data_ma-ornl-sphdiv-21650 _entry.id ma-ornl-sphdiv-21650 _entry.ma_collection_id ma-ornl-sphdiv _struct.entry_id ma-ornl-sphdiv-21650 _struct.pdbx_model_details 'AlphaFold v2.0 was used to predict 5 structural models which were ranked with the pTM metric. The top ranked model was energy minimized with OpenMM version 7.6. The Amber ff99SB force field was used for parameters. MSAs and structural templates were calculated using Kalign, HMMER, and HHSuite using the MGnify, UniRef90, UniClust30, pdb70, RCSB PDB, and reduced BFD sequence libraries.' _struct.pdbx_structure_determination_methodology computational _struct.title 'AlphaFold2 model of Sphmag19G049700.1' _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 'Proteome-scale Deployment of Protein Structure Prediction Workflows on the Summit Supercomputer' 'In 2022 IEEE International Parallel and Distributed Processing Symposium Workshops (IPDPSW)' . 206 215 2022 . 10.1109/IPDPSW55747.2022.00045 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 'Gao M' 1 primary 'Coletti M' 2 primary 'Davidson RB' 3 primary 'Prout R' 4 primary 'Abraham S' 5 primary 'Hernandez B' 6 primary 'Sedova A' 7 2 'Jumper J' 8 2 'Evans R' 9 2 'Pritzel A' 10 2 'Green T' 11 2 'Figurnov M' 12 2 'Ronneberger O' 13 2 'Tunyasuvunakool K' 14 2 'Bates R' 15 2 'Zidek A' 16 2 'Potapenko A' 17 2 'Bridgland A' 18 2 'Meyer C' 19 2 'Kohl SAA' 20 2 'Ballard AJ' 21 2 'Cowie A' 22 2 'Romera-Paredes B' 23 2 'Nikolov S' 24 2 'Jain R' 25 2 'Adler J' 26 2 'Back T' 27 2 'Petersen S' 28 2 'Reiman D' 29 2 'Clancy E' 30 2 'Zielinski M' 31 2 'Steinegger M' 32 2 'Pacholska M' 33 2 'Berghammer T' 34 2 'Bodenstein S' 35 2 'Silver D' 36 2 'Vinyals O' 37 2 'Senior AW' 38 2 'Kavukcuoglu K' 39 2 'Kohli P' 40 2 'Hassabis D' 41 loop_ _software.pdbx_ordinal _software.name _software.classification _software.description _software.version _software.type _software.location _software.citation_id 1 AlphaFold 'model building' . 2.0.1 program 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 'Gao M' 1 'Coletti M' 2 'Davidson RB' 3 'Prout R' 4 'Abraham S' 5 'Hernandez B' 6 'Sedova A' 7 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 man Sphmag19G049700.1 49450.628 1 . 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 Other Phytozyme . 41943550 ? 1 401 2779801 'Sphagnum divinum' . . 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 ;MGAAGETGTTAAVSKASKGGAAAAVTAAPPSTYAEWAAAFQAYYSAGGQPPPGAAFAGHPYMWGGQPMMP PYGTPHPQYGAMYHPAGMYAHPAMYGQYGLQSDTMMNSDQTETKPELKDTDSGKNQAQKQSPLKRSQGSK GSLAMIIGGKGSEGEKGNGGVVMSHSSNGDDNENESGSEGSTGGSEENKNEQHNRQKVNLGEVATDATGV ESYGAHPVQSVSGTPAAGGSLDMSLDHWNAGNAPVKTGKQMSASPSVNATPPADLWLQDEREVKRQRRKQ SNRESARRSRLRKQAECEELGARVDTLAVENLALRNELAWFTEECKRLEAANASLVEQMRNTSKDVADTS ATPEASAVVGQDAPANKHEETESKSQGNGNVKRTDNTPAGVKREQGELLPS ; ;MGAAGETGTTAAVSKASKGGAAAAVTAAPPSTYAEWAAAFQAYYSAGGQPPPGAAFAGHPYMWGGQPMMP PYGTPHPQYGAMYHPAGMYAHPAMYGQYGLQSDTMMNSDQTETKPELKDTDSGKNQAQKQSPLKRSQGSK GSLAMIIGGKGSEGEKGNGGVVMSHSSNGDDNENESGSEGSTGGSEENKNEQHNRQKVNLGEVATDATGV ESYGAHPVQSVSGTPAAGGSLDMSLDHWNAGNAPVKTGKQMSASPSVNATPPADLWLQDEREVKRQRRKQ SNRESARRSRLRKQAECEELGARVDTLAVENLALRNELAWFTEECKRLEAANASLVEQMRNTSKDVADTS ATPEASAVVGQDAPANKHEETESKSQGNGNVKRTDNTPAGVKREQGELLPS ; loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 MET . 1 2 GLY . 1 3 ALA . 1 4 ALA . 1 5 GLY . 1 6 GLU . 1 7 THR . 1 8 GLY . 1 9 THR . 1 10 THR . 1 11 ALA . 1 12 ALA . 1 13 VAL . 1 14 SER . 1 15 LYS . 1 16 ALA . 1 17 SER . 1 18 LYS . 1 19 GLY . 1 20 GLY . 1 21 ALA . 1 22 ALA . 1 23 ALA . 1 24 ALA . 1 25 VAL . 1 26 THR . 1 27 ALA . 1 28 ALA . 1 29 PRO . 1 30 PRO . 1 31 SER . 1 32 THR . 1 33 TYR . 1 34 ALA . 1 35 GLU . 1 36 TRP . 1 37 ALA . 1 38 ALA . 1 39 ALA . 1 40 PHE . 1 41 GLN . 1 42 ALA . 1 43 TYR . 1 44 TYR . 1 45 SER . 1 46 ALA . 1 47 GLY . 1 48 GLY . 1 49 GLN . 1 50 PRO . 1 51 PRO . 1 52 PRO . 1 53 GLY . 1 54 ALA . 1 55 ALA . 1 56 PHE . 1 57 ALA . 1 58 GLY . 1 59 HIS . 1 60 PRO . 1 61 TYR . 1 62 MET . 1 63 TRP . 1 64 GLY . 1 65 GLY . 1 66 GLN . 1 67 PRO . 1 68 MET . 1 69 MET . 1 70 PRO . 1 71 PRO . 1 72 TYR . 1 73 GLY . 1 74 THR . 1 75 PRO . 1 76 HIS . 1 77 PRO . 1 78 GLN . 1 79 TYR . 1 80 GLY . 1 81 ALA . 1 82 MET . 1 83 TYR . 1 84 HIS . 1 85 PRO . 1 86 ALA . 1 87 GLY . 1 88 MET . 1 89 TYR . 1 90 ALA . 1 91 HIS . 1 92 PRO . 1 93 ALA . 1 94 MET . 1 95 TYR . 1 96 GLY . 1 97 GLN . 1 98 TYR . 1 99 GLY . 1 100 LEU . 1 101 GLN . 1 102 SER . 1 103 ASP . 1 104 THR . 1 105 MET . 1 106 MET . 1 107 ASN . 1 108 SER . 1 109 ASP . 1 110 GLN . 1 111 THR . 1 112 GLU . 1 113 THR . 1 114 LYS . 1 115 PRO . 1 116 GLU . 1 117 LEU . 1 118 LYS . 1 119 ASP . 1 120 THR . 1 121 ASP . 1 122 SER . 1 123 GLY . 1 124 LYS . 1 125 ASN . 1 126 GLN . 1 127 ALA . 1 128 GLN . 1 129 LYS . 1 130 GLN . 1 131 SER . 1 132 PRO . 1 133 LEU . 1 134 LYS . 1 135 ARG . 1 136 SER . 1 137 GLN . 1 138 GLY . 1 139 SER . 1 140 LYS . 1 141 GLY . 1 142 SER . 1 143 LEU . 1 144 ALA . 1 145 MET . 1 146 ILE . 1 147 ILE . 1 148 GLY . 1 149 GLY . 1 150 LYS . 1 151 GLY . 1 152 SER . 1 153 GLU . 1 154 GLY . 1 155 GLU . 1 156 LYS . 1 157 GLY . 1 158 ASN . 1 159 GLY . 1 160 GLY . 1 161 VAL . 1 162 VAL . 1 163 MET . 1 164 SER . 1 165 HIS . 1 166 SER . 1 167 SER . 1 168 ASN . 1 169 GLY . 1 170 ASP . 1 171 ASP . 1 172 ASN . 1 173 GLU . 1 174 ASN . 1 175 GLU . 1 176 SER . 1 177 GLY . 1 178 SER . 1 179 GLU . 1 180 GLY . 1 181 SER . 1 182 THR . 1 183 GLY . 1 184 GLY . 1 185 SER . 1 186 GLU . 1 187 GLU . 1 188 ASN . 1 189 LYS . 1 190 ASN . 1 191 GLU . 1 192 GLN . 1 193 HIS . 1 194 ASN . 1 195 ARG . 1 196 GLN . 1 197 LYS . 1 198 VAL . 1 199 ASN . 1 200 LEU . 1 201 GLY . 1 202 GLU . 1 203 VAL . 1 204 ALA . 1 205 THR . 1 206 ASP . 1 207 ALA . 1 208 THR . 1 209 GLY . 1 210 VAL . 1 211 GLU . 1 212 SER . 1 213 TYR . 1 214 GLY . 1 215 ALA . 1 216 HIS . 1 217 PRO . 1 218 VAL . 1 219 GLN . 1 220 SER . 1 221 VAL . 1 222 SER . 1 223 GLY . 1 224 THR . 1 225 PRO . 1 226 ALA . 1 227 ALA . 1 228 GLY . 1 229 GLY . 1 230 SER . 1 231 LEU . 1 232 ASP . 1 233 MET . 1 234 SER . 1 235 LEU . 1 236 ASP . 1 237 HIS . 1 238 TRP . 1 239 ASN . 1 240 ALA . 1 241 GLY . 1 242 ASN . 1 243 ALA . 1 244 PRO . 1 245 VAL . 1 246 LYS . 1 247 THR . 1 248 GLY . 1 249 LYS . 1 250 GLN . 1 251 MET . 1 252 SER . 1 253 ALA . 1 254 SER . 1 255 PRO . 1 256 SER . 1 257 VAL . 1 258 ASN . 1 259 ALA . 1 260 THR . 1 261 PRO . 1 262 PRO . 1 263 ALA . 1 264 ASP . 1 265 LEU . 1 266 TRP . 1 267 LEU . 1 268 GLN . 1 269 ASP . 1 270 GLU . 1 271 ARG . 1 272 GLU . 1 273 VAL . 1 274 LYS . 1 275 ARG . 1 276 GLN . 1 277 ARG . 1 278 ARG . 1 279 LYS . 1 280 GLN . 1 281 SER . 1 282 ASN . 1 283 ARG . 1 284 GLU . 1 285 SER . 1 286 ALA . 1 287 ARG . 1 288 ARG . 1 289 SER . 1 290 ARG . 1 291 LEU . 1 292 ARG . 1 293 LYS . 1 294 GLN . 1 295 ALA . 1 296 GLU . 1 297 CYS . 1 298 GLU . 1 299 GLU . 1 300 LEU . 1 301 GLY . 1 302 ALA . 1 303 ARG . 1 304 VAL . 1 305 ASP . 1 306 THR . 1 307 LEU . 1 308 ALA . 1 309 VAL . 1 310 GLU . 1 311 ASN . 1 312 LEU . 1 313 ALA . 1 314 LEU . 1 315 ARG . 1 316 ASN . 1 317 GLU . 1 318 LEU . 1 319 ALA . 1 320 TRP . 1 321 PHE . 1 322 THR . 1 323 GLU . 1 324 GLU . 1 325 CYS . 1 326 LYS . 1 327 ARG . 1 328 LEU . 1 329 GLU . 1 330 ALA . 1 331 ALA . 1 332 ASN . 1 333 ALA . 1 334 SER . 1 335 LEU . 1 336 VAL . 1 337 GLU . 1 338 GLN . 1 339 MET . 1 340 ARG . 1 341 ASN . 1 342 THR . 1 343 SER . 1 344 LYS . 1 345 ASP . 1 346 VAL . 1 347 ALA . 1 348 ASP . 1 349 THR . 1 350 SER . 1 351 ALA . 1 352 THR . 1 353 PRO . 1 354 GLU . 1 355 ALA . 1 356 SER . 1 357 ALA . 1 358 VAL . 1 359 VAL . 1 360 GLY . 1 361 GLN . 1 362 ASP . 1 363 ALA . 1 364 PRO . 1 365 ALA . 1 366 ASN . 1 367 LYS . 1 368 HIS . 1 369 GLU . 1 370 GLU . 1 371 THR . 1 372 GLU . 1 373 SER . 1 374 LYS . 1 375 SER . 1 376 GLN . 1 377 GLY . 1 378 ASN . 1 379 GLY . 1 380 ASN . 1 381 VAL . 1 382 LYS . 1 383 ARG . 1 384 THR . 1 385 ASP . 1 386 ASN . 1 387 THR . 1 388 PRO . 1 389 ALA . 1 390 GLY . 1 391 VAL . 1 392 LYS . 1 393 ARG . 1 394 GLU . 1 395 GLN . 1 396 GLY . 1 397 GLU . 1 398 LEU . 1 399 LEU . 1 400 PRO . 1 401 SER . loop_ _struct_asym.id _struct_asym.entity_id _struct_asym.details A 1 ? 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 GLY 2 2 GLY GLY A . A 1 3 ALA 3 3 ALA ALA A . A 1 4 ALA 4 4 ALA ALA A . A 1 5 GLY 5 5 GLY GLY A . A 1 6 GLU 6 6 GLU GLU A . A 1 7 THR 7 7 THR THR A . A 1 8 GLY 8 8 GLY GLY A . A 1 9 THR 9 9 THR THR A . A 1 10 THR 10 10 THR THR A . A 1 11 ALA 11 11 ALA ALA A . A 1 12 ALA 12 12 ALA ALA A . A 1 13 VAL 13 13 VAL VAL A . A 1 14 SER 14 14 SER SER A . A 1 15 LYS 15 15 LYS LYS A . A 1 16 ALA 16 16 ALA ALA A . A 1 17 SER 17 17 SER SER A . A 1 18 LYS 18 18 LYS LYS A . A 1 19 GLY 19 19 GLY GLY A . A 1 20 GLY 20 20 GLY GLY A . A 1 21 ALA 21 21 ALA ALA A . A 1 22 ALA 22 22 ALA ALA A . A 1 23 ALA 23 23 ALA ALA A . A 1 24 ALA 24 24 ALA ALA A . A 1 25 VAL 25 25 VAL VAL A . A 1 26 THR 26 26 THR THR A . A 1 27 ALA 27 27 ALA ALA A . A 1 28 ALA 28 28 ALA ALA A . A 1 29 PRO 29 29 PRO PRO A . A 1 30 PRO 30 30 PRO PRO A . A 1 31 SER 31 31 SER SER A . A 1 32 THR 32 32 THR THR A . A 1 33 TYR 33 33 TYR TYR A . A 1 34 ALA 34 34 ALA ALA A . A 1 35 GLU 35 35 GLU GLU A . A 1 36 TRP 36 36 TRP TRP A . A 1 37 ALA 37 37 ALA ALA A . A 1 38 ALA 38 38 ALA ALA A . A 1 39 ALA 39 39 ALA ALA A . A 1 40 PHE 40 40 PHE PHE A . A 1 41 GLN 41 41 GLN GLN A . A 1 42 ALA 42 42 ALA ALA A . A 1 43 TYR 43 43 TYR TYR A . A 1 44 TYR 44 44 TYR TYR A . A 1 45 SER 45 45 SER SER A . A 1 46 ALA 46 46 ALA ALA A . A 1 47 GLY 47 47 GLY GLY A . A 1 48 GLY 48 48 GLY GLY A . A 1 49 GLN 49 49 GLN GLN A . A 1 50 PRO 50 50 PRO PRO A . A 1 51 PRO 51 51 PRO PRO A . A 1 52 PRO 52 52 PRO PRO A . A 1 53 GLY 53 53 GLY GLY A . A 1 54 ALA 54 54 ALA ALA A . A 1 55 ALA 55 55 ALA ALA A . A 1 56 PHE 56 56 PHE PHE A . A 1 57 ALA 57 57 ALA ALA A . A 1 58 GLY 58 58 GLY GLY A . A 1 59 HIS 59 59 HIS HIS A . A 1 60 PRO 60 60 PRO PRO A . A 1 61 TYR 61 61 TYR TYR A . A 1 62 MET 62 62 MET MET A . A 1 63 TRP 63 63 TRP TRP A . A 1 64 GLY 64 64 GLY GLY A . A 1 65 GLY 65 65 GLY GLY A . A 1 66 GLN 66 66 GLN GLN A . A 1 67 PRO 67 67 PRO PRO A . A 1 68 MET 68 68 MET MET A . A 1 69 MET 69 69 MET MET A . A 1 70 PRO 70 70 PRO PRO A . A 1 71 PRO 71 71 PRO PRO A . A 1 72 TYR 72 72 TYR TYR A . A 1 73 GLY 73 73 GLY GLY A . A 1 74 THR 74 74 THR THR A . A 1 75 PRO 75 75 PRO PRO A . A 1 76 HIS 76 76 HIS HIS A . A 1 77 PRO 77 77 PRO PRO A . A 1 78 GLN 78 78 GLN GLN A . A 1 79 TYR 79 79 TYR TYR A . A 1 80 GLY 80 80 GLY GLY A . A 1 81 ALA 81 81 ALA ALA A . A 1 82 MET 82 82 MET MET A . A 1 83 TYR 83 83 TYR TYR A . A 1 84 HIS 84 84 HIS HIS A . A 1 85 PRO 85 85 PRO PRO A . A 1 86 ALA 86 86 ALA ALA A . A 1 87 GLY 87 87 GLY GLY A . A 1 88 MET 88 88 MET MET A . A 1 89 TYR 89 89 TYR TYR A . A 1 90 ALA 90 90 ALA ALA A . A 1 91 HIS 91 91 HIS HIS A . A 1 92 PRO 92 92 PRO PRO A . A 1 93 ALA 93 93 ALA ALA A . A 1 94 MET 94 94 MET MET A . A 1 95 TYR 95 95 TYR TYR A . A 1 96 GLY 96 96 GLY GLY A . A 1 97 GLN 97 97 GLN GLN A . A 1 98 TYR 98 98 TYR TYR A . A 1 99 GLY 99 99 GLY GLY A . A 1 100 LEU 100 100 LEU LEU A . A 1 101 GLN 101 101 GLN GLN A . A 1 102 SER 102 102 SER SER A . A 1 103 ASP 103 103 ASP ASP A . A 1 104 THR 104 104 THR THR A . A 1 105 MET 105 105 MET MET A . A 1 106 MET 106 106 MET MET A . A 1 107 ASN 107 107 ASN ASN A . A 1 108 SER 108 108 SER SER A . A 1 109 ASP 109 109 ASP ASP A . A 1 110 GLN 110 110 GLN GLN A . A 1 111 THR 111 111 THR THR A . A 1 112 GLU 112 112 GLU GLU A . A 1 113 THR 113 113 THR THR A . A 1 114 LYS 114 114 LYS LYS A . A 1 115 PRO 115 115 PRO PRO A . A 1 116 GLU 116 116 GLU GLU A . A 1 117 LEU 117 117 LEU LEU A . A 1 118 LYS 118 118 LYS LYS A . A 1 119 ASP 119 119 ASP ASP A . A 1 120 THR 120 120 THR THR A . A 1 121 ASP 121 121 ASP ASP A . A 1 122 SER 122 122 SER SER A . A 1 123 GLY 123 123 GLY GLY A . A 1 124 LYS 124 124 LYS LYS A . A 1 125 ASN 125 125 ASN ASN A . A 1 126 GLN 126 126 GLN GLN A . A 1 127 ALA 127 127 ALA ALA A . A 1 128 GLN 128 128 GLN GLN A . A 1 129 LYS 129 129 LYS LYS A . A 1 130 GLN 130 130 GLN GLN A . A 1 131 SER 131 131 SER SER A . A 1 132 PRO 132 132 PRO PRO A . A 1 133 LEU 133 133 LEU LEU A . A 1 134 LYS 134 134 LYS LYS A . A 1 135 ARG 135 135 ARG ARG A . A 1 136 SER 136 136 SER SER A . A 1 137 GLN 137 137 GLN GLN A . A 1 138 GLY 138 138 GLY GLY A . A 1 139 SER 139 139 SER SER A . A 1 140 LYS 140 140 LYS LYS A . A 1 141 GLY 141 141 GLY GLY A . A 1 142 SER 142 142 SER SER A . A 1 143 LEU 143 143 LEU LEU A . A 1 144 ALA 144 144 ALA ALA A . A 1 145 MET 145 145 MET MET A . A 1 146 ILE 146 146 ILE ILE A . A 1 147 ILE 147 147 ILE ILE A . A 1 148 GLY 148 148 GLY GLY A . A 1 149 GLY 149 149 GLY GLY A . A 1 150 LYS 150 150 LYS LYS A . A 1 151 GLY 151 151 GLY GLY A . A 1 152 SER 152 152 SER SER A . A 1 153 GLU 153 153 GLU GLU A . A 1 154 GLY 154 154 GLY GLY A . A 1 155 GLU 155 155 GLU GLU A . A 1 156 LYS 156 156 LYS LYS A . A 1 157 GLY 157 157 GLY GLY A . A 1 158 ASN 158 158 ASN ASN A . A 1 159 GLY 159 159 GLY GLY A . A 1 160 GLY 160 160 GLY GLY A . A 1 161 VAL 161 161 VAL VAL A . A 1 162 VAL 162 162 VAL VAL A . A 1 163 MET 163 163 MET MET A . A 1 164 SER 164 164 SER SER A . A 1 165 HIS 165 165 HIS HIS A . A 1 166 SER 166 166 SER SER A . A 1 167 SER 167 167 SER SER A . A 1 168 ASN 168 168 ASN ASN A . A 1 169 GLY 169 169 GLY GLY A . A 1 170 ASP 170 170 ASP ASP A . A 1 171 ASP 171 171 ASP ASP A . A 1 172 ASN 172 172 ASN ASN A . A 1 173 GLU 173 173 GLU GLU A . A 1 174 ASN 174 174 ASN ASN A . A 1 175 GLU 175 175 GLU GLU A . A 1 176 SER 176 176 SER SER A . A 1 177 GLY 177 177 GLY GLY A . A 1 178 SER 178 178 SER SER A . A 1 179 GLU 179 179 GLU GLU A . A 1 180 GLY 180 180 GLY GLY A . A 1 181 SER 181 181 SER SER A . A 1 182 THR 182 182 THR THR A . A 1 183 GLY 183 183 GLY GLY A . A 1 184 GLY 184 184 GLY GLY A . A 1 185 SER 185 185 SER SER A . A 1 186 GLU 186 186 GLU GLU A . A 1 187 GLU 187 187 GLU GLU A . A 1 188 ASN 188 188 ASN ASN A . A 1 189 LYS 189 189 LYS LYS A . A 1 190 ASN 190 190 ASN ASN A . A 1 191 GLU 191 191 GLU GLU A . A 1 192 GLN 192 192 GLN GLN A . A 1 193 HIS 193 193 HIS HIS A . A 1 194 ASN 194 194 ASN ASN A . A 1 195 ARG 195 195 ARG ARG A . A 1 196 GLN 196 196 GLN GLN A . A 1 197 LYS 197 197 LYS LYS A . A 1 198 VAL 198 198 VAL VAL A . A 1 199 ASN 199 199 ASN ASN A . A 1 200 LEU 200 200 LEU LEU A . A 1 201 GLY 201 201 GLY GLY A . A 1 202 GLU 202 202 GLU GLU A . A 1 203 VAL 203 203 VAL VAL A . A 1 204 ALA 204 204 ALA ALA A . A 1 205 THR 205 205 THR THR A . A 1 206 ASP 206 206 ASP ASP A . A 1 207 ALA 207 207 ALA ALA A . A 1 208 THR 208 208 THR THR A . A 1 209 GLY 209 209 GLY GLY A . A 1 210 VAL 210 210 VAL VAL A . A 1 211 GLU 211 211 GLU GLU A . A 1 212 SER 212 212 SER SER A . A 1 213 TYR 213 213 TYR TYR A . A 1 214 GLY 214 214 GLY GLY A . A 1 215 ALA 215 215 ALA ALA A . A 1 216 HIS 216 216 HIS HIS A . A 1 217 PRO 217 217 PRO PRO A . A 1 218 VAL 218 218 VAL VAL A . A 1 219 GLN 219 219 GLN GLN A . A 1 220 SER 220 220 SER SER A . A 1 221 VAL 221 221 VAL VAL A . A 1 222 SER 222 222 SER SER A . A 1 223 GLY 223 223 GLY GLY A . A 1 224 THR 224 224 THR THR A . A 1 225 PRO 225 225 PRO PRO A . A 1 226 ALA 226 226 ALA ALA A . A 1 227 ALA 227 227 ALA ALA A . A 1 228 GLY 228 228 GLY GLY A . A 1 229 GLY 229 229 GLY GLY A . A 1 230 SER 230 230 SER SER A . A 1 231 LEU 231 231 LEU LEU A . A 1 232 ASP 232 232 ASP ASP A . A 1 233 MET 233 233 MET MET A . A 1 234 SER 234 234 SER SER A . A 1 235 LEU 235 235 LEU LEU A . A 1 236 ASP 236 236 ASP ASP A . A 1 237 HIS 237 237 HIS HIS A . A 1 238 TRP 238 238 TRP TRP A . A 1 239 ASN 239 239 ASN ASN A . A 1 240 ALA 240 240 ALA ALA A . A 1 241 GLY 241 241 GLY GLY A . A 1 242 ASN 242 242 ASN ASN A . A 1 243 ALA 243 243 ALA ALA A . A 1 244 PRO 244 244 PRO PRO A . A 1 245 VAL 245 245 VAL VAL A . A 1 246 LYS 246 246 LYS LYS A . A 1 247 THR 247 247 THR THR A . A 1 248 GLY 248 248 GLY GLY A . A 1 249 LYS 249 249 LYS LYS A . A 1 250 GLN 250 250 GLN GLN A . A 1 251 MET 251 251 MET MET A . A 1 252 SER 252 252 SER SER A . A 1 253 ALA 253 253 ALA ALA A . A 1 254 SER 254 254 SER SER A . A 1 255 PRO 255 255 PRO PRO A . A 1 256 SER 256 256 SER SER A . A 1 257 VAL 257 257 VAL VAL A . A 1 258 ASN 258 258 ASN ASN A . A 1 259 ALA 259 259 ALA ALA A . A 1 260 THR 260 260 THR THR A . A 1 261 PRO 261 261 PRO PRO A . A 1 262 PRO 262 262 PRO PRO A . A 1 263 ALA 263 263 ALA ALA A . A 1 264 ASP 264 264 ASP ASP A . A 1 265 LEU 265 265 LEU LEU A . A 1 266 TRP 266 266 TRP TRP A . A 1 267 LEU 267 267 LEU LEU A . A 1 268 GLN 268 268 GLN GLN A . A 1 269 ASP 269 269 ASP ASP A . A 1 270 GLU 270 270 GLU GLU A . A 1 271 ARG 271 271 ARG ARG A . A 1 272 GLU 272 272 GLU GLU A . A 1 273 VAL 273 273 VAL VAL A . A 1 274 LYS 274 274 LYS LYS A . A 1 275 ARG 275 275 ARG ARG A . A 1 276 GLN 276 276 GLN GLN A . A 1 277 ARG 277 277 ARG ARG A . A 1 278 ARG 278 278 ARG ARG A . A 1 279 LYS 279 279 LYS LYS A . A 1 280 GLN 280 280 GLN GLN A . A 1 281 SER 281 281 SER SER A . A 1 282 ASN 282 282 ASN ASN A . A 1 283 ARG 283 283 ARG ARG A . A 1 284 GLU 284 284 GLU GLU A . A 1 285 SER 285 285 SER SER A . A 1 286 ALA 286 286 ALA ALA A . A 1 287 ARG 287 287 ARG ARG A . A 1 288 ARG 288 288 ARG ARG A . A 1 289 SER 289 289 SER SER A . A 1 290 ARG 290 290 ARG ARG A . A 1 291 LEU 291 291 LEU LEU A . A 1 292 ARG 292 292 ARG ARG A . A 1 293 LYS 293 293 LYS LYS A . A 1 294 GLN 294 294 GLN GLN A . A 1 295 ALA 295 295 ALA ALA A . A 1 296 GLU 296 296 GLU GLU A . A 1 297 CYS 297 297 CYS CYS A . A 1 298 GLU 298 298 GLU GLU A . A 1 299 GLU 299 299 GLU GLU A . A 1 300 LEU 300 300 LEU LEU A . A 1 301 GLY 301 301 GLY GLY A . A 1 302 ALA 302 302 ALA ALA A . A 1 303 ARG 303 303 ARG ARG A . A 1 304 VAL 304 304 VAL VAL A . A 1 305 ASP 305 305 ASP ASP A . A 1 306 THR 306 306 THR THR A . A 1 307 LEU 307 307 LEU LEU A . A 1 308 ALA 308 308 ALA ALA A . A 1 309 VAL 309 309 VAL VAL A . A 1 310 GLU 310 310 GLU GLU A . A 1 311 ASN 311 311 ASN ASN A . A 1 312 LEU 312 312 LEU LEU A . A 1 313 ALA 313 313 ALA ALA A . A 1 314 LEU 314 314 LEU LEU A . A 1 315 ARG 315 315 ARG ARG A . A 1 316 ASN 316 316 ASN ASN A . A 1 317 GLU 317 317 GLU GLU A . A 1 318 LEU 318 318 LEU LEU A . A 1 319 ALA 319 319 ALA ALA A . A 1 320 TRP 320 320 TRP TRP A . A 1 321 PHE 321 321 PHE PHE A . A 1 322 THR 322 322 THR THR A . A 1 323 GLU 323 323 GLU GLU A . A 1 324 GLU 324 324 GLU GLU A . A 1 325 CYS 325 325 CYS CYS A . A 1 326 LYS 326 326 LYS LYS A . A 1 327 ARG 327 327 ARG ARG A . A 1 328 LEU 328 328 LEU LEU A . A 1 329 GLU 329 329 GLU GLU A . A 1 330 ALA 330 330 ALA ALA A . A 1 331 ALA 331 331 ALA ALA A . A 1 332 ASN 332 332 ASN ASN A . A 1 333 ALA 333 333 ALA ALA A . A 1 334 SER 334 334 SER SER A . A 1 335 LEU 335 335 LEU LEU A . A 1 336 VAL 336 336 VAL VAL A . A 1 337 GLU 337 337 GLU GLU A . A 1 338 GLN 338 338 GLN GLN A . A 1 339 MET 339 339 MET MET A . A 1 340 ARG 340 340 ARG ARG A . A 1 341 ASN 341 341 ASN ASN A . A 1 342 THR 342 342 THR THR A . A 1 343 SER 343 343 SER SER A . A 1 344 LYS 344 344 LYS LYS A . A 1 345 ASP 345 345 ASP ASP A . A 1 346 VAL 346 346 VAL VAL A . A 1 347 ALA 347 347 ALA ALA A . A 1 348 ASP 348 348 ASP ASP A . A 1 349 THR 349 349 THR THR A . A 1 350 SER 350 350 SER SER A . A 1 351 ALA 351 351 ALA ALA A . A 1 352 THR 352 352 THR THR A . A 1 353 PRO 353 353 PRO PRO A . A 1 354 GLU 354 354 GLU GLU A . A 1 355 ALA 355 355 ALA ALA A . A 1 356 SER 356 356 SER SER A . A 1 357 ALA 357 357 ALA ALA A . A 1 358 VAL 358 358 VAL VAL A . A 1 359 VAL 359 359 VAL VAL A . A 1 360 GLY 360 360 GLY GLY A . A 1 361 GLN 361 361 GLN GLN A . A 1 362 ASP 362 362 ASP ASP A . A 1 363 ALA 363 363 ALA ALA A . A 1 364 PRO 364 364 PRO PRO A . A 1 365 ALA 365 365 ALA ALA A . A 1 366 ASN 366 366 ASN ASN A . A 1 367 LYS 367 367 LYS LYS A . A 1 368 HIS 368 368 HIS HIS A . A 1 369 GLU 369 369 GLU GLU A . A 1 370 GLU 370 370 GLU GLU A . A 1 371 THR 371 371 THR THR A . A 1 372 GLU 372 372 GLU GLU A . A 1 373 SER 373 373 SER SER A . A 1 374 LYS 374 374 LYS LYS A . A 1 375 SER 375 375 SER SER A . A 1 376 GLN 376 376 GLN GLN A . A 1 377 GLY 377 377 GLY GLY A . A 1 378 ASN 378 378 ASN ASN A . A 1 379 GLY 379 379 GLY GLY A . A 1 380 ASN 380 380 ASN ASN A . A 1 381 VAL 381 381 VAL VAL A . A 1 382 LYS 382 382 LYS LYS A . A 1 383 ARG 383 383 ARG ARG A . A 1 384 THR 384 384 THR THR A . A 1 385 ASP 385 385 ASP ASP A . A 1 386 ASN 386 386 ASN ASN A . A 1 387 THR 387 387 THR THR A . A 1 388 PRO 388 388 PRO PRO A . A 1 389 ALA 389 389 ALA ALA A . A 1 390 GLY 390 390 GLY GLY A . A 1 391 VAL 391 391 VAL VAL A . A 1 392 LYS 392 392 LYS LYS A . A 1 393 ARG 393 393 ARG ARG A . A 1 394 GLU 394 394 GLU GLU A . A 1 395 GLN 395 395 GLN GLN A . A 1 396 GLY 396 396 GLY GLY A . A 1 397 GLU 397 397 GLU GLU A . A 1 398 LEU 398 398 LEU LEU A . A 1 399 LEU 399 399 LEU LEU A . A 1 400 PRO 400 400 PRO PRO A . A 1 401 SER 401 401 SER SER A . loop_ _ma_data.id _ma_data.name _ma_data.content_type _ma_data.content_type_other_details 1 Sphmag19G049700.1 target . 2 'Top scoring model' 'model coordinates' . loop_ _ma_data_group.ordinal_id _ma_data_group.group_id _ma_data_group.data_id 1 1 1 2 2 2 loop_ _ma_target_entity.entity_id _ma_target_entity.data_id _ma_target_entity.origin 1 1 'reference database' loop_ _ma_target_entity_instance.asym_id _ma_target_entity_instance.entity_id _ma_target_entity_instance.details A 1 ? 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 1 1 1 modeling AlphaFold . 1 2 1 2 'model selection' AlphaFold . 1 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 'Top scoring model' . 2 '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 41.203 49.537 43.146 1.000 1 A 36.340 1 ATOM 2 C CA . MET 1 1 ? A 42.565 49.553 42.571 1.000 1 A 36.340 1 ATOM 3 C C . MET 1 1 ? A 43.000 48.123 42.329 1.000 1 A 36.340 1 ATOM 4 C CB . MET 1 1 ? A 43.583 50.231 43.503 1.000 1 A 36.340 1 ATOM 5 O O . MET 1 1 ? A 42.926 47.328 43.254 1.000 1 A 36.340 1 ATOM 6 C CG . MET 1 1 ? A 43.720 51.732 43.242 1.000 1 A 36.340 1 ATOM 7 S SD . MET 1 1 ? A 44.805 52.522 44.458 1.000 1 A 36.340 1 ATOM 8 C CE . MET 1 1 ? A 45.448 53.927 43.507 1.000 1 A 36.340 1 ATOM 9 N N . GLY 2 2 ? A 43.432 47.835 41.105 1.000 1 A 37.930 1 ATOM 10 C CA . GLY 2 2 ? A 44.035 46.572 40.684 1.000 1 A 37.930 1 ATOM 11 C C . GLY 2 2 ? A 43.441 46.107 39.353 1.000 1 A 37.930 1 ATOM 12 O O . GLY 2 2 ? A 42.232 46.196 39.186 1.000 1 A 37.930 1 ATOM 13 N N . ALA 3 3 ? A 44.173 45.598 38.373 1.000 1 A 38.590 1 ATOM 14 C CA . ALA 3 3 ? A 45.548 45.751 37.890 1.000 1 A 38.590 1 ATOM 15 C C . ALA 3 3 ? A 45.599 44.902 36.598 1.000 1 A 38.590 1 ATOM 16 C CB . ALA 3 3 ? A 46.596 45.202 38.875 1.000 1 A 38.590 1 ATOM 17 O O . ALA 3 3 ? A 44.926 43.876 36.556 1.000 1 A 38.590 1 ATOM 18 N N . ALA 4 4 ? A 46.442 45.300 35.634 1.000 1 A 42.010 1 ATOM 19 C CA . ALA 4 4 ? A 46.844 44.574 34.411 1.000 1 A 42.010 1 ATOM 20 C C . ALA 4 4 ? A 45.738 44.390 33.343 1.000 1 A 42.010 1 ATOM 21 C CB . ALA 4 4 ? A 47.537 43.269 34.822 1.000 1 A 42.010 1 ATOM 22 O O . ALA 4 4 ? A 44.647 43.926 33.639 1.000 1 A 42.010 1 ATOM 23 N N . GLY 5 5 ? A 45.895 44.838 32.092 1.000 1 A 34.810 1 ATOM 24 C CA . GLY 5 5 ? A 46.998 44.554 31.155 1.000 1 A 34.810 1 ATOM 25 C C . GLY 5 5 ? A 46.508 43.416 30.235 1.000 1 A 34.810 1 ATOM 26 O O . GLY 5 5 ? A 45.918 42.472 30.731 1.000 1 A 34.810 1 ATOM 27 N N . GLU 6 6 ? A 46.611 43.403 28.910 1.000 1 A 42.880 1 ATOM 28 C CA . GLU 6 6 ? A 47.493 44.084 27.974 1.000 1 A 42.880 1 ATOM 29 C C . GLU 6 6 ? A 46.833 44.092 26.581 1.000 1 A 42.880 1 ATOM 30 C CB . GLU 6 6 ? A 48.816 43.304 27.878 1.000 1 A 42.880 1 ATOM 31 O O . GLU 6 6 ? A 46.056 43.210 26.213 1.000 1 A 42.880 1 ATOM 32 C CG . GLU 6 6 ? A 49.630 43.365 29.181 1.000 1 A 42.880 1 ATOM 33 C CD . GLU 6 6 ? A 50.884 42.489 29.162 1.000 1 A 42.880 1 ATOM 34 O OE1 . GLU 6 6 ? A 51.851 42.889 29.848 1.000 1 A 42.880 1 ATOM 35 O OE2 . GLU 6 6 ? A 50.853 41.425 28.507 1.000 1 A 42.880 1 ATOM 36 N N . THR 7 7 ? A 47.162 45.111 25.797 1.000 1 A 42.010 1 ATOM 37 C CA . THR 7 7 ? A 46.816 45.270 24.386 1.000 1 A 42.010 1 ATOM 38 C C . THR 7 7 ? A 47.675 44.356 23.509 1.000 1 A 42.010 1 ATOM 39 C CB . THR 7 7 ? A 47.075 46.731 23.985 1.000 1 A 42.010 1 ATOM 40 O O . THR 7 7 ? A 48.874 44.590 23.364 1.000 1 A 42.010 1 ATOM 41 C CG2 . THR 7 7 ? A 46.054 47.688 24.598 1.000 1 A 42.010 1 ATOM 42 O OG1 . THR 7 7 ? A 48.349 47.130 24.449 1.000 1 A 42.010 1 ATOM 43 N N . GLY 8 8 ? A 47.061 43.362 22.867 1.000 1 A 44.180 1 ATOM 44 C CA . GLY 8 8 ? A 47.670 42.577 21.793 1.000 1 A 44.180 1 ATOM 45 C C . GLY 8 8 ? A 47.455 43.228 20.427 1.000 1 A 44.180 1 ATOM 46 O O . GLY 8 8 ? A 46.506 42.904 19.721 1.000 1 A 44.180 1 ATOM 47 N N . THR 9 9 ? A 48.345 44.144 20.054 1.000 1 A 35.800 1 ATOM 48 C CA . THR 9 9 ? A 48.563 44.572 18.664 1.000 1 A 35.800 1 ATOM 49 C C . THR 9 9 ? A 49.617 43.649 18.053 1.000 1 A 35.800 1 ATOM 50 C CB . THR 9 9 ? A 49.053 46.035 18.629 1.000 1 A 35.800 1 ATOM 51 O O . THR 9 9 ? A 50.690 43.521 18.630 1.000 1 A 35.800 1 ATOM 52 C CG2 . THR 9 9 ? A 49.559 46.516 17.267 1.000 1 A 35.800 1 ATOM 53 O OG1 . THR 9 9 ? A 47.988 46.892 18.965 1.000 1 A 35.800 1 ATOM 54 N N . THR 10 10 ? A 49.343 43.020 16.903 1.000 1 A 37.170 1 ATOM 55 C CA . THR 10 10 ? A 50.227 42.967 15.710 1.000 1 A 37.170 1 ATOM 56 C C . THR 10 10 ? A 49.706 41.994 14.637 1.000 1 A 37.170 1 ATOM 57 C CB . THR 10 10 ? A 51.718 42.623 15.953 1.000 1 A 37.170 1 ATOM 58 O O . THR 10 10 ? A 49.519 40.807 14.865 1.000 1 A 37.170 1 ATOM 59 C CG2 . THR 10 10 ? A 52.583 43.860 16.223 1.000 1 A 37.170 1 ATOM 60 O OG1 . THR 10 10 ? A 51.919 41.709 16.992 1.000 1 A 37.170 1 ATOM 61 N N . ALA 11 11 ? A 49.531 42.549 13.434 1.000 1 A 34.780 1 ATOM 62 C CA . ALA 11 11 ? A 49.848 41.966 12.127 1.000 1 A 34.780 1 ATOM 63 C C . ALA 11 11 ? A 49.321 40.556 11.773 1.000 1 A 34.780 1 ATOM 64 C CB . ALA 11 11 ? A 51.365 42.095 11.932 1.000 1 A 34.780 1 ATOM 65 O O . ALA 11 11 ? A 50.043 39.561 11.833 1.000 1 A 34.780 1 ATOM 66 N N . ALA 12 12 ? A 48.115 40.506 11.198 1.000 1 A 40.510 1 ATOM 67 C CA . ALA 12 12 ? A 47.753 39.441 10.265 1.000 1 A 40.510 1 ATOM 68 C C . ALA 12 12 ? A 48.554 39.625 8.962 1.000 1 A 40.510 1 ATOM 69 C CB . ALA 12 12 ? A 46.236 39.438 10.045 1.000 1 A 40.510 1 ATOM 70 O O . ALA 12 12 ? A 48.270 40.496 8.141 1.000 1 A 40.510 1 ATOM 71 N N . VAL 13 13 ? A 49.606 38.821 8.828 1.000 1 A 37.430 1 ATOM 72 C CA . VAL 13 13 ? A 50.477 38.722 7.657 1.000 1 A 37.430 1 ATOM 73 C C . VAL 13 13 ? A 49.685 38.263 6.433 1.000 1 A 37.430 1 ATOM 74 C CB . VAL 13 13 ? A 51.652 37.773 7.971 1.000 1 A 37.430 1 ATOM 75 O O . VAL 13 13 ? A 49.004 37.239 6.431 1.000 1 A 37.430 1 ATOM 76 C CG1 . VAL 13 13 ? A 52.447 37.320 6.741 1.000 1 A 37.430 1 ATOM 77 C CG2 . VAL 13 13 ? A 52.627 38.465 8.933 1.000 1 A 37.430 1 ATOM 78 N N . SER 14 14 ? A 49.847 39.024 5.361 1.000 1 A 32.470 1 ATOM 79 C CA . SER 14 14 ? A 49.494 38.710 3.987 1.000 1 A 32.470 1 ATOM 80 C C . SER 14 14 ? A 50.121 37.387 3.530 1.000 1 A 32.470 1 ATOM 81 C CB . SER 14 14 ? A 49.973 39.871 3.085 1.000 1 A 32.470 1 ATOM 82 O O . SER 14 14 ? A 51.342 37.245 3.476 1.000 1 A 32.470 1 ATOM 83 O OG . SER 14 14 ? A 50.856 40.771 3.751 1.000 1 A 32.470 1 ATOM 84 N N . LYS 15 15 ? A 49.287 36.437 3.092 1.000 1 A 38.830 1 ATOM 85 C CA . LYS 15 15 ? A 49.722 35.341 2.219 1.000 1 A 38.830 1 ATOM 86 C C . LYS 15 15 ? A 48.747 35.186 1.059 1.000 1 A 38.830 1 ATOM 87 C CB . LYS 15 15 ? A 49.974 34.054 3.026 1.000 1 A 38.830 1 ATOM 88 O O . LYS 15 15 ? A 47.695 34.568 1.162 1.000 1 A 38.830 1 ATOM 89 C CG . LYS 15 15 ? A 51.045 33.178 2.350 1.000 1 A 38.830 1 ATOM 90 C CD . LYS 15 15 ? A 51.484 32.036 3.277 1.000 1 A 38.830 1 ATOM 91 C CE . LYS 15 15 ? A 52.702 31.301 2.703 1.000 1 A 38.830 1 ATOM 92 N NZ . LYS 15 15 ? A 53.317 30.405 3.715 1.000 1 A 38.830 1 ATOM 93 N N . ALA 16 16 ? A 49.126 35.795 -0.057 1.000 1 A 31.920 1 ATOM 94 C CA . ALA 16 16 ? A 48.593 35.496 -1.371 1.000 1 A 31.920 1 ATOM 95 C C . ALA 16 16 ? A 49.036 34.086 -1.802 1.000 1 A 31.920 1 ATOM 96 C CB . ALA 16 16 ? A 49.133 36.567 -2.331 1.000 1 A 31.920 1 ATOM 97 O O . ALA 16 16 ? A 50.213 33.749 -1.683 1.000 1 A 31.920 1 ATOM 98 N N . SER 17 17 ? A 48.120 33.265 -2.323 1.000 1 A 32.880 1 ATOM 99 C CA . SER 17 17 ? A 48.246 32.602 -3.635 1.000 1 A 32.880 1 ATOM 100 C C . SER 17 17 ? A 47.256 31.438 -3.811 1.000 1 A 32.880 1 ATOM 101 C CB . SER 17 17 ? A 49.662 32.103 -3.992 1.000 1 A 32.880 1 ATOM 102 O O . SER 17 17 ? A 47.121 30.577 -2.953 1.000 1 A 32.880 1 ATOM 103 O OG . SER 17 17 ? A 50.173 31.176 -3.068 1.000 1 A 32.880 1 ATOM 104 N N . LYS 18 18 ? A 46.661 31.421 -5.013 1.000 1 A 33.690 1 ATOM 105 C CA . LYS 18 18 ? A 46.127 30.280 -5.780 1.000 1 A 33.690 1 ATOM 106 C C . LYS 18 18 ? A 44.854 29.560 -5.303 1.000 1 A 33.690 1 ATOM 107 C CB . LYS 18 18 ? A 47.265 29.287 -6.093 1.000 1 A 33.690 1 ATOM 108 O O . LYS 18 18 ? A 44.890 28.658 -4.481 1.000 1 A 33.690 1 ATOM 109 C CG . LYS 18 18 ? A 48.028 29.711 -7.354 1.000 1 A 33.690 1 ATOM 110 C CD . LYS 18 18 ? A 49.254 28.828 -7.600 1.000 1 A 33.690 1 ATOM 111 C CE . LYS 18 18 ? A 49.857 29.168 -8.968 1.000 1 A 33.690 1 ATOM 112 N NZ . LYS 18 18 ? A 51.158 28.488 -9.184 1.000 1 A 33.690 1 ATOM 113 N N . GLY 19 19 ? A 43.784 29.821 -6.063 1.000 1 A 28.700 1 ATOM 114 C CA . GLY 19 19 ? A 42.959 28.754 -6.642 1.000 1 A 28.700 1 ATOM 115 C C . GLY 19 19 ? A 41.781 28.288 -5.797 1.000 1 A 28.700 1 ATOM 116 O O . GLY 19 19 ? A 41.733 27.129 -5.405 1.000 1 A 28.700 1 ATOM 117 N N . GLY 20 20 ? A 40.807 29.169 -5.560 1.000 1 A 30.700 1 ATOM 118 C CA . GLY 20 20 ? A 39.499 28.758 -5.054 1.000 1 A 30.700 1 ATOM 119 C C . GLY 20 20 ? A 38.773 27.927 -6.108 1.000 1 A 30.700 1 ATOM 120 O O . GLY 20 20 ? A 38.323 28.462 -7.119 1.000 1 A 30.700 1 ATOM 121 N N . ALA 21 21 ? A 38.697 26.618 -5.877 1.000 1 A 31.710 1 ATOM 122 C CA . ALA 21 21 ? A 37.821 25.715 -6.601 1.000 1 A 31.710 1 ATOM 123 C C . ALA 21 21 ? A 36.379 26.223 -6.456 1.000 1 A 31.710 1 ATOM 124 C CB . ALA 21 21 ? A 38.008 24.304 -6.025 1.000 1 A 31.710 1 ATOM 125 O O . ALA 21 21 ? A 35.819 26.218 -5.359 1.000 1 A 31.710 1 ATOM 126 N N . ALA 22 22 ? A 35.802 26.706 -7.556 1.000 1 A 36.720 1 ATOM 127 C CA . ALA 22 22 ? A 34.382 26.996 -7.631 1.000 1 A 36.720 1 ATOM 128 C C . ALA 22 22 ? A 33.638 25.693 -7.325 1.000 1 A 36.720 1 ATOM 129 C CB . ALA 22 22 ? A 34.051 27.559 -9.019 1.000 1 A 36.720 1 ATOM 130 O O . ALA 22 22 ? A 33.782 24.705 -8.046 1.000 1 A 36.720 1 ATOM 131 N N . ALA 23 23 ? A 32.912 25.686 -6.209 1.000 1 A 36.370 1 ATOM 132 C CA . ALA 23 23 ? A 32.048 24.595 -5.812 1.000 1 A 36.370 1 ATOM 133 C C . ALA 23 23 ? A 31.068 24.327 -6.958 1.000 1 A 36.370 1 ATOM 134 C CB . ALA 23 23 ? A 31.345 24.991 -4.506 1.000 1 A 36.370 1 ATOM 135 O O . ALA 23 23 ? A 30.146 25.107 -7.198 1.000 1 A 36.370 1 ATOM 136 N N . ALA 24 24 ? A 31.308 23.247 -7.700 1.000 1 A 38.540 1 ATOM 137 C CA . ALA 24 24 ? A 30.339 22.701 -8.625 1.000 1 A 38.540 1 ATOM 138 C C . ALA 24 24 ? A 29.143 22.274 -7.773 1.000 1 A 38.540 1 ATOM 139 C CB . ALA 24 24 ? A 30.983 21.548 -9.409 1.000 1 A 38.540 1 ATOM 140 O O . ALA 24 24 ? A 29.161 21.222 -7.140 1.000 1 A 38.540 1 ATOM 141 N N . VAL 25 25 ? A 28.146 23.152 -7.682 1.000 1 A 43.550 1 ATOM 142 C CA . VAL 25 25 ? A 26.828 22.850 -7.134 1.000 1 A 43.550 1 ATOM 143 C C . VAL 25 25 ? A 26.283 21.691 -7.956 1.000 1 A 43.550 1 ATOM 144 C CB . VAL 25 25 ? A 25.875 24.072 -7.154 1.000 1 A 43.550 1 ATOM 145 O O . VAL 25 25 ? A 25.801 21.861 -9.073 1.000 1 A 43.550 1 ATOM 146 C CG1 . VAL 25 25 ? A 25.739 24.666 -5.749 1.000 1 A 43.550 1 ATOM 147 C CG2 . VAL 25 25 ? A 26.307 25.201 -8.105 1.000 1 A 43.550 1 ATOM 148 N N . THR 26 26 ? A 26.440 20.484 -7.426 1.000 1 A 45.740 1 ATOM 149 C CA . THR 26 26 ? A 25.775 19.290 -7.922 1.000 1 A 45.740 1 ATOM 150 C C . THR 26 26 ? A 24.285 19.522 -7.712 1.000 1 A 45.740 1 ATOM 151 C CB . THR 26 26 ? A 26.264 18.043 -7.164 1.000 1 A 45.740 1 ATOM 152 O O . THR 26 26 ? A 23.783 19.353 -6.601 1.000 1 A 45.740 1 ATOM 153 C CG2 . THR 26 26 ? A 27.714 17.698 -7.506 1.000 1 A 45.740 1 ATOM 154 O OG1 . THR 26 26 ? A 26.205 18.259 -5.772 1.000 1 A 45.740 1 ATOM 155 N N . ALA 27 27 ? A 23.589 19.997 -8.745 1.000 1 A 56.800 1 ATOM 156 C CA . ALA 27 27 ? A 22.137 20.054 -8.732 1.000 1 A 56.800 1 ATOM 157 C C . ALA 27 27 ? A 21.629 18.632 -8.461 1.000 1 A 56.800 1 ATOM 158 C CB . ALA 27 27 ? A 21.636 20.630 -10.061 1.000 1 A 56.800 1 ATOM 159 O O . ALA 27 27 ? A 22.004 17.692 -9.169 1.000 1 A 56.800 1 ATOM 160 N N . ALA 28 28 ? A 20.861 18.469 -7.384 1.000 1 A 60.790 1 ATOM 161 C CA . ALA 28 28 ? A 20.272 17.187 -7.037 1.000 1 A 60.790 1 ATOM 162 C C . ALA 28 28 ? A 19.422 16.689 -8.221 1.000 1 A 60.790 1 ATOM 163 C CB . ALA 28 28 ? A 19.452 17.340 -5.750 1.000 1 A 60.790 1 ATOM 164 O O . ALA 28 28 ? A 18.753 17.500 -8.870 1.000 1 A 60.790 1 ATOM 165 N N . PRO 29 29 ? A 19.464 15.386 -8.546 1.000 1 A 63.490 1 ATOM 166 C CA . PRO 29 29 ? A 18.634 14.841 -9.610 1.000 1 A 63.490 1 ATOM 167 C C . PRO 29 29 ? A 17.152 15.091 -9.280 1.000 1 A 63.490 1 ATOM 168 C CB . PRO 29 29 ? A 18.985 13.353 -9.685 1.000 1 A 63.490 1 ATOM 169 O O . PRO 29 29 ? A 16.772 14.939 -8.117 1.000 1 A 63.490 1 ATOM 170 C CG . PRO 29 29 ? A 19.487 13.033 -8.276 1.000 1 A 63.490 1 ATOM 171 C CD . PRO 29 29 ? A 20.164 14.328 -7.837 1.000 1 A 63.490 1 ATOM 172 N N . PRO 30 30 ? A 16.322 15.477 -10.268 1.000 1 A 64.300 1 ATOM 173 C CA . PRO 30 30 ? A 14.919 15.796 -10.035 1.000 1 A 64.300 1 ATOM 174 C C . PRO 30 30 ? A 14.203 14.598 -9.407 1.000 1 A 64.300 1 ATOM 175 C CB . PRO 30 30 ? A 14.341 16.177 -11.401 1.000 1 A 64.300 1 ATOM 176 O O . PRO 30 30 ? A 14.241 13.486 -9.934 1.000 1 A 64.300 1 ATOM 177 C CG . PRO 30 30 ? A 15.280 15.495 -12.396 1.000 1 A 64.300 1 ATOM 178 C CD . PRO 30 30 ? A 16.630 15.545 -11.686 1.000 1 A 64.300 1 ATOM 179 N N . SER 31 31 ? A 13.572 14.840 -8.262 1.000 1 A 77.990 1 ATOM 180 C CA . SER 31 31 ? A 12.929 13.825 -7.422 1.000 1 A 77.990 1 ATOM 181 C C . SER 31 31 ? A 11.527 13.462 -7.900 1.000 1 A 77.990 1 ATOM 182 C CB . SER 31 31 ? A 12.872 14.309 -5.962 1.000 1 A 77.990 1 ATOM 183 O O . SER 31 31 ? A 11.019 12.386 -7.590 1.000 1 A 77.990 1 ATOM 184 O OG . SER 31 31 ? A 13.160 15.692 -5.801 1.000 1 A 77.990 1 ATOM 185 N N . THR 32 32 ? A 10.892 14.354 -8.658 1.000 1 A 82.750 1 ATOM 186 C CA . THR 32 32 ? A 9.519 14.192 -9.140 1.000 1 A 82.750 1 ATOM 187 C C . THR 32 32 ? A 9.433 14.379 -10.651 1.000 1 A 82.750 1 ATOM 188 C CB . THR 32 32 ? A 8.568 15.159 -8.424 1.000 1 A 82.750 1 ATOM 189 O O . THR 32 32 ? A 10.257 15.059 -11.262 1.000 1 A 82.750 1 ATOM 190 C CG2 . THR 32 32 ? A 8.592 15.009 -6.904 1.000 1 A 82.750 1 ATOM 191 O OG1 . THR 32 32 ? A 8.898 16.489 -8.735 1.000 1 A 82.750 1 ATOM 192 N N . TYR 33 33 ? A 8.403 13.797 -11.275 1.000 1 A 83.740 1 ATOM 193 C CA . TYR 33 33 ? A 8.165 13.966 -12.713 1.000 1 A 83.740 1 ATOM 194 C C . TYR 33 33 ? A 7.944 15.438 -13.093 1.000 1 A 83.740 1 ATOM 195 C CB . TYR 33 33 ? A 6.967 13.110 -13.138 1.000 1 A 83.740 1 ATOM 196 O O . TYR 33 33 ? A 8.431 15.882 -14.129 1.000 1 A 83.740 1 ATOM 197 C CG . TYR 33 33 ? A 6.685 13.184 -14.626 1.000 1 A 83.740 1 ATOM 198 C CD1 . TYR 33 33 ? A 5.680 14.040 -15.118 1.000 1 A 83.740 1 ATOM 199 C CD2 . TYR 33 33 ? A 7.459 12.421 -15.521 1.000 1 A 83.740 1 ATOM 200 C CE1 . TYR 33 33 ? A 5.442 14.128 -16.503 1.000 1 A 83.740 1 ATOM 201 C CE2 . TYR 33 33 ? A 7.223 12.506 -16.906 1.000 1 A 83.740 1 ATOM 202 O OH . TYR 33 33 ? A 5.992 13.435 -18.737 1.000 1 A 83.740 1 ATOM 203 C CZ . TYR 33 33 ? A 6.214 13.358 -17.399 1.000 1 A 83.740 1 ATOM 204 N N . ALA 34 34 ? A 7.269 16.208 -12.232 1.000 1 A 84.570 1 ATOM 205 C CA . ALA 34 34 ? A 7.071 17.642 -12.427 1.000 1 A 84.570 1 ATOM 206 C C . ALA 34 34 ? A 8.407 18.407 -12.429 1.000 1 A 84.570 1 ATOM 207 C CB . ALA 34 34 ? A 6.121 18.154 -11.339 1.000 1 A 84.570 1 ATOM 208 O O . ALA 34 34 ? A 8.642 19.216 -13.324 1.000 1 A 84.570 1 ATOM 209 N N . GLU 35 35 ? A 9.313 18.106 -11.491 1.000 1 A 77.880 1 ATOM 210 C CA . GLU 35 35 ? A 10.665 18.681 -11.471 1.000 1 A 77.880 1 ATOM 211 C C . GLU 35 35 ? A 11.509 18.229 -12.662 1.000 1 A 77.880 1 ATOM 212 C CB . GLU 35 35 ? A 11.407 18.289 -10.189 1.000 1 A 77.880 1 ATOM 213 O O . GLU 35 35 ? A 12.261 19.032 -13.202 1.000 1 A 77.880 1 ATOM 214 C CG . GLU 35 35 ? A 10.957 19.099 -8.971 1.000 1 A 77.880 1 ATOM 215 C CD . GLU 35 35 ? A 11.623 18.583 -7.689 1.000 1 A 77.880 1 ATOM 216 O OE1 . GLU 35 35 ? A 12.011 19.431 -6.861 1.000 1 A 77.880 1 ATOM 217 O OE2 . GLU 35 35 ? A 11.717 17.332 -7.535 1.000 1 A 77.880 1 ATOM 218 N N . TRP 36 36 ? A 11.388 16.973 -13.105 1.000 1 A 84.750 1 ATOM 219 C CA . TRP 36 36 ? A 12.106 16.484 -14.284 1.000 1 A 84.750 1 ATOM 220 C C . TRP 36 36 ? A 11.627 17.182 -15.556 1.000 1 A 84.750 1 ATOM 221 C CB . TRP 36 36 ? A 11.968 14.964 -14.415 1.000 1 A 84.750 1 ATOM 222 O O . TRP 36 36 ? A 12.454 17.648 -16.334 1.000 1 A 84.750 1 ATOM 223 C CG . TRP 36 36 ? A 12.524 14.419 -15.697 1.000 1 A 84.750 1 ATOM 224 C CD1 . TRP 36 36 ? A 13.830 14.187 -15.957 1.000 1 A 84.750 1 ATOM 225 C CD2 . TRP 36 36 ? A 11.809 14.115 -16.935 1.000 1 A 84.750 1 ATOM 226 C CE2 . TRP 36 36 ? A 12.761 13.693 -17.912 1.000 1 A 84.750 1 ATOM 227 C CE3 . TRP 36 36 ? A 10.456 14.168 -17.337 1.000 1 A 84.750 1 ATOM 228 N NE1 . TRP 36 36 ? A 13.975 13.752 -17.261 1.000 1 A 84.750 1 ATOM 229 C CH2 . TRP 36 36 ? A 11.037 13.397 -19.583 1.000 1 A 84.750 1 ATOM 230 C CZ2 . TRP 36 36 ? A 12.393 13.336 -19.218 1.000 1 A 84.750 1 ATOM 231 C CZ3 . TRP 36 36 ? A 10.075 13.814 -18.645 1.000 1 A 84.750 1 ATOM 232 N N . ALA 37 37 ? A 10.312 17.312 -15.745 1.000 1 A 84.290 1 ATOM 233 C CA . ALA 37 37 ? A 9.740 18.030 -16.876 1.000 1 A 84.290 1 ATOM 234 C C . ALA 37 37 ? A 10.124 19.516 -16.840 1.000 1 A 84.290 1 ATOM 235 C CB . ALA 37 37 ? A 8.221 17.830 -16.872 1.000 1 A 84.290 1 ATOM 236 O O . ALA 37 37 ? A 10.516 20.060 -17.869 1.000 1 A 84.290 1 ATOM 237 N N . ALA 38 38 ? A 10.089 20.153 -15.664 1.000 1 A 82.840 1 ATOM 238 C CA . ALA 38 38 ? A 10.514 21.539 -15.487 1.000 1 A 82.840 1 ATOM 239 C C . ALA 38 38 ? A 12.018 21.721 -15.738 1.000 1 A 82.840 1 ATOM 240 C CB . ALA 38 38 ? A 10.125 22.004 -14.080 1.000 1 A 82.840 1 ATOM 241 O O . ALA 38 38 ? A 12.404 22.655 -16.430 1.000 1 A 82.840 1 ATOM 242 N N . ALA 39 39 ? A 12.872 20.821 -15.243 1.000 1 A 81.730 1 ATOM 243 C CA . ALA 39 39 ? A 14.313 20.851 -15.483 1.000 1 A 81.730 1 ATOM 244 C C . ALA 39 39 ? A 14.648 20.581 -16.956 1.000 1 A 81.730 1 ATOM 245 C CB . ALA 39 39 ? A 14.999 19.831 -14.565 1.000 1 A 81.730 1 ATOM 246 O O . ALA 39 39 ? A 15.508 21.252 -17.516 1.000 1 A 81.730 1 ATOM 247 N N . PHE 40 40 ? A 13.948 19.645 -17.602 1.000 1 A 80.680 1 ATOM 248 C CA . PHE 40 40 ? A 14.097 19.348 -19.024 1.000 1 A 80.680 1 ATOM 249 C C . PHE 40 40 ? A 13.665 20.543 -19.877 1.000 1 A 80.680 1 ATOM 250 C CB . PHE 40 40 ? A 13.289 18.088 -19.367 1.000 1 A 80.680 1 ATOM 251 O O . PHE 40 40 ? A 14.420 21.003 -20.729 1.000 1 A 80.680 1 ATOM 252 C CG . PHE 40 40 ? A 13.465 17.614 -20.794 1.000 1 A 80.680 1 ATOM 253 C CD1 . PHE 40 40 ? A 12.612 18.081 -21.813 1.000 1 A 80.680 1 ATOM 254 C CD2 . PHE 40 40 ? A 14.490 16.702 -21.104 1.000 1 A 80.680 1 ATOM 255 C CE1 . PHE 40 40 ? A 12.790 17.641 -23.136 1.000 1 A 80.680 1 ATOM 256 C CE2 . PHE 40 40 ? A 14.654 16.245 -22.423 1.000 1 A 80.680 1 ATOM 257 C CZ . PHE 40 40 ? A 13.811 16.724 -23.441 1.000 1 A 80.680 1 ATOM 258 N N . GLN 41 41 ? A 12.484 21.105 -19.609 1.000 1 A 80.870 1 ATOM 259 C CA . GLN 41 41 ? A 12.024 22.313 -20.285 1.000 1 A 80.870 1 ATOM 260 C C . GLN 41 41 ? A 12.971 23.482 -20.019 1.000 1 A 80.870 1 ATOM 261 C CB . GLN 41 41 ? A 10.593 22.668 -19.869 1.000 1 A 80.870 1 ATOM 262 O O . GLN 41 41 ? A 13.348 24.145 -20.974 1.000 1 A 80.870 1 ATOM 263 C CG . GLN 41 41 ? A 9.557 21.722 -20.496 1.000 1 A 80.870 1 ATOM 264 C CD . GLN 41 41 ? A 8.133 22.034 -20.046 1.000 1 A 80.870 1 ATOM 265 N NE2 . GLN 41 41 ? A 7.179 21.181 -20.348 1.000 1 A 80.870 1 ATOM 266 O OE1 . GLN 41 41 ? A 7.837 23.045 -19.435 1.000 1 A 80.870 1 ATOM 267 N N . ALA 42 42 ? A 13.426 23.714 -18.787 1.000 1 A 73.870 1 ATOM 268 C CA . ALA 42 42 ? A 14.370 24.783 -18.463 1.000 1 A 73.870 1 ATOM 269 C C . ALA 42 42 ? A 15.725 24.599 -19.162 1.000 1 A 73.870 1 ATOM 270 C CB . ALA 42 42 ? A 14.542 24.861 -16.943 1.000 1 A 73.870 1 ATOM 271 O O . ALA 42 42 ? A 16.277 25.576 -19.658 1.000 1 A 73.870 1 ATOM 272 N N . TYR 43 43 ? A 16.227 23.365 -19.256 1.000 1 A 73.420 1 ATOM 273 C CA . TYR 43 43 ? A 17.491 23.035 -19.918 1.000 1 A 73.420 1 ATOM 274 C C . TYR 43 43 ? A 17.482 23.348 -21.422 1.000 1 A 73.420 1 ATOM 275 C CB . TYR 43 43 ? A 17.807 21.553 -19.666 1.000 1 A 73.420 1 ATOM 276 O O . TYR 43 43 ? A 18.506 23.756 -21.958 1.000 1 A 73.420 1 ATOM 277 C CG . TYR 43 43 ? A 19.093 21.078 -20.310 1.000 1 A 73.420 1 ATOM 278 C CD1 . TYR 43 43 ? A 19.057 20.381 -21.532 1.000 1 A 73.420 1 ATOM 279 C CD2 . TYR 43 43 ? A 20.328 21.374 -19.704 1.000 1 A 73.420 1 ATOM 280 C CE1 . TYR 43 43 ? A 20.255 19.978 -22.152 1.000 1 A 73.420 1 ATOM 281 C CE2 . TYR 43 43 ? A 21.529 20.983 -20.323 1.000 1 A 73.420 1 ATOM 282 O OH . TYR 43 43 ? A 22.654 19.920 -22.154 1.000 1 A 73.420 1 ATOM 283 C CZ . TYR 43 43 ? A 21.492 20.287 -21.551 1.000 1 A 73.420 1 ATOM 284 N N . TYR 44 44 ? A 16.338 23.185 -22.097 1.000 1 A 74.090 1 ATOM 285 C CA . TYR 44 44 ? A 16.199 23.513 -23.523 1.000 1 A 74.090 1 ATOM 286 C C . TYR 44 44 ? A 15.629 24.915 -23.790 1.000 1 A 74.090 1 ATOM 287 C CB . TYR 44 44 ? A 15.354 22.433 -24.213 1.000 1 A 74.090 1 ATOM 288 O O . TYR 44 44 ? A 15.916 25.499 -24.834 1.000 1 A 74.090 1 ATOM 289 C CG . TYR 44 44 ? A 16.083 21.115 -24.405 1.000 1 A 74.090 1 ATOM 290 C CD1 . TYR 44 44 ? A 17.032 20.986 -25.437 1.000 1 A 74.090 1 ATOM 291 C CD2 . TYR 44 44 ? A 15.827 20.023 -23.557 1.000 1 A 74.090 1 ATOM 292 C CE1 . TYR 44 44 ? A 17.726 19.773 -25.618 1.000 1 A 74.090 1 ATOM 293 C CE2 . TYR 44 44 ? A 16.542 18.823 -23.711 1.000 1 A 74.090 1 ATOM 294 O OH . TYR 44 44 ? A 18.154 17.518 -24.904 1.000 1 A 74.090 1 ATOM 295 C CZ . TYR 44 44 ? A 17.483 18.689 -24.747 1.000 1 A 74.090 1 ATOM 296 N N . SER 45 45 ? A 14.815 25.456 -22.879 1.000 1 A 69.360 1 ATOM 297 C CA . SER 45 45 ? A 14.155 26.764 -23.036 1.000 1 A 69.360 1 ATOM 298 C C . SER 45 45 ? A 15.081 27.915 -22.670 1.000 1 A 69.360 1 ATOM 299 C CB . SER 45 45 ? A 12.891 26.888 -22.180 1.000 1 A 69.360 1 ATOM 300 O O . SER 45 45 ? A 15.096 28.937 -23.353 1.000 1 A 69.360 1 ATOM 301 O OG . SER 45 45 ? A 11.989 25.840 -22.451 1.000 1 A 69.360 1 ATOM 302 N N . ALA 46 46 ? A 15.894 27.759 -21.623 1.000 1 A 60.440 1 ATOM 303 C CA . ALA 46 46 ? A 17.104 28.551 -21.531 1.000 1 A 60.440 1 ATOM 304 C C . ALA 46 46 ? A 18.047 27.936 -22.561 1.000 1 A 60.440 1 ATOM 305 C CB . ALA 46 46 ? A 17.657 28.498 -20.099 1.000 1 A 60.440 1 ATOM 306 O O . ALA 46 46 ? A 18.333 26.751 -22.456 1.000 1 A 60.440 1 ATOM 307 N N . GLY 47 47 ? A 18.521 28.688 -23.556 1.000 1 A 60.150 1 ATOM 308 C CA . GLY 47 47 ? A 19.548 28.243 -24.515 1.000 1 A 60.150 1 ATOM 309 C C . GLY 47 47 ? A 20.912 27.966 -23.856 1.000 1 A 60.150 1 ATOM 310 O O . GLY 47 47 ? A 21.952 28.402 -24.347 1.000 1 A 60.150 1 ATOM 311 N N . GLY 48 48 ? A 20.892 27.317 -22.693 1.000 1 A 50.930 1 ATOM 312 C CA . GLY 48 48 ? A 21.935 27.143 -21.713 1.000 1 A 50.930 1 ATOM 313 C C . GLY 48 48 ? A 22.850 26.022 -22.139 1.000 1 A 50.930 1 ATOM 314 O O . GLY 48 48 ? A 22.567 24.839 -21.974 1.000 1 A 50.930 1 ATOM 315 N N . GLN 49 49 ? A 23.980 26.443 -22.685 1.000 1 A 54.260 1 ATOM 316 C CA . GLN 49 49 ? A 25.184 25.641 -22.790 1.000 1 A 54.260 1 ATOM 317 C C . GLN 49 49 ? A 25.423 24.822 -21.504 1.000 1 A 54.260 1 ATOM 318 C CB . GLN 49 49 ? A 26.355 26.608 -23.018 1.000 1 A 54.260 1 ATOM 319 O O . GLN 49 49 ? A 25.202 25.337 -20.403 1.000 1 A 54.260 1 ATOM 320 C CG . GLN 49 49 ? A 26.334 27.260 -24.408 1.000 1 A 54.260 1 ATOM 321 C CD . GLN 49 49 ? A 26.720 26.254 -25.482 1.000 1 A 54.260 1 ATOM 322 N NE2 . GLN 49 49 ? A 25.783 25.747 -26.253 1.000 1 A 54.260 1 ATOM 323 O OE1 . GLN 49 49 ? A 27.870 25.879 -25.623 1.000 1 A 54.260 1 ATOM 324 N N . PRO 50 50 ? A 25.889 23.564 -21.623 1.000 1 A 53.530 1 ATOM 325 C CA . PRO 50 50 ? A 26.261 22.762 -20.463 1.000 1 A 53.530 1 ATOM 326 C C . PRO 50 50 ? A 27.315 23.494 -19.608 1.000 1 A 53.530 1 ATOM 327 C CB . PRO 50 50 ? A 26.768 21.429 -21.026 1.000 1 A 53.530 1 ATOM 328 O O . PRO 50 50 ? A 28.060 24.328 -20.133 1.000 1 A 53.530 1 ATOM 329 C CG . PRO 50 50 ? A 27.236 21.788 -22.435 1.000 1 A 53.530 1 ATOM 330 C CD . PRO 50 50 ? A 26.268 22.889 -22.854 1.000 1 A 53.530 1 ATOM 331 N N . PRO 51 51 ? A 27.375 23.206 -18.294 1.000 1 A 50.590 1 ATOM 332 C CA . PRO 51 51 ? A 28.192 23.947 -17.338 1.000 1 A 50.590 1 ATOM 333 C C . PRO 51 51 ? A 29.651 24.097 -17.809 1.000 1 A 50.590 1 ATOM 334 C CB . PRO 51 51 ? A 28.077 23.196 -16.005 1.000 1 A 50.590 1 ATOM 335 O O . PRO 51 51 ? A 30.249 23.130 -18.295 1.000 1 A 50.590 1 ATOM 336 C CG . PRO 51 51 ? A 27.548 21.817 -16.398 1.000 1 A 50.590 1 ATOM 337 C CD . PRO 51 51 ? A 26.695 22.114 -17.625 1.000 1 A 50.590 1 ATOM 338 N N . PRO 52 52 ? A 30.243 25.298 -17.668 1.000 1 A 44.160 1 ATOM 339 C CA . PRO 52 52 ? A 31.565 25.600 -18.194 1.000 1 A 44.160 1 ATOM 340 C C . PRO 52 52 ? A 32.616 24.883 -17.342 1.000 1 A 44.160 1 ATOM 341 C CB . PRO 52 52 ? A 31.672 27.130 -18.143 1.000 1 A 44.160 1 ATOM 342 O O . PRO 52 52 ? A 32.912 25.291 -16.222 1.000 1 A 44.160 1 ATOM 343 C CG . PRO 52 52 ? A 30.783 27.517 -16.961 1.000 1 A 44.160 1 ATOM 344 C CD . PRO 52 52 ? A 29.689 26.453 -16.977 1.000 1 A 44.160 1 ATOM 345 N N . GLY 53 53 ? A 33.167 23.783 -17.853 1.000 1 A 43.470 1 ATOM 346 C CA . GLY 53 53 ? A 34.193 23.028 -17.127 1.000 1 A 43.470 1 ATOM 347 C C . GLY 53 53 ? A 34.770 21.806 -17.836 1.000 1 A 43.470 1 ATOM 348 O O . GLY 53 53 ? A 35.870 21.387 -17.494 1.000 1 A 43.470 1 ATOM 349 N N . ALA 54 54 ? A 34.108 21.262 -18.859 1.000 1 A 42.970 1 ATOM 350 C CA . ALA 54 54 ? A 34.695 20.235 -19.716 1.000 1 A 42.970 1 ATOM 351 C C . ALA 54 54 ? A 34.832 20.786 -21.135 1.000 1 A 42.970 1 ATOM 352 C CB . ALA 54 54 ? A 33.868 18.951 -19.627 1.000 1 A 42.970 1 ATOM 353 O O . ALA 54 54 ? A 33.845 21.040 -21.820 1.000 1 A 42.970 1 ATOM 354 N N . ALA 55 55 ? A 36.075 21.011 -21.549 1.000 1 A 41.300 1 ATOM 355 C CA . ALA 55 55 ? A 36.444 21.447 -22.882 1.000 1 A 41.300 1 ATOM 356 C C . ALA 55 55 ? A 35.991 20.431 -23.947 1.000 1 A 41.300 1 ATOM 357 C CB . ALA 55 55 ? A 37.965 21.660 -22.882 1.000 1 A 41.300 1 ATOM 358 O O . ALA 55 55 ? A 36.734 19.533 -24.319 1.000 1 A 41.300 1 ATOM 359 N N . PHE 56 56 ? A 34.776 20.609 -24.456 1.000 1 A 40.620 1 ATOM 360 C CA . PHE 56 56 ? A 34.339 20.103 -25.753 1.000 1 A 40.620 1 ATOM 361 C C . PHE 56 56 ? A 33.683 21.266 -26.492 1.000 1 A 40.620 1 ATOM 362 C CB . PHE 56 56 ? A 33.458 18.858 -25.605 1.000 1 A 40.620 1 ATOM 363 O O . PHE 56 56 ? A 32.466 21.418 -26.552 1.000 1 A 40.620 1 ATOM 364 C CG . PHE 56 56 ? A 34.235 17.643 -25.132 1.000 1 A 40.620 1 ATOM 365 C CD1 . PHE 56 56 ? A 35.059 16.936 -26.030 1.000 1 A 40.620 1 ATOM 366 C CD2 . PHE 56 56 ? A 34.173 17.247 -23.783 1.000 1 A 40.620 1 ATOM 367 C CE1 . PHE 56 56 ? A 35.812 15.836 -25.582 1.000 1 A 40.620 1 ATOM 368 C CE2 . PHE 56 56 ? A 34.923 16.144 -23.336 1.000 1 A 40.620 1 ATOM 369 C CZ . PHE 56 56 ? A 35.742 15.438 -24.236 1.000 1 A 40.620 1 ATOM 370 N N . ALA 57 57 ? A 34.544 22.157 -26.978 1.000 1 A 42.900 1 ATOM 371 C CA . ALA 57 57 ? A 34.171 23.210 -27.899 1.000 1 A 42.900 1 ATOM 372 C C . ALA 57 57 ? A 33.745 22.581 -29.236 1.000 1 A 42.900 1 ATOM 373 C CB . ALA 57 57 ? A 35.378 24.146 -28.060 1.000 1 A 42.900 1 ATOM 374 O O . ALA 57 57 ? A 34.550 21.919 -29.883 1.000 1 A 42.900 1 ATOM 375 N N . GLY 58 58 ? A 32.502 22.839 -29.646 1.000 1 A 39.260 1 ATOM 376 C CA . GLY 58 58 ? A 32.022 22.644 -31.016 1.000 1 A 39.260 1 ATOM 377 C C . GLY 58 58 ? A 31.596 21.216 -31.383 1.000 1 A 39.260 1 ATOM 378 O O . GLY 58 58 ? A 32.375 20.280 -31.288 1.000 1 A 39.260 1 ATOM 379 N N . HIS 59 59 ? A 30.374 21.113 -31.921 1.000 1 A 38.300 1 ATOM 380 C CA . HIS 59 59 ? A 29.725 19.968 -32.592 1.000 1 A 38.300 1 ATOM 381 C C . HIS 59 59 ? A 28.793 19.080 -31.733 1.000 1 A 38.300 1 ATOM 382 C CB . HIS 59 59 ? A 30.685 19.156 -33.475 1.000 1 A 38.300 1 ATOM 383 O O . HIS 59 59 ? A 29.245 18.214 -30.983 1.000 1 A 38.300 1 ATOM 384 C CG . HIS 59 59 ? A 31.497 20.030 -34.396 1.000 1 A 38.300 1 ATOM 385 C CD2 . HIS 59 59 ? A 32.840 20.283 -34.304 1.000 1 A 38.300 1 ATOM 386 N ND1 . HIS 59 59 ? A 31.006 20.804 -35.425 1.000 1 A 38.300 1 ATOM 387 C CE1 . HIS 59 59 ? A 32.029 21.506 -35.938 1.000 1 A 38.300 1 ATOM 388 N NE2 . HIS 59 59 ? A 33.166 21.223 -35.287 1.000 1 A 38.300 1 ATOM 389 N N . PRO 60 60 ? A 27.458 19.215 -31.898 1.000 1 A 46.960 1 ATOM 390 C CA . PRO 60 60 ? A 26.478 18.373 -31.226 1.000 1 A 46.960 1 ATOM 391 C C . PRO 60 60 ? A 26.200 17.100 -32.044 1.000 1 A 46.960 1 ATOM 392 C CB . PRO 60 60 ? A 25.251 19.285 -31.075 1.000 1 A 46.960 1 ATOM 393 O O . PRO 60 60 ? A 25.188 17.039 -32.727 1.000 1 A 46.960 1 ATOM 394 C CG . PRO 60 60 ? A 25.273 20.125 -32.353 1.000 1 A 46.960 1 ATOM 395 C CD . PRO 60 60 ? A 26.761 20.220 -32.699 1.000 1 A 46.960 1 ATOM 396 N N . TYR 61 61 ? A 27.086 16.093 -32.002 1.000 1 A 45.260 1 ATOM 397 C CA . TYR 61 61 ? A 26.750 14.688 -32.359 1.000 1 A 45.260 1 ATOM 398 C C . TYR 61 61 ? A 27.830 13.633 -32.013 1.000 1 A 45.260 1 ATOM 399 C CB . TYR 61 61 ? A 26.275 14.538 -33.826 1.000 1 A 45.260 1 ATOM 400 O O . TYR 61 61 ? A 27.826 12.532 -32.563 1.000 1 A 45.260 1 ATOM 401 C CG . TYR 61 61 ? A 27.106 15.255 -34.867 1.000 1 A 45.260 1 ATOM 402 C CD1 . TYR 61 61 ? A 26.647 16.471 -35.409 1.000 1 A 45.260 1 ATOM 403 C CD2 . TYR 61 61 ? A 28.318 14.697 -35.311 1.000 1 A 45.260 1 ATOM 404 C CE1 . TYR 61 61 ? A 27.411 17.149 -36.371 1.000 1 A 45.260 1 ATOM 405 C CE2 . TYR 61 61 ? A 29.083 15.367 -36.285 1.000 1 A 45.260 1 ATOM 406 O OH . TYR 61 61 ? A 29.359 17.260 -37.744 1.000 1 A 45.260 1 ATOM 407 C CZ . TYR 61 61 ? A 28.629 16.597 -36.811 1.000 1 A 45.260 1 ATOM 408 N N . MET 62 62 ? A 28.744 13.881 -31.071 1.000 1 A 47.140 1 ATOM 409 C CA . MET 62 62 ? A 29.713 12.855 -30.643 1.000 1 A 47.140 1 ATOM 410 C C . MET 62 62 ? A 29.106 11.879 -29.617 1.000 1 A 47.140 1 ATOM 411 C CB . MET 62 62 ? A 31.017 13.521 -30.180 1.000 1 A 47.140 1 ATOM 412 O O . MET 62 62 ? A 29.456 11.887 -28.445 1.000 1 A 47.140 1 ATOM 413 C CG . MET 62 62 ? A 31.820 14.034 -31.385 1.000 1 A 47.140 1 ATOM 414 S SD . MET 62 62 ? A 32.790 15.532 -31.080 1.000 1 A 47.140 1 ATOM 415 C CE . MET 62 62 ? A 33.877 14.993 -29.734 1.000 1 A 47.140 1 ATOM 416 N N . TRP 63 63 ? A 28.221 10.989 -30.077 1.000 1 A 53.070 1 ATOM 417 C CA . TRP 63 63 ? A 27.850 9.746 -29.370 1.000 1 A 53.070 1 ATOM 418 C C . TRP 63 63 ? A 28.788 8.564 -29.720 1.000 1 A 53.070 1 ATOM 419 C CB . TRP 63 63 ? A 26.353 9.440 -29.570 1.000 1 A 53.070 1 ATOM 420 O O . TRP 63 63 ? A 28.441 7.395 -29.548 1.000 1 A 53.070 1 ATOM 421 C CG . TRP 63 63 ? A 25.435 10.136 -28.610 1.000 1 A 53.070 1 ATOM 422 C CD1 . TRP 63 63 ? A 24.764 11.287 -28.840 1.000 1 A 53.070 1 ATOM 423 C CD2 . TRP 63 63 ? A 25.073 9.730 -27.251 1.000 1 A 53.070 1 ATOM 424 C CE2 . TRP 63 63 ? A 24.167 10.694 -26.717 1.000 1 A 53.070 1 ATOM 425 C CE3 . TRP 63 63 ? A 25.420 8.643 -26.417 1.000 1 A 53.070 1 ATOM 426 N NE1 . TRP 63 63 ? A 24.015 11.620 -27.727 1.000 1 A 53.070 1 ATOM 427 C CH2 . TRP 63 63 ? A 23.997 9.497 -24.621 1.000 1 A 53.070 1 ATOM 428 C CZ2 . TRP 63 63 ? A 23.631 10.589 -25.425 1.000 1 A 53.070 1 ATOM 429 C CZ3 . TRP 63 63 ? A 24.889 8.527 -25.117 1.000 1 A 53.070 1 ATOM 430 N N . GLY 64 64 ? A 29.996 8.849 -30.218 1.000 1 A 44.420 1 ATOM 431 C CA . GLY 64 64 ? A 31.037 7.862 -30.526 1.000 1 A 44.420 1 ATOM 432 C C . GLY 64 64 ? A 32.075 7.788 -29.406 1.000 1 A 44.420 1 ATOM 433 O O . GLY 64 64 ? A 32.733 8.780 -29.114 1.000 1 A 44.420 1 ATOM 434 N N . GLY 65 65 ? A 32.188 6.620 -28.772 1.000 1 A 43.640 1 ATOM 435 C CA . GLY 65 65 ? A 32.900 6.402 -27.515 1.000 1 A 43.640 1 ATOM 436 C C . GLY 65 65 ? A 34.344 6.906 -27.434 1.000 1 A 43.640 1 ATOM 437 O O . GLY 65 65 ? A 35.162 6.692 -28.322 1.000 1 A 43.640 1 ATOM 438 N N . GLN 66 66 ? A 34.660 7.478 -26.276 1.000 1 A 43.830 1 ATOM 439 C CA . GLN 66 66 ? A 36.007 7.518 -25.724 1.000 1 A 43.830 1 ATOM 440 C C . GLN 66 66 ? A 35.940 6.805 -24.367 1.000 1 A 43.830 1 ATOM 441 C CB . GLN 66 66 ? A 36.482 8.974 -25.582 1.000 1 A 43.830 1 ATOM 442 O O . GLN 66 66 ? A 35.182 7.251 -23.500 1.000 1 A 43.830 1 ATOM 443 C CG . GLN 66 66 ? A 36.736 9.652 -26.940 1.000 1 A 43.830 1 ATOM 444 C CD . GLN 66 66 ? A 37.926 9.072 -27.701 1.000 1 A 43.830 1 ATOM 445 N NE2 . GLN 66 66 ? A 38.022 9.310 -28.990 1.000 1 A 43.830 1 ATOM 446 O OE1 . GLN 66 66 ? A 38.799 8.414 -27.159 1.000 1 A 43.830 1 ATOM 447 N N . PRO 67 67 ? A 36.652 5.684 -24.153 1.000 1 A 50.300 1 ATOM 448 C CA . PRO 67 67 ? A 36.812 5.125 -22.822 1.000 1 A 50.300 1 ATOM 449 C C . PRO 67 67 ? A 37.681 6.097 -22.019 1.000 1 A 50.300 1 ATOM 450 C CB . PRO 67 67 ? A 37.436 3.740 -23.028 1.000 1 A 50.300 1 ATOM 451 O O . PRO 67 67 ? A 38.906 6.068 -22.089 1.000 1 A 50.300 1 ATOM 452 C CG . PRO 67 67 ? A 38.216 3.885 -24.334 1.000 1 A 50.300 1 ATOM 453 C CD . PRO 67 67 ? A 37.439 4.940 -25.125 1.000 1 A 50.300 1 ATOM 454 N N . MET 68 68 ? A 37.037 7.004 -21.283 1.000 1 A 52.550 1 ATOM 455 C CA . MET 68 68 ? A 37.689 7.733 -20.201 1.000 1 A 52.550 1 ATOM 456 C C . MET 68 68 ? A 38.178 6.682 -19.205 1.000 1 A 52.550 1 ATOM 457 C CB . MET 68 68 ? A 36.717 8.742 -19.559 1.000 1 A 52.550 1 ATOM 458 O O . MET 68 68 ? A 37.383 6.046 -18.513 1.000 1 A 52.550 1 ATOM 459 C CG . MET 68 68 ? A 36.984 10.185 -20.006 1.000 1 A 52.550 1 ATOM 460 S SD . MET 68 68 ? A 38.350 10.982 -19.114 1.000 1 A 52.550 1 ATOM 461 C CE . MET 68 68 ? A 38.352 12.617 -19.894 1.000 1 A 52.550 1 ATOM 462 N N . MET 69 69 ? A 39.489 6.452 -19.219 1.000 1 A 51.670 1 ATOM 463 C CA . MET 69 69 ? A 40.226 5.733 -18.186 1.000 1 A 51.670 1 ATOM 464 C C . MET 69 69 ? A 39.642 6.072 -16.804 1.000 1 A 51.670 1 ATOM 465 C CB . MET 69 69 ? A 41.688 6.201 -18.234 1.000 1 A 51.670 1 ATOM 466 O O . MET 69 69 ? A 39.502 7.262 -16.502 1.000 1 A 51.670 1 ATOM 467 C CG . MET 69 69 ? A 42.511 5.499 -19.315 1.000 1 A 51.670 1 ATOM 468 S SD . MET 69 69 ? A 43.013 3.825 -18.832 1.000 1 A 51.670 1 ATOM 469 C CE . MET 69 69 ? A 44.723 3.830 -19.433 1.000 1 A 51.670 1 ATOM 470 N N . PRO 70 70 ? A 39.301 5.080 -15.959 1.000 1 A 51.380 1 ATOM 471 C CA . PRO 70 70 ? A 38.858 5.359 -14.601 1.000 1 A 51.380 1 ATOM 472 C C . PRO 70 70 ? A 39.927 6.194 -13.881 1.000 1 A 51.380 1 ATOM 473 C CB . PRO 70 70 ? A 38.646 4.002 -13.922 1.000 1 A 51.380 1 ATOM 474 O O . PRO 70 70 ? A 41.116 5.875 -13.996 1.000 1 A 51.380 1 ATOM 475 C CG . PRO 70 70 ? A 38.518 3.022 -15.087 1.000 1 A 51.380 1 ATOM 476 C CD . PRO 70 70 ? A 39.359 3.650 -16.195 1.000 1 A 51.380 1 ATOM 477 N N . PRO 71 71 ? A 39.548 7.259 -13.155 1.000 1 A 51.560 1 ATOM 478 C CA . PRO 71 71 ? A 40.508 8.067 -12.424 1.000 1 A 51.560 1 ATOM 479 C C . PRO 71 71 ? A 41.177 7.190 -11.360 1.000 1 A 51.560 1 ATOM 480 C CB . PRO 71 71 ? A 39.706 9.236 -11.842 1.000 1 A 51.560 1 ATOM 481 O O . PRO 71 71 ? A 40.496 6.572 -10.549 1.000 1 A 51.560 1 ATOM 482 C CG . PRO 71 71 ? A 38.290 8.672 -11.713 1.000 1 A 51.560 1 ATOM 483 C CD . PRO 71 71 ? A 38.188 7.690 -12.878 1.000 1 A 51.560 1 ATOM 484 N N . TYR 72 72 ? A 42.507 7.100 -11.438 1.000 1 A 42.850 1 ATOM 485 C CA . TYR 72 72 ? A 43.454 6.674 -10.401 1.000 1 A 42.850 1 ATOM 486 C C . TYR 72 72 ? A 42.836 6.104 -9.108 1.000 1 A 42.850 1 ATOM 487 C CB . TYR 72 72 ? A 44.301 7.911 -10.039 1.000 1 A 42.850 1 ATOM 488 O O . TYR 72 72 ? A 42.329 6.869 -8.292 1.000 1 A 42.850 1 ATOM 489 C CG . TYR 72 72 ? A 45.413 8.244 -11.014 1.000 1 A 42.850 1 ATOM 490 C CD1 . TYR 72 72 ? A 46.728 7.839 -10.712 1.000 1 A 42.850 1 ATOM 491 C CD2 . TYR 72 72 ? A 45.156 8.975 -12.192 1.000 1 A 42.850 1 ATOM 492 C CE1 . TYR 72 72 ? A 47.786 8.155 -11.583 1.000 1 A 42.850 1 ATOM 493 C CE2 . TYR 72 72 ? A 46.213 9.285 -13.071 1.000 1 A 42.850 1 ATOM 494 O OH . TYR 72 72 ? A 48.547 9.187 -13.609 1.000 1 A 42.850 1 ATOM 495 C CZ . TYR 72 72 ? A 47.529 8.878 -12.767 1.000 1 A 42.850 1 ATOM 496 N N . GLY 73 73 ? A 43.001 4.798 -8.840 1.000 1 A 46.080 1 ATOM 497 C CA . GLY 73 73 ? A 43.024 4.357 -7.436 1.000 1 A 46.080 1 ATOM 498 C C . GLY 73 73 ? A 42.535 2.965 -7.043 1.000 1 A 46.080 1 ATOM 499 O O . GLY 73 73 ? A 42.528 2.689 -5.848 1.000 1 A 46.080 1 ATOM 500 N N . THR 74 74 ? A 42.144 2.058 -7.943 1.000 1 A 43.430 1 ATOM 501 C CA . THR 74 74 ? A 41.796 0.681 -7.517 1.000 1 A 43.430 1 ATOM 502 C C . THR 74 74 ? A 42.436 -0.345 -8.452 1.000 1 A 43.430 1 ATOM 503 C CB . THR 74 74 ? A 40.279 0.494 -7.344 1.000 1 A 43.430 1 ATOM 504 O O . THR 74 74 ? A 42.358 -0.180 -9.672 1.000 1 A 43.430 1 ATOM 505 C CG2 . THR 74 74 ? A 39.926 -0.669 -6.418 1.000 1 A 43.430 1 ATOM 506 O OG1 . THR 74 74 ? A 39.717 1.635 -6.738 1.000 1 A 43.430 1 ATOM 507 N N . PRO 75 75 ? A 43.172 -1.340 -7.916 1.000 1 A 42.310 1 ATOM 508 C CA . PRO 75 75 ? A 44.113 -2.125 -8.696 1.000 1 A 42.310 1 ATOM 509 C C . PRO 75 75 ? A 43.370 -2.999 -9.696 1.000 1 A 42.310 1 ATOM 510 C CB . PRO 75 75 ? A 44.935 -2.939 -7.690 1.000 1 A 42.310 1 ATOM 511 O O . PRO 75 75 ? A 42.387 -3.664 -9.373 1.000 1 A 42.310 1 ATOM 512 C CG . PRO 75 75 ? A 43.983 -3.089 -6.507 1.000 1 A 42.310 1 ATOM 513 C CD . PRO 75 75 ? A 43.202 -1.779 -6.528 1.000 1 A 42.310 1 ATOM 514 N N . HIS 76 76 ? A 43.894 -3.017 -10.918 1.000 1 A 45.810 1 ATOM 515 C CA . HIS 76 76 ? A 43.585 -4.063 -11.875 1.000 1 A 45.810 1 ATOM 516 C C . HIS 76 76 ? A 43.816 -5.418 -11.189 1.000 1 A 45.810 1 ATOM 517 C CB . HIS 76 76 ? A 44.525 -3.925 -13.083 1.000 1 A 45.810 1 ATOM 518 O O . HIS 76 76 ? A 44.862 -5.582 -10.547 1.000 1 A 45.810 1 ATOM 519 C CG . HIS 76 76 ? A 44.203 -2.773 -14.003 1.000 1 A 45.810 1 ATOM 520 C CD2 . HIS 76 76 ? A 44.016 -2.864 -15.356 1.000 1 A 45.810 1 ATOM 521 N ND1 . HIS 76 76 ? A 44.016 -1.450 -13.660 1.000 1 A 45.810 1 ATOM 522 C CE1 . HIS 76 76 ? A 43.727 -0.767 -14.780 1.000 1 A 45.810 1 ATOM 523 N NE2 . HIS 76 76 ? A 43.714 -1.589 -15.838 1.000 1 A 45.810 1 ATOM 524 N N . PRO 77 77 ? A 42.916 -6.407 -11.327 1.000 1 A 50.630 1 ATOM 525 C CA . PRO 77 77 ? A 43.304 -7.788 -11.122 1.000 1 A 50.630 1 ATOM 526 C C . PRO 77 77 ? A 44.360 -8.107 -12.183 1.000 1 A 50.630 1 ATOM 527 C CB . PRO 77 77 ? A 42.023 -8.617 -11.206 1.000 1 A 50.630 1 ATOM 528 O O . PRO 77 77 ? A 44.075 -8.412 -13.337 1.000 1 A 50.630 1 ATOM 529 C CG . PRO 77 77 ? A 41.097 -7.763 -12.069 1.000 1 A 50.630 1 ATOM 530 C CD . PRO 77 77 ? A 41.553 -6.322 -11.824 1.000 1 A 50.630 1 ATOM 531 N N . GLN 78 78 ? A 45.605 -7.908 -11.766 1.000 1 A 44.330 1 ATOM 532 C CA . GLN 78 78 ? A 46.804 -8.566 -12.236 1.000 1 A 44.330 1 ATOM 533 C C . GLN 78 78 ? A 46.472 -9.909 -12.879 1.000 1 A 44.330 1 ATOM 534 C CB . GLN 78 78 ? A 47.751 -8.705 -11.031 1.000 1 A 44.330 1 ATOM 535 O O . GLN 78 78 ? A 45.860 -10.773 -12.256 1.000 1 A 44.330 1 ATOM 536 C CG . GLN 78 78 ? A 47.134 -9.340 -9.761 1.000 1 A 44.330 1 ATOM 537 C CD . GLN 78 78 ? A 47.715 -8.724 -8.494 1.000 1 A 44.330 1 ATOM 538 N NE2 . GLN 78 78 ? A 46.910 -8.162 -7.617 1.000 1 A 44.330 1 ATOM 539 O OE1 . GLN 78 78 ? A 48.912 -8.708 -8.280 1.000 1 A 44.330 1 ATOM 540 N N . TYR 79 79 ? A 46.859 -10.015 -14.146 1.000 1 A 37.640 1 ATOM 541 C CA . TYR 79 79 ? A 46.898 -11.204 -14.980 1.000 1 A 37.640 1 ATOM 542 C C . TYR 79 79 ? A 47.100 -12.493 -14.169 1.000 1 A 37.640 1 ATOM 543 C CB . TYR 79 79 ? A 48.047 -10.996 -15.981 1.000 1 A 37.640 1 ATOM 544 O O . TYR 79 79 ? A 48.220 -12.949 -13.956 1.000 1 A 37.640 1 ATOM 545 C CG . TYR 79 79 ? A 47.746 -10.006 -17.092 1.000 1 A 37.640 1 ATOM 546 C CD1 . TYR 79 79 ? A 47.344 -10.501 -18.346 1.000 1 A 37.640 1 ATOM 547 C CD2 . TYR 79 79 ? A 47.881 -8.614 -16.898 1.000 1 A 37.640 1 ATOM 548 C CE1 . TYR 79 79 ? A 47.075 -9.617 -19.405 1.000 1 A 37.640 1 ATOM 549 C CE2 . TYR 79 79 ? A 47.597 -7.723 -17.954 1.000 1 A 37.640 1 ATOM 550 O OH . TYR 79 79 ? A 46.938 -7.384 -20.244 1.000 1 A 37.640 1 ATOM 551 C CZ . TYR 79 79 ? A 47.198 -8.227 -19.212 1.000 1 A 37.640 1 ATOM 552 N N . GLY 80 80 ? A 45.994 -13.110 -13.756 1.000 1 A 41.420 1 ATOM 553 C CA . GLY 80 80 ? A 45.954 -14.479 -13.265 1.000 1 A 41.420 1 ATOM 554 C C . GLY 80 80 ? A 45.937 -15.429 -14.452 1.000 1 A 41.420 1 ATOM 555 O O . GLY 80 80 ? A 44.943 -16.100 -14.703 1.000 1 A 41.420 1 ATOM 556 N N . ALA 81 81 ? A 47.017 -15.447 -15.228 1.000 1 A 45.870 1 ATOM 557 C CA . ALA 81 81 ? A 47.276 -16.536 -16.150 1.000 1 A 45.870 1 ATOM 558 C C . ALA 81 81 ? A 47.654 -17.761 -15.315 1.000 1 A 45.870 1 ATOM 559 C CB . ALA 81 81 ? A 48.397 -16.115 -17.111 1.000 1 A 45.870 1 ATOM 560 O O . ALA 81 81 ? A 48.812 -17.910 -14.959 1.000 1 A 45.870 1 ATOM 561 N N . MET 82 82 ? A 46.693 -18.611 -14.961 1.000 1 A 44.430 1 ATOM 562 C CA . MET 82 82 ? A 46.963 -19.949 -14.431 1.000 1 A 44.430 1 ATOM 563 C C . MET 82 82 ? A 45.725 -20.818 -14.659 1.000 1 A 44.430 1 ATOM 564 C CB . MET 82 82 ? A 47.395 -19.885 -12.947 1.000 1 A 44.430 1 ATOM 565 O O . MET 82 82 ? A 44.738 -20.716 -13.942 1.000 1 A 44.430 1 ATOM 566 C CG . MET 82 82 ? A 48.915 -20.069 -12.767 1.000 1 A 44.430 1 ATOM 567 S SD . MET 82 82 ? A 49.588 -19.634 -11.139 1.000 1 A 44.430 1 ATOM 568 C CE . MET 82 82 ? A 49.480 -17.823 -11.179 1.000 1 A 44.430 1 ATOM 569 N N . TYR 83 83 ? A 45.787 -21.600 -15.739 1.000 1 A 37.550 1 ATOM 570 C CA . TYR 83 83 ? A 45.154 -22.906 -15.931 1.000 1 A 37.550 1 ATOM 571 C C . TYR 83 83 ? A 44.005 -23.266 -14.975 1.000 1 A 37.550 1 ATOM 572 C CB . TYR 83 83 ? A 46.267 -23.965 -15.811 1.000 1 A 37.550 1 ATOM 573 O O . TYR 83 83 ? A 44.231 -23.564 -13.805 1.000 1 A 37.550 1 ATOM 574 C CG . TYR 83 83 ? A 46.930 -24.332 -17.123 1.000 1 A 37.550 1 ATOM 575 C CD1 . TYR 83 83 ? A 46.603 -25.563 -17.723 1.000 1 A 37.550 1 ATOM 576 C CD2 . TYR 83 83 ? A 47.860 -23.472 -17.742 1.000 1 A 37.550 1 ATOM 577 C CE1 . TYR 83 83 ? A 47.209 -25.942 -18.933 1.000 1 A 37.550 1 ATOM 578 C CE2 . TYR 83 83 ? A 48.459 -23.844 -18.964 1.000 1 A 37.550 1 ATOM 579 O OH . TYR 83 83 ? A 48.710 -25.463 -20.727 1.000 1 A 37.550 1 ATOM 580 C CZ . TYR 83 83 ? A 48.135 -25.085 -19.557 1.000 1 A 37.550 1 ATOM 581 N N . HIS 84 84 ? A 42.795 -23.412 -15.517 1.000 1 A 51.530 1 ATOM 582 C CA . HIS 84 84 ? A 41.826 -24.344 -14.939 1.000 1 A 51.530 1 ATOM 583 C C . HIS 84 84 ? A 42.456 -25.748 -15.035 1.000 1 A 51.530 1 ATOM 584 C CB . HIS 84 84 ? A 40.468 -24.287 -15.671 1.000 1 A 51.530 1 ATOM 585 O O . HIS 84 84 ? A 42.742 -26.197 -16.152 1.000 1 A 51.530 1 ATOM 586 C CG . HIS 84 84 ? A 40.273 -23.062 -16.528 1.000 1 A 51.530 1 ATOM 587 C CD2 . HIS 84 84 ? A 40.522 -22.972 -17.871 1.000 1 A 51.530 1 ATOM 588 N ND1 . HIS 84 84 ? A 39.948 -21.801 -16.087 1.000 1 A 51.530 1 ATOM 589 C CE1 . HIS 84 84 ? A 39.997 -20.970 -17.140 1.000 1 A 51.530 1 ATOM 590 N NE2 . HIS 84 84 ? A 40.351 -21.637 -18.248 1.000 1 A 51.530 1 ATOM 591 N N . PRO 85 85 ? A 42.749 -26.431 -13.916 1.000 1 A 44.510 1 ATOM 592 C CA . PRO 85 85 ? A 43.288 -27.778 -13.971 1.000 1 A 44.510 1 ATOM 593 C C . PRO 85 85 ? A 42.235 -28.721 -14.566 1.000 1 A 44.510 1 ATOM 594 C CB . PRO 85 85 ? A 43.686 -28.127 -12.533 1.000 1 A 44.510 1 ATOM 595 O O . PRO 85 85 ? A 41.122 -28.821 -14.065 1.000 1 A 44.510 1 ATOM 596 C CG . PRO 85 85 ? A 42.771 -27.250 -11.680 1.000 1 A 44.510 1 ATOM 597 C CD . PRO 85 85 ? A 42.553 -26.007 -12.538 1.000 1 A 44.510 1 ATOM 598 N N . ALA 86 86 ? A 42.626 -29.392 -15.648 1.000 1 A 41.770 1 ATOM 599 C CA . ALA 86 86 ? A 42.150 -30.700 -16.090 1.000 1 A 41.770 1 ATOM 600 C C . ALA 86 86 ? A 40.619 -30.954 -16.140 1.000 1 A 41.770 1 ATOM 601 C CB . ALA 86 86 ? A 42.894 -31.748 -15.248 1.000 1 A 41.770 1 ATOM 602 O O . ALA 86 86 ? A 40.013 -31.444 -15.198 1.000 1 A 41.770 1 ATOM 603 N N . GLY 87 87 ? A 40.048 -30.851 -17.345 1.000 1 A 48.380 1 ATOM 604 C CA . GLY 87 87 ? A 39.686 -32.099 -18.032 1.000 1 A 48.380 1 ATOM 605 C C . GLY 87 87 ? A 38.283 -32.702 -17.898 1.000 1 A 48.380 1 ATOM 606 O O . GLY 87 87 ? A 38.174 -33.904 -18.112 1.000 1 A 48.380 1 ATOM 607 N N . MET 88 88 ? A 37.203 -31.948 -17.675 1.000 1 A 42.560 1 ATOM 608 C CA . MET 88 88 ? A 35.851 -32.493 -17.906 1.000 1 A 42.560 1 ATOM 609 C C . MET 88 88 ? A 35.130 -31.762 -19.036 1.000 1 A 42.560 1 ATOM 610 C CB . MET 88 88 ? A 35.035 -32.600 -16.614 1.000 1 A 42.560 1 ATOM 611 O O . MET 88 88 ? A 34.570 -30.683 -18.872 1.000 1 A 42.560 1 ATOM 612 C CG . MET 88 88 ? A 35.676 -33.595 -15.635 1.000 1 A 42.560 1 ATOM 613 S SD . MET 88 88 ? A 36.509 -32.822 -14.227 1.000 1 A 42.560 1 ATOM 614 C CE . MET 88 88 ? A 35.185 -32.951 -12.998 1.000 1 A 42.560 1 ATOM 615 N N . TYR 89 89 ? A 35.159 -32.392 -20.207 1.000 1 A 39.730 1 ATOM 616 C CA . TYR 89 89 ? A 34.227 -32.159 -21.300 1.000 1 A 39.730 1 ATOM 617 C C . TYR 89 89 ? A 32.776 -32.185 -20.790 1.000 1 A 39.730 1 ATOM 618 C CB . TYR 89 89 ? A 34.412 -33.302 -22.318 1.000 1 A 39.730 1 ATOM 619 O O . TYR 89 89 ? A 32.295 -33.222 -20.343 1.000 1 A 39.730 1 ATOM 620 C CG . TYR 89 89 ? A 35.342 -33.017 -23.478 1.000 1 A 39.730 1 ATOM 621 C CD1 . TYR 89 89 ? A 34.777 -32.730 -24.731 1.000 1 A 39.730 1 ATOM 622 C CD2 . TYR 89 89 ? A 36.742 -33.091 -23.343 1.000 1 A 39.730 1 ATOM 623 C CE1 . TYR 89 89 ? A 35.591 -32.550 -25.861 1.000 1 A 39.730 1 ATOM 624 C CE2 . TYR 89 89 ? A 37.567 -32.893 -24.470 1.000 1 A 39.730 1 ATOM 625 O OH . TYR 89 89 ? A 37.772 -32.456 -26.829 1.000 1 A 39.730 1 ATOM 626 C CZ . TYR 89 89 ? A 36.989 -32.633 -25.734 1.000 1 A 39.730 1 ATOM 627 N N . ALA 90 90 ? A 32.054 -31.081 -20.952 1.000 1 A 41.710 1 ATOM 628 C CA . ALA 90 90 ? A 30.602 -31.093 -21.070 1.000 1 A 41.710 1 ATOM 629 C C . ALA 90 90 ? A 30.263 -30.388 -22.387 1.000 1 A 41.710 1 ATOM 630 C CB . ALA 90 90 ? A 29.961 -30.469 -19.824 1.000 1 A 41.710 1 ATOM 631 O O . ALA 90 90 ? A 30.135 -29.166 -22.447 1.000 1 A 41.710 1 ATOM 632 N N . HIS 91 91 ? A 30.205 -31.164 -23.476 1.000 1 A 39.400 1 ATOM 633 C CA . HIS 91 91 ? A 29.601 -30.695 -24.722 1.000 1 A 39.400 1 ATOM 634 C C . HIS 91 91 ? A 28.175 -30.206 -24.416 1.000 1 A 39.400 1 ATOM 635 C CB . HIS 91 91 ? A 29.566 -31.818 -25.774 1.000 1 A 39.400 1 ATOM 636 O O . HIS 91 91 ? A 27.474 -30.860 -23.640 1.000 1 A 39.400 1 ATOM 637 C CG . HIS 91 91 ? A 30.718 -31.770 -26.743 1.000 1 A 39.400 1 ATOM 638 C CD2 . HIS 91 91 ? A 31.857 -32.522 -26.703 1.000 1 A 39.400 1 ATOM 639 N ND1 . HIS 91 91 ? A 30.784 -31.001 -27.883 1.000 1 A 39.400 1 ATOM 640 C CE1 . HIS 91 91 ? A 31.950 -31.262 -28.496 1.000 1 A 39.400 1 ATOM 641 N NE2 . HIS 91 91 ? A 32.644 -32.175 -27.804 1.000 1 A 39.400 1 ATOM 642 N N . PRO 92 92 ? A 27.727 -29.082 -25.001 1.000 1 A 50.020 1 ATOM 643 C CA . PRO 92 92 ? A 26.377 -28.590 -24.785 1.000 1 A 50.020 1 ATOM 644 C C . PRO 92 92 ? A 25.388 -29.644 -25.280 1.000 1 A 50.020 1 ATOM 645 C CB . PRO 92 92 ? A 26.291 -27.264 -25.550 1.000 1 A 50.020 1 ATOM 646 O O . PRO 92 92 ? A 25.334 -29.950 -26.472 1.000 1 A 50.020 1 ATOM 647 C CG . PRO 92 92 ? A 27.358 -27.401 -26.637 1.000 1 A 50.020 1 ATOM 648 C CD . PRO 92 92 ? A 28.428 -28.265 -25.976 1.000 1 A 50.020 1 ATOM 649 N N . ALA 93 93 ? A 24.627 -30.218 -24.348 1.000 1 A 46.290 1 ATOM 650 C CA . ALA 93 93 ? A 23.496 -31.065 -24.667 1.000 1 A 46.290 1 ATOM 651 C C . ALA 93 93 ? A 22.546 -30.260 -25.559 1.000 1 A 46.290 1 ATOM 652 C CB . ALA 93 93 ? A 22.835 -31.544 -23.369 1.000 1 A 46.290 1 ATOM 653 O O . ALA 93 93 ? A 21.969 -29.251 -25.146 1.000 1 A 46.290 1 ATOM 654 N N . MET 94 94 ? A 22.438 -30.699 -26.810 1.000 1 A 44.790 1 ATOM 655 C CA . MET 94 94 ? A 21.381 -30.307 -27.724 1.000 1 A 44.790 1 ATOM 656 C C . MET 94 94 ? A 20.056 -30.680 -27.057 1.000 1 A 44.790 1 ATOM 657 C CB . MET 94 94 ? A 21.566 -31.064 -29.052 1.000 1 A 44.790 1 ATOM 658 O O . MET 94 94 ? A 19.694 -31.852 -27.003 1.000 1 A 44.790 1 ATOM 659 C CG . MET 94 94 ? A 22.805 -30.633 -29.851 1.000 1 A 44.790 1 ATOM 660 S SD . MET 94 94 ? A 22.486 -29.487 -31.224 1.000 1 A 44.790 1 ATOM 661 C CE . MET 94 94 ? A 22.041 -27.973 -30.337 1.000 1 A 44.790 1 ATOM 662 N N . TYR 95 95 ? A 19.360 -29.694 -26.500 1.000 1 A 42.650 1 ATOM 663 C CA . TYR 95 95 ? A 17.995 -29.867 -26.019 1.000 1 A 42.650 1 ATOM 664 C C . TYR 95 95 ? A 17.085 -30.006 -27.250 1.000 1 A 42.650 1 ATOM 665 C CB . TYR 95 95 ? A 17.615 -28.714 -25.063 1.000 1 A 42.650 1 ATOM 666 O O . TYR 95 95 ? A 16.586 -29.019 -27.787 1.000 1 A 42.650 1 ATOM 667 C CG . TYR 95 95 ? A 17.332 -29.150 -23.635 1.000 1 A 42.650 1 ATOM 668 C CD1 . TYR 95 95 ? A 16.003 -29.368 -23.220 1.000 1 A 42.650 1 ATOM 669 C CD2 . TYR 95 95 ? A 18.389 -29.332 -22.720 1.000 1 A 42.650 1 ATOM 670 C CE1 . TYR 95 95 ? A 15.728 -29.744 -21.892 1.000 1 A 42.650 1 ATOM 671 C CE2 . TYR 95 95 ? A 18.118 -29.719 -21.391 1.000 1 A 42.650 1 ATOM 672 O OH . TYR 95 95 ? A 16.504 -30.283 -19.695 1.000 1 A 42.650 1 ATOM 673 C CZ . TYR 95 95 ? A 16.783 -29.920 -20.974 1.000 1 A 42.650 1 ATOM 674 N N . GLY 96 96 ? A 16.921 -31.243 -27.730 1.000 1 A 39.190 1 ATOM 675 C CA . GLY 96 96 ? A 15.687 -31.656 -28.403 1.000 1 A 39.190 1 ATOM 676 C C . GLY 96 96 ? A 14.552 -31.490 -27.392 1.000 1 A 39.190 1 ATOM 677 O O . GLY 96 96 ? A 14.716 -31.806 -26.219 1.000 1 A 39.190 1 ATOM 678 N N . GLN 97 97 ? A 13.520 -30.719 -27.720 1.000 1 A 34.740 1 ATOM 679 C CA . GLN 97 97 ? A 12.292 -31.205 -28.351 1.000 1 A 34.740 1 ATOM 680 C C . GLN 97 97 ? A 11.651 -32.356 -27.551 1.000 1 A 34.740 1 ATOM 681 C CB . GLN 97 97 ? A 12.495 -31.514 -29.848 1.000 1 A 34.740 1 ATOM 682 O O . GLN 97 97 ? A 12.284 -33.378 -27.344 1.000 1 A 34.740 1 ATOM 683 C CG . GLN 97 97 ? A 11.157 -31.561 -30.606 1.000 1 A 34.740 1 ATOM 684 C CD . GLN 97 97 ? A 11.348 -31.821 -32.097 1.000 1 A 34.740 1 ATOM 685 N NE2 . GLN 97 97 ? A 11.307 -30.805 -32.933 1.000 1 A 34.740 1 ATOM 686 O OE1 . GLN 97 97 ? A 11.546 -32.939 -32.538 1.000 1 A 34.740 1 ATOM 687 N N . TYR 98 98 ? A 10.384 -32.141 -27.176 1.000 1 A 37.720 1 ATOM 688 C CA . TYR 98 98 ? A 9.422 -33.002 -26.464 1.000 1 A 37.720 1 ATOM 689 C C . TYR 98 98 ? A 9.709 -33.339 -24.985 1.000 1 A 37.720 1 ATOM 690 C CB . TYR 98 98 ? A 8.945 -34.184 -27.320 1.000 1 A 37.720 1 ATOM 691 O O . TYR 98 98 ? A 10.792 -33.736 -24.577 1.000 1 A 37.720 1 ATOM 692 C CG . TYR 98 98 ? A 9.954 -35.286 -27.557 1.000 1 A 37.720 1 ATOM 693 C CD1 . TYR 98 98 ? A 10.757 -35.274 -28.715 1.000 1 A 37.720 1 ATOM 694 C CD2 . TYR 98 98 ? A 10.094 -36.324 -26.617 1.000 1 A 37.720 1 ATOM 695 C CE1 . TYR 98 98 ? A 11.759 -36.243 -28.893 1.000 1 A 37.720 1 ATOM 696 C CE2 . TYR 98 98 ? A 11.060 -37.326 -26.818 1.000 1 A 37.720 1 ATOM 697 O OH . TYR 98 98 ? A 12.862 -38.224 -28.121 1.000 1 A 37.720 1 ATOM 698 C CZ . TYR 98 98 ? A 11.909 -37.273 -27.942 1.000 1 A 37.720 1 ATOM 699 N N . GLY 99 99 ? A 8.687 -33.094 -24.161 1.000 1 A 33.940 1 ATOM 700 C CA . GLY 99 99 ? A 8.788 -33.000 -22.713 1.000 1 A 33.940 1 ATOM 701 C C . GLY 99 99 ? A 9.014 -34.313 -21.973 1.000 1 A 33.940 1 ATOM 702 O O . GLY 99 99 ? A 8.517 -35.367 -22.354 1.000 1 A 33.940 1 ATOM 703 N N . LEU 100 100 ? A 9.697 -34.175 -20.842 1.000 1 A 39.860 1 ATOM 704 C CA . LEU 100 100 ? A 9.542 -34.979 -19.639 1.000 1 A 39.860 1 ATOM 705 C C . LEU 100 100 ? A 9.947 -34.082 -18.464 1.000 1 A 39.860 1 ATOM 706 C CB . LEU 100 100 ? A 10.398 -36.260 -19.727 1.000 1 A 39.860 1 ATOM 707 O O . LEU 100 100 ? A 11.081 -33.611 -18.392 1.000 1 A 39.860 1 ATOM 708 C CG . LEU 100 100 ? A 9.581 -37.484 -20.202 1.000 1 A 39.860 1 ATOM 709 C CD1 . LEU 100 100 ? A 10.346 -38.289 -21.251 1.000 1 A 39.860 1 ATOM 710 C CD2 . LEU 100 100 ? A 9.238 -38.399 -19.026 1.000 1 A 39.860 1 ATOM 711 N N . GLN 101 101 ? A 8.999 -33.819 -17.564 1.000 1 A 34.270 1 ATOM 712 C CA . GLN 101 101 ? A 9.290 -33.365 -16.209 1.000 1 A 34.270 1 ATOM 713 C C . GLN 101 101 ? A 10.248 -34.391 -15.584 1.000 1 A 34.270 1 ATOM 714 C CB . GLN 101 101 ? A 7.975 -33.309 -15.388 1.000 1 A 34.270 1 ATOM 715 O O . GLN 101 101 ? A 9.850 -35.525 -15.329 1.000 1 A 34.270 1 ATOM 716 C CG . GLN 101 101 ? A 7.568 -31.925 -14.862 1.000 1 A 34.270 1 ATOM 717 C CD . GLN 101 101 ? A 6.621 -31.146 -15.770 1.000 1 A 34.270 1 ATOM 718 N NE2 . GLN 101 101 ? A 5.911 -30.179 -15.229 1.000 1 A 34.270 1 ATOM 719 O OE1 . GLN 101 101 ? A 6.496 -31.370 -16.962 1.000 1 A 34.270 1 ATOM 720 N N . SER 102 102 ? A 11.503 -34.022 -15.341 1.000 1 A 34.620 1 ATOM 721 C CA . SER 102 102 ? A 12.331 -34.740 -14.377 1.000 1 A 34.620 1 ATOM 722 C C . SER 102 102 ? A 12.202 -34.024 -13.039 1.000 1 A 34.620 1 ATOM 723 C CB . SER 102 102 ? A 13.778 -34.899 -14.855 1.000 1 A 34.620 1 ATOM 724 O O . SER 102 102 ? A 12.976 -33.120 -12.720 1.000 1 A 34.620 1 ATOM 725 O OG . SER 102 102 ? A 14.419 -33.646 -14.955 1.000 1 A 34.620 1 ATOM 726 N N . ASP 103 103 ? A 11.197 -34.417 -12.264 1.000 1 A 32.300 1 ATOM 727 C CA . ASP 103 103 ? A 11.329 -34.345 -10.817 1.000 1 A 32.300 1 ATOM 728 C C . ASP 103 103 ? A 12.548 -35.182 -10.407 1.000 1 A 32.300 1 ATOM 729 C CB . ASP 103 103 ? A 10.057 -34.865 -10.124 1.000 1 A 32.300 1 ATOM 730 O O . ASP 103 103 ? A 12.797 -36.256 -10.959 1.000 1 A 32.300 1 ATOM 731 C CG . ASP 103 103 ? A 8.963 -33.800 -10.028 1.000 1 A 32.300 1 ATOM 732 O OD1 . ASP 103 103 ? A 9.308 -32.672 -9.607 1.000 1 A 32.300 1 ATOM 733 O OD2 . ASP 103 103 ? A 7.800 -34.122 -10.355 1.000 1 A 32.300 1 ATOM 734 N N . THR 104 104 ? A 13.251 -34.729 -9.371 1.000 1 A 40.440 1 ATOM 735 C CA . THR 104 104 ? A 14.323 -35.448 -8.655 1.000 1 A 40.440 1 ATOM 736 C C . THR 104 104 ? A 15.749 -35.254 -9.182 1.000 1 A 40.440 1 ATOM 737 C CB . THR 104 104 ? A 14.028 -36.950 -8.413 1.000 1 A 40.440 1 ATOM 738 O O . THR 104 104 ? A 16.366 -36.150 -9.743 1.000 1 A 40.440 1 ATOM 739 C CG2 . THR 104 104 ? A 14.608 -37.405 -7.076 1.000 1 A 40.440 1 ATOM 740 O OG1 . THR 104 104 ? A 12.653 -37.231 -8.361 1.000 1 A 40.440 1 ATOM 741 N N . MET 105 105 ? A 16.357 -34.122 -8.826 1.000 1 A 35.530 1 ATOM 742 C CA . MET 105 105 ? A 17.750 -34.132 -8.360 1.000 1 A 35.530 1 ATOM 743 C C . MET 105 105 ? A 17.806 -33.360 -7.042 1.000 1 A 35.530 1 ATOM 744 C CB . MET 105 105 ? A 18.750 -33.642 -9.422 1.000 1 A 35.530 1 ATOM 745 O O . MET 105 105 ? A 18.361 -32.269 -6.943 1.000 1 A 35.530 1 ATOM 746 C CG . MET 105 105 ? A 18.822 -34.588 -10.629 1.000 1 A 35.530 1 ATOM 747 S SD . MET 105 105 ? A 19.985 -34.094 -11.930 1.000 1 A 35.530 1 ATOM 748 C CE . MET 105 105 ? A 21.526 -34.796 -11.291 1.000 1 A 35.530 1 ATOM 749 N N . MET 106 106 ? A 17.160 -33.933 -6.022 1.000 1 A 37.360 1 ATOM 750 C CA . MET 106 106 ? A 17.504 -33.626 -4.641 1.000 1 A 37.360 1 ATOM 751 C C . MET 106 106 ? A 18.968 -34.020 -4.469 1.000 1 A 37.360 1 ATOM 752 C CB . MET 106 106 ? A 16.612 -34.404 -3.662 1.000 1 A 37.360 1 ATOM 753 O O . MET 106 106 ? A 19.330 -35.191 -4.601 1.000 1 A 37.360 1 ATOM 754 C CG . MET 106 106 ? A 15.151 -33.942 -3.669 1.000 1 A 37.360 1 ATOM 755 S SD . MET 106 106 ? A 14.894 -32.236 -3.106 1.000 1 A 37.360 1 ATOM 756 C CE . MET 106 106 ? A 13.189 -32.372 -2.505 1.000 1 A 37.360 1 ATOM 757 N N . ASN 107 107 ? A 19.805 -33.012 -4.259 1.000 1 A 37.990 1 ATOM 758 C CA . ASN 107 107 ? A 21.206 -33.182 -3.938 1.000 1 A 37.990 1 ATOM 759 C C . ASN 107 107 ? A 21.278 -33.974 -2.627 1.000 1 A 37.990 1 ATOM 760 C CB . ASN 107 107 ? A 21.840 -31.784 -3.860 1.000 1 A 37.990 1 ATOM 761 O O . ASN 107 107 ? A 20.825 -33.505 -1.584 1.000 1 A 37.990 1 ATOM 762 C CG . ASN 107 107 ? A 23.354 -31.815 -3.859 1.000 1 A 37.990 1 ATOM 763 N ND2 . ASN 107 107 ? A 23.985 -30.669 -3.785 1.000 1 A 37.990 1 ATOM 764 O OD1 . ASN 107 107 ? A 23.988 -32.847 -3.972 1.000 1 A 37.990 1 ATOM 765 N N . SER 108 108 ? A 21.740 -35.216 -2.735 1.000 1 A 31.060 1 ATOM 766 C CA . SER 108 108 ? A 21.938 -36.110 -1.606 1.000 1 A 31.060 1 ATOM 767 C C . SER 108 108 ? A 23.117 -35.598 -0.797 1.000 1 A 31.060 1 ATOM 768 C CB . SER 108 108 ? A 22.219 -37.530 -2.105 1.000 1 A 31.060 1 ATOM 769 O O . SER 108 108 ? A 24.259 -35.747 -1.223 1.000 1 A 31.060 1 ATOM 770 O OG . SER 108 108 ? A 21.064 -38.061 -2.724 1.000 1 A 31.060 1 ATOM 771 N N . ASP 109 109 ? A 22.825 -35.035 0.371 1.000 1 A 34.010 1 ATOM 772 C CA . ASP 109 109 ? A 23.772 -35.043 1.472 1.000 1 A 34.010 1 ATOM 773 C C . ASP 109 109 ? A 23.295 -36.048 2.520 1.000 1 A 34.010 1 ATOM 774 C CB . ASP 109 109 ? A 24.077 -33.636 2.010 1.000 1 A 34.010 1 ATOM 775 O O . ASP 109 109 ? A 22.108 -36.181 2.826 1.000 1 A 34.010 1 ATOM 776 C CG . ASP 109 109 ? A 25.579 -33.430 2.262 1.000 1 A 34.010 1 ATOM 777 O OD1 . ASP 109 109 ? A 26.303 -34.445 2.407 1.000 1 A 34.010 1 ATOM 778 O OD2 . ASP 109 109 ? A 25.991 -32.248 2.293 1.000 1 A 34.010 1 ATOM 779 N N . GLN 110 110 ? A 24.252 -36.851 2.948 1.000 1 A 29.870 1 ATOM 780 C CA . GLN 110 110 ? A 24.107 -38.119 3.638 1.000 1 A 29.870 1 ATOM 781 C C . GLN 110 110 ? A 23.410 -37.965 4.994 1.000 1 A 29.870 1 ATOM 782 C CB . GLN 110 110 ? A 25.530 -38.655 3.861 1.000 1 A 29.870 1 ATOM 783 O O . GLN 110 110 ? A 23.740 -37.075 5.766 1.000 1 A 29.870 1 ATOM 784 C CG . GLN 110 110 ? A 26.306 -38.962 2.567 1.000 1 A 29.870 1 ATOM 785 C CD . GLN 110 110 ? A 27.800 -39.180 2.801 1.000 1 A 29.870 1 ATOM 786 N NE2 . GLN 110 110 ? A 28.546 -39.505 1.770 1.000 1 A 29.870 1 ATOM 787 O OE1 . GLN 110 110 ? A 28.338 -39.067 3.889 1.000 1 A 29.870 1 ATOM 788 N N . THR 111 111 ? A 22.513 -38.887 5.340 1.000 1 A 32.430 1 ATOM 789 C CA . THR 111 111 ? A 22.578 -39.631 6.612 1.000 1 A 32.430 1 ATOM 790 C C . THR 111 111 ? A 21.584 -40.789 6.576 1.000 1 A 32.430 1 ATOM 791 C CB . THR 111 111 ? A 22.366 -38.816 7.905 1.000 1 A 32.430 1 ATOM 792 O O . THR 111 111 ? A 20.390 -40.647 6.328 1.000 1 A 32.430 1 ATOM 793 C CG2 . THR 111 111 ? A 23.659 -38.217 8.476 1.000 1 A 32.430 1 ATOM 794 O OG1 . THR 111 111 ? A 21.457 -37.766 7.720 1.000 1 A 32.430 1 ATOM 795 N N . GLU 112 112 ? A 22.137 -41.975 6.772 1.000 1 A 30.200 1 ATOM 796 C CA . GLU 112 112 ? A 21.486 -43.272 6.757 1.000 1 A 30.200 1 ATOM 797 C C . GLU 112 112 ? A 20.471 -43.402 7.901 1.000 1 A 30.200 1 ATOM 798 C CB . GLU 112 112 ? A 22.593 -44.324 6.962 1.000 1 A 30.200 1 ATOM 799 O O . GLU 112 112 ? A 20.844 -43.272 9.061 1.000 1 A 30.200 1 ATOM 800 C CG . GLU 112 112 ? A 23.719 -44.297 5.910 1.000 1 A 30.200 1 ATOM 801 C CD . GLU 112 112 ? A 24.907 -45.190 6.301 1.000 1 A 30.200 1 ATOM 802 O OE1 . GLU 112 112 ? A 25.454 -45.848 5.388 1.000 1 A 30.200 1 ATOM 803 O OE2 . GLU 112 112 ? A 25.260 -45.212 7.501 1.000 1 A 30.200 1 ATOM 804 N N . THR 113 113 ? A 19.219 -43.765 7.607 1.000 1 A 34.340 1 ATOM 805 C CA . THR 113 113 ? A 18.441 -44.675 8.468 1.000 1 A 34.340 1 ATOM 806 C C . THR 113 113 ? A 17.495 -45.528 7.609 1.000 1 A 34.340 1 ATOM 807 C CB . THR 113 113 ? A 17.682 -44.009 9.633 1.000 1 A 34.340 1 ATOM 808 O O . THR 113 113 ? A 16.675 -45.050 6.835 1.000 1 A 34.340 1 ATOM 809 C CG2 . THR 113 113 ? A 18.552 -43.625 10.834 1.000 1 A 34.340 1 ATOM 810 O OG1 . THR 113 113 ? A 17.027 -42.842 9.220 1.000 1 A 34.340 1 ATOM 811 N N . LYS 114 114 ? A 17.704 -46.835 7.729 1.000 1 A 27.560 1 ATOM 812 C CA . LYS 114 114 ? A 17.040 -48.013 7.142 1.000 1 A 27.560 1 ATOM 813 C C . LYS 114 114 ? A 16.039 -48.574 8.200 1.000 1 A 27.560 1 ATOM 814 C CB . LYS 114 114 ? A 18.275 -48.913 6.858 1.000 1 A 27.560 1 ATOM 815 O O . LYS 114 114 ? A 16.220 -48.188 9.356 1.000 1 A 27.560 1 ATOM 816 C CG . LYS 114 114 ? A 18.009 -50.363 6.501 1.000 1 A 27.560 1 ATOM 817 C CD . LYS 114 114 ? A 19.248 -51.252 6.366 1.000 1 A 27.560 1 ATOM 818 C CE . LYS 114 114 ? A 18.765 -52.702 6.202 1.000 1 A 27.560 1 ATOM 819 N NZ . LYS 114 114 ? A 19.891 -53.665 6.178 1.000 1 A 27.560 1 ATOM 820 N N . PRO 115 115 ? A 15.120 -49.552 7.972 1.000 1 A 41.030 1 ATOM 821 C CA . PRO 115 115 ? A 14.475 -50.116 6.765 1.000 1 A 41.030 1 ATOM 822 C C . PRO 115 115 ? A 12.909 -50.212 6.828 1.000 1 A 41.030 1 ATOM 823 C CB . PRO 115 115 ? A 15.001 -51.564 6.749 1.000 1 A 41.030 1 ATOM 824 O O . PRO 115 115 ? A 12.309 -50.187 7.894 1.000 1 A 41.030 1 ATOM 825 C CG . PRO 115 115 ? A 15.223 -51.928 8.218 1.000 1 A 41.030 1 ATOM 826 C CD . PRO 115 115 ? A 15.060 -50.613 8.977 1.000 1 A 41.030 1 ATOM 827 N N . GLU 116 116 ? A 12.282 -50.426 5.662 1.000 1 A 25.460 1 ATOM 828 C CA . GLU 116 116 ? A 11.330 -51.530 5.345 1.000 1 A 25.460 1 ATOM 829 C C . GLU 116 116 ? A 10.062 -51.802 6.197 1.000 1 A 25.460 1 ATOM 830 C CB . GLU 116 116 ? A 12.171 -52.808 5.222 1.000 1 A 25.460 1 ATOM 831 O O . GLU 116 116 ? A 10.122 -52.388 7.271 1.000 1 A 25.460 1 ATOM 832 C CG . GLU 116 116 ? A 11.606 -54.019 4.489 1.000 1 A 25.460 1 ATOM 833 C CD . GLU 116 116 ? A 12.586 -55.213 4.562 1.000 1 A 25.460 1 ATOM 834 O OE1 . GLU 116 116 ? A 12.134 -56.333 4.229 1.000 1 A 25.460 1 ATOM 835 O OE2 . GLU 116 116 ? A 13.774 -55.015 4.926 1.000 1 A 25.460 1 ATOM 836 N N . LEU 117 117 ? A 8.899 -51.552 5.576 1.000 1 A 40.600 1 ATOM 837 C CA . LEU 117 117 ? A 7.617 -52.288 5.662 1.000 1 A 40.600 1 ATOM 838 C C . LEU 117 117 ? A 6.969 -52.071 4.273 1.000 1 A 40.600 1 ATOM 839 C CB . LEU 117 117 ? A 6.720 -51.672 6.765 1.000 1 A 40.600 1 ATOM 840 O O . LEU 117 117 ? A 6.697 -50.927 3.925 1.000 1 A 40.600 1 ATOM 841 C CG . LEU 117 117 ? A 7.034 -52.048 8.227 1.000 1 A 40.600 1 ATOM 842 C CD1 . LEU 117 117 ? A 6.231 -51.161 9.181 1.000 1 A 40.600 1 ATOM 843 C CD2 . LEU 117 117 ? A 6.673 -53.507 8.518 1.000 1 A 40.600 1 ATOM 844 N N . LYS 118 118 ? A 6.948 -52.976 3.290 1.000 1 A 29.440 1 ATOM 845 C CA . LYS 118 118 ? A 6.428 -54.346 3.137 1.000 1 A 29.440 1 ATOM 846 C C . LYS 118 118 ? A 4.888 -54.464 3.161 1.000 1 A 29.440 1 ATOM 847 C CB . LYS 118 118 ? A 7.203 -55.426 3.919 1.000 1 A 29.440 1 ATOM 848 O O . LYS 118 118 ? A 4.279 -54.537 4.219 1.000 1 A 29.440 1 ATOM 849 C CG . LYS 118 118 ? A 6.999 -56.785 3.225 1.000 1 A 29.440 1 ATOM 850 C CD . LYS 118 118 ? A 7.943 -57.898 3.679 1.000 1 A 29.440 1 ATOM 851 C CE . LYS 118 118 ? A 7.679 -59.125 2.799 1.000 1 A 29.440 1 ATOM 852 N NZ . LYS 118 118 ? A 8.612 -60.229 3.104 1.000 1 A 29.440 1 ATOM 853 N N . ASP 119 119 ? A 4.364 -54.567 1.934 1.000 1 A 29.460 1 ATOM 854 C CA . ASP 119 119 ? A 3.244 -55.388 1.444 1.000 1 A 29.460 1 ATOM 855 C C . ASP 119 119 ? A 1.758 -54.979 1.598 1.000 1 A 29.460 1 ATOM 856 C CB . ASP 119 119 ? A 3.497 -56.875 1.774 1.000 1 A 29.460 1 ATOM 857 O O . ASP 119 119 ? A 1.236 -54.731 2.679 1.000 1 A 29.460 1 ATOM 858 C CG . ASP 119 119 ? A 4.703 -57.474 1.032 1.000 1 A 29.460 1 ATOM 859 O OD1 . ASP 119 119 ? A 5.191 -56.836 0.071 1.000 1 A 29.460 1 ATOM 860 O OD2 . ASP 119 119 ? A 5.180 -58.552 1.458 1.000 1 A 29.460 1 ATOM 861 N N . THR 120 120 ? A 1.075 -55.124 0.446 1.000 1 A 32.840 1 ATOM 862 C CA . THR 120 120 ? A -0.363 -55.374 0.168 1.000 1 A 32.840 1 ATOM 863 C C . THR 120 120 ? A -1.343 -54.208 0.345 1.000 1 A 32.840 1 ATOM 864 C CB . THR 120 120 ? A -0.854 -56.672 0.825 1.000 1 A 32.840 1 ATOM 865 O O . THR 120 120 ? A -1.479 -53.639 1.416 1.000 1 A 32.840 1 ATOM 866 C CG2 . THR 120 120 ? A -0.137 -57.891 0.239 1.000 1 A 32.840 1 ATOM 867 O OG1 . THR 120 120 ? A -0.666 -56.681 2.217 1.000 1 A 32.840 1 ATOM 868 N N . ASP 121 121 ? A -1.925 -53.669 -0.728 1.000 1 A 27.600 1 ATOM 869 C CA . ASP 121 121 ? A -2.964 -54.214 -1.629 1.000 1 A 27.600 1 ATOM 870 C C . ASP 121 121 ? A -4.371 -53.729 -1.228 1.000 1 A 27.600 1 ATOM 871 C CB . ASP 121 121 ? A -2.935 -55.737 -1.893 1.000 1 A 27.600 1 ATOM 872 O O . ASP 121 121 ? A -4.842 -53.959 -0.123 1.000 1 A 27.600 1 ATOM 873 C CG . ASP 121 121 ? A -3.958 -56.166 -2.957 1.000 1 A 27.600 1 ATOM 874 O OD1 . ASP 121 121 ? A -4.164 -55.374 -3.907 1.000 1 A 27.600 1 ATOM 875 O OD2 . ASP 121 121 ? A -4.552 -57.253 -2.820 1.000 1 A 27.600 1 ATOM 876 N N . SER 122 122 ? A -5.015 -53.080 -2.201 1.000 1 A 28.930 1 ATOM 877 C CA . SER 122 122 ? A -6.462 -52.949 -2.391 1.000 1 A 28.930 1 ATOM 878 C C . SER 122 122 ? A -7.345 -52.334 -1.296 1.000 1 A 28.930 1 ATOM 879 C CB . SER 122 122 ? A -7.020 -54.313 -2.802 1.000 1 A 28.930 1 ATOM 880 O O . SER 122 122 ? A -7.649 -52.942 -0.278 1.000 1 A 28.930 1 ATOM 881 O OG . SER 122 122 ? A -6.596 -54.595 -4.118 1.000 1 A 28.930 1 ATOM 882 N N . GLY 123 123 ? A -7.994 -51.215 -1.649 1.000 1 A 29.610 1 ATOM 883 C CA . GLY 123 123 ? A -9.383 -50.992 -1.229 1.000 1 A 29.610 1 ATOM 884 C C . GLY 123 123 ? A -9.756 -49.576 -0.804 1.000 1 A 29.610 1 ATOM 885 O O . GLY 123 123 ? A -9.581 -49.194 0.340 1.000 1 A 29.610 1 ATOM 886 N N . LYS 124 124 ? A -10.378 -48.850 -1.739 1.000 1 A 29.030 1 ATOM 887 C CA . LYS 124 124 ? A -11.622 -48.076 -1.565 1.000 1 A 29.030 1 ATOM 888 C C . LYS 124 124 ? A -11.872 -47.340 -0.230 1.000 1 A 29.030 1 ATOM 889 C CB . LYS 124 124 ? A -12.810 -49.023 -1.835 1.000 1 A 29.030 1 ATOM 890 O O . LYS 124 124 ? A -12.225 -47.943 0.770 1.000 1 A 29.030 1 ATOM 891 C CG . LYS 124 124 ? A -12.985 -49.366 -3.320 1.000 1 A 29.030 1 ATOM 892 C CD . LYS 124 124 ? A -14.091 -50.414 -3.505 1.000 1 A 29.030 1 ATOM 893 C CE . LYS 124 124 ? A -14.305 -50.695 -4.997 1.000 1 A 29.030 1 ATOM 894 N NZ . LYS 124 124 ? A -15.219 -51.845 -5.216 1.000 1 A 29.030 1 ATOM 895 N N . ASN 125 125 ? A -12.040 -46.027 -0.402 1.000 1 A 29.330 1 ATOM 896 C CA . ASN 125 125 ? A -13.116 -45.196 0.152 1.000 1 A 29.330 1 ATOM 897 C C . ASN 125 125 ? A -13.124 -44.830 1.648 1.000 1 A 29.330 1 ATOM 898 C CB . ASN 125 125 ? A -14.492 -45.742 -0.294 1.000 1 A 29.330 1 ATOM 899 O O . ASN 125 125 ? A -13.218 -45.662 2.535 1.000 1 A 29.330 1 ATOM 900 C CG . ASN 125 125 ? A -14.767 -45.560 -1.773 1.000 1 A 29.330 1 ATOM 901 N ND2 . ASN 125 125 ? A -15.676 -46.322 -2.333 1.000 1 A 29.330 1 ATOM 902 O OD1 . ASN 125 125 ? A -14.194 -44.722 -2.444 1.000 1 A 29.330 1 ATOM 903 N N . GLN 126 126 ? A -13.292 -43.516 1.829 1.000 1 A 30.040 1 ATOM 904 C CA . GLN 126 126 ? A -13.892 -42.818 2.967 1.000 1 A 30.040 1 ATOM 905 C C . GLN 126 126 ? A -13.030 -42.605 4.217 1.000 1 A 30.040 1 ATOM 906 C CB . GLN 126 126 ? A -15.304 -43.338 3.287 1.000 1 A 30.040 1 ATOM 907 O O . GLN 126 126 ? A -12.840 -43.468 5.060 1.000 1 A 30.040 1 ATOM 908 C CG . GLN 126 126 ? A -16.313 -42.937 2.199 1.000 1 A 30.040 1 ATOM 909 C CD . GLN 126 126 ? A -17.711 -43.481 2.464 1.000 1 A 30.040 1 ATOM 910 N NE2 . GLN 126 126 ? A -18.502 -43.705 1.437 1.000 1 A 30.040 1 ATOM 911 O OE1 . GLN 126 126 ? A -18.138 -43.693 3.583 1.000 1 A 30.040 1 ATOM 912 N N . ALA 127 127 ? A -12.649 -41.332 4.353 1.000 1 A 30.580 1 ATOM 913 C CA . ALA 127 127 ? A -12.827 -40.539 5.561 1.000 1 A 30.580 1 ATOM 914 C C . ALA 127 127 ? A -12.324 -41.165 6.866 1.000 1 A 30.580 1 ATOM 915 C CB . ALA 127 127 ? A -14.311 -40.134 5.648 1.000 1 A 30.580 1 ATOM 916 O O . ALA 127 127 ? A -13.098 -41.757 7.607 1.000 1 A 30.580 1 ATOM 917 N N . GLN 128 128 ? A -11.070 -40.874 7.221 1.000 1 A 30.670 1 ATOM 918 C CA . GLN 128 128 ? A -10.725 -40.356 8.548 1.000 1 A 30.670 1 ATOM 919 C C . GLN 128 128 ? A -9.226 -40.028 8.639 1.000 1 A 30.670 1 ATOM 920 C CB . GLN 128 128 ? A -11.136 -41.324 9.687 1.000 1 A 30.670 1 ATOM 921 O O . GLN 128 128 ? A -8.375 -40.868 8.384 1.000 1 A 30.670 1 ATOM 922 C CG . GLN 128 128 ? A -12.418 -40.836 10.401 1.000 1 A 30.670 1 ATOM 923 C CD . GLN 128 128 ? A -12.934 -41.796 11.467 1.000 1 A 30.670 1 ATOM 924 N NE2 . GLN 128 128 ? A -14.172 -41.659 11.882 1.000 1 A 30.670 1 ATOM 925 O OE1 . GLN 128 128 ? A -12.211 -42.583 12.059 1.000 1 A 30.670 1 ATOM 926 N N . LYS 129 129 ? A -8.936 -38.817 9.132 1.000 1 A 31.260 1 ATOM 927 C CA . LYS 129 129 ? A -7.741 -38.485 9.927 1.000 1 A 31.260 1 ATOM 928 C C . LYS 129 129 ? A -6.395 -38.510 9.184 1.000 1 A 31.260 1 ATOM 929 C CB . LYS 129 129 ? A -7.714 -39.386 11.185 1.000 1 A 31.260 1 ATOM 930 O O . LYS 129 129 ? A -5.559 -39.371 9.433 1.000 1 A 31.260 1 ATOM 931 C CG . LYS 129 129 ? A -8.979 -39.298 12.057 1.000 1 A 31.260 1 ATOM 932 C CD . LYS 129 129 ? A -9.042 -40.467 13.045 1.000 1 A 31.260 1 ATOM 933 C CE . LYS 129 129 ? A -10.354 -40.411 13.833 1.000 1 A 31.260 1 ATOM 934 N NZ . LYS 129 129 ? A -10.589 -41.663 14.585 1.000 1 A 31.260 1 ATOM 935 N N . GLN 130 130 ? A -6.108 -37.455 8.419 1.000 1 A 34.520 1 ATOM 936 C CA . GLN 130 130 ? A -4.738 -36.937 8.390 1.000 1 A 34.520 1 ATOM 937 C C . GLN 130 130 ? A -4.668 -35.647 9.206 1.000 1 A 34.520 1 ATOM 938 C CB . GLN 130 130 ? A -4.138 -36.848 6.984 1.000 1 A 34.520 1 ATOM 939 O O . GLN 130 130 ? A -5.437 -34.708 9.025 1.000 1 A 34.520 1 ATOM 940 C CG . GLN 130 130 ? A -3.754 -38.253 6.467 1.000 1 A 34.520 1 ATOM 941 C CD . GLN 130 130 ? A -2.455 -38.270 5.665 1.000 1 A 34.520 1 ATOM 942 N NE2 . GLN 130 130 ? A -1.764 -39.387 5.605 1.000 1 A 34.520 1 ATOM 943 O OE1 . GLN 130 130 ? A -2.025 -37.285 5.094 1.000 1 A 34.520 1 ATOM 944 N N . SER 131 131 ? A -3.798 -35.728 10.204 1.000 1 A 41.040 1 ATOM 945 C CA . SER 131 131 ? A -3.464 -34.786 11.263 1.000 1 A 41.040 1 ATOM 946 C C . SER 131 131 ? A -3.668 -33.300 10.938 1.000 1 A 41.040 1 ATOM 947 C CB . SER 131 131 ? A -1.974 -34.986 11.552 1.000 1 A 41.040 1 ATOM 948 O O . SER 131 131 ? A -3.123 -32.821 9.941 1.000 1 A 41.040 1 ATOM 949 O OG . SER 131 131 ? A -1.230 -34.910 10.349 1.000 1 A 41.040 1 ATOM 950 N N . PRO 132 132 ? A -4.296 -32.524 11.841 1.000 1 A 40.500 1 ATOM 951 C CA . PRO 132 132 ? A -4.095 -31.085 11.872 1.000 1 A 40.500 1 ATOM 952 C C . PRO 132 132 ? A -2.602 -30.844 12.096 1.000 1 A 40.500 1 ATOM 953 C CB . PRO 132 132 ? A -4.953 -30.545 13.030 1.000 1 A 40.500 1 ATOM 954 O O . PRO 132 132 ? A -2.064 -31.221 13.144 1.000 1 A 40.500 1 ATOM 955 C CG . PRO 132 132 ? A -5.820 -31.730 13.461 1.000 1 A 40.500 1 ATOM 956 C CD . PRO 132 132 ? A -5.022 -32.951 13.022 1.000 1 A 40.500 1 ATOM 957 N N . LEU 133 133 ? A -1.919 -30.245 11.117 1.000 1 A 43.250 1 ATOM 958 C CA . LEU 133 133 ? A -0.598 -29.690 11.369 1.000 1 A 43.250 1 ATOM 959 C C . LEU 133 133 ? A -0.733 -28.743 12.562 1.000 1 A 43.250 1 ATOM 960 C CB . LEU 133 133 ? A 0.012 -28.990 10.143 1.000 1 A 43.250 1 ATOM 961 O O . LEU 133 133 ? A -1.588 -27.857 12.612 1.000 1 A 43.250 1 ATOM 962 C CG . LEU 133 133 ? A 0.793 -29.943 9.217 1.000 1 A 43.250 1 ATOM 963 C CD1 . LEU 133 133 ? A -0.125 -30.682 8.245 1.000 1 A 43.250 1 ATOM 964 C CD2 . LEU 133 133 ? A 1.829 -29.158 8.415 1.000 1 A 43.250 1 ATOM 965 N N . LYS 134 134 ? A 0.077 -29.052 13.565 1.000 1 A 37.170 1 ATOM 966 C CA . LYS 134 134 ? A 0.152 -28.436 14.879 1.000 1 A 37.170 1 ATOM 967 C C . LYS 134 134 ? A 0.008 -26.918 14.761 1.000 1 A 37.170 1 ATOM 968 C CB . LYS 134 134 ? A 1.515 -28.832 15.475 1.000 1 A 37.170 1 ATOM 969 O O . LYS 134 134 ? A 0.874 -26.244 14.213 1.000 1 A 37.170 1 ATOM 970 C CG . LYS 134 134 ? A 1.636 -30.349 15.725 1.000 1 A 37.170 1 ATOM 971 C CD . LYS 134 134 ? A 3.093 -30.758 15.984 1.000 1 A 37.170 1 ATOM 972 C CE . LYS 134 134 ? A 3.178 -32.258 16.295 1.000 1 A 37.170 1 ATOM 973 N NZ . LYS 134 134 ? A 4.585 -32.717 16.432 1.000 1 A 37.170 1 ATOM 974 N N . ARG 135 135 ? A -1.071 -26.385 15.338 1.000 1 A 38.090 1 ATOM 975 C CA . ARG 135 135 ? A -1.183 -24.976 15.722 1.000 1 A 38.090 1 ATOM 976 C C . ARG 135 135 ? A -0.088 -24.701 16.755 1.000 1 A 38.090 1 ATOM 977 C CB . ARG 135 135 ? A -2.587 -24.707 16.306 1.000 1 A 38.090 1 ATOM 978 O O . ARG 135 135 ? A -0.314 -24.877 17.949 1.000 1 A 38.090 1 ATOM 979 C CG . ARG 135 135 ? A -3.728 -24.768 15.276 1.000 1 A 38.090 1 ATOM 980 C CD . ARG 135 135 ? A -5.101 -24.706 15.977 1.000 1 A 38.090 1 ATOM 981 N NE . ARG 135 135 ? A -5.939 -23.580 15.510 1.000 1 A 38.090 1 ATOM 982 N NH1 . ARG 135 135 ? A -7.141 -24.676 13.879 1.000 1 A 38.090 1 ATOM 983 N NH2 . ARG 135 135 ? A -7.578 -22.537 14.321 1.000 1 A 38.090 1 ATOM 984 C CZ . ARG 135 135 ? A -6.878 -23.606 14.577 1.000 1 A 38.090 1 ATOM 985 N N . SER 136 136 ? A 1.110 -24.322 16.318 1.000 1 A 42.620 1 ATOM 986 C CA . SER 136 136 ? A 2.108 -23.754 17.220 1.000 1 A 42.620 1 ATOM 987 C C . SER 136 136 ? A 1.626 -22.362 17.612 1.000 1 A 42.620 1 ATOM 988 C CB . SER 136 136 ? A 3.511 -23.741 16.609 1.000 1 A 42.620 1 ATOM 989 O O . SER 136 136 ? A 1.774 -21.386 16.877 1.000 1 A 42.620 1 ATOM 990 O OG . SER 136 136 ? A 3.519 -23.006 15.407 1.000 1 A 42.620 1 ATOM 991 N N . GLN 137 137 ? A 0.985 -22.308 18.771 1.000 1 A 42.840 1 ATOM 992 C CA . GLN 137 137 ? A 0.816 -21.104 19.566 1.000 1 A 42.840 1 ATOM 993 C C . GLN 137 137 ? A 2.169 -20.374 19.643 1.000 1 A 42.840 1 ATOM 994 C CB . GLN 137 137 ? A 0.369 -21.558 20.970 1.000 1 A 42.840 1 ATOM 995 O O . GLN 137 137 ? A 3.130 -20.931 20.166 1.000 1 A 42.840 1 ATOM 996 C CG . GLN 137 137 ? A -1.026 -22.210 21.014 1.000 1 A 42.840 1 ATOM 997 C CD . GLN 137 137 ? A -2.141 -21.179 20.900 1.000 1 A 42.840 1 ATOM 998 N NE2 . GLN 137 137 ? A -3.064 -21.324 19.976 1.000 1 A 42.840 1 ATOM 999 O OE1 . GLN 137 137 ? A -2.192 -20.208 21.628 1.000 1 A 42.840 1 ATOM 1000 N N . GLY 138 138 ? A 2.255 -19.148 19.117 1.000 1 A 40.930 1 ATOM 1001 C CA . GLY 138 138 ? A 3.293 -18.205 19.550 1.000 1 A 40.930 1 ATOM 1002 C C . GLY 138 138 ? A 4.355 -17.721 18.557 1.000 1 A 40.930 1 ATOM 1003 O O . GLY 138 138 ? A 5.333 -17.145 19.025 1.000 1 A 40.930 1 ATOM 1004 N N . SER 139 139 ? A 4.205 -17.835 17.232 1.000 1 A 44.220 1 ATOM 1005 C CA . SER 139 139 ? A 5.156 -17.155 16.327 1.000 1 A 44.220 1 ATOM 1006 C C . SER 139 139 ? A 4.787 -15.680 16.122 1.000 1 A 44.220 1 ATOM 1007 C CB . SER 139 139 ? A 5.377 -17.903 15.013 1.000 1 A 44.220 1 ATOM 1008 O O . SER 139 139 ? A 4.264 -15.277 15.087 1.000 1 A 44.220 1 ATOM 1009 O OG . SER 139 139 ? A 6.529 -17.360 14.394 1.000 1 A 44.220 1 ATOM 1010 N N . LYS 140 140 ? A 5.081 -14.847 17.126 1.000 1 A 45.430 1 ATOM 1011 C CA . LYS 140 140 ? A 5.129 -13.373 17.025 1.000 1 A 45.430 1 ATOM 1012 C C . LYS 140 140 ? A 6.354 -12.912 16.206 1.000 1 A 45.430 1 ATOM 1013 C CB . LYS 140 140 ? A 5.116 -12.747 18.436 1.000 1 A 45.430 1 ATOM 1014 O O . LYS 140 140 ? A 7.072 -12.007 16.616 1.000 1 A 45.430 1 ATOM 1015 C CG . LYS 140 140 ? A 3.802 -12.960 19.199 1.000 1 A 45.430 1 ATOM 1016 C CD . LYS 140 140 ? A 3.884 -12.308 20.588 1.000 1 A 45.430 1 ATOM 1017 C CE . LYS 140 140 ? A 2.546 -12.459 21.320 1.000 1 A 45.430 1 ATOM 1018 N NZ . LYS 140 140 ? A 2.643 -12.050 22.743 1.000 1 A 45.430 1 ATOM 1019 N N . GLY 141 141 ? A 6.639 -13.588 15.091 1.000 1 A 47.060 1 ATOM 1020 C CA . GLY 141 141 ? A 7.918 -13.494 14.383 1.000 1 A 47.060 1 ATOM 1021 C C . GLY 141 141 ? A 7.881 -12.801 13.021 1.000 1 A 47.060 1 ATOM 1022 O O . GLY 141 141 ? A 8.895 -12.240 12.624 1.000 1 A 47.060 1 ATOM 1023 N N . SER 142 142 ? A 6.752 -12.777 12.302 1.000 1 A 48.920 1 ATOM 1024 C CA . SER 142 142 ? A 6.731 -12.183 10.950 1.000 1 A 48.920 1 ATOM 1025 C C . SER 142 142 ? A 6.619 -10.656 10.953 1.000 1 A 48.920 1 ATOM 1026 C CB . SER 142 142 ? A 5.641 -12.807 10.079 1.000 1 A 48.920 1 ATOM 1027 O O . SER 142 142 ? A 7.131 -10.009 10.046 1.000 1 A 48.920 1 ATOM 1028 O OG . SER 142 142 ? A 4.377 -12.639 10.686 1.000 1 A 48.920 1 ATOM 1029 N N . LEU 143 143 ? A 6.037 -10.058 11.998 1.000 1 A 49.130 1 ATOM 1030 C CA . LEU 143 143 ? A 5.885 -8.601 12.078 1.000 1 A 49.130 1 ATOM 1031 C C . LEU 143 143 ? A 7.187 -7.887 12.489 1.000 1 A 49.130 1 ATOM 1032 C CB . LEU 143 143 ? A 4.705 -8.287 13.014 1.000 1 A 49.130 1 ATOM 1033 O O . LEU 143 143 ? A 7.461 -6.778 12.037 1.000 1 A 49.130 1 ATOM 1034 C CG . LEU 143 143 ? A 4.221 -6.829 12.924 1.000 1 A 49.130 1 ATOM 1035 C CD1 . LEU 143 143 ? A 3.654 -6.498 11.541 1.000 1 A 49.130 1 ATOM 1036 C CD2 . LEU 143 143 ? A 3.132 -6.585 13.968 1.000 1 A 49.130 1 ATOM 1037 N N . ALA 144 144 ? A 8.040 -8.533 13.292 1.000 1 A 50.430 1 ATOM 1038 C CA . ALA 144 144 ? A 9.304 -7.944 13.742 1.000 1 A 50.430 1 ATOM 1039 C C . ALA 144 144 ? A 10.333 -7.782 12.606 1.000 1 A 50.430 1 ATOM 1040 C CB . ALA 144 144 ? A 9.858 -8.786 14.896 1.000 1 A 50.430 1 ATOM 1041 O O . ALA 144 144 ? A 11.173 -6.890 12.682 1.000 1 A 50.430 1 ATOM 1042 N N . MET 145 145 ? A 10.240 -8.580 11.534 1.000 1 A 51.620 1 ATOM 1043 C CA . MET 145 145 ? A 11.117 -8.430 10.363 1.000 1 A 51.620 1 ATOM 1044 C C . MET 145 145 ? A 10.702 -7.260 9.459 1.000 1 A 51.620 1 ATOM 1045 C CB . MET 145 145 ? A 11.199 -9.743 9.569 1.000 1 A 51.620 1 ATOM 1046 O O . MET 145 145 ? A 11.536 -6.736 8.730 1.000 1 A 51.620 1 ATOM 1047 C CG . MET 145 145 ? A 11.564 -10.932 10.471 1.000 1 A 51.620 1 ATOM 1048 S SD . MET 145 145 ? A 12.608 -12.213 9.721 1.000 1 A 51.620 1 ATOM 1049 C CE . MET 145 145 ? A 11.533 -12.817 8.396 1.000 1 A 51.620 1 ATOM 1050 N N . ILE 146 146 ? A 9.439 -6.826 9.541 1.000 1 A 55.860 1 ATOM 1051 C CA . ILE 146 146 ? A 8.919 -5.672 8.794 1.000 1 A 55.860 1 ATOM 1052 C C . ILE 146 146 ? A 9.061 -4.380 9.619 1.000 1 A 55.860 1 ATOM 1053 C CB . ILE 146 146 ? A 7.469 -5.962 8.328 1.000 1 A 55.860 1 ATOM 1054 O O . ILE 146 146 ? A 9.301 -3.319 9.053 1.000 1 A 55.860 1 ATOM 1055 C CG1 . ILE 146 146 ? A 7.448 -7.189 7.378 1.000 1 A 55.860 1 ATOM 1056 C CG2 . ILE 146 146 ? A 6.854 -4.737 7.626 1.000 1 A 55.860 1 ATOM 1057 C CD1 . ILE 146 146 ? A 6.045 -7.723 7.062 1.000 1 A 55.860 1 ATOM 1058 N N . ILE 147 147 ? A 8.970 -4.458 10.956 1.000 1 A 50.580 1 ATOM 1059 C CA . ILE 147 147 ? A 8.931 -3.270 11.833 1.000 1 A 50.580 1 ATOM 1060 C C . ILE 147 147 ? A 10.244 -3.020 12.610 1.000 1 A 50.580 1 ATOM 1061 C CB . ILE 147 147 ? A 7.669 -3.346 12.740 1.000 1 A 50.580 1 ATOM 1062 O O . ILE 147 147 ? A 10.498 -1.896 13.034 1.000 1 A 50.580 1 ATOM 1063 C CG1 . ILE 147 147 ? A 6.394 -3.433 11.858 1.000 1 A 50.580 1 ATOM 1064 C CG2 . ILE 147 147 ? A 7.573 -2.147 13.706 1.000 1 A 50.580 1 ATOM 1065 C CD1 . ILE 147 147 ? A 5.059 -3.324 12.607 1.000 1 A 50.580 1 ATOM 1066 N N . GLY 148 148 ? A 11.104 -4.022 12.828 1.000 1 A 37.040 1 ATOM 1067 C CA . GLY 148 148 ? A 12.033 -4.005 13.969 1.000 1 A 37.040 1 ATOM 1068 C C . GLY 148 148 ? A 13.485 -4.395 13.700 1.000 1 A 37.040 1 ATOM 1069 O O . GLY 148 148 ? A 14.069 -5.111 14.512 1.000 1 A 37.040 1 ATOM 1070 N N . GLY 149 149 ? A 14.102 -3.909 12.622 1.000 1 A 38.420 1 ATOM 1071 C CA . GLY 149 149 ? A 15.561 -3.935 12.465 1.000 1 A 38.420 1 ATOM 1072 C C . GLY 149 149 ? A 16.241 -2.973 13.446 1.000 1 A 38.420 1 ATOM 1073 O O . GLY 149 149 ? A 16.512 -1.822 13.120 1.000 1 A 38.420 1 ATOM 1074 N N . LYS 150 150 ? A 16.486 -3.431 14.675 1.000 1 A 38.120 1 ATOM 1075 C CA . LYS 150 150 ? A 17.239 -2.715 15.709 1.000 1 A 38.120 1 ATOM 1076 C C . LYS 150 150 ? A 18.712 -3.111 15.622 1.000 1 A 38.120 1 ATOM 1077 C CB . LYS 150 150 ? A 16.592 -3.034 17.068 1.000 1 A 38.120 1 ATOM 1078 O O . LYS 150 150 ? A 19.059 -4.225 15.994 1.000 1 A 38.120 1 ATOM 1079 C CG . LYS 150 150 ? A 17.136 -2.223 18.256 1.000 1 A 38.120 1 ATOM 1080 C CD . LYS 150 150 ? A 16.146 -2.333 19.427 1.000 1 A 38.120 1 ATOM 1081 C CE . LYS 150 150 ? A 16.658 -1.615 20.679 1.000 1 A 38.120 1 ATOM 1082 N NZ . LYS 150 150 ? A 15.620 -1.574 21.739 1.000 1 A 38.120 1 ATOM 1083 N N . GLY 151 151 ? A 19.565 -2.182 15.193 1.000 1 A 34.610 1 ATOM 1084 C CA . GLY 151 151 ? A 21.010 -2.262 15.420 1.000 1 A 34.610 1 ATOM 1085 C C . GLY 151 151 ? A 21.865 -1.834 14.234 1.000 1 A 34.610 1 ATOM 1086 O O . GLY 151 151 ? A 22.181 -2.654 13.388 1.000 1 A 34.610 1 ATOM 1087 N N . SER 152 152 ? A 22.268 -0.565 14.206 1.000 1 A 38.450 1 ATOM 1088 C CA . SER 152 152 ? A 23.665 -0.145 14.401 1.000 1 A 38.450 1 ATOM 1089 C C . SER 152 152 ? A 23.815 1.310 13.965 1.000 1 A 38.450 1 ATOM 1090 C CB . SER 152 152 ? A 24.721 -0.997 13.682 1.000 1 A 38.450 1 ATOM 1091 O O . SER 152 152 ? A 23.391 1.700 12.882 1.000 1 A 38.450 1 ATOM 1092 O OG . SER 152 152 ? A 24.552 -0.985 12.285 1.000 1 A 38.450 1 ATOM 1093 N N . GLU 153 153 ? A 24.399 2.091 14.858 1.000 1 A 34.000 1 ATOM 1094 C CA . GLU 153 153 ? A 24.757 3.498 14.741 1.000 1 A 34.000 1 ATOM 1095 C C . GLU 153 153 ? A 25.470 3.808 13.413 1.000 1 A 34.000 1 ATOM 1096 C CB . GLU 153 153 ? A 25.682 3.789 15.934 1.000 1 A 34.000 1 ATOM 1097 O O . GLU 153 153 ? A 26.427 3.138 13.032 1.000 1 A 34.000 1 ATOM 1098 C CG . GLU 153 153 ? A 24.972 3.589 17.293 1.000 1 A 34.000 1 ATOM 1099 C CD . GLU 153 153 ? A 25.921 3.385 18.485 1.000 1 A 34.000 1 ATOM 1100 O OE1 . GLU 153 153 ? A 25.423 3.542 19.622 1.000 1 A 34.000 1 ATOM 1101 O OE2 . GLU 153 153 ? A 27.092 3.009 18.265 1.000 1 A 34.000 1 ATOM 1102 N N . GLY 154 154 ? A 24.996 4.829 12.701 1.000 1 A 33.690 1 ATOM 1103 C CA . GLY 154 154 ? A 25.525 5.211 11.395 1.000 1 A 33.690 1 ATOM 1104 C C . GLY 154 154 ? A 24.839 6.462 10.863 1.000 1 A 33.690 1 ATOM 1105 O O . GLY 154 154 ? A 23.969 6.382 10.012 1.000 1 A 33.690 1 ATOM 1106 N N . GLU 155 155 ? A 25.180 7.589 11.480 1.000 1 A 33.740 1 ATOM 1107 C CA . GLU 155 155 ? A 25.291 8.947 10.932 1.000 1 A 33.740 1 ATOM 1108 C C . GLU 155 155 ? A 24.604 9.319 9.590 1.000 1 A 33.740 1 ATOM 1109 C CB . GLU 155 155 ? A 26.800 9.238 10.829 1.000 1 A 33.740 1 ATOM 1110 O O . GLU 155 155 ? A 24.804 8.687 8.557 1.000 1 A 33.740 1 ATOM 1111 C CG . GLU 155 155 ? A 27.159 10.684 11.170 1.000 1 A 33.740 1 ATOM 1112 C CD . GLU 155 155 ? A 28.641 10.935 10.879 1.000 1 A 33.740 1 ATOM 1113 O OE1 . GLU 155 155 ? A 28.921 11.691 9.912 1.000 1 A 33.740 1 ATOM 1114 O OE2 . GLU 155 155 ? A 29.478 10.349 11.594 1.000 1 A 33.740 1 ATOM 1115 N N . LYS 156 156 ? A 23.991 10.515 9.609 1.000 1 A 36.120 1 ATOM 1116 C CA . LYS 156 156 ? A 23.477 11.353 8.502 1.000 1 A 36.120 1 ATOM 1117 C C . LYS 156 156 ? A 22.036 11.085 8.064 1.000 1 A 36.120 1 ATOM 1118 C CB . LYS 156 156 ? A 24.447 11.466 7.312 1.000 1 A 36.120 1 ATOM 1119 O O . LYS 156 156 ? A 21.725 10.229 7.246 1.000 1 A 36.120 1 ATOM 1120 C CG . LYS 156 156 ? A 25.770 12.145 7.700 1.000 1 A 36.120 1 ATOM 1121 C CD . LYS 156 156 ? A 26.614 12.411 6.449 1.000 1 A 36.120 1 ATOM 1122 C CE . LYS 156 156 ? A 27.844 13.280 6.740 1.000 1 A 36.120 1 ATOM 1123 N NZ . LYS 156 156 ? A 28.953 12.510 7.347 1.000 1 A 36.120 1 ATOM 1124 N N . GLY 157 157 ? A 21.158 11.935 8.597 1.000 1 A 31.500 1 ATOM 1125 C CA . GLY 157 157 ? A 19.777 12.051 8.171 1.000 1 A 31.500 1 ATOM 1126 C C . GLY 157 157 ? A 19.625 12.578 6.745 1.000 1 A 31.500 1 ATOM 1127 O O . GLY 157 157 ? A 20.358 13.454 6.295 1.000 1 A 31.500 1 ATOM 1128 N N . ASN 158 158 ? A 18.584 12.089 6.087 1.000 1 A 37.520 1 ATOM 1129 C CA . ASN 158 158 ? A 17.745 12.915 5.241 1.000 1 A 37.520 1 ATOM 1130 C C . ASN 158 158 ? A 16.296 12.484 5.490 1.000 1 A 37.520 1 ATOM 1131 C CB . ASN 158 158 ? A 18.166 12.816 3.772 1.000 1 A 37.520 1 ATOM 1132 O O . ASN 158 158 ? A 15.987 11.293 5.487 1.000 1 A 37.520 1 ATOM 1133 C CG . ASN 158 158 ? A 17.454 13.862 2.932 1.000 1 A 37.520 1 ATOM 1134 N ND2 . ASN 158 158 ? A 17.374 13.662 1.639 1.000 1 A 37.520 1 ATOM 1135 O OD1 . ASN 158 158 ? A 16.972 14.869 3.424 1.000 1 A 37.520 1 ATOM 1136 N N . GLY 159 159 ? A 15.460 13.461 5.826 1.000 1 A 34.520 1 ATOM 1137 C CA . GLY 159 159 ? A 14.089 13.270 6.270 1.000 1 A 34.520 1 ATOM 1138 C C . GLY 159 159 ? A 13.193 12.714 5.172 1.000 1 A 34.520 1 ATOM 1139 O O . GLY 159 159 ? A 13.390 12.964 3.984 1.000 1 A 34.520 1 ATOM 1140 N N . GLY 160 160 ? A 12.192 11.955 5.611 1.000 1 A 34.930 1 ATOM 1141 C CA . GLY 160 160 ? A 11.131 11.444 4.766 1.000 1 A 34.930 1 ATOM 1142 C C . GLY 160 160 ? A 10.337 12.567 4.108 1.000 1 A 34.930 1 ATOM 1143 O O . GLY 160 160 ? A 9.933 13.531 4.754 1.000 1 A 34.930 1 ATOM 1144 N N . VAL 161 161 ? A 10.071 12.387 2.820 1.000 1 A 38.360 1 ATOM 1145 C CA . VAL 161 161 ? A 9.017 13.098 2.104 1.000 1 A 38.360 1 ATOM 1146 C C . VAL 161 161 ? A 8.082 12.014 1.590 1.000 1 A 38.360 1 ATOM 1147 C CB . VAL 161 161 ? A 9.551 14.027 0.992 1.000 1 A 38.360 1 ATOM 1148 O O . VAL 161 161 ? A 8.368 11.321 0.616 1.000 1 A 38.360 1 ATOM 1149 C CG1 . VAL 161 161 ? A 8.534 15.150 0.748 1.000 1 A 38.360 1 ATOM 1150 C CG2 . VAL 161 161 ? A 10.896 14.680 1.339 1.000 1 A 38.360 1 ATOM 1151 N N . VAL 162 162 ? A 7.008 11.785 2.337 1.000 1 A 43.810 1 ATOM 1152 C CA . VAL 162 162 ? A 5.900 10.919 1.934 1.000 1 A 43.810 1 ATOM 1153 C C . VAL 162 162 ? A 5.161 11.621 0.799 1.000 1 A 43.810 1 ATOM 1154 C CB . VAL 162 162 ? A 4.969 10.600 3.127 1.000 1 A 43.810 1 ATOM 1155 O O . VAL 162 162 ? A 4.480 12.619 1.017 1.000 1 A 43.810 1 ATOM 1156 C CG1 . VAL 162 162 ? A 5.501 9.387 3.899 1.000 1 A 43.810 1 ATOM 1157 C CG2 . VAL 162 162 ? A 4.808 11.755 4.132 1.000 1 A 43.810 1 ATOM 1158 N N . MET 163 163 ? A 5.351 11.146 -0.432 1.000 1 A 44.440 1 ATOM 1159 C CA . MET 163 163 ? A 4.635 11.671 -1.592 1.000 1 A 44.440 1 ATOM 1160 C C . MET 163 163 ? A 3.226 11.090 -1.654 1.000 1 A 44.440 1 ATOM 1161 C CB . MET 163 163 ? A 5.419 11.458 -2.899 1.000 1 A 44.440 1 ATOM 1162 O O . MET 163 163 ? A 2.996 10.003 -2.183 1.000 1 A 44.440 1 ATOM 1163 C CG . MET 163 163 ? A 6.538 12.493 -3.070 1.000 1 A 44.440 1 ATOM 1164 S SD . MET 163 163 ? A 5.975 14.218 -2.973 1.000 1 A 44.440 1 ATOM 1165 C CE . MET 163 163 ? A 7.506 15.106 -3.330 1.000 1 A 44.440 1 ATOM 1166 N N . SER 164 164 ? A 2.281 11.856 -1.119 1.000 1 A 39.540 1 ATOM 1167 C CA . SER 164 164 ? A 0.854 11.711 -1.377 1.000 1 A 39.540 1 ATOM 1168 C C . SER 164 164 ? A 0.574 12.161 -2.811 1.000 1 A 39.540 1 ATOM 1169 C CB . SER 164 164 ? A 0.056 12.579 -0.393 1.000 1 A 39.540 1 ATOM 1170 O O . SER 164 164 ? A 0.599 13.356 -3.098 1.000 1 A 39.540 1 ATOM 1171 O OG . SER 164 164 ? A 0.458 12.321 0.940 1.000 1 A 39.540 1 ATOM 1172 N N . HIS 165 165 ? A 0.326 11.226 -3.724 1.000 1 A 45.920 1 ATOM 1173 C CA . HIS 165 165 ? A -0.286 11.550 -5.008 1.000 1 A 45.920 1 ATOM 1174 C C . HIS 165 165 ? A -1.756 11.146 -4.932 1.000 1 A 45.920 1 ATOM 1175 C CB . HIS 165 165 ? A 0.488 10.945 -6.188 1.000 1 A 45.920 1 ATOM 1176 O O . HIS 165 165 ? A -2.099 9.970 -4.878 1.000 1 A 45.920 1 ATOM 1177 C CG . HIS 165 165 ? A 0.564 9.441 -6.205 1.000 1 A 45.920 1 ATOM 1178 C CD2 . HIS 165 165 ? A -0.137 8.597 -7.026 1.000 1 A 45.920 1 ATOM 1179 N ND1 . HIS 165 165 ? A 1.350 8.659 -5.387 1.000 1 A 45.920 1 ATOM 1180 C CE1 . HIS 165 165 ? A 1.124 7.375 -5.710 1.000 1 A 45.920 1 ATOM 1181 N NE2 . HIS 165 165 ? A 0.246 7.289 -6.717 1.000 1 A 45.920 1 ATOM 1182 N N . SER 166 166 ? A -2.627 12.149 -4.870 1.000 1 A 45.610 1 ATOM 1183 C CA . SER 166 166 ? A -4.053 11.978 -5.110 1.000 1 A 45.610 1 ATOM 1184 C C . SER 166 166 ? A -4.239 11.685 -6.597 1.000 1 A 45.610 1 ATOM 1185 C CB . SER 166 166 ? A -4.816 13.249 -4.716 1.000 1 A 45.610 1 ATOM 1186 O O . SER 166 166 ? A -4.128 12.586 -7.425 1.000 1 A 45.610 1 ATOM 1187 O OG . SER 166 166 ? A -4.561 13.588 -3.364 1.000 1 A 45.610 1 ATOM 1188 N N . SER 167 167 ? A -4.477 10.429 -6.954 1.000 1 A 50.820 1 ATOM 1189 C CA . SER 167 167 ? A -5.031 10.065 -8.256 1.000 1 A 50.820 1 ATOM 1190 C C . SER 167 167 ? A -6.525 9.842 -8.077 1.000 1 A 50.820 1 ATOM 1191 C CB . SER 167 167 ? A -4.320 8.846 -8.853 1.000 1 A 50.820 1 ATOM 1192 O O . SER 167 167 ? A -6.937 8.907 -7.392 1.000 1 A 50.820 1 ATOM 1193 O OG . SER 167 167 ? A -4.165 7.827 -7.889 1.000 1 A 50.820 1 ATOM 1194 N N . ASN 168 168 ? A -7.315 10.743 -8.660 1.000 1 A 51.340 1 ATOM 1195 C CA . ASN 168 168 ? A -8.757 10.595 -8.790 1.000 1 A 51.340 1 ATOM 1196 C C . ASN 168 168 ? A -9.060 9.277 -9.509 1.000 1 A 51.340 1 ATOM 1197 C CB . ASN 168 168 ? A -9.327 11.799 -9.564 1.000 1 A 51.340 1 ATOM 1198 O O . ASN 168 168 ? A -8.509 9.015 -10.579 1.000 1 A 51.340 1 ATOM 1199 C CG . ASN 168 168 ? A -9.368 13.084 -8.756 1.000 1 A 51.340 1 ATOM 1200 N ND2 . ASN 168 168 ? A -9.712 14.185 -9.381 1.000 1 A 51.340 1 ATOM 1201 O OD1 . ASN 168 168 ? A -9.096 13.134 -7.568 1.000 1 A 51.340 1 ATOM 1202 N N . GLY 169 169 ? A -9.907 8.468 -8.877 1.000 1 A 40.100 1 ATOM 1203 C CA . GLY 169 169 ? A -10.485 7.274 -9.467 1.000 1 A 40.100 1 ATOM 1204 C C . GLY 169 169 ? A -11.421 7.646 -10.609 1.000 1 A 40.100 1 ATOM 1205 O O . GLY 169 169 ? A -12.254 8.541 -10.474 1.000 1 A 40.100 1 ATOM 1206 N N . ASP 170 170 ? A -11.254 6.949 -11.723 1.000 1 A 47.990 1 ATOM 1207 C CA . ASP 170 170 ? A -12.312 6.724 -12.696 1.000 1 A 47.990 1 ATOM 1208 C C . ASP 170 170 ? A -12.419 5.200 -12.811 1.000 1 A 47.990 1 ATOM 1209 C CB . ASP 170 170 ? A -12.026 7.463 -14.010 1.000 1 A 47.990 1 ATOM 1210 O O . ASP 170 170 ? A -11.637 4.532 -13.497 1.000 1 A 47.990 1 ATOM 1211 C CG . ASP 170 170 ? A -13.296 7.660 -14.845 1.000 1 A 47.990 1 ATOM 1212 O OD1 . ASP 170 170 ? A -14.035 6.672 -15.040 1.000 1 A 47.990 1 ATOM 1213 O OD2 . ASP 170 170 ? A -13.498 8.801 -15.318 1.000 1 A 47.990 1 ATOM 1214 N N . ASP 171 171 ? A -13.292 4.660 -11.964 1.000 1 A 46.930 1 ATOM 1215 C CA . ASP 171 171 ? A -13.651 3.254 -11.895 1.000 1 A 46.930 1 ATOM 1216 C C . ASP 171 171 ? A -14.444 2.903 -13.157 1.000 1 A 46.930 1 ATOM 1217 C CB . ASP 171 171 ? A -14.477 2.993 -10.619 1.000 1 A 46.930 1 ATOM 1218 O O . ASP 171 171 ? A -15.650 3.116 -13.233 1.000 1 A 46.930 1 ATOM 1219 C CG . ASP 171 171 ? A -13.677 3.196 -9.328 1.000 1 A 46.930 1 ATOM 1220 O OD1 . ASP 171 171 ? A -12.573 2.612 -9.227 1.000 1 A 46.930 1 ATOM 1221 O OD2 . ASP 171 171 ? A -14.153 3.955 -8.451 1.000 1 A 46.930 1 ATOM 1222 N N . ASN 172 172 ? A -13.767 2.355 -14.167 1.000 1 A 53.120 1 ATOM 1223 C CA . ASN 172 172 ? A -14.447 1.634 -15.237 1.000 1 A 53.120 1 ATOM 1224 C C . ASN 172 172 ? A -14.335 0.140 -14.951 1.000 1 A 53.120 1 ATOM 1225 C CB . ASN 172 172 ? A -13.972 2.092 -16.620 1.000 1 A 53.120 1 ATOM 1226 O O . ASN 172 172 ? A -13.363 -0.530 -15.306 1.000 1 A 53.120 1 ATOM 1227 C CG . ASN 172 172 ? A -14.543 3.465 -16.925 1.000 1 A 53.120 1 ATOM 1228 N ND2 . ASN 172 172 ? A -13.750 4.496 -16.780 1.000 1 A 53.120 1 ATOM 1229 O OD1 . ASN 172 172 ? A -15.701 3.608 -17.279 1.000 1 A 53.120 1 ATOM 1230 N N . GLU 173 173 ? A -15.361 -0.352 -14.263 1.000 1 A 48.790 1 ATOM 1231 C CA . GLU 173 173 ? A -15.690 -1.761 -14.131 1.000 1 A 48.790 1 ATOM 1232 C C . GLU 173 173 ? A -15.924 -2.344 -15.530 1.000 1 A 48.790 1 ATOM 1233 C CB . GLU 173 173 ? A -16.959 -1.915 -13.269 1.000 1 A 48.790 1 ATOM 1234 O O . GLU 173 173 ? A -16.972 -2.152 -16.141 1.000 1 A 48.790 1 ATOM 1235 C CG . GLU 173 173 ? A -16.796 -1.388 -11.833 1.000 1 A 48.790 1 ATOM 1236 C CD . GLU 173 173 ? A -18.051 -1.595 -10.963 1.000 1 A 48.790 1 ATOM 1237 O OE1 . GLU 173 173 ? A -17.927 -1.427 -9.728 1.000 1 A 48.790 1 ATOM 1238 O OE2 . GLU 173 173 ? A -19.124 -1.930 -11.516 1.000 1 A 48.790 1 ATOM 1239 N N . ASN 174 174 ? A -14.937 -3.057 -16.066 1.000 1 A 52.640 1 ATOM 1240 C CA . ASN 174 174 ? A -15.185 -3.996 -17.151 1.000 1 A 52.640 1 ATOM 1241 C C . ASN 174 174 ? A -15.163 -5.407 -16.566 1.000 1 A 52.640 1 ATOM 1242 C CB . ASN 174 174 ? A -14.213 -3.765 -18.314 1.000 1 A 52.640 1 ATOM 1243 O O . ASN 174 174 ? A -14.117 -6.055 -16.495 1.000 1 A 52.640 1 ATOM 1244 C CG . ASN 174 174 ? A -14.569 -4.637 -19.509 1.000 1 A 52.640 1 ATOM 1245 N ND2 . ASN 174 174 ? A -13.590 -5.179 -20.194 1.000 1 A 52.640 1 ATOM 1246 O OD1 . ASN 174 174 ? A -15.712 -4.844 -19.869 1.000 1 A 52.640 1 ATOM 1247 N N . GLU 175 175 ? A -16.336 -5.863 -16.129 1.000 1 A 48.130 1 ATOM 1248 C CA . GLU 175 175 ? A -16.636 -7.284 -16.021 1.000 1 A 48.130 1 ATOM 1249 C C . GLU 175 175 ? A -16.506 -7.922 -17.409 1.000 1 A 48.130 1 ATOM 1250 C CB . GLU 175 175 ? A -18.080 -7.521 -15.540 1.000 1 A 48.130 1 ATOM 1251 O O . GLU 175 175 ? A -17.305 -7.670 -18.309 1.000 1 A 48.130 1 ATOM 1252 C CG . GLU 175 175 ? A -18.302 -7.489 -14.024 1.000 1 A 48.130 1 ATOM 1253 C CD . GLU 175 175 ? A -19.591 -8.253 -13.657 1.000 1 A 48.130 1 ATOM 1254 O OE1 . GLU 175 175 ? A -19.541 -9.041 -12.684 1.000 1 A 48.130 1 ATOM 1255 O OE2 . GLU 175 175 ? A -20.596 -8.119 -14.394 1.000 1 A 48.130 1 ATOM 1256 N N . SER 176 176 ? A -15.531 -8.806 -17.601 1.000 1 A 52.680 1 ATOM 1257 C CA . SER 176 176 ? A -15.683 -9.844 -18.618 1.000 1 A 52.680 1 ATOM 1258 C C . SER 176 176 ? A -14.786 -11.032 -18.318 1.000 1 A 52.680 1 ATOM 1259 C CB . SER 176 176 ? A -15.432 -9.317 -20.032 1.000 1 A 52.680 1 ATOM 1260 O O . SER 176 176 ? A -13.564 -10.914 -18.246 1.000 1 A 52.680 1 ATOM 1261 O OG . SER 176 176 ? A -16.408 -9.876 -20.886 1.000 1 A 52.680 1 ATOM 1262 N N . GLY 177 177 ? A -15.436 -12.169 -18.081 1.000 1 A 38.140 1 ATOM 1263 C CA . GLY 177 177 ? A -14.818 -13.431 -17.714 1.000 1 A 38.140 1 ATOM 1264 C C . GLY 177 177 ? A -14.367 -14.298 -18.892 1.000 1 A 38.140 1 ATOM 1265 O O . GLY 177 177 ? A -14.203 -13.853 -20.026 1.000 1 A 38.140 1 ATOM 1266 N N . SER 178 178 ? A -14.250 -15.586 -18.570 1.000 1 A 40.530 1 ATOM 1267 C CA . SER 178 178 ? A -13.794 -16.731 -19.375 1.000 1 A 40.530 1 ATOM 1268 C C . SER 178 178 ? A -12.268 -16.821 -19.518 1.000 1 A 40.530 1 ATOM 1269 C CB . SER 178 178 ? A -14.587 -16.901 -20.675 1.000 1 A 40.530 1 ATOM 1270 O O . SER 178 178 ? A -11.610 -15.961 -20.087 1.000 1 A 40.530 1 ATOM 1271 O OG . SER 178 178 ? A -14.173 -16.016 -21.685 1.000 1 A 40.530 1 ATOM 1272 N N . GLU 179 179 ? A -11.601 -17.720 -18.793 1.000 1 A 41.970 1 ATOM 1273 C CA . GLU 179 179 ? A -11.568 -19.183 -18.978 1.000 1 A 41.970 1 ATOM 1274 C C . GLU 179 179 ? A -11.052 -19.597 -20.358 1.000 1 A 41.970 1 ATOM 1275 C CB . GLU 179 179 ? A -12.859 -19.942 -18.623 1.000 1 A 41.970 1 ATOM 1276 O O . GLU 179 179 ? A -11.719 -19.403 -21.368 1.000 1 A 41.970 1 ATOM 1277 C CG . GLU 179 179 ? A -13.262 -19.741 -17.152 1.000 1 A 41.970 1 ATOM 1278 C CD . GLU 179 179 ? A -14.110 -20.876 -16.558 1.000 1 A 41.970 1 ATOM 1279 O OE1 . GLU 179 179 ? A -14.529 -20.698 -15.394 1.000 1 A 41.970 1 ATOM 1280 O OE2 . GLU 179 179 ? A -14.277 -21.926 -17.219 1.000 1 A 41.970 1 ATOM 1281 N N . GLY 180 180 ? A -9.869 -20.222 -20.403 1.000 1 A 41.600 1 ATOM 1282 C CA . GLY 180 180 ? A -9.392 -20.841 -21.639 1.000 1 A 41.600 1 ATOM 1283 C C . GLY 180 180 ? A -7.892 -21.077 -21.709 1.000 1 A 41.600 1 ATOM 1284 O O . GLY 180 180 ? A -7.157 -20.327 -22.338 1.000 1 A 41.600 1 ATOM 1285 N N . SER 181 181 ? A -7.452 -22.170 -21.097 1.000 1 A 38.540 1 ATOM 1286 C CA . SER 181 181 ? A -6.155 -22.800 -21.341 1.000 1 A 38.540 1 ATOM 1287 C C . SER 181 181 ? A -6.000 -23.220 -22.812 1.000 1 A 38.540 1 ATOM 1288 C CB . SER 181 181 ? A -6.106 -24.050 -20.453 1.000 1 A 38.540 1 ATOM 1289 O O . SER 181 181 ? A -6.782 -24.033 -23.291 1.000 1 A 38.540 1 ATOM 1290 O OG . SER 181 181 ? A -4.877 -24.734 -20.571 1.000 1 A 38.540 1 ATOM 1291 N N . THR 182 182 ? A -4.960 -22.735 -23.496 1.000 1 A 45.490 1 ATOM 1292 C CA . THR 182 182 ? A -4.202 -23.469 -24.533 1.000 1 A 45.490 1 ATOM 1293 C C . THR 182 182 ? A -2.746 -22.990 -24.385 1.000 1 A 45.490 1 ATOM 1294 C CB . THR 182 182 ? A -4.737 -23.267 -25.969 1.000 1 A 45.490 1 ATOM 1295 O O . THR 182 182 ? A -2.485 -21.795 -24.321 1.000 1 A 45.490 1 ATOM 1296 C CG2 . THR 182 182 ? A -6.180 -23.728 -26.184 1.000 1 A 45.490 1 ATOM 1297 O OG1 . THR 182 182 ? A -4.708 -21.920 -26.360 1.000 1 A 45.490 1 ATOM 1298 N N . GLY 183 183 ? A -1.742 -23.821 -24.109 1.000 1 A 39.110 1 ATOM 1299 C CA . GLY 183 183 ? A -1.452 -25.099 -24.750 1.000 1 A 39.110 1 ATOM 1300 C C . GLY 183 183 ? A -0.661 -24.795 -26.020 1.000 1 A 39.110 1 ATOM 1301 O O . GLY 183 183 ? A -1.257 -24.461 -27.033 1.000 1 A 39.110 1 ATOM 1302 N N . GLY 184 184 ? A 0.671 -24.791 -25.920 1.000 1 A 38.430 1 ATOM 1303 C CA . GLY 184 184 ? A 1.567 -24.149 -26.883 1.000 1 A 38.430 1 ATOM 1304 C C . GLY 184 184 ? A 1.542 -24.687 -28.317 1.000 1 A 38.430 1 ATOM 1305 O O . GLY 184 184 ? A 1.331 -25.870 -28.561 1.000 1 A 38.430 1 ATOM 1306 N N . SER 185 185 ? A 1.889 -23.806 -29.254 1.000 1 A 45.210 1 ATOM 1307 C CA . SER 185 185 ? A 2.454 -24.181 -30.548 1.000 1 A 45.210 1 ATOM 1308 C C . SER 185 185 ? A 3.623 -23.253 -30.865 1.000 1 A 45.210 1 ATOM 1309 C CB . SER 185 185 ? A 1.403 -24.171 -31.666 1.000 1 A 45.210 1 ATOM 1310 O O . SER 185 185 ? A 3.445 -22.050 -31.065 1.000 1 A 45.210 1 ATOM 1311 O OG . SER 185 185 ? A 0.966 -22.860 -31.963 1.000 1 A 45.210 1 ATOM 1312 N N . GLU 186 186 ? A 4.825 -23.814 -30.896 1.000 1 A 38.750 1 ATOM 1313 C CA . GLU 186 186 ? A 5.955 -23.194 -31.570 1.000 1 A 38.750 1 ATOM 1314 C C . GLU 186 186 ? A 5.763 -23.321 -33.083 1.000 1 A 38.750 1 ATOM 1315 C CB . GLU 186 186 ? A 7.273 -23.881 -31.179 1.000 1 A 38.750 1 ATOM 1316 O O . GLU 186 186 ? A 5.618 -24.427 -33.593 1.000 1 A 38.750 1 ATOM 1317 C CG . GLU 186 186 ? A 7.624 -23.756 -29.690 1.000 1 A 38.750 1 ATOM 1318 C CD . GLU 186 186 ? A 9.131 -23.931 -29.427 1.000 1 A 38.750 1 ATOM 1319 O OE1 . GLU 186 186 ? A 9.585 -23.427 -28.374 1.000 1 A 38.750 1 ATOM 1320 O OE2 . GLU 186 186 ? A 9.828 -24.529 -30.278 1.000 1 A 38.750 1 ATOM 1321 N N . GLU 187 187 ? A 5.836 -22.209 -33.810 1.000 1 A 40.130 1 ATOM 1322 C CA . GLU 187 187 ? A 6.276 -22.218 -35.203 1.000 1 A 40.130 1 ATOM 1323 C C . GLU 187 187 ? A 7.246 -21.055 -35.421 1.000 1 A 40.130 1 ATOM 1324 C CB . GLU 187 187 ? A 5.127 -22.215 -36.222 1.000 1 A 40.130 1 ATOM 1325 O O . GLU 187 187 ? A 6.885 -19.897 -35.624 1.000 1 A 40.130 1 ATOM 1326 C CG . GLU 187 187 ? A 4.427 -23.581 -36.371 1.000 1 A 40.130 1 ATOM 1327 C CD . GLU 187 187 ? A 3.680 -23.689 -37.711 1.000 1 A 40.130 1 ATOM 1328 O OE1 . GLU 187 187 ? A 3.693 -24.763 -38.352 1.000 1 A 40.130 1 ATOM 1329 O OE2 . GLU 187 187 ? A 3.216 -22.654 -38.248 1.000 1 A 40.130 1 ATOM 1330 N N . ASN 188 188 ? A 8.526 -21.404 -35.368 1.000 1 A 42.880 1 ATOM 1331 C CA . ASN 188 188 ? A 9.612 -20.667 -35.983 1.000 1 A 42.880 1 ATOM 1332 C C . ASN 188 188 ? A 9.426 -20.710 -37.513 1.000 1 A 42.880 1 ATOM 1333 C CB . ASN 188 188 ? A 10.900 -21.371 -35.511 1.000 1 A 42.880 1 ATOM 1334 O O . ASN 188 188 ? A 9.787 -21.702 -38.141 1.000 1 A 42.880 1 ATOM 1335 C CG . ASN 188 188 ? A 12.160 -20.825 -36.151 1.000 1 A 42.880 1 ATOM 1336 N ND2 . ASN 188 188 ? A 12.948 -21.666 -36.778 1.000 1 A 42.880 1 ATOM 1337 O OD1 . ASN 188 188 ? A 12.454 -19.643 -36.092 1.000 1 A 42.880 1 ATOM 1338 N N . LYS 189 189 ? A 8.862 -19.656 -38.114 1.000 1 A 41.250 1 ATOM 1339 C CA . LYS 189 189 ? A 8.879 -19.427 -39.570 1.000 1 A 41.250 1 ATOM 1340 C C . LYS 189 189 ? A 9.539 -18.088 -39.863 1.000 1 A 41.250 1 ATOM 1341 C CB . LYS 189 189 ? A 7.485 -19.578 -40.200 1.000 1 A 41.250 1 ATOM 1342 O O . LYS 189 189 ? A 8.908 -17.037 -39.934 1.000 1 A 41.250 1 ATOM 1343 C CG . LYS 189 189 ? A 7.146 -21.066 -40.386 1.000 1 A 41.250 1 ATOM 1344 C CD . LYS 189 189 ? A 5.725 -21.277 -40.924 1.000 1 A 41.250 1 ATOM 1345 C CE . LYS 189 189 ? A 5.431 -22.783 -40.954 1.000 1 A 41.250 1 ATOM 1346 N NZ . LYS 189 189 ? A 3.990 -23.088 -40.784 1.000 1 A 41.250 1 ATOM 1347 N N . ASN 190 190 ? A 10.856 -18.161 -39.989 1.000 1 A 36.430 1 ATOM 1348 C CA . ASN 190 190 ? A 11.666 -17.170 -40.668 1.000 1 A 36.430 1 ATOM 1349 C C . ASN 190 190 ? A 11.620 -17.484 -42.171 1.000 1 A 36.430 1 ATOM 1350 C CB . ASN 190 190 ? A 13.083 -17.230 -40.064 1.000 1 A 36.430 1 ATOM 1351 O O . ASN 190 190 ? A 12.572 -18.040 -42.699 1.000 1 A 36.430 1 ATOM 1352 C CG . ASN 190 190 ? A 14.076 -16.326 -40.776 1.000 1 A 36.430 1 ATOM 1353 N ND2 . ASN 190 190 ? A 15.073 -16.887 -41.417 1.000 1 A 36.430 1 ATOM 1354 O OD1 . ASN 190 190 ? A 13.978 -15.110 -40.760 1.000 1 A 36.430 1 ATOM 1355 N N . GLU 191 191 ? A 10.543 -17.117 -42.865 1.000 1 A 42.250 1 ATOM 1356 C CA . GLU 191 191 ? A 10.564 -17.034 -44.324 1.000 1 A 42.250 1 ATOM 1357 C C . GLU 191 191 ? A 9.788 -15.822 -44.833 1.000 1 A 42.250 1 ATOM 1358 C CB . GLU 191 191 ? A 10.124 -18.316 -45.051 1.000 1 A 42.250 1 ATOM 1359 O O . GLU 191 191 ? A 8.773 -15.377 -44.305 1.000 1 A 42.250 1 ATOM 1360 C CG . GLU 191 191 ? A 11.253 -19.351 -45.251 1.000 1 A 42.250 1 ATOM 1361 C CD . GLU 191 191 ? A 11.349 -20.440 -44.171 1.000 1 A 42.250 1 ATOM 1362 O OE1 . GLU 191 191 ? A 12.373 -21.161 -44.185 1.000 1 A 42.250 1 ATOM 1363 O OE2 . GLU 191 191 ? A 10.388 -20.587 -43.378 1.000 1 A 42.250 1 ATOM 1364 N N . GLN 192 192 ? A 10.381 -15.269 -45.873 1.000 1 A 36.900 1 ATOM 1365 C CA . GLN 192 192 ? A 10.117 -14.010 -46.524 1.000 1 A 36.900 1 ATOM 1366 C C . GLN 192 192 ? A 8.806 -14.025 -47.335 1.000 1 A 36.900 1 ATOM 1367 C CB . GLN 192 192 ? A 11.335 -13.800 -47.443 1.000 1 A 36.900 1 ATOM 1368 O O . GLN 192 192 ? A 8.271 -15.074 -47.675 1.000 1 A 36.900 1 ATOM 1369 C CG . GLN 192 192 ? A 12.686 -13.695 -46.704 1.000 1 A 36.900 1 ATOM 1370 C CD . GLN 192 192 ? A 13.883 -13.837 -47.642 1.000 1 A 36.900 1 ATOM 1371 N NE2 . GLN 192 192 ? A 14.985 -13.178 -47.362 1.000 1 A 36.900 1 ATOM 1372 O OE1 . GLN 192 192 ? A 13.872 -14.553 -48.626 1.000 1 A 36.900 1 ATOM 1373 N N . HIS 193 193 ? A 8.404 -12.823 -47.757 1.000 1 A 35.270 1 ATOM 1374 C CA . HIS 193 193 ? A 7.434 -12.504 -48.814 1.000 1 A 35.270 1 ATOM 1375 C C . HIS 193 193 ? A 5.936 -12.425 -48.456 1.000 1 A 35.270 1 ATOM 1376 C CB . HIS 193 193 ? A 7.713 -13.272 -50.121 1.000 1 A 35.270 1 ATOM 1377 O O . HIS 193 193 ? A 5.180 -13.386 -48.509 1.000 1 A 35.270 1 ATOM 1378 C CG . HIS 193 193 ? A 8.977 -12.810 -50.795 1.000 1 A 35.270 1 ATOM 1379 C CD2 . HIS 193 193 ? A 10.224 -13.366 -50.693 1.000 1 A 35.270 1 ATOM 1380 N ND1 . HIS 193 193 ? A 9.087 -11.715 -51.624 1.000 1 A 35.270 1 ATOM 1381 C CE1 . HIS 193 193 ? A 10.371 -11.607 -52.001 1.000 1 A 35.270 1 ATOM 1382 N NE2 . HIS 193 193 ? A 11.102 -12.581 -51.447 1.000 1 A 35.270 1 ATOM 1383 N N . ASN 194 194 ? A 5.502 -11.164 -48.327 1.000 1 A 36.940 1 ATOM 1384 C CA . ASN 194 194 ? A 4.462 -10.571 -49.175 1.000 1 A 36.940 1 ATOM 1385 C C . ASN 194 194 ? A 3.092 -11.267 -49.189 1.000 1 A 36.940 1 ATOM 1386 C CB . ASN 194 194 ? A 5.042 -10.451 -50.607 1.000 1 A 36.940 1 ATOM 1387 O O . ASN 194 194 ? A 2.838 -12.069 -50.083 1.000 1 A 36.940 1 ATOM 1388 C CG . ASN 194 194 ? A 4.107 -9.750 -51.579 1.000 1 A 36.940 1 ATOM 1389 N ND2 . ASN 194 194 ? A 4.161 -10.091 -52.846 1.000 1 A 36.940 1 ATOM 1390 O OD1 . ASN 194 194 ? A 3.339 -8.874 -51.217 1.000 1 A 36.940 1 ATOM 1391 N N . ARG 195 195 ? A 2.158 -10.830 -48.331 1.000 1 A 38.520 1 ATOM 1392 C CA . ARG 195 195 ? A 0.719 -10.856 -48.647 1.000 1 A 38.520 1 ATOM 1393 C C . ARG 195 195 ? A -0.016 -9.641 -48.076 1.000 1 A 38.520 1 ATOM 1394 C CB . ARG 195 195 ? A 0.052 -12.185 -48.236 1.000 1 A 38.520 1 ATOM 1395 O O . ARG 195 195 ? A -0.347 -9.577 -46.904 1.000 1 A 38.520 1 ATOM 1396 C CG . ARG 195 195 ? A 0.438 -13.322 -49.199 1.000 1 A 38.520 1 ATOM 1397 C CD . ARG 195 195 ? A -0.515 -14.509 -49.177 1.000 1 A 38.520 1 ATOM 1398 N NE . ARG 195 195 ? A -0.363 -15.298 -50.418 1.000 1 A 38.520 1 ATOM 1399 N NH1 . ARG 195 195 ? A -2.592 -15.679 -50.822 1.000 1 A 38.520 1 ATOM 1400 N NH2 . ARG 195 195 ? A -1.073 -16.374 -52.297 1.000 1 A 38.520 1 ATOM 1401 C CZ . ARG 195 195 ? A -1.339 -15.776 -51.170 1.000 1 A 38.520 1 ATOM 1402 N N . GLN 196 196 ? A -0.198 -8.667 -48.965 1.000 1 A 31.800 1 ATOM 1403 C CA . GLN 196 196 ? A -1.445 -7.953 -49.261 1.000 1 A 31.800 1 ATOM 1404 C C . GLN 196 196 ? A -2.434 -7.690 -48.109 1.000 1 A 31.800 1 ATOM 1405 C CB . GLN 196 196 ? A -2.162 -8.689 -50.408 1.000 1 A 31.800 1 ATOM 1406 O O . GLN 196 196 ? A -3.094 -8.598 -47.618 1.000 1 A 31.800 1 ATOM 1407 C CG . GLN 196 196 ? A -1.338 -8.705 -51.707 1.000 1 A 31.800 1 ATOM 1408 C CD . GLN 196 196 ? A -2.065 -9.442 -52.823 1.000 1 A 31.800 1 ATOM 1409 N NE2 . GLN 196 196 ? A -2.745 -8.748 -53.709 1.000 1 A 31.800 1 ATOM 1410 O OE1 . GLN 196 196 ? A -2.033 -10.656 -52.914 1.000 1 A 31.800 1 ATOM 1411 N N . LYS 197 197 ? A -2.613 -6.389 -47.830 1.000 1 A 36.540 1 ATOM 1412 C CA . LYS 197 197 ? A -3.888 -5.699 -47.557 1.000 1 A 36.540 1 ATOM 1413 C C . LYS 197 197 ? A -5.082 -6.615 -47.250 1.000 1 A 36.540 1 ATOM 1414 C CB . LYS 197 197 ? A -4.269 -4.845 -48.788 1.000 1 A 36.540 1 ATOM 1415 O O . LYS 197 197 ? A -5.728 -7.116 -48.167 1.000 1 A 36.540 1 ATOM 1416 C CG . LYS 197 197 ? A -3.574 -3.482 -48.887 1.000 1 A 36.540 1 ATOM 1417 C CD . LYS 197 197 ? A -4.116 -2.725 -50.112 1.000 1 A 36.540 1 ATOM 1418 C CE . LYS 197 197 ? A -3.669 -1.260 -50.105 1.000 1 A 36.540 1 ATOM 1419 N NZ . LYS 197 197 ? A -4.388 -0.469 -51.135 1.000 1 A 36.540 1 ATOM 1420 N N . VAL 198 198 ? A -5.477 -6.657 -45.985 1.000 1 A 41.070 1 ATOM 1421 C CA . VAL 198 198 ? A -6.892 -6.787 -45.628 1.000 1 A 41.070 1 ATOM 1422 C C . VAL 198 198 ? A -7.389 -5.399 -45.235 1.000 1 A 41.070 1 ATOM 1423 C CB . VAL 198 198 ? A -7.153 -7.891 -44.585 1.000 1 A 41.070 1 ATOM 1424 O O . VAL 198 198 ? A -7.077 -4.877 -44.171 1.000 1 A 41.070 1 ATOM 1425 C CG1 . VAL 198 198 ? A -7.111 -9.258 -45.283 1.000 1 A 41.070 1 ATOM 1426 C CG2 . VAL 198 198 ? A -6.153 -7.912 -43.421 1.000 1 A 41.070 1 ATOM 1427 N N . ASN 199 199 ? A -8.086 -4.762 -46.178 1.000 1 A 38.200 1 ATOM 1428 C CA . ASN 199 199 ? A -8.951 -3.617 -45.923 1.000 1 A 38.200 1 ATOM 1429 C C . ASN 199 199 ? A -10.043 -4.079 -44.949 1.000 1 A 38.200 1 ATOM 1430 C CB . ASN 199 199 ? A -9.628 -3.185 -47.248 1.000 1 A 38.200 1 ATOM 1431 O O . ASN 199 199 ? A -10.850 -4.928 -45.326 1.000 1 A 38.200 1 ATOM 1432 C CG . ASN 199 199 ? A -9.021 -1.996 -47.967 1.000 1 A 38.200 1 ATOM 1433 N ND2 . ASN 199 199 ? A -9.845 -1.255 -48.671 1.000 1 A 38.200 1 ATOM 1434 O OD1 . ASN 199 199 ? A -7.828 -1.729 -47.948 1.000 1 A 38.200 1 ATOM 1435 N N . LEU 200 200 ? A -10.103 -3.511 -43.748 1.000 1 A 38.420 1 ATOM 1436 C CA . LEU 200 200 ? A -11.306 -3.573 -42.927 1.000 1 A 38.420 1 ATOM 1437 C C . LEU 200 200 ? A -11.942 -2.180 -42.963 1.000 1 A 38.420 1 ATOM 1438 C CB . LEU 200 200 ? A -10.962 -4.117 -41.528 1.000 1 A 38.420 1 ATOM 1439 O O . LEU 200 200 ? A -11.363 -1.222 -42.454 1.000 1 A 38.420 1 ATOM 1440 C CG . LEU 200 200 ? A -12.182 -4.633 -40.739 1.000 1 A 38.420 1 ATOM 1441 C CD1 . LEU 200 200 ? A -12.845 -5.847 -41.404 1.000 1 A 38.420 1 ATOM 1442 C CD2 . LEU 200 200 ? A -11.734 -5.069 -39.343 1.000 1 A 38.420 1 ATOM 1443 N N . GLY 201 201 ? A -13.059 -2.080 -43.692 1.000 1 A 36.150 1 ATOM 1444 C CA . GLY 201 201 ? A -13.893 -0.881 -43.820 1.000 1 A 36.150 1 ATOM 1445 C C . GLY 201 201 ? A -14.364 -0.390 -42.452 1.000 1 A 36.150 1 ATOM 1446 O O . GLY 201 201 ? A -14.516 -1.167 -41.516 1.000 1 A 36.150 1 ATOM 1447 N N . GLU 202 202 ? A -14.399 0.923 -42.261 1.000 1 A 35.170 1 ATOM 1448 C CA . GLU 202 202 ? A -15.623 1.713 -42.453 1.000 1 A 35.170 1 ATOM 1449 C C . GLU 202 202 ? A -16.716 1.308 -41.458 1.000 1 A 35.170 1 ATOM 1450 C CB . GLU 202 202 ? A -16.111 1.749 -43.915 1.000 1 A 35.170 1 ATOM 1451 O O . GLU 202 202 ? A -17.550 0.449 -41.725 1.000 1 A 35.170 1 ATOM 1452 C CG . GLU 202 202 ? A -17.198 2.827 -44.112 1.000 1 A 35.170 1 ATOM 1453 C CD . GLU 202 202 ? A -17.706 2.934 -45.561 1.000 1 A 35.170 1 ATOM 1454 O OE1 . GLU 202 202 ? A -18.776 3.555 -45.749 1.000 1 A 35.170 1 ATOM 1455 O OE2 . GLU 202 202 ? A -17.009 2.432 -46.474 1.000 1 A 35.170 1 ATOM 1456 N N . VAL 203 203 ? A -16.715 1.986 -40.311 1.000 1 A 39.960 1 ATOM 1457 C CA . VAL 203 203 ? A -17.933 2.249 -39.546 1.000 1 A 39.960 1 ATOM 1458 C C . VAL 203 203 ? A -17.966 3.743 -39.256 1.000 1 A 39.960 1 ATOM 1459 C CB . VAL 203 203 ? A -18.095 1.372 -38.289 1.000 1 A 39.960 1 ATOM 1460 O O . VAL 203 203 ? A -17.185 4.280 -38.474 1.000 1 A 39.960 1 ATOM 1461 C CG1 . VAL 203 203 ? A -18.580 -0.029 -38.683 1.000 1 A 39.960 1 ATOM 1462 C CG2 . VAL 203 203 ? A -16.821 1.221 -37.448 1.000 1 A 39.960 1 ATOM 1463 N N . ALA 204 204 ? A -18.822 4.419 -40.012 1.000 1 A 36.480 1 ATOM 1464 C CA . ALA 204 204 ? A -19.226 5.793 -39.812 1.000 1 A 36.480 1 ATOM 1465 C C . ALA 204 204 ? A -20.315 5.846 -38.733 1.000 1 A 36.480 1 ATOM 1466 C CB . ALA 204 204 ? A -19.759 6.304 -41.158 1.000 1 A 36.480 1 ATOM 1467 O O . ALA 204 204 ? A -21.308 5.136 -38.851 1.000 1 A 36.480 1 ATOM 1468 N N . THR 205 205 ? A -20.153 6.719 -37.741 1.000 1 A 41.290 1 ATOM 1469 C CA . THR 205 205 ? A -21.244 7.277 -36.920 1.000 1 A 41.290 1 ATOM 1470 C C . THR 205 205 ? A -20.812 8.694 -36.518 1.000 1 A 41.290 1 ATOM 1471 C CB . THR 205 205 ? A -21.566 6.426 -35.676 1.000 1 A 41.290 1 ATOM 1472 O O . THR 205 205 ? A -19.803 8.854 -35.837 1.000 1 A 41.290 1 ATOM 1473 C CG2 . THR 205 205 ? A -22.165 5.055 -35.996 1.000 1 A 41.290 1 ATOM 1474 O OG1 . THR 205 205 ? A -20.407 6.196 -34.910 1.000 1 A 41.290 1 ATOM 1475 N N . ASP 206 206 ? A -21.321 9.713 -37.213 1.000 1 A 33.320 1 ATOM 1476 C CA . ASP 206 206 ? A -22.421 10.590 -36.755 1.000 1 A 33.320 1 ATOM 1477 C C . ASP 206 206 ? A -21.895 11.644 -35.750 1.000 1 A 33.320 1 ATOM 1478 C CB . ASP 206 206 ? A -23.637 9.766 -36.266 1.000 1 A 33.320 1 ATOM 1479 O O . ASP 206 206 ? A -21.583 11.339 -34.607 1.000 1 A 33.320 1 ATOM 1480 C CG . ASP 206 206 ? A -25.001 10.341 -36.666 1.000 1 A 33.320 1 ATOM 1481 O OD1 . ASP 206 206 ? A -25.058 11.071 -37.681 1.000 1 A 33.320 1 ATOM 1482 O OD2 . ASP 206 206 ? A -25.995 9.956 -36.015 1.000 1 A 33.320 1 ATOM 1483 N N . ALA 207 207 ? A -21.412 12.801 -36.211 1.000 1 A 32.640 1 ATOM 1484 C CA . ALA 207 207 ? A -22.174 14.015 -36.529 1.000 1 A 32.640 1 ATOM 1485 C C . ALA 207 207 ? A -22.857 14.666 -35.311 1.000 1 A 32.640 1 ATOM 1486 C CB . ALA 207 207 ? A -23.148 13.817 -37.700 1.000 1 A 32.640 1 ATOM 1487 O O . ALA 207 207 ? A -23.963 14.291 -34.963 1.000 1 A 32.640 1 ATOM 1488 N N . THR 208 208 ? A -22.249 15.728 -34.762 1.000 1 A 37.870 1 ATOM 1489 C CA . THR 208 208 ? A -22.959 16.901 -34.207 1.000 1 A 37.870 1 ATOM 1490 C C . THR 208 208 ? A -22.005 18.093 -34.044 1.000 1 A 37.870 1 ATOM 1491 C CB . THR 208 208 ? A -23.651 16.680 -32.843 1.000 1 A 37.870 1 ATOM 1492 O O . THR 208 208 ? A -21.151 18.096 -33.166 1.000 1 A 37.870 1 ATOM 1493 C CG2 . THR 208 208 ? A -25.038 16.034 -32.909 1.000 1 A 37.870 1 ATOM 1494 O OG1 . THR 208 208 ? A -22.837 15.937 -31.972 1.000 1 A 37.870 1 ATOM 1495 N N . GLY 209 209 ? A -22.189 19.097 -34.909 1.000 1 A 31.500 1 ATOM 1496 C CA . GLY 209 209 ? A -22.197 20.533 -34.597 1.000 1 A 31.500 1 ATOM 1497 C C . GLY 209 209 ? A -20.977 21.200 -33.953 1.000 1 A 31.500 1 ATOM 1498 O O . GLY 209 209 ? A -20.857 21.194 -32.739 1.000 1 A 31.500 1 ATOM 1499 N N . VAL 210 210 ? A -20.219 21.960 -34.754 1.000 1 A 41.250 1 ATOM 1500 C CA . VAL 210 210 ? A -19.998 23.398 -34.491 1.000 1 A 41.250 1 ATOM 1501 C C . VAL 210 210 ? A -19.837 24.159 -35.815 1.000 1 A 41.250 1 ATOM 1502 C CB . VAL 210 210 ? A -18.837 23.746 -33.531 1.000 1 A 41.250 1 ATOM 1503 O O . VAL 210 210 ? A -19.029 23.817 -36.676 1.000 1 A 41.250 1 ATOM 1504 C CG1 . VAL 210 210 ? A -19.189 23.564 -32.049 1.000 1 A 41.250 1 ATOM 1505 C CG2 . VAL 210 210 ? A -17.537 22.992 -33.825 1.000 1 A 41.250 1 ATOM 1506 N N . GLU 211 211 ? A -20.678 25.174 -35.962 1.000 1 A 31.180 1 ATOM 1507 C CA . GLU 211 211 ? A -20.778 26.175 -37.028 1.000 1 A 31.180 1 ATOM 1508 C C . GLU 211 211 ? A -19.599 27.176 -36.937 1.000 1 A 31.180 1 ATOM 1509 C CB . GLU 211 211 ? A -22.148 26.847 -36.795 1.000 1 A 31.180 1 ATOM 1510 O O . GLU 211 211 ? A -19.189 27.557 -35.850 1.000 1 A 31.180 1 ATOM 1511 C CG . GLU 211 211 ? A -23.327 25.910 -37.130 1.000 1 A 31.180 1 ATOM 1512 C CD . GLU 211 211 ? A -24.614 26.225 -36.352 1.000 1 A 31.180 1 ATOM 1513 O OE1 . GLU 211 211 ? A -25.698 26.078 -36.958 1.000 1 A 31.180 1 ATOM 1514 O OE2 . GLU 211 211 ? A -24.504 26.568 -35.154 1.000 1 A 31.180 1 ATOM 1515 N N . SER 212 212 ? A -18.924 27.523 -38.039 1.000 1 A 30.800 1 ATOM 1516 C CA . SER 212 212 ? A -19.145 28.738 -38.852 1.000 1 A 30.800 1 ATOM 1517 C C . SER 212 212 ? A -18.180 29.924 -38.596 1.000 1 A 30.800 1 ATOM 1518 C CB . SER 212 212 ? A -20.606 29.203 -38.841 1.000 1 A 30.800 1 ATOM 1519 O O . SER 212 212 ? A -17.858 30.264 -37.464 1.000 1 A 30.800 1 ATOM 1520 O OG . SER 212 212 ? A -20.798 30.231 -39.787 1.000 1 A 30.800 1 ATOM 1521 N N . TYR 213 213 ? A -17.857 30.592 -39.719 1.000 1 A 33.550 1 ATOM 1522 C CA . TYR 213 213 ? A -17.339 31.959 -39.963 1.000 1 A 33.550 1 ATOM 1523 C C . TYR 213 213 ? A -15.821 32.216 -40.154 1.000 1 A 33.550 1 ATOM 1524 C CB . TYR 213 213 ? A -18.004 33.007 -39.053 1.000 1 A 33.550 1 ATOM 1525 O O . TYR 213 213 ? A -15.023 32.113 -39.233 1.000 1 A 33.550 1 ATOM 1526 C CG . TYR 213 213 ? A -19.523 33.002 -39.097 1.000 1 A 33.550 1 ATOM 1527 C CD1 . TYR 213 213 ? A -20.201 33.435 -40.255 1.000 1 A 33.550 1 ATOM 1528 C CD2 . TYR 213 213 ? A -20.260 32.528 -37.993 1.000 1 A 33.550 1 ATOM 1529 C CE1 . TYR 213 213 ? A -21.607 33.377 -40.315 1.000 1 A 33.550 1 ATOM 1530 C CE2 . TYR 213 213 ? A -21.667 32.468 -38.050 1.000 1 A 33.550 1 ATOM 1531 O OH . TYR 213 213 ? A -23.696 32.802 -39.299 1.000 1 A 33.550 1 ATOM 1532 C CZ . TYR 213 213 ? A -22.344 32.890 -39.216 1.000 1 A 33.550 1 ATOM 1533 N N . GLY 214 214 ? A -15.484 32.724 -41.360 1.000 1 A 34.660 1 ATOM 1534 C CA . GLY 214 214 ? A -14.336 33.609 -41.668 1.000 1 A 34.660 1 ATOM 1535 C C . GLY 214 214 ? A -13.096 32.917 -42.260 1.000 1 A 34.660 1 ATOM 1536 O O . GLY 214 214 ? A -12.269 32.403 -41.528 1.000 1 A 34.660 1 ATOM 1537 N N . ALA 215 215 ? A -12.936 32.743 -43.577 1.000 1 A 31.790 1 ATOM 1538 C CA . ALA 215 215 ? A -12.485 33.744 -44.561 1.000 1 A 31.790 1 ATOM 1539 C C . ALA 215 215 ? A -11.226 34.547 -44.146 1.000 1 A 31.790 1 ATOM 1540 C CB . ALA 215 215 ? A -13.645 34.647 -45.013 1.000 1 A 31.790 1 ATOM 1541 O O . ALA 215 215 ? A -11.351 35.503 -43.398 1.000 1 A 31.790 1 ATOM 1542 N N . HIS 216 216 ? A -10.036 34.154 -44.638 1.000 1 A 33.580 1 ATOM 1543 C CA . HIS 216 216 ? A -9.045 34.939 -45.420 1.000 1 A 33.580 1 ATOM 1544 C C . HIS 216 216 ? A -7.740 34.112 -45.606 1.000 1 A 33.580 1 ATOM 1545 C CB . HIS 216 216 ? A -8.689 36.306 -44.806 1.000 1 A 33.580 1 ATOM 1546 O O . HIS 216 216 ? A -7.295 33.478 -44.651 1.000 1 A 33.580 1 ATOM 1547 C CG . HIS 216 216 ? A -9.756 37.362 -44.990 1.000 1 A 33.580 1 ATOM 1548 C CD2 . HIS 216 216 ? A -10.364 38.075 -43.990 1.000 1 A 33.580 1 ATOM 1549 N ND1 . HIS 216 216 ? A -10.365 37.733 -46.171 1.000 1 A 33.580 1 ATOM 1550 C CE1 . HIS 216 216 ? A -11.327 38.625 -45.880 1.000 1 A 33.580 1 ATOM 1551 N NE2 . HIS 216 216 ? A -11.359 38.871 -44.566 1.000 1 A 33.580 1 ATOM 1552 N N . PRO 217 217 ? A -7.104 34.083 -46.800 1.000 1 A 38.670 1 ATOM 1553 C CA . PRO 217 217 ? A -5.973 33.199 -47.088 1.000 1 A 38.670 1 ATOM 1554 C C . PRO 217 217 ? A -4.628 33.938 -47.007 1.000 1 A 38.670 1 ATOM 1555 C CB . PRO 217 217 ? A -6.255 32.707 -48.511 1.000 1 A 38.670 1 ATOM 1556 O O . PRO 217 217 ? A -4.417 34.903 -47.738 1.000 1 A 38.670 1 ATOM 1557 C CG . PRO 217 217 ? A -6.897 33.922 -49.189 1.000 1 A 38.670 1 ATOM 1558 C CD . PRO 217 217 ? A -7.541 34.711 -48.044 1.000 1 A 38.670 1 ATOM 1559 N N . VAL 218 218 ? A -3.678 33.455 -46.200 1.000 1 A 37.450 1 ATOM 1560 C CA . VAL 218 218 ? A -2.264 33.843 -46.332 1.000 1 A 37.450 1 ATOM 1561 C C . VAL 218 218 ? A -1.333 32.640 -46.143 1.000 1 A 37.450 1 ATOM 1562 C CB . VAL 218 218 ? A -1.849 35.045 -45.447 1.000 1 A 37.450 1 ATOM 1563 O O . VAL 218 218 ? A -1.269 32.028 -45.088 1.000 1 A 37.450 1 ATOM 1564 C CG1 . VAL 218 218 ? A -2.468 36.362 -45.936 1.000 1 A 37.450 1 ATOM 1565 C CG2 . VAL 218 218 ? A -2.186 34.893 -43.961 1.000 1 A 37.450 1 ATOM 1566 N N . GLN 219 219 ? A -0.603 32.353 -47.221 1.000 1 A 33.000 1 ATOM 1567 C CA . GLN 219 219 ? A 0.759 31.810 -47.250 1.000 1 A 33.000 1 ATOM 1568 C C . GLN 219 219 ? A 0.992 30.378 -46.736 1.000 1 A 33.000 1 ATOM 1569 C CB . GLN 219 219 ? A 1.731 32.857 -46.685 1.000 1 A 33.000 1 ATOM 1570 O O . GLN 219 219 ? A 1.369 30.122 -45.599 1.000 1 A 33.000 1 ATOM 1571 C CG . GLN 219 219 ? A 1.685 34.140 -47.539 1.000 1 A 33.000 1 ATOM 1572 C CD . GLN 219 219 ? A 2.671 35.208 -47.093 1.000 1 A 33.000 1 ATOM 1573 N NE2 . GLN 219 219 ? A 2.995 36.150 -47.951 1.000 1 A 33.000 1 ATOM 1574 O OE1 . GLN 219 219 ? A 3.158 35.241 -45.981 1.000 1 A 33.000 1 ATOM 1575 N N . SER 220 220 ? A 0.872 29.456 -47.695 1.000 1 A 30.820 1 ATOM 1576 C CA . SER 220 220 ? A 1.781 28.339 -47.978 1.000 1 A 30.820 1 ATOM 1577 C C . SER 220 220 ? A 2.946 28.106 -47.004 1.000 1 A 30.820 1 ATOM 1578 C CB . SER 220 220 ? A 2.379 28.560 -49.378 1.000 1 A 30.820 1 ATOM 1579 O O . SER 220 220 ? A 4.063 28.563 -47.237 1.000 1 A 30.820 1 ATOM 1580 O OG . SER 220 220 ? A 1.363 28.578 -50.363 1.000 1 A 30.820 1 ATOM 1581 N N . VAL 221 221 ? A 2.724 27.238 -46.020 1.000 1 A 39.750 1 ATOM 1582 C CA . VAL 221 221 ? A 3.693 26.199 -45.645 1.000 1 A 39.750 1 ATOM 1583 C C . VAL 221 221 ? A 2.970 24.863 -45.785 1.000 1 A 39.750 1 ATOM 1584 C CB . VAL 221 221 ? A 4.367 26.432 -44.277 1.000 1 A 39.750 1 ATOM 1585 O O . VAL 221 221 ? A 2.208 24.421 -44.933 1.000 1 A 39.750 1 ATOM 1586 C CG1 . VAL 221 221 ? A 5.304 27.644 -44.358 1.000 1 A 39.750 1 ATOM 1587 C CG2 . VAL 221 221 ? A 3.403 26.654 -43.107 1.000 1 A 39.750 1 ATOM 1588 N N . SER 222 222 ? A 3.084 24.291 -46.978 1.000 1 A 34.490 1 ATOM 1589 C CA . SER 222 222 ? A 2.417 23.056 -47.375 1.000 1 A 34.490 1 ATOM 1590 C C . SER 222 222 ? A 2.875 21.883 -46.510 1.000 1 A 34.490 1 ATOM 1591 C CB . SER 222 222 ? A 2.754 22.773 -48.844 1.000 1 A 34.490 1 ATOM 1592 O O . SER 222 222 ? A 4.055 21.535 -46.538 1.000 1 A 34.490 1 ATOM 1593 O OG . SER 222 222 ? A 4.157 22.825 -49.031 1.000 1 A 34.490 1 ATOM 1594 N N . GLY 223 223 ? A 1.933 21.243 -45.817 1.000 1 A 33.830 1 ATOM 1595 C CA . GLY 223 223 ? A 2.125 19.909 -45.247 1.000 1 A 33.830 1 ATOM 1596 C C . GLY 223 223 ? A 1.593 19.745 -43.830 1.000 1 A 33.830 1 ATOM 1597 O O . GLY 223 223 ? A 2.343 19.370 -42.937 1.000 1 A 33.830 1 ATOM 1598 N N . THR 224 224 ? A 0.305 20.002 -43.607 1.000 1 A 37.420 1 ATOM 1599 C CA . THR 224 224 ? A -0.391 19.445 -42.441 1.000 1 A 37.420 1 ATOM 1600 C C . THR 224 224 ? A -0.492 17.915 -42.589 1.000 1 A 37.420 1 ATOM 1601 C CB . THR 224 224 ? A -1.775 20.083 -42.266 1.000 1 A 37.420 1 ATOM 1602 O O . THR 224 224 ? A -0.621 17.415 -43.711 1.000 1 A 37.420 1 ATOM 1603 C CG2 . THR 224 224 ? A -1.659 21.522 -41.764 1.000 1 A 37.420 1 ATOM 1604 O OG1 . THR 224 224 ? A -2.455 20.136 -43.499 1.000 1 A 37.420 1 ATOM 1605 N N . PRO 225 225 ? A -0.371 17.145 -41.493 1.000 1 A 38.980 1 ATOM 1606 C CA . PRO 225 225 ? A -0.110 15.712 -41.551 1.000 1 A 38.980 1 ATOM 1607 C C . PRO 225 225 ? A -1.382 14.952 -41.927 1.000 1 A 38.980 1 ATOM 1608 C CB . PRO 225 225 ? A 0.427 15.343 -40.166 1.000 1 A 38.980 1 ATOM 1609 O O . PRO 225 225 ? A -2.393 15.006 -41.228 1.000 1 A 38.980 1 ATOM 1610 C CG . PRO 225 225 ? A -0.266 16.347 -39.244 1.000 1 A 38.980 1 ATOM 1611 C CD . PRO 225 225 ? A -0.405 17.597 -40.111 1.000 1 A 38.980 1 ATOM 1612 N N . ALA 226 226 ? A -1.329 14.246 -43.054 1.000 1 A 44.150 1 ATOM 1613 C CA . ALA 226 226 ? A -2.401 13.368 -43.488 1.000 1 A 44.150 1 ATOM 1614 C C . ALA 226 226 ? A -2.529 12.169 -42.537 1.000 1 A 44.150 1 ATOM 1615 C CB . ALA 226 226 ? A -2.156 12.949 -44.941 1.000 1 A 44.150 1 ATOM 1616 O O . ALA 226 226 ? A -1.541 11.573 -42.108 1.000 1 A 44.150 1 ATOM 1617 N N . ALA 227 227 ? A -3.779 11.847 -42.222 1.000 1 A 45.300 1 ATOM 1618 C CA . ALA 227 227 ? A -4.218 10.715 -41.426 1.000 1 A 45.300 1 ATOM 1619 C C . ALA 227 227 ? A -3.506 9.403 -41.804 1.000 1 A 45.300 1 ATOM 1620 C CB . ALA 227 227 ? A -5.730 10.604 -41.649 1.000 1 A 45.300 1 ATOM 1621 O O . ALA 227 227 ? A -3.485 9.004 -42.967 1.000 1 A 45.300 1 ATOM 1622 N N . GLY 228 228 ? A -2.964 8.717 -40.797 1.000 1 A 42.700 1 ATOM 1623 C CA . GLY 228 228 ? A -2.253 7.449 -40.951 1.000 1 A 42.700 1 ATOM 1624 C C . GLY 228 228 ? A -0.831 7.577 -40.433 1.000 1 A 42.700 1 ATOM 1625 O O . GLY 228 228 ? A 0.090 7.824 -41.204 1.000 1 A 42.700 1 ATOM 1626 N N . GLY 229 229 ? A -0.669 7.436 -39.114 1.000 1 A 42.650 1 ATOM 1627 C CA . GLY 229 229 ? A 0.621 7.451 -38.427 1.000 1 A 42.650 1 ATOM 1628 C C . GLY 229 229 ? A 1.516 6.315 -38.913 1.000 1 A 42.650 1 ATOM 1629 O O . GLY 229 229 ? A 1.606 5.265 -38.288 1.000 1 A 42.650 1 ATOM 1630 N N . SER 230 230 ? A 2.158 6.519 -40.056 1.000 1 A 49.090 1 ATOM 1631 C CA . SER 230 230 ? A 3.256 5.700 -40.527 1.000 1 A 49.090 1 ATOM 1632 C C . SER 230 230 ? A 4.429 5.989 -39.601 1.000 1 A 49.090 1 ATOM 1633 C CB . SER 230 230 ? A 3.577 6.055 -41.982 1.000 1 A 49.090 1 ATOM 1634 O O . SER 230 230 ? A 4.992 7.083 -39.634 1.000 1 A 49.090 1 ATOM 1635 O OG . SER 230 230 ? A 4.582 5.191 -42.455 1.000 1 A 49.090 1 ATOM 1636 N N . LEU 231 231 ? A 4.779 5.030 -38.739 1.000 1 A 52.210 1 ATOM 1637 C CA . LEU 231 231 ? A 6.009 5.030 -37.939 1.000 1 A 52.210 1 ATOM 1638 C C . LEU 231 231 ? A 7.260 4.889 -38.840 1.000 1 A 52.210 1 ATOM 1639 C CB . LEU 231 231 ? A 5.960 3.927 -36.853 1.000 1 A 52.210 1 ATOM 1640 O O . LEU 231 231 ? A 8.144 4.079 -38.576 1.000 1 A 52.210 1 ATOM 1641 C CG . LEU 231 231 ? A 5.142 4.241 -35.589 1.000 1 A 52.210 1 ATOM 1642 C CD1 . LEU 231 231 ? A 3.686 3.792 -35.703 1.000 1 A 52.210 1 ATOM 1643 C CD2 . LEU 231 231 ? A 5.757 3.506 -34.393 1.000 1 A 52.210 1 ATOM 1644 N N . ASP 232 232 ? A 7.339 5.671 -39.914 1.000 1 A 58.210 1 ATOM 1645 C CA . ASP 232 232 ? A 8.435 5.666 -40.883 1.000 1 A 58.210 1 ATOM 1646 C C . ASP 232 232 ? A 9.368 6.876 -40.722 1.000 1 A 58.210 1 ATOM 1647 C CB . ASP 232 232 ? A 7.862 5.522 -42.293 1.000 1 A 58.210 1 ATOM 1648 O O . ASP 232 232 ? A 10.377 7.000 -41.408 1.000 1 A 58.210 1 ATOM 1649 C CG . ASP 232 232 ? A 8.918 5.104 -43.315 1.000 1 A 58.210 1 ATOM 1650 O OD1 . ASP 232 232 ? A 9.757 4.243 -42.956 1.000 1 A 58.210 1 ATOM 1651 O OD2 . ASP 232 232 ? A 8.792 5.569 -44.465 1.000 1 A 58.210 1 ATOM 1652 N N . MET 233 233 ? A 9.134 7.734 -39.718 1.000 1 A 56.630 1 ATOM 1653 C CA . MET 233 233 ? A 10.051 8.838 -39.384 1.000 1 A 56.630 1 ATOM 1654 C C . MET 233 233 ? A 11.464 8.383 -38.973 1.000 1 A 56.630 1 ATOM 1655 C CB . MET 233 233 ? A 9.454 9.718 -38.276 1.000 1 A 56.630 1 ATOM 1656 O O . MET 233 233 ? A 12.344 9.224 -38.792 1.000 1 A 56.630 1 ATOM 1657 C CG . MET 233 233 ? A 8.300 10.601 -38.760 1.000 1 A 56.630 1 ATOM 1658 S SD . MET 233 233 ? A 6.695 10.191 -38.033 1.000 1 A 56.630 1 ATOM 1659 C CE . MET 233 233 ? A 5.883 11.802 -38.204 1.000 1 A 56.630 1 ATOM 1660 N N . SER 234 234 ? A 11.713 7.078 -38.809 1.000 1 A 56.050 1 ATOM 1661 C CA . SER 234 234 ? A 13.036 6.565 -38.438 1.000 1 A 56.050 1 ATOM 1662 C C . SER 234 234 ? A 13.793 5.869 -39.568 1.000 1 A 56.050 1 ATOM 1663 C CB . SER 234 234 ? A 12.943 5.634 -37.230 1.000 1 A 56.050 1 ATOM 1664 O O . SER 234 234 ? A 14.979 5.595 -39.373 1.000 1 A 56.050 1 ATOM 1665 O OG . SER 234 234 ? A 14.239 5.454 -36.688 1.000 1 A 56.050 1 ATOM 1666 N N . LEU 235 235 ? A 13.176 5.547 -40.709 1.000 1 A 63.280 1 ATOM 1667 C CA . LEU 235 235 ? A 13.894 4.810 -41.752 1.000 1 A 63.280 1 ATOM 1668 C C . LEU 235 235 ? A 14.702 5.752 -42.647 1.000 1 A 63.280 1 ATOM 1669 C CB . LEU 235 235 ? A 12.910 3.931 -42.533 1.000 1 A 63.280 1 ATOM 1670 O O . LEU 235 235 ? A 15.882 5.504 -42.905 1.000 1 A 63.280 1 ATOM 1671 C CG . LEU 235 235 ? A 13.589 2.886 -43.437 1.000 1 A 63.280 1 ATOM 1672 C CD1 . LEU 235 235 ? A 14.456 1.889 -42.653 1.000 1 A 63.280 1 ATOM 1673 C CD2 . LEU 235 235 ? A 12.526 2.082 -44.182 1.000 1 A 63.280 1 ATOM 1674 N N . ASP 236 236 ? A 14.110 6.880 -43.034 1.000 1 A 62.530 1 ATOM 1675 C CA . ASP 236 236 ? A 14.728 7.776 -44.007 1.000 1 A 62.530 1 ATOM 1676 C C . ASP 236 236 ? A 15.927 8.538 -43.440 1.000 1 A 62.530 1 ATOM 1677 C CB . ASP 236 236 ? A 13.672 8.722 -44.585 1.000 1 A 62.530 1 ATOM 1678 O O . ASP 236 236 ? A 16.944 8.637 -44.112 1.000 1 A 62.530 1 ATOM 1679 C CG . ASP 236 236 ? A 12.676 8.001 -45.499 1.000 1 A 62.530 1 ATOM 1680 O OD1 . ASP 236 236 ? A 13.070 6.966 -46.088 1.000 1 A 62.530 1 ATOM 1681 O OD2 . ASP 236 236 ? A 11.567 8.553 -45.647 1.000 1 A 62.530 1 ATOM 1682 N N . HIS 237 237 ? A 15.905 9.001 -42.188 1.000 1 A 57.160 1 ATOM 1683 C CA . HIS 237 237 ? A 17.038 9.765 -41.636 1.000 1 A 57.160 1 ATOM 1684 C C . HIS 237 237 ? A 18.305 8.934 -41.398 1.000 1 A 57.160 1 ATOM 1685 C CB . HIS 237 237 ? A 16.605 10.484 -40.354 1.000 1 A 57.160 1 ATOM 1686 O O . HIS 237 237 ? A 19.409 9.471 -41.478 1.000 1 A 57.160 1 ATOM 1687 C CG . HIS 237 237 ? A 15.794 11.735 -40.585 1.000 1 A 57.160 1 ATOM 1688 C CD2 . HIS 237 237 ? A 15.440 12.304 -41.783 1.000 1 A 57.160 1 ATOM 1689 N ND1 . HIS 237 237 ? A 15.321 12.562 -39.594 1.000 1 A 57.160 1 ATOM 1690 C CE1 . HIS 237 237 ? A 14.700 13.601 -40.177 1.000 1 A 57.160 1 ATOM 1691 N NE2 . HIS 237 237 ? A 14.757 13.492 -41.510 1.000 1 A 57.160 1 ATOM 1692 N N . TRP 238 238 ? A 18.174 7.631 -41.142 1.000 1 A 62.660 1 ATOM 1693 C CA . TRP 238 238 ? A 19.332 6.752 -40.948 1.000 1 A 62.660 1 ATOM 1694 C C . TRP 238 238 ? A 19.802 6.093 -42.248 1.000 1 A 62.660 1 ATOM 1695 C CB . TRP 238 238 ? A 19.025 5.735 -39.848 1.000 1 A 62.660 1 ATOM 1696 O O . TRP 238 238 ? A 20.972 5.726 -42.349 1.000 1 A 62.660 1 ATOM 1697 C CG . TRP 238 238 ? A 18.878 6.341 -38.484 1.000 1 A 62.660 1 ATOM 1698 C CD1 . TRP 238 238 ? A 17.722 6.776 -37.937 1.000 1 A 62.660 1 ATOM 1699 C CD2 . TRP 238 238 ? A 19.917 6.653 -37.506 1.000 1 A 62.660 1 ATOM 1700 C CE2 . TRP 238 238 ? A 19.297 7.243 -36.362 1.000 1 A 62.660 1 ATOM 1701 C CE3 . TRP 238 238 ? A 21.323 6.518 -37.476 1.000 1 A 62.660 1 ATOM 1702 N NE1 . TRP 238 238 ? A 17.957 7.284 -36.677 1.000 1 A 62.660 1 ATOM 1703 C CH2 . TRP 238 238 ? A 21.426 7.511 -35.244 1.000 1 A 62.660 1 ATOM 1704 C CZ2 . TRP 238 238 ? A 20.029 7.662 -35.241 1.000 1 A 62.660 1 ATOM 1705 C CZ3 . TRP 238 238 ? A 22.069 6.943 -36.359 1.000 1 A 62.660 1 ATOM 1706 N N . ASN 239 239 ? A 18.931 5.980 -43.256 1.000 1 A 62.580 1 ATOM 1707 C CA . ASN 239 239 ? A 19.303 5.494 -44.584 1.000 1 A 62.580 1 ATOM 1708 C C . ASN 239 239 ? A 19.700 6.624 -45.559 1.000 1 A 62.580 1 ATOM 1709 C CB . ASN 239 239 ? A 18.155 4.627 -45.116 1.000 1 A 62.580 1 ATOM 1710 O O . ASN 239 239 ? A 20.359 6.358 -46.562 1.000 1 A 62.580 1 ATOM 1711 C CG . ASN 239 239 ? A 18.572 3.773 -46.299 1.000 1 A 62.580 1 ATOM 1712 N ND2 . ASN 239 239 ? A 17.671 3.543 -47.223 1.000 1 A 62.580 1 ATOM 1713 O OD1 . ASN 239 239 ? A 19.680 3.265 -46.394 1.000 1 A 62.580 1 ATOM 1714 N N . ALA 240 240 ? A 19.378 7.890 -45.259 1.000 1 A 54.570 1 ATOM 1715 C CA . ALA 240 240 ? A 19.660 9.062 -46.103 1.000 1 A 54.570 1 ATOM 1716 C C . ALA 240 240 ? A 21.155 9.347 -46.353 1.000 1 A 54.570 1 ATOM 1717 C CB . ALA 240 240 ? A 18.964 10.302 -45.521 1.000 1 A 54.570 1 ATOM 1718 O O . ALA 240 240 ? A 21.480 10.226 -47.147 1.000 1 A 54.570 1 ATOM 1719 N N . GLY 241 241 ? A 22.074 8.589 -45.747 1.000 1 A 52.390 1 ATOM 1720 C CA . GLY 241 241 ? A 23.482 8.578 -46.157 1.000 1 A 52.390 1 ATOM 1721 C C . GLY 241 241 ? A 23.725 7.908 -47.516 1.000 1 A 52.390 1 ATOM 1722 O O . GLY 241 241 ? A 24.719 8.209 -48.171 1.000 1 A 52.390 1 ATOM 1723 N N . ASN 242 242 ? A 22.806 7.056 -47.980 1.000 1 A 54.880 1 ATOM 1724 C CA . ASN 242 242 ? A 22.922 6.353 -49.253 1.000 1 A 54.880 1 ATOM 1725 C C . ASN 242 242 ? A 21.812 6.815 -50.200 1.000 1 A 54.880 1 ATOM 1726 C CB . ASN 242 242 ? A 22.945 4.838 -49.003 1.000 1 A 54.880 1 ATOM 1727 O O . ASN 242 242 ? A 20.865 6.086 -50.494 1.000 1 A 54.880 1 ATOM 1728 C CG . ASN 242 242 ? A 24.196 4.352 -48.289 1.000 1 A 54.880 1 ATOM 1729 N ND2 . ASN 242 242 ? A 24.265 3.075 -48.006 1.000 1 A 54.880 1 ATOM 1730 O OD1 . ASN 242 242 ? A 25.133 5.067 -47.984 1.000 1 A 54.880 1 ATOM 1731 N N . ALA 243 243 ? A 21.930 8.053 -50.681 1.000 1 A 42.550 1 ATOM 1732 C CA . ALA 243 243 ? A 21.113 8.540 -51.783 1.000 1 A 42.550 1 ATOM 1733 C C . ALA 243 243 ? A 21.161 7.536 -52.959 1.000 1 A 42.550 1 ATOM 1734 C CB . ALA 243 243 ? A 21.620 9.923 -52.204 1.000 1 A 42.550 1 ATOM 1735 O O . ALA 243 243 ? A 22.249 7.103 -53.355 1.000 1 A 42.550 1 ATOM 1736 N N . PRO 244 244 ? A 20.010 7.155 -53.541 1.000 1 A 46.100 1 ATOM 1737 C CA . PRO 244 244 ? A 19.968 6.212 -54.643 1.000 1 A 46.100 1 ATOM 1738 C C . PRO 244 244 ? A 20.502 6.906 -55.892 1.000 1 A 46.100 1 ATOM 1739 C CB . PRO 244 244 ? A 18.503 5.778 -54.755 1.000 1 A 46.100 1 ATOM 1740 O O . PRO 244 244 ? A 19.808 7.689 -56.548 1.000 1 A 46.100 1 ATOM 1741 C CG . PRO 244 244 ? A 17.732 6.987 -54.228 1.000 1 A 46.100 1 ATOM 1742 C CD . PRO 244 244 ? A 18.670 7.582 -53.179 1.000 1 A 46.100 1 ATOM 1743 N N . VAL 245 245 ? A 21.752 6.608 -56.240 1.000 1 A 43.220 1 ATOM 1744 C CA . VAL 245 245 ? A 22.280 6.925 -57.562 1.000 1 A 43.220 1 ATOM 1745 C C . VAL 245 245 ? A 21.485 6.083 -58.555 1.000 1 A 43.220 1 ATOM 1746 C CB . VAL 245 245 ? A 23.804 6.718 -57.702 1.000 1 A 43.220 1 ATOM 1747 O O . VAL 245 245 ? A 21.671 4.877 -58.702 1.000 1 A 43.220 1 ATOM 1748 C CG1 . VAL 245 245 ? A 24.356 7.760 -58.686 1.000 1 A 43.220 1 ATOM 1749 C CG2 . VAL 245 245 ? A 24.570 6.861 -56.382 1.000 1 A 43.220 1 ATOM 1750 N N . LYS 246 246 ? A 20.523 6.733 -59.202 1.000 1 A 40.950 1 ATOM 1751 C CA . LYS 246 246 ? A 19.815 6.227 -60.371 1.000 1 A 40.950 1 ATOM 1752 C C . LYS 246 246 ? A 20.858 5.976 -61.459 1.000 1 A 40.950 1 ATOM 1753 C CB . LYS 246 246 ? A 18.801 7.291 -60.843 1.000 1 A 40.950 1 ATOM 1754 O O . LYS 246 246 ? A 21.259 6.922 -62.122 1.000 1 A 40.950 1 ATOM 1755 C CG . LYS 246 246 ? A 17.738 7.674 -59.804 1.000 1 A 40.950 1 ATOM 1756 C CD . LYS 246 246 ? A 16.910 8.864 -60.312 1.000 1 A 40.950 1 ATOM 1757 C CE . LYS 246 246 ? A 15.908 9.302 -59.239 1.000 1 A 40.950 1 ATOM 1758 N NZ . LYS 246 246 ? A 15.138 10.500 -59.658 1.000 1 A 40.950 1 ATOM 1759 N N . THR 247 247 ? A 21.315 4.742 -61.641 1.000 1 A 37.660 1 ATOM 1760 C CA . THR 247 247 ? A 21.879 4.247 -62.907 1.000 1 A 37.660 1 ATOM 1761 C C . THR 247 247 ? A 21.993 2.729 -62.848 1.000 1 A 37.660 1 ATOM 1762 C CB . THR 247 247 ? A 23.233 4.895 -63.278 1.000 1 A 37.660 1 ATOM 1763 O O . THR 247 247 ? A 22.815 2.176 -62.135 1.000 1 A 37.660 1 ATOM 1764 C CG2 . THR 247 247 ? A 24.042 4.146 -64.340 1.000 1 A 37.660 1 ATOM 1765 O OG1 . THR 247 247 ? A 22.968 6.133 -63.896 1.000 1 A 37.660 1 ATOM 1766 N N . GLY 248 248 ? A 21.129 2.078 -63.624 1.000 1 A 36.780 1 ATOM 1767 C CA . GLY 248 248 ? A 21.567 1.144 -64.652 1.000 1 A 36.780 1 ATOM 1768 C C . GLY 248 248 ? A 22.338 -0.110 -64.236 1.000 1 A 36.780 1 ATOM 1769 O O . GLY 248 248 ? A 23.529 -0.069 -63.971 1.000 1 A 36.780 1 ATOM 1770 N N . LYS 249 249 ? A 21.683 -1.236 -64.536 1.000 1 A 39.140 1 ATOM 1771 C CA . LYS 249 249 ? A 22.274 -2.378 -65.248 1.000 1 A 39.140 1 ATOM 1772 C C . LYS 249 249 ? A 22.954 -3.461 -64.391 1.000 1 A 39.140 1 ATOM 1773 C CB . LYS 249 249 ? A 23.142 -1.862 -66.426 1.000 1 A 39.140 1 ATOM 1774 O O . LYS 249 249 ? A 24.119 -3.390 -64.043 1.000 1 A 39.140 1 ATOM 1775 C CG . LYS 249 249 ? A 22.961 -2.695 -67.691 1.000 1 A 39.140 1 ATOM 1776 C CD . LYS 249 249 ? A 23.591 -2.028 -68.917 1.000 1 A 39.140 1 ATOM 1777 C CE . LYS 249 249 ? A 23.285 -2.867 -70.162 1.000 1 A 39.140 1 ATOM 1778 N NZ . LYS 249 249 ? A 23.918 -2.297 -71.376 1.000 1 A 39.140 1 ATOM 1779 N N . GLN 250 250 ? A 22.176 -4.528 -64.184 1.000 1 A 37.880 1 ATOM 1780 C CA . GLN 250 250 ? A 22.553 -5.923 -64.451 1.000 1 A 37.880 1 ATOM 1781 C C . GLN 250 250 ? A 23.969 -6.347 -64.022 1.000 1 A 37.880 1 ATOM 1782 C CB . GLN 250 250 ? A 22.410 -6.197 -65.973 1.000 1 A 37.880 1 ATOM 1783 O O . GLN 250 250 ? A 24.886 -6.210 -64.817 1.000 1 A 37.880 1 ATOM 1784 C CG . GLN 250 250 ? A 21.086 -5.811 -66.647 1.000 1 A 37.880 1 ATOM 1785 C CD . GLN 250 250 ? A 21.184 -5.952 -68.166 1.000 1 A 37.880 1 ATOM 1786 N NE2 . GLN 250 250 ? A 20.822 -7.086 -68.718 1.000 1 A 37.880 1 ATOM 1787 O OE1 . GLN 250 250 ? A 21.595 -5.056 -68.888 1.000 1 A 37.880 1 ATOM 1788 N N . MET 251 251 ? A 24.119 -7.038 -62.889 1.000 1 A 40.470 1 ATOM 1789 C CA . MET 251 251 ? A 25.068 -8.155 -62.805 1.000 1 A 40.470 1 ATOM 1790 C C . MET 251 251 ? A 24.503 -9.253 -61.906 1.000 1 A 40.470 1 ATOM 1791 C CB . MET 251 251 ? A 26.488 -7.743 -62.374 1.000 1 A 40.470 1 ATOM 1792 O O . MET 251 251 ? A 24.252 -9.063 -60.720 1.000 1 A 40.470 1 ATOM 1793 C CG . MET 251 251 ? A 27.248 -7.029 -63.503 1.000 1 A 40.470 1 ATOM 1794 S SD . MET 251 251 ? A 29.035 -6.886 -63.309 1.000 1 A 40.470 1 ATOM 1795 C CE . MET 251 251 ? A 29.068 -5.750 -61.901 1.000 1 A 40.470 1 ATOM 1796 N N . SER 252 252 ? A 24.273 -10.393 -62.551 1.000 1 A 42.830 1 ATOM 1797 C CA . SER 252 252 ? A 24.141 -11.735 -61.997 1.000 1 A 42.830 1 ATOM 1798 C C . SER 252 252 ? A 24.880 -11.905 -60.666 1.000 1 A 42.830 1 ATOM 1799 C CB . SER 252 252 ? A 24.760 -12.655 -63.058 1.000 1 A 42.830 1 ATOM 1800 O O . SER 252 252 ? A 26.107 -11.814 -60.619 1.000 1 A 42.830 1 ATOM 1801 O OG . SER 252 252 ? A 24.928 -13.972 -62.603 1.000 1 A 42.830 1 ATOM 1802 N N . ALA 253 253 ? A 24.128 -12.212 -59.609 1.000 1 A 48.560 1 ATOM 1803 C CA . ALA 253 253 ? A 24.654 -12.678 -58.336 1.000 1 A 48.560 1 ATOM 1804 C C . ALA 253 253 ? A 25.301 -14.058 -58.532 1.000 1 A 48.560 1 ATOM 1805 C CB . ALA 253 253 ? A 23.501 -12.698 -57.321 1.000 1 A 48.560 1 ATOM 1806 O O . ALA 253 253 ? A 24.656 -15.090 -58.377 1.000 1 A 48.560 1 ATOM 1807 N N . SER 254 254 ? A 26.575 -14.083 -58.922 1.000 1 A 44.870 1 ATOM 1808 C CA . SER 254 254 ? A 27.395 -15.273 -58.723 1.000 1 A 44.870 1 ATOM 1809 C C . SER 254 254 ? A 27.774 -15.304 -57.241 1.000 1 A 44.870 1 ATOM 1810 C CB . SER 254 254 ? A 28.639 -15.245 -59.610 1.000 1 A 44.870 1 ATOM 1811 O O . SER 254 254 ? A 28.354 -14.320 -56.766 1.000 1 A 44.870 1 ATOM 1812 O OG . SER 254 254 ? A 29.249 -16.518 -59.575 1.000 1 A 44.870 1 ATOM 1813 N N . PRO 255 255 ? A 27.443 -16.365 -56.481 1.000 1 A 51.580 1 ATOM 1814 C CA . PRO 255 255 ? A 27.937 -16.528 -55.125 1.000 1 A 51.580 1 ATOM 1815 C C . PRO 255 255 ? A 29.427 -16.844 -55.241 1.000 1 A 51.580 1 ATOM 1816 C CB . PRO 255 255 ? A 27.091 -17.648 -54.511 1.000 1 A 51.580 1 ATOM 1817 O O . PRO 255 255 ? A 29.836 -18.001 -55.303 1.000 1 A 51.580 1 ATOM 1818 C CG . PRO 255 255 ? A 26.729 -18.518 -55.714 1.000 1 A 51.580 1 ATOM 1819 C CD . PRO 255 255 ? A 26.682 -17.537 -56.887 1.000 1 A 51.580 1 ATOM 1820 N N . SER 256 256 ? A 30.247 -15.799 -55.358 1.000 1 A 47.770 1 ATOM 1821 C CA . SER 256 256 ? A 31.688 -15.951 -55.263 1.000 1 A 47.770 1 ATOM 1822 C C . SER 256 256 ? A 31.951 -16.521 -53.881 1.000 1 A 47.770 1 ATOM 1823 C CB . SER 256 256 ? A 32.428 -14.628 -55.480 1.000 1 A 47.770 1 ATOM 1824 O O . SER 256 256 ? A 31.720 -15.852 -52.873 1.000 1 A 47.770 1 ATOM 1825 O OG . SER 256 256 ? A 33.757 -14.897 -55.879 1.000 1 A 47.770 1 ATOM 1826 N N . VAL 257 257 ? A 32.394 -17.776 -53.857 1.000 1 A 52.500 1 ATOM 1827 C CA . VAL 257 257 ? A 32.988 -18.476 -52.718 1.000 1 A 52.500 1 ATOM 1828 C C . VAL 257 257 ? A 34.299 -17.783 -52.344 1.000 1 A 52.500 1 ATOM 1829 C CB . VAL 257 257 ? A 33.179 -19.976 -53.038 1.000 1 A 52.500 1 ATOM 1830 O O . VAL 257 257 ? A 35.375 -18.368 -52.355 1.000 1 A 52.500 1 ATOM 1831 C CG1 . VAL 257 257 ? A 31.822 -20.684 -53.139 1.000 1 A 52.500 1 ATOM 1832 C CG2 . VAL 257 257 ? A 33.932 -20.235 -54.356 1.000 1 A 52.500 1 ATOM 1833 N N . ASN 258 258 ? A 34.236 -16.481 -52.076 1.000 1 A 52.840 1 ATOM 1834 C CA . ASN 258 258 ? A 35.354 -15.737 -51.551 1.000 1 A 52.840 1 ATOM 1835 C C . ASN 258 258 ? A 35.497 -16.232 -50.129 1.000 1 A 52.840 1 ATOM 1836 C CB . ASN 258 258 ? A 35.117 -14.225 -51.680 1.000 1 A 52.840 1 ATOM 1837 O O . ASN 258 258 ? A 34.721 -15.845 -49.253 1.000 1 A 52.840 1 ATOM 1838 C CG . ASN 258 258 ? A 35.290 -13.739 -53.106 1.000 1 A 52.840 1 ATOM 1839 N ND2 . ASN 258 258 ? A 35.066 -12.475 -53.361 1.000 1 A 52.840 1 ATOM 1840 O OD1 . ASN 258 258 ? A 35.608 -14.478 -54.022 1.000 1 A 52.840 1 ATOM 1841 N N . ALA 259 259 ? A 36.451 -17.154 -49.973 1.000 1 A 59.120 1 ATOM 1842 C CA . ALA 259 259 ? A 37.088 -17.530 -48.729 1.000 1 A 59.120 1 ATOM 1843 C C . ALA 259 259 ? A 37.309 -16.245 -47.941 1.000 1 A 59.120 1 ATOM 1844 C CB . ALA 259 259 ? A 38.401 -18.248 -49.066 1.000 1 A 59.120 1 ATOM 1845 O O . ALA 259 259 ? A 38.260 -15.498 -48.168 1.000 1 A 59.120 1 ATOM 1846 N N . THR 260 260 ? A 36.318 -15.932 -47.116 1.000 1 A 63.740 1 ATOM 1847 C CA . THR 260 260 ? A 36.299 -14.723 -46.323 1.000 1 A 63.740 1 ATOM 1848 C C . THR 260 260 ? A 37.495 -14.901 -45.398 1.000 1 A 63.740 1 ATOM 1849 C CB . THR 260 260 ? A 34.941 -14.617 -45.627 1.000 1 A 63.740 1 ATOM 1850 O O . THR 260 260 ? A 37.602 -15.961 -44.769 1.000 1 A 63.740 1 ATOM 1851 C CG2 . THR 260 260 ? A 34.789 -13.376 -44.770 1.000 1 A 63.740 1 ATOM 1852 O OG1 . THR 260 260 ? A 33.923 -14.564 -46.604 1.000 1 A 63.740 1 ATOM 1853 N N . PRO 261 261 ? A 38.488 -13.995 -45.433 1.000 1 A 68.550 1 ATOM 1854 C CA . PRO 261 261 ? A 39.712 -14.196 -44.679 1.000 1 A 68.550 1 ATOM 1855 C C . PRO 261 261 ? A 39.345 -14.442 -43.209 1.000 1 A 68.550 1 ATOM 1856 C CB . PRO 261 261 ? A 40.562 -12.941 -44.909 1.000 1 A 68.550 1 ATOM 1857 O O . PRO 261 261 ? A 38.357 -13.884 -42.729 1.000 1 A 68.550 1 ATOM 1858 C CG . PRO 261 261 ? A 39.547 -11.886 -45.348 1.000 1 A 68.550 1 ATOM 1859 C CD . PRO 261 261 ? A 38.488 -12.699 -46.087 1.000 1 A 68.550 1 ATOM 1860 N N . PRO 262 262 ? A 40.106 -15.263 -42.467 1.000 1 A 73.840 1 ATOM 1861 C CA . PRO 262 262 ? A 39.770 -15.614 -41.085 1.000 1 A 73.840 1 ATOM 1862 C C . PRO 262 262 ? A 39.561 -14.380 -40.189 1.000 1 A 73.840 1 ATOM 1863 C CB . PRO 262 262 ? A 40.919 -16.508 -40.603 1.000 1 A 73.840 1 ATOM 1864 O O . PRO 262 262 ? A 38.772 -14.431 -39.254 1.000 1 A 73.840 1 ATOM 1865 C CG . PRO 262 262 ? A 42.059 -16.244 -41.590 1.000 1 A 73.840 1 ATOM 1866 C CD . PRO 262 262 ? A 41.335 -15.905 -42.886 1.000 1 A 73.840 1 ATOM 1867 N N . ALA 263 263 ? A 40.199 -13.249 -40.517 1.000 1 A 76.060 1 ATOM 1868 C CA . ALA 263 263 ? A 39.933 -11.965 -39.876 1.000 1 A 76.060 1 ATOM 1869 C C . ALA 263 263 ? A 38.484 -11.481 -40.083 1.000 1 A 76.060 1 ATOM 1870 C CB . ALA 263 263 ? A 40.950 -10.943 -40.398 1.000 1 A 76.060 1 ATOM 1871 O O . ALA 263 263 ? A 37.828 -11.128 -39.112 1.000 1 A 76.060 1 ATOM 1872 N N . ASP 264 264 ? A 37.953 -11.518 -41.306 1.000 1 A 77.770 1 ATOM 1873 C CA . ASP 264 264 ? A 36.570 -11.115 -41.592 1.000 1 A 77.770 1 ATOM 1874 C C . ASP 264 264 ? A 35.550 -12.062 -40.929 1.000 1 A 77.770 1 ATOM 1875 C CB . ASP 264 264 ? A 36.345 -11.051 -43.110 1.000 1 A 77.770 1 ATOM 1876 O O . ASP 264 264 ? A 34.516 -11.591 -40.449 1.000 1 A 77.770 1 ATOM 1877 C CG . ASP 264 264 ? A 36.908 -9.823 -43.824 1.000 1 A 77.770 1 ATOM 1878 O OD1 . ASP 264 264 ? A 37.216 -8.821 -43.143 1.000 1 A 77.770 1 ATOM 1879 O OD2 . ASP 264 264 ? A 37.024 -9.905 -45.068 1.000 1 A 77.770 1 ATOM 1880 N N . LEU 265 265 ? A 35.860 -13.366 -40.811 1.000 1 A 81.440 1 ATOM 1881 C CA . LEU 265 265 ? A 35.075 -14.301 -39.983 1.000 1 A 81.440 1 ATOM 1882 C C . LEU 265 265 ? A 35.072 -13.866 -38.514 1.000 1 A 81.440 1 ATOM 1883 C CB . LEU 265 265 ? A 35.598 -15.752 -40.081 1.000 1 A 81.440 1 ATOM 1884 O O . LEU 265 265 ? A 34.011 -13.815 -37.901 1.000 1 A 81.440 1 ATOM 1885 C CG . LEU 265 265 ? A 34.865 -16.631 -41.105 1.000 1 A 81.440 1 ATOM 1886 C CD1 . LEU 265 265 ? A 35.184 -16.197 -42.524 1.000 1 A 81.440 1 ATOM 1887 C CD2 . LEU 265 265 ? A 35.278 -18.095 -40.953 1.000 1 A 81.440 1 ATOM 1888 N N . TRP 266 266 ? A 36.228 -13.504 -37.946 1.000 1 A 83.990 1 ATOM 1889 C CA . TRP 266 266 ? A 36.311 -13.059 -36.549 1.000 1 A 83.990 1 ATOM 1890 C C . TRP 266 266 ? A 35.564 -11.749 -36.309 1.000 1 A 83.990 1 ATOM 1891 C CB . TRP 266 266 ? A 37.772 -12.944 -36.107 1.000 1 A 83.990 1 ATOM 1892 O O . TRP 266 266 ? A 34.875 -11.625 -35.299 1.000 1 A 83.990 1 ATOM 1893 C CG . TRP 266 266 ? A 38.560 -14.218 -36.022 1.000 1 A 83.990 1 ATOM 1894 C CD1 . TRP 266 266 ? A 39.879 -14.266 -35.729 1.000 1 A 83.990 1 ATOM 1895 C CD2 . TRP 266 266 ? A 38.140 -15.613 -36.214 1.000 1 A 83.990 1 ATOM 1896 C CE2 . TRP 266 266 ? A 39.289 -16.444 -36.041 1.000 1 A 83.990 1 ATOM 1897 C CE3 . TRP 266 266 ? A 36.924 -16.284 -36.496 1.000 1 A 83.990 1 ATOM 1898 N NE1 . TRP 266 266 ? A 40.312 -15.575 -35.732 1.000 1 A 83.990 1 ATOM 1899 C CH2 . TRP 266 266 ? A 38.023 -18.460 -36.480 1.000 1 A 83.990 1 ATOM 1900 C CZ2 . TRP 266 266 ? A 39.245 -17.840 -36.172 1.000 1 A 83.990 1 ATOM 1901 C CZ3 . TRP 266 266 ? A 36.868 -17.680 -36.635 1.000 1 A 83.990 1 ATOM 1902 N N . LEU 267 267 ? A 35.629 -10.790 -37.239 1.000 1 A 84.440 1 ATOM 1903 C CA . LEU 267 267 ? A 34.820 -9.569 -37.160 1.000 1 A 84.440 1 ATOM 1904 C C . LEU 267 267 ? A 33.316 -9.875 -37.263 1.000 1 A 84.440 1 ATOM 1905 C CB . LEU 267 267 ? A 35.232 -8.574 -38.262 1.000 1 A 84.440 1 ATOM 1906 O O . LEU 267 267 ? A 32.499 -9.243 -36.583 1.000 1 A 84.440 1 ATOM 1907 C CG . LEU 267 267 ? A 36.439 -7.680 -37.902 1.000 1 A 84.440 1 ATOM 1908 C CD1 . LEU 267 267 ? A 37.764 -8.190 -38.460 1.000 1 A 84.440 1 ATOM 1909 C CD2 . LEU 267 267 ? A 36.230 -6.271 -38.460 1.000 1 A 84.440 1 ATOM 1910 N N . GLN 268 268 ? A 32.923 -10.836 -38.102 1.000 1 A 89.000 1 ATOM 1911 C CA . GLN 268 268 ? A 31.535 -11.282 -38.207 1.000 1 A 89.000 1 ATOM 1912 C C . GLN 268 268 ? A 31.064 -11.970 -36.920 1.000 1 A 89.000 1 ATOM 1913 C CB . GLN 268 268 ? A 31.377 -12.183 -39.437 1.000 1 A 89.000 1 ATOM 1914 O O . GLN 268 268 ? A 29.961 -11.665 -36.452 1.000 1 A 89.000 1 ATOM 1915 C CG . GLN 268 268 ? A 29.919 -12.618 -39.643 1.000 1 A 89.000 1 ATOM 1916 C CD . GLN 268 268 ? A 29.703 -13.383 -40.944 1.000 1 A 89.000 1 ATOM 1917 N NE2 . GLN 268 268 ? A 28.489 -13.792 -41.237 1.000 1 A 89.000 1 ATOM 1918 O OE1 . GLN 268 268 ? A 30.585 -13.608 -41.747 1.000 1 A 89.000 1 ATOM 1919 N N . ASP 269 269 ? A 31.901 -12.819 -36.328 1.000 1 A 92.210 1 ATOM 1920 C CA . ASP 269 269 ? A 31.657 -13.470 -35.044 1.000 1 A 92.210 1 ATOM 1921 C C . ASP 269 269 ? A 31.551 -12.435 -33.925 1.000 1 A 92.210 1 ATOM 1922 C CB . ASP 269 269 ? A 32.767 -14.490 -34.736 1.000 1 A 92.210 1 ATOM 1923 O O . ASP 269 269 ? A 30.613 -12.478 -33.135 1.000 1 A 92.210 1 ATOM 1924 C CG . ASP 269 269 ? A 32.623 -15.815 -35.494 1.000 1 A 92.210 1 ATOM 1925 O OD1 . ASP 269 269 ? A 31.608 -15.983 -36.210 1.000 1 A 92.210 1 ATOM 1926 O OD2 . ASP 269 269 ? A 33.502 -16.677 -35.283 1.000 1 A 92.210 1 ATOM 1927 N N . GLU 270 270 ? A 32.419 -11.423 -33.889 1.000 1 A 94.910 1 ATOM 1928 C CA . GLU 270 270 ? A 32.339 -10.338 -32.909 1.000 1 A 94.910 1 ATOM 1929 C C . GLU 270 270 ? A 31.028 -9.543 -33.052 1.000 1 A 94.910 1 ATOM 1930 C CB . GLU 270 270 ? A 33.563 -9.424 -33.062 1.000 1 A 94.910 1 ATOM 1931 O O . GLU 270 270 ? A 30.344 -9.229 -32.065 1.000 1 A 94.910 1 ATOM 1932 C CG . GLU 270 270 ? A 33.695 -8.501 -31.844 1.000 1 A 94.910 1 ATOM 1933 C CD . GLU 270 270 ? A 34.824 -7.468 -31.954 1.000 1 A 94.910 1 ATOM 1934 O OE1 . GLU 270 270 ? A 34.865 -6.619 -31.032 1.000 1 A 94.910 1 ATOM 1935 O OE2 . GLU 270 270 ? A 35.572 -7.481 -32.953 1.000 1 A 94.910 1 ATOM 1936 N N . ARG 271 271 ? A 30.617 -9.268 -34.298 1.000 1 A 94.850 1 ATOM 1937 C CA . ARG 271 271 ? A 29.339 -8.617 -34.604 1.000 1 A 94.850 1 ATOM 1938 C C . ARG 271 271 ? A 28.151 -9.482 -34.177 1.000 1 A 94.850 1 ATOM 1939 C CB . ARG 271 271 ? A 29.301 -8.265 -36.099 1.000 1 A 94.850 1 ATOM 1940 O O . ARG 271 271 ? A 27.177 -8.939 -33.646 1.000 1 A 94.850 1 ATOM 1941 C CG . ARG 271 271 ? A 28.128 -7.339 -36.448 1.000 1 A 94.850 1 ATOM 1942 C CD . ARG 271 271 ? A 28.078 -7.080 -37.959 1.000 1 A 94.850 1 ATOM 1943 N NE . ARG 271 271 ? A 26.935 -6.216 -38.335 1.000 1 A 94.850 1 ATOM 1944 N NH1 . ARG 271 271 ? A 26.816 -6.818 -40.551 1.000 1 A 94.850 1 ATOM 1945 N NH2 . ARG 271 271 ? A 25.376 -5.320 -39.746 1.000 1 A 94.850 1 ATOM 1946 C CZ . ARG 271 271 ? A 26.387 -6.119 -39.538 1.000 1 A 94.850 1 ATOM 1947 N N . GLU 272 272 ? A 28.209 -10.796 -34.386 1.000 1 A 95.610 1 ATOM 1948 C CA . GLU 272 272 ? A 27.173 -11.739 -33.955 1.000 1 A 95.610 1 ATOM 1949 C C . GLU 272 272 ? A 27.117 -11.859 -32.431 1.000 1 A 95.610 1 ATOM 1950 C CB . GLU 272 272 ? A 27.363 -13.105 -34.641 1.000 1 A 95.610 1 ATOM 1951 O O . GLU 272 272 ? A 26.046 -11.695 -31.849 1.000 1 A 95.610 1 ATOM 1952 C CG . GLU 272 272 ? A 26.261 -14.129 -34.295 1.000 1 A 95.610 1 ATOM 1953 C CD . GLU 272 272 ? A 24.835 -13.620 -34.569 1.000 1 A 95.610 1 ATOM 1954 O OE1 . GLU 272 272 ? A 23.899 -13.973 -33.819 1.000 1 A 95.610 1 ATOM 1955 O OE2 . GLU 272 272 ? A 24.657 -12.765 -35.471 1.000 1 A 95.610 1 ATOM 1956 N N . VAL 273 273 ? A 28.259 -11.995 -31.756 1.000 1 A 96.200 1 ATOM 1957 C CA . VAL 273 273 ? A 28.363 -12.001 -30.290 1.000 1 A 96.200 1 ATOM 1958 C C . VAL 273 273 ? A 27.751 -10.729 -29.701 1.000 1 A 96.200 1 ATOM 1959 C CB . VAL 273 273 ? A 29.836 -12.170 -29.861 1.000 1 A 96.200 1 ATOM 1960 O O . VAL 273 273 ? A 26.986 -10.791 -28.736 1.000 1 A 96.200 1 ATOM 1961 C CG1 . VAL 273 273 ? A 30.045 -11.916 -28.359 1.000 1 A 96.200 1 ATOM 1962 C CG2 . VAL 273 273 ? A 30.326 -13.595 -30.142 1.000 1 A 96.200 1 ATOM 1963 N N . LYS 274 274 ? A 27.997 -9.558 -30.301 1.000 1 A 96.740 1 ATOM 1964 C CA . LYS 274 274 ? A 27.370 -8.297 -29.873 1.000 1 A 96.740 1 ATOM 1965 C C . LYS 274 274 ? A 25.852 -8.300 -30.066 1.000 1 A 96.740 1 ATOM 1966 C CB . LYS 274 274 ? A 28.040 -7.135 -30.613 1.000 1 A 96.740 1 ATOM 1967 O O . LYS 274 274 ? A 25.132 -7.801 -29.195 1.000 1 A 96.740 1 ATOM 1968 C CG . LYS 274 274 ? A 27.597 -5.759 -30.087 1.000 1 A 96.740 1 ATOM 1969 C CD . LYS 274 274 ? A 28.485 -4.671 -30.705 1.000 1 A 96.740 1 ATOM 1970 C CE . LYS 274 274 ? A 28.217 -3.285 -30.107 1.000 1 A 96.740 1 ATOM 1971 N NZ . LYS 274 274 ? A 29.274 -2.322 -30.522 1.000 1 A 96.740 1 ATOM 1972 N N . ARG 275 275 ? A 25.346 -8.856 -31.175 1.000 1 A 96.220 1 ATOM 1973 C CA . ARG 275 275 ? A 23.898 -9.037 -31.386 1.000 1 A 96.220 1 ATOM 1974 C C . ARG 275 275 ? A 23.300 -9.952 -30.320 1.000 1 A 96.220 1 ATOM 1975 C CB . ARG 275 275 ? A 23.593 -9.586 -32.791 1.000 1 A 96.220 1 ATOM 1976 O O . ARG 275 275 ? A 22.278 -9.591 -29.741 1.000 1 A 96.220 1 ATOM 1977 C CG . ARG 275 275 ? A 23.727 -8.523 -33.890 1.000 1 A 96.220 1 ATOM 1978 C CD . ARG 275 275 ? A 23.237 -9.058 -35.244 1.000 1 A 96.220 1 ATOM 1979 N NE . ARG 275 275 ? A 24.138 -10.080 -35.807 1.000 1 A 96.220 1 ATOM 1980 N NH1 . ARG 275 275 ? A 25.173 -8.853 -37.449 1.000 1 A 96.220 1 ATOM 1981 N NH2 . ARG 275 275 ? A 25.760 -10.969 -37.109 1.000 1 A 96.220 1 ATOM 1982 C CZ . ARG 275 275 ? A 25.023 -9.956 -36.777 1.000 1 A 96.220 1 ATOM 1983 N N . GLN 276 276 ? A 23.951 -11.068 -30.007 1.000 1 A 97.600 1 ATOM 1984 C CA . GLN 276 276 ? A 23.500 -12.002 -28.974 1.000 1 A 97.600 1 ATOM 1985 C C . GLN 276 276 ? A 23.492 -11.360 -27.582 1.000 1 A 97.600 1 ATOM 1986 C CB . GLN 276 276 ? A 24.358 -13.276 -29.013 1.000 1 A 97.600 1 ATOM 1987 O O . GLN 276 276 ? A 22.483 -11.440 -26.885 1.000 1 A 97.600 1 ATOM 1988 C CG . GLN 276 276 ? A 24.164 -14.077 -30.315 1.000 1 A 97.600 1 ATOM 1989 C CD . GLN 276 276 ? A 22.736 -14.571 -30.530 1.000 1 A 97.600 1 ATOM 1990 N NE2 . GLN 276 276 ? A 22.320 -14.799 -31.754 1.000 1 A 97.600 1 ATOM 1991 O OE1 . GLN 276 276 ? A 21.944 -14.722 -29.616 1.000 1 A 97.600 1 ATOM 1992 N N . ARG 277 277 ? A 24.533 -10.597 -27.215 1.000 1 A 98.140 1 ATOM 1993 C CA . ARG 277 277 ? A 24.563 -9.825 -25.956 1.000 1 A 98.140 1 ATOM 1994 C C . ARG 277 277 ? A 23.395 -8.840 -25.847 1.000 1 A 98.140 1 ATOM 1995 C CB . ARG 277 277 ? A 25.900 -9.079 -25.816 1.000 1 A 98.140 1 ATOM 1996 O O . ARG 277 277 ? A 22.784 -8.731 -24.789 1.000 1 A 98.140 1 ATOM 1997 C CG . ARG 277 277 ? A 27.075 -10.009 -25.476 1.000 1 A 98.140 1 ATOM 1998 C CD . ARG 277 277 ? A 28.384 -9.210 -25.445 1.000 1 A 98.140 1 ATOM 1999 N NE . ARG 277 277 ? A 29.554 -10.079 -25.222 1.000 1 A 98.140 1 ATOM 2000 N NH1 . ARG 277 277 ? A 31.193 -8.480 -25.457 1.000 1 A 98.140 1 ATOM 2001 N NH2 . ARG 277 277 ? A 31.771 -10.604 -25.129 1.000 1 A 98.140 1 ATOM 2002 C CZ . ARG 277 277 ? A 30.827 -9.718 -25.268 1.000 1 A 98.140 1 ATOM 2003 N N . ARG 278 278 ? A 23.041 -8.143 -26.935 1.000 1 A 97.000 1 ATOM 2004 C CA . ARG 278 278 ? A 21.879 -7.230 -26.962 1.000 1 A 97.000 1 ATOM 2005 C C . ARG 278 278 ? A 20.555 -7.975 -26.829 1.000 1 A 97.000 1 ATOM 2006 C CB . ARG 278 278 ? A 21.870 -6.395 -28.246 1.000 1 A 97.000 1 ATOM 2007 O O . ARG 278 278 ? A 19.708 -7.545 -26.054 1.000 1 A 97.000 1 ATOM 2008 C CG . ARG 278 278 ? A 22.941 -5.302 -28.235 1.000 1 A 97.000 1 ATOM 2009 C CD . ARG 278 278 ? A 22.895 -4.557 -29.571 1.000 1 A 97.000 1 ATOM 2010 N NE . ARG 278 278 ? A 23.843 -3.429 -29.601 1.000 1 A 97.000 1 ATOM 2011 N NH1 . ARG 278 278 ? A 23.551 -2.881 -31.814 1.000 1 A 97.000 1 ATOM 2012 N NH2 . ARG 278 278 ? A 24.898 -1.642 -30.540 1.000 1 A 97.000 1 ATOM 2013 C CZ . ARG 278 278 ? A 24.096 -2.664 -30.649 1.000 1 A 97.000 1 ATOM 2014 N N . LYS 279 279 ? A 20.387 -9.090 -27.548 1.000 1 A 98.300 1 ATOM 2015 C CA . LYS 279 279 ? A 19.196 -9.948 -27.446 1.000 1 A 98.300 1 ATOM 2016 C C . LYS 279 279 ? A 19.028 -10.490 -26.024 1.000 1 A 98.300 1 ATOM 2017 C CB . LYS 279 279 ? A 19.283 -11.099 -28.462 1.000 1 A 98.300 1 ATOM 2018 O O . LYS 279 279 ? A 17.935 -10.413 -25.473 1.000 1 A 98.300 1 ATOM 2019 C CG . LYS 279 279 ? A 19.077 -10.658 -29.922 1.000 1 A 98.300 1 ATOM 2020 C CD . LYS 279 279 ? A 19.291 -11.860 -30.857 1.000 1 A 98.300 1 ATOM 2021 C CE . LYS 279 279 ? A 19.090 -11.500 -32.335 1.000 1 A 98.300 1 ATOM 2022 N NZ . LYS 279 279 ? A 19.336 -12.681 -33.207 1.000 1 A 98.300 1 ATOM 2023 N N . GLN 280 280 ? A 20.109 -10.956 -25.398 1.000 1 A 98.220 1 ATOM 2024 C CA . GLN 280 280 ? A 20.109 -11.419 -24.009 1.000 1 A 98.220 1 ATOM 2025 C C . GLN 280 280 ? A 19.786 -10.285 -23.031 1.000 1 A 98.220 1 ATOM 2026 C CB . GLN 280 280 ? A 21.469 -12.052 -23.690 1.000 1 A 98.220 1 ATOM 2027 O O . GLN 280 280 ? A 18.919 -10.451 -22.179 1.000 1 A 98.220 1 ATOM 2028 C CG . GLN 280 280 ? A 21.506 -12.675 -22.283 1.000 1 A 98.220 1 ATOM 2029 C CD . GLN 280 280 ? A 22.873 -13.251 -21.931 1.000 1 A 98.220 1 ATOM 2030 N NE2 . GLN 280 280 ? A 23.021 -13.837 -20.765 1.000 1 A 98.220 1 ATOM 2031 O OE1 . GLN 280 280 ? A 23.830 -13.175 -22.684 1.000 1 A 98.220 1 ATOM 2032 N N . SER 281 281 ? A 20.428 -9.123 -23.180 1.000 1 A 98.350 1 ATOM 2033 C CA . SER 281 281 ? A 20.179 -7.959 -22.324 1.000 1 A 98.350 1 ATOM 2034 C C . SER 281 281 ? A 18.736 -7.453 -22.440 1.000 1 A 98.350 1 ATOM 2035 C CB . SER 281 281 ? A 21.177 -6.852 -22.668 1.000 1 A 98.350 1 ATOM 2036 O O . SER 281 281 ? A 18.118 -7.165 -21.420 1.000 1 A 98.350 1 ATOM 2037 O OG . SER 281 281 ? A 20.964 -5.710 -21.867 1.000 1 A 98.350 1 ATOM 2038 N N . ASN 282 282 ? A 18.160 -7.411 -23.649 1.000 1 A 98.540 1 ATOM 2039 C CA . ASN 282 282 ? A 16.756 -7.050 -23.870 1.000 1 A 98.540 1 ATOM 2040 C C . ASN 282 282 ? A 15.794 -8.089 -23.271 1.000 1 A 98.540 1 ATOM 2041 C CB . ASN 282 282 ? A 16.526 -6.868 -25.379 1.000 1 A 98.540 1 ATOM 2042 O O . ASN 282 282 ? A 14.831 -7.727 -22.599 1.000 1 A 98.540 1 ATOM 2043 C CG . ASN 282 282 ? A 15.102 -6.439 -25.683 1.000 1 A 98.540 1 ATOM 2044 N ND2 . ASN 282 282 ? A 14.826 -5.156 -25.716 1.000 1 A 98.540 1 ATOM 2045 O OD1 . ASN 282 282 ? A 14.223 -7.253 -25.889 1.000 1 A 98.540 1 ATOM 2046 N N . ARG 283 283 ? A 16.096 -9.383 -23.442 1.000 1 A 98.560 1 ATOM 2047 C CA . ARG 283 283 ? A 15.337 -10.471 -22.812 1.000 1 A 98.560 1 ATOM 2048 C C . ARG 283 283 ? A 15.344 -10.339 -21.289 1.000 1 A 98.560 1 ATOM 2049 C CB . ARG 283 283 ? A 15.916 -11.817 -23.281 1.000 1 A 98.560 1 ATOM 2050 O O . ARG 283 283 ? A 14.310 -10.503 -20.642 1.000 1 A 98.560 1 ATOM 2051 C CG . ARG 283 283 ? A 15.130 -13.018 -22.740 1.000 1 A 98.560 1 ATOM 2052 C CD . ARG 283 283 ? A 15.738 -14.328 -23.253 1.000 1 A 98.560 1 ATOM 2053 N NE . ARG 283 283 ? A 14.986 -15.499 -22.757 1.000 1 A 98.560 1 ATOM 2054 N NH1 . ARG 283 283 ? A 16.754 -16.939 -22.422 1.000 1 A 98.560 1 ATOM 2055 N NH2 . ARG 283 283 ? A 14.680 -17.627 -22.001 1.000 1 A 98.560 1 ATOM 2056 C CZ . ARG 283 283 ? A 15.477 -16.675 -22.396 1.000 1 A 98.560 1 ATOM 2057 N N . GLU 284 284 ? A 16.498 -10.031 -20.711 1.000 1 A 98.460 1 ATOM 2058 C CA . GLU 284 284 ? A 16.656 -9.897 -19.268 1.000 1 A 98.460 1 ATOM 2059 C C . GLU 284 284 ? A 16.002 -8.620 -18.726 1.000 1 A 98.460 1 ATOM 2060 C CB . GLU 284 284 ? A 18.147 -9.970 -18.928 1.000 1 A 98.460 1 ATOM 2061 O O . GLU 284 284 ? A 15.336 -8.673 -17.691 1.000 1 A 98.460 1 ATOM 2062 C CG . GLU 284 284 ? A 18.360 -10.185 -17.426 1.000 1 A 98.460 1 ATOM 2063 C CD . GLU 284 284 ? A 19.840 -10.301 -17.046 1.000 1 A 98.460 1 ATOM 2064 O OE1 . GLU 284 284 ? A 20.100 -10.434 -15.829 1.000 1 A 98.460 1 ATOM 2065 O OE2 . GLU 284 284 ? A 20.707 -10.135 -17.925 1.000 1 A 98.460 1 ATOM 2066 N N . SER 285 285 ? A 16.123 -7.485 -19.423 1.000 1 A 98.290 1 ATOM 2067 C CA . SER 285 285 ? A 15.484 -6.232 -19.010 1.000 1 A 98.290 1 ATOM 2068 C C . SER 285 285 ? A 13.960 -6.309 -19.110 1.000 1 A 98.290 1 ATOM 2069 C CB . SER 285 285 ? A 16.037 -5.036 -19.792 1.000 1 A 98.290 1 ATOM 2070 O O . SER 285 285 ? A 13.277 -5.861 -18.188 1.000 1 A 98.290 1 ATOM 2071 O OG . SER 285 285 ? A 15.671 -5.086 -21.153 1.000 1 A 98.290 1 ATOM 2072 N N . ALA 286 286 ? A 13.418 -6.962 -20.144 1.000 1 A 98.470 1 ATOM 2073 C CA . ALA 286 286 ? A 11.988 -7.233 -20.265 1.000 1 A 98.470 1 ATOM 2074 C C . ALA 286 286 ? A 11.484 -8.144 -19.132 1.000 1 A 98.470 1 ATOM 2075 C CB . ALA 286 286 ? A 11.714 -7.842 -21.644 1.000 1 A 98.470 1 ATOM 2076 O O . ALA 286 286 ? A 10.474 -7.831 -18.500 1.000 1 A 98.470 1 ATOM 2077 N N . ARG 287 287 ? A 12.206 -9.232 -18.812 1.000 1 A 98.660 1 ATOM 2078 C CA . ARG 287 287 ? A 11.861 -10.111 -17.679 1.000 1 A 98.660 1 ATOM 2079 C C . ARG 287 287 ? A 11.897 -9.356 -16.349 1.000 1 A 98.660 1 ATOM 2080 C CB . ARG 287 287 ? A 12.775 -11.347 -17.656 1.000 1 A 98.660 1 ATOM 2081 O O . ARG 287 287 ? A 10.953 -9.465 -15.574 1.000 1 A 98.660 1 ATOM 2082 C CG . ARG 287 287 ? A 12.389 -12.321 -16.528 1.000 1 A 98.660 1 ATOM 2083 C CD . ARG 287 287 ? A 13.321 -13.537 -16.487 1.000 1 A 98.660 1 ATOM 2084 N NE . ARG 287 287 ? A 13.021 -14.396 -15.321 1.000 1 A 98.660 1 ATOM 2085 N NH1 . ARG 287 287 ? A 15.137 -14.561 -14.412 1.000 1 A 98.660 1 ATOM 2086 N NH2 . ARG 287 287 ? A 13.427 -15.581 -13.418 1.000 1 A 98.660 1 ATOM 2087 C CZ . ARG 287 287 ? A 13.861 -14.838 -14.396 1.000 1 A 98.660 1 ATOM 2088 N N . ARG 288 288 ? A 12.947 -8.567 -16.088 1.000 1 A 98.610 1 ATOM 2089 C CA . ARG 288 288 ? A 13.044 -7.736 -14.874 1.000 1 A 98.610 1 ATOM 2090 C C . ARG 288 288 ? A 11.918 -6.711 -14.793 1.000 1 A 98.610 1 ATOM 2091 C CB . ARG 288 288 ? A 14.395 -7.010 -14.800 1.000 1 A 98.610 1 ATOM 2092 O O . ARG 288 288 ? A 11.372 -6.518 -13.715 1.000 1 A 98.610 1 ATOM 2093 C CG . ARG 288 288 ? A 15.544 -7.911 -14.329 1.000 1 A 98.610 1 ATOM 2094 C CD . ARG 288 288 ? A 16.772 -7.044 -14.013 1.000 1 A 98.610 1 ATOM 2095 N NE . ARG 288 288 ? A 17.886 -7.844 -13.469 1.000 1 A 98.610 1 ATOM 2096 N NH1 . ARG 288 288 ? A 19.351 -7.704 -15.249 1.000 1 A 98.610 1 ATOM 2097 N NH2 . ARG 288 288 ? A 19.816 -9.040 -13.562 1.000 1 A 98.610 1 ATOM 2098 C CZ . ARG 288 288 ? A 19.007 -8.174 -14.086 1.000 1 A 98.610 1 ATOM 2099 N N . SER 289 289 ? A 11.564 -6.073 -15.909 1.000 1 A 98.620 1 ATOM 2100 C CA . SER 289 289 ? A 10.453 -5.119 -15.952 1.000 1 A 98.620 1 ATOM 2101 C C . SER 289 289 ? A 9.123 -5.791 -15.600 1.000 1 A 98.620 1 ATOM 2102 C CB . SER 289 289 ? A 10.385 -4.446 -17.325 1.000 1 A 98.620 1 ATOM 2103 O O . SER 289 289 ? A 8.395 -5.259 -14.768 1.000 1 A 98.620 1 ATOM 2104 O OG . SER 289 289 ? A 9.301 -3.541 -17.382 1.000 1 A 98.620 1 ATOM 2105 N N . ARG 290 290 ? A 8.844 -6.983 -16.151 1.000 1 A 98.640 1 ATOM 2106 C CA . ARG 290 290 ? A 7.651 -7.773 -15.795 1.000 1 A 98.640 1 ATOM 2107 C C . ARG 290 290 ? A 7.634 -8.159 -14.313 1.000 1 A 98.640 1 ATOM 2108 C CB . ARG 290 290 ? A 7.534 -9.022 -16.684 1.000 1 A 98.640 1 ATOM 2109 O O . ARG 290 290 ? A 6.615 -7.968 -13.667 1.000 1 A 98.640 1 ATOM 2110 C CG . ARG 290 290 ? A 7.168 -8.689 -18.138 1.000 1 A 98.640 1 ATOM 2111 C CD . ARG 290 290 ? A 7.059 -9.978 -18.963 1.000 1 A 98.640 1 ATOM 2112 N NE . ARG 290 290 ? A 6.807 -9.698 -20.392 1.000 1 A 98.640 1 ATOM 2113 N NH1 . ARG 290 290 ? A 6.042 -11.786 -20.986 1.000 1 A 98.640 1 ATOM 2114 N NH2 . ARG 290 290 ? A 6.167 -10.183 -22.528 1.000 1 A 98.640 1 ATOM 2115 C CZ . ARG 290 290 ? A 6.344 -10.554 -21.290 1.000 1 A 98.640 1 ATOM 2116 N N . LEU 291 291 ? A 8.760 -8.632 -13.770 1.000 1 A 98.600 1 ATOM 2117 C CA . LEU 291 291 ? A 8.863 -9.019 -12.356 1.000 1 A 98.600 1 ATOM 2118 C C . LEU 291 291 ? A 8.671 -7.842 -11.394 1.000 1 A 98.600 1 ATOM 2119 C CB . LEU 291 291 ? A 10.220 -9.691 -12.088 1.000 1 A 98.600 1 ATOM 2120 O O . LEU 291 291 ? A 8.013 -8.008 -10.377 1.000 1 A 98.600 1 ATOM 2121 C CG . LEU 291 291 ? A 10.335 -11.131 -12.614 1.000 1 A 98.600 1 ATOM 2122 C CD1 . LEU 291 291 ? A 11.780 -11.614 -12.447 1.000 1 A 98.600 1 ATOM 2123 C CD2 . LEU 291 291 ? A 9.421 -12.103 -11.867 1.000 1 A 98.600 1 ATOM 2124 N N . ARG 292 292 ? A 9.210 -6.655 -11.707 1.000 1 A 98.700 1 ATOM 2125 C CA . ARG 292 292 ? A 8.971 -5.454 -10.886 1.000 1 A 98.700 1 ATOM 2126 C C . ARG 292 292 ? A 7.491 -5.084 -10.855 1.000 1 A 98.700 1 ATOM 2127 C CB . ARG 292 292 ? A 9.786 -4.258 -11.379 1.000 1 A 98.700 1 ATOM 2128 O O . ARG 292 292 ? A 6.953 -4.903 -9.776 1.000 1 A 98.700 1 ATOM 2129 C CG . ARG 292 292 ? A 11.276 -4.390 -11.053 1.000 1 A 98.700 1 ATOM 2130 C CD . ARG 292 292 ? A 11.983 -3.135 -11.565 1.000 1 A 98.700 1 ATOM 2131 N NE . ARG 292 292 ? A 13.440 -3.336 -11.686 1.000 1 A 98.700 1 ATOM 2132 N NH1 . ARG 292 292 ? A 13.745 -2.032 -13.550 1.000 1 A 98.700 1 ATOM 2133 N NH2 . ARG 292 292 ? A 15.500 -3.044 -12.611 1.000 1 A 98.700 1 ATOM 2134 C CZ . ARG 292 292 ? A 14.217 -2.811 -12.615 1.000 1 A 98.700 1 ATOM 2135 N N . LYS 293 293 ? A 6.829 -5.062 -12.018 1.000 1 A 98.720 1 ATOM 2136 C CA . LYS 293 293 ? A 5.385 -4.784 -12.095 1.000 1 A 98.720 1 ATOM 2137 C C . LYS 293 293 ? A 4.557 -5.812 -11.324 1.000 1 A 98.720 1 ATOM 2138 C CB . LYS 293 293 ? A 4.919 -4.727 -13.553 1.000 1 A 98.720 1 ATOM 2139 O O . LYS 293 293 ? A 3.631 -5.434 -10.624 1.000 1 A 98.720 1 ATOM 2140 C CG . LYS 293 293 ? A 5.416 -3.465 -14.267 1.000 1 A 98.720 1 ATOM 2141 C CD . LYS 293 293 ? A 4.789 -3.380 -15.662 1.000 1 A 98.720 1 ATOM 2142 C CE . LYS 293 293 ? A 5.182 -2.060 -16.327 1.000 1 A 98.720 1 ATOM 2143 N NZ . LYS 293 293 ? A 4.389 -1.822 -17.558 1.000 1 A 98.720 1 ATOM 2144 N N . GLN 294 294 ? A 4.902 -7.097 -11.427 1.000 1 A 98.780 1 ATOM 2145 C CA . GLN 294 294 ? A 4.244 -8.144 -10.646 1.000 1 A 98.780 1 ATOM 2146 C C . GLN 294 294 ? A 4.418 -7.918 -9.136 1.000 1 A 98.780 1 ATOM 2147 C CB . GLN 294 294 ? A 4.770 -9.515 -11.096 1.000 1 A 98.780 1 ATOM 2148 O O . GLN 294 294 ? A 3.434 -7.965 -8.409 1.000 1 A 98.780 1 ATOM 2149 C CG . GLN 294 294 ? A 4.120 -10.637 -10.279 1.000 1 A 98.780 1 ATOM 2150 C CD . GLN 294 294 ? A 4.462 -12.041 -10.754 1.000 1 A 98.780 1 ATOM 2151 N NE2 . GLN 294 294 ? A 4.028 -13.024 -10.002 1.000 1 A 98.780 1 ATOM 2152 O OE1 . GLN 294 294 ? A 5.111 -12.269 -11.772 1.000 1 A 98.780 1 ATOM 2153 N N . ALA 295 295 ? A 5.637 -7.616 -8.680 1.000 1 A 98.670 1 ATOM 2154 C CA . ALA 295 295 ? A 5.909 -7.339 -7.271 1.000 1 A 98.670 1 ATOM 2155 C C . ALA 295 295 ? A 5.154 -6.100 -6.755 1.000 1 A 98.670 1 ATOM 2156 C CB . ALA 295 295 ? A 7.423 -7.189 -7.088 1.000 1 A 98.670 1 ATOM 2157 O O . ALA 295 295 ? A 4.636 -6.129 -5.645 1.000 1 A 98.670 1 ATOM 2158 N N . GLU 296 296 ? A 5.039 -5.039 -7.560 1.000 1 A 98.600 1 ATOM 2159 C CA . GLU 296 296 ? A 4.236 -3.854 -7.222 1.000 1 A 98.600 1 ATOM 2160 C C . GLU 296 296 ? A 2.744 -4.204 -7.078 1.000 1 A 98.600 1 ATOM 2161 C CB . GLU 296 296 ? A 4.433 -2.767 -8.296 1.000 1 A 98.600 1 ATOM 2162 O O . GLU 296 296 ? A 2.098 -3.761 -6.131 1.000 1 A 98.600 1 ATOM 2163 C CG . GLU 296 296 ? A 5.811 -2.080 -8.231 1.000 1 A 98.600 1 ATOM 2164 C CD . GLU 296 296 ? A 6.127 -1.217 -9.471 1.000 1 A 98.600 1 ATOM 2165 O OE1 . GLU 296 296 ? A 7.336 -1.011 -9.752 1.000 1 A 98.600 1 ATOM 2166 O OE2 . GLU 296 296 ? A 5.189 -0.803 -10.190 1.000 1 A 98.600 1 ATOM 2167 N N . CYS 297 297 ? A 2.191 -5.039 -7.965 1.000 1 A 98.660 1 ATOM 2168 C CA . CYS 297 297 ? A 0.806 -5.506 -7.850 1.000 1 A 98.660 1 ATOM 2169 C C . CYS 297 297 ? A 0.582 -6.384 -6.608 1.000 1 A 98.660 1 ATOM 2170 C CB . CYS 297 297 ? A 0.409 -6.271 -9.121 1.000 1 A 98.660 1 ATOM 2171 O O . CYS 297 297 ? A -0.427 -6.223 -5.925 1.000 1 A 98.660 1 ATOM 2172 S SG . CYS 297 297 ? A 0.315 -5.159 -10.556 1.000 1 A 98.660 1 ATOM 2173 N N . GLU 298 298 ? A 1.514 -7.289 -6.300 1.000 1 A 98.700 1 ATOM 2174 C CA . GLU 298 298 ? A 1.460 -8.131 -5.097 1.000 1 A 98.700 1 ATOM 2175 C C . GLU 298 298 ? A 1.574 -7.289 -3.816 1.000 1 A 98.700 1 ATOM 2176 C CB . GLU 298 298 ? A 2.573 -9.195 -5.155 1.000 1 A 98.700 1 ATOM 2177 O O . GLU 298 298 ? A 0.827 -7.512 -2.864 1.000 1 A 98.700 1 ATOM 2178 C CG . GLU 298 298 ? A 2.290 -10.306 -6.187 1.000 1 A 98.700 1 ATOM 2179 C CD . GLU 298 298 ? A 3.474 -11.268 -6.421 1.000 1 A 98.700 1 ATOM 2180 O OE1 . GLU 298 298 ? A 3.397 -12.066 -7.393 1.000 1 A 98.700 1 ATOM 2181 O OE2 . GLU 298 298 ? A 4.473 -11.210 -5.667 1.000 1 A 98.700 1 ATOM 2182 N N . GLU 299 299 ? A 2.449 -6.279 -3.796 1.000 1 A 98.670 1 ATOM 2183 C CA . GLU 299 299 ? A 2.584 -5.350 -2.672 1.000 1 A 98.670 1 ATOM 2184 C C . GLU 299 299 ? A 1.311 -4.520 -2.464 1.000 1 A 98.670 1 ATOM 2185 C CB . GLU 299 299 ? A 3.805 -4.441 -2.893 1.000 1 A 98.670 1 ATOM 2186 O O . GLU 299 299 ? A 0.847 -4.377 -1.331 1.000 1 A 98.670 1 ATOM 2187 C CG . GLU 299 299 ? A 4.021 -3.507 -1.694 1.000 1 A 98.670 1 ATOM 2188 C CD . GLU 299 299 ? A 5.233 -2.577 -1.813 1.000 1 A 98.670 1 ATOM 2189 O OE1 . GLU 299 299 ? A 5.436 -1.826 -0.828 1.000 1 A 98.670 1 ATOM 2190 O OE2 . GLU 299 299 ? A 5.913 -2.546 -2.859 1.000 1 A 98.670 1 ATOM 2191 N N . LEU 300 300 ? A 0.719 -3.990 -3.539 1.000 1 A 98.820 1 ATOM 2192 C CA . LEU 300 300 ? A -0.551 -3.266 -3.458 1.000 1 A 98.820 1 ATOM 2193 C C . LEU 300 300 ? A -1.684 -4.171 -2.959 1.000 1 A 98.820 1 ATOM 2194 C CB . LEU 300 300 ? A -0.891 -2.643 -4.823 1.000 1 A 98.820 1 ATOM 2195 O O . LEU 300 300 ? A -2.433 -3.753 -2.078 1.000 1 A 98.820 1 ATOM 2196 C CG . LEU 300 300 ? A -0.017 -1.436 -5.214 1.000 1 A 98.820 1 ATOM 2197 C CD1 . LEU 300 300 ? A -0.352 -1.015 -6.645 1.000 1 A 98.820 1 ATOM 2198 C CD2 . LEU 300 300 ? A -0.235 -0.229 -4.296 1.000 1 A 98.820 1 ATOM 2199 N N . GLY 301 301 ? A -1.770 -5.414 -3.446 1.000 1 A 98.780 1 ATOM 2200 C CA . GLY 301 301 ? A -2.725 -6.408 -2.948 1.000 1 A 98.780 1 ATOM 2201 C C . GLY 301 301 ? A -2.552 -6.682 -1.450 1.000 1 A 98.780 1 ATOM 2202 O O . GLY 301 301 ? A -3.504 -6.564 -0.684 1.000 1 A 98.780 1 ATOM 2203 N N . ALA 302 302 ? A -1.317 -6.922 -1.000 1.000 1 A 98.720 1 ATOM 2204 C CA . ALA 302 302 ? A -1.014 -7.141 0.415 1.000 1 A 98.720 1 ATOM 2205 C C . ALA 302 302 ? A -1.356 -5.926 1.299 1.000 1 A 98.720 1 ATOM 2206 C CB . ALA 302 302 ? A 0.470 -7.508 0.537 1.000 1 A 98.720 1 ATOM 2207 O O . ALA 302 302 ? A -1.803 -6.088 2.439 1.000 1 A 98.720 1 ATOM 2208 N N . ARG 303 303 ? A -1.171 -4.698 0.791 1.000 1 A 98.790 1 ATOM 2209 C CA . ARG 303 303 ? A -1.585 -3.469 1.488 1.000 1 A 98.790 1 ATOM 2210 C C . ARG 303 303 ? A -3.105 -3.374 1.612 1.000 1 A 98.790 1 ATOM 2211 C CB . ARG 303 303 ? A -1.033 -2.226 0.778 1.000 1 A 98.790 1 ATOM 2212 O O . ARG 303 303 ? A -3.578 -3.004 2.682 1.000 1 A 98.790 1 ATOM 2213 C CG . ARG 303 303 ? A 0.479 -2.028 0.970 1.000 1 A 98.790 1 ATOM 2214 C CD . ARG 303 303 ? A 0.915 -0.839 0.107 1.000 1 A 98.790 1 ATOM 2215 N NE . ARG 303 303 ? A 2.375 -0.626 0.096 1.000 1 A 98.790 1 ATOM 2216 N NH1 . ARG 303 303 ? A 2.319 1.461 -0.852 1.000 1 A 98.790 1 ATOM 2217 N NH2 . ARG 303 303 ? A 4.278 0.518 -0.430 1.000 1 A 98.790 1 ATOM 2218 C CZ . ARG 303 303 ? A 2.985 0.442 -0.385 1.000 1 A 98.790 1 ATOM 2219 N N . VAL 304 304 ? A -3.863 -3.726 0.571 1.000 1 A 98.850 1 ATOM 2220 C CA . VAL 304 304 ? A -5.337 -3.764 0.623 1.000 1 A 98.850 1 ATOM 2221 C C . VAL 304 304 ? A -5.816 -4.781 1.654 1.000 1 A 98.850 1 ATOM 2222 C CB . VAL 304 304 ? A -5.946 -4.052 -0.764 1.000 1 A 98.850 1 ATOM 2223 O O . VAL 304 304 ? A -6.645 -4.434 2.491 1.000 1 A 98.850 1 ATOM 2224 C CG1 . VAL 304 304 ? A -7.455 -4.327 -0.703 1.000 1 A 98.850 1 ATOM 2225 C CG2 . VAL 304 304 ? A -5.738 -2.846 -1.689 1.000 1 A 98.850 1 ATOM 2226 N N . ASP 305 305 ? A -5.251 -5.988 1.661 1.000 1 A 98.780 1 ATOM 2227 C CA . ASP 305 305 ? A -5.599 -7.022 2.643 1.000 1 A 98.780 1 ATOM 2228 C C . ASP 305 305 ? A -5.280 -6.574 4.076 1.000 1 A 98.780 1 ATOM 2229 C CB . ASP 305 305 ? A -4.840 -8.319 2.326 1.000 1 A 98.780 1 ATOM 2230 O O . ASP 305 305 ? A -6.096 -6.733 4.986 1.000 1 A 98.780 1 ATOM 2231 C CG . ASP 305 305 ? A -5.320 -9.036 1.061 1.000 1 A 98.780 1 ATOM 2232 O OD1 . ASP 305 305 ? A -6.472 -8.787 0.640 1.000 1 A 98.780 1 ATOM 2233 O OD2 . ASP 305 305 ? A -4.539 -9.882 0.572 1.000 1 A 98.780 1 ATOM 2234 N N . THR 306 306 ? A -4.114 -5.950 4.278 1.000 1 A 98.820 1 ATOM 2235 C CA . THR 306 306 ? A -3.710 -5.398 5.581 1.000 1 A 98.820 1 ATOM 2236 C C . THR 306 306 ? A -4.686 -4.318 6.041 1.000 1 A 98.820 1 ATOM 2237 C CB . THR 306 306 ? A -2.282 -4.835 5.529 1.000 1 A 98.820 1 ATOM 2238 O O . THR 306 306 ? A -5.221 -4.401 7.146 1.000 1 A 98.820 1 ATOM 2239 C CG2 . THR 306 306 ? A -1.812 -4.303 6.882 1.000 1 A 98.820 1 ATOM 2240 O OG1 . THR 306 306 ? A -1.379 -5.850 5.148 1.000 1 A 98.820 1 ATOM 2241 N N . LEU 307 307 ? A -4.994 -3.350 5.171 1.000 1 A 98.840 1 ATOM 2242 C CA . LEU 307 307 ? A -5.961 -2.296 5.465 1.000 1 A 98.840 1 ATOM 2243 C C . LEU 307 307 ? A -7.363 -2.865 5.704 1.000 1 A 98.840 1 ATOM 2244 C CB . LEU 307 307 ? A -5.985 -1.274 4.315 1.000 1 A 98.840 1 ATOM 2245 O O . LEU 307 307 ? A -8.080 -2.353 6.558 1.000 1 A 98.840 1 ATOM 2246 C CG . LEU 307 307 ? A -4.747 -0.362 4.239 1.000 1 A 98.840 1 ATOM 2247 C CD1 . LEU 307 307 ? A -4.811 0.462 2.950 1.000 1 A 98.840 1 ATOM 2248 C CD2 . LEU 307 307 ? A -4.668 0.611 5.418 1.000 1 A 98.840 1 ATOM 2249 N N . ALA 308 308 ? A -7.783 -3.916 4.999 1.000 1 A 98.840 1 ATOM 2250 C CA . ALA 308 308 ? A -9.078 -4.556 5.217 1.000 1 A 98.840 1 ATOM 2251 C C . ALA 308 308 ? A -9.168 -5.193 6.614 1.000 1 A 98.840 1 ATOM 2252 C CB . ALA 308 308 ? A -9.321 -5.580 4.102 1.000 1 A 98.840 1 ATOM 2253 O O . ALA 308 308 ? A -10.171 -5.012 7.310 1.000 1 A 98.840 1 ATOM 2254 N N . VAL 309 309 ? A -8.106 -5.879 7.054 1.000 1 A 98.810 1 ATOM 2255 C CA . VAL 309 309 ? A -8.006 -6.449 8.408 1.000 1 A 98.810 1 ATOM 2256 C C . VAL 309 309 ? A -7.991 -5.351 9.472 1.000 1 A 98.810 1 ATOM 2257 C CB . VAL 309 309 ? A -6.767 -7.359 8.529 1.000 1 A 98.810 1 ATOM 2258 O O . VAL 309 309 ? A -8.718 -5.456 10.459 1.000 1 A 98.810 1 ATOM 2259 C CG1 . VAL 309 309 ? A -6.525 -7.834 9.970 1.000 1 A 98.810 1 ATOM 2260 C CG2 . VAL 309 309 ? A -6.934 -8.619 7.669 1.000 1 A 98.810 1 ATOM 2261 N N . GLU 310 310 ? A -7.222 -4.280 9.274 1.000 1 A 98.780 1 ATOM 2262 C CA . GLU 310 310 ? A -7.175 -3.137 10.195 1.000 1 A 98.780 1 ATOM 2263 C C . GLU 310 310 ? A -8.527 -2.418 10.285 1.000 1 A 98.780 1 ATOM 2264 C CB . GLU 310 310 ? A -6.090 -2.149 9.751 1.000 1 A 98.780 1 ATOM 2265 O O . GLU 310 310 ? A -9.011 -2.145 11.380 1.000 1 A 98.780 1 ATOM 2266 C CG . GLU 310 310 ? A -4.670 -2.677 10.007 1.000 1 A 98.780 1 ATOM 2267 C CD . GLU 310 310 ? A -3.573 -1.738 9.477 1.000 1 A 98.780 1 ATOM 2268 O OE1 . GLU 310 310 ? A -2.388 -2.119 9.609 1.000 1 A 98.780 1 ATOM 2269 O OE2 . GLU 310 310 ? A -3.909 -0.646 8.964 1.000 1 A 98.780 1 ATOM 2270 N N . ASN 311 311 ? A -9.196 -2.178 9.154 1.000 1 A 98.760 1 ATOM 2271 C CA . ASN 311 311 ? A -10.538 -1.592 9.133 1.000 1 A 98.760 1 ATOM 2272 C C . ASN 311 311 ? A -11.558 -2.477 9.862 1.000 1 A 98.760 1 ATOM 2273 C CB . ASN 311 311 ? A -10.985 -1.353 7.681 1.000 1 A 98.760 1 ATOM 2274 O O . ASN 311 311 ? A -12.423 -1.961 10.571 1.000 1 A 98.760 1 ATOM 2275 C CG . ASN 311 311 ? A -10.486 -0.032 7.132 1.000 1 A 98.760 1 ATOM 2276 N ND2 . ASN 311 311 ? A -9.546 -0.037 6.225 1.000 1 A 98.760 1 ATOM 2277 O OD1 . ASN 311 311 ? A -10.968 1.023 7.502 1.000 1 A 98.760 1 ATOM 2278 N N . LEU 312 312 ? A -11.474 -3.803 9.711 1.000 1 A 98.800 1 ATOM 2279 C CA . LEU 312 312 ? A -12.314 -4.735 10.462 1.000 1 A 98.800 1 ATOM 2280 C C . LEU 312 312 ? A -12.018 -4.666 11.967 1.000 1 A 98.800 1 ATOM 2281 C CB . LEU 312 312 ? A -12.118 -6.155 9.902 1.000 1 A 98.800 1 ATOM 2282 O O . LEU 312 312 ? A -12.952 -4.619 12.766 1.000 1 A 98.800 1 ATOM 2283 C CG . LEU 312 312 ? A -12.974 -7.227 10.602 1.000 1 A 98.800 1 ATOM 2284 C CD1 . LEU 312 312 ? A -14.472 -7.004 10.384 1.000 1 A 98.800 1 ATOM 2285 C CD2 . LEU 312 312 ? A -12.606 -8.610 10.066 1.000 1 A 98.800 1 ATOM 2286 N N . ALA 313 313 ? A -10.741 -4.622 12.354 1.000 1 A 98.740 1 ATOM 2287 C CA . ALA 313 313 ? A -10.329 -4.489 13.748 1.000 1 A 98.740 1 ATOM 2288 C C . ALA 313 313 ? A -10.861 -3.189 14.373 1.000 1 A 98.740 1 ATOM 2289 C CB . ALA 313 313 ? A -8.802 -4.595 13.833 1.000 1 A 98.740 1 ATOM 2290 O O . ALA 313 313 ? A -11.520 -3.243 15.408 1.000 1 A 98.740 1 ATOM 2291 N N . LEU 314 314 ? A -10.692 -2.048 13.698 1.000 1 A 98.830 1 ATOM 2292 C CA . LEU 314 314 ? A -11.204 -0.751 14.152 1.000 1 A 98.830 1 ATOM 2293 C C . LEU 314 314 ? A -12.734 -0.738 14.278 1.000 1 A 98.830 1 ATOM 2294 C CB . LEU 314 314 ? A -10.749 0.345 13.172 1.000 1 A 98.830 1 ATOM 2295 O O . LEU 314 314 ? A -13.273 -0.197 15.241 1.000 1 A 98.830 1 ATOM 2296 C CG . LEU 314 314 ? A -9.243 0.663 13.212 1.000 1 A 98.830 1 ATOM 2297 C CD1 . LEU 314 314 ? A -8.908 1.627 12.072 1.000 1 A 98.830 1 ATOM 2298 C CD2 . LEU 314 314 ? A -8.825 1.316 14.530 1.000 1 A 98.830 1 ATOM 2299 N N . ARG 315 315 ? A -13.459 -1.360 13.339 1.000 1 A 98.760 1 ATOM 2300 C CA . ARG 315 315 ? A -14.925 -1.494 13.430 1.000 1 A 98.760 1 ATOM 2301 C C . ARG 315 315 ? A -15.351 -2.326 14.638 1.000 1 A 98.760 1 ATOM 2302 C CB . ARG 315 315 ? A -15.481 -2.108 12.141 1.000 1 A 98.760 1 ATOM 2303 O O . ARG 315 315 ? A -16.312 -1.958 15.309 1.000 1 A 98.760 1 ATOM 2304 C CG . ARG 315 315 ? A -15.503 -1.095 10.991 1.000 1 A 98.760 1 ATOM 2305 C CD . ARG 315 315 ? A -15.853 -1.817 9.689 1.000 1 A 98.760 1 ATOM 2306 N NE . ARG 315 315 ? A -15.854 -0.891 8.542 1.000 1 A 98.760 1 ATOM 2307 N NH1 . ARG 315 315 ? A -15.599 -2.469 6.892 1.000 1 A 98.760 1 ATOM 2308 N NH2 . ARG 315 315 ? A -15.700 -0.310 6.345 1.000 1 A 98.760 1 ATOM 2309 C CZ . ARG 315 315 ? A -15.720 -1.227 7.271 1.000 1 A 98.760 1 ATOM 2310 N N . ASN 316 316 ? A -14.633 -3.408 14.932 1.000 1 A 98.730 1 ATOM 2311 C CA . ASN 316 316 ? A -14.892 -4.230 16.113 1.000 1 A 98.730 1 ATOM 2312 C C . ASN 316 316 ? A -14.601 -3.463 17.410 1.000 1 A 98.730 1 ATOM 2313 C CB . ASN 316 316 ? A -14.056 -5.516 16.034 1.000 1 A 98.730 1 ATOM 2314 O O . ASN 316 316 ? A -15.390 -3.537 18.347 1.000 1 A 98.730 1 ATOM 2315 C CG . ASN 316 316 ? A -14.491 -6.457 14.927 1.000 1 A 98.730 1 ATOM 2316 N ND2 . ASN 316 316 ? A -13.623 -7.355 14.525 1.000 1 A 98.730 1 ATOM 2317 O OD1 . ASN 316 316 ? A -15.603 -6.436 14.428 1.000 1 A 98.730 1 ATOM 2318 N N . GLU 317 317 ? A -13.512 -2.693 17.457 1.000 1 A 98.720 1 ATOM 2319 C CA . GLU 317 317 ? A -13.189 -1.834 18.601 1.000 1 A 98.720 1 ATOM 2320 C C . GLU 317 317 ? A -14.266 -0.765 18.826 1.000 1 A 98.720 1 ATOM 2321 C CB . GLU 317 317 ? A -11.820 -1.171 18.398 1.000 1 A 98.720 1 ATOM 2322 O O . GLU 317 317 ? A -14.729 -0.591 19.950 1.000 1 A 98.720 1 ATOM 2323 C CG . GLU 317 317 ? A -10.658 -2.163 18.564 1.000 1 A 98.720 1 ATOM 2324 C CD . GLU 317 317 ? A -9.281 -1.530 18.298 1.000 1 A 98.720 1 ATOM 2325 O OE1 . GLU 317 317 ? A -8.301 -2.308 18.238 1.000 1 A 98.720 1 ATOM 2326 O OE2 . GLU 317 317 ? A -9.203 -0.285 18.184 1.000 1 A 98.720 1 ATOM 2327 N N . LEU 318 318 ? A -14.735 -0.095 17.767 1.000 1 A 98.760 1 ATOM 2328 C CA . LEU 318 318 ? A -15.835 0.871 17.861 1.000 1 A 98.760 1 ATOM 2329 C C . LEU 318 318 ? A -17.137 0.227 18.347 1.000 1 A 98.760 1 ATOM 2330 C CB . LEU 318 318 ? A -16.067 1.536 16.495 1.000 1 A 98.760 1 ATOM 2331 O O . LEU 318 318 ? A -17.839 0.820 19.169 1.000 1 A 98.760 1 ATOM 2332 C CG . LEU 318 318 ? A -15.008 2.577 16.095 1.000 1 A 98.760 1 ATOM 2333 C CD1 . LEU 318 318 ? A -15.301 3.055 14.671 1.000 1 A 98.760 1 ATOM 2334 C CD2 . LEU 318 318 ? A -15.018 3.798 17.019 1.000 1 A 98.760 1 ATOM 2335 N N . ALA 319 319 ? A -17.463 -0.976 17.867 1.000 1 A 98.540 1 ATOM 2336 C CA . ALA 319 319 ? A -18.625 -1.721 18.339 1.000 1 A 98.540 1 ATOM 2337 C C . ALA 319 319 ? A -18.501 -2.043 19.836 1.000 1 A 98.540 1 ATOM 2338 C CB . ALA 319 319 ? A -18.794 -2.983 17.485 1.000 1 A 98.540 1 ATOM 2339 O O . ALA 319 319 ? A -19.425 -1.760 20.598 1.000 1 A 98.540 1 ATOM 2340 N N . TRP 320 320 ? A -17.334 -2.527 20.267 1.000 1 A 98.630 1 ATOM 2341 C CA . TRP 320 320 ? A -17.051 -2.823 21.669 1.000 1 A 98.630 1 ATOM 2342 C C . TRP 320 320 ? A -17.151 -1.579 22.562 1.000 1 A 98.630 1 ATOM 2343 C CB . TRP 320 320 ? A -15.668 -3.472 21.776 1.000 1 A 98.630 1 ATOM 2344 O O . TRP 320 320 ? A -17.852 -1.603 23.570 1.000 1 A 98.630 1 ATOM 2345 C CG . TRP 320 320 ? A -15.316 -3.888 23.166 1.000 1 A 98.630 1 ATOM 2346 C CD1 . TRP 320 320 ? A -15.709 -5.040 23.752 1.000 1 A 98.630 1 ATOM 2347 C CD2 . TRP 320 320 ? A -14.610 -3.131 24.198 1.000 1 A 98.630 1 ATOM 2348 C CE2 . TRP 320 320 ? A -14.618 -3.903 25.399 1.000 1 A 98.630 1 ATOM 2349 C CE3 . TRP 320 320 ? A -13.993 -1.863 24.256 1.000 1 A 98.630 1 ATOM 2350 N NE1 . TRP 320 320 ? A -15.288 -5.060 25.065 1.000 1 A 98.630 1 ATOM 2351 C CH2 . TRP 320 320 ? A -13.454 -2.177 26.623 1.000 1 A 98.630 1 ATOM 2352 C CZ2 . TRP 320 320 ? A -14.055 -3.444 26.597 1.000 1 A 98.630 1 ATOM 2353 C CZ3 . TRP 320 320 ? A -13.420 -1.398 25.456 1.000 1 A 98.630 1 ATOM 2354 N N . PHE 321 321 ? A -16.530 -0.458 22.172 1.000 1 A 98.610 1 ATOM 2355 C CA . PHE 321 321 ? A -16.645 0.802 22.915 1.000 1 A 98.610 1 ATOM 2356 C C . PHE 321 321 ? A -18.087 1.311 22.970 1.000 1 A 98.610 1 ATOM 2357 C CB . PHE 321 321 ? A -15.741 1.879 22.297 1.000 1 A 98.610 1 ATOM 2358 O O . PHE 321 321 ? A -18.516 1.828 23.998 1.000 1 A 98.610 1 ATOM 2359 C CG . PHE 321 321 ? A -14.271 1.760 22.649 1.000 1 A 98.610 1 ATOM 2360 C CD1 . PHE 321 321 ? A -13.865 1.829 23.996 1.000 1 A 98.610 1 ATOM 2361 C CD2 . PHE 321 321 ? A -13.301 1.633 21.638 1.000 1 A 98.610 1 ATOM 2362 C CE1 . PHE 321 321 ? A -12.500 1.759 24.326 1.000 1 A 98.610 1 ATOM 2363 C CE2 . PHE 321 321 ? A -11.939 1.534 21.970 1.000 1 A 98.610 1 ATOM 2364 C CZ . PHE 321 321 ? A -11.538 1.592 23.315 1.000 1 A 98.610 1 ATOM 2365 N N . THR 322 322 ? A -18.860 1.140 21.897 1.000 1 A 98.650 1 ATOM 2366 C CA . THR 322 322 ? A -20.276 1.532 21.870 1.000 1 A 98.650 1 ATOM 2367 C C . THR 322 322 ? A -21.109 0.698 22.847 1.000 1 A 98.650 1 ATOM 2368 C CB . THR 322 322 ? A -20.849 1.404 20.452 1.000 1 A 98.650 1 ATOM 2369 O O . THR 322 322 ? A -21.972 1.241 23.539 1.000 1 A 98.650 1 ATOM 2370 C CG2 . THR 322 322 ? A -22.309 1.849 20.363 1.000 1 A 98.650 1 ATOM 2371 O OG1 . THR 322 322 ? A -20.135 2.221 19.556 1.000 1 A 98.650 1 ATOM 2372 N N . GLU 323 323 ? A -20.873 -0.612 22.922 1.000 1 A 98.670 1 ATOM 2373 C CA . GLU 323 323 ? A -21.522 -1.491 23.902 1.000 1 A 98.670 1 ATOM 2374 C C . GLU 323 323 ? A -21.117 -1.141 25.335 1.000 1 A 98.670 1 ATOM 2375 C CB . GLU 323 323 ? A -21.185 -2.959 23.610 1.000 1 A 98.670 1 ATOM 2376 O O . GLU 323 323 ? A -21.974 -1.049 26.214 1.000 1 A 98.670 1 ATOM 2377 C CG . GLU 323 323 ? A -21.913 -3.470 22.360 1.000 1 A 98.670 1 ATOM 2378 C CD . GLU 323 323 ? A -21.641 -4.952 22.059 1.000 1 A 98.670 1 ATOM 2379 O OE1 . GLU 323 323 ? A -22.297 -5.453 21.117 1.000 1 A 98.670 1 ATOM 2380 O OE2 . GLU 323 323 ? A -20.825 -5.582 22.771 1.000 1 A 98.670 1 ATOM 2381 N N . GLU 324 324 ? A -19.834 -0.872 25.562 1.000 1 A 98.620 1 ATOM 2382 C CA . GLU 324 324 ? A -19.307 -0.487 26.867 1.000 1 A 98.620 1 ATOM 2383 C C . GLU 324 324 ? A -19.874 0.860 27.342 1.000 1 A 98.620 1 ATOM 2384 C CB . GLU 324 324 ? A -17.774 -0.489 26.780 1.000 1 A 98.620 1 ATOM 2385 O O . GLU 324 324 ? A -20.298 0.980 28.493 1.000 1 A 98.620 1 ATOM 2386 C CG . GLU 324 324 ? A -17.062 -0.117 28.083 1.000 1 A 98.620 1 ATOM 2387 C CD . GLU 324 324 ? A -17.367 -1.038 29.269 1.000 1 A 98.620 1 ATOM 2388 O OE1 . GLU 324 324 ? A -16.993 -0.650 30.395 1.000 1 A 98.620 1 ATOM 2389 O OE2 . GLU 324 324 ? A -17.998 -2.111 29.136 1.000 1 A 98.620 1 ATOM 2390 N N . CYS 325 325 ? A -19.982 1.854 26.453 1.000 1 A 98.560 1 ATOM 2391 C CA . CYS 325 325 ? A -20.659 3.118 26.744 1.000 1 A 98.560 1 ATOM 2392 C C . CYS 325 325 ? A -22.119 2.891 27.155 1.000 1 A 98.560 1 ATOM 2393 C CB . CYS 325 325 ? A -20.564 4.055 25.532 1.000 1 A 98.560 1 ATOM 2394 O O . CYS 325 325 ? A -22.528 3.374 28.208 1.000 1 A 98.560 1 ATOM 2395 S SG . CYS 325 325 ? A -18.903 4.783 25.429 1.000 1 A 98.560 1 ATOM 2396 N N . LYS 326 326 ? A -22.886 2.087 26.403 1.000 1 A 98.610 1 ATOM 2397 C CA . LYS 326 326 ? A -24.280 1.751 26.755 1.000 1 A 98.610 1 ATOM 2398 C C . LYS 326 326 ? A -24.382 1.023 28.096 1.000 1 A 98.610 1 ATOM 2399 C CB . LYS 326 326 ? A -24.897 0.874 25.662 1.000 1 A 98.610 1 ATOM 2400 O O . LYS 326 326 ? A -25.298 1.278 28.877 1.000 1 A 98.610 1 ATOM 2401 C CG . LYS 326 326 ? A -25.179 1.654 24.375 1.000 1 A 98.610 1 ATOM 2402 C CD . LYS 326 326 ? A -25.586 0.672 23.275 1.000 1 A 98.610 1 ATOM 2403 C CE . LYS 326 326 ? A -25.810 1.424 21.966 1.000 1 A 98.610 1 ATOM 2404 N NZ . LYS 326 326 ? A -26.060 0.476 20.853 1.000 1 A 98.610 1 ATOM 2405 N N . ARG 327 327 ? A -23.441 0.120 28.386 1.000 1 A 98.520 1 ATOM 2406 C CA . ARG 327 327 ? A -23.375 -0.607 29.660 1.000 1 A 98.520 1 ATOM 2407 C C . ARG 327 327 ? A -23.130 0.346 30.830 1.000 1 A 98.520 1 ATOM 2408 C CB . ARG 327 327 ? A -22.272 -1.670 29.560 1.000 1 A 98.520 1 ATOM 2409 O O . ARG 327 327 ? A -23.794 0.227 31.860 1.000 1 A 98.520 1 ATOM 2410 C CG . ARG 327 327 ? A -22.295 -2.638 30.751 1.000 1 A 98.520 1 ATOM 2411 C CD . ARG 327 327 ? A -21.019 -3.490 30.795 1.000 1 A 98.520 1 ATOM 2412 N NE . ARG 327 327 ? A -19.820 -2.697 31.124 1.000 1 A 98.520 1 ATOM 2413 N NH1 . ARG 327 327 ? A -20.251 -2.283 33.341 1.000 1 A 98.520 1 ATOM 2414 N NH2 . ARG 327 327 ? A -18.386 -1.525 32.449 1.000 1 A 98.520 1 ATOM 2415 C CZ . ARG 327 327 ? A -19.491 -2.174 32.289 1.000 1 A 98.520 1 ATOM 2416 N N . LEU 328 328 ? A -22.201 1.289 30.677 1.000 1 A 98.620 1 ATOM 2417 C CA . LEU 328 328 ? A -21.909 2.313 31.682 1.000 1 A 98.620 1 ATOM 2418 C C . LEU 328 328 ? A -23.065 3.305 31.845 1.000 1 A 98.620 1 ATOM 2419 C CB . LEU 328 328 ? A -20.607 3.044 31.312 1.000 1 A 98.620 1 ATOM 2420 O O . LEU 328 328 ? A -23.388 3.671 32.971 1.000 1 A 98.620 1 ATOM 2421 C CG . LEU 328 328 ? A -19.329 2.204 31.489 1.000 1 A 98.620 1 ATOM 2422 C CD1 . LEU 328 328 ? A -18.134 2.982 30.939 1.000 1 A 98.620 1 ATOM 2423 C CD2 . LEU 328 328 ? A -19.049 1.884 32.963 1.000 1 A 98.620 1 ATOM 2424 N N . GLU 329 329 ? A -23.730 3.699 30.759 1.000 1 A 98.550 1 ATOM 2425 C CA . GLU 329 329 ? A -24.942 4.524 30.800 1.000 1 A 98.550 1 ATOM 2426 C C . GLU 329 329 ? A -26.069 3.833 31.576 1.000 1 A 98.550 1 ATOM 2427 C CB . GLU 329 329 ? A -25.408 4.846 29.373 1.000 1 A 98.550 1 ATOM 2428 O O . GLU 329 329 ? A -26.668 4.449 32.456 1.000 1 A 98.550 1 ATOM 2429 C CG . GLU 329 329 ? A -24.549 5.926 28.698 1.000 1 A 98.550 1 ATOM 2430 C CD . GLU 329 329 ? A -24.861 6.089 27.200 1.000 1 A 98.550 1 ATOM 2431 O OE1 . GLU 329 329 ? A -24.107 6.843 26.544 1.000 1 A 98.550 1 ATOM 2432 O OE2 . GLU 329 329 ? A -25.839 5.475 26.713 1.000 1 A 98.550 1 ATOM 2433 N N . ALA 330 330 ? A -26.313 2.542 31.327 1.000 1 A 98.380 1 ATOM 2434 C CA . ALA 330 330 ? A -27.304 1.758 32.063 1.000 1 A 98.380 1 ATOM 2435 C C . ALA 330 330 ? A -26.937 1.596 33.550 1.000 1 A 98.380 1 ATOM 2436 C CB . ALA 330 330 ? A -27.461 0.399 31.371 1.000 1 A 98.380 1 ATOM 2437 O O . ALA 330 330 ? A -27.797 1.735 34.421 1.000 1 A 98.380 1 ATOM 2438 N N . ALA 331 331 ? A -25.659 1.349 33.857 1.000 1 A 98.300 1 ATOM 2439 C CA . ALA 331 331 ? A -25.174 1.279 35.234 1.000 1 A 98.300 1 ATOM 2440 C C . ALA 331 331 ? A -25.339 2.624 35.964 1.000 1 A 98.300 1 ATOM 2441 C CB . ALA 331 331 ? A -23.713 0.812 35.222 1.000 1 A 98.300 1 ATOM 2442 O O . ALA 331 331 ? A -25.834 2.657 37.090 1.000 1 A 98.300 1 ATOM 2443 N N . ASN 332 332 ? A -25.001 3.737 35.307 1.000 1 A 98.370 1 ATOM 2444 C CA . ASN 332 332 ? A -25.194 5.081 35.849 1.000 1 A 98.370 1 ATOM 2445 C C . ASN 332 332 ? A -26.680 5.399 36.057 1.000 1 A 98.370 1 ATOM 2446 C CB . ASN 332 332 ? A -24.529 6.110 34.918 1.000 1 A 98.370 1 ATOM 2447 O O . ASN 332 332 ? A -27.042 5.919 37.110 1.000 1 A 98.370 1 ATOM 2448 C CG . ASN 332 332 ? A -23.017 6.155 35.049 1.000 1 A 98.370 1 ATOM 2449 N ND2 . ASN 332 332 ? A -22.337 6.712 34.075 1.000 1 A 98.370 1 ATOM 2450 O OD1 . ASN 332 332 ? A -22.424 5.745 36.033 1.000 1 A 98.370 1 ATOM 2451 N N . ALA 333 333 ? A -27.551 5.052 35.106 1.000 1 A 98.180 1 ATOM 2452 C CA . ALA 333 333 ? A -28.996 5.224 35.250 1.000 1 A 98.180 1 ATOM 2453 C C . ALA 333 333 ? A -29.545 4.435 36.452 1.000 1 A 98.180 1 ATOM 2454 C CB . ALA 333 333 ? A -29.676 4.816 33.938 1.000 1 A 98.180 1 ATOM 2455 O O . ALA 333 333 ? A -30.309 4.983 37.246 1.000 1 A 98.180 1 ATOM 2456 N N . SER 334 334 ? A -29.095 3.188 36.639 1.000 1 A 98.070 1 ATOM 2457 C CA . SER 334 334 ? A -29.469 2.364 37.794 1.000 1 A 98.070 1 ATOM 2458 C C . SER 334 334 ? A -28.987 2.961 39.118 1.000 1 A 98.070 1 ATOM 2459 C CB . SER 334 334 ? A -28.906 0.950 37.637 1.000 1 A 98.070 1 ATOM 2460 O O . SER 334 334 ? A -29.752 3.009 40.078 1.000 1 A 98.070 1 ATOM 2461 O OG . SER 334 334 ? A -29.298 0.149 38.738 1.000 1 A 98.070 1 ATOM 2462 N N . LEU 335 335 ? A -27.748 3.459 39.186 1.000 1 A 98.110 1 ATOM 2463 C CA . LEU 335 335 ? A -27.230 4.119 40.389 1.000 1 A 98.110 1 ATOM 2464 C C . LEU 335 335 ? A -28.018 5.391 40.723 1.000 1 A 98.110 1 ATOM 2465 C CB . LEU 335 335 ? A -25.737 4.441 40.210 1.000 1 A 98.110 1 ATOM 2466 O O . LEU 335 335 ? A -28.361 5.613 41.882 1.000 1 A 98.110 1 ATOM 2467 C CG . LEU 335 335 ? A -24.805 3.220 40.288 1.000 1 A 98.110 1 ATOM 2468 C CD1 . LEU 335 335 ? A -23.379 3.656 39.946 1.000 1 A 98.110 1 ATOM 2469 C CD2 . LEU 335 335 ? A -24.788 2.591 41.684 1.000 1 A 98.110 1 ATOM 2470 N N . VAL 336 336 ? A -28.360 6.200 39.718 1.000 1 A 98.160 1 ATOM 2471 C CA . VAL 336 336 ? A -29.192 7.398 39.903 1.000 1 A 98.160 1 ATOM 2472 C C . VAL 336 336 ? A -30.590 7.029 40.410 1.000 1 A 98.160 1 ATOM 2473 C CB . VAL 336 336 ? A -29.253 8.212 38.595 1.000 1 A 98.160 1 ATOM 2474 O O . VAL 336 336 ? A -31.121 7.702 41.295 1.000 1 A 98.160 1 ATOM 2475 C CG1 . VAL 336 336 ? A -30.293 9.340 38.642 1.000 1 A 98.160 1 ATOM 2476 C CG2 . VAL 336 336 ? A -27.895 8.870 38.309 1.000 1 A 98.160 1 ATOM 2477 N N . GLU 337 337 ? A -31.186 5.946 39.907 1.000 1 A 96.990 1 ATOM 2478 C CA . GLU 337 337 ? A -32.468 5.441 40.404 1.000 1 A 96.990 1 ATOM 2479 C C . GLU 337 337 ? A -32.369 4.945 41.855 1.000 1 A 96.990 1 ATOM 2480 C CB . GLU 337 337 ? A -32.988 4.343 39.468 1.000 1 A 96.990 1 ATOM 2481 O O . GLU 337 337 ? A -33.202 5.308 42.685 1.000 1 A 96.990 1 ATOM 2482 C CG . GLU 337 337 ? A -34.429 3.961 39.831 1.000 1 A 96.990 1 ATOM 2483 C CD . GLU 337 337 ? A -35.007 2.835 38.967 1.000 1 A 96.990 1 ATOM 2484 O OE1 . GLU 337 337 ? A -36.162 2.461 39.269 1.000 1 A 96.990 1 ATOM 2485 O OE2 . GLU 337 337 ? A -34.316 2.372 38.033 1.000 1 A 96.990 1 ATOM 2486 N N . GLN 338 338 ? A -31.319 4.197 42.199 1.000 1 A 97.080 1 ATOM 2487 C CA . GLN 338 338 ? A -31.059 3.748 43.571 1.000 1 A 97.080 1 ATOM 2488 C C . GLN 338 338 ? A -30.875 4.932 44.533 1.000 1 A 97.080 1 ATOM 2489 C CB . GLN 338 338 ? A -29.819 2.845 43.593 1.000 1 A 97.080 1 ATOM 2490 O O . GLN 338 338 ? A -31.458 4.947 45.619 1.000 1 A 97.080 1 ATOM 2491 C CG . GLN 338 338 ? A -30.075 1.465 42.972 1.000 1 A 97.080 1 ATOM 2492 C CD . GLN 338 338 ? A -28.789 0.651 42.907 1.000 1 A 97.080 1 ATOM 2493 N NE2 . GLN 338 338 ? A -28.339 0.241 41.741 1.000 1 A 97.080 1 ATOM 2494 O OE1 . GLN 338 338 ? A -28.154 0.378 43.911 1.000 1 A 97.080 1 ATOM 2495 N N . MET 339 339 ? A -30.135 5.969 44.129 1.000 1 A 96.670 1 ATOM 2496 C CA . MET 339 339 ? A -29.999 7.205 44.910 1.000 1 A 96.670 1 ATOM 2497 C C . MET 339 339 ? A -31.342 7.918 45.088 1.000 1 A 96.670 1 ATOM 2498 C CB . MET 339 339 ? A -29.011 8.159 44.233 1.000 1 A 96.670 1 ATOM 2499 O O . MET 339 339 ? A -31.643 8.432 46.166 1.000 1 A 96.670 1 ATOM 2500 C CG . MET 339 339 ? A -27.561 7.689 44.362 1.000 1 A 96.670 1 ATOM 2501 S SD . MET 339 339 ? A -26.359 8.835 43.633 1.000 1 A 96.670 1 ATOM 2502 C CE . MET 339 339 ? A -26.514 10.235 44.776 1.000 1 A 96.670 1 ATOM 2503 N N . ARG 340 340 ? A -32.186 7.932 44.050 1.000 1 A 96.290 1 ATOM 2504 C CA . ARG 340 340 ? A -33.530 8.509 44.132 1.000 1 A 96.290 1 ATOM 2505 C C . ARG 340 340 ? A -34.442 7.710 45.063 1.000 1 A 96.290 1 ATOM 2506 C CB . ARG 340 340 ? A -34.106 8.634 42.716 1.000 1 A 96.290 1 ATOM 2507 O O . ARG 340 340 ? A -35.237 8.322 45.769 1.000 1 A 96.290 1 ATOM 2508 C CG . ARG 340 340 ? A -35.467 9.334 42.735 1.000 1 A 96.290 1 ATOM 2509 C CD . ARG 340 340 ? A -35.998 9.526 41.315 1.000 1 A 96.290 1 ATOM 2510 N NE . ARG 340 340 ? A -37.280 10.259 41.323 1.000 1 A 96.290 1 ATOM 2511 N NH1 . ARG 340 340 ? A -37.537 10.382 39.046 1.000 1 A 96.290 1 ATOM 2512 N NH2 . ARG 340 340 ? A -39.085 11.281 40.379 1.000 1 A 96.290 1 ATOM 2513 C CZ . ARG 340 340 ? A -37.958 10.637 40.253 1.000 1 A 96.290 1 ATOM 2514 N N . ASN 341 341 ? A -34.352 6.384 45.061 1.000 1 A 95.470 1 ATOM 2515 C CA . ASN 341 341 ? A -35.177 5.517 45.902 1.000 1 A 95.470 1 ATOM 2516 C C . ASN 341 341 ? A -34.757 5.614 47.372 1.000 1 A 95.470 1 ATOM 2517 C CB . ASN 341 341 ? A -35.150 4.090 45.334 1.000 1 A 95.470 1 ATOM 2518 O O . ASN 341 341 ? A -35.587 5.950 48.204 1.000 1 A 95.470 1 ATOM 2519 C CG . ASN 341 341 ? A -35.842 3.990 43.979 1.000 1 A 95.470 1 ATOM 2520 N ND2 . ASN 341 341 ? A -35.657 2.885 43.293 1.000 1 A 95.470 1 ATOM 2521 O OD1 . ASN 341 341 ? A -36.556 4.891 43.533 1.000 1 A 95.470 1 ATOM 2522 N N . THR 342 342 ? A -33.459 5.515 47.665 1.000 1 A 95.740 1 ATOM 2523 C CA . THR 342 342 ? A -32.929 5.730 49.026 1.000 1 A 95.740 1 ATOM 2524 C C . THR 342 342 ? A -33.237 7.130 49.571 1.000 1 A 95.740 1 ATOM 2525 C CB . THR 342 342 ? A -31.414 5.490 49.084 1.000 1 A 95.740 1 ATOM 2526 O O . THR 342 342 ? A -33.553 7.273 50.748 1.000 1 A 95.740 1 ATOM 2527 C CG2 . THR 342 342 ? A -31.053 4.022 48.870 1.000 1 A 95.740 1 ATOM 2528 O OG1 . THR 342 342 ? A -30.745 6.226 48.085 1.000 1 A 95.740 1 ATOM 2529 N N . SER 343 343 ? A -33.231 8.169 48.727 1.000 1 A 93.960 1 ATOM 2530 C CA . SER 343 343 ? A -33.645 9.523 49.138 1.000 1 A 93.960 1 ATOM 2531 C C . SER 343 343 ? A -35.144 9.629 49.462 1.000 1 A 93.960 1 ATOM 2532 C CB . SER 343 343 ? A -33.308 10.556 48.060 1.000 1 A 93.960 1 ATOM 2533 O O . SER 343 343 ? A -35.520 10.425 50.320 1.000 1 A 93.960 1 ATOM 2534 O OG . SER 343 343 ? A -31.922 10.590 47.785 1.000 1 A 93.960 1 ATOM 2535 N N . LYS 344 344 ? A -36.006 8.849 48.792 1.000 1 A 92.560 1 ATOM 2536 C CA . LYS 344 344 ? A -37.446 8.776 49.104 1.000 1 A 92.560 1 ATOM 2537 C C . LYS 344 344 ? A -37.700 7.971 50.374 1.000 1 A 92.560 1 ATOM 2538 C CB . LYS 344 344 ? A -38.233 8.128 47.965 1.000 1 A 92.560 1 ATOM 2539 O O . LYS 344 344 ? A -38.442 8.442 51.223 1.000 1 A 92.560 1 ATOM 2540 C CG . LYS 344 344 ? A -38.351 8.977 46.694 1.000 1 A 92.560 1 ATOM 2541 C CD . LYS 344 344 ? A -38.870 8.038 45.603 1.000 1 A 92.560 1 ATOM 2542 C CE . LYS 344 344 ? A -38.879 8.653 44.211 1.000 1 A 92.560 1 ATOM 2543 N NZ . LYS 344 344 ? A -38.970 7.548 43.220 1.000 1 A 92.560 1 ATOM 2544 N N . ASP 345 345 ? A -37.034 6.830 50.540 1.000 1 A 91.640 1 ATOM 2545 C CA . ASP 345 345 ? A -37.180 5.979 51.727 1.000 1 A 91.640 1 ATOM 2546 C C . ASP 345 345 ? A -36.782 6.741 53.007 1.000 1 A 91.640 1 ATOM 2547 C CB . ASP 345 345 ? A -36.322 4.709 51.568 1.000 1 A 91.640 1 ATOM 2548 O O . ASP 345 345 ? A -37.436 6.636 54.045 1.000 1 A 91.640 1 ATOM 2549 C CG . ASP 345 345 ? A -36.696 3.824 50.368 1.000 1 A 91.640 1 ATOM 2550 O OD1 . ASP 345 345 ? A -37.871 3.852 49.941 1.000 1 A 91.640 1 ATOM 2551 O OD2 . ASP 345 345 ? A -35.781 3.126 49.872 1.000 1 A 91.640 1 ATOM 2552 N N . VAL 346 346 ? A -35.747 7.587 52.931 1.000 1 A 88.110 1 ATOM 2553 C CA . VAL 346 346 ? A -35.351 8.484 54.032 1.000 1 A 88.110 1 ATOM 2554 C C . VAL 346 346 ? A -36.391 9.588 54.282 1.000 1 A 88.110 1 ATOM 2555 C CB . VAL 346 346 ? A -33.951 9.070 53.766 1.000 1 A 88.110 1 ATOM 2556 O O . VAL 346 346 ? A -36.621 9.963 55.431 1.000 1 A 88.110 1 ATOM 2557 C CG1 . VAL 346 346 ? A -33.537 10.135 54.792 1.000 1 A 88.110 1 ATOM 2558 C CG2 . VAL 346 346 ? A -32.881 7.970 53.829 1.000 1 A 88.110 1 ATOM 2559 N N . ALA 347 347 ? A -37.051 10.102 53.240 1.000 1 A 83.200 1 ATOM 2560 C CA . ALA 347 347 ? A -38.108 11.100 53.397 1.000 1 A 83.200 1 ATOM 2561 C C . ALA 347 347 ? A -39.382 10.499 54.022 1.000 1 A 83.200 1 ATOM 2562 C CB . ALA 347 347 ? A -38.380 11.768 52.043 1.000 1 A 83.200 1 ATOM 2563 O O . ALA 347 347 ? A -39.920 11.075 54.969 1.000 1 A 83.200 1 ATOM 2564 N N . ASP 348 348 ? A -39.818 9.322 53.568 1.000 1 A 77.260 1 ATOM 2565 C CA . ASP 348 348 ? A -41.029 8.654 54.059 1.000 1 A 77.260 1 ATOM 2566 C C . ASP 348 348 ? A -40.861 8.157 55.504 1.000 1 A 77.260 1 ATOM 2567 C CB . ASP 348 348 ? A -41.414 7.506 53.106 1.000 1 A 77.260 1 ATOM 2568 O O . ASP 348 348 ? A -41.760 8.329 56.329 1.000 1 A 77.260 1 ATOM 2569 C CG . ASP 348 348 ? A -41.976 7.977 51.752 1.000 1 A 77.260 1 ATOM 2570 O OD1 . ASP 348 348 ? A -42.376 9.160 51.640 1.000 1 A 77.260 1 ATOM 2571 O OD2 . ASP 348 348 ? A -42.040 7.138 50.825 1.000 1 A 77.260 1 ATOM 2572 N N . THR 349 349 ? A -39.680 7.639 55.864 1.000 1 A 74.740 1 ATOM 2573 C CA . THR 349 349 ? A -39.375 7.241 57.255 1.000 1 A 74.740 1 ATOM 2574 C C . THR 349 349 ? A -39.289 8.426 58.218 1.000 1 A 74.740 1 ATOM 2575 C CB . THR 349 349 ? A -38.087 6.412 57.359 1.000 1 A 74.740 1 ATOM 2576 O O . THR 349 349 ? A -39.530 8.258 59.413 1.000 1 A 74.740 1 ATOM 2577 C CG2 . THR 349 349 ? A -38.234 5.033 56.718 1.000 1 A 74.740 1 ATOM 2578 O OG1 . THR 349 349 ? A -37.003 7.054 56.736 1.000 1 A 74.740 1 ATOM 2579 N N . SER 350 350 ? A -39.013 9.639 57.724 1.000 1 A 64.820 1 ATOM 2580 C CA . SER 350 350 ? A -39.062 10.859 58.543 1.000 1 A 64.820 1 ATOM 2581 C C . SER 350 350 ? A -40.486 11.392 58.770 1.000 1 A 64.820 1 ATOM 2582 C CB . SER 350 350 ? A -38.141 11.932 57.954 1.000 1 A 64.820 1 ATOM 2583 O O . SER 350 350 ? A -40.707 12.155 59.710 1.000 1 A 64.820 1 ATOM 2584 O OG . SER 350 350 ? A -38.694 12.589 56.830 1.000 1 A 64.820 1 ATOM 2585 N N . ALA 351 351 ? A -41.459 10.978 57.946 1.000 1 A 62.150 1 ATOM 2586 C CA . ALA 351 351 ? A -42.835 11.475 57.982 1.000 1 A 62.150 1 ATOM 2587 C C . ALA 351 351 ? A -43.793 10.645 58.859 1.000 1 A 62.150 1 ATOM 2588 C CB . ALA 351 351 ? A -43.341 11.610 56.542 1.000 1 A 62.150 1 ATOM 2589 O O . ALA 351 351 ? A -44.908 11.096 59.122 1.000 1 A 62.150 1 ATOM 2590 N N . THR 352 352 ? A -43.378 9.481 59.371 1.000 1 A 52.730 1 ATOM 2591 C CA . THR 352 352 ? A -44.168 8.694 60.336 1.000 1 A 52.730 1 ATOM 2592 C C . THR 352 352 ? A -43.552 8.725 61.742 1.000 1 A 52.730 1 ATOM 2593 C CB . THR 352 352 ? A -44.380 7.247 59.851 1.000 1 A 52.730 1 ATOM 2594 O O . THR 352 352 ? A -42.891 7.762 62.135 1.000 1 A 52.730 1 ATOM 2595 C CG2 . THR 352 352 ? A -45.202 7.176 58.566 1.000 1 A 52.730 1 ATOM 2596 O OG1 . THR 352 352 ? A -43.147 6.611 59.610 1.000 1 A 52.730 1 ATOM 2597 N N . PRO 353 353 ? A -43.752 9.787 62.549 1.000 1 A 53.950 1 ATOM 2598 C CA . PRO 353 353 ? A -43.419 9.758 63.960 1.000 1 A 53.950 1 ATOM 2599 C C . PRO 353 353 ? A -44.664 9.366 64.764 1.000 1 A 53.950 1 ATOM 2600 C CB . PRO 353 353 ? A -42.919 11.176 64.254 1.000 1 A 53.950 1 ATOM 2601 O O . PRO 353 353 ? A -45.225 10.206 65.450 1.000 1 A 53.950 1 ATOM 2602 C CG . PRO 353 353 ? A -43.852 12.036 63.398 1.000 1 A 53.950 1 ATOM 2603 C CD . PRO 353 353 ? A -44.200 11.134 62.204 1.000 1 A 53.950 1 ATOM 2604 N N . GLU 354 354 ? A -45.109 8.109 64.718 1.000 1 A 44.070 1 ATOM 2605 C CA . GLU 354 354 ? A -45.971 7.588 65.789 1.000 1 A 44.070 1 ATOM 2606 C C . GLU 354 354 ? A -45.679 6.115 66.099 1.000 1 A 44.070 1 ATOM 2607 C CB . GLU 354 354 ? A -47.483 7.840 65.582 1.000 1 A 44.070 1 ATOM 2608 O O . GLU 354 354 ? A -45.901 5.214 65.299 1.000 1 A 44.070 1 ATOM 2609 C CG . GLU 354 354 ? A -47.934 9.237 66.074 1.000 1 A 44.070 1 ATOM 2610 C CD . GLU 354 354 ? A -49.397 9.327 66.534 1.000 1 A 44.070 1 ATOM 2611 O OE1 . GLU 354 354 ? A -49.712 10.309 67.247 1.000 1 A 44.070 1 ATOM 2612 O OE2 . GLU 354 354 ? A -50.192 8.418 66.206 1.000 1 A 44.070 1 ATOM 2613 N N . ALA 355 355 ? A -45.182 5.926 67.324 1.000 1 A 44.000 1 ATOM 2614 C CA . ALA 355 355 ? A -45.415 4.791 68.207 1.000 1 A 44.000 1 ATOM 2615 C C . ALA 355 355 ? A -45.209 3.368 67.649 1.000 1 A 44.000 1 ATOM 2616 C CB . ALA 355 355 ? A -46.808 4.984 68.829 1.000 1 A 44.000 1 ATOM 2617 O O . ALA 355 355 ? A -46.157 2.684 67.284 1.000 1 A 44.000 1 ATOM 2618 N N . SER 356 356 ? A -43.995 2.835 67.813 1.000 1 A 43.380 1 ATOM 2619 C CA . SER 356 356 ? A -43.835 1.553 68.518 1.000 1 A 43.380 1 ATOM 2620 C C . SER 356 356 ? A -42.393 1.374 68.986 1.000 1 A 43.380 1 ATOM 2621 C CB . SER 356 356 ? A -44.268 0.337 67.693 1.000 1 A 43.380 1 ATOM 2622 O O . SER 356 356 ? A -41.482 1.070 68.219 1.000 1 A 43.380 1 ATOM 2623 O OG . SER 356 356 ? A -44.466 -0.743 68.587 1.000 1 A 43.380 1 ATOM 2624 N N . ALA 357 357 ? A -42.188 1.602 70.278 1.000 1 A 41.420 1 ATOM 2625 C CA . ALA 357 357 ? A -41.002 1.183 70.996 1.000 1 A 41.420 1 ATOM 2626 C C . ALA 357 357 ? A -41.128 -0.312 71.335 1.000 1 A 41.420 1 ATOM 2627 C CB . ALA 357 357 ? A -40.905 2.053 72.258 1.000 1 A 41.420 1 ATOM 2628 O O . ALA 357 357 ? A -41.918 -0.657 72.206 1.000 1 A 41.420 1 ATOM 2629 N N . VAL 358 358 ? A -40.343 -1.175 70.686 1.000 1 A 41.610 1 ATOM 2630 C CA . VAL 358 358 ? A -40.019 -2.558 71.107 1.000 1 A 41.610 1 ATOM 2631 C C . VAL 358 358 ? A -38.629 -2.850 70.512 1.000 1 A 41.610 1 ATOM 2632 C CB . VAL 358 358 ? A -41.083 -3.571 70.601 1.000 1 A 41.610 1 ATOM 2633 O O . VAL 358 358 ? A -38.496 -2.954 69.302 1.000 1 A 41.610 1 ATOM 2634 C CG1 . VAL 358 358 ? A -40.678 -5.014 70.916 1.000 1 A 41.610 1 ATOM 2635 C CG2 . VAL 358 358 ? A -42.473 -3.376 71.225 1.000 1 A 41.610 1 ATOM 2636 N N . VAL 359 359 ? A -37.514 -2.639 71.221 1.000 1 A 37.350 1 ATOM 2637 C CA . VAL 359 359 ? A -36.859 -3.554 72.184 1.000 1 A 37.350 1 ATOM 2638 C C . VAL 359 359 ? A -36.673 -4.981 71.644 1.000 1 A 37.350 1 ATOM 2639 C CB . VAL 359 359 ? A -37.497 -3.558 73.590 1.000 1 A 37.350 1 ATOM 2640 O O . VAL 359 359 ? A -37.640 -5.716 71.506 1.000 1 A 37.350 1 ATOM 2641 C CG1 . VAL 359 359 ? A -36.748 -4.500 74.549 1.000 1 A 37.350 1 ATOM 2642 C CG2 . VAL 359 359 ? A -37.453 -2.157 74.216 1.000 1 A 37.350 1 ATOM 2643 N N . GLY 360 360 ? A -35.413 -5.393 71.457 1.000 1 A 39.890 1 ATOM 2644 C CA . GLY 360 360 ? A -34.993 -6.786 71.221 1.000 1 A 39.890 1 ATOM 2645 C C . GLY 360 360 ? A -34.034 -6.890 70.033 1.000 1 A 39.890 1 ATOM 2646 O O . GLY 360 360 ? A -34.459 -6.778 68.895 1.000 1 A 39.890 1 ATOM 2647 N N . GLN 361 361 ? A -32.717 -6.841 70.259 1.000 1 A 39.610 1 ATOM 2648 C CA . GLN 361 361 ? A -31.861 -8.042 70.331 1.000 1 A 39.610 1 ATOM 2649 C C . GLN 361 361 ? A -31.933 -8.896 69.052 1.000 1 A 39.610 1 ATOM 2650 C CB . GLN 361 361 ? A -32.144 -8.896 71.584 1.000 1 A 39.610 1 ATOM 2651 O O . GLN 361 361 ? A -32.893 -9.621 68.847 1.000 1 A 39.610 1 ATOM 2652 C CG . GLN 361 361 ? A -31.697 -8.223 72.889 1.000 1 A 39.610 1 ATOM 2653 C CD . GLN 361 361 ? A -31.908 -9.099 74.124 1.000 1 A 39.610 1 ATOM 2654 N NE2 . GLN 361 361 ? A -31.446 -8.669 75.278 1.000 1 A 39.610 1 ATOM 2655 O OE1 . GLN 361 361 ? A -32.511 -10.155 74.119 1.000 1 A 39.610 1 ATOM 2656 N N . ASP 362 362 ? A -30.939 -8.808 68.167 1.000 1 A 39.500 1 ATOM 2657 C CA . ASP 362 362 ? A -29.764 -9.685 68.220 1.000 1 A 39.500 1 ATOM 2658 C C . ASP 362 362 ? A -28.851 -9.461 67.008 1.000 1 A 39.500 1 ATOM 2659 C CB . ASP 362 362 ? A -30.123 -11.186 68.328 1.000 1 A 39.500 1 ATOM 2660 O O . ASP 362 362 ? A -29.279 -9.354 65.859 1.000 1 A 39.500 1 ATOM 2661 C CG . ASP 362 362 ? A -30.112 -11.690 69.779 1.000 1 A 39.500 1 ATOM 2662 O OD1 . ASP 362 362 ? A -29.296 -11.152 70.568 1.000 1 A 39.500 1 ATOM 2663 O OD2 . ASP 362 362 ? A -30.880 -12.626 70.085 1.000 1 A 39.500 1 ATOM 2664 N N . ALA 363 363 ? A -27.553 -9.409 67.291 1.000 1 A 41.710 1 ATOM 2665 C CA . ALA 363 363 ? A -26.514 -9.621 66.301 1.000 1 A 41.710 1 ATOM 2666 C C . ALA 363 363 ? A -26.578 -11.071 65.792 1.000 1 A 41.710 1 ATOM 2667 C CB . ALA 363 363 ? A -25.168 -9.321 66.976 1.000 1 A 41.710 1 ATOM 2668 O O . ALA 363 363 ? A -26.808 -11.996 66.572 1.000 1 A 41.710 1 ATOM 2669 N N . PRO 364 364 ? A -26.225 -11.296 64.519 1.000 1 A 43.480 1 ATOM 2670 C CA . PRO 364 364 ? A -25.123 -12.222 64.323 1.000 1 A 43.480 1 ATOM 2671 C C . PRO 364 364 ? A -24.078 -11.676 63.353 1.000 1 A 43.480 1 ATOM 2672 C CB . PRO 364 364 ? A -25.741 -13.535 63.854 1.000 1 A 43.480 1 ATOM 2673 O O . PRO 364 364 ? A -24.350 -11.215 62.247 1.000 1 A 43.480 1 ATOM 2674 C CG . PRO 364 364 ? A -26.937 -13.067 63.032 1.000 1 A 43.480 1 ATOM 2675 C CD . PRO 364 364 ? A -27.263 -11.665 63.562 1.000 1 A 43.480 1 ATOM 2676 N N . ALA 365 365 ? A -22.839 -11.800 63.806 1.000 1 A 39.460 1 ATOM 2677 C CA . ALA 365 365 ? A -21.642 -11.756 62.998 1.000 1 A 39.460 1 ATOM 2678 C C . ALA 365 365 ? A -21.697 -12.789 61.855 1.000 1 A 39.460 1 ATOM 2679 C CB . ALA 365 365 ? A -20.487 -12.071 63.957 1.000 1 A 39.460 1 ATOM 2680 O O . ALA 365 365 ? A -21.968 -13.967 62.090 1.000 1 A 39.460 1 ATOM 2681 N N . ASN 366 366 ? A -21.339 -12.371 60.639 1.000 1 A 44.200 1 ATOM 2682 C CA . ASN 366 366 ? A -20.896 -13.271 59.573 1.000 1 A 44.200 1 ATOM 2683 C C . ASN 366 366 ? A -19.698 -12.608 58.866 1.000 1 A 44.200 1 ATOM 2684 C CB . ASN 366 366 ? A -22.086 -13.608 58.652 1.000 1 A 44.200 1 ATOM 2685 O O . ASN 366 366 ? A -19.860 -11.591 58.202 1.000 1 A 44.200 1 ATOM 2686 C CG . ASN 366 366 ? A -21.940 -14.953 57.960 1.000 1 A 44.200 1 ATOM 2687 N ND2 . ASN 366 366 ? A -22.767 -15.226 56.980 1.000 1 A 44.200 1 ATOM 2688 O OD1 . ASN 366 366 ? A -21.128 -15.797 58.311 1.000 1 A 44.200 1 ATOM 2689 N N . LYS 367 367 ? A -18.479 -12.923 59.329 1.000 1 A 43.500 1 ATOM 2690 C CA . LYS 367 367 ? A -17.434 -13.682 58.602 1.000 1 A 43.500 1 ATOM 2691 C C . LYS 367 367 ? A -17.066 -13.032 57.257 1.000 1 A 43.500 1 ATOM 2692 C CB . LYS 367 367 ? A -17.809 -15.163 58.447 1.000 1 A 43.500 1 ATOM 2693 O O . LYS 367 367 ? A -17.850 -13.060 56.325 1.000 1 A 43.500 1 ATOM 2694 C CG . LYS 367 367 ? A -18.003 -15.868 59.800 1.000 1 A 43.500 1 ATOM 2695 C CD . LYS 367 367 ? A -18.373 -17.338 59.593 1.000 1 A 43.500 1 ATOM 2696 C CE . LYS 367 367 ? A -18.755 -17.971 60.932 1.000 1 A 43.500 1 ATOM 2697 N NZ . LYS 367 367 ? A -19.217 -19.364 60.737 1.000 1 A 43.500 1 ATOM 2698 N N . HIS 368 368 ? A -15.971 -12.275 57.197 1.000 1 A 35.200 1 ATOM 2699 C CA . HIS 368 368 ? A -14.621 -12.768 56.869 1.000 1 A 35.200 1 ATOM 2700 C C . HIS 368 368 ? A -14.591 -13.472 55.505 1.000 1 A 35.200 1 ATOM 2701 C CB . HIS 368 368 ? A -13.965 -13.590 58.004 1.000 1 A 35.200 1 ATOM 2702 O O . HIS 368 368 ? A -14.763 -14.683 55.427 1.000 1 A 35.200 1 ATOM 2703 C CG . HIS 368 368 ? A -12.521 -13.237 58.285 1.000 1 A 35.200 1 ATOM 2704 C CD2 . HIS 368 368 ? A -12.084 -12.592 59.411 1.000 1 A 35.200 1 ATOM 2705 N ND1 . HIS 368 368 ? A -11.400 -13.502 57.522 1.000 1 A 35.200 1 ATOM 2706 C CE1 . HIS 368 368 ? A -10.325 -13.021 58.177 1.000 1 A 35.200 1 ATOM 2707 N NE2 . HIS 368 368 ? A -10.700 -12.460 59.339 1.000 1 A 35.200 1 ATOM 2708 N N . GLU 369 369 ? A -14.329 -12.704 54.450 1.000 1 A 41.520 1 ATOM 2709 C CA . GLU 369 369 ? A -13.738 -13.235 53.224 1.000 1 A 41.520 1 ATOM 2710 C C . GLU 369 369 ? A -12.620 -12.274 52.799 1.000 1 A 41.520 1 ATOM 2711 C CB . GLU 369 369 ? A -14.805 -13.552 52.160 1.000 1 A 41.520 1 ATOM 2712 O O . GLU 369 369 ? A -12.826 -11.229 52.185 1.000 1 A 41.520 1 ATOM 2713 C CG . GLU 369 369 ? A -14.359 -14.731 51.273 1.000 1 A 41.520 1 ATOM 2714 C CD . GLU 369 369 ? A -15.490 -15.315 50.408 1.000 1 A 41.520 1 ATOM 2715 O OE1 . GLU 369 369 ? A -15.378 -16.509 50.040 1.000 1 A 41.520 1 ATOM 2716 O OE2 . GLU 369 369 ? A -16.468 -14.585 50.126 1.000 1 A 41.520 1 ATOM 2717 N N . GLU 370 370 ? A -11.418 -12.597 53.275 1.000 1 A 40.480 1 ATOM 2718 C CA . GLU 370 370 ? A -10.159 -12.162 52.689 1.000 1 A 40.480 1 ATOM 2719 C C . GLU 370 370 ? A -10.052 -12.772 51.290 1.000 1 A 40.480 1 ATOM 2720 C CB . GLU 370 370 ? A -8.982 -12.710 53.525 1.000 1 A 40.480 1 ATOM 2721 O O . GLU 370 370 ? A -9.966 -13.990 51.154 1.000 1 A 40.480 1 ATOM 2722 C CG . GLU 370 370 ? A -8.530 -11.812 54.678 1.000 1 A 40.480 1 ATOM 2723 C CD . GLU 370 370 ? A -7.517 -12.527 55.587 1.000 1 A 40.480 1 ATOM 2724 O OE1 . GLU 370 370 ? A -6.455 -11.929 55.869 1.000 1 A 40.480 1 ATOM 2725 O OE2 . GLU 370 370 ? A -7.850 -13.644 56.047 1.000 1 A 40.480 1 ATOM 2726 N N . THR 371 371 ? A -9.954 -11.934 50.261 1.000 1 A 48.030 1 ATOM 2727 C CA . THR 371 371 ? A -9.190 -12.269 49.054 1.000 1 A 48.030 1 ATOM 2728 C C . THR 371 371 ? A -8.308 -11.079 48.688 1.000 1 A 48.030 1 ATOM 2729 C CB . THR 371 371 ? A -10.038 -12.752 47.868 1.000 1 A 48.030 1 ATOM 2730 O O . THR 371 371 ? A -8.705 -10.155 47.986 1.000 1 A 48.030 1 ATOM 2731 C CG2 . THR 371 371 ? A -10.777 -14.061 48.148 1.000 1 A 48.030 1 ATOM 2732 O OG1 . THR 371 371 ? A -10.975 -11.777 47.488 1.000 1 A 48.030 1 ATOM 2733 N N . GLU 372 372 ? A -7.143 -11.062 49.324 1.000 1 A 35.150 1 ATOM 2734 C CA . GLU 372 372 ? A -5.816 -10.977 48.712 1.000 1 A 35.150 1 ATOM 2735 C C . GLU 372 372 ? A -5.649 -10.428 47.278 1.000 1 A 35.150 1 ATOM 2736 C CB . GLU 372 372 ? A -5.192 -12.389 48.787 1.000 1 A 35.150 1 ATOM 2737 O O . GLU 372 372 ? A -6.278 -10.879 46.325 1.000 1 A 35.150 1 ATOM 2738 C CG . GLU 372 372 ? A -3.962 -12.415 49.702 1.000 1 A 35.150 1 ATOM 2739 C CD . GLU 372 372 ? A -3.369 -13.824 49.876 1.000 1 A 35.150 1 ATOM 2740 O OE1 . GLU 372 372 ? A -2.251 -13.895 50.432 1.000 1 A 35.150 1 ATOM 2741 O OE2 . GLU 372 372 ? A -3.996 -14.799 49.406 1.000 1 A 35.150 1 ATOM 2742 N N . SER 373 373 ? A -4.569 -9.638 47.142 1.000 1 A 42.530 1 ATOM 2743 C CA . SER 373 373 ? A -3.788 -9.350 45.920 1.000 1 A 42.530 1 ATOM 2744 C C . SER 373 373 ? A -4.417 -8.305 44.975 1.000 1 A 42.530 1 ATOM 2745 C CB . SER 373 373 ? A -3.460 -10.669 45.196 1.000 1 A 42.530 1 ATOM 2746 O O . SER 373 373 ? A -5.468 -8.519 44.400 1.000 1 A 42.530 1 ATOM 2747 O OG . SER 373 373 ? A -2.883 -11.609 46.079 1.000 1 A 42.530 1 ATOM 2748 N N . LYS 374 374 ? A -3.800 -7.168 44.635 1.000 1 A 41.690 1 ATOM 2749 C CA . LYS 374 374 ? A -2.412 -7.019 44.205 1.000 1 A 41.690 1 ATOM 2750 C C . LYS 374 374 ? A -2.110 -5.530 43.979 1.000 1 A 41.690 1 ATOM 2751 C CB . LYS 374 374 ? A -2.312 -7.783 42.868 1.000 1 A 41.690 1 ATOM 2752 O O . LYS 374 374 ? A -2.687 -4.881 43.112 1.000 1 A 41.690 1 ATOM 2753 C CG . LYS 374 374 ? A -0.883 -8.069 42.401 1.000 1 A 41.690 1 ATOM 2754 C CD . LYS 374 374 ? A -0.939 -9.073 41.241 1.000 1 A 41.690 1 ATOM 2755 C CE . LYS 374 374 ? A 0.465 -9.476 40.793 1.000 1 A 41.690 1 ATOM 2756 N NZ . LYS 374 374 ? A 0.400 -10.597 39.826 1.000 1 A 41.690 1 ATOM 2757 N N . SER 375 375 ? A -1.152 -5.016 44.738 1.000 1 A 39.640 1 ATOM 2758 C CA . SER 375 375 ? A -0.362 -3.841 44.382 1.000 1 A 39.640 1 ATOM 2759 C C . SER 375 375 ? A 0.310 -4.065 43.019 1.000 1 A 39.640 1 ATOM 2760 C CB . SER 375 375 ? A 0.693 -3.674 45.485 1.000 1 A 39.640 1 ATOM 2761 O O . SER 375 375 ? A 1.143 -4.960 42.881 1.000 1 A 39.640 1 ATOM 2762 O OG . SER 375 375 ? A 1.763 -2.847 45.086 1.000 1 A 39.640 1 ATOM 2763 N N . GLN 376 376 ? A -0.042 -3.263 42.012 1.000 1 A 41.750 1 ATOM 2764 C CA . GLN 376 376 ? A 0.837 -2.957 40.883 1.000 1 A 41.750 1 ATOM 2765 C C . GLN 376 376 ? A 0.744 -1.461 40.588 1.000 1 A 41.750 1 ATOM 2766 C CB . GLN 376 376 ? A 0.562 -3.816 39.632 1.000 1 A 41.750 1 ATOM 2767 O O . GLN 376 376 ? A -0.093 -0.999 39.819 1.000 1 A 41.750 1 ATOM 2768 C CG . GLN 376 376 ? A 1.026 -5.268 39.825 1.000 1 A 41.750 1 ATOM 2769 C CD . GLN 376 376 ? A 1.132 -6.053 38.525 1.000 1 A 41.750 1 ATOM 2770 N NE2 . GLN 376 376 ? A 2.299 -6.143 37.926 1.000 1 A 41.750 1 ATOM 2771 O OE1 . GLN 376 376 ? A 0.191 -6.661 38.048 1.000 1 A 41.750 1 ATOM 2772 N N . GLY 377 377 ? A 1.645 -0.702 41.209 1.000 1 A 34.130 1 ATOM 2773 C CA . GLY 377 377 ? A 2.137 0.514 40.583 1.000 1 A 34.130 1 ATOM 2774 C C . GLY 377 377 ? A 2.866 0.157 39.287 1.000 1 A 34.130 1 ATOM 2775 O O . GLY 377 377 ? A 3.563 -0.857 39.234 1.000 1 A 34.130 1 ATOM 2776 N N . ASN 378 378 ? A 2.651 0.968 38.251 1.000 1 A 39.260 1 ATOM 2777 C CA . ASN 378 378 ? A 3.611 1.397 37.224 1.000 1 A 39.260 1 ATOM 2778 C C . ASN 378 378 ? A 2.870 1.716 35.926 1.000 1 A 39.260 1 ATOM 2779 C CB . ASN 378 378 ? A 4.731 0.377 36.927 1.000 1 A 39.260 1 ATOM 2780 O O . ASN 378 378 ? A 2.224 0.853 35.342 1.000 1 A 39.260 1 ATOM 2781 C CG . ASN 378 378 ? A 5.825 0.388 37.983 1.000 1 A 39.260 1 ATOM 2782 N ND2 . ASN 378 378 ? A 6.675 -0.609 38.000 1.000 1 A 39.260 1 ATOM 2783 O OD1 . ASN 378 378 ? A 5.956 1.308 38.774 1.000 1 A 39.260 1 ATOM 2784 N N . GLY 379 379 ? A 3.035 2.943 35.435 1.000 1 A 38.030 1 ATOM 2785 C CA . GLY 379 379 ? A 2.617 3.286 34.081 1.000 1 A 38.030 1 ATOM 2786 C C . GLY 379 379 ? A 2.238 4.743 33.924 1.000 1 A 38.030 1 ATOM 2787 O O . GLY 379 379 ? A 1.075 5.068 33.746 1.000 1 A 38.030 1 ATOM 2788 N N . ASN 380 380 ? A 3.238 5.614 33.992 1.000 1 A 38.210 1 ATOM 2789 C CA . ASN 380 380 ? A 3.193 6.985 33.506 1.000 1 A 38.210 1 ATOM 2790 C C . ASN 380 380 ? A 2.640 7.014 32.064 1.000 1 A 38.210 1 ATOM 2791 C CB . ASN 380 380 ? A 4.656 7.467 33.600 1.000 1 A 38.210 1 ATOM 2792 O O . ASN 380 380 ? A 3.387 6.806 31.108 1.000 1 A 38.210 1 ATOM 2793 C CG . ASN 380 380 ? A 4.886 8.904 33.182 1.000 1 A 38.210 1 ATOM 2794 N ND2 . ASN 380 380 ? A 6.118 9.262 32.901 1.000 1 A 38.210 1 ATOM 2795 O OD1 . ASN 380 380 ? A 3.995 9.729 33.139 1.000 1 A 38.210 1 ATOM 2796 N N . VAL 381 381 ? A 1.331 7.231 31.900 1.000 1 A 42.540 1 ATOM 2797 C CA . VAL 381 381 ? A 0.729 7.510 30.594 1.000 1 A 42.540 1 ATOM 2798 C C . VAL 381 381 ? A 1.125 8.933 30.241 1.000 1 A 42.540 1 ATOM 2799 C CB . VAL 381 381 ? A -0.795 7.282 30.558 1.000 1 A 42.540 1 ATOM 2800 O O . VAL 381 381 ? A 0.500 9.914 30.648 1.000 1 A 42.540 1 ATOM 2801 C CG1 . VAL 381 381 ? A -1.380 7.621 29.178 1.000 1 A 42.540 1 ATOM 2802 C CG2 . VAL 381 381 ? A -1.122 5.812 30.846 1.000 1 A 42.540 1 ATOM 2803 N N . LYS 382 382 ? A 2.227 9.032 29.500 1.000 1 A 45.520 1 ATOM 2804 C CA . LYS 382 382 ? A 2.625 10.230 28.777 1.000 1 A 45.520 1 ATOM 2805 C C . LYS 382 382 ? A 1.490 10.556 27.804 1.000 1 A 45.520 1 ATOM 2806 C CB . LYS 382 382 ? A 3.980 9.943 28.106 1.000 1 A 45.520 1 ATOM 2807 O O . LYS 382 382 ? A 1.430 10.002 26.710 1.000 1 A 45.520 1 ATOM 2808 C CG . LYS 382 382 ? A 4.672 11.192 27.543 1.000 1 A 45.520 1 ATOM 2809 C CD . LYS 382 382 ? A 6.095 10.834 27.085 1.000 1 A 45.520 1 ATOM 2810 C CE . LYS 382 382 ? A 6.847 12.082 26.613 1.000 1 A 45.520 1 ATOM 2811 N NZ . LYS 382 382 ? A 8.233 11.760 26.187 1.000 1 A 45.520 1 ATOM 2812 N N . ARG 383 383 ? A 0.567 11.416 28.241 1.000 1 A 40.290 1 ATOM 2813 C CA . ARG 383 383 ? A -0.401 12.100 27.383 1.000 1 A 40.290 1 ATOM 2814 C C . ARG 383 383 ? A 0.398 12.803 26.295 1.000 1 A 40.290 1 ATOM 2815 C CB . ARG 383 383 ? A -1.239 13.106 28.196 1.000 1 A 40.290 1 ATOM 2816 O O . ARG 383 383 ? A 1.078 13.792 26.551 1.000 1 A 40.290 1 ATOM 2817 C CG . ARG 383 383 ? A -2.415 12.427 28.912 1.000 1 A 40.290 1 ATOM 2818 C CD . ARG 383 383 ? A -3.266 13.443 29.685 1.000 1 A 40.290 1 ATOM 2819 N NE . ARG 383 383 ? A -2.763 13.668 31.058 1.000 1 A 40.290 1 ATOM 2820 N NH1 . ARG 383 383 ? A -3.806 15.681 31.420 1.000 1 A 40.290 1 ATOM 2821 N NH2 . ARG 383 383 ? A -2.690 14.701 33.088 1.000 1 A 40.290 1 ATOM 2822 C CZ . ARG 383 383 ? A -3.086 14.680 31.845 1.000 1 A 40.290 1 ATOM 2823 N N . THR 384 384 ? A 0.403 12.216 25.108 1.000 1 A 48.290 1 ATOM 2824 C CA . THR 384 384 ? A 0.799 12.930 23.902 1.000 1 A 48.290 1 ATOM 2825 C C . THR 384 384 ? A -0.491 13.500 23.353 1.000 1 A 48.290 1 ATOM 2826 C CB . THR 384 384 ? A 1.601 12.067 22.912 1.000 1 A 48.290 1 ATOM 2827 O O . THR 384 384 ? A -1.221 12.842 22.620 1.000 1 A 48.290 1 ATOM 2828 C CG2 . THR 384 384 ? A 2.975 11.719 23.490 1.000 1 A 48.290 1 ATOM 2829 O OG1 . THR 384 384 ? A 0.995 10.838 22.601 1.000 1 A 48.290 1 ATOM 2830 N N . ASP 385 385 ? A -0.812 14.711 23.802 1.000 1 A 40.500 1 ATOM 2831 C CA . ASP 385 385 ? A -1.840 15.536 23.182 1.000 1 A 40.500 1 ATOM 2832 C C . ASP 385 385 ? A -1.305 15.943 21.807 1.000 1 A 40.500 1 ATOM 2833 C CB . ASP 385 385 ? A -2.181 16.744 24.073 1.000 1 A 40.500 1 ATOM 2834 O O . ASP 385 385 ? A -0.725 17.010 21.619 1.000 1 A 40.500 1 ATOM 2835 C CG . ASP 385 385 ? A -2.862 16.351 25.391 1.000 1 A 40.500 1 ATOM 2836 O OD1 . ASP 385 385 ? A -3.649 15.380 25.391 1.000 1 A 40.500 1 ATOM 2837 O OD2 . ASP 385 385 ? A -2.566 17.003 26.418 1.000 1 A 40.500 1 ATOM 2838 N N . ASN 386 386 ? A -1.433 15.039 20.839 1.000 1 A 36.870 1 ATOM 2839 C CA . ASN 386 386 ? A -1.186 15.327 19.436 1.000 1 A 36.870 1 ATOM 2840 C C . ASN 386 386 ? A -2.468 15.945 18.863 1.000 1 A 36.870 1 ATOM 2841 C CB . ASN 386 386 ? A -0.653 14.058 18.731 1.000 1 A 36.870 1 ATOM 2842 O O . ASN 386 386 ? A -3.144 15.371 18.015 1.000 1 A 36.870 1 ATOM 2843 C CG . ASN 386 386 ? A 0.590 14.294 17.886 1.000 1 A 36.870 1 ATOM 2844 N ND2 . ASN 386 386 ? A 1.013 13.297 17.147 1.000 1 A 36.870 1 ATOM 2845 O OD1 . ASN 386 386 ? A 1.229 15.333 17.895 1.000 1 A 36.870 1 ATOM 2846 N N . THR 387 387 ? A -2.843 17.110 19.391 1.000 1 A 43.650 1 ATOM 2847 C CA . THR 387 387 ? A -3.862 17.961 18.777 1.000 1 A 43.650 1 ATOM 2848 C C . THR 387 387 ? A -3.143 18.796 17.720 1.000 1 A 43.650 1 ATOM 2849 C CB . THR 387 387 ? A -4.563 18.856 19.808 1.000 1 A 43.650 1 ATOM 2850 O O . THR 387 387 ? A -2.334 19.651 18.091 1.000 1 A 43.650 1 ATOM 2851 C CG2 . THR 387 387 ? A -5.684 19.684 19.177 1.000 1 A 43.650 1 ATOM 2852 O OG1 . THR 387 387 ? A -5.165 18.047 20.790 1.000 1 A 43.650 1 ATOM 2853 N N . PRO 388 388 ? A -3.378 18.576 16.413 1.000 1 A 42.310 1 ATOM 2854 C CA . PRO 388 388 ? A -2.784 19.411 15.387 1.000 1 A 42.310 1 ATOM 2855 C C . PRO 388 388 ? A -3.358 20.819 15.529 1.000 1 A 42.310 1 ATOM 2856 C CB . PRO 388 388 ? A -3.100 18.737 14.050 1.000 1 A 42.310 1 ATOM 2857 O O . PRO 388 388 ? A -4.548 21.070 15.328 1.000 1 A 42.310 1 ATOM 2858 C CG . PRO 388 388 ? A -4.382 17.958 14.339 1.000 1 A 42.310 1 ATOM 2859 C CD . PRO 388 388 ? A -4.266 17.589 15.818 1.000 1 A 42.310 1 ATOM 2860 N N . ALA 389 389 ? A -2.489 21.740 15.931 1.000 1 A 39.660 1 ATOM 2861 C CA . ALA 389 389 ? A -2.772 23.156 15.937 1.000 1 A 39.660 1 ATOM 2862 C C . ALA 389 389 ? A -3.078 23.614 14.504 1.000 1 A 39.660 1 ATOM 2863 C CB . ALA 389 389 ? A -1.567 23.888 16.542 1.000 1 A 39.660 1 ATOM 2864 O O . ALA 389 389 ? A -2.224 23.555 13.626 1.000 1 A 39.660 1 ATOM 2865 N N . GLY 390 390 ? A -4.304 24.088 14.303 1.000 1 A 34.620 1 ATOM 2866 C CA . GLY 390 390 ? A -4.625 25.142 13.349 1.000 1 A 34.620 1 ATOM 2867 C C . GLY 390 390 ? A -4.324 24.867 11.877 1.000 1 A 34.620 1 ATOM 2868 O O . GLY 390 390 ? A -3.345 25.371 11.339 1.000 1 A 34.620 1 ATOM 2869 N N . VAL 391 391 ? A -5.287 24.275 11.173 1.000 1 A 39.780 1 ATOM 2870 C CA . VAL 391 391 ? A -5.614 24.772 9.832 1.000 1 A 39.780 1 ATOM 2871 C C . VAL 391 391 ? A -7.054 25.258 9.873 1.000 1 A 39.780 1 ATOM 2872 C CB . VAL 391 391 ? A -5.307 23.783 8.698 1.000 1 A 39.780 1 ATOM 2873 O O . VAL 391 391 ? A -7.984 24.530 10.215 1.000 1 A 39.780 1 ATOM 2874 C CG1 . VAL 391 391 ? A -5.634 24.415 7.336 1.000 1 A 39.780 1 ATOM 2875 C CG2 . VAL 391 391 ? A -3.813 23.429 8.693 1.000 1 A 39.780 1 ATOM 2876 N N . LYS 392 392 ? A -7.179 26.561 9.635 1.000 1 A 41.920 1 ATOM 2877 C CA . LYS 392 392 ? A -8.395 27.362 9.644 1.000 1 A 41.920 1 ATOM 2878 C C . LYS 392 392 ? A -9.493 26.673 8.828 1.000 1 A 41.920 1 ATOM 2879 C CB . LYS 392 392 ? A -8.046 28.720 9.005 1.000 1 A 41.920 1 ATOM 2880 O O . LYS 392 392 ? A -9.357 26.526 7.619 1.000 1 A 41.920 1 ATOM 2881 C CG . LYS 392 392 ? A -7.034 29.563 9.803 1.000 1 A 41.920 1 ATOM 2882 C CD . LYS 392 392 ? A -6.556 30.740 8.942 1.000 1 A 41.920 1 ATOM 2883 C CE . LYS 392 392 ? A -5.634 31.686 9.716 1.000 1 A 41.920 1 ATOM 2884 N NZ . LYS 392 392 ? A -5.196 32.805 8.846 1.000 1 A 41.920 1 ATOM 2885 N N . ARG 393 393 ? A -10.606 26.319 9.475 1.000 1 A 39.890 1 ATOM 2886 C CA . ARG 393 393 ? A -11.901 26.305 8.789 1.000 1 A 39.890 1 ATOM 2887 C C . ARG 393 393 ? A -12.291 27.765 8.619 1.000 1 A 39.890 1 ATOM 2888 C CB . ARG 393 393 ? A -12.968 25.520 9.571 1.000 1 A 39.890 1 ATOM 2889 O O . ARG 393 393 ? A -12.803 28.372 9.558 1.000 1 A 39.890 1 ATOM 2890 C CG . ARG 393 393 ? A -12.728 24.005 9.554 1.000 1 A 39.890 1 ATOM 2891 C CD . ARG 393 393 ? A -13.922 23.277 10.186 1.000 1 A 39.890 1 ATOM 2892 N NE . ARG 393 393 ? A -13.608 21.859 10.452 1.000 1 A 39.890 1 ATOM 2893 N NH1 . ARG 393 393 ? A -13.587 21.931 12.755 1.000 1 A 39.890 1 ATOM 2894 N NH2 . ARG 393 393 ? A -13.145 20.016 11.705 1.000 1 A 39.890 1 ATOM 2895 C CZ . ARG 393 393 ? A -13.448 21.281 11.632 1.000 1 A 39.890 1 ATOM 2896 N N . GLU 394 394 ? A -11.944 28.347 7.476 1.000 1 A 40.340 1 ATOM 2897 C CA . GLU 394 394 ? A -12.640 29.551 7.045 1.000 1 A 40.340 1 ATOM 2898 C C . GLU 394 394 ? A -14.113 29.204 6.855 1.000 1 A 40.340 1 ATOM 2899 C CB . GLU 394 394 ? A -12.039 30.188 5.786 1.000 1 A 40.340 1 ATOM 2900 O O . GLU 394 394 ? A -14.482 28.174 6.291 1.000 1 A 40.340 1 ATOM 2901 C CG . GLU 394 394 ? A -10.917 31.166 6.162 1.000 1 A 40.340 1 ATOM 2902 C CD . GLU 394 394 ? A -10.535 32.122 5.024 1.000 1 A 40.340 1 ATOM 2903 O OE1 . GLU 394 394 ? A -9.970 33.187 5.369 1.000 1 A 40.340 1 ATOM 2904 O OE2 . GLU 394 394 ? A -10.727 31.754 3.847 1.000 1 A 40.340 1 ATOM 2905 N N . GLN 395 395 ? A -14.928 30.049 7.463 1.000 1 A 38.520 1 ATOM 2906 C CA . GLN 395 395 ? A -16.362 30.085 7.309 1.000 1 A 38.520 1 ATOM 2907 C C . GLN 395 395 ? A -16.713 30.831 6.020 1.000 1 A 38.520 1 ATOM 2908 C CB . GLN 395 395 ? A -16.962 30.832 8.505 1.000 1 A 38.520 1 ATOM 2909 O O . GLN 395 395 ? A -15.995 31.749 5.634 1.000 1 A 38.520 1 ATOM 2910 C CG . GLN 395 395 ? A -16.621 30.211 9.868 1.000 1 A 38.520 1 ATOM 2911 C CD . GLN 395 395 ? A -17.549 30.713 10.970 1.000 1 A 38.520 1 ATOM 2912 N NE2 . GLN 395 395 ? A -17.336 30.315 12.203 1.000 1 A 38.520 1 ATOM 2913 O OE1 . GLN 395 395 ? A -18.497 31.448 10.764 1.000 1 A 38.520 1 ATOM 2914 N N . GLY 396 396 ? A -17.869 30.497 5.448 1.000 1 A 37.440 1 ATOM 2915 C CA . GLY 396 396 ? A -18.499 31.230 4.347 1.000 1 A 37.440 1 ATOM 2916 C C . GLY 396 396 ? A -18.422 30.441 3.038 1.000 1 A 37.440 1 ATOM 2917 O O . GLY 396 396 ? A -17.354 30.002 2.653 1.000 1 A 37.440 1 ATOM 2918 N N . GLU 397 397 ? A -19.492 30.164 2.305 1.000 1 A 40.860 1 ATOM 2919 C CA . GLU 397 397 ? A -20.841 30.704 2.352 1.000 1 A 40.860 1 ATOM 2920 C C . GLU 397 397 ? A -21.847 29.663 1.852 1.000 1 A 40.860 1 ATOM 2921 C CB . GLU 397 397 ? A -20.942 31.953 1.463 1.000 1 A 40.860 1 ATOM 2922 O O . GLU 397 397 ? A -21.570 28.842 0.978 1.000 1 A 40.860 1 ATOM 2923 C CG . GLU 397 397 ? A -20.164 33.150 2.024 1.000 1 A 40.860 1 ATOM 2924 C CD . GLU 397 397 ? A -20.598 34.469 1.371 1.000 1 A 40.860 1 ATOM 2925 O OE1 . GLU 397 397 ? A -20.618 35.483 2.106 1.000 1 A 40.860 1 ATOM 2926 O OE2 . GLU 397 397 ? A -20.919 34.457 0.163 1.000 1 A 40.860 1 ATOM 2927 N N . LEU 398 398 ? A -23.041 29.744 2.428 1.000 1 A 38.570 1 ATOM 2928 C CA . LEU 398 398 ? A -24.281 29.268 1.839 1.000 1 A 38.570 1 ATOM 2929 C C . LEU 398 398 ? A -24.523 30.035 0.531 1.000 1 A 38.570 1 ATOM 2930 C CB . LEU 398 398 ? A -25.403 29.615 2.841 1.000 1 A 38.570 1 ATOM 2931 O O . LEU 398 398 ? A -24.680 31.252 0.574 1.000 1 A 38.570 1 ATOM 2932 C CG . LEU 398 398 ? A -25.427 28.742 4.108 1.000 1 A 38.570 1 ATOM 2933 C CD1 . LEU 398 398 ? A -25.919 29.542 5.317 1.000 1 A 38.570 1 ATOM 2934 C CD2 . LEU 398 398 ? A -26.363 27.551 3.905 1.000 1 A 38.570 1 ATOM 2935 N N . LEU 399 399 ? A -24.648 29.339 -0.598 1.000 1 A 43.980 1 ATOM 2936 C CA . LEU 399 399 ? A -25.405 29.850 -1.741 1.000 1 A 43.980 1 ATOM 2937 C C . LEU 399 399 ? A -26.643 28.964 -1.945 1.000 1 A 43.980 1 ATOM 2938 C CB . LEU 399 399 ? A -24.540 29.952 -3.008 1.000 1 A 43.980 1 ATOM 2939 O O . LEU 399 399 ? A -26.489 27.750 -2.082 1.000 1 A 43.980 1 ATOM 2940 C CG . LEU 399 399 ? A -23.513 31.103 -2.994 1.000 1 A 43.980 1 ATOM 2941 C CD1 . LEU 399 399 ? A -22.777 31.120 -4.335 1.000 1 A 43.980 1 ATOM 2942 C CD2 . LEU 399 399 ? A -24.148 32.486 -2.805 1.000 1 A 43.980 1 ATOM 2943 N N . PRO 400 400 ? A -27.861 29.537 -1.928 1.000 1 A 39.290 1 ATOM 2944 C CA . PRO 400 400 ? A -29.099 28.815 -2.179 1.000 1 A 39.290 1 ATOM 2945 C C . PRO 400 400 ? A -29.534 28.935 -3.651 1.000 1 A 39.290 1 ATOM 2946 C CB . PRO 400 400 ? A -30.105 29.474 -1.230 1.000 1 A 39.290 1 ATOM 2947 O O . PRO 400 400 ? A -29.705 30.043 -4.163 1.000 1 A 39.290 1 ATOM 2948 C CG . PRO 400 400 ? A -29.669 30.941 -1.200 1.000 1 A 39.290 1 ATOM 2949 C CD . PRO 400 400 ? A -28.168 30.896 -1.492 1.000 1 A 39.290 1 ATOM 2950 N N . SER 401 401 ? A -29.775 27.800 -4.309 1.000 1 A 40.630 1 ATOM 2951 C CA . SER 401 401 ? A -30.836 27.546 -5.308 1.000 1 A 40.630 1 ATOM 2952 C C . SER 401 401 ? A -30.825 26.082 -5.709 1.000 1 A 40.630 1 ATOM 2953 C CB . SER 401 401 ? A -30.719 28.371 -6.584 1.000 1 A 40.630 1 ATOM 2954 O O . SER 401 401 ? A -29.712 25.559 -5.936 1.000 1 A 40.630 1 ATOM 2955 O OG . SER 401 401 ? A -31.327 29.613 -6.321 1.000 1 A 40.630 1 ATOM 2956 O OXT . SER 401 401 ? A -31.947 25.538 -5.744 1.000 1 A 40.630 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-ornl-sphdiv-21650 https://modelarchive.org/api/projects/ma-ornl-sphdiv-21650?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 1 1 ma-ornl-sphdiv-21650_predicted_aligned_error_v1.cif cif 'local pairwise QA scores' 'Predicted aligned error' 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 . pLDDT local . 1 2 pLDDT . pLDDT global . 1 3 PAE . PAE local-pairwise . 1 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 2 55.120 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 1 36.340 2 1 A 2 GLY 1 37.930 3 1 A 3 ALA 1 38.590 4 1 A 4 ALA 1 42.010 5 1 A 5 GLY 1 34.810 6 1 A 6 GLU 1 42.880 7 1 A 7 THR 1 42.010 8 1 A 8 GLY 1 44.180 9 1 A 9 THR 1 35.800 10 1 A 10 THR 1 37.170 11 1 A 11 ALA 1 34.780 12 1 A 12 ALA 1 40.510 13 1 A 13 VAL 1 37.430 14 1 A 14 SER 1 32.470 15 1 A 15 LYS 1 38.830 16 1 A 16 ALA 1 31.920 17 1 A 17 SER 1 32.880 18 1 A 18 LYS 1 33.690 19 1 A 19 GLY 1 28.700 20 1 A 20 GLY 1 30.700 21 1 A 21 ALA 1 31.710 22 1 A 22 ALA 1 36.720 23 1 A 23 ALA 1 36.370 24 1 A 24 ALA 1 38.540 25 1 A 25 VAL 1 43.550 26 1 A 26 THR 1 45.740 27 1 A 27 ALA 1 56.800 28 1 A 28 ALA 1 60.790 29 1 A 29 PRO 1 63.490 30 1 A 30 PRO 1 64.300 31 1 A 31 SER 1 77.990 32 1 A 32 THR 1 82.750 33 1 A 33 TYR 1 83.740 34 1 A 34 ALA 1 84.570 35 1 A 35 GLU 1 77.880 36 1 A 36 TRP 1 84.750 37 1 A 37 ALA 1 84.290 38 1 A 38 ALA 1 82.840 39 1 A 39 ALA 1 81.730 40 1 A 40 PHE 1 80.680 41 1 A 41 GLN 1 80.870 42 1 A 42 ALA 1 73.870 43 1 A 43 TYR 1 73.420 44 1 A 44 TYR 1 74.090 45 1 A 45 SER 1 69.360 46 1 A 46 ALA 1 60.440 47 1 A 47 GLY 1 60.150 48 1 A 48 GLY 1 50.930 49 1 A 49 GLN 1 54.260 50 1 A 50 PRO 1 53.530 51 1 A 51 PRO 1 50.590 52 1 A 52 PRO 1 44.160 53 1 A 53 GLY 1 43.470 54 1 A 54 ALA 1 42.970 55 1 A 55 ALA 1 41.300 56 1 A 56 PHE 1 40.620 57 1 A 57 ALA 1 42.900 58 1 A 58 GLY 1 39.260 59 1 A 59 HIS 1 38.300 60 1 A 60 PRO 1 46.960 61 1 A 61 TYR 1 45.260 62 1 A 62 MET 1 47.140 63 1 A 63 TRP 1 53.070 64 1 A 64 GLY 1 44.420 65 1 A 65 GLY 1 43.640 66 1 A 66 GLN 1 43.830 67 1 A 67 PRO 1 50.300 68 1 A 68 MET 1 52.550 69 1 A 69 MET 1 51.670 70 1 A 70 PRO 1 51.380 71 1 A 71 PRO 1 51.560 72 1 A 72 TYR 1 42.850 73 1 A 73 GLY 1 46.080 74 1 A 74 THR 1 43.430 75 1 A 75 PRO 1 42.310 76 1 A 76 HIS 1 45.810 77 1 A 77 PRO 1 50.630 78 1 A 78 GLN 1 44.330 79 1 A 79 TYR 1 37.640 80 1 A 80 GLY 1 41.420 81 1 A 81 ALA 1 45.870 82 1 A 82 MET 1 44.430 83 1 A 83 TYR 1 37.550 84 1 A 84 HIS 1 51.530 85 1 A 85 PRO 1 44.510 86 1 A 86 ALA 1 41.770 87 1 A 87 GLY 1 48.380 88 1 A 88 MET 1 42.560 89 1 A 89 TYR 1 39.730 90 1 A 90 ALA 1 41.710 91 1 A 91 HIS 1 39.400 92 1 A 92 PRO 1 50.020 93 1 A 93 ALA 1 46.290 94 1 A 94 MET 1 44.790 95 1 A 95 TYR 1 42.650 96 1 A 96 GLY 1 39.190 97 1 A 97 GLN 1 34.740 98 1 A 98 TYR 1 37.720 99 1 A 99 GLY 1 33.940 100 1 A 100 LEU 1 39.860 101 1 A 101 GLN 1 34.270 102 1 A 102 SER 1 34.620 103 1 A 103 ASP 1 32.300 104 1 A 104 THR 1 40.440 105 1 A 105 MET 1 35.530 106 1 A 106 MET 1 37.360 107 1 A 107 ASN 1 37.990 108 1 A 108 SER 1 31.060 109 1 A 109 ASP 1 34.010 110 1 A 110 GLN 1 29.870 111 1 A 111 THR 1 32.430 112 1 A 112 GLU 1 30.200 113 1 A 113 THR 1 34.340 114 1 A 114 LYS 1 27.560 115 1 A 115 PRO 1 41.030 116 1 A 116 GLU 1 25.460 117 1 A 117 LEU 1 40.600 118 1 A 118 LYS 1 29.440 119 1 A 119 ASP 1 29.460 120 1 A 120 THR 1 32.840 121 1 A 121 ASP 1 27.600 122 1 A 122 SER 1 28.930 123 1 A 123 GLY 1 29.610 124 1 A 124 LYS 1 29.030 125 1 A 125 ASN 1 29.330 126 1 A 126 GLN 1 30.040 127 1 A 127 ALA 1 30.580 128 1 A 128 GLN 1 30.670 129 1 A 129 LYS 1 31.260 130 1 A 130 GLN 1 34.520 131 1 A 131 SER 1 41.040 132 1 A 132 PRO 1 40.500 133 1 A 133 LEU 1 43.250 134 1 A 134 LYS 1 37.170 135 1 A 135 ARG 1 38.090 136 1 A 136 SER 1 42.620 137 1 A 137 GLN 1 42.840 138 1 A 138 GLY 1 40.930 139 1 A 139 SER 1 44.220 140 1 A 140 LYS 1 45.430 141 1 A 141 GLY 1 47.060 142 1 A 142 SER 1 48.920 143 1 A 143 LEU 1 49.130 144 1 A 144 ALA 1 50.430 145 1 A 145 MET 1 51.620 146 1 A 146 ILE 1 55.860 147 1 A 147 ILE 1 50.580 148 1 A 148 GLY 1 37.040 149 1 A 149 GLY 1 38.420 150 1 A 150 LYS 1 38.120 151 1 A 151 GLY 1 34.610 152 1 A 152 SER 1 38.450 153 1 A 153 GLU 1 34.000 154 1 A 154 GLY 1 33.690 155 1 A 155 GLU 1 33.740 156 1 A 156 LYS 1 36.120 157 1 A 157 GLY 1 31.500 158 1 A 158 ASN 1 37.520 159 1 A 159 GLY 1 34.520 160 1 A 160 GLY 1 34.930 161 1 A 161 VAL 1 38.360 162 1 A 162 VAL 1 43.810 163 1 A 163 MET 1 44.440 164 1 A 164 SER 1 39.540 165 1 A 165 HIS 1 45.920 166 1 A 166 SER 1 45.610 167 1 A 167 SER 1 50.820 168 1 A 168 ASN 1 51.340 169 1 A 169 GLY 1 40.100 170 1 A 170 ASP 1 47.990 171 1 A 171 ASP 1 46.930 172 1 A 172 ASN 1 53.120 173 1 A 173 GLU 1 48.790 174 1 A 174 ASN 1 52.640 175 1 A 175 GLU 1 48.130 176 1 A 176 SER 1 52.680 177 1 A 177 GLY 1 38.140 178 1 A 178 SER 1 40.530 179 1 A 179 GLU 1 41.970 180 1 A 180 GLY 1 41.600 181 1 A 181 SER 1 38.540 182 1 A 182 THR 1 45.490 183 1 A 183 GLY 1 39.110 184 1 A 184 GLY 1 38.430 185 1 A 185 SER 1 45.210 186 1 A 186 GLU 1 38.750 187 1 A 187 GLU 1 40.130 188 1 A 188 ASN 1 42.880 189 1 A 189 LYS 1 41.250 190 1 A 190 ASN 1 36.430 191 1 A 191 GLU 1 42.250 192 1 A 192 GLN 1 36.900 193 1 A 193 HIS 1 35.270 194 1 A 194 ASN 1 36.940 195 1 A 195 ARG 1 38.520 196 1 A 196 GLN 1 31.800 197 1 A 197 LYS 1 36.540 198 1 A 198 VAL 1 41.070 199 1 A 199 ASN 1 38.200 200 1 A 200 LEU 1 38.420 201 1 A 201 GLY 1 36.150 202 1 A 202 GLU 1 35.170 203 1 A 203 VAL 1 39.960 204 1 A 204 ALA 1 36.480 205 1 A 205 THR 1 41.290 206 1 A 206 ASP 1 33.320 207 1 A 207 ALA 1 32.640 208 1 A 208 THR 1 37.870 209 1 A 209 GLY 1 31.500 210 1 A 210 VAL 1 41.250 211 1 A 211 GLU 1 31.180 212 1 A 212 SER 1 30.800 213 1 A 213 TYR 1 33.550 214 1 A 214 GLY 1 34.660 215 1 A 215 ALA 1 31.790 216 1 A 216 HIS 1 33.580 217 1 A 217 PRO 1 38.670 218 1 A 218 VAL 1 37.450 219 1 A 219 GLN 1 33.000 220 1 A 220 SER 1 30.820 221 1 A 221 VAL 1 39.750 222 1 A 222 SER 1 34.490 223 1 A 223 GLY 1 33.830 224 1 A 224 THR 1 37.420 225 1 A 225 PRO 1 38.980 226 1 A 226 ALA 1 44.150 227 1 A 227 ALA 1 45.300 228 1 A 228 GLY 1 42.700 229 1 A 229 GLY 1 42.650 230 1 A 230 SER 1 49.090 231 1 A 231 LEU 1 52.210 232 1 A 232 ASP 1 58.210 233 1 A 233 MET 1 56.630 234 1 A 234 SER 1 56.050 235 1 A 235 LEU 1 63.280 236 1 A 236 ASP 1 62.530 237 1 A 237 HIS 1 57.160 238 1 A 238 TRP 1 62.660 239 1 A 239 ASN 1 62.580 240 1 A 240 ALA 1 54.570 241 1 A 241 GLY 1 52.390 242 1 A 242 ASN 1 54.880 243 1 A 243 ALA 1 42.550 244 1 A 244 PRO 1 46.100 245 1 A 245 VAL 1 43.220 246 1 A 246 LYS 1 40.950 247 1 A 247 THR 1 37.660 248 1 A 248 GLY 1 36.780 249 1 A 249 LYS 1 39.140 250 1 A 250 GLN 1 37.880 251 1 A 251 MET 1 40.470 252 1 A 252 SER 1 42.830 253 1 A 253 ALA 1 48.560 254 1 A 254 SER 1 44.870 255 1 A 255 PRO 1 51.580 256 1 A 256 SER 1 47.770 257 1 A 257 VAL 1 52.500 258 1 A 258 ASN 1 52.840 259 1 A 259 ALA 1 59.120 260 1 A 260 THR 1 63.740 261 1 A 261 PRO 1 68.550 262 1 A 262 PRO 1 73.840 263 1 A 263 ALA 1 76.060 264 1 A 264 ASP 1 77.770 265 1 A 265 LEU 1 81.440 266 1 A 266 TRP 1 83.990 267 1 A 267 LEU 1 84.440 268 1 A 268 GLN 1 89.000 269 1 A 269 ASP 1 92.210 270 1 A 270 GLU 1 94.910 271 1 A 271 ARG 1 94.850 272 1 A 272 GLU 1 95.610 273 1 A 273 VAL 1 96.200 274 1 A 274 LYS 1 96.740 275 1 A 275 ARG 1 96.220 276 1 A 276 GLN 1 97.600 277 1 A 277 ARG 1 98.140 278 1 A 278 ARG 1 97.000 279 1 A 279 LYS 1 98.300 280 1 A 280 GLN 1 98.220 281 1 A 281 SER 1 98.350 282 1 A 282 ASN 1 98.540 283 1 A 283 ARG 1 98.560 284 1 A 284 GLU 1 98.460 285 1 A 285 SER 1 98.290 286 1 A 286 ALA 1 98.470 287 1 A 287 ARG 1 98.660 288 1 A 288 ARG 1 98.610 289 1 A 289 SER 1 98.620 290 1 A 290 ARG 1 98.640 291 1 A 291 LEU 1 98.600 292 1 A 292 ARG 1 98.700 293 1 A 293 LYS 1 98.720 294 1 A 294 GLN 1 98.780 295 1 A 295 ALA 1 98.670 296 1 A 296 GLU 1 98.600 297 1 A 297 CYS 1 98.660 298 1 A 298 GLU 1 98.700 299 1 A 299 GLU 1 98.670 300 1 A 300 LEU 1 98.820 301 1 A 301 GLY 1 98.780 302 1 A 302 ALA 1 98.720 303 1 A 303 ARG 1 98.790 304 1 A 304 VAL 1 98.850 305 1 A 305 ASP 1 98.780 306 1 A 306 THR 1 98.820 307 1 A 307 LEU 1 98.840 308 1 A 308 ALA 1 98.840 309 1 A 309 VAL 1 98.810 310 1 A 310 GLU 1 98.780 311 1 A 311 ASN 1 98.760 312 1 A 312 LEU 1 98.800 313 1 A 313 ALA 1 98.740 314 1 A 314 LEU 1 98.830 315 1 A 315 ARG 1 98.760 316 1 A 316 ASN 1 98.730 317 1 A 317 GLU 1 98.720 318 1 A 318 LEU 1 98.760 319 1 A 319 ALA 1 98.540 320 1 A 320 TRP 1 98.630 321 1 A 321 PHE 1 98.610 322 1 A 322 THR 1 98.650 323 1 A 323 GLU 1 98.670 324 1 A 324 GLU 1 98.620 325 1 A 325 CYS 1 98.560 326 1 A 326 LYS 1 98.610 327 1 A 327 ARG 1 98.520 328 1 A 328 LEU 1 98.620 329 1 A 329 GLU 1 98.550 330 1 A 330 ALA 1 98.380 331 1 A 331 ALA 1 98.300 332 1 A 332 ASN 1 98.370 333 1 A 333 ALA 1 98.180 334 1 A 334 SER 1 98.070 335 1 A 335 LEU 1 98.110 336 1 A 336 VAL 1 98.160 337 1 A 337 GLU 1 96.990 338 1 A 338 GLN 1 97.080 339 1 A 339 MET 1 96.670 340 1 A 340 ARG 1 96.290 341 1 A 341 ASN 1 95.470 342 1 A 342 THR 1 95.740 343 1 A 343 SER 1 93.960 344 1 A 344 LYS 1 92.560 345 1 A 345 ASP 1 91.640 346 1 A 346 VAL 1 88.110 347 1 A 347 ALA 1 83.200 348 1 A 348 ASP 1 77.260 349 1 A 349 THR 1 74.740 350 1 A 350 SER 1 64.820 351 1 A 351 ALA 1 62.150 352 1 A 352 THR 1 52.730 353 1 A 353 PRO 1 53.950 354 1 A 354 GLU 1 44.070 355 1 A 355 ALA 1 44.000 356 1 A 356 SER 1 43.380 357 1 A 357 ALA 1 41.420 358 1 A 358 VAL 1 41.610 359 1 A 359 VAL 1 37.350 360 1 A 360 GLY 1 39.890 361 1 A 361 GLN 1 39.610 362 1 A 362 ASP 1 39.500 363 1 A 363 ALA 1 41.710 364 1 A 364 PRO 1 43.480 365 1 A 365 ALA 1 39.460 366 1 A 366 ASN 1 44.200 367 1 A 367 LYS 1 43.500 368 1 A 368 HIS 1 35.200 369 1 A 369 GLU 1 41.520 370 1 A 370 GLU 1 40.480 371 1 A 371 THR 1 48.030 372 1 A 372 GLU 1 35.150 373 1 A 373 SER 1 42.530 374 1 A 374 LYS 1 41.690 375 1 A 375 SER 1 39.640 376 1 A 376 GLN 1 41.750 377 1 A 377 GLY 1 34.130 378 1 A 378 ASN 1 39.260 379 1 A 379 GLY 1 38.030 380 1 A 380 ASN 1 38.210 381 1 A 381 VAL 1 42.540 382 1 A 382 LYS 1 45.520 383 1 A 383 ARG 1 40.290 384 1 A 384 THR 1 48.290 385 1 A 385 ASP 1 40.500 386 1 A 386 ASN 1 36.870 387 1 A 387 THR 1 43.650 388 1 A 388 PRO 1 42.310 389 1 A 389 ALA 1 39.660 390 1 A 390 GLY 1 34.620 391 1 A 391 VAL 1 39.780 392 1 A 392 LYS 1 41.920 393 1 A 393 ARG 1 39.890 394 1 A 394 GLU 1 40.340 395 1 A 395 GLN 1 38.520 396 1 A 396 GLY 1 37.440 397 1 A 397 GLU 1 40.860 398 1 A 398 LEU 1 38.570 399 1 A 399 LEU 1 43.980 400 1 A 400 PRO 1 39.290 401 1 A 401 SER 1 40.630 _database_2.database_id ModelArchive _database_2.database_code ma-ornl-sphdiv-21650 _database_2.pdbx_DOI 10.5452/ma-ornl-sphdiv-21650 _pdbx_database_status.entry_id ma-ornl-sphdiv-21650 _pdbx_database_status.date_coordinates 2022-09-29:02:50 _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 1 Dr. Mu Gao . mu.gao@gatech.edu 'Center for the Study of Systems Biology, Georgia Institute of Technology, Atlanta, GA USA' . . 7 Dr. Ada Sedova . sedovaaa@ornl.gov 'Biosciences Division, Oak Ridge National Laboratory, Oak Ridge, TN USA' . . 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 2022-09-28 2 'Structure model' 1 1 2023-06-08 3 'Structure model' 1 2 2023-06-22 4 'Structure model' 1 3 2023-07-17 5 'Structure model' 1 4 2023-07-23 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' ? 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' 'Database references' 2 2 'Structure model' 'Source and taxonomy' 3 3 'Structure model' 'Version format compliance' 4 4 'Structure model' Other 5 5 'Structure model' Other 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' ma_target_ref_db_details 2 3 'Structure model' audit_conform 3 4 'Structure model' ma_associated_archive_file_details 4 5 'Structure model' exptl 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' '_ma_target_ref_db_details.ncbi_taxonomy_id' 2 2 'Structure model' '_ma_target_ref_db_details.organism_scientific' 3 3 'Structure model' '_audit_conform.dict_location' 4 3 'Structure model' '_audit_conform.dict_version' 5 4 'Structure model' '_ma_associated_archive_file_details.file_path' 6 5 'Structure model' '_exptl.entry_id' 7 5 'Structure model' '_exptl.method'