . ASN 356 356 ? A -24.689 -2.780 -12.907 1.000 1 A 98.041 1 ATOM 2857 N ND2 . ASN 356 356 ? A -26.492 -2.801 -14.248 1.000 1 A 98.041 1 ATOM 2858 N N . GLU 357 357 ? A -27.571 -5.586 -9.696 1.000 1 A 98.376 1 ATOM 2859 C CA . GLU 357 357 ? A -28.349 -5.876 -8.495 1.000 1 A 98.376 1 ATOM 2860 C C . GLU 357 357 ? A -27.441 -6.239 -7.324 1.000 1 A 98.376 1 ATOM 2861 O O . GLU 357 357 ? A -27.612 -5.726 -6.216 1.000 1 A 98.376 1 ATOM 2862 C CB . GLU 357 357 ? A -29.345 -7.009 -8.759 1.000 1 A 98.376 1 ATOM 2863 C CG . GLU 357 357 ? A -30.451 -6.639 -9.738 1.000 1 A 98.376 1 ATOM 2864 C CD . GLU 357 357 ? A -30.030 -6.764 -11.193 1.000 1 A 98.376 1 ATOM 2865 O OE1 . GLU 357 357 ? A -30.734 -6.225 -12.077 1.000 1 A 98.376 1 ATOM 2866 O OE2 . GLU 357 357 ? A -28.988 -7.408 -11.452 1.000 1 A 98.376 1 ATOM 2867 N N . TYR 358 358 ? A -26.478 -7.140 -7.568 1.000 1 A 98.345 1 ATOM 2868 C CA . TYR 358 358 ? A -25.528 -7.558 -6.544 1.000 1 A 98.345 1 ATOM 2869 C C . TYR 358 358 ? A -24.718 -6.371 -6.035 1.000 1 A 98.345 1 ATOM 2870 O O . TYR 358 358 ? A -24.618 -6.153 -4.825 1.000 1 A 98.345 1 ATOM 2871 C CB . TYR 358 358 ? A -24.587 -8.636 -7.091 1.000 1 A 98.345 1 ATOM 2872 C CG . TYR 358 358 ? A -23.458 -8.988 -6.154 1.000 1 A 98.345 1 ATOM 2873 C CD1 . TYR 358 358 ? A -22.154 -8.570 -6.415 1.000 1 A 98.345 1 ATOM 2874 C CD2 . TYR 358 358 ? A -23.690 -9.739 -5.007 1.000 1 A 98.345 1 ATOM 2875 C CE1 . TYR 358 358 ? A -21.110 -8.894 -5.555 1.000 1 A 98.345 1 ATOM 2876 C CE2 . TYR 358 358 ? A -22.654 -10.069 -4.140 1.000 1 A 98.345 1 ATOM 2877 C CZ . TYR 358 358 ? A -21.369 -9.642 -4.422 1.000 1 A 98.345 1 ATOM 2878 O OH . TYR 358 358 ? A -20.339 -9.966 -3.568 1.000 1 A 98.345 1 ATOM 2879 N N . LEU 359 359 ? A -24.180 -5.569 -6.926 1.000 1 A 98.632 1 ATOM 2880 C CA . LEU 359 359 ? A -23.343 -4.426 -6.580 1.000 1 A 98.632 1 ATOM 2881 C C . LEU 359 359 ? A -24.138 -3.386 -5.798 1.000 1 A 98.632 1 ATOM 2882 O O . LEU 359 359 ? A -23.644 -2.832 -4.813 1.000 1 A 98.632 1 ATOM 2883 C CB . LEU 359 359 ? A -22.755 -3.791 -7.843 1.000 1 A 98.632 1 ATOM 2884 C CG . LEU 359 359 ? A -21.782 -4.656 -8.647 1.000 1 A 98.632 1 ATOM 2885 C CD1 . LEU 359 359 ? A -21.318 -3.913 -9.895 1.000 1 A 98.632 1 ATOM 2886 C CD2 . LEU 359 359 ? A -20.591 -5.062 -7.786 1.000 1 A 98.632 1 ATOM 2887 N N . GLU 360 360 ? A -25.305 -3.155 -6.177 1.000 1 A 98.386 1 ATOM 2888 C CA . GLU 360 360 ? A -26.163 -2.179 -5.512 1.000 1 A 98.386 1 ATOM 2889 C C . GLU 360 360 ? A -26.524 -2.632 -4.100 1.000 1 A 98.386 1 ATOM 2890 O O . GLU 360 360 ? A -26.578 -1.818 -3.176 1.000 1 A 98.386 1 ATOM 2891 C CB . GLU 360 360 ? A -27.435 -1.938 -6.328 1.000 1 A 98.386 1 ATOM 2892 C CG . GLU 360 360 ? A -27.218 -1.082 -7.568 1.000 1 A 98.386 1 ATOM 2893 C CD . GLU 360 360 ? A -26.579 0.264 -7.263 1.000 1 A 98.386 1 ATOM 2894 O OE1 . GLU 360 360 ? A -25.661 0.682 -8.005 1.000 1 A 98.386 1 ATOM 2895 O OE2 . GLU 360 360 ? A -27.001 0.905 -6.275 1.000 1 A 98.386 1 ATOM 2896 N N . LYS 361 361 ? A -26.805 -3.872 -3.961 1.000 1 A 98.372 1 ATOM 2897 C CA . LYS 361 361 ? A -27.114 -4.422 -2.645 1.000 1 A 98.372 1 ATOM 2898 C C . LYS 361 361 ? A -25.952 -4.219 -1.677 1.000 1 A 98.372 1 ATOM 2899 O O . LYS 361 361 ? A -26.154 -3.803 -0.534 1.000 1 A 98.372 1 ATOM 2900 C CB . LYS 361 361 ? A -27.454 -5.910 -2.751 1.000 1 A 98.372 1 ATOM 2901 C CG . LYS 361 361 ? A -27.889 -6.541 -1.437 1.000 1 A 98.372 1 ATOM 2902 C CD . LYS 361 361 ? A -28.251 -8.009 -1.614 1.000 1 A 98.372 1 ATOM 2903 C CE . LYS 361 361 ? A -28.609 -8.663 -0.286 1.000 1 A 98.372 1 ATOM 2904 N NZ . LYS 361 361 ? A -28.979 -10.100 -0.458 1.000 1 A 98.372 1 ATOM 2905 N N . ILE 362 362 ? A -24.763 -4.533 -2.085 1.000 1 A 98.483 1 ATOM 2906 C CA . ILE 362 362 ? A -23.575 -4.364 -1.254 1.000 1 A 98.483 1 ATOM 2907 C C . ILE 362 362 ? A -23.373 -2.884 -0.938 1.000 1 A 98.483 1 ATOM 2908 O O . ILE 362 362 ? A -23.120 -2.518 0.213 1.000 1 A 98.483 1 ATOM 2909 C CB . ILE 362 362 ? A -22.318 -4.942 -1.942 1.000 1 A 98.483 1 ATOM 2910 C CG1 . ILE 362 362 ? A -22.494 -6.442 -2.203 1.000 1 A 98.483 1 ATOM 2911 C CG2 . ILE 362 362 ? A -21.069 -4.675 -1.097 1.000 1 A 98.483 1 ATOM 2912 C CD1 . ILE 362 362 ? A -22.731 -7.265 -0.944 1.000 1 A 98.483 1 ATOM 2913 N N . LYS 363 363 ? A -23.455 -2.029 -1.967 1.000 1 A 98.475 1 ATOM 2914 C CA . LYS 363 363 ? A -23.292 -0.588 -1.800 1.000 1 A 98.475 1 ATOM 2915 C C . LYS 363 363 ? A -24.272 -0.040 -0.766 1.000 1 A 98.475 1 ATOM 2916 O O . LYS 363 363 ? A -23.889 0.744 0.105 1.000 1 A 98.475 1 ATOM 2917 C CB . LYS 363 363 ? A -23.483 0.133 -3.135 1.000 1 A 98.475 1 ATOM 2918 C CG . LYS 363 363 ? A -23.206 1.628 -3.077 1.000 1 A 98.475 1 ATOM 2919 C CD . LYS 363 363 ? A -23.353 2.278 -4.447 1.000 1 A 98.475 1 ATOM 2920 C CE . LYS 363 363 ? A -24.793 2.228 -4.938 1.000 1 A 98.475 1 ATOM 2921 N NZ . LYS 363 363 ? A -24.944 2.873 -6.277 1.000 1 A 98.475 1 ATOM 2922 N N . GLN 364 364 ? A -25.529 -0.422 -0.821 1.000 1 A 98.257 1 ATOM 2923 C CA . GLN 364 364 ? A -26.549 0.038 0.114 1.000 1 A 98.257 1 ATOM 2924 C C . GLN 364 364 ? A -26.200 -0.355 1.547 1.000 1 A 98.257 1 ATOM 2925 O O . GLN 364 364 ? A -26.327 0.456 2.467 1.000 1 A 98.257 1 ATOM 2926 C CB . GLN 364 364 ? A -27.920 -0.526 -0.265 1.000 1 A 98.257 1 ATOM 2927 C CG . GLN 364 364 ? A -28.518 0.103 -1.516 1.000 1 A 98.257 1 ATOM 2928 C CD . GLN 364 364 ? A -29.825 -0.547 -1.932 1.000 1 A 98.257 1 ATOM 2929 O OE1 . GLN 364 364 ? A -30.286 -1.504 -1.302 1.000 1 A 98.257 1 ATOM 2930 N NE2 . GLN 364 364 ? A -30.430 -0.033 -2.998 1.000 1 A 98.257 1 ATOM 2931 N N . ARG 365 365 ? A -25.790 -1.529 1.701 1.000 1 A 98.301 1 ATOM 2932 C CA . ARG 365 365 ? A -25.397 -1.998 3.026 1.000 1 A 98.301 1 ATOM 2933 C C . ARG 365 365 ? A -24.222 -1.191 3.566 1.000 1 A 98.301 1 ATOM 2934 O O . ARG 365 365 ? A -24.205 -0.819 4.742 1.000 1 A 98.301 1 ATOM 2935 C CB . ARG 365 365 ? A -25.038 -3.485 2.985 1.000 1 A 98.301 1 ATOM 2936 C CG . ARG 365 365 ? A -24.622 -4.055 4.332 1.000 1 A 98.301 1 ATOM 2937 C CD . ARG 365 365 ? A -25.782 -4.075 5.318 1.000 1 A 98.301 1 ATOM 2938 N NE . ARG 365 365 ? A -25.411 -4.723 6.573 1.000 1 A 98.301 1 ATOM 2939 C CZ . ARG 365 365 ? A -26.162 -4.734 7.671 1.000 1 A 98.301 1 ATOM 2940 N NH1 . ARG 365 365 ? A -27.344 -4.129 7.690 1.000 1 A 98.301 1 ATOM 2941 N NH2 . ARG 365 365 ? A -25.727 -5.354 8.759 1.000 1 A 98.301 1 ATOM 2942 N N . LEU 366 366 ? A -23.236 -0.976 2.721 1.000 1 A 98.498 1 ATOM 2943 C CA . LEU 366 366 ? A -22.070 -0.202 3.133 1.000 1 A 98.498 1 ATOM 2944 C C . LEU 366 366 ? A -22.466 1.222 3.506 1.000 1 A 98.498 1 ATOM 2945 O O . LEU 366 366 ? A -21.981 1.765 4.501 1.000 1 A 98.498 1 ATOM 2946 C CB . LEU 366 366 ? A -21.022 -0.176 2.017 1.000 1 A 98.498 1 ATOM 2947 C CG . LEU 366 366 ? A -20.292 -1.492 1.742 1.000 1 A 98.498 1 ATOM 2948 C CD1 . LEU 366 366 ? A -19.281 -1.311 0.615 1.000 1 A 98.498 1 ATOM 2949 C CD2 . LEU 366 366 ? A -19.605 -1.997 3.007 1.000 1 A 98.498 1 ATOM 2950 N N . PHE 367 367 ? A -23.372 1.822 2.760 1.000 1 A 98.479 1 ATOM 2951 C CA . PHE 367 367 ? A -23.856 3.162 3.069 1.000 1 A 98.479 1 ATOM 2952 C C . PHE 367 367 ? A -24.551 3.188 4.425 1.000 1 A 98.479 1 ATOM 2953 O O . PHE 367 367 ? A -24.391 4.139 5.192 1.000 1 A 98.479 1 ATOM 2954 C CB . PHE 367 367 ? A -24.814 3.654 1.979 1.000 1 A 98.479 1 ATOM 2955 C CG . PHE 367 367 ? A -24.119 4.256 0.787 1.000 1 A 98.479 1 ATOM 2956 C CD1 . PHE 367 367 ? A -22.792 3.951 0.511 1.000 1 A 98.479 1 ATOM 2957 C CD2 . PHE 367 367 ? A -24.794 5.128 -0.057 1.000 1 A 98.479 1 ATOM 2958 C CE1 . PHE 367 367 ? A -22.147 4.507 -0.591 1.000 1 A 98.479 1 ATOM 2959 C CE2 . PHE 367 367 ? A -24.156 5.688 -1.160 1.000 1 A 98.479 1 ATOM 2960 C CZ . PHE 367 367 ? A -22.832 5.377 -1.425 1.000 1 A 98.479 1 ATOM 2961 N N . GLU 368 368 ? A -25.253 2.138 4.734 1.000 1 A 97.655 1 ATOM 2962 C CA . GLU 368 368 ? A -25.901 2.038 6.038 1.000 1 A 97.655 1 ATOM 2963 C C . GLU 368 368 ? A -24.871 1.954 7.161 1.000 1 A 97.655 1 ATOM 2964 O O . GLU 368 368 ? A -25.022 2.602 8.198 1.000 1 A 97.655 1 ATOM 2965 C CB . GLU 368 368 ? A -26.830 0.822 6.085 1.000 1 A 97.655 1 ATOM 2966 C CG . GLU 368 368 ? A -28.078 0.968 5.226 1.000 1 A 97.655 1 ATOM 2967 C CD . GLU 368 368 ? A -28.899 -0.308 5.138 1.000 1 A 97.655 1 ATOM 2968 O OE1 . GLU 368 368 ? A -29.910 -0.330 4.400 1.000 1 A 97.655 1 ATOM 2969 O OE2 . GLU 368 368 ? A -28.528 -1.295 5.813 1.000 1 A 97.655 1 ATOM 2970 N N . ASN 369 369 ? A -23.902 1.168 6.903 1.000 1 A 97.620 1 ATOM 2971 C CA . ASN 369 369 ? A -22.835 1.069 7.894 1.000 1 A 97.620 1 ATOM 2972 C C . ASN 369 369 ? A -22.160 2.418 8.126 1.000 1 A 97.620 1 ATOM 2973 O O . ASN 369 369 ? A -21.932 2.813 9.271 1.000 1 A 97.620 1 ATOM 2974 C CB . ASN 369 369 ? A -21.803 0.024 7.467 1.000 1 A 97.620 1 ATOM 2975 C CG . ASN 369 369 ? A -22.327 -1.394 7.576 1.000 1 A 97.620 1 ATOM 2976 O OD1 . ASN 369 369 ? A -23.376 -1.636 8.179 1.000 1 A 97.620 1 ATOM 2977 N ND2 . ASN 369 369 ? A -21.602 -2.341 6.994 1.000 1 A 97.620 1 ATOM 2978 N N . LEU 370 370 ? A -21.833 3.108 7.035 1.000 1 A 97.075 1 ATOM 2979 C CA . LEU 370 370 ? A -21.098 4.366 7.108 1.000 1 A 97.075 1 ATOM 2980 C C . LEU 370 370 ? A -21.923 5.437 7.815 1.000 1 A 97.075 1 ATOM 2981 O O . LEU 370 370 ? A -21.366 6.349 8.431 1.000 1 A 97.075 1 ATOM 2982 C CB . LEU 370 370 ? A -20.713 4.844 5.706 1.000 1 A 97.075 1 ATOM 2983 C CG . LEU 370 370 ? A -19.573 4.089 5.021 1.000 1 A 97.075 1 ATOM 2984 C CD1 . LEU 370 370 ? A -19.483 4.484 3.551 1.000 1 A 97.075 1 ATOM 2985 C CD2 . LEU 370 370 ? A -18.251 4.354 5.733 1.000 1 A 97.075 1 ATOM 2986 N N . ARG 371 371 ? A -23.234 5.308 7.831 1.000 1 A 94.784 1 ATOM 2987 C CA . ARG 371 371 ? A -24.118 6.249 8.512 1.000 1 A 94.784 1 ATOM 2988 C C . ARG 371 371 ? A -24.000 6.113 10.026 1.000 1 A 94.784 1 ATOM 2989 O O . ARG 371 371 ? A -24.371 7.025 10.768 1.000 1 A 94.784 1 ATOM 2990 C CB . ARG 371 371 ? A -25.570 6.033 8.079 1.000 1 A 94.784 1 ATOM 2991 C CG . ARG 371 371 ? A -25.857 6.469 6.651 1.000 1 A 94.784 1 ATOM 2992 C CD . ARG 371 371 ? A -27.310 6.224 6.268 1.000 1 A 94.784 1 ATOM 2993 N NE . ARG 371 371 ? A -27.584 6.641 4.896 1.000 1 A 94.784 1 ATOM 2994 C CZ . ARG 371 371 ? A -28.759 6.515 4.285 1.000 1 A 94.784 1 ATOM 2995 N NH1 . ARG 371 371 ? A -29.797 5.979 4.917 1.000 1 A 94.784 1 ATOM 2996 N NH2 . ARG 371 371 ? A -28.898 6.927 3.034 1.000 1 A 94.784 1 ATOM 2997 N N . MET 372 372 ? A -23.425 4.992 10.405 1.000 1 A 94.767 1 ATOM 2998 C CA . MET 372 372 ? A -23.340 4.711 11.836 1.000 1 A 94.767 1 ATOM 2999 C C . MET 372 372 ? A -22.141 5.418 12.459 1.000 1 A 94.767 1 ATOM 3000 O O . MET 372 372 ? A -22.010 5.466 13.683 1.000 1 A 94.767 1 ATOM 3001 C CB . MET 372 372 ? A -23.246 3.205 12.084 1.000 1 A 94.767 1 ATOM 3002 C CG . MET 372 372 ? A -24.470 2.430 11.623 1.000 1 A 94.767 1 ATOM 3003 S SD . MET 372 372 ? A -26.011 2.999 12.440 1.000 1 A 94.767 1 ATOM 3004 C CE . MET 372 372 ? A -25.700 2.438 14.137 1.000 1 A 94.767 1 ATOM 3005 N N . LEU 373 373 ? A -21.247 5.942 11.583 1.000 1 A 92.471 1 ATOM 3006 C CA . LEU 373 373 ? A -20.085 6.656 12.101 1.000 1 A 92.471 1 ATOM 3007 C C . LEU 373 373 ? A -20.505 7.948 12.794 1.000 1 A 92.471 1 ATOM 3008 O O . LEU 373 373 ? A -21.424 8.632 12.339 1.000 1 A 92.471 1 ATOM 3009 C CB . LEU 373 373 ? A -19.099 6.967 10.971 1.000 1 A 92.471 1 ATOM 3010 C CG . LEU 373 373 ? A -18.427 5.764 10.307 1.000 1 A 92.471 1 ATOM 3011 C CD1 . LEU 373 373 ? A -17.562 6.219 9.137 1.000 1 A 92.471 1 ATOM 3012 C CD2 . LEU 373 373 ? A -17.596 4.987 11.323 1.000 1 A 92.471 1 ATOM 3013 N N . PRO 374 374 ? A -19.989 8.143 14.017 1.000 1 A 83.969 1 ATOM 3014 C CA . PRO 374 374 ? A -20.328 9.420 14.649 1.000 1 A 83.969 1 ATOM 3015 C C . PRO 374 374 ? A -19.995 10.621 13.767 1.000 1 A 83.969 1 ATOM 3016 O O . PRO 374 374 ? A -19.047 10.569 12.979 1.000 1 A 83.969 1 ATOM 3017 C CB . PRO 374 374 ? A -19.474 9.422 15.920 1.000 1 A 83.969 1 ATOM 3018 C CG . PRO 374 374 ? A -18.380 8.442 15.646 1.000 1 A 83.969 1 ATOM 3019 C CD . PRO 374 374 ? A -18.838 7.505 14.566 1.000 1 A 83.969 1 ATOM 3020 N N . HIS 375 375 ? A -20.891 11.495 13.469 1.000 1 A 68.844 1 ATOM 3021 C CA . HIS 375 375 ? A -20.606 12.748 12.779 1.000 1 A 68.844 1 ATOM 3022 C C . HIS 375 375 ? A -19.336 13.398 13.317 1.000 1 A 68.844 1 ATOM 3023 O O . HIS 375 375 ? A -19.029 13.280 14.506 1.000 1 A 68.844 1 ATOM 3024 C CB . HIS 375 375 ? A -21.786 13.713 12.912 1.000 1 A 68.844 1 ATOM 3025 C CG . HIS 375 375 ? A -22.967 13.335 12.076 1.000 1 A 68.844 1 ATOM 3026 N ND1 . HIS 375 375 ? A -23.909 12.419 12.491 1.000 1 A 68.844 1 ATOM 3027 C CD2 . HIS 375 375 ? A -23.359 13.753 10.849 1.000 1 A 68.844 1 ATOM 3028 C CE1 . HIS 375 375 ? A -24.832 12.289 11.552 1.000 1 A 68.844 1 ATOM 3029 N NE2 . HIS 375 375 ? A -24.521 13.088 10.545 1.000 1 A 68.844 1 ATOM 3030 N N . ALA 376 376 ? A -18.201 13.279 12.523 1.000 1 A 55.062 1 ATOM 3031 C CA . ALA 376 376 ? A -16.901 13.888 12.791 1.000 1 A 55.062 1 ATOM 3032 C C . ALA 376 376 ? A -16.889 14.581 14.150 1.000 1 A 55.062 1 ATOM 3033 O O . ALA 376 376 ? A -17.741 15.427 14.430 1.000 1 A 55.062 1 ATOM 3034 C CB . ALA 376 376 ? A -16.541 14.880 11.688 1.000 1 A 55.062 1 ATOM 3035 N N . PRO 377 377 ? A -16.496 13.882 15.378 1.000 1 A 52.677 1 ATOM 3036 C CA . PRO 377 377 ? A -16.364 14.749 16.552 1.000 1 A 52.677 1 ATOM 3037 C C . PRO 377 377 ? A -15.483 15.968 16.290 1.000 1 A 52.677 1 ATOM 3038 O O . PRO 377 377 ? A -14.495 15.874 15.557 1.000 1 A 52.677 1 ATOM 3039 C CB . PRO 377 377 ? A -15.728 13.830 17.598 1.000 1 A 52.677 1 ATOM 3040 C CG . PRO 377 377 ? A -15.390 12.579 16.854 1.000 1 A 52.677 1 ATOM 3041 C CD . PRO 377 377 ? A -15.858 12.728 15.434 1.000 1 A 52.677 1 ATOM 3042 N N . GLY 378 378 ? A -15.894 17.082 15.666 1.000 1 A 45.669 1 ATOM 3043 C CA . GLY 378 378 ? A -15.366 18.376 16.068 1.000 1 A 45.669 1 ATOM 3044 C C . GLY 378 378 ? A -14.285 18.277 17.127 1.000 1 A 45.669 1 ATOM 3045 O O . GLY 378 378 ? A -14.341 17.406 17.998 1.000 1 A 45.669 1 ATOM 3046 N N . VAL 379 379 ? A -13.009 17.647 16.890 1.000 1 A 43.317 1 ATOM 3047 C CA . VAL 379 379 ? A -11.739 18.029 17.499 1.000 1 A 43.317 1 ATOM 3048 C C . VAL 379 379 ? A -11.457 17.139 18.707 1.000 1 A 43.317 1 ATOM 3049 O O . VAL 379 379 ? A -12.205 17.159 19.688 1.000 1 A 43.317 1 ATOM 3050 C CB . VAL 379 379 ? A -11.736 19.516 17.919 1.000 1 A 43.317 1 ATOM 3051 C CG1 . VAL 379 379 ? A -10.367 19.919 18.465 1.000 1 A 43.317 1 ATOM 3052 C CG2 . VAL 379 379 ? A -12.128 20.404 16.740 1.000 1 A 43.317 1 ATOM 3053 N N . GLN 380 380 ? A -11.282 15.818 18.705 1.000 1 A 44.006 1 ATOM 3054 C CA . GLN 380 380 ? A -10.538 15.254 19.826 1.000 1 A 44.006 1 ATOM 3055 C C . GLN 380 380 ? A -9.414 16.187 20.266 1.000 1 A 44.006 1 ATOM 3056 O O . GLN 380 380 ? A -8.591 16.606 19.449 1.000 1 A 44.006 1 ATOM 3057 C CB . GLN 380 380 ? A -9.968 13.883 19.457 1.000 1 A 44.006 1 ATOM 3058 C CG . GLN 380 380 ? A -10.445 12.755 20.361 1.000 1 A 44.006 1 ATOM 3059 C CD . GLN 380 380 ? A -10.250 11.384 19.741 1.000 1 A 44.006 1 ATOM 3060 O OE1 . GLN 380 380 ? A -10.033 11.260 18.531 1.000 1 A 44.006 1 ATOM 3061 N NE2 . GLN 380 380 ? A -10.328 10.344 20.565 1.000 1 A 44.006 1 ATOM 3062 N N . MET 381 381 ? A -9.668 17.275 21.055 1.000 1 A 49.359 1 ATOM 3063 C CA . MET 381 381 ? A -8.894 18.165 21.915 1.000 1 A 49.359 1 ATOM 3064 C C . MET 381 381 ? A -7.656 17.459 22.456 1.000 1 A 49.359 1 ATOM 3065 O O . MET 381 381 ? A -6.856 18.062 23.175 1.000 1 A 49.359 1 ATOM 3066 C CB . MET 381 381 ? A -9.753 18.675 23.074 1.000 1 A 49.359 1 ATOM 3067 C CG . MET 381 381 ? A -10.720 19.780 22.680 1.000 1 A 49.359 1 ATOM 3068 S SD . MET 381 381 ? A -11.498 20.585 24.134 1.000 1 A 49.359 1 ATOM 3069 C CE . MET 381 381 ? A -10.061 21.447 24.829 1.000 1 A 49.359 1 ATOM 3070 N N . GLN 382 382 ? A -7.372 16.191 21.952 1.000 1 A 52.322 1 ATOM 3071 C CA . GLN 382 382 ? A -6.090 15.844 22.555 1.000 1 A 52.322 1 ATOM 3072 C C . GLN 382 382 ? A -4.940 16.095 21.584 1.000 1 A 52.322 1 ATOM 3073 O O . GLN 382 382 ? A -5.034 15.758 20.402 1.000 1 A 52.322 1 ATOM 3074 C CB . GLN 382 382 ? A -6.086 14.384 23.008 1.000 1 A 52.322 1 ATOM 3075 C CG . GLN 382 382 ? A -6.843 14.141 24.307 1.000 1 A 52.322 1 ATOM 3076 C CD . GLN 382 382 ? A -6.622 12.746 24.863 1.000 1 A 52.322 1 ATOM 3077 O OE1 . GLN 382 382 ? A -6.213 11.833 24.140 1.000 1 A 52.322 1 ATOM 3078 N NE2 . GLN 382 382 ? A -6.892 12.572 26.152 1.000 1 A 52.322 1 ATOM 3079 N N . ALA 383 383 ? A -4.156 17.100 21.770 1.000 1 A 56.860 1 ATOM 3080 C CA . ALA 383 383 ? A -2.936 17.513 21.080 1.000 1 A 56.860 1 ATOM 3081 C C . ALA 383 383 ? A -2.052 16.311 20.762 1.000 1 A 56.860 1 ATOM 3082 O O . ALA 383 383 ? A -1.986 15.357 21.542 1.000 1 A 56.860 1 ATOM 3083 C CB . ALA 383 383 ? A -2.166 18.528 21.922 1.000 1 A 56.860 1 ATOM 3084 N N . ILE 384 384 ? A -1.832 15.959 19.427 1.000 1 A 59.744 1 ATOM 3085 C CA . ILE 384 384 ? A -0.796 15.033 18.982 1.000 1 A 59.744 1 ATOM 3086 C C . ILE 384 384 ? A 0.522 15.357 19.684 1.000 1 A 59.744 1 ATOM 3087 O O . ILE 384 384 ? A 0.993 16.496 19.637 1.000 1 A 59.744 1 ATOM 3088 C CB . ILE 384 384 ? A -0.613 15.084 17.449 1.000 1 A 59.744 1 ATOM 3089 C CG1 . ILE 384 384 ? A -1.952 14.843 16.743 1.000 1 A 59.744 1 ATOM 3090 C CG2 . ILE 384 384 ? A 0.436 14.065 16.996 1.000 1 A 59.744 1 ATOM 3091 C CD1 . ILE 384 384 ? A -1.922 15.121 15.246 1.000 1 A 59.744 1 ATOM 3092 N N . PRO 385 385 ? A 1.007 14.480 20.633 1.000 1 A 60.741 1 ATOM 3093 C CA . PRO 385 385 ? A 2.282 14.715 21.314 1.000 1 A 60.741 1 ATOM 3094 C C . PRO 385 385 ? A 3.427 14.995 20.343 1.000 1 A 60.741 1 ATOM 3095 O O . PRO 385 385 ? A 3.410 14.512 19.207 1.000 1 A 60.741 1 ATOM 3096 C CB . PRO 385 385 ? A 2.521 13.409 22.076 1.000 1 A 60.741 1 ATOM 3097 C CG . PRO 385 385 ? A 1.230 12.662 21.968 1.000 1 A 60.741 1 ATOM 3098 C CD . PRO 385 385 ? A 0.428 13.256 20.846 1.000 1 A 60.741 1 ATOM 3099 N N . GLU 386 386 ? A 4.247 16.073 20.566 1.000 1 A 62.714 1 ATOM 3100 C CA . GLU 386 386 ? A 5.476 16.457 19.879 1.000 1 A 62.714 1 ATOM 3101 C C . GLU 386 386 ? A 6.520 15.347 19.956 1.000 1 A 62.714 1 ATOM 3102 O O . GLU 386 386 ? A 6.538 14.569 20.912 1.000 1 A 62.714 1 ATOM 3103 C CB . GLU 386 386 ? A 6.041 17.752 20.467 1.000 1 A 62.714 1 ATOM 3104 C CG . GLU 386 386 ? A 5.284 19.002 20.042 1.000 1 A 62.714 1 ATOM 3105 C CD . GLU 386 386 ? A 5.885 20.284 20.595 1.000 1 A 62.714 1 ATOM 3106 O OE1 . GLU 386 386 ? A 5.325 21.375 20.343 1.000 1 A 62.714 1 ATOM 3107 O OE2 . GLU 386 386 ? A 6.926 20.198 21.284 1.000 1 A 62.714 1 ATOM 3108 N N . ASP 387 387 ? A 7.112 14.888 18.784 1.000 1 A 55.994 1 ATOM 3109 C CA . ASP 387 387 ? A 8.260 13.988 18.741 1.000 1 A 55.994 1 ATOM 3110 C C . ASP 387 387 ? A 9.186 14.223 19.933 1.000 1 A 55.994 1 ATOM 3111 O O . ASP 387 387 ? A 9.360 15.360 20.376 1.000 1 A 55.994 1 ATOM 3112 C CB . ASP 387 387 ? A 9.032 14.165 17.432 1.000 1 A 55.994 1 ATOM 3113 C CG . ASP 387 387 ? A 8.409 13.412 16.270 1.000 1 A 55.994 1 ATOM 3114 O OD1 . ASP 387 387 ? A 7.546 12.539 16.502 1.000 1 A 55.994 1 ATOM 3115 O OD2 . ASP 387 387 ? A 8.787 13.693 15.112 1.000 1 A 55.994 1 ATOM 3116 N N . ALA 388 388 ? A 9.288 13.261 20.846 1.000 1 A 55.037 1 ATOM 3117 C CA . ALA 388 388 ? A 10.415 13.343 21.771 1.000 1 A 55.037 1 ATOM 3118 C C . ALA 388 388 ? A 11.706 13.687 21.033 1.000 1 A 55.037 1 ATOM 3119 O O . ALA 388 388 ? A 11.963 13.167 19.944 1.000 1 A 55.037 1 ATOM 3120 C CB . ALA 388 388 ? A 10.575 12.030 22.533 1.000 1 A 55.037 1 ATOM 3121 N N . ILE 389 389 ? A 11.901 14.904 20.443 1.000 1 A 45.335 1 ATOM 3122 C CA . ILE 389 389 ? A 13.240 15.213 19.954 1.000 1 A 45.335 1 ATOM 3123 C C . ILE 389 389 ? A 14.249 14.243 20.566 1.000 1 A 45.335 1 ATOM 3124 O O . ILE 389 389 ? A 14.379 14.162 21.790 1.000 1 A 45.335 1 ATOM 3125 C CB . ILE 389 389 ? A 13.637 16.671 20.275 1.000 1 A 45.335 1 ATOM 3126 C CG1 . ILE 389 389 ? A 12.554 17.639 19.785 1.000 1 A 45.335 1 ATOM 3127 C CG2 . ILE 389 389 ? A 14.996 17.010 19.655 1.000 1 A 45.335 1 ATOM 3128 C CD1 . ILE 389 389 ? A 12.788 19.087 20.194 1.000 1 A 45.335 1 ATOM 3129 N N . PRO 390 390 ? A 14.515 13.017 20.000 1.000 1 A 47.162 1 ATOM 3130 C CA . PRO 390 390 ? A 15.658 12.393 20.670 1.000 1 A 47.162 1 ATOM 3131 C C . PRO 390 390 ? A 16.871 13.317 20.752 1.000 1 A 47.162 1 ATOM 3132 O O . PRO 390 390 ? A 17.175 14.029 19.792 1.000 1 A 47.162 1 ATOM 3133 C CB . PRO 390 390 ? A 15.959 11.175 19.792 1.000 1 A 47.162 1 ATOM 3134 C CG . PRO 390 390 ? A 15.032 11.306 18.627 1.000 1 A 47.162 1 ATOM 3135 C CD . PRO 390 390 ? A 14.321 12.625 18.729 1.000 1 A 47.162 1 ATOM 3136 N N . GLU 391 391 ? A 16.984 14.271 21.749 1.000 1 A 38.198 1 ATOM 3137 C CA . GLU 391 391 ? A 18.286 14.867 22.034 1.000 1 A 38.198 1 ATOM 3138 C C . GLU 391 391 ? A 19.415 14.049 21.413 1.000 1 A 38.198 1 ATOM 3139 O O . GLU 391 391 ? A 19.520 12.845 21.653 1.000 1 A 38.198 1 ATOM 3140 C CB . GLU 391 391 ? A 18.499 14.998 23.544 1.000 1 A 38.198 1 ATOM 3141 C CG . GLU 391 391 ? A 17.942 16.284 24.135 1.000 1 A 38.198 1 ATOM 3142 C CD . GLU 391 391 ? A 18.304 16.479 25.599 1.000 1 A 38.198 1 ATOM 3143 O OE1 . GLU 391 391 ? A 17.893 17.500 26.195 1.000 1 A 38.198 1 ATOM 3144 O OE2 . GLU 391 391 ? A 19.005 15.603 26.153 1.000 1 A 38.198 1 ATOM 3145 N N . GLU 392 392 ? A 19.539 13.913 19.983 1.000 1 A 33.120 1 ATOM 3146 C CA . GLU 392 392 ? A 20.823 13.746 19.309 1.000 1 A 33.120 1 ATOM 3147 C C . GLU 392 392 ? A 20.640 13.604 17.800 1.000 1 A 33.120 1 ATOM 3148 O O . GLU 392 392 ? A 19.885 12.746 17.340 1.000 1 A 33.120 1 ATOM 3149 C CB . GLU 392 392 ? A 21.569 12.531 19.865 1.000 1 A 33.120 1 ATOM 3150 C CG . GLU 392 392 ? A 22.500 12.858 21.024 1.000 1 A 33.120 1 ATOM 3151 C CD . GLU 392 392 ? A 23.293 11.657 21.514 1.000 1 A 33.120 1 ATOM 3152 O OE1 . GLU 392 392 ? A 24.087 11.803 22.471 1.000 1 A 33.120 1 ATOM 3153 O OE2 . GLU 392 392 ? A 23.120 10.561 20.936 1.000 1 A 33.120 1 ATOM 3154 N N . ALA 1 2347 ? B 30.430 32.089 -0.755 1.000 2 B 42.212 1 ATOM 3155 C CA . ALA 1 2347 ? B 30.634 31.255 -1.936 1.000 2 B 42.212 1 ATOM 3156 C C . ALA 1 2347 ? B 30.311 29.794 -1.639 1.000 2 B 42.212 1 ATOM 3157 O O . ALA 1 2347 ? B 30.831 29.219 -0.680 1.000 2 B 42.212 1 ATOM 3158 C CB . ALA 1 2347 ? B 32.070 31.387 -2.440 1.000 2 B 42.212 1 ATOM 3159 N N . PRO 2 2348 ? B 29.163 29.275 -2.046 1.000 2 B 37.499 1 ATOM 3160 C CA . PRO 2 2348 ? B 28.901 27.903 -1.606 1.000 2 B 37.499 1 ATOM 3161 C C . PRO 2 2348 ? B 29.597 26.861 -2.478 1.000 2 B 37.499 1 ATOM 3162 O O . PRO 2 2348 ? B 29.825 27.097 -3.667 1.000 2 B 37.499 1 ATOM 3163 C CB . PRO 2 2348 ? B 27.379 27.781 -1.720 1.000 2 B 37.499 1 ATOM 3164 C CG . PRO 2 2348 ? B 26.994 28.773 -2.770 1.000 2 B 37.499 1 ATOM 3165 C CD . PRO 2 2348 ? B 28.227 29.514 -3.201 1.000 2 B 37.499 1 ATOM 3166 N N . VAL 3 2349 ? B 30.641 26.203 -2.082 1.000 2 B 38.698 1 ATOM 3167 C CA . VAL 3 2349 ? B 31.450 24.990 -2.148 1.000 2 B 38.698 1 ATOM 3168 C C . VAL 3 2349 ? B 30.718 23.924 -2.960 1.000 2 B 38.698 1 ATOM 3169 O O . VAL 3 2349 ? B 29.572 23.583 -2.659 1.000 2 B 38.698 1 ATOM 3170 C CB . VAL 3 2349 ? B 31.781 24.452 -0.738 1.000 2 B 38.698 1 ATOM 3171 C CG1 . VAL 3 2349 ? B 32.721 23.251 -0.825 1.000 2 B 38.698 1 ATOM 3172 C CG2 . VAL 3 2349 ? B 32.395 25.554 0.123 1.000 2 B 38.698 1 ATOM 3173 N N . GLN 4 2350 ? B 30.866 23.932 -4.322 1.000 2 B 37.712 1 ATOM 3174 C CA . GLN 4 2350 ? B 30.672 23.058 -5.474 1.000 2 B 37.712 1 ATOM 3175 C C . GLN 4 2350 ? B 31.253 21.671 -5.216 1.000 2 B 37.712 1 ATOM 3176 O O . GLN 4 2350 ? B 32.418 21.542 -4.832 1.000 2 B 37.712 1 ATOM 3177 C CB . GLN 4 2350 ? B 31.306 23.668 -6.725 1.000 2 B 37.712 1 ATOM 3178 C CG . GLN 4 2350 ? B 30.376 24.595 -7.496 1.000 2 B 37.712 1 ATOM 3179 C CD . GLN 4 2350 ? B 31.013 25.151 -8.756 1.000 2 B 37.712 1 ATOM 3180 O OE1 . GLN 4 2350 ? B 32.129 24.770 -9.122 1.000 2 B 37.712 1 ATOM 3181 N NE2 . GLN 4 2350 ? B 30.309 26.056 -9.427 1.000 2 B 37.712 1 ATOM 3182 N N . SER 5 2351 ? B 30.541 20.746 -4.634 1.000 2 B 41.674 1 ATOM 3183 C CA . SER 5 2351 ? B 30.793 19.309 -4.589 1.000 2 B 41.674 1 ATOM 3184 C C . SER 5 2351 ? B 30.934 18.728 -5.992 1.000 2 B 41.674 1 ATOM 3185 O O . SER 5 2351 ? B 30.191 19.102 -6.902 1.000 2 B 41.674 1 ATOM 3186 C CB . SER 5 2351 ? B 29.669 18.590 -3.841 1.000 2 B 41.674 1 ATOM 3187 O OG . SER 5 2351 ? B 28.467 19.337 -3.902 1.000 2 B 41.674 1 ATOM 3188 N N . PRO 6 2352 ? B 32.066 18.049 -6.298 1.000 2 B 38.862 1 ATOM 3189 C CA . PRO 6 2352 ? B 32.598 17.446 -7.522 1.000 2 B 38.862 1 ATOM 3190 C C . PRO 6 2352 ? B 31.788 16.237 -7.984 1.000 2 B 38.862 1 ATOM 3191 O O . PRO 6 2352 ? B 31.264 15.487 -7.156 1.000 2 B 38.862 1 ATOM 3192 C CB . PRO 6 2352 ? B 34.017 17.032 -7.122 1.000 2 B 38.862 1 ATOM 3193 C CG . PRO 6 2352 ? B 33.984 16.944 -5.631 1.000 2 B 38.862 1 ATOM 3194 C CD . PRO 6 2352 ? B 32.624 17.371 -5.158 1.000 2 B 38.862 1 ATOM 3195 N N . ARG 7 2353 ? B 31.018 16.387 -9.107 1.000 2 B 38.415 1 ATOM 3196 C CA . ARG 7 2353 ? B 30.444 15.518 -10.129 1.000 2 B 38.415 1 ATOM 3197 C C . ARG 7 2353 ? B 31.251 14.232 -10.271 1.000 2 B 38.415 1 ATOM 3198 O O . ARG 7 2353 ? B 32.468 14.274 -10.461 1.000 2 B 38.415 1 ATOM 3199 C CB . ARG 7 2353 ? B 30.375 16.244 -11.475 1.000 2 B 38.415 1 ATOM 3200 C CG . ARG 7 2353 ? B 28.958 16.514 -11.956 1.000 2 B 38.415 1 ATOM 3201 C CD . ARG 7 2353 ? B 28.946 17.231 -13.299 1.000 2 B 38.415 1 ATOM 3202 N NE . ARG 7 2353 ? B 27.586 17.528 -13.740 1.000 2 B 38.415 1 ATOM 3203 C CZ . ARG 7 2353 ? B 27.269 18.048 -14.922 1.000 2 B 38.415 1 ATOM 3204 N NH1 . ARG 7 2353 ? B 28.213 18.340 -15.810 1.000 2 B 38.415 1 ATOM 3205 N NH2 . ARG 7 2353 ? B 25.999 18.278 -15.220 1.000 2 B 38.415 1 ATOM 3206 N N . PRO 8 2354 ? B 30.779 13.073 -9.868 1.000 2 B 38.723 1 ATOM 3207 C CA . PRO 8 2354 ? B 31.478 11.822 -10.174 1.000 2 B 38.723 1 ATOM 3208 C C . PRO 8 2354 ? B 31.367 11.430 -11.645 1.000 2 B 38.723 1 ATOM 3209 O O . PRO 8 2354 ? B 30.352 11.710 -12.288 1.000 2 B 38.723 1 ATOM 3210 C CB . PRO 8 2354 ? B 30.774 10.797 -9.281 1.000 2 B 38.723 1 ATOM 3211 C CG . PRO 8 2354 ? B 29.550 11.498 -8.786 1.000 2 B 38.723 1 ATOM 3212 C CD . PRO 8 2354 ? B 29.537 12.890 -9.349 1.000 2 B 38.723 1 ATOM 3213 N N . GLN 9 2355 ? B 32.518 11.466 -12.384 1.000 2 B 37.686 1 ATOM 3214 C CA . GLN 9 2355 ? B 33.130 10.825 -13.543 1.000 2 B 37.686 1 ATOM 3215 C C . GLN 9 2355 ? B 32.429 9.512 -13.879 1.000 2 B 37.686 1 ATOM 3216 O O . GLN 9 2355 ? B 32.197 8.682 -12.997 1.000 2 B 37.686 1 ATOM 3217 C CB . GLN 9 2355 ? B 34.619 10.577 -13.296 1.000 2 B 37.686 1 ATOM 3218 C CG . GLN 9 2355 ? B 35.513 11.735 -13.718 1.000 2 B 37.686 1 ATOM 3219 C CD . GLN 9 2355 ? B 36.982 11.473 -13.442 1.000 2 B 37.686 1 ATOM 3220 O OE1 . GLN 9 2355 ? B 37.352 10.408 -12.938 1.000 2 B 37.686 1 ATOM 3221 N NE2 . GLN 9 2355 ? B 37.829 12.444 -13.768 1.000 2 B 37.686 1 ATOM 3222 N N . SER 10 2356 ? B 31.427 9.499 -14.798 1.000 2 B 37.947 1 ATOM 3223 C CA . SER 10 2356 ? B 30.720 8.668 -15.767 1.000 2 B 37.947 1 ATOM 3224 C C . SER 10 2356 ? B 31.491 7.387 -16.064 1.000 2 B 37.947 1 ATOM 3225 O O . SER 10 2356 ? B 32.657 7.436 -16.464 1.000 2 B 37.947 1 ATOM 3226 C CB . SER 10 2356 ? B 30.481 9.442 -17.064 1.000 2 B 37.947 1 ATOM 3227 O OG . SER 10 2356 ? B 31.712 9.823 -17.656 1.000 2 B 37.947 1 ATOM 3228 N N . GLN 11 2357 ? B 31.528 6.392 -15.209 1.000 2 B 36.996 1 ATOM 3229 C CA . GLN 11 2357 ? B 31.941 5.040 -15.572 1.000 2 B 36.996 1 ATOM 3230 C C . GLN 11 2357 ? B 31.046 4.468 -16.668 1.000 2 B 36.996 1 ATOM 3231 O O . GLN 11 2357 ? B 29.827 4.651 -16.639 1.000 2 B 36.996 1 ATOM 3232 C CB . GLN 11 2357 ? B 31.922 4.125 -14.347 1.000 2 B 36.996 1 ATOM 3233 C CG . GLN 11 2357 ? B 33.257 4.044 -13.619 1.000 2 B 36.996 1 ATOM 3234 C CD . GLN 11 2357 ? B 33.261 3.007 -12.513 1.000 2 B 36.996 1 ATOM 3235 O OE1 . GLN 11 2357 ? B 32.202 2.558 -12.061 1.000 2 B 36.996 1 ATOM 3236 N NE2 . GLN 11 2357 ? B 34.451 2.619 -12.067 1.000 2 B 36.996 1 ATOM 3237 N N . PRO 12 2358 ? B 31.577 4.074 -17.858 1.000 2 B 36.974 1 ATOM 3238 C CA . PRO 12 2358 ? B 30.883 3.389 -18.951 1.000 2 B 36.974 1 ATOM 3239 C C . PRO 12 2358 ? B 30.248 2.071 -18.514 1.000 2 B 36.974 1 ATOM 3240 O O . PRO 12 2358 ? B 30.715 1.444 -17.559 1.000 2 B 36.974 1 ATOM 3241 C CB . PRO 12 2358 ? B 31.992 3.147 -19.977 1.000 2 B 36.974 1 ATOM 3242 C CG . PRO 12 2358 ? B 33.263 3.416 -19.237 1.000 2 B 36.974 1 ATOM 3243 C CD . PRO 12 2358 ? B 32.918 3.851 -17.841 1.000 2 B 36.974 1 ATOM 3244 N N . PRO 13 2359 ? B 28.972 1.804 -19.019 1.000 2 B 39.160 1 ATOM 3245 C CA . PRO 13 2359 ? B 28.028 0.738 -18.674 1.000 2 B 39.160 1 ATOM 3246 C C . PRO 13 2359 ? B 28.617 -0.657 -18.867 1.000 2 B 39.160 1 ATOM 3247 O O . PRO 13 2359 ? B 29.374 -0.886 -19.815 1.000 2 B 39.160 1 ATOM 3248 C CB . PRO 13 2359 ? B 26.861 0.976 -19.635 1.000 2 B 39.160 1 ATOM 3249 C CG . PRO 13 2359 ? B 27.436 1.807 -20.736 1.000 2 B 39.160 1 ATOM 3250 C CD . PRO 13 2359 ? B 28.836 2.198 -20.358 1.000 2 B 39.160 1 ATOM 3251 N N . HIS 14 2360 ? B 29.212 -1.256 -17.869 1.000 2 B 34.349 1 ATOM 3252 C CA . HIS 14 2360 ? B 29.428 -2.689 -17.698 1.000 2 B 34.349 1 ATOM 3253 C C . HIS 14 2360 ? B 28.237 -3.491 -18.212 1.000 2 B 34.349 1 ATOM 3254 O O . HIS 14 2360 ? B 27.089 -3.189 -17.878 1.000 2 B 34.349 1 ATOM 3255 C CB . HIS 14 2360 ? B 29.688 -3.020 -16.227 1.000 2 B 34.349 1 ATOM 3256 C CG . HIS 14 2360 ? B 31.138 -3.176 -15.894 1.000 2 B 34.349 1 ATOM 3257 N ND1 . HIS 14 2360 ? B 31.911 -4.200 -16.397 1.000 2 B 34.349 1 ATOM 3258 C CD2 . HIS 14 2360 ? B 31.955 -2.434 -15.110 1.000 2 B 34.349 1 ATOM 3259 C CE1 . HIS 14 2360 ? B 33.144 -4.081 -15.934 1.000 2 B 34.349 1 ATOM 3260 N NE2 . HIS 14 2360 ? B 33.197 -3.017 -15.151 1.000 2 B 34.349 1 ATOM 3261 N N . SER 15 2361 ? B 28.190 -3.801 -19.543 1.000 2 B 31.357 1 ATOM 3262 C CA . SER 15 2361 ? B 27.557 -4.837 -20.352 1.000 2 B 31.357 1 ATOM 3263 C C . SER 15 2361 ? B 27.717 -6.212 -19.712 1.000 2 B 31.357 1 ATOM 3264 O O . SER 15 2361 ? B 28.838 -6.669 -19.482 1.000 2 B 31.357 1 ATOM 3265 C CB . SER 15 2361 ? B 28.147 -4.850 -21.763 1.000 2 B 31.357 1 ATOM 3266 O OG . SER 15 2361 ? B 29.421 -4.230 -21.782 1.000 2 B 31.357 1 ATOM 3267 N N . SER 16 2362 ? B 27.078 -6.541 -18.642 1.000 2 B 32.533 1 ATOM 3268 C CA . SER 16 2362 ? B 26.933 -7.951 -18.293 1.000 2 B 32.533 1 ATOM 3269 C C . SER 16 2362 ? B 26.003 -8.668 -19.267 1.000 2 B 32.533 1 ATOM 3270 O O . SER 16 2362 ? B 24.985 -8.112 -19.684 1.000 2 B 32.533 1 ATOM 3271 C CB . SER 16 2362 ? B 26.404 -8.099 -16.866 1.000 2 B 32.533 1 ATOM 3272 O OG . SER 16 2362 ? B 26.821 -7.011 -16.060 1.000 2 B 32.533 1 ATOM 3273 N N . PRO 17 2363 ? B 26.475 -9.677 -20.051 1.000 2 B 32.762 1 ATOM 3274 C CA . PRO 17 2363 ? B 25.749 -10.513 -21.011 1.000 2 B 32.762 1 ATOM 3275 C C . PRO 17 2363 ? B 24.597 -11.283 -20.370 1.000 2 B 32.762 1 ATOM 3276 O O . PRO 17 2363 ? B 24.693 -11.693 -19.211 1.000 2 B 32.762 1 ATOM 3277 C CB . PRO 17 2363 ? B 26.825 -11.472 -21.528 1.000 2 B 32.762 1 ATOM 3278 C CG . PRO 17 2363 ? B 27.948 -11.349 -20.549 1.000 2 B 32.762 1 ATOM 3279 C CD . PRO 17 2363 ? B 27.578 -10.314 -19.526 1.000 2 B 32.762 1 ATOM 3280 N N . SER 18 2364 ? B 23.316 -10.850 -20.565 1.000 2 B 32.454 1 ATOM 3281 C CA . SER 18 2364 ? B 22.028 -11.533 -20.499 1.000 2 B 32.454 1 ATOM 3282 C C . SER 18 2364 ? B 22.199 -13.045 -20.591 1.000 2 B 32.454 1 ATOM 3283 O O . SER 18 2364 ? B 23.001 -13.537 -21.388 1.000 2 B 32.454 1 ATOM 3284 C CB . SER 18 2364 ? B 21.105 -11.047 -21.618 1.000 2 B 32.454 1 ATOM 3285 O OG . SER 18 2364 ? B 20.758 -9.686 -21.427 1.000 2 B 32.454 1 ATOM 3286 N N . PRO 19 2365 ? B 21.956 -13.828 -19.540 1.000 2 B 31.255 1 ATOM 3287 C CA . PRO 19 2365 ? B 21.976 -15.289 -19.645 1.000 2 B 31.255 1 ATOM 3288 C C . PRO 19 2365 ? B 21.005 -15.819 -20.696 1.000 2 B 31.255 1 ATOM 3289 O O . PRO 19 2365 ? B 19.914 -15.269 -20.867 1.000 2 B 31.255 1 ATOM 3290 C CB . PRO 19 2365 ? B 21.568 -15.748 -18.243 1.000 2 B 31.255 1 ATOM 3291 C CG . PRO 19 2365 ? B 21.041 -14.519 -17.576 1.000 2 B 31.255 1 ATOM 3292 C CD . PRO 19 2365 ? B 21.144 -13.372 -18.540 1.000 2 B 31.255 1 ATOM 3293 N N . ARG 20 2366 ? B 21.506 -16.195 -21.901 1.000 2 B 28.807 1 ATOM 3294 C CA . ARG 20 2366 ? B 21.091 -17.132 -22.941 1.000 2 B 28.807 1 ATOM 3295 C C . ARG 20 2366 ? B 20.194 -18.223 -22.368 1.000 2 B 28.807 1 ATOM 3296 O O . ARG 20 2366 ? B 20.571 -18.909 -21.415 1.000 2 B 28.807 1 ATOM 3297 C CB . ARG 20 2366 ? B 22.312 -17.759 -23.618 1.000 2 B 28.807 1 ATOM 3298 C CG . ARG 20 2366 ? B 22.106 -18.072 -25.091 1.000 2 B 28.807 1 ATOM 3299 C CD . ARG 20 2366 ? B 23.366 -18.641 -25.728 1.000 2 B 28.807 1 ATOM 3300 N NE . ARG 20 2366 ? B 23.159 -18.963 -27.137 1.000 2 B 28.807 1 ATOM 3301 C CZ . ARG 20 2366 ? B 24.099 -19.429 -27.955 1.000 2 B 28.807 1 ATOM 3302 N NH1 . ARG 20 2366 ? B 25.336 -19.636 -27.517 1.000 2 B 28.807 1 ATOM 3303 N NH2 . ARG 20 2366 ? B 23.802 -19.688 -29.220 1.000 2 B 28.807 1 ATOM 3304 N N . ILE 21 2367 ? B 18.913 -18.054 -22.217 1.000 2 B 34.014 1 ATOM 3305 C CA . ILE 21 2367 ? B 17.883 -19.037 -21.902 1.000 2 B 34.014 1 ATOM 3306 C C . ILE 21 2367 ? B 17.668 -19.961 -23.099 1.000 2 B 34.014 1 ATOM 3307 O O . ILE 21 2367 ? B 17.430 -19.494 -24.216 1.000 2 B 34.014 1 ATOM 3308 C CB . ILE 21 2367 ? B 16.554 -18.356 -21.505 1.000 2 B 34.014 1 ATOM 3309 C CG1 . ILE 21 2367 ? B 16.727 -17.564 -20.204 1.000 2 B 34.014 1 ATOM 3310 C CG2 . ILE 21 2367 ? B 15.435 -19.393 -21.370 1.000 2 B 34.014 1 ATOM 3311 C CD1 . ILE 21 2367 ? B 15.496 -16.768 -19.795 1.000 2 B 34.014 1 ATOM 3312 N N . GLN 22 2368 ? B 18.355 -21.096 -23.229 1.000 2 B 28.843 1 ATOM 3313 C CA . GLN 22 2368 ? B 17.995 -22.343 -23.897 1.000 2 B 28.843 1 ATOM 3314 C C . GLN 22 2368 ? B 16.540 -22.712 -23.627 1.000 2 B 28.843 1 ATOM 3315 O O . GLN 22 2368 ? B 16.095 -22.705 -22.477 1.000 2 B 28.843 1 ATOM 3316 C CB . GLN 22 2368 ? B 18.917 -23.478 -23.448 1.000 2 B 28.843 1 ATOM 3317 C CG . GLN 22 2368 ? B 19.648 -24.166 -24.593 1.000 2 B 28.843 1 ATOM 3318 C CD . GLN 22 2368 ? B 20.702 -25.145 -24.112 1.000 2 B 28.843 1 ATOM 3319 O OE1 . GLN 22 2368 ? B 20.760 -25.482 -22.926 1.000 2 B 28.843 1 ATOM 3320 N NE2 . GLN 22 2368 ? B 21.544 -25.608 -25.030 1.000 2 B 28.843 1 ATOM 3321 N N . PRO 23 2369 ? B 15.626 -22.797 -24.678 1.000 2 B 31.399 1 ATOM 3322 C CA . PRO 23 2369 ? B 14.210 -23.170 -24.633 1.000 2 B 31.399 1 ATOM 3323 C C . PRO 23 2369 ? B 13.991 -24.596 -24.132 1.000 2 B 31.399 1 ATOM 3324 O O . PRO 23 2369 ? B 14.769 -25.495 -24.460 1.000 2 B 31.399 1 ATOM 3325 C CB . PRO 23 2369 ? B 13.761 -23.028 -26.090 1.000 2 B 31.399 1 ATOM 3326 C CG . PRO 23 2369 ? B 15.025 -22.828 -26.861 1.000 2 B 31.399 1 ATOM 3327 C CD . PRO 23 2369 ? B 16.174 -22.798 -25.895 1.000 2 B 31.399 1 ATOM 3328 N N . GLN 24 2370 ? B 13.786 -24.838 -22.864 1.000 2 B 30.798 1 ATOM 3329 C CA . GLN 24 2370 ? B 13.272 -26.052 -22.237 1.000 2 B 30.798 1 ATOM 3330 C C . GLN 24 2370 ? B 12.176 -26.688 -23.087 1.000 2 B 30.798 1 ATOM 3331 O O . GLN 24 2370 ? B 11.255 -26.002 -23.536 1.000 2 B 30.798 1 ATOM 3332 C CB . GLN 24 2370 ? B 12.740 -25.749 -20.836 1.000 2 B 30.798 1 ATOM 3333 C CG . GLN 24 2370 ? B 13.452 -26.515 -19.729 1.000 2 B 30.798 1 ATOM 3334 C CD . GLN 24 2370 ? B 12.772 -26.367 -18.381 1.000 2 B 30.798 1 ATOM 3335 O OE1 . GLN 24 2370 ? B 11.941 -25.474 -18.185 1.000 2 B 30.798 1 ATOM 3336 N NE2 . GLN 24 2370 ? B 13.120 -27.240 -17.442 1.000 2 B 30.798 1 ATOM 3337 N N . PRO 25 2371 ? B 12.316 -28.008 -23.549 1.000 2 B 30.132 1 ATOM 3338 C CA . PRO 25 2371 ? B 11.406 -28.898 -24.274 1.000 2 B 30.132 1 ATOM 3339 C C . PRO 25 2371 ? B 10.312 -29.479 -23.380 1.000 2 B 30.132 1 ATOM 3340 O O . PRO 25 2371 ? B 10.501 -29.600 -22.167 1.000 2 B 30.132 1 ATOM 3341 C CB . PRO 25 2371 ? B 12.331 -30.002 -24.793 1.000 2 B 30.132 1 ATOM 3342 C CG . PRO 25 2371 ? B 13.565 -29.890 -23.957 1.000 2 B 30.132 1 ATOM 3343 C CD . PRO 25 2371 ? B 13.410 -28.717 -23.032 1.000 2 B 30.132 1 ATOM 3344 N N . SER 26 2372 ? B 8.967 -29.256 -23.768 1.000 2 B 29.551 1 ATOM 3345 C CA . SER 26 2372 ? B 7.637 -29.820 -23.562 1.000 2 B 29.551 1 ATOM 3346 C C . SER 26 2372 ? B 7.712 -31.159 -22.836 1.000 2 B 29.551 1 ATOM 3347 O O . SER 26 2372 ? B 8.535 -32.011 -23.176 1.000 2 B 29.551 1 ATOM 3348 C CB . SER 26 2372 ? B 6.915 -29.996 -24.898 1.000 2 B 29.551 1 ATOM 3349 O OG . SER 26 2372 ? B 6.775 -28.751 -25.561 1.000 2 B 29.551 1 ATOM 3350 N N . PRO 27 2373 ? B 7.251 -31.313 -21.639 1.000 2 B 33.033 1 ATOM 3351 C CA . PRO 27 2373 ? B 7.243 -32.594 -20.929 1.000 2 B 33.033 1 ATOM 3352 C C . PRO 27 2373 ? B 6.149 -33.537 -21.426 1.000 2 B 33.033 1 ATOM 3353 O O . PRO 27 2373 ? B 5.080 -33.083 -21.842 1.000 2 B 33.033 1 ATOM 3354 C CB . PRO 27 2373 ? B 6.995 -32.190 -19.474 1.000 2 B 33.033 1 ATOM 3355 C CG . PRO 27 2373 ? B 6.334 -30.852 -19.556 1.000 2 B 33.033 1 ATOM 3356 C CD . PRO 27 2373 ? B 6.240 -30.455 -21.001 1.000 2 B 33.033 1 ATOM 3357 N N . HIS 28 2374 ? B 6.433 -34.631 -22.228 1.000 2 B 30.136 1 ATOM 3358 C CA . HIS 28 2374 ? B 6.189 -36.068 -22.275 1.000 2 B 30.136 1 ATOM 3359 C C . HIS 28 2374 ? B 5.455 -36.543 -21.026 1.000 2 B 30.136 1 ATOM 3360 O O . HIS 28 2374 ? B 5.813 -36.165 -19.908 1.000 2 B 30.136 1 ATOM 3361 C CB . HIS 28 2374 ? B 7.506 -36.830 -22.432 1.000 2 B 30.136 1 ATOM 3362 C CG . HIS 28 2374 ? B 7.982 -36.921 -23.847 1.000 2 B 30.136 1 ATOM 3363 N ND1 . HIS 28 2374 ? B 7.242 -37.520 -24.844 1.000 2 B 30.136 1 ATOM 3364 C CD2 . HIS 28 2374 ? B 9.123 -36.486 -24.432 1.000 2 B 30.136 1 ATOM 3365 C CE1 . HIS 28 2374 ? B 7.910 -37.449 -25.983 1.000 2 B 30.136 1 ATOM 3366 N NE2 . HIS 28 2374 ? B 9.054 -36.826 -25.760 1.000 2 B 30.136 1 ATOM 3367 N N . HIS 29 2375 ? B 4.114 -36.853 -21.160 1.000 2 B 28.019 1 ATOM 3368 C CA . HIS 29 2375 ? B 3.146 -37.921 -20.936 1.000 2 B 28.019 1 ATOM 3369 C C . HIS 29 2375 ? B 3.740 -39.032 -20.076 1.000 2 B 28.019 1 ATOM 3370 O O . HIS 29 2375 ? B 4.815 -39.553 -20.382 1.000 2 B 28.019 1 ATOM 3371 C CB . HIS 29 2375 ? B 2.661 -38.493 -22.269 1.000 2 B 28.019 1 ATOM 3372 C CG . HIS 29 2375 ? B 1.338 -37.952 -22.709 1.000 2 B 28.019 1 ATOM 3373 N ND1 . HIS 29 2375 ? B 0.163 -38.231 -22.045 1.000 2 B 28.019 1 ATOM 3374 C CD2 . HIS 29 2375 ? B 1.006 -37.145 -23.744 1.000 2 B 28.019 1 ATOM 3375 C CE1 . HIS 29 2375 ? B -0.837 -37.618 -22.656 1.000 2 B 28.019 1 ATOM 3376 N NE2 . HIS 29 2375 ? B -0.352 -36.952 -23.690 1.000 2 B 28.019 1 ATOM 3377 N N . VAL 30 2376 ? B 3.484 -38.977 -18.805 1.000 2 B 28.146 1 ATOM 3378 C CA . VAL 30 2376 ? B 3.506 -40.230 -18.058 1.000 2 B 28.146 1 ATOM 3379 C C . VAL 30 2376 ? B 2.258 -40.332 -17.183 1.000 2 B 28.146 1 ATOM 3380 O O . VAL 30 2376 ? B 1.946 -39.409 -16.426 1.000 2 B 28.146 1 ATOM 3381 C CB . VAL 30 2376 ? B 4.777 -40.351 -17.188 1.000 2 B 28.146 1 ATOM 3382 C CG1 . VAL 30 2376 ? B 4.783 -41.671 -16.420 1.000 2 B 28.146 1 ATOM 3383 C CG2 . VAL 30 2376 ? B 6.029 -40.229 -18.055 1.000 2 B 28.146 1 ATOM 3384 N N . SER 31 2377 ? B 1.223 -41.043 -17.642 1.000 2 B 26.917 1 ATOM 3385 C CA . SER 31 2377 ? B 0.276 -42.007 -17.090 1.000 2 B 26.917 1 ATOM 3386 C C . SER 31 2377 ? B 0.872 -42.745 -15.896 1.000 2 B 26.917 1 ATOM 3387 O O . SER 31 2377 ? B 1.995 -43.249 -15.968 1.000 2 B 26.917 1 ATOM 3388 C CB . SER 31 2377 ? B -0.152 -43.012 -18.160 1.000 2 B 26.917 1 ATOM 3389 O OG . SER 31 2377 ? B -1.119 -42.444 -19.026 1.000 2 B 26.917 1 ATOM 3390 N N . PRO 32 2378 ? B 0.150 -42.743 -14.740 1.000 2 B 33.372 1 ATOM 3391 C CA . PRO 32 2378 ? B 0.030 -43.978 -13.960 1.000 2 B 33.372 1 ATOM 3392 C C . PRO 32 2378 ? B -1.410 -44.280 -13.552 1.000 2 B 33.372 1 ATOM 3393 O O . PRO 32 2378 ? B -2.217 -43.360 -13.396 1.000 2 B 33.372 1 ATOM 3394 C CB . PRO 32 2378 ? B 0.900 -43.704 -12.731 1.000 2 B 33.372 1 ATOM 3395 C CG . PRO 32 2378 ? B 0.808 -42.228 -12.518 1.000 2 B 33.372 1 ATOM 3396 C CD . PRO 32 2378 ? B -0.012 -41.636 -13.629 1.000 2 B 33.372 1 ATOM 3397 N N . GLN 33 2379 ? B -2.063 -45.345 -14.136 1.000 2 B 24.059 1 ATOM 3398 C CA . GLN 33 2379 ? B -2.547 -46.647 -13.688 1.000 2 B 24.059 1 ATOM 3399 C C . GLN 33 2379 ? B -2.673 -46.694 -12.168 1.000 2 B 24.059 1 ATOM 3400 O O . GLN 33 2379 ? B -1.757 -46.284 -11.452 1.000 2 B 24.059 1 ATOM 3401 C CB . GLN 33 2379 ? B -1.619 -47.761 -14.174 1.000 2 B 24.059 1 ATOM 3402 C CG . GLN 33 2379 ? B -1.985 -48.313 -15.545 1.000 2 B 24.059 1 ATOM 3403 C CD . GLN 33 2379 ? B -1.106 -49.477 -15.963 1.000 2 B 24.059 1 ATOM 3404 O OE1 . GLN 33 2379 ? B -0.177 -49.860 -15.245 1.000 2 B 24.059 1 ATOM 3405 N NE2 . GLN 33 2379 ? B -1.392 -50.047 -17.129 1.000 2 B 24.059 1 ATOM 3406 N N . THR 34 2380 ? B -3.924 -46.851 -11.608 1.000 2 B 29.303 1 ATOM 3407 C CA . THR 34 2380 ? B -4.544 -47.910 -10.820 1.000 2 B 29.303 1 ATOM 3408 C C . THR 34 2380 ? B -5.248 -47.333 -9.596 1.000 2 B 29.303 1 ATOM 3409 O O . THR 34 2380 ? B -4.680 -46.505 -8.880 1.000 2 B 29.303 1 ATOM 3410 C CB . THR 34 2380 ? B -3.505 -48.955 -10.373 1.000 2 B 29.303 1 ATOM 3411 O OG1 . THR 34 2380 ? B -2.451 -48.297 -9.659 1.000 2 B 29.303 1 ATOM 3412 C CG2 . THR 34 2380 ? B -2.911 -49.688 -11.572 1.000 2 B 29.303 1 ATOM 3413 N N . GLY 35 2381 ? B -6.598 -47.432 -9.541 1.000 2 B 29.155 1 ATOM 3414 C CA . GLY 35 2381 ? B -7.388 -48.200 -8.592 1.000 2 B 29.155 1 ATOM 3415 C C . GLY 35 2381 ? B -8.676 -47.507 -8.189 1.000 2 B 29.155 1 ATOM 3416 O O . GLY 35 2381 ? B -8.675 -46.315 -7.877 1.000 2 B 29.155 1 ATOM 3417 N N . SER 36 2382 ? B -9.734 -47.843 -8.824 1.000 2 B 26.800 1 ATOM 3418 C CA . SER 36 2382 ? B -11.059 -48.317 -8.436 1.000 2 B 26.800 1 ATOM 3419 C C . SER 36 2382 ? B -11.219 -48.331 -6.919 1.000 2 B 26.800 1 ATOM 3420 O O . SER 36 2382 ? B -10.257 -48.585 -6.191 1.000 2 B 26.800 1 ATOM 3421 C CB . SER 36 2382 ? B -11.315 -49.716 -8.997 1.000 2 B 26.800 1 ATOM 3422 O OG . SER 36 2382 ? B -10.686 -49.875 -10.257 1.000 2 B 26.800 1 ATOM 3423 N N . PRO 37 2383 ? B -12.556 -48.327 -6.456 1.000 2 B 36.862 1 ATOM 3424 C CA . PRO 37 2383 ? B -13.951 -48.700 -6.697 1.000 2 B 36.862 1 ATOM 3425 C C . PRO 37 2383 ? B -14.940 -47.675 -6.146 1.000 2 B 36.862 1 ATOM 3426 O O . PRO 37 2383 ? B -14.553 -46.790 -5.378 1.000 2 B 36.862 1 ATOM 3427 C CB . PRO 37 2383 ? B -14.090 -50.039 -5.966 1.000 2 B 36.862 1 ATOM 3428 C CG . PRO 37 2383 ? B -13.201 -49.915 -4.771 1.000 2 B 36.862 1 ATOM 3429 C CD . PRO 37 2383 ? B -12.452 -48.617 -4.865 1.000 2 B 36.862 1 ATOM 3430 N N . HIS 38 2384 ? B -15.951 -47.436 -6.873 1.000 2 B 28.286 1 ATOM 3431 C CA . HIS 38 2384 ? B -17.404 -47.544 -6.931 1.000 2 B 28.286 1 ATOM 3432 C C . HIS 38 2384 ? B -18.029 -47.316 -5.559 1.000 2 B 28.286 1 ATOM 3433 O O . HIS 38 2384 ? B -17.499 -47.779 -4.546 1.000 2 B 28.286 1 ATOM 3434 C CB . HIS 38 2384 ? B -17.818 -48.912 -7.477 1.000 2 B 28.286 1 ATOM 3435 C CG . HIS 38 2384 ? B -18.041 -48.926 -8.955 1.000 2 B 28.286 1 ATOM 3436 N ND1 . HIS 38 2384 ? B -19.017 -48.170 -9.568 1.000 2 B 28.286 1 ATOM 3437 C CD2 . HIS 38 2384 ? B -17.410 -49.604 -9.943 1.000 2 B 28.286 1 ATOM 3438 C CE1 . HIS 38 2384 ? B -18.977 -48.384 -10.873 1.000 2 B 28.286 1 ATOM 3439 N NE2 . HIS 38 2384 ? B -18.011 -49.250 -11.126 1.000 2 B 28.286 1 ATOM 3440 N N . PRO 39 2385 ? B -19.361 -46.969 -5.549 1.000 2 B 35.632 1 ATOM 3441 C CA . PRO 39 2385 ? B -20.647 -47.301 -6.166 1.000 2 B 35.632 1 ATOM 3442 C C . PRO 39 2385 ? B -21.662 -46.166 -6.062 1.000 2 B 35.632 1 ATOM 3443 O O . PRO 39 2385 ? B -21.460 -45.220 -5.296 1.000 2 B 35.632 1 ATOM 3444 C CB . PRO 39 2385 ? B -21.113 -48.525 -5.373 1.000 2 B 35.632 1 ATOM 3445 C CG . PRO 39 2385 ? B -20.606 -48.296 -3.986 1.000 2 B 35.632 1 ATOM 3446 C CD . PRO 39 2385 ? B -19.748 -47.063 -3.988 1.000 2 B 35.632 1 ATOM 3447 N N . GLY 40 2386 ? B -22.463 -46.012 -7.127 1.000 2 B 26.037 1 ATOM 3448 C CA . GLY 40 2386 ? B -23.905 -46.183 -7.038 1.000 2 B 26.037 1 ATOM 3449 C C . GLY 40 2386 ? B -24.681 -45.021 -7.628 1.000 2 B 26.037 1 ATOM 3450 O O . GLY 40 2386 ? B -24.334 -43.859 -7.407 1.000 2 B 26.037 1 ATOM 3451 N N . LEU 41 2387 ? B -25.348 -45.286 -8.766 1.000 2 B 30.194 1 ATOM 3452 C CA . LEU 41 2387 ? B -26.790 -45.232 -8.980 1.000 2 B 30.194 1 ATOM 3453 C C . LEU 41 2387 ? B -27.125 -44.408 -10.219 1.000 2 B 30.194 1 ATOM 3454 O O . LEU 41 2387 ? B -26.660 -43.275 -10.361 1.000 2 B 30.194 1 ATOM 3455 C CB . LEU 41 2387 ? B -27.493 -44.640 -7.755 1.000 2 B 30.194 1 ATOM 3456 C CG . LEU 41 2387 ? B -27.822 -45.616 -6.625 1.000 2 B 30.194 1 ATOM 3457 C CD1 . LEU 41 2387 ? B -27.995 -44.865 -5.309 1.000 2 B 30.194 1 ATOM 3458 C CD2 . LEU 41 2387 ? B -29.077 -46.416 -6.959 1.000 2 B 30.194 1 ATOM 3459 N N . ALA 42 2388 ? B -27.573 -45.066 -11.319 1.000 2 B 26.773 1 ATOM 3460 C CA . ALA 42 2388 ? B -28.906 -45.218 -11.897 1.000 2 B 26.773 1 ATOM 3461 C C . ALA 42 2388 ? B -29.151 -44.179 -12.988 1.000 2 B 26.773 1 ATOM 3462 O O . ALA 42 2388 ? B -28.865 -42.994 -12.802 1.000 2 B 26.773 1 ATOM 3463 C CB . ALA 42 2388 ? B -29.973 -45.106 -10.811 1.000 2 B 26.773 1 ATOM 3464 N N . VAL 43 2389 ? B -29.312 -44.651 -14.280 1.000 2 B 28.474 1 ATOM 3465 C CA . VAL 43 2389 ? B -30.507 -44.721 -15.115 1.000 2 B 28.474 1 ATOM 3466 C C . VAL 43 2389 ? B -30.321 -43.853 -16.358 1.000 2 B 28.474 1 ATOM 3467 O O . VAL 43 2389 ? B -29.884 -42.704 -16.260 1.000 2 B 28.474 1 ATOM 3468 C CB . VAL 43 2389 ? B -31.768 -44.277 -14.339 1.000 2 B 28.474 1 ATOM 3469 C CG1 . VAL 43 2389 ? B -32.979 -44.219 -15.268 1.000 2 B 28.474 1 ATOM 3470 C CG2 . VAL 43 2389 ? B -32.033 -45.222 -13.168 1.000 2 B 28.474 1 ATOM 3471 N N . THR 44 2390 ? B -30.312 -44.434 -17.571 1.000 2 B 23.445 1 ATOM 3472 C CA . THR 44 2390 ? B -31.136 -44.690 -18.747 1.000 2 B 23.445 1 ATOM 3473 C C . THR 44 2390 ? B -31.154 -43.474 -19.669 1.000 2 B 23.445 1 ATOM 3474 O O . THR 44 2390 ? B -31.290 -42.339 -19.207 1.000 2 B 23.445 1 ATOM 3475 C CB . THR 44 2390 ? B -32.578 -45.057 -18.350 1.000 2 B 23.445 1 ATOM 3476 O OG1 . THR 44 2390 ? B -33.035 -44.148 -17.340 1.000 2 B 23.445 1 ATOM 3477 C CG2 . THR 44 2390 ? B -32.654 -46.480 -17.808 1.000 2 B 23.445 1 ATOM 3478 N N . MET 45 2391 ? B -30.757 -43.611 -20.918 1.000 2 B 25.209 1 ATOM 3479 C CA . MET 45 2391 ? B -31.494 -43.552 -22.177 1.000 2 B 25.209 1 ATOM 3480 C C . MET 45 2391 ? B -30.989 -42.408 -23.050 1.000 2 B 25.209 1 ATOM 3481 O O . MET 45 2391 ? B -30.833 -41.281 -22.576 1.000 2 B 25.209 1 ATOM 3482 C CB . MET 45 2391 ? B -32.993 -43.388 -21.917 1.000 2 B 25.209 1 ATOM 3483 C CG . MET 45 2391 ? B -33.701 -44.689 -21.576 1.000 2 B 25.209 1 ATOM 3484 S SD . MET 45 2391 ? B -34.912 -45.189 -22.861 1.000 2 B 25.209 1 ATOM 3485 C CE . MET 45 2391 ? B -36.402 -45.373 -21.843 1.000 2 B 25.209 1 ATOM 3486 N N . ALA 46 2392 ? B -30.413 -42.697 -24.229 1.000 2 B 28.278 1 ATOM 3487 C CA . ALA 46 2392 ? B -30.956 -42.414 -25.555 1.000 2 B 28.278 1 ATOM 3488 C C . ALA 46 2392 ? B -30.080 -41.415 -26.305 1.000 2 B 28.278 1 ATOM 3489 O O . ALA 46 2392 ? B -29.671 -40.395 -25.744 1.000 2 B 28.278 1 ATOM 3490 C CB . ALA 46 2392 ? B -32.384 -41.884 -25.442 1.000 2 B 28.278 1 ATOM 3491 N N . SER 47 2393 ? B -29.376 -41.854 -27.360 1.000 2 B 24.615 1 ATOM 3492 C CA . SER 47 2393 ? B -29.519 -41.660 -28.799 1.000 2 B 24.615 1 ATOM 3493 C C . SER 47 2393 ? B -28.987 -40.298 -29.229 1.000 2 B 24.615 1 ATOM 3494 O O . SER 47 2393 ? B -29.254 -39.287 -28.577 1.000 2 B 24.615 1 ATOM 3495 C CB . SER 47 2393 ? B -30.983 -41.800 -29.216 1.000 2 B 24.615 1 ATOM 3496 O OG . SER 47 2393 ? B -31.801 -40.895 -28.494 1.000 2 B 24.615 1 ATOM 3497 N N . SER 48 2394 ? B -27.940 -40.242 -30.040 1.000 2 B 27.047 1 ATOM 3498 C CA . SER 48 2394 ? B -27.920 -39.734 -31.408 1.000 2 B 27.047 1 ATOM 3499 C C . SER 48 2394 ? B -27.128 -38.435 -31.504 1.000 2 B 27.047 1 ATOM 3500 O O . SER 48 2394 ? B -27.288 -37.541 -30.670 1.000 2 B 27.047 1 ATOM 3501 C CB . SER 48 2394 ? B -29.344 -39.512 -31.919 1.000 2 B 27.047 1 ATOM 3502 O OG . SER 48 2394 ? B -30.295 -39.894 -30.940 1.000 2 B 27.047 1 ATOM 3503 N N . ILE 49 2395 ? B -25.978 -38.394 -32.163 1.000 2 B 25.247 1 ATOM 3504 C CA . ILE 49 2395 ? B -25.541 -37.828 -33.434 1.000 2 B 25.247 1 ATOM 3505 C C . ILE 49 2395 ? B -25.171 -36.359 -33.245 1.000 2 B 25.247 1 ATOM 3506 O O . ILE 49 2395 ? B -25.947 -35.585 -32.678 1.000 2 B 25.247 1 ATOM 3507 C CB . ILE 49 2395 ? B -26.629 -37.972 -34.521 1.000 2 B 25.247 1 ATOM 3508 C CG1 . ILE 49 2395 ? B -26.841 -39.449 -34.873 1.000 2 B 25.247 1 ATOM 3509 C CG2 . ILE 49 2395 ? B -26.260 -37.160 -35.766 1.000 2 B 25.247 1 ATOM 3510 C CD1 . ILE 49 2395 ? B -27.944 -39.690 -35.894 1.000 2 B 25.247 1 ATOM 3511 N N . ASP 50 2396 ? B -23.869 -35.942 -33.418 1.000 2 B 26.084 1 ATOM 3512 C CA . ASP 50 2396 ? B -23.324 -35.022 -34.411 1.000 2 B 26.084 1 ATOM 3513 C C . ASP 50 2396 ? B -22.728 -33.784 -33.745 1.000 2 B 26.084 1 ATOM 3514 O O . ASP 50 2396 ? B -23.381 -33.142 -32.920 1.000 2 B 26.084 1 ATOM 3515 C CB . ASP 50 2396 ? B -24.405 -34.611 -35.413 1.000 2 B 26.084 1 ATOM 3516 C CG . ASP 50 2396 ? B -23.880 -34.479 -36.832 1.000 2 B 26.084 1 ATOM 3517 O OD1 . ASP 50 2396 ? B -22.722 -34.871 -37.093 1.000 2 B 26.084 1 ATOM 3518 O OD2 . ASP 50 2396 ? B -24.630 -33.976 -37.696 1.000 2 B 26.084 1 ATOM 3519 N N . GLN 51 2397 ? B -21.372 -33.570 -33.812 1.000 2 B 25.651 1 ATOM 3520 C CA . GLN 51 2397 ? B -20.543 -32.592 -34.508 1.000 2 B 25.651 1 ATOM 3521 C C . GLN 51 2397 ? B -20.430 -31.297 -33.708 1.000 2 B 25.651 1 ATOM 3522 O O . GLN 51 2397 ? B -21.443 -30.700 -33.337 1.000 2 B 25.651 1 ATOM 3523 C CB . GLN 51 2397 ? B -21.108 -32.302 -35.900 1.000 2 B 25.651 1 ATOM 3524 C CG . GLN 51 2397 ? B -20.349 -32.989 -37.027 1.000 2 B 25.651 1 ATOM 3525 C CD . GLN 51 2397 ? B -20.854 -32.592 -38.401 1.000 2 B 25.651 1 ATOM 3526 O OE1 . GLN 51 2397 ? B -21.619 -31.633 -38.543 1.000 2 B 25.651 1 ATOM 3527 N NE2 . GLN 51 2397 ? B -20.430 -33.327 -39.424 1.000 2 B 25.651 1 ATOM 3528 N N . GLY 52 2398 ? B -19.264 -31.011 -33.064 1.000 2 B 25.801 1 ATOM 3529 C CA . GLY 52 2398 ? B -18.467 -29.795 -33.099 1.000 2 B 25.801 1 ATOM 3530 C C . GLY 52 2398 ? B -17.735 -29.523 -31.798 1.000 2 B 25.801 1 ATOM 3531 O O . GLY 52 2398 ? B -18.345 -29.511 -30.727 1.000 2 B 25.801 1 ATOM 3532 N N . HIS 53 2399 ? B -16.520 -30.063 -31.612 1.000 2 B 25.008 1 ATOM 3533 C CA . HIS 53 2399 ? B -15.114 -29.844 -31.290 1.000 2 B 25.008 1 ATOM 3534 C C . HIS 53 2399 ? B -14.794 -28.355 -31.206 1.000 2 B 25.008 1 ATOM 3535 O O . HIS 53 2399 ? B -14.967 -27.623 -32.183 1.000 2 B 25.008 1 ATOM 3536 C CB . HIS 53 2399 ? B -14.215 -30.517 -32.328 1.000 2 B 25.008 1 ATOM 3537 C CG . HIS 53 2399 ? B -12.985 -31.137 -31.745 1.000 2 B 25.008 1 ATOM 3538 N ND1 . HIS 53 2399 ? B -12.480 -30.775 -30.515 1.000 2 B 25.008 1 ATOM 3539 C CD2 . HIS 53 2399 ? B -12.162 -32.099 -32.225 1.000 2 B 25.008 1 ATOM 3540 C CE1 . HIS 53 2399 ? B -11.396 -31.488 -30.263 1.000 2 B 25.008 1 ATOM 3541 N NE2 . HIS 53 2399 ? B -11.181 -32.300 -31.285 1.000 2 B 25.008 1 ATOM 3542 N N . LEU 54 2400 ? B -15.028 -27.678 -30.095 1.000 2 B 28.821 1 ATOM 3543 C CA . LEU 54 2400 ? B -14.257 -26.498 -29.719 1.000 2 B 28.821 1 ATOM 3544 C C . LEU 54 2400 ? B -14.127 -26.395 -28.203 1.000 2 B 28.821 1 ATOM 3545 O O . LEU 54 2400 ? B -15.123 -26.481 -27.482 1.000 2 B 28.821 1 ATOM 3546 C CB . LEU 54 2400 ? B -14.913 -25.230 -30.273 1.000 2 B 28.821 1 ATOM 3547 C CG . LEU 54 2400 ? B -14.698 -24.951 -31.762 1.000 2 B 28.821 1 ATOM 3548 C CD1 . LEU 54 2400 ? B -15.735 -23.954 -32.269 1.000 2 B 28.821 1 ATOM 3549 C CD2 . LEU 54 2400 ? B -13.285 -24.436 -32.011 1.000 2 B 28.821 1 ATOM 3550 N N . GLY 55 2401 ? B -13.113 -27.056 -27.655 1.000 2 B 28.296 1 ATOM 3551 C CA . GLY 55 2401 ? B -11.949 -26.756 -26.837 1.000 2 B 28.296 1 ATOM 3552 C C . GLY 55 2401 ? B -12.297 -26.063 -25.534 1.000 2 B 28.296 1 ATOM 3553 O O . GLY 55 2401 ? B -13.072 -25.103 -25.523 1.000 2 B 28.296 1 ATOM 3554 N N . ASN 56 2402 ? B -12.708 -26.784 -24.509 1.000 2 B 28.804 1 ATOM 3555 C CA . ASN 56 2402 ? B -12.735 -26.715 -23.051 1.000 2 B 28.804 1 ATOM 3556 C C . ASN 56 2402 ? B -11.766 -25.661 -22.522 1.000 2 B 28.804 1 ATOM 3557 O O . ASN 56 2402 ? B -10.602 -25.625 -22.924 1.000 2 B 28.804 1 ATOM 3558 C CB . ASN 56 2402 ? B -12.417 -28.082 -22.443 1.000 2 B 28.804 1 ATOM 3559 C CG . ASN 56 2402 ? B -13.500 -28.569 -21.501 1.000 2 B 28.804 1 ATOM 3560 O OD1 . ASN 56 2402 ? B -14.554 -27.941 -21.371 1.000 2 B 28.804 1 ATOM 3561 N ND2 . ASN 56 2402 ? B -13.249 -29.692 -20.838 1.000 2 B 28.804 1 ATOM 3562 N N . PRO 57 2403 ? B -12.173 -24.574 -21.889 1.000 2 B 33.475 1 ATOM 3563 C CA . PRO 57 2403 ? B -11.438 -23.521 -21.184 1.000 2 B 33.475 1 ATOM 3564 C C . PRO 57 2403 ? B -10.909 -23.979 -19.826 1.000 2 B 33.475 1 ATOM 3565 O O . PRO 57 2403 ? B -11.533 -24.814 -19.167 1.000 2 B 33.475 1 ATOM 3566 C CB . PRO 57 2403 ? B -12.481 -22.413 -21.019 1.000 2 B 33.475 1 ATOM 3567 C CG . PRO 57 2403 ? B -13.795 -23.090 -21.237 1.000 2 B 33.475 1 ATOM 3568 C CD . PRO 57 2403 ? B -13.538 -24.518 -21.623 1.000 2 B 33.475 1 ATOM 3569 N N . GLU 58 2404 ? B -9.547 -24.141 -19.761 1.000 2 B 31.504 1 ATOM 3570 C CA . GLU 58 2404 ? B -8.417 -23.593 -19.017 1.000 2 B 31.504 1 ATOM 3571 C C . GLU 58 2404 ? B -8.678 -23.623 -17.514 1.000 2 B 31.504 1 ATOM 3572 O O . GLU 58 2404 ? B -9.701 -23.119 -17.046 1.000 2 B 31.504 1 ATOM 3573 C CB . GLU 58 2404 ? B -8.118 -22.162 -19.471 1.000 2 B 31.504 1 ATOM 3574 C CG . GLU 58 2404 ? B -7.224 -22.081 -20.700 1.000 2 B 31.504 1 ATOM 3575 C CD . GLU 58 2404 ? B -6.788 -20.662 -21.032 1.000 2 B 31.504 1 ATOM 3576 O OE1 . GLU 58 2404 ? B -5.684 -20.482 -21.594 1.000 2 B 31.504 1 ATOM 3577 O OE2 . GLU 58 2404 ? B -7.557 -19.723 -20.727 1.000 2 B 31.504 1 ATOM 3578 N N . GLN 59 2405 ? B -8.456 -24.791 -16.858 1.000 2 B 26.395 1 ATOM 3579 C CA . GLN 59 2405 ? B -7.955 -25.298 -15.585 1.000 2 B 26.395 1 ATOM 3580 C C . GLN 59 2405 ? B -7.252 -24.199 -14.793 1.000 2 B 26.395 1 ATOM 3581 O O . GLN 59 2405 ? B -6.223 -23.676 -15.226 1.000 2 B 26.395 1 ATOM 3582 C CB . GLN 59 2405 ? B -7.002 -26.473 -15.812 1.000 2 B 26.395 1 ATOM 3583 C CG . GLN 59 2405 ? B -7.673 -27.836 -15.714 1.000 2 B 26.395 1 ATOM 3584 C CD . GLN 59 2405 ? B -6.722 -28.981 -16.008 1.000 2 B 26.395 1 ATOM 3585 O OE1 . GLN 59 2405 ? B -5.524 -28.770 -16.226 1.000 2 B 26.395 1 ATOM 3586 N NE2 . GLN 59 2405 ? B -7.247 -30.201 -16.016 1.000 2 B 26.395 1 ATOM 3587 N N . SER 60 2406 ? B -7.895 -23.123 -14.276 1.000 2 B 31.281 1 ATOM 3588 C CA . SER 60 2406 ? B -7.602 -22.272 -13.127 1.000 2 B 31.281 1 ATOM 3589 C C . SER 60 2406 ? B -7.055 -23.087 -11.961 1.000 2 B 31.281 1 ATOM 3590 O O . SER 60 2406 ? B -7.623 -24.119 -11.597 1.000 2 B 31.281 1 ATOM 3591 C CB . SER 60 2406 ? B -8.855 -21.514 -12.687 1.000 2 B 31.281 1 ATOM 3592 O OG . SER 60 2406 ? B -8.515 -20.243 -12.160 1.000 2 B 31.281 1 ATOM 3593 N N . ALA 61 2407 ? B -5.798 -23.481 -11.945 1.000 2 B 29.279 1 ATOM 3594 C CA . ALA 61 2407 ? B -4.926 -23.887 -10.847 1.000 2 B 29.279 1 ATOM 3595 C C . ALA 61 2407 ? B -5.489 -23.434 -9.502 1.000 2 B 29.279 1 ATOM 3596 O O . ALA 61 2407 ? B -5.656 -22.236 -9.264 1.000 2 B 29.279 1 ATOM 3597 C CB . ALA 61 2407 ? B -3.520 -23.326 -11.048 1.000 2 B 29.279 1 ATOM 3598 N N . MET 62 2408 ? B -6.671 -23.882 -9.010 1.000 2 B 27.317 1 ATOM 3599 C CA . MET 62 2408 ? B -7.310 -23.914 -7.698 1.000 2 B 27.317 1 ATOM 3600 C C . MET 62 2408 ? B -6.298 -24.250 -6.607 1.000 2 B 27.317 1 ATOM 3601 O O . MET 62 2408 ? B -5.512 -25.188 -6.751 1.000 2 B 27.317 1 ATOM 3602 C CB . MET 62 2408 ? B -8.454 -24.930 -7.681 1.000 2 B 27.317 1 ATOM 3603 C CG . MET 62 2408 ? B -9.678 -24.488 -8.465 1.000 2 B 27.317 1 ATOM 3604 S SD . MET 62 2408 ? B -11.222 -25.276 -7.861 1.000 2 B 27.317 1 ATOM 3605 C CE . MET 62 2408 ? B -11.775 -24.024 -6.670 1.000 2 B 27.317 1 ATOM 3606 N N . LEU 63 2409 ? B -5.439 -23.322 -6.001 1.000 2 B 33.443 1 ATOM 3607 C CA . LEU 63 2409 ? B -4.669 -23.470 -4.770 1.000 2 B 33.443 1 ATOM 3608 C C . LEU 63 2409 ? B -5.389 -24.384 -3.785 1.000 2 B 33.443 1 ATOM 3609 O O . LEU 63 2409 ? B -6.618 -24.357 -3.691 1.000 2 B 33.443 1 ATOM 3610 C CB . LEU 63 2409 ? B -4.418 -22.104 -4.127 1.000 2 B 33.443 1 ATOM 3611 C CG . LEU 63 2409 ? B -3.168 -21.355 -4.593 1.000 2 B 33.443 1 ATOM 3612 C CD1 . LEU 63 2409 ? B -3.435 -19.854 -4.635 1.000 2 B 33.443 1 ATOM 3613 C CD2 . LEU 63 2409 ? B -1.986 -21.668 -3.681 1.000 2 B 33.443 1 ATOM 3614 N N . PRO 64 2410 ? B -4.746 -25.338 -3.057 1.000 2 B 28.233 1 ATOM 3615 C CA . PRO 64 2410 ? B -5.300 -26.157 -1.977 1.000 2 B 28.233 1 ATOM 3616 C C . PRO 64 2410 ? B -5.736 -25.328 -0.771 1.000 2 B 28.233 1 ATOM 3617 O O . PRO 64 2410 ? B -5.096 -24.326 -0.443 1.000 2 B 28.233 1 ATOM 3618 C CB . PRO 64 2410 ? B -4.142 -27.088 -1.609 1.000 2 B 28.233 1 ATOM 3619 C CG . PRO 64 2410 ? B -2.991 -26.610 -2.436 1.000 2 B 28.233 1 ATOM 3620 C CD . PRO 64 2410 ? B -3.417 -25.375 -3.177 1.000 2 B 28.233 1 ATOM 3621 N N . GLN 65 2411 ? B -7.080 -25.016 -0.633 1.000 2 B 26.624 1 ATOM 3622 C CA . GLN 65 2411 ? B -8.064 -24.808 0.424 1.000 2 B 26.624 1 ATOM 3623 C C . GLN 65 2411 ? B -7.390 -24.685 1.788 1.000 2 B 26.624 1 ATOM 3624 O O . GLN 65 2411 ? B -6.572 -25.528 2.159 1.000 2 B 26.624 1 ATOM 3625 C CB . GLN 65 2411 ? B -9.082 -25.949 0.443 1.000 2 B 26.624 1 ATOM 3626 C CG . GLN 65 2411 ? B -10.120 -25.866 -0.669 1.000 2 B 26.624 1 ATOM 3627 C CD . GLN 65 2411 ? B -11.434 -26.526 -0.296 1.000 2 B 26.624 1 ATOM 3628 O OE1 . GLN 65 2411 ? B -11.558 -27.131 0.774 1.000 2 B 26.624 1 ATOM 3629 N NE2 . GLN 65 2411 ? B -12.424 -26.414 -1.175 1.000 2 B 26.624 1 ATOM 3630 N N . LEU 66 2412 ? B -6.761 -23.571 2.234 1.000 2 B 28.907 1 ATOM 3631 C CA . LEU 66 2412 ? B -6.415 -23.124 3.579 1.000 2 B 28.907 1 ATOM 3632 C C . LEU 66 2412 ? B -7.565 -23.375 4.548 1.000 2 B 28.907 1 ATOM 3633 O O . LEU 66 2412 ? B -8.707 -22.999 4.274 1.000 2 B 28.907 1 ATOM 3634 C CB . LEU 66 2412 ? B -6.053 -21.637 3.573 1.000 2 B 28.907 1 ATOM 3635 C CG . LEU 66 2412 ? B -4.662 -21.280 3.045 1.000 2 B 28.907 1 ATOM 3636 C CD1 . LEU 66 2412 ? B -4.646 -19.848 2.521 1.000 2 B 28.907 1 ATOM 3637 C CD2 . LEU 66 2412 ? B -3.612 -21.468 4.134 1.000 2 B 28.907 1 ATOM 3638 N N . ASN 67 2413 ? B -7.667 -24.538 5.206 1.000 2 B 23.019 1 ATOM 3639 C CA . ASN 67 2413 ? B -8.465 -24.796 6.399 1.000 2 B 23.019 1 ATOM 3640 C C . ASN 67 2413 ? B -8.121 -23.825 7.525 1.000 2 B 23.019 1 ATOM 3641 O O . ASN 67 2413 ? B -6.967 -23.746 7.951 1.000 2 B 23.019 1 ATOM 3642 C CB . ASN 67 2413 ? B -8.278 -26.240 6.869 1.000 2 B 23.019 1 ATOM 3643 C CG . ASN 67 2413 ? B -9.338 -27.175 6.319 1.000 2 B 23.019 1 ATOM 3644 O OD1 . ASN 67 2413 ? B -10.264 -26.744 5.628 1.000 2 B 23.019 1 ATOM 3645 N ND2 . ASN 67 2413 ? B -9.208 -28.461 6.622 1.000 2 B 23.019 1 ATOM 3646 N N . THR 68 2414 ? B -8.501 -22.607 7.524 1.000 2 B 28.588 1 ATOM 3647 C CA . THR 68 2414 ? B -8.483 -21.866 8.780 1.000 2 B 28.588 1 ATOM 3648 C C . THR 68 2414 ? B -9.456 -22.480 9.783 1.000 2 B 28.588 1 ATOM 3649 O O . THR 68 2414 ? B -10.550 -22.911 9.411 1.000 2 B 28.588 1 ATOM 3650 C CB . THR 68 2414 ? B -8.836 -20.383 8.560 1.000 2 B 28.588 1 ATOM 3651 O OG1 . THR 68 2414 ? B -9.719 -20.270 7.437 1.000 2 B 28.588 1 ATOM 3652 C CG2 . THR 68 2414 ? B -7.584 -19.554 8.293 1.000 2 B 28.588 1 ATOM 3653 N N . PRO 69 2415 ? B -9.098 -23.036 10.984 1.000 2 B 27.770 1 ATOM 3654 C CA . PRO 69 2415 ? B -10.116 -23.560 11.898 1.000 2 B 27.770 1 ATOM 3655 C C . PRO 69 2415 ? B -11.237 -22.559 12.169 1.000 2 B 27.770 1 ATOM 3656 O O . PRO 69 2415 ? B -10.983 -21.357 12.278 1.000 2 B 27.770 1 ATOM 3657 C CB . PRO 69 2415 ? B -9.325 -23.853 13.176 1.000 2 B 27.770 1 ATOM 3658 C CG . PRO 69 2415 ? B -8.025 -23.138 12.993 1.000 2 B 27.770 1 ATOM 3659 C CD . PRO 69 2415 ? B -8.066 -22.401 11.685 1.000 2 B 27.770 1 ATOM 3660 N N . SER 70 2416 ? B -12.412 -22.735 11.530 1.000 2 B 26.507 1 ATOM 3661 C CA . SER 70 2416 ? B -13.833 -22.527 11.787 1.000 2 B 26.507 1 ATOM 3662 C C . SER 70 2416 ? B -14.069 -22.007 13.202 1.000 2 B 26.507 1 ATOM 3663 O O . SER 70 2416 ? B -13.532 -22.554 14.167 1.000 2 B 26.507 1 ATOM 3664 C CB . SER 70 2416 ? B -14.612 -23.826 11.577 1.000 2 B 26.507 1 ATOM 3665 O OG . SER 70 2416 ? B -14.634 -24.598 12.765 1.000 2 B 26.507 1 ATOM 3666 N N . ARG 71 2417 ? B -13.989 -20.702 13.504 1.000 2 B 33.351 1 ATOM 3667 C CA . ARG 71 2417 ? B -14.464 -19.876 14.610 1.000 2 B 33.351 1 ATOM 3668 C C . ARG 71 2417 ? B -15.898 -20.234 14.983 1.000 2 B 33.351 1 ATOM 3669 O O . ARG 71 2417 ? B -16.541 -19.520 15.756 1.000 2 B 33.351 1 ATOM 3670 C CB . ARG 71 2417 ? B -14.371 -18.392 14.251 1.000 2 B 33.351 1 ATOM 3671 C CG . ARG 71 2417 ? B -13.243 -17.657 14.958 1.000 2 B 33.351 1 ATOM 3672 C CD . ARG 71 2417 ? B -13.236 -16.173 14.617 1.000 2 B 33.351 1 ATOM 3673 N NE . ARG 71 2417 ? B -12.174 -15.463 15.325 1.000 2 B 33.351 1 ATOM 3674 C CZ . ARG 71 2417 ? B -11.952 -14.154 15.241 1.000 2 B 33.351 1 ATOM 3675 N NH1 . ARG 71 2417 ? B -12.716 -13.384 14.476 1.000 2 B 33.351 1 ATOM 3676 N NH2 . ARG 71 2417 ? B -10.957 -13.611 15.928 1.000 2 B 33.351 1 ATOM 3677 N N . SER 72 2418 ? B -16.285 -21.540 14.994 1.000 2 B 27.816 1 ATOM 3678 C CA . SER 72 2418 ? B -17.526 -21.747 15.733 1.000 2 B 27.816 1 ATOM 3679 C C . SER 72 2418 ? B -17.485 -23.046 16.530 1.000 2 B 27.816 1 ATOM 3680 O O . SER 72 2418 ? B -18.398 -23.333 17.307 1.000 2 B 27.816 1 ATOM 3681 C CB . SER 72 2418 ? B -18.722 -21.763 14.779 1.000 2 B 27.816 1 ATOM 3682 O OG . SER 72 2418 ? B -18.578 -22.784 13.808 1.000 2 B 27.816 1 ATOM 3683 N N . ALA 73 2419 ? B -16.469 -23.336 17.370 1.000 2 B 25.663 1 ATOM 3684 C CA . ALA 73 2419 ? B -16.711 -24.319 18.422 1.000 2 B 25.663 1 ATOM 3685 C C . ALA 73 2419 ? B -15.695 -24.176 19.551 1.000 2 B 25.663 1 ATOM 3686 O O . ALA 73 2419 ? B -14.551 -24.619 19.425 1.000 2 B 25.663 1 ATOM 3687 C CB . ALA 73 2419 ? B -16.669 -25.734 17.849 1.000 2 B 25.663 1 ATOM 3688 N N . LEU 74 2420 ? B -15.585 -23.064 20.207 1.000 2 B 25.106 1 ATOM 3689 C CA . LEU 74 2420 ? B -15.020 -23.318 21.528 1.000 2 B 25.106 1 ATOM 3690 C C . LEU 74 2420 ? B -15.807 -22.581 22.606 1.000 2 B 25.106 1 ATOM 3691 O O . LEU 74 2420 ? B -15.758 -21.351 22.686 1.000 2 B 25.106 1 ATOM 3692 C CB . LEU 74 2420 ? B -13.550 -22.893 21.573 1.000 2 B 25.106 1 ATOM 3693 C CG . LEU 74 2420 ? B -12.543 -23.873 20.969 1.000 2 B 25.106 1 ATOM 3694 C CD1 . LEU 74 2420 ? B -11.248 -23.150 20.613 1.000 2 B 25.106 1 ATOM 3695 C CD2 . LEU 74 2420 ? B -12.271 -25.023 21.933 1.000 2 B 25.106 1 ATOM 3696 N N . SER 75 2421 ? B -17.107 -22.890 22.792 1.000 2 B 24.039 1 ATOM 3697 C CA . SER 75 2421 ? B -17.862 -22.916 24.041 1.000 2 B 24.039 1 ATOM 3698 C C . SER 75 2421 ? B -17.514 -24.148 24.870 1.000 2 B 24.039 1 ATOM 3699 O O . SER 75 2421 ? B -17.501 -25.267 24.354 1.000 2 B 24.039 1 ATOM 3700 C CB . SER 75 2421 ? B -19.364 -22.888 23.759 1.000 2 B 24.039 1 ATOM 3701 O OG . SER 75 2421 ? B -19.657 -23.518 22.524 1.000 2 B 24.039 1 ATOM 3702 N N . SER 76 2422 ? B -16.481 -24.176 25.726 1.000 2 B 24.971 1 ATOM 3703 C CA . SER 76 2422 ? B -16.477 -24.795 27.047 1.000 2 B 24.971 1 ATOM 3704 C C . SER 76 2422 ? B -15.116 -25.405 27.368 1.000 2 B 24.971 1 ATOM 3705 O O . SER 76 2422 ? B -14.576 -26.180 26.577 1.000 2 B 24.971 1 ATOM 3706 C CB . SER 76 2422 ? B -17.561 -25.870 27.140 1.000 2 B 24.971 1 ATOM 3707 O OG . SER 76 2422 ? B -17.200 -27.014 26.386 1.000 2 B 24.971 1 ATOM 3708 N N . GLU 77 2423 ? B -14.150 -24.685 27.987 1.000 2 B 23.979 1 ATOM 3709 C CA . GLU 77 2423 ? B -13.367 -25.097 29.148 1.000 2 B 23.979 1 ATOM 3710 C C . GLU 77 2423 ? B -11.872 -24.933 28.892 1.000 2 B 23.979 1 ATOM 3711 O O . GLU 77 2423 ? B -11.329 -25.524 27.955 1.000 2 B 23.979 1 ATOM 3712 C CB . GLU 77 2423 ? B -13.681 -26.548 29.521 1.000 2 B 23.979 1 ATOM 3713 C CG . GLU 77 2423 ? B -14.713 -26.688 30.631 1.000 2 B 23.979 1 ATOM 3714 C CD . GLU 77 2423 ? B -14.728 -28.070 31.266 1.000 2 B 23.979 1 ATOM 3715 O OE1 . GLU 77 2423 ? B -15.386 -28.248 32.316 1.000 2 B 23.979 1 ATOM 3716 O OE2 . GLU 77 2423 ? B -14.075 -28.980 30.709 1.000 2 B 23.979 1 ATOM 3717 N N . LEU 78 2424 ? B -11.265 -23.748 29.301 1.000 2 B 23.300 1 ATOM 3718 C CA . LEU 78 2424 ? B -10.008 -23.731 30.042 1.000 2 B 23.300 1 ATOM 3719 C C . LEU 78 2424 ? B -9.405 -22.330 30.055 1.000 2 B 23.300 1 ATOM 3720 O O . LEU 78 2424 ? B -9.157 -21.746 28.998 1.000 2 B 23.300 1 ATOM 3721 C CB . LEU 78 2424 ? B -9.013 -24.722 29.433 1.000 2 B 23.300 1 ATOM 3722 C CG . LEU 78 2424 ? B -8.300 -25.655 30.412 1.000 2 B 23.300 1 ATOM 3723 C CD1 . LEU 78 2424 ? B -8.948 -27.036 30.396 1.000 2 B 23.300 1 ATOM 3724 C CD2 . LEU 78 2424 ? B -6.816 -25.752 30.076 1.000 2 B 23.300 1 ATOM 3725 N N . SER 79 2425 ? B -9.733 -21.520 31.052 1.000 2 B 22.541 1 ATOM 3726 C CA . SER 79 2425 ? B -8.959 -20.758 32.026 1.000 2 B 22.541 1 ATOM 3727 C C . SER 79 2425 ? B -7.471 -21.080 31.924 1.000 2 B 22.541 1 ATOM 3728 O O . SER 79 2425 ? B -7.058 -22.214 32.170 1.000 2 B 22.541 1 ATOM 3729 C CB . SER 79 2425 ? B -9.454 -21.041 33.445 1.000 2 B 22.541 1 ATOM 3730 O OG . SER 79 2425 ? B -9.631 -22.432 33.647 1.000 2 B 22.541 1 ATOM 3731 N N . LEU 80 2426 ? B -6.695 -20.481 30.907 1.000 2 B 24.161 1 ATOM 3732 C CA . LEU 80 2426 ? B -5.270 -20.192 31.023 1.000 2 B 24.161 1 ATOM 3733 C C . LEU 80 2426 ? B -4.900 -18.953 30.215 1.000 2 B 24.161 1 ATOM 3734 O O . LEU 80 2426 ? B -5.284 -18.828 29.050 1.000 2 B 24.161 1 ATOM 3735 C CB . LEU 80 2426 ? B -4.440 -21.389 30.553 1.000 2 B 24.161 1 ATOM 3736 C CG . LEU 80 2426 ? B -3.971 -22.357 31.641 1.000 2 B 24.161 1 ATOM 3737 C CD1 . LEU 80 2426 ? B -4.009 -23.792 31.124 1.000 2 B 24.161 1 ATOM 3738 C CD2 . LEU 80 2426 ? B -2.570 -21.991 32.116 1.000 2 B 24.161 1 ATOM 3739 N N . VAL 81 2427 ? B -4.953 -17.721 30.795 1.000 2 B 24.991 1 ATOM 3740 C CA . VAL 81 2427 ? B -4.110 -16.530 30.817 1.000 2 B 24.991 1 ATOM 3741 C C . VAL 81 2427 ? B -4.185 -15.820 29.467 1.000 2 B 24.991 1 ATOM 3742 O O . VAL 81 2427 ? B -3.823 -16.393 28.436 1.000 2 B 24.991 1 ATOM 3743 C CB . VAL 81 2427 ? B -2.644 -16.878 31.156 1.000 2 B 24.991 1 ATOM 3744 C CG1 . VAL 81 2427 ? B -1.817 -15.607 31.343 1.000 2 B 24.991 1 ATOM 3745 C CG2 . VAL 81 2427 ? B -2.579 -17.751 32.408 1.000 2 B 24.991 1 ATOM 3746 N N . GLY 82 2428 ? B -5.212 -15.216 29.171 1.000 2 B 26.265 1 ATOM 3747 C CA . GLY 82 2428 ? B -5.723 -13.988 28.583 1.000 2 B 26.265 1 ATOM 3748 C C . GLY 82 2428 ? B -4.631 -13.089 28.036 1.000 2 B 26.265 1 ATOM 3749 O O . GLY 82 2428 ? B -3.633 -12.833 28.713 1.000 2 B 26.265 1 ATOM 3750 N N . ASP 83 2429 ? B -3.950 -13.337 26.910 1.000 2 B 32.879 1 ATOM 3751 C CA . ASP 83 2429 ? B -3.163 -12.405 26.108 1.000 2 B 32.879 1 ATOM 3752 C C . ASP 83 2429 ? B -3.890 -11.073 25.942 1.000 2 B 32.879 1 ATOM 3753 O O . ASP 83 2429 ? B -4.942 -11.009 25.303 1.000 2 B 32.879 1 ATOM 3754 C CB . ASP 83 2429 ? B -2.850 -13.008 24.737 1.000 2 B 32.879 1 ATOM 3755 C CG . ASP 83 2429 ? B -1.418 -12.767 24.296 1.000 2 B 32.879 1 ATOM 3756 O OD1 . ASP 83 2429 ? B -0.650 -12.120 25.041 1.000 2 B 32.879 1 ATOM 3757 O OD2 . ASP 83 2429 ? B -1.053 -13.225 23.191 1.000 2 B 32.879 1 ATOM 3758 N N . THR 84 2430 ? B -3.988 -10.133 26.913 1.000 2 B 31.688 1 ATOM 3759 C CA . THR 84 2430 ? B -4.313 -8.713 26.978 1.000 2 B 31.688 1 ATOM 3760 C C . THR 84 2430 ? B -3.425 -7.910 26.031 1.000 2 B 31.688 1 ATOM 3761 O O . THR 84 2430 ? B -3.511 -6.681 25.983 1.000 2 B 31.688 1 ATOM 3762 C CB . THR 84 2430 ? B -4.162 -8.170 28.411 1.000 2 B 31.688 1 ATOM 3763 O OG1 . THR 84 2430 ? B -2.887 -8.565 28.933 1.000 2 B 31.688 1 ATOM 3764 C CG2 . THR 84 2430 ? B -5.260 -8.710 29.322 1.000 2 B 31.688 1 ATOM 3765 N N . THR 85 2431 ? B -2.987 -8.244 24.728 1.000 2 B 48.620 1 ATOM 3766 C CA . THR 85 2431 ? B -2.030 -7.507 23.910 1.000 2 B 48.620 1 ATOM 3767 C C . THR 85 2431 ? B -2.747 -6.716 22.820 1.000 2 B 48.620 1 ATOM 3768 O O . THR 85 2431 ? B -2.257 -5.675 22.377 1.000 2 B 48.620 1 ATOM 3769 C CB . THR 85 2431 ? B -1.000 -8.454 23.267 1.000 2 B 48.620 1 ATOM 3770 O OG1 . THR 85 2431 ? B -1.688 -9.452 22.503 1.000 2 B 48.620 1 ATOM 3771 C CG2 . THR 85 2431 ? B -0.147 -9.141 24.328 1.000 2 B 48.620 1 ATOM 3772 N N . GLY 86 2432 ? B -3.988 -7.088 22.213 1.000 2 B 46.392 1 ATOM 3773 C CA . GLY 86 2432 ? B -4.790 -6.140 21.456 1.000 2 B 46.392 1 ATOM 3774 C C . GLY 86 2432 ? B -4.930 -4.795 22.142 1.000 2 B 46.392 1 ATOM 3775 O O . GLY 86 2432 ? B -4.984 -3.757 21.480 1.000 2 B 46.392 1 ATOM 3776 N N . ASP 87 2433 ? B -4.561 -4.731 23.432 1.000 2 B 53.958 1 ATOM 3777 C CA . ASP 87 2433 ? B -4.645 -3.533 24.261 1.000 2 B 53.958 1 ATOM 3778 C C . ASP 87 2433 ? B -3.418 -2.644 24.068 1.000 2 B 53.958 1 ATOM 3779 O O . ASP 87 2433 ? B -3.530 -1.417 24.055 1.000 2 B 53.958 1 ATOM 3780 C CB . ASP 87 2433 ? B -4.794 -3.910 25.737 1.000 2 B 53.958 1 ATOM 3781 C CG . ASP 87 2433 ? B -6.243 -3.990 26.185 1.000 2 B 53.958 1 ATOM 3782 O OD1 . ASP 87 2433 ? B -7.143 -3.598 25.411 1.000 2 B 53.958 1 ATOM 3783 O OD2 . ASP 87 2433 ? B -6.487 -4.446 27.323 1.000 2 B 53.958 1 ATOM 3784 N N . THR 88 2434 ? B -2.261 -3.242 23.461 1.000 2 B 70.180 1 ATOM 3785 C CA . THR 88 2434 ? B -1.057 -2.420 23.409 1.000 2 B 70.180 1 ATOM 3786 C C . THR 88 2434 ? B -1.036 -1.573 22.140 1.000 2 B 70.180 1 ATOM 3787 O O . THR 88 2434 ? B -0.680 -0.393 22.180 1.000 2 B 70.180 1 ATOM 3788 C CB . THR 88 2434 ? B 0.214 -3.286 23.473 1.000 2 B 70.180 1 ATOM 3789 O OG1 . THR 88 2434 ? B 0.119 -4.336 22.502 1.000 2 B 70.180 1 ATOM 3790 C CG2 . THR 88 2434 ? B 0.391 -3.903 24.856 1.000 2 B 70.180 1 ATOM 3791 N N . LEU 89 2435 ? B -1.322 -2.289 20.878 1.000 2 B 80.002 1 ATOM 3792 C CA . LEU 89 2435 ? B -1.311 -1.483 19.662 1.000 2 B 80.002 1 ATOM 3793 C C . LEU 89 2435 ? B -2.378 -0.395 19.722 1.000 2 B 80.002 1 ATOM 3794 O O . LEU 89 2435 ? B -2.125 0.751 19.344 1.000 2 B 80.002 1 ATOM 3795 C CB . LEU 89 2435 ? B -1.535 -2.366 18.431 1.000 2 B 80.002 1 ATOM 3796 C CG . LEU 89 2435 ? B -1.518 -1.657 17.076 1.000 2 B 80.002 1 ATOM 3797 C CD1 . LEU 89 2435 ? B -0.156 -1.016 16.831 1.000 2 B 80.002 1 ATOM 3798 C CD2 . LEU 89 2435 ? B -1.864 -2.634 15.957 1.000 2 B 80.002 1 ATOM 3799 N N . GLU 90 2436 ? B -3.494 -0.837 20.143 1.000 2 B 79.665 1 ATOM 3800 C CA . GLU 90 2436 ? B -4.575 0.127 20.324 1.000 2 B 79.665 1 ATOM 3801 C C . GLU 90 2436 ? B -4.139 1.282 21.222 1.000 2 B 79.665 1 ATOM 3802 O O . GLU 90 2436 ? B -4.369 2.448 20.897 1.000 2 B 79.665 1 ATOM 3803 C CB . GLU 90 2436 ? B -5.813 -0.557 20.910 1.000 2 B 79.665 1 ATOM 3804 C CG . GLU 90 2436 ? B -7.043 0.339 20.964 1.000 2 B 79.665 1 ATOM 3805 C CD . GLU 90 2436 ? B -8.274 -0.365 21.512 1.000 2 B 79.665 1 ATOM 3806 O OE1 . GLU 90 2436 ? B -9.358 0.259 21.561 1.000 2 B 79.665 1 ATOM 3807 O OE2 . GLU 90 2436 ? B -8.153 -1.550 21.896 1.000 2 B 79.665 1 ATOM 3808 N N . LYS 91 2437 ? B -3.582 0.986 22.333 1.000 2 B 78.447 1 ATOM 3809 C CA . LYS 91 2437 ? B -3.106 2.014 23.253 1.000 2 B 78.447 1 ATOM 3810 C C . LYS 91 2437 ? B -2.011 2.862 22.611 1.000 2 B 78.447 1 ATOM 3811 O O . LYS 91 2437 ? B -1.955 4.076 22.822 1.000 2 B 78.447 1 ATOM 3812 C CB . LYS 91 2437 ? B -2.587 1.380 24.545 1.000 2 B 78.447 1 ATOM 3813 C CG . LYS 91 2437 ? B -3.685 0.873 25.469 1.000 2 B 78.447 1 ATOM 3814 C CD . LYS 91 2437 ? B -3.120 0.412 26.807 1.000 2 B 78.447 1 ATOM 3815 C CE . LYS 91 2437 ? B -4.215 -0.111 27.726 1.000 2 B 78.447 1 ATOM 3816 N NZ . LYS 91 2437 ? B -3.658 -0.633 29.010 1.000 2 B 78.447 1 ATOM 3817 N N . PHE 92 2438 ? B -1.170 2.077 21.869 1.000 2 B 83.639 1 ATOM 3818 C CA . PHE 92 2438 ? B -0.113 2.784 21.157 1.000 2 B 83.639 1 ATOM 3819 C C . PHE 92 2438 ? B -0.700 3.787 20.171 1.000 2 B 83.639 1 ATOM 3820 O O . PHE 92 2438 ? B -0.278 4.944 20.129 1.000 2 B 83.639 1 ATOM 3821 C CB . PHE 92 2438 ? B 0.796 1.795 20.420 1.000 2 B 83.639 1 ATOM 3822 C CG . PHE 92 2438 ? B 1.919 2.450 19.663 1.000 2 B 83.639 1 ATOM 3823 C CD1 . PHE 92 2438 ? B 1.885 2.534 18.276 1.000 2 B 83.639 1 ATOM 3824 C CD2 . PHE 92 2438 ? B 3.010 2.982 20.338 1.000 2 B 83.639 1 ATOM 3825 C CE1 . PHE 92 2438 ? B 2.924 3.140 17.573 1.000 2 B 83.639 1 ATOM 3826 C CE2 . PHE 92 2438 ? B 4.051 3.589 19.642 1.000 2 B 83.639 1 ATOM 3827 C CZ . PHE 92 2438 ? B 4.007 3.666 18.259 1.000 2 B 83.639 1 ATOM 3828 N N . VAL 93 2439 ? B -1.704 3.340 19.342 1.000 2 B 84.089 1 ATOM 3829 C CA . VAL 93 2439 ? B -2.352 4.202 18.359 1.000 2 B 84.089 1 ATOM 3830 C C . VAL 93 2439 ? B -3.059 5.355 19.068 1.000 2 B 84.089 1 ATOM 3831 O O . VAL 93 2439 ? B -2.984 6.503 18.625 1.000 2 B 84.089 1 ATOM 3832 C CB . VAL 93 2439 ? B -3.358 3.415 17.489 1.000 2 B 84.089 1 ATOM 3833 C CG1 . VAL 93 2439 ? B -4.192 4.366 16.633 1.000 2 B 84.089 1 ATOM 3834 C CG2 . VAL 93 2439 ? B -2.624 2.403 16.610 1.000 2 B 84.089 1 ATOM 3835 N N . GLU 94 2440 ? B -3.601 5.125 20.186 1.000 2 B 81.444 1 ATOM 3836 C CA . GLU 94 2440 ? B -4.286 6.152 20.966 1.000 2 B 81.444 1 ATOM 3837 C C . GLU 94 2440 ? B -3.304 7.200 21.482 1.000 2 B 81.444 1 ATOM 3838 O O . GLU 94 2440 ? B -3.638 8.383 21.565 1.000 2 B 81.444 1 ATOM 3839 C CB . GLU 94 2440 ? B -5.045 5.522 22.136 1.000 2 B 81.444 1 ATOM 3840 C CG . GLU 94 2440 ? B -6.339 4.832 21.729 1.000 2 B 81.444 1 ATOM 3841 C CD . GLU 94 2440 ? B -7.065 4.181 22.896 1.000 2 B 81.444 1 ATOM 3842 O OE1 . GLU 94 2440 ? B -8.132 3.564 22.679 1.000 2 B 81.444 1 ATOM 3843 O OE2 . GLU 94 2440 ? B -6.563 4.290 24.037 1.000 2 B 81.444 1 ATOM 3844 N N . GLY 95 2441 ? B -2.158 6.772 21.746 1.000 2 B 74.904 1 ATOM 3845 C CA . GLY 95 2441 ? B -1.138 7.675 22.252 1.000 2 B 74.904 1 ATOM 3846 C C . GLY 95 2441 ? B -0.513 8.537 21.171 1.000 2 B 74.904 1 ATOM 3847 O O . GLY 95 2441 ? B 0.118 9.553 21.467 1.000 2 B 74.904 1 ATOM 3848 N N . LEU 96 2442 ? B -0.613 8.018 19.896 1.000 2 B 79.677 1 ATOM 3849 C CA . LEU 96 2442 ? B -0.058 8.795 18.792 1.000 2 B 79.677 1 ATOM 3850 C C . LEU 96 2442 ? B -0.952 9.986 18.462 1.000 2 B 79.677 1 ATOM 3851 O O . LEU 96 2442 ? B -0.457 11.077 18.172 1.000 2 B 79.677 1 ATOM 3852 C CB . LEU 96 2442 ? B 0.116 7.914 17.552 1.000 2 B 79.677 1 ATOM 3853 C CG . LEU 96 2442 ? B 1.202 6.841 17.629 1.000 2 B 79.677 1 ATOM 3854 C CD1 . LEU 96 2442 ? B 1.142 5.935 16.404 1.000 2 B 79.677 1 ATOM 3855 C CD2 . LEU 96 2442 ? B 2.580 7.482 17.759 1.000 2 B 79.677 1 loop_ _atom_type.symbol C N O S loop_ _ma_entry_associated_files.id _ma_entry_associated_files.entry_id _ma_entry_associated_files.file_url _ma_entry_associated_files.file_type _ma_entry_associated_files.file_format _ma_entry_associated_files.file_content _ma_entry_associated_files.details 1 ma-t3vr3-776 https://modelarchive.org/api/projects/ma-t3vr3-776?type=materials_procedures__accompanying_data_file_name archive zip 'archive with multiple files' . loop_ _ma_associated_archive_file_details.id _ma_associated_archive_file_details.archive_file_id _ma_associated_archive_file_details.file_path _ma_associated_archive_file_details.file_format _ma_associated_archive_file_details.file_content _ma_associated_archive_file_details.description _ma_associated_archive_file_details.data_id 1 1 ma-t3vr3-776_predicted_aligned_error_v1.cif cif 'local pairwise QA scores' 'Predicted aligned error and contact probability' . 2 1 Q13547-D1_Q92793-D15.i95.fas fasta 'multiple sequence alignments' 'Paired MSAs' 4 loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.description _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.type_other_details _ma_qa_metric.software_group_id 1 pLDDT 'Predicted accuracy according to the CA-only lDDT in [0,100]' pLDDT global . . 2 pLDDT 'Predicted accuracy according to the CA-only lDDT in [0,100]' pLDDT local . . 3 PAE 'Predicted aligned error (in Angstroms)' PAE local-pairwise . . 4 'contact probability' 'Contact probability of a pairwise interaction in [0,1]' 'contact probability' local-pairwise . . loop_ _ma_qa_metric_global.ordinal_id _ma_qa_metric_global.model_id _ma_qa_metric_global.metric_id _ma_qa_metric_global.metric_value 1 1 1 82.423 loop_ _ma_qa_metric_local.ordinal_id _ma_qa_metric_local.model_id _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value 1 1 A 1 MET 2 40.955 2 1 A 2 ALA 2 35.983 3 1 A 3 GLN 2 35.883 4 1 A 4 THR 2 40.954 5 1 A 5 GLN 2 36.774 6 1 A 6 GLY 2 49.489 7 1 A 7 THR 2 59.867 8 1 A 8 ARG 2 75.385 9 1 A 9 ARG 2 89.105 10 1 A 10 LYS 2 97.177 11 1 A 11 VAL 2 98.470 12 1 A 12 CYS 2 98.473 13 1 A 13 TYR 2 98.742 14 1 A 14 TYR 2 98.508 15 1 A 15 TYR 2 98.497 16 1 A 16 ASP 2 97.407 17 1 A 17 GLY 2 96.381 18 1 A 18 ASP 2 96.019 19 1 A 19 VAL 2 95.772 20 1 A 20 GLY 2 95.836 21 1 A 21 ASN 2 96.174 22 1 A 22 TYR 2 96.968 23 1 A 23 TYR 2 95.698 24 1 A 24 TYR 2 94.462 25 1 A 25 GLY 2 93.866 26 1 A 26 GLN 2 93.835 27 1 A 27 GLY 2 93.381 28 1 A 28 HIS 2 95.995 29 1 A 29 PRO 2 96.091 30 1 A 30 MET 2 96.729 31 1 A 31 LYS 2 97.632 32 1 A 32 PRO 2 97.595 33 1 A 33 HIS 2 98.100 34 1 A 34 ARG 2 98.211 35 1 A 35 ILE 2 98.434 36 1 A 36 ARG 2 98.013 37 1 A 37 MET 2 98.594 38 1 A 38 THR 2 98.756 39 1 A 39 HIS 2 98.693 40 1 A 40 ASN 2 98.558 41 1 A 41 LEU 2 98.709 42 1 A 42 LEU 2 98.767 43 1 A 43 LEU 2 98.497 44 1 A 44 ASN 2 98.588 45 1 A 45 TYR 2 98.621 46 1 A 46 GLY 2 98.466 47 1 A 47 LEU 2 98.488 48 1 A 48 TYR 2 97.771 49 1 A 49 ARG 2 97.604 50 1 A 50 LYS 2 97.902 51 1 A 51 MET 2 98.016 52 1 A 52 GLU 2 98.063 53 1 A 53 ILE 2 98.375 54 1 A 54 TYR 2 98.190 55 1 A 55 ARG 2 97.150 56 1 A 56 PRO 2 89.538 57 1 A 57 HIS 2 93.324 58 1 A 58 LYS 2 97.250 59 1 A 59 ALA 2 98.013 60 1 A 60 ASN 2 97.459 61 1 A 61 ALA 2 97.264 62 1 A 62 GLU 2 96.137 63 1 A 63 GLU 2 97.088 64 1 A 64 MET 2 98.381 65 1 A 65 THR 2 98.144 66 1 A 66 LYS 2 97.158 67 1 A 67 TYR 2 97.961 68 1 A 68 HIS 2 98.358 69 1 A 69 SER 2 98.120 70 1 A 70 ASP 2 97.987 71 1 A 71 ASP 2 98.265 72 1 A 72 TYR 2 98.548 73 1 A 73 ILE 2 98.623 74 1 A 74 LYS 2 98.348 75 1 A 75 PHE 2 98.388 76 1 A 76 LEU 2 98.404 77 1 A 77 ARG 2 98.001 78 1 A 78 SER 2 97.920 79 1 A 79 ILE 2 98.129 80 1 A 80 ARG 2 97.193 81 1 A 81 PRO 2 96.586 82 1 A 82 ASP 2 97.106 83 1 A 83 ASN 2 97.266 84 1 A 84 MET 2 96.184 85 1 A 85 SER 2 96.193 86 1 A 86 GLU 2 97.070 87 1 A 87 TYR 2 97.014 88 1 A 88 SER 2 96.146 89 1 A 89 LYS 2 97.109 90 1 A 90 GLN 2 97.754 91 1 A 91 MET 2 97.657 92 1 A 92 GLN 2 96.995 93 1 A 93 ARG 2 97.337 94 1 A 94 PHE 2 98.068 95 1 A 95 ASN 2 97.380 96 1 A 96 VAL 2 97.107 97 1 A 97 GLY 2 92.572 98 1 A 98 GLU 2 89.925 99 1 A 99 ASP 2 93.276 100 1 A 100 CYS 2 97.190 101 1 A 101 PRO 2 97.231 102 1 A 102 VAL 2 97.797 103 1 A 103 PHE 2 96.922 104 1 A 104 ASP 2 96.331 105 1 A 105 GLY 2 97.162 106 1 A 106 LEU 2 97.750 107 1 A 107 PHE 2 98.160 108 1 A 108 GLU 2 98.048 109 1 A 109 PHE 2 97.991 110 1 A 110 CYS 2 98.258 111 1 A 111 GLN 2 98.482 112 1 A 112 LEU 2 98.035 113 1 A 113 SER 2 97.593 114 1 A 114 THR 2 98.477 115 1 A 115 GLY 2 98.433 116 1 A 116 GLY 2 98.445 117 1 A 117 SER 2 98.730 118 1 A 118 VAL 2 98.618 119 1 A 119 ALA 2 98.418 120 1 A 120 SER 2 98.592 121 1 A 121 ALA 2 98.688 122 1 A 122 VAL 2 98.308 123 1 A 123 LYS 2 98.017 124 1 A 124 LEU 2 98.525 125 1 A 125 ASN 2 98.403 126 1 A 126 LYS 2 97.602 127 1 A 127 GLN 2 97.281 128 1 A 128 GLN 2 97.534 129 1 A 129 THR 2 98.062 130 1 A 130 ASP 2 98.368 131 1 A 131 ILE 2 98.782 132 1 A 132 ALA 2 98.824 133 1 A 133 VAL 2 98.882 134 1 A 134 ASN 2 98.781 135 1 A 135 TRP 2 98.770 136 1 A 136 ALA 2 98.100 137 1 A 137 GLY 2 98.147 138 1 A 138 GLY 2 98.144 139 1 A 139 LEU 2 97.565 140 1 A 140 HIS 2 97.560 141 1 A 141 HIS 2 97.184 142 1 A 142 ALA 2 97.482 143 1 A 143 LYS 2 96.637 144 1 A 144 LYS 2 96.663 145 1 A 145 SER 2 97.492 146 1 A 146 GLU 2 96.877 147 1 A 147 ALA 2 97.848 148 1 A 148 SER 2 95.733 149 1 A 149 GLY 2 92.254 150 1 A 150 PHE 2 95.892 151 1 A 151 CYS 2 97.765 152 1 A 152 TYR 2 98.413 153 1 A 153 VAL 2 98.579 154 1 A 154 ASN 2 98.671 155 1 A 155 ASP 2 98.760 156 1 A 156 ILE 2 98.882 157 1 A 157 VAL 2 98.810 158 1 A 158 LEU 2 98.793 159 1 A 159 ALA 2 98.844 160 1 A 160 ILE 2 98.862 161 1 A 161 LEU 2 98.701 162 1 A 162 GLU 2 98.457 163 1 A 163 LEU 2 98.733 164 1 A 164 LEU 2 98.365 165 1 A 165 LYS 2 96.690 166 1 A 166 TYR 2 97.028 167 1 A 167 HIS 2 96.455 168 1 A 168 GLN 2 94.942 169 1 A 169 ARG 2 96.875 170 1 A 170 VAL 2 98.745 171 1 A 171 LEU 2 98.887 172 1 A 172 TYR 2 98.920 173 1 A 173 ILE 2 98.923 174 1 A 174 ASP 2 98.805 175 1 A 175 ILE 2 98.588 176 1 A 176 ASP 2 97.474 177 1 A 177 ILE 2 95.764 178 1 A 178 HIS 2 95.062 179 1 A 179 HIS 2 94.319 180 1 A 180 GLY 2 92.299 181 1 A 181 ASP 2 96.086 182 1 A 182 GLY 2 97.329 183 1 A 183 VAL 2 98.535 184 1 A 184 GLU 2 98.011 185 1 A 185 GLU 2 96.997 186 1 A 186 ALA 2 98.050 187 1 A 187 PHE 2 98.171 188 1 A 188 TYR 2 97.331 189 1 A 189 THR 2 96.892 190 1 A 190 THR 2 95.963 191 1 A 191 ASP 2 95.985 192 1 A 192 ARG 2 97.592 193 1 A 193 VAL 2 98.499 194 1 A 194 MET 2 98.692 195 1 A 195 THR 2 98.851 196 1 A 196 VAL 2 98.855 197 1 A 197 SER 2 98.635 198 1 A 198 PHE 2 98.578 199 1 A 199 HIS 2 97.731 200 1 A 200 LYS 2 96.327 201 1 A 201 TYR 2 92.817 202 1 A 202 GLY 2 84.911 203 1 A 203 GLU 2 73.635 204 1 A 204 TYR 2 64.390 205 1 A 205 PHE 2 68.160 206 1 A 206 PRO 2 68.639 207 1 A 207 GLY 2 77.513 208 1 A 208 THR 2 86.683 209 1 A 209 GLY 2 92.394 210 1 A 210 ASP 2 94.733 211 1 A 211 LEU 2 95.497 212 1 A 212 ARG 2 95.714 213 1 A 213 ASP 2 95.705 214 1 A 214 ILE 2 97.677 215 1 A 215 GLY 2 97.128 216 1 A 216 ALA 2 97.263 217 1 A 217 GLY 2 95.417 218 1 A 218 LYS 2 94.933 219 1 A 219 GLY 2 96.295 220 1 A 220 LYS 2 97.498 221 1 A 221 TYR 2 98.005 222 1 A 222 TYR 2 98.224 223 1 A 223 ALA 2 98.448 224 1 A 224 VAL 2 98.583 225 1 A 225 ASN 2 98.518 226 1 A 226 TYR 2 98.348 227 1 A 227 PRO 2 97.368 228 1 A 228 LEU 2 97.948 229 1 A 229 ARG 2 97.209 230 1 A 230 ASP 2 97.356 231 1 A 231 GLY 2 98.033 232 1 A 232 ILE 2 98.655 233 1 A 233 ASP 2 98.639 234 1 A 234 ASP 2 98.618 235 1 A 235 GLU 2 98.423 236 1 A 236 SER 2 98.644 237 1 A 237 TYR 2 98.753 238 1 A 238 GLU 2 98.651 239 1 A 239 ALA 2 98.514 240 1 A 240 ILE 2 98.632 241 1 A 241 PHE 2 98.835 242 1 A 242 LYS 2 98.777 243 1 A 243 PRO 2 98.647 244 1 A 244 VAL 2 98.778 245 1 A 245 MET 2 98.830 246 1 A 246 SER 2 98.639 247 1 A 247 LYS 2 98.351 248 1 A 248 VAL 2 98.461 249 1 A 249 MET 2 98.019 250 1 A 250 GLU 2 96.138 251 1 A 251 MET 2 96.014 252 1 A 252 PHE 2 96.714 253 1 A 253 GLN 2 96.376 254 1 A 254 PRO 2 97.651 255 1 A 255 SER 2 98.132 256 1 A 256 ALA 2 98.728 257 1 A 257 VAL 2 98.909 258 1 A 258 VAL 2 98.951 259 1 A 259 LEU 2 98.895 260 1 A 260 GLN 2 98.668 261 1 A 261 CYS 2 98.662 262 1 A 262 GLY 2 98.200 263 1 A 263 SER 2 98.244 264 1 A 264 ASP 2 97.938 265 1 A 265 SER 2 98.042 266 1 A 266 LEU 2 98.538 267 1 A 267 SER 2 98.072 268 1 A 268 GLY 2 96.344 269 1 A 269 ASP 2 97.611 270 1 A 270 ARG 2 96.347 271 1 A 271 LEU 2 95.010 272 1 A 272 GLY 2 95.201 273 1 A 273 CYS 2 96.074 274 1 A 274 PHE 2 98.159 275 1 A 275 ASN 2 98.569 276 1 A 276 LEU 2 98.731 277 1 A 277 THR 2 98.767 278 1 A 278 ILE 2 98.752 279 1 A 279 LYS 2 98.580 280 1 A 280 GLY 2 98.575 281 1 A 281 HIS 2 98.724 282 1 A 282 ALA 2 98.790 283 1 A 283 LYS 2 98.768 284 1 A 284 CYS 2 98.809 285 1 A 285 VAL 2 98.766 286 1 A 286 GLU 2 98.629 287 1 A 287 PHE 2 98.829 288 1 A 288 VAL 2 98.770 289 1 A 289 LYS 2 98.196 290 1 A 290 SER 2 98.070 291 1 A 291 PHE 2 98.094 292 1 A 292 ASN 2 97.041 293 1 A 293 LEU 2 98.182 294 1 A 294 PRO 2 98.639 295 1 A 295 MET 2 98.797 296 1 A 296 LEU 2 98.916 297 1 A 297 MET 2 98.891 298 1 A 298 LEU 2 98.869 299 1 A 299 GLY 2 98.430 300 1 A 300 GLY 2 97.202 301 1 A 301 GLY 2 96.631 302 1 A 302 GLY 2 97.726 303 1 A 303 TYR 2 97.842 304 1 A 304 THR 2 98.021 305 1 A 305 ILE 2 97.948 306 1 A 306 ARG 2 97.916 307 1 A 307 ASN 2 98.265 308 1 A 308 VAL 2 98.667 309 1 A 309 ALA 2 98.735 310 1 A 310 ARG 2 98.798 311 1 A 311 CYS 2 98.866 312 1 A 312 TRP 2 98.874 313 1 A 313 THR 2 98.883 314 1 A 314 TYR 2 98.910 315 1 A 315 GLU 2 98.866 316 1 A 316 THR 2 98.836 317 1 A 317 ALA 2 98.767 318 1 A 318 VAL 2 98.650 319 1 A 319 ALA 2 98.540 320 1 A 320 LEU 2 98.390 321 1 A 321 ASP 2 97.617 322 1 A 322 THR 2 97.780 323 1 A 323 GLU 2 97.859 324 1 A 324 ILE 2 98.491 325 1 A 325 PRO 2 98.303 326 1 A 326 ASN 2 98.478 327 1 A 327 GLU 2 98.123 328 1 A 328 LEU 2 98.028 329 1 A 329 PRO 2 97.837 330 1 A 330 TYR 2 97.164 331 1 A 331 ASN 2 96.977 332 1 A 332 ASP 2 97.625 333 1 A 333 TYR 2 97.697 334 1 A 334 PHE 2 97.415 335 1 A 335 GLU 2 97.498 336 1 A 336 TYR 2 97.253 337 1 A 337 PHE 2 97.657 338 1 A 338 GLY 2 94.678 339 1 A 339 PRO 2 95.016 340 1 A 340 ASP 2 94.372 341 1 A 341 PHE 2 97.140 342 1 A 342 LYS 2 98.317 343 1 A 343 LEU 2 98.515 344 1 A 344 HIS 2 98.358 345 1 A 345 ILE 2 97.398 346 1 A 346 SER 2 96.463 347 1 A 347 PRO 2 96.221 348 1 A 348 SER 2 95.407 349 1 A 349 ASN 2 95.610 350 1 A 350 MET 2 96.297 351 1 A 351 THR 2 97.617 352 1 A 352 ASN 2 98.337 353 1 A 353 GLN 2 98.133 354 1 A 354 ASN 2 98.190 355 1 A 355 THR 2 98.166 356 1 A 356 ASN 2 98.041 357 1 A 357 GLU 2 98.376 358 1 A 358 TYR 2 98.345 359 1 A 359 LEU 2 98.632 360 1 A 360 GLU 2 98.386 361 1 A 361 LYS 2 98.372 362 1 A 362 ILE 2 98.483 363 1 A 363 LYS 2 98.475 364 1 A 364 GLN 2 98.257 365 1 A 365 ARG 2 98.301 366 1 A 366 LEU 2 98.498 367 1 A 367 PHE 2 98.479 368 1 A 368 GLU 2 97.655 369 1 A 369 ASN 2 97.620 370 1 A 370 LEU 2 97.075 371 1 A 371 ARG 2 94.784 372 1 A 372 MET 2 94.767 373 1 A 373 LEU 2 92.471 374 1 A 374 PRO 2 83.969 375 1 A 375 HIS 2 68.844 376 1 A 376 ALA 2 55.062 377 1 A 377 PRO 2 52.677 378 1 A 378 GLY 2 45.669 379 1 A 379 VAL 2 43.317 380 1 A 380 GLN 2 44.006 381 1 A 381 MET 2 49.359 382 1 A 382 GLN 2 52.322 383 1 A 383 ALA 2 56.860 384 1 A 384 ILE 2 59.744 385 1 A 385 PRO 2 60.741 386 1 A 386 GLU 2 62.714 387 1 A 387 ASP 2 55.994 388 1 A 388 ALA 2 55.037 389 1 A 389 ILE 2 45.335 390 1 A 390 PRO 2 47.162 391 1 A 391 GLU 2 38.198 392 1 A 392 GLU 2 33.120 393 1 B 1 ALA 2 42.212 394 1 B 2 PRO 2 37.499 395 1 B 3 VAL 2 38.698 396 1 B 4 GLN 2 37.712 397 1 B 5 SER 2 41.674 398 1 B 6 PRO 2 38.862 399 1 B 7 ARG 2 38.415 400 1 B 8 PRO 2 38.723 401 1 B 9 GLN 2 37.686 402 1 B 10 SER 2 37.947 403 1 B 11 GLN 2 36.996 404 1 B 12 PRO 2 36.974 405 1 B 13 PRO 2 39.160 406 1 B 14 HIS 2 34.349 407 1 B 15 SER 2 31.357 408 1 B 16 SER 2 32.533 409 1 B 17 PRO 2 32.762 410 1 B 18 SER 2 32.454 411 1 B 19 PRO 2 31.255 412 1 B 20 ARG 2 28.807 413 1 B 21 ILE 2 34.014 414 1 B 22 GLN 2 28.843 415 1 B 23 PRO 2 31.399 416 1 B 24 GLN 2 30.798 417 1 B 25 PRO 2 30.132 418 1 B 26 SER 2 29.551 419 1 B 27 PRO 2 33.033 420 1 B 28 HIS 2 30.136 421 1 B 29 HIS 2 28.019 422 1 B 30 VAL 2 28.146 423 1 B 31 SER 2 26.917 424 1 B 32 PRO 2 33.372 425 1 B 33 GLN 2 24.059 426 1 B 34 THR 2 29.303 427 1 B 35 GLY 2 29.155 428 1 B 36 SER 2 26.800 429 1 B 37 PRO 2 36.862 430 1 B 38 HIS 2 28.286 431 1 B 39 PRO 2 35.632 432 1 B 40 GLY 2 26.037 433 1 B 41 LEU 2 30.194 434 1 B 42 ALA 2 26.773 435 1 B 43 VAL 2 28.474 436 1 B 44 THR 2 23.445 437 1 B 45 MET 2 25.209 438 1 B 46 ALA 2 28.278 439 1 B 47 SER 2 24.615 440 1 B 48 SER 2 27.047 441 1 B 49 ILE 2 25.247 442 1 B 50 ASP 2 26.084 443 1 B 51 GLN 2 25.651 444 1 B 52 GLY 2 25.801 445 1 B 53 HIS 2 25.008 446 1 B 54 LEU 2 28.821 447 1 B 55 GLY 2 28.296 448 1 B 56 ASN 2 28.804 449 1 B 57 PRO 2 33.475 450 1 B 58 GLU 2 31.504 451 1 B 59 GLN 2 26.395 452 1 B 60 SER 2 31.281 453 1 B 61 ALA 2 29.279 454 1 B 62 MET 2 27.317 455 1 B 63 LEU 2 33.443 456 1 B 64 PRO 2 28.233 457 1 B 65 GLN 2 26.624 458 1 B 66 LEU 2 28.907 459 1 B 67 ASN 2 23.019 460 1 B 68 THR 2 28.588 461 1 B 69 PRO 2 27.770 462 1 B 70 SER 2 26.507 463 1 B 71 ARG 2 33.351 464 1 B 72 SER 2 27.816 465 1 B 73 ALA 2 25.663 466 1 B 74 LEU 2 25.106 467 1 B 75 SER 2 24.039 468 1 B 76 SER 2 24.971 469 1 B 77 GLU 2 23.979 470 1 B 78 LEU 2 23.300 471 1 B 79 SER 2 22.541 472 1 B 80 LEU 2 24.161 473 1 B 81 VAL 2 24.991 474 1 B 82 GLY 2 26.265 475 1 B 83 ASP 2 32.879 476 1 B 84 THR 2 31.688 477 1 B 85 THR 2 48.620 478 1 B 86 GLY 2 46.392 479 1 B 87 ASP 2 53.958 480 1 B 88 THR 2 70.180 481 1 B 89 LEU 2 80.002 482 1 B 90 GLU 2 79.665 483 1 B 91 LYS 2 78.447 484 1 B 92 PHE 2 83.639 485 1 B 93 VAL 2 84.089 486 1 B 94 GLU 2 81.444 487 1 B 95 GLY 2 74.904 488 1 B 96 LEU 2 79.677 _database_2.database_id ModelArchive _database_2.database_code ma-t3vr3-776 _database_2.pdbx_DOI 10.5452/ma-t3vr3-776 _pdbx_database_status.entry_id ma-t3vr3-776 _pdbx_database_status.date_coordinates 2022-09-28:22:27 _pdbx_database_status.status_code REL loop_ _pdbx_contact_author.id _pdbx_contact_author.name_salutation _pdbx_contact_author.name_first _pdbx_contact_author.name_last _pdbx_contact_author.name_mi _pdbx_contact_author.email _pdbx_contact_author.address_1 _pdbx_contact_author.address_2 _pdbx_contact_author.address_3 5 Prof. Qian Cong . Qian.Cong@UTSouthwestern.edu 'University of Texas Southwestern Medical Center' . . 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 2022-12-21 2 'Structure model' 1 1 2023-07-19 3 'Structure model' 1 2 2023-07-25 loop_ _pdbx_audit_revision_details.ordinal _pdbx_audit_revision_details.revision_ordinal _pdbx_audit_revision_details.data_content_type _pdbx_audit_revision_details.provider _pdbx_audit_revision_details.type _pdbx_audit_revision_details.description 1 1 'Structure model' repository 'Initial release' ? 2 3 'Structure model' repository Remediation 'Format compliance remediation' 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' Other 2 3 'Structure model' Other 3 3 'Structure model' 'Version format compliance' 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' exptl 2 3 'Structure model' ma_data 3 3 'Structure model' ma_associated_archive_file_details 4 3 'Structure model' audit_conform 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' '_exptl.entry_id' 2 2 'Structure model' '_exptl.method' 3 3 'Structure model' '_ma_data.content_type' 4 3 'Structure model' '_ma_data.content_type_other_details' 5 3 'Structure model' '_ma_associated_archive_file_details.data_id' 6 3 'Structure model' '_audit_conform.dict_location' 7 3 'Structure model' '_audit_conform.dict_version'