data_3N42 # _entry.id 3N42 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3N42 RCSB RCSB059353 WWPDB D_1000059353 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 2ALA 'Crystal structure of the Semliki Forest Virus envelope protein E1 in its monomeric conformation.' unspecified PDB 1RER 'Crystal structure of the homotrimer of fusion glycoprotein E1 from Semliki Forest Virus.' unspecified EMDB EMD-1121 'Mapping the structure and function of the E1 and E2 glycoproteins in alphaviruses (Sindbis virus).' unspecified EMDB EMD-1015 'Cryo-electron microscopy reveals the functional organization of an enveloped virus, Semliki Forest virus.' unspecified PDB 3MUU 'Crystal structure of the Sindbis virus E2-E1 heterodimer at low pH.' unspecified PDB 3MUW 'Pseudo-atomic structure of the E2-E1 protein shell in Sindbis virus.' unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3N42 _pdbx_database_status.recvd_initial_deposition_date 2010-05-21 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Voss, J.' 1 'Vaney, M.C.' 2 'Duquerroy, S.' 3 'Rey, F.A.' 4 # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Glycoprotein organization of Chikungunya virus particles revealed by X-ray crystallography.' Nature 468 709 712 2010 NATUAS UK 0028-0836 0006 ? 21124458 10.1038/nature09555 1 'Structure and interactions at the viral surface of the envelope protein E1 of Semliki Forest virus.' Structure 14 75 86 2006 STRUE6 UK 0969-2126 2005 ? 16407067 10.1016/j.str.2005.09.014 2 'Conformational change and protein-protein interactions of the fusion protein of Semliki Forest virus.' Nature 427 320 325 2004 NATUAS UK 0028-0836 0006 ? 14737160 10.1038/nature02239 3 'The Fusion glycoprotein shell of Semliki Forest virus: an icosahedral assembly primed for fusogenic activation at endosomal pH.' 'Cell(Cambridge,Mass.)' 105 137 148 2001 CELLB5 US 0092-8674 0998 ? 11301009 ? 4 'Structural Changes of Envelope Proteins During Alphavirus Fusion.' 'To be Published' ? ? ? ? ? ? ? 0353 ? ? ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Voss, J.E.' 1 primary 'Vaney, M.C.' 2 primary 'Duquerroy, S.' 3 primary 'Vonrhein, C.' 4 primary 'Girard-Blanc, C.' 5 primary 'Crublet, E.' 6 primary 'Thompson, A.' 7 primary 'Bricogne, G.' 8 primary 'Rey, F.A.' 9 1 'Roussel, A.' 10 1 'Lescar, J.' 11 1 'Vaney, M.C.' 12 1 'Wengler, G.' 13 1 'Rey, F.A.' 14 2 'Gibbons, D.L.' 15 2 'Vaney, M.C.' 16 2 'Roussel, A.' 17 2 'Vigouroux, A.' 18 2 'Reilly, B.' 19 2 'Lepault, J.' 20 2 'Kielian, M.' 21 2 'Rey, F.A.' 22 3 'Lescar, J.' 23 3 'Roussel, A.' 24 3 'Wien, M.W.' 25 3 'Navaza, J.' 26 3 'Fuller, S.D.' 27 3 'Wengler, G.' 28 3 'Rey, F.A.' 29 4 'Li, L.' 30 4 'Jose, J.' 31 4 'Xiang, Y.' 32 4 'Kuhn, R.J.' 33 4 'Rossmann, M.G.' 34 # _cell.entry_id 3N42 _cell.length_a 58.391 _cell.length_b 90.678 _cell.length_c 178.410 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 3N42 _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'E3 envelope glycoprotein' 7470.737 1 ? ? 'polyprotein fragment residues 266-319' ? 2 polymer man 'E2 envelope glycoprotein' 40600.785 1 ? ? 'polyprotein fragment residues 330-667' ? 3 polymer man 'E1 envelope glycoprotein' 50356.223 1 ? ? 'polyprotein fragment residues 810-1202' ? 4 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 5 non-polymer man '2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE' 221.208 1 ? ? ? ? 6 water nat water 18.015 88 ? ? ? ? # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no MSLAIPVMCLLANTTFPCSQPPCTPCCYEKEPEETLRMLEDNVMRPGYYQLLQASLTCSPHRQRR MSLAIPVMCLLANTTFPCSQPPCTPCCYEKEPEETLRMLEDNVMRPGYYQLLQASLTCSPHRQRR A ? 2 'polypeptide(L)' no no ;STKDNFNVYKATRPYLAHCPDCGEGHSCHSPVALERIRNEATDGTLKIQVSLQIGIKTDDSHDWTKLRYMDNHMPADAER AGLFVRTSAPCTITGTMGHFILARCPKGETLTVGFTDSRKISHSCTHPFHHDPPVIGREKFHSRPQHGKELPCSTYVQST AATTEEIEVHMPPDTPDRTLMSQQSGNVKITVNGQTVRYKCNCGGSNEGLTTTDKVINNCKVDQCHAAVTNHKKWQYNSP LVPRNAELGDRKGKIHIPFPLANVTCRVPKARNPTVTYGKNQVIMLLYPDHPTLLSYRNMGEEPNYQEEWVMHKKEVVLT VPTEGLEVTWGNNEPYKYWPQLSTNGTAHGHPHEIILYYY ; ;STKDNFNVYKATRPYLAHCPDCGEGHSCHSPVALERIRNEATDGTLKIQVSLQIGIKTDDSHDWTKLRYMDNHMPADAER AGLFVRTSAPCTITGTMGHFILARCPKGETLTVGFTDSRKISHSCTHPFHHDPPVIGREKFHSRPQHGKELPCSTYVQST AATTEEIEVHMPPDTPDRTLMSQQSGNVKITVNGQTVRYKCNCGGSNEGLTTTDKVINNCKVDQCHAAVTNHKKWQYNSP LVPRNAELGDRKGKIHIPFPLANVTCRVPKARNPTVTYGKNQVIMLLYPDHPTLLSYRNMGEEPNYQEEWVMHKKEVVLT VPTEGLEVTWGNNEPYKYWPQLSTNGTAHGHPHEIILYYY ; B ? 3 'polypeptide(L)' no no ;ELYGGGGSGGGGSGGGGSGGGGYEHVTVIPNTVGVPYKTLVNRPGYSPMVLEMELLSVTLEPTLSLDYITCEYKTVIPSP YVKCCGTAECKDKNLPDYSCKVFTGVYPFMWGGAYCFCDAENTQLSEAHVEKSESCKTEFASAYRAHTASASAKLRVLYQ GNNITVTAYANGDHAVTVKDAKFIVGPMSSAWTPFDNKIVVYKGDVYNMDYPPFGAGRPGQFGDIQSRTPESKDVYANTQ LVLQRPAAGTVHVPYSQAPSGFKYWLKERGASLQHTAPFGCQIATNPVRAVNCAVGNMPISIDIPEAAFTRVVDAPSLTD MSCEVPACTHSSDFGGVAIIKYAASKKGKCAVHSMTNAVTIREAEIEVEGNSQLQISFSTALASAEFRVQVCSTQVHCAA ECHPPKDHIVNYPASHTTLGVQDISATAMSWVQKGPFEDDDDKAGWSHPQFEKGGGSGGGSGGGSWSHPQFEK ; ;ELYGGGGSGGGGSGGGGSGGGGYEHVTVIPNTVGVPYKTLVNRPGYSPMVLEMELLSVTLEPTLSLDYITCEYKTVIPSP YVKCCGTAECKDKNLPDYSCKVFTGVYPFMWGGAYCFCDAENTQLSEAHVEKSESCKTEFASAYRAHTASASAKLRVLYQ GNNITVTAYANGDHAVTVKDAKFIVGPMSSAWTPFDNKIVVYKGDVYNMDYPPFGAGRPGQFGDIQSRTPESKDVYANTQ LVLQRPAAGTVHVPYSQAPSGFKYWLKERGASLQHTAPFGCQIATNPVRAVNCAVGNMPISIDIPEAAFTRVVDAPSLTD MSCEVPACTHSSDFGGVAIIKYAASKKGKCAVHSMTNAVTIREAEIEVEGNSQLQISFSTALASAEFRVQVCSTQVHCAA ECHPPKDHIVNYPASHTTLGVQDISATAMSWVQKGPFEDDDDKAGWSHPQFEKGGGSGGGSGGGSWSHPQFEK ; F ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 MET n 1 2 SER n 1 3 LEU n 1 4 ALA n 1 5 ILE n 1 6 PRO n 1 7 VAL n 1 8 MET n 1 9 CYS n 1 10 LEU n 1 11 LEU n 1 12 ALA n 1 13 ASN n 1 14 THR n 1 15 THR n 1 16 PHE n 1 17 PRO n 1 18 CYS n 1 19 SER n 1 20 GLN n 1 21 PRO n 1 22 PRO n 1 23 CYS n 1 24 THR n 1 25 PRO n 1 26 CYS n 1 27 CYS n 1 28 TYR n 1 29 GLU n 1 30 LYS n 1 31 GLU n 1 32 PRO n 1 33 GLU n 1 34 GLU n 1 35 THR n 1 36 LEU n 1 37 ARG n 1 38 MET n 1 39 LEU n 1 40 GLU n 1 41 ASP n 1 42 ASN n 1 43 VAL n 1 44 MET n 1 45 ARG n 1 46 PRO n 1 47 GLY n 1 48 TYR n 1 49 TYR n 1 50 GLN n 1 51 LEU n 1 52 LEU n 1 53 GLN n 1 54 ALA n 1 55 SER n 1 56 LEU n 1 57 THR n 1 58 CYS n 1 59 SER n 1 60 PRO n 1 61 HIS n 1 62 ARG n 1 63 GLN n 1 64 ARG n 1 65 ARG n 2 1 SER n 2 2 THR n 2 3 LYS n 2 4 ASP n 2 5 ASN n 2 6 PHE n 2 7 ASN n 2 8 VAL n 2 9 TYR n 2 10 LYS n 2 11 ALA n 2 12 THR n 2 13 ARG n 2 14 PRO n 2 15 TYR n 2 16 LEU n 2 17 ALA n 2 18 HIS n 2 19 CYS n 2 20 PRO n 2 21 ASP n 2 22 CYS n 2 23 GLY n 2 24 GLU n 2 25 GLY n 2 26 HIS n 2 27 SER n 2 28 CYS n 2 29 HIS n 2 30 SER n 2 31 PRO n 2 32 VAL n 2 33 ALA n 2 34 LEU n 2 35 GLU n 2 36 ARG n 2 37 ILE n 2 38 ARG n 2 39 ASN n 2 40 GLU n 2 41 ALA n 2 42 THR n 2 43 ASP n 2 44 GLY n 2 45 THR n 2 46 LEU n 2 47 LYS n 2 48 ILE n 2 49 GLN n 2 50 VAL n 2 51 SER n 2 52 LEU n 2 53 GLN n 2 54 ILE n 2 55 GLY n 2 56 ILE n 2 57 LYS n 2 58 THR n 2 59 ASP n 2 60 ASP n 2 61 SER n 2 62 HIS n 2 63 ASP n 2 64 TRP n 2 65 THR n 2 66 LYS n 2 67 LEU n 2 68 ARG n 2 69 TYR n 2 70 MET n 2 71 ASP n 2 72 ASN n 2 73 HIS n 2 74 MET n 2 75 PRO n 2 76 ALA n 2 77 ASP n 2 78 ALA n 2 79 GLU n 2 80 ARG n 2 81 ALA n 2 82 GLY n 2 83 LEU n 2 84 PHE n 2 85 VAL n 2 86 ARG n 2 87 THR n 2 88 SER n 2 89 ALA n 2 90 PRO n 2 91 CYS n 2 92 THR n 2 93 ILE n 2 94 THR n 2 95 GLY n 2 96 THR n 2 97 MET n 2 98 GLY n 2 99 HIS n 2 100 PHE n 2 101 ILE n 2 102 LEU n 2 103 ALA n 2 104 ARG n 2 105 CYS n 2 106 PRO n 2 107 LYS n 2 108 GLY n 2 109 GLU n 2 110 THR n 2 111 LEU n 2 112 THR n 2 113 VAL n 2 114 GLY n 2 115 PHE n 2 116 THR n 2 117 ASP n 2 118 SER n 2 119 ARG n 2 120 LYS n 2 121 ILE n 2 122 SER n 2 123 HIS n 2 124 SER n 2 125 CYS n 2 126 THR n 2 127 HIS n 2 128 PRO n 2 129 PHE n 2 130 HIS n 2 131 HIS n 2 132 ASP n 2 133 PRO n 2 134 PRO n 2 135 VAL n 2 136 ILE n 2 137 GLY n 2 138 ARG n 2 139 GLU n 2 140 LYS n 2 141 PHE n 2 142 HIS n 2 143 SER n 2 144 ARG n 2 145 PRO n 2 146 GLN n 2 147 HIS n 2 148 GLY n 2 149 LYS n 2 150 GLU n 2 151 LEU n 2 152 PRO n 2 153 CYS n 2 154 SER n 2 155 THR n 2 156 TYR n 2 157 VAL n 2 158 GLN n 2 159 SER n 2 160 THR n 2 161 ALA n 2 162 ALA n 2 163 THR n 2 164 THR n 2 165 GLU n 2 166 GLU n 2 167 ILE n 2 168 GLU n 2 169 VAL n 2 170 HIS n 2 171 MET n 2 172 PRO n 2 173 PRO n 2 174 ASP n 2 175 THR n 2 176 PRO n 2 177 ASP n 2 178 ARG n 2 179 THR n 2 180 LEU n 2 181 MET n 2 182 SER n 2 183 GLN n 2 184 GLN n 2 185 SER n 2 186 GLY n 2 187 ASN n 2 188 VAL n 2 189 LYS n 2 190 ILE n 2 191 THR n 2 192 VAL n 2 193 ASN n 2 194 GLY n 2 195 GLN n 2 196 THR n 2 197 VAL n 2 198 ARG n 2 199 TYR n 2 200 LYS n 2 201 CYS n 2 202 ASN n 2 203 CYS n 2 204 GLY n 2 205 GLY n 2 206 SER n 2 207 ASN n 2 208 GLU n 2 209 GLY n 2 210 LEU n 2 211 THR n 2 212 THR n 2 213 THR n 2 214 ASP n 2 215 LYS n 2 216 VAL n 2 217 ILE n 2 218 ASN n 2 219 ASN n 2 220 CYS n 2 221 LYS n 2 222 VAL n 2 223 ASP n 2 224 GLN n 2 225 CYS n 2 226 HIS n 2 227 ALA n 2 228 ALA n 2 229 VAL n 2 230 THR n 2 231 ASN n 2 232 HIS n 2 233 LYS n 2 234 LYS n 2 235 TRP n 2 236 GLN n 2 237 TYR n 2 238 ASN n 2 239 SER n 2 240 PRO n 2 241 LEU n 2 242 VAL n 2 243 PRO n 2 244 ARG n 2 245 ASN n 2 246 ALA n 2 247 GLU n 2 248 LEU n 2 249 GLY n 2 250 ASP n 2 251 ARG n 2 252 LYS n 2 253 GLY n 2 254 LYS n 2 255 ILE n 2 256 HIS n 2 257 ILE n 2 258 PRO n 2 259 PHE n 2 260 PRO n 2 261 LEU n 2 262 ALA n 2 263 ASN n 2 264 VAL n 2 265 THR n 2 266 CYS n 2 267 ARG n 2 268 VAL n 2 269 PRO n 2 270 LYS n 2 271 ALA n 2 272 ARG n 2 273 ASN n 2 274 PRO n 2 275 THR n 2 276 VAL n 2 277 THR n 2 278 TYR n 2 279 GLY n 2 280 LYS n 2 281 ASN n 2 282 GLN n 2 283 VAL n 2 284 ILE n 2 285 MET n 2 286 LEU n 2 287 LEU n 2 288 TYR n 2 289 PRO n 2 290 ASP n 2 291 HIS n 2 292 PRO n 2 293 THR n 2 294 LEU n 2 295 LEU n 2 296 SER n 2 297 TYR n 2 298 ARG n 2 299 ASN n 2 300 MET n 2 301 GLY n 2 302 GLU n 2 303 GLU n 2 304 PRO n 2 305 ASN n 2 306 TYR n 2 307 GLN n 2 308 GLU n 2 309 GLU n 2 310 TRP n 2 311 VAL n 2 312 MET n 2 313 HIS n 2 314 LYS n 2 315 LYS n 2 316 GLU n 2 317 VAL n 2 318 VAL n 2 319 LEU n 2 320 THR n 2 321 VAL n 2 322 PRO n 2 323 THR n 2 324 GLU n 2 325 GLY n 2 326 LEU n 2 327 GLU n 2 328 VAL n 2 329 THR n 2 330 TRP n 2 331 GLY n 2 332 ASN n 2 333 ASN n 2 334 GLU n 2 335 PRO n 2 336 TYR n 2 337 LYS n 2 338 TYR n 2 339 TRP n 2 340 PRO n 2 341 GLN n 2 342 LEU n 2 343 SER n 2 344 THR n 2 345 ASN n 2 346 GLY n 2 347 THR n 2 348 ALA n 2 349 HIS n 2 350 GLY n 2 351 HIS n 2 352 PRO n 2 353 HIS n 2 354 GLU n 2 355 ILE n 2 356 ILE n 2 357 LEU n 2 358 TYR n 2 359 TYR n 2 360 TYR n 3 1 GLU n 3 2 LEU n 3 3 TYR n 3 4 GLY n 3 5 GLY n 3 6 GLY n 3 7 GLY n 3 8 SER n 3 9 GLY n 3 10 GLY n 3 11 GLY n 3 12 GLY n 3 13 SER n 3 14 GLY n 3 15 GLY n 3 16 GLY n 3 17 GLY n 3 18 SER n 3 19 GLY n 3 20 GLY n 3 21 GLY n 3 22 GLY n 3 23 TYR n 3 24 GLU n 3 25 HIS n 3 26 VAL n 3 27 THR n 3 28 VAL n 3 29 ILE n 3 30 PRO n 3 31 ASN n 3 32 THR n 3 33 VAL n 3 34 GLY n 3 35 VAL n 3 36 PRO n 3 37 TYR n 3 38 LYS n 3 39 THR n 3 40 LEU n 3 41 VAL n 3 42 ASN n 3 43 ARG n 3 44 PRO n 3 45 GLY n 3 46 TYR n 3 47 SER n 3 48 PRO n 3 49 MET n 3 50 VAL n 3 51 LEU n 3 52 GLU n 3 53 MET n 3 54 GLU n 3 55 LEU n 3 56 LEU n 3 57 SER n 3 58 VAL n 3 59 THR n 3 60 LEU n 3 61 GLU n 3 62 PRO n 3 63 THR n 3 64 LEU n 3 65 SER n 3 66 LEU n 3 67 ASP n 3 68 TYR n 3 69 ILE n 3 70 THR n 3 71 CYS n 3 72 GLU n 3 73 TYR n 3 74 LYS n 3 75 THR n 3 76 VAL n 3 77 ILE n 3 78 PRO n 3 79 SER n 3 80 PRO n 3 81 TYR n 3 82 VAL n 3 83 LYS n 3 84 CYS n 3 85 CYS n 3 86 GLY n 3 87 THR n 3 88 ALA n 3 89 GLU n 3 90 CYS n 3 91 LYS n 3 92 ASP n 3 93 LYS n 3 94 ASN n 3 95 LEU n 3 96 PRO n 3 97 ASP n 3 98 TYR n 3 99 SER n 3 100 CYS n 3 101 LYS n 3 102 VAL n 3 103 PHE n 3 104 THR n 3 105 GLY n 3 106 VAL n 3 107 TYR n 3 108 PRO n 3 109 PHE n 3 110 MET n 3 111 TRP n 3 112 GLY n 3 113 GLY n 3 114 ALA n 3 115 TYR n 3 116 CYS n 3 117 PHE n 3 118 CYS n 3 119 ASP n 3 120 ALA n 3 121 GLU n 3 122 ASN n 3 123 THR n 3 124 GLN n 3 125 LEU n 3 126 SER n 3 127 GLU n 3 128 ALA n 3 129 HIS n 3 130 VAL n 3 131 GLU n 3 132 LYS n 3 133 SER n 3 134 GLU n 3 135 SER n 3 136 CYS n 3 137 LYS n 3 138 THR n 3 139 GLU n 3 140 PHE n 3 141 ALA n 3 142 SER n 3 143 ALA n 3 144 TYR n 3 145 ARG n 3 146 ALA n 3 147 HIS n 3 148 THR n 3 149 ALA n 3 150 SER n 3 151 ALA n 3 152 SER n 3 153 ALA n 3 154 LYS n 3 155 LEU n 3 156 ARG n 3 157 VAL n 3 158 LEU n 3 159 TYR n 3 160 GLN n 3 161 GLY n 3 162 ASN n 3 163 ASN n 3 164 ILE n 3 165 THR n 3 166 VAL n 3 167 THR n 3 168 ALA n 3 169 TYR n 3 170 ALA n 3 171 ASN n 3 172 GLY n 3 173 ASP n 3 174 HIS n 3 175 ALA n 3 176 VAL n 3 177 THR n 3 178 VAL n 3 179 LYS n 3 180 ASP n 3 181 ALA n 3 182 LYS n 3 183 PHE n 3 184 ILE n 3 185 VAL n 3 186 GLY n 3 187 PRO n 3 188 MET n 3 189 SER n 3 190 SER n 3 191 ALA n 3 192 TRP n 3 193 THR n 3 194 PRO n 3 195 PHE n 3 196 ASP n 3 197 ASN n 3 198 LYS n 3 199 ILE n 3 200 VAL n 3 201 VAL n 3 202 TYR n 3 203 LYS n 3 204 GLY n 3 205 ASP n 3 206 VAL n 3 207 TYR n 3 208 ASN n 3 209 MET n 3 210 ASP n 3 211 TYR n 3 212 PRO n 3 213 PRO n 3 214 PHE n 3 215 GLY n 3 216 ALA n 3 217 GLY n 3 218 ARG n 3 219 PRO n 3 220 GLY n 3 221 GLN n 3 222 PHE n 3 223 GLY n 3 224 ASP n 3 225 ILE n 3 226 GLN n 3 227 SER n 3 228 ARG n 3 229 THR n 3 230 PRO n 3 231 GLU n 3 232 SER n 3 233 LYS n 3 234 ASP n 3 235 VAL n 3 236 TYR n 3 237 ALA n 3 238 ASN n 3 239 THR n 3 240 GLN n 3 241 LEU n 3 242 VAL n 3 243 LEU n 3 244 GLN n 3 245 ARG n 3 246 PRO n 3 247 ALA n 3 248 ALA n 3 249 GLY n 3 250 THR n 3 251 VAL n 3 252 HIS n 3 253 VAL n 3 254 PRO n 3 255 TYR n 3 256 SER n 3 257 GLN n 3 258 ALA n 3 259 PRO n 3 260 SER n 3 261 GLY n 3 262 PHE n 3 263 LYS n 3 264 TYR n 3 265 TRP n 3 266 LEU n 3 267 LYS n 3 268 GLU n 3 269 ARG n 3 270 GLY n 3 271 ALA n 3 272 SER n 3 273 LEU n 3 274 GLN n 3 275 HIS n 3 276 THR n 3 277 ALA n 3 278 PRO n 3 279 PHE n 3 280 GLY n 3 281 CYS n 3 282 GLN n 3 283 ILE n 3 284 ALA n 3 285 THR n 3 286 ASN n 3 287 PRO n 3 288 VAL n 3 289 ARG n 3 290 ALA n 3 291 VAL n 3 292 ASN n 3 293 CYS n 3 294 ALA n 3 295 VAL n 3 296 GLY n 3 297 ASN n 3 298 MET n 3 299 PRO n 3 300 ILE n 3 301 SER n 3 302 ILE n 3 303 ASP n 3 304 ILE n 3 305 PRO n 3 306 GLU n 3 307 ALA n 3 308 ALA n 3 309 PHE n 3 310 THR n 3 311 ARG n 3 312 VAL n 3 313 VAL n 3 314 ASP n 3 315 ALA n 3 316 PRO n 3 317 SER n 3 318 LEU n 3 319 THR n 3 320 ASP n 3 321 MET n 3 322 SER n 3 323 CYS n 3 324 GLU n 3 325 VAL n 3 326 PRO n 3 327 ALA n 3 328 CYS n 3 329 THR n 3 330 HIS n 3 331 SER n 3 332 SER n 3 333 ASP n 3 334 PHE n 3 335 GLY n 3 336 GLY n 3 337 VAL n 3 338 ALA n 3 339 ILE n 3 340 ILE n 3 341 LYS n 3 342 TYR n 3 343 ALA n 3 344 ALA n 3 345 SER n 3 346 LYS n 3 347 LYS n 3 348 GLY n 3 349 LYS n 3 350 CYS n 3 351 ALA n 3 352 VAL n 3 353 HIS n 3 354 SER n 3 355 MET n 3 356 THR n 3 357 ASN n 3 358 ALA n 3 359 VAL n 3 360 THR n 3 361 ILE n 3 362 ARG n 3 363 GLU n 3 364 ALA n 3 365 GLU n 3 366 ILE n 3 367 GLU n 3 368 VAL n 3 369 GLU n 3 370 GLY n 3 371 ASN n 3 372 SER n 3 373 GLN n 3 374 LEU n 3 375 GLN n 3 376 ILE n 3 377 SER n 3 378 PHE n 3 379 SER n 3 380 THR n 3 381 ALA n 3 382 LEU n 3 383 ALA n 3 384 SER n 3 385 ALA n 3 386 GLU n 3 387 PHE n 3 388 ARG n 3 389 VAL n 3 390 GLN n 3 391 VAL n 3 392 CYS n 3 393 SER n 3 394 THR n 3 395 GLN n 3 396 VAL n 3 397 HIS n 3 398 CYS n 3 399 ALA n 3 400 ALA n 3 401 GLU n 3 402 CYS n 3 403 HIS n 3 404 PRO n 3 405 PRO n 3 406 LYS n 3 407 ASP n 3 408 HIS n 3 409 ILE n 3 410 VAL n 3 411 ASN n 3 412 TYR n 3 413 PRO n 3 414 ALA n 3 415 SER n 3 416 HIS n 3 417 THR n 3 418 THR n 3 419 LEU n 3 420 GLY n 3 421 VAL n 3 422 GLN n 3 423 ASP n 3 424 ILE n 3 425 SER n 3 426 ALA n 3 427 THR n 3 428 ALA n 3 429 MET n 3 430 SER n 3 431 TRP n 3 432 VAL n 3 433 GLN n 3 434 LYS n 3 435 GLY n 3 436 PRO n 3 437 PHE n 3 438 GLU n 3 439 ASP n 3 440 ASP n 3 441 ASP n 3 442 ASP n 3 443 LYS n 3 444 ALA n 3 445 GLY n 3 446 TRP n 3 447 SER n 3 448 HIS n 3 449 PRO n 3 450 GLN n 3 451 PHE n 3 452 GLU n 3 453 LYS n 3 454 GLY n 3 455 GLY n 3 456 GLY n 3 457 SER n 3 458 GLY n 3 459 GLY n 3 460 GLY n 3 461 SER n 3 462 GLY n 3 463 GLY n 3 464 GLY n 3 465 SER n 3 466 TRP n 3 467 SER n 3 468 HIS n 3 469 PRO n 3 470 GLN n 3 471 PHE n 3 472 GLU n 3 473 LYS n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _entity_src_gen.pdbx_seq_type _entity_src_gen.pdbx_beg_seq_num _entity_src_gen.pdbx_end_seq_num _entity_src_gen.gene_src_common_name _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _entity_src_gen.gene_src_species _entity_src_gen.gene_src_strain _entity_src_gen.gene_src_tissue _entity_src_gen.gene_src_tissue_fraction _entity_src_gen.gene_src_details _entity_src_gen.pdbx_gene_src_fragment _entity_src_gen.pdbx_gene_src_scientific_name _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _entity_src_gen.pdbx_gene_src_variant _entity_src_gen.pdbx_gene_src_cell_line _entity_src_gen.pdbx_gene_src_atcc _entity_src_gen.pdbx_gene_src_organ _entity_src_gen.pdbx_gene_src_organelle _entity_src_gen.pdbx_gene_src_cell _entity_src_gen.pdbx_gene_src_cellular_location _entity_src_gen.host_org_common_name _entity_src_gen.pdbx_host_org_scientific_name _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample ? ? ? CHIKV ? ? ? 05-115 ? ? ? ? 'Chikungunya virus' 37124 ? ? ? ? ? ? ? ? 'Drosophila Melanogaster' 7227 ? ? ? ? ? ? ? ? 'SCHNEIDER 2' ? ? ? ? ? PLASMID ? ? ? 'pMRBiP/V5 HisA' ? ? 2 1 sample ? ? ? CHIKV ? ? ? 05-115 ? ? ? ? 'Chikungunya virus' 37124 ? ? ? ? ? ? ? ? 'Drosophila Melanogaster' 7227 ? ? ? ? ? ? ? ? 'SCHNEIDER 2' ? ? ? ? ? PLASMID ? ? ? 'pMRBiP/V5 HisA' ? ? 3 1 sample ? ? ? CHIKV ? ? ? 'pMRBiP/V5 HisA' ? ? ? ? 'Chikungunya virus' 37124 ? ? ? ? ? ? ? ? 'Drosophila Melanogaster' 7227 ? ? ? ? ? ? ? ? 'SCHNEIDER 2' ? ? ? ? ? PLASMID ? ? ? 'pMRBiP/V5 HisA' ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin _struct_ref.pdbx_db_isoform 1 UNP Q1H8W5_CHIKV Q1H8W5 1 PVMCLLANTTFPCSQPPCTPCCYEKEPEETLRMLEDNVMRPGYYQLLQASLTCS 266 ? 2 UNP Q1H8W5_CHIKV Q1H8W5 2 ;NFNVYKATRPYLAHCPDCGEGHSCHSPVALERIRNEATDGTLKIQVSLQIGIKTDDSHDWTKLRYMDNHMPADAERAGLF VRTSAPCTITGTMGHFILARCPKGETLTVGFTDSRKISHSCTHPFHHDPPVIGREKFHSRPQHGKELPCSTYVQSTAATT EEIEVHMPPDTPDRTLMSQQSGNVKITVNGQTVRYKCNCGGSNEGLTTTDKVINNCKVDQCHAAVTNHKKWQYNSPLVPR NAELGDRKGKIHIPFPLANVTCRVPKARNPTVTYGKNQVIMLLYPDHPTLLSYRNMGEEPNYQEEWVMHKKEVVLTVPTE GLEVTWGNNEPYKYWPQL ; 330 ? 3 UNP Q1H8W5_CHIKV Q1H8W5 3 ;YEHVTVIPNTVGVPYKTLVNRPGYSPMVLEMELLSVTLEPTLSLDYITCEYKTVIPSPYVKCCGTAECKDKNLPDYSCKV FTGVYPFMWGGAYCFCDAENTQLSEAHVEKSESCKTEFASAYRAHTASASAKLRVLYQGNNITVTAYANGDHAVTVKDAK FIVGPMSSAWTPFDNKIVVYKGDVYNMDYPPFGAGRPGQFGDIQSRTPESKDVYANTQLVLQRPAAGTVHVPYSQAPSGF KYWLKERGASLQHTAPFGCQIATNPVRAVNCAVGNMPISIDIPEAAFTRVVDAPSLTDMSCEVPACTHSSDFGGVAIIKY AASKKGKCAVHSMTNAVTIREAEIEVEGNSQLQISFSTALASAEFRVQVCSTQVHCAAECHPPKDHIVNYPAS ; 810 ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 3N42 A 6 ? 59 ? Q1H8W5 266 ? 319 ? 5 58 2 2 3N42 B 5 ? 342 ? Q1H8W5 330 ? 667 ? 5 342 3 3 3N42 F 23 ? 415 ? Q1H8W5 810 ? 1202 ? 1 393 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 3 3N42 GLY F 21 ? UNP Q1H8W5 ? ? 'SEE REMARK 999' -1 1 3 3N42 GLY F 22 ? UNP Q1H8W5 ? ? 'SEE REMARK 999' 0 2 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 NDG D-saccharide . '2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE' ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 3N42 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.40 _exptl_crystal.density_percent_sol 48.74 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.0 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '8-12% PEG4K, 100mM NaAcetate, 100mM Hepes pH7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K' # _diffrn.id 1 _diffrn.ambient_temp 110 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'MARMOSAIC 225 mm CCD' _diffrn_detector.pdbx_collection_date 2009-11-13 _diffrn_detector.details 'ONE PAIR OF (300X40X15) MM3 LONG PT COATED SI MIRROR, 260MM USABLE, IN A KIRKPATRICK-BAEZ GEOMETRY' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'S 111' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.8726 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ESRF BEAMLINE ID23-2' _diffrn_source.pdbx_synchrotron_site ESRF _diffrn_source.pdbx_synchrotron_beamline ID23-2 _diffrn_source.pdbx_wavelength 0.8726 _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 3N42 _reflns.observed_criterion_sigma_I 0.000 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 49.700 _reflns.d_resolution_high 3.000 _reflns.number_obs 18964 _reflns.number_all ? _reflns.percent_possible_obs 96.4 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.12300 _reflns.pdbx_netI_over_sigmaI 9.2000 _reflns.B_iso_Wilson_estimate 68.11 _reflns.pdbx_redundancy 3.700 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 # _reflns_shell.d_res_high 3.00 _reflns_shell.d_res_low 3.16 _reflns_shell.percent_possible_all 82.2 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value 0.46900 _reflns_shell.meanI_over_sigI_obs 2.000 _reflns_shell.pdbx_redundancy 2.40 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_diffrn_id ? _reflns_shell.pdbx_ordinal 1 # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 3N42 _refine.ls_number_reflns_obs 18926 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.000 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 44.60 _refine.ls_d_res_high 3.00 _refine.ls_percent_reflns_obs 96.2 _refine.ls_R_factor_obs 0.249 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.247 _refine.ls_R_factor_R_free 0.278 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.180 _refine.ls_number_reflns_R_free 980 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.850 _refine.correlation_coeff_Fo_to_Fc_free 0.832 _refine.B_iso_mean 59.22 _refine.aniso_B[1][1] -0.50040 _refine.aniso_B[2][2] 13.09510 _refine.aniso_B[3][3] -12.59480 _refine.aniso_B[1][2] 0.00000 _refine.aniso_B[1][3] 0.00000 _refine.aniso_B[2][3] 0.00000 _refine.solvent_model_details ? _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details ? _refine.pdbx_starting_model 'P62E1 ENVELOPE GLYCOPROTEINS FROM CHIKUNGUNYA VIRUS' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML ? _refine.pdbx_overall_phase_error ? _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? # _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_analyze.entry_id 3N42 _refine_analyze.Luzzati_coordinate_error_obs 0.55 _refine_analyze.Luzzati_sigma_a_obs ? _refine_analyze.Luzzati_d_res_low_obs ? _refine_analyze.Luzzati_coordinate_error_free ? _refine_analyze.Luzzati_sigma_a_free ? _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 6075 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 42 _refine_hist.number_atoms_solvent 88 _refine_hist.number_atoms_total 6205 _refine_hist.d_res_high 3.00 _refine_hist.d_res_low 44.60 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function t_bond_d 0.007 ? 2.000 6310 'X-RAY DIFFRACTION' HARMONIC t_angle_deg 0.97 ? 2.000 8613 'X-RAY DIFFRACTION' HARMONIC t_dihedral_angle_d ? ? 2.000 2080 'X-RAY DIFFRACTION' SINUSOIDAL t_incorr_chiral_ct ? ? ? ? 'X-RAY DIFFRACTION' ? t_pseud_angle ? ? ? ? 'X-RAY DIFFRACTION' ? t_trig_c_planes ? ? 2.000 147 'X-RAY DIFFRACTION' HARMONIC t_gen_planes ? ? 5.000 918 'X-RAY DIFFRACTION' HARMONIC t_it ? ? 20.000 6310 'X-RAY DIFFRACTION' HARMONIC t_nbd ? ? ? ? 'X-RAY DIFFRACTION' ? t_omega_torsion 1.800 ? ? ? 'X-RAY DIFFRACTION' ? t_other_torsion 19.340 ? ? ? 'X-RAY DIFFRACTION' ? t_improper_torsion ? ? ? ? 'X-RAY DIFFRACTION' ? t_chiral_improper_torsion ? ? 5.000 847 'X-RAY DIFFRACTION' SEMIHARMONIC t_sum_occupancies ? ? ? ? 'X-RAY DIFFRACTION' ? t_utility_distance ? ? ? ? 'X-RAY DIFFRACTION' ? t_utility_angle ? ? ? ? 'X-RAY DIFFRACTION' ? t_utility_torsion ? ? ? ? 'X-RAY DIFFRACTION' ? t_ideal_dist_contact ? ? 4.000 6322 'X-RAY DIFFRACTION' SEMIHARMONIC # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.pdbx_total_number_of_bins_used 10 _refine_ls_shell.d_res_high 3.00 _refine_ls_shell.d_res_low 3.16 _refine_ls_shell.number_reflns_R_work 2172 _refine_ls_shell.R_factor_R_work 0.3033 _refine_ls_shell.percent_reflns_obs 96.15 _refine_ls_shell.R_factor_R_free 0.3655 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free 5.69 _refine_ls_shell.number_reflns_R_free 131 _refine_ls_shell.number_reflns_all 2303 _refine_ls_shell.R_factor_all 0.3066 _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.number_reflns_obs ? # _struct.entry_id 3N42 _struct.title 'Crystal structures of the mature envelope glycoprotein complex (furin cleavage) of Chikungunya virus.' _struct.pdbx_descriptor 'E3 envelope glycoprotein, E2 envelope glycoprotein, E1 envelope glycoprotein' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3N42 _struct_keywords.pdbx_keywords 'VIRAL PROTEIN' _struct_keywords.text 'VIRAL PROTEIN, IMMATURE HETERODIMER, ALPHAVIRUS, RECEPTOR BINDING, MEMBRANE FUSION' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 4 ? E N N 4 ? F N N 5 ? G N N 6 ? H N N 6 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 CYS A 26 ? GLU A 31 ? CYS A 25 GLU A 30 1 ? 6 HELX_P HELX_P2 2 GLU A 31 ? ASP A 41 ? GLU A 30 ASP A 40 1 ? 11 HELX_P HELX_P3 3 GLY A 47 ? LEU A 56 ? GLY A 46 LEU A 55 1 ? 10 HELX_P HELX_P4 4 ASN B 7 ? ALA B 11 ? ASN B 7 ALA B 11 5 ? 5 HELX_P HELX_P5 5 LYS B 221 ? ASP B 223 ? LYS B 221 ASP B 223 5 ? 3 HELX_P HELX_P6 6 GLU C 134 ? THR C 138 ? GLU F 112 THR F 116 5 ? 5 HELX_P HELX_P7 7 SER C 260 ? LEU C 266 ? SER F 238 LEU F 244 1 ? 7 HELX_P HELX_P8 8 SER C 272 ? ALA C 277 ? SER F 250 ALA F 255 1 ? 6 HELX_P HELX_P9 9 PRO C 278 ? CYS C 281 ? PRO F 256 CYS F 259 5 ? 4 HELX_P HELX_P10 10 ALA C 307 ? PHE C 309 ? ALA F 285 PHE F 287 5 ? 3 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 9 SG ? ? ? 1_555 A CYS 18 SG ? ? A CYS 8 A CYS 17 1_555 ? ? ? ? ? ? ? 2.034 ? disulf2 disulf ? ? A CYS 23 SG ? ? ? 1_555 A CYS 27 SG ? ? A CYS 22 A CYS 26 1_555 ? ? ? ? ? ? ? 2.034 ? disulf3 disulf ? ? A CYS 26 SG ? ? ? 1_555 A CYS 58 SG ? ? A CYS 25 A CYS 57 1_555 ? ? ? ? ? ? ? 2.028 ? disulf4 disulf ? ? B CYS 19 SG ? ? ? 1_555 B CYS 125 SG ? ? B CYS 19 B CYS 125 1_555 ? ? ? ? ? ? ? 2.035 ? disulf5 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 28 SG ? ? B CYS 22 B CYS 28 1_555 ? ? ? ? ? ? ? 2.032 ? disulf6 disulf ? ? B CYS 91 SG ? ? ? 1_555 B CYS 105 SG ? ? B CYS 91 B CYS 105 1_555 ? ? ? ? ? ? ? 2.031 ? disulf7 disulf ? ? B CYS 153 SG ? ? ? 1_555 B CYS 266 SG ? ? B CYS 153 B CYS 266 1_555 ? ? ? ? ? ? ? 2.034 ? disulf8 disulf ? ? B CYS 201 SG ? ? ? 1_555 B CYS 225 SG ? ? B CYS 201 B CYS 225 1_555 ? ? ? ? ? ? ? 2.035 ? disulf9 disulf ? ? B CYS 203 SG ? ? ? 1_555 B CYS 220 SG ? ? B CYS 203 B CYS 220 1_555 ? ? ? ? ? ? ? 2.035 ? disulf10 disulf ? ? C CYS 71 SG ? ? ? 1_555 C CYS 136 SG ? ? F CYS 49 F CYS 114 1_555 ? ? ? ? ? ? ? 2.031 ? disulf11 disulf ? ? C CYS 84 SG ? ? ? 1_555 C CYS 116 SG ? ? F CYS 62 F CYS 94 1_555 ? ? ? ? ? ? ? 2.036 ? disulf12 disulf ? ? C CYS 85 SG ? ? ? 1_555 C CYS 118 SG ? ? F CYS 63 F CYS 96 1_555 ? ? ? ? ? ? ? 2.035 ? disulf13 disulf ? ? C CYS 90 SG ? ? ? 1_555 C CYS 100 SG ? ? F CYS 68 F CYS 78 1_555 ? ? ? ? ? ? ? 2.036 ? disulf14 disulf ? ? C CYS 281 SG ? ? ? 1_555 C CYS 293 SG ? ? F CYS 259 F CYS 271 1_555 ? ? ? ? ? ? ? 2.033 ? disulf15 disulf ? ? C CYS 323 SG ? ? ? 1_555 C CYS 398 SG ? ? F CYS 301 F CYS 376 1_555 ? ? ? ? ? ? ? 2.033 ? disulf16 disulf ? ? C CYS 328 SG ? ? ? 1_555 C CYS 402 SG ? ? F CYS 306 F CYS 380 1_555 ? ? ? ? ? ? ? 2.034 ? disulf17 disulf ? ? C CYS 350 SG ? ? ? 1_555 C CYS 392 SG ? ? F CYS 328 F CYS 370 1_555 ? ? ? ? ? ? ? 2.034 ? covale1 covale ? ? C ASN 163 ND2 ? ? ? 1_555 E NAG . C1 ? ? F ASN 141 F NAG 1001 1_555 ? ? ? ? ? ? ? 1.443 ? covale2 covale ? ? E NAG . O4 ? ? ? 1_555 F NDG . C1 ? ? F NAG 1001 F NDG 1002 1_555 ? ? ? ? ? ? ? 1.452 ? covale3 covale ? ? B ASN 263 ND2 ? ? ? 1_555 D NAG . C1 ? ? B ASN 263 B NAG 1001 1_555 ? ? ? ? ? ? ? 1.465 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 THR 24 A . ? THR 23 A PRO 25 A ? PRO 24 A 1 0.33 2 GLY 186 C . ? GLY 164 F PRO 187 C ? PRO 165 F 1 0.69 3 ASN 286 C . ? ASN 264 F PRO 287 C ? PRO 265 F 1 -0.39 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 2 ? B ? 2 ? C ? 4 ? D ? 3 ? E ? 3 ? F ? 2 ? G ? 3 ? H ? 4 ? I ? 3 ? J ? 3 ? K ? 5 ? L ? 4 ? M ? 5 ? N ? 5 ? O ? 3 ? P ? 3 ? Q ? 2 ? R ? 2 ? S ? 2 ? T ? 4 ? U ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel B 1 2 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel F 1 2 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel K 4 5 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel L 3 4 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel M 4 5 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel N 4 5 ? anti-parallel O 1 2 ? anti-parallel O 2 3 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel Q 1 2 ? anti-parallel R 1 2 ? anti-parallel S 1 2 ? anti-parallel T 1 2 ? anti-parallel T 2 3 ? anti-parallel T 3 4 ? anti-parallel U 1 2 ? anti-parallel U 2 3 ? anti-parallel U 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 MET A 8 ? CYS A 9 ? MET A 7 CYS A 8 A 2 PHE A 16 ? PRO A 17 ? PHE A 15 PRO A 16 B 1 ALA B 17 ? CYS B 19 ? ALA B 17 CYS B 19 B 2 CYS B 28 ? SER B 30 ? CYS B 28 SER B 30 C 1 LEU B 34 ? ARG B 38 ? LEU B 34 ARG B 38 C 2 LEU B 46 ? ILE B 56 ? LEU B 46 ILE B 56 C 3 HIS B 62 ? ASP B 71 ? HIS B 62 ASP B 71 C 4 MET B 74 ? GLU B 79 ? MET B 74 GLU B 79 D 1 LEU B 34 ? ARG B 38 ? LEU B 34 ARG B 38 D 2 LEU B 46 ? ILE B 56 ? LEU B 46 ILE B 56 D 3 THR B 92 ? ARG B 104 ? THR B 92 ARG B 104 E 1 PHE B 84 ? ARG B 86 ? PHE B 84 ARG B 86 E 2 GLY B 108 ? THR B 116 ? GLY B 108 THR B 116 E 3 SER B 122 ? HIS B 131 ? SER B 122 HIS B 131 F 1 LYS B 149 ? TYR B 156 ? LYS B 149 TYR B 156 F 2 LEU B 261 ? VAL B 268 ? LEU B 261 VAL B 268 G 1 GLN B 236 ? TYR B 237 ? GLN B 236 TYR B 237 G 2 GLU B 166 ? HIS B 170 ? GLU B 166 HIS B 170 G 3 GLY B 253 ? HIS B 256 ? GLY B 253 HIS B 256 H 1 THR B 175 ? PRO B 176 ? THR B 175 PRO B 176 H 2 CYS B 225 ? VAL B 229 ? CYS B 225 VAL B 229 H 3 VAL B 197 ? CYS B 201 ? VAL B 197 CYS B 201 H 4 LEU B 210 ? THR B 211 ? LEU B 210 THR B 211 I 1 MET B 181 ? SER B 182 ? MET B 181 SER B 182 I 2 VAL B 188 ? ILE B 190 ? VAL B 188 ILE B 190 I 3 LYS B 215 ? ILE B 217 ? LYS B 215 ILE B 217 J 1 THR B 275 ? GLY B 279 ? THR B 275 GLY B 279 J 2 GLN B 282 ? LEU B 287 ? GLN B 282 LEU B 287 J 3 LYS B 315 ? THR B 320 ? LYS B 315 THR B 320 K 1 GLN B 307 ? VAL B 311 ? GLN B 307 VAL B 311 K 2 THR B 293 ? ASN B 299 ? THR B 293 ASN B 299 K 3 LEU B 326 ? TRP B 330 ? LEU B 326 TRP B 330 K 4 TYR B 336 ? PRO B 340 ? TYR B 336 PRO B 340 K 5 ILE C 409 ? VAL C 410 ? ILE F 387 VAL F 388 L 1 GLY C 22 ? PRO C 30 ? GLY F 0 PRO F 8 L 2 ASN C 297 ? PRO C 305 ? ASN F 275 PRO F 283 L 3 ALA C 181 ? VAL C 185 ? ALA F 159 VAL F 163 L 4 ALA C 175 ? VAL C 178 ? ALA F 153 VAL F 156 M 1 TYR C 37 ? VAL C 41 ? TYR F 15 VAL F 19 M 2 MET C 49 ? THR C 70 ? MET F 27 THR F 48 M 3 ALA C 141 ? TYR C 159 ? ALA F 119 TYR F 137 M 4 LYS C 198 ? TYR C 202 ? LYS F 176 TYR F 180 M 5 ASP C 205 ? ASN C 208 ? ASP F 183 ASN F 186 N 1 ASN C 162 ? TYR C 169 ? ASN F 140 TYR F 147 N 2 ALA C 141 ? TYR C 159 ? ALA F 119 TYR F 137 N 3 MET C 49 ? THR C 70 ? MET F 27 THR F 48 N 4 ARG C 289 ? VAL C 291 ? ARG F 267 VAL F 269 N 5 GLN C 282 ? ALA C 284 ? GLN F 260 ALA F 262 O 1 TYR C 73 ? VAL C 76 ? TYR F 51 VAL F 54 O 2 THR C 123 ? LYS C 132 ? THR F 101 LYS F 110 O 3 TYR C 81 ? LYS C 83 ? TYR F 59 LYS F 61 P 1 TYR C 73 ? VAL C 76 ? TYR F 51 VAL F 54 P 2 THR C 123 ? LYS C 132 ? THR F 101 LYS F 110 P 3 SER C 99 ? THR C 104 ? SER F 77 THR F 82 Q 1 PHE C 109 ? MET C 110 ? PHE F 87 MET F 88 Q 2 GLY C 113 ? ALA C 114 ? GLY F 91 ALA F 92 R 1 ILE C 225 ? SER C 227 ? ILE F 203 SER F 205 R 2 VAL C 235 ? ALA C 237 ? VAL F 213 ALA F 215 S 1 VAL C 242 ? LEU C 243 ? VAL F 220 LEU F 221 S 2 TYR C 255 ? SER C 256 ? TYR F 233 SER F 234 T 1 LEU C 318 ? ALA C 327 ? LEU F 296 ALA F 305 T 2 GLY C 336 ? ALA C 344 ? GLY F 314 ALA F 322 T 3 GLN C 373 ? THR C 380 ? GLN F 351 THR F 358 T 4 VAL C 359 ? ILE C 361 ? VAL F 337 ILE F 339 U 1 GLU C 365 ? VAL C 368 ? GLU F 343 VAL F 346 U 2 GLY C 348 ? SER C 354 ? GLY F 326 SER F 332 U 3 SER C 384 ? VAL C 391 ? SER F 362 VAL F 369 U 4 THR C 394 ? GLU C 401 ? THR F 372 GLU F 379 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N CYS A 9 ? N CYS A 8 O PHE A 16 ? O PHE A 15 B 1 2 N ALA B 17 ? N ALA B 17 O SER B 30 ? O SER B 30 C 1 2 N ARG B 38 ? N ARG B 38 O LYS B 47 ? O LYS B 47 C 2 3 N GLN B 53 ? N GLN B 53 O ARG B 68 ? O ARG B 68 C 3 4 N TYR B 69 ? N TYR B 69 O ALA B 76 ? O ALA B 76 D 1 2 N ARG B 38 ? N ARG B 38 O LYS B 47 ? O LYS B 47 D 2 3 N ILE B 48 ? N ILE B 48 O ILE B 101 ? O ILE B 101 E 1 2 N ARG B 86 ? N ARG B 86 O THR B 112 ? O THR B 112 E 2 3 N GLY B 108 ? N GLY B 108 O HIS B 131 ? O HIS B 131 F 1 2 N CYS B 153 ? N CYS B 153 O VAL B 264 ? O VAL B 264 G 1 2 O GLN B 236 ? O GLN B 236 N HIS B 170 ? N HIS B 170 G 2 3 N VAL B 169 ? N VAL B 169 O GLY B 253 ? O GLY B 253 H 1 2 N THR B 175 ? N THR B 175 O VAL B 229 ? O VAL B 229 H 2 3 O ALA B 228 ? O ALA B 228 N ARG B 198 ? N ARG B 198 H 3 4 N VAL B 197 ? N VAL B 197 O THR B 211 ? O THR B 211 I 1 2 N SER B 182 ? N SER B 182 O LYS B 189 ? O LYS B 189 I 2 3 N VAL B 188 ? N VAL B 188 O ILE B 217 ? O ILE B 217 J 1 2 N THR B 277 ? N THR B 277 O ILE B 284 ? O ILE B 284 J 2 3 N VAL B 283 ? N VAL B 283 O LEU B 319 ? O LEU B 319 K 1 2 O VAL B 311 ? O VAL B 311 N THR B 293 ? N THR B 293 K 2 3 N SER B 296 ? N SER B 296 O THR B 329 ? O THR B 329 K 3 4 N VAL B 328 ? N VAL B 328 O TYR B 336 ? O TYR B 336 K 4 5 N TRP B 339 ? N TRP B 339 O VAL C 410 ? O VAL F 388 L 1 2 N THR C 27 ? N THR F 5 O ILE C 300 ? O ILE F 278 L 2 3 O ASP C 303 ? O ASP F 281 N LYS C 182 ? N LYS F 160 L 3 4 O PHE C 183 ? O PHE F 161 N VAL C 176 ? N VAL F 154 M 1 2 N VAL C 41 ? N VAL F 19 O MET C 49 ? O MET F 27 M 2 3 N GLU C 54 ? N GLU F 32 O ARG C 156 ? O ARG F 134 M 3 4 N TYR C 144 ? N TYR F 122 O ILE C 199 ? O ILE F 177 M 4 5 N VAL C 200 ? N VAL F 178 O TYR C 207 ? O TYR F 185 N 1 2 O ALA C 168 ? O ALA F 146 N ALA C 153 ? N ALA F 131 N 2 3 O ARG C 156 ? O ARG F 134 N GLU C 54 ? N GLU F 32 N 3 4 N LEU C 60 ? N LEU F 38 O ALA C 290 ? O ALA F 268 N 4 5 O VAL C 291 ? O VAL F 269 N GLN C 282 ? N GLN F 260 O 1 2 N LYS C 74 ? N LYS F 52 O GLU C 131 ? O GLU F 109 O 2 3 O THR C 123 ? O THR F 101 N LYS C 83 ? N LYS F 61 P 1 2 N LYS C 74 ? N LYS F 52 O GLU C 131 ? O GLU F 109 P 2 3 O ALA C 128 ? O ALA F 106 N SER C 99 ? N SER F 77 Q 1 2 N MET C 110 ? N MET F 88 O GLY C 113 ? O GLY F 91 R 1 2 N GLN C 226 ? N GLN F 204 O TYR C 236 ? O TYR F 214 S 1 2 N VAL C 242 ? N VAL F 220 O SER C 256 ? O SER F 234 T 1 2 N GLU C 324 ? N GLU F 302 O ILE C 339 ? O ILE F 317 T 2 3 N ILE C 340 ? N ILE F 318 O LEU C 374 ? O LEU F 352 T 3 4 O SER C 379 ? O SER F 357 N THR C 360 ? N THR F 338 U 1 2 O VAL C 368 ? O VAL F 346 N GLY C 348 ? N GLY F 326 U 2 3 N HIS C 353 ? N HIS F 331 O GLN C 390 ? O GLN F 368 U 3 4 N PHE C 387 ? N PHE F 365 O CYS C 398 ? O CYS F 376 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG B 1001' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG F 1001' AC3 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NDG F 1002' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 4 ALA B 262 ? ALA B 262 . ? 1_555 ? 2 AC1 4 ASN B 263 ? ASN B 263 . ? 1_555 ? 3 AC1 4 LYS C 137 ? LYS F 115 . ? 1_555 ? 4 AC1 4 THR C 138 ? THR F 116 . ? 1_555 ? 5 AC2 4 ARG C 156 ? ARG F 134 . ? 1_555 ? 6 AC2 4 GLY C 161 ? GLY F 139 . ? 1_555 ? 7 AC2 4 ASN C 163 ? ASN F 141 . ? 1_555 ? 8 AC2 4 NDG F . ? NDG F 1002 . ? 1_555 ? 9 AC3 1 NAG E . ? NAG F 1001 . ? 1_555 ? # _database_PDB_matrix.entry_id 3N42 _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 3N42 _atom_sites.fract_transf_matrix[1][1] 0.017126 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.011028 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.005605 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 8 ? -55.400 -4.154 -43.715 1.00 114.30 ? 7 MET A N 1 ATOM 2 C CA . MET A 1 8 ? -56.074 -5.385 -44.140 1.00 113.86 ? 7 MET A CA 1 ATOM 3 C C . MET A 1 8 ? -55.292 -6.659 -43.825 1.00 117.01 ? 7 MET A C 1 ATOM 4 O O . MET A 1 8 ? -54.073 -6.706 -44.002 1.00 116.70 ? 7 MET A O 1 ATOM 5 C CB . MET A 1 8 ? -56.452 -5.337 -45.633 1.00 116.84 ? 7 MET A CB 1 ATOM 6 C CG . MET A 1 8 ? -57.424 -4.218 -45.995 1.00 120.84 ? 7 MET A CG 1 ATOM 7 S SD . MET A 1 8 ? -59.060 -4.353 -45.226 1.00 124.64 ? 7 MET A SD 1 ATOM 8 C CE . MET A 1 8 ? -59.843 -5.528 -46.320 1.00 121.67 ? 7 MET A CE 1 ATOM 9 N N . CYS A 1 9 ? -56.013 -7.687 -43.342 1.00 112.92 ? 8 CYS A N 1 ATOM 10 C CA . CYS A 1 9 ? -55.489 -9.011 -42.999 1.00 112.32 ? 8 CYS A CA 1 ATOM 11 C C . CYS A 1 9 ? -56.077 -10.079 -43.938 1.00 116.48 ? 8 CYS A C 1 ATOM 12 O O . CYS A 1 9 ? -57.054 -9.806 -44.641 1.00 116.32 ? 8 CYS A O 1 ATOM 13 C CB . CYS A 1 9 ? -55.741 -9.336 -41.528 1.00 111.96 ? 8 CYS A CB 1 ATOM 14 S SG . CYS A 1 9 ? -54.470 -8.707 -40.398 1.00 115.58 ? 8 CYS A SG 1 ATOM 15 N N . LEU A 1 10 ? -55.466 -11.278 -43.969 1.00 113.08 ? 9 LEU A N 1 ATOM 16 C CA . LEU A 1 10 ? -55.852 -12.367 -44.867 1.00 113.26 ? 9 LEU A CA 1 ATOM 17 C C . LEU A 1 10 ? -56.443 -13.597 -44.170 1.00 116.87 ? 9 LEU A C 1 ATOM 18 O O . LEU A 1 10 ? -55.976 -14.005 -43.105 1.00 115.96 ? 9 LEU A O 1 ATOM 19 C CB . LEU A 1 10 ? -54.632 -12.773 -45.713 1.00 113.73 ? 9 LEU A CB 1 ATOM 20 C CG . LEU A 1 10 ? -54.898 -13.344 -47.100 1.00 119.17 ? 9 LEU A CG 1 ATOM 21 C CD1 . LEU A 1 10 ? -53.990 -12.702 -48.130 1.00 119.98 ? 9 LEU A CD1 1 ATOM 22 C CD2 . LEU A 1 10 ? -54.722 -14.852 -47.112 1.00 121.65 ? 9 LEU A CD2 1 ATOM 23 N N . LEU A 1 11 ? -57.460 -14.194 -44.812 1.00 113.84 ? 10 LEU A N 1 ATOM 24 C CA . LEU A 1 11 ? -58.136 -15.415 -44.381 1.00 113.56 ? 10 LEU A CA 1 ATOM 25 C C . LEU A 1 11 ? -58.537 -16.193 -45.635 1.00 118.08 ? 10 LEU A C 1 ATOM 26 O O . LEU A 1 11 ? -59.593 -15.939 -46.220 1.00 118.03 ? 10 LEU A O 1 ATOM 27 C CB . LEU A 1 11 ? -59.348 -15.107 -43.470 1.00 113.37 ? 10 LEU A CB 1 ATOM 28 C CG . LEU A 1 11 ? -59.928 -16.218 -42.561 1.00 117.89 ? 10 LEU A CG 1 ATOM 29 C CD1 . LEU A 1 11 ? -61.125 -16.894 -43.206 1.00 118.58 ? 10 LEU A CD1 1 ATOM 30 C CD2 . LEU A 1 11 ? -58.877 -17.242 -42.118 1.00 120.10 ? 10 LEU A CD2 1 ATOM 31 N N . ALA A 1 12 ? -57.644 -17.108 -46.069 1.00 114.83 ? 11 ALA A N 1 ATOM 32 C CA . ALA A 1 12 ? -57.760 -17.965 -47.255 1.00 115.38 ? 11 ALA A CA 1 ATOM 33 C C . ALA A 1 12 ? -58.003 -17.201 -48.572 1.00 119.94 ? 11 ALA A C 1 ATOM 34 O O . ALA A 1 12 ? -57.060 -17.032 -49.347 1.00 119.89 ? 11 ALA A O 1 ATOM 35 C CB . ALA A 1 12 ? -58.797 -19.067 -47.043 1.00 116.28 ? 11 ALA A CB 1 ATOM 36 N N . ASN A 1 13 ? -59.247 -16.731 -48.816 1.00 116.72 ? 12 ASN A N 1 ATOM 37 C CA . ASN A 1 13 ? -59.624 -16.003 -50.031 1.00 117.27 ? 12 ASN A CA 1 ATOM 38 C C . ASN A 1 13 ? -60.644 -14.878 -49.770 1.00 120.77 ? 12 ASN A C 1 ATOM 39 O O . ASN A 1 13 ? -61.400 -14.534 -50.685 1.00 121.00 ? 12 ASN A O 1 ATOM 40 C CB . ASN A 1 13 ? -60.181 -16.985 -51.077 1.00 119.13 ? 12 ASN A CB 1 ATOM 41 C CG . ASN A 1 13 ? -59.133 -17.753 -51.839 1.00 143.14 ? 12 ASN A CG 1 ATOM 42 O OD1 . ASN A 1 13 ? -58.534 -18.707 -51.334 1.00 137.38 ? 12 ASN A OD1 1 ATOM 43 N ND2 . ASN A 1 13 ? -58.930 -17.388 -53.096 1.00 136.02 ? 12 ASN A ND2 1 ATOM 44 N N . THR A 1 14 ? -60.662 -14.286 -48.552 1.00 116.38 ? 13 THR A N 1 ATOM 45 C CA . THR A 1 14 ? -61.653 -13.240 -48.254 1.00 116.03 ? 13 THR A CA 1 ATOM 46 C C . THR A 1 14 ? -61.185 -11.770 -48.135 1.00 119.46 ? 13 THR A C 1 ATOM 47 O O . THR A 1 14 ? -61.838 -10.903 -48.718 1.00 119.45 ? 13 THR A O 1 ATOM 48 C CB . THR A 1 14 ? -62.662 -13.681 -47.172 1.00 123.75 ? 13 THR A CB 1 ATOM 49 O OG1 . THR A 1 14 ? -63.812 -12.833 -47.209 1.00 123.60 ? 13 THR A OG1 1 ATOM 50 C CG2 . THR A 1 14 ? -62.071 -13.716 -45.764 1.00 121.52 ? 13 THR A CG2 1 ATOM 51 N N . THR A 1 15 ? -60.092 -11.491 -47.379 1.00 115.25 ? 14 THR A N 1 ATOM 52 C CA . THR A 1 15 ? -59.526 -10.152 -47.076 1.00 114.76 ? 14 THR A CA 1 ATOM 53 C C . THR A 1 15 ? -60.454 -9.362 -46.133 1.00 117.92 ? 14 THR A C 1 ATOM 54 O O . THR A 1 15 ? -61.599 -9.085 -46.487 1.00 117.75 ? 14 THR A O 1 ATOM 55 C CB . THR A 1 15 ? -59.032 -9.383 -48.325 1.00 123.52 ? 14 THR A CB 1 ATOM 56 O OG1 . THR A 1 15 ? -58.566 -10.305 -49.314 1.00 123.50 ? 14 THR A OG1 1 ATOM 57 C CG2 . THR A 1 15 ? -57.931 -8.387 -48.000 1.00 122.05 ? 14 THR A CG2 1 ATOM 58 N N . PHE A 1 16 ? -59.963 -9.031 -44.926 1.00 113.72 ? 15 PHE A N 1 ATOM 59 C CA . PHE A 1 16 ? -60.750 -8.377 -43.873 1.00 113.13 ? 15 PHE A CA 1 ATOM 60 C C . PHE A 1 16 ? -59.926 -7.371 -43.038 1.00 116.38 ? 15 PHE A C 1 ATOM 61 O O . PHE A 1 16 ? -58.708 -7.543 -42.964 1.00 115.83 ? 15 PHE A O 1 ATOM 62 C CB . PHE A 1 16 ? -61.338 -9.470 -42.945 1.00 114.64 ? 15 PHE A CB 1 ATOM 63 C CG . PHE A 1 16 ? -60.317 -10.239 -42.131 1.00 115.83 ? 15 PHE A CG 1 ATOM 64 C CD1 . PHE A 1 16 ? -59.647 -11.331 -42.673 1.00 119.03 ? 15 PHE A CD1 1 ATOM 65 C CD2 . PHE A 1 16 ? -60.040 -9.883 -40.817 1.00 117.64 ? 15 PHE A CD2 1 ATOM 66 C CE1 . PHE A 1 16 ? -58.694 -12.028 -41.926 1.00 119.61 ? 15 PHE A CE1 1 ATOM 67 C CE2 . PHE A 1 16 ? -59.088 -10.582 -40.073 1.00 120.19 ? 15 PHE A CE2 1 ATOM 68 C CZ . PHE A 1 16 ? -58.434 -11.660 -40.626 1.00 118.31 ? 15 PHE A CZ 1 ATOM 69 N N . PRO A 1 17 ? -60.543 -6.375 -42.337 1.00 112.64 ? 16 PRO A N 1 ATOM 70 C CA . PRO A 1 17 ? -59.729 -5.475 -41.493 1.00 112.19 ? 16 PRO A CA 1 ATOM 71 C C . PRO A 1 17 ? -59.164 -6.216 -40.276 1.00 115.30 ? 16 PRO A C 1 ATOM 72 O O . PRO A 1 17 ? -59.911 -6.908 -39.582 1.00 114.64 ? 16 PRO A O 1 ATOM 73 C CB . PRO A 1 17 ? -60.703 -4.355 -41.106 1.00 114.07 ? 16 PRO A CB 1 ATOM 74 C CG . PRO A 1 17 ? -62.051 -4.958 -41.219 1.00 118.57 ? 16 PRO A CG 1 ATOM 75 C CD . PRO A 1 17 ? -61.979 -6.020 -42.280 1.00 114.29 ? 16 PRO A CD 1 ATOM 76 N N . CYS A 1 18 ? -57.834 -6.110 -40.060 1.00 111.57 ? 17 CYS A N 1 ATOM 77 C CA . CYS A 1 18 ? -57.073 -6.769 -38.987 1.00 110.98 ? 17 CYS A CA 1 ATOM 78 C C . CYS A 1 18 ? -57.717 -6.697 -37.602 1.00 113.63 ? 17 CYS A C 1 ATOM 79 O O . CYS A 1 18 ? -57.809 -7.720 -36.924 1.00 112.94 ? 17 CYS A O 1 ATOM 80 C CB . CYS A 1 18 ? -55.630 -6.276 -38.958 1.00 111.60 ? 17 CYS A CB 1 ATOM 81 S SG . CYS A 1 18 ? -54.673 -6.684 -40.441 1.00 115.87 ? 17 CYS A SG 1 ATOM 82 N N . SER A 1 19 ? -58.188 -5.503 -37.203 1.00 109.61 ? 18 SER A N 1 ATOM 83 C CA . SER A 1 19 ? -58.843 -5.266 -35.915 1.00 109.05 ? 18 SER A CA 1 ATOM 84 C C . SER A 1 19 ? -60.237 -5.914 -35.817 1.00 111.85 ? 18 SER A C 1 ATOM 85 O O . SER A 1 19 ? -60.757 -6.063 -34.708 1.00 111.44 ? 18 SER A O 1 ATOM 86 C CB . SER A 1 19 ? -58.938 -3.768 -35.638 1.00 112.93 ? 18 SER A CB 1 ATOM 87 O OG . SER A 1 19 ? -59.749 -3.113 -36.600 1.00 121.91 ? 18 SER A OG 1 ATOM 88 N N . GLN A 1 20 ? -60.836 -6.301 -36.966 1.00 107.59 ? 19 GLN A N 1 ATOM 89 C CA . GLN A 1 20 ? -62.169 -6.910 -37.010 1.00 107.05 ? 19 GLN A CA 1 ATOM 90 C C . GLN A 1 20 ? -62.216 -8.318 -37.668 1.00 109.64 ? 19 GLN A C 1 ATOM 91 O O . GLN A 1 20 ? -62.760 -8.450 -38.771 1.00 109.38 ? 19 GLN A O 1 ATOM 92 C CB . GLN A 1 20 ? -63.186 -5.945 -37.654 1.00 108.73 ? 19 GLN A CB 1 ATOM 93 C CG . GLN A 1 20 ? -63.556 -4.746 -36.787 1.00 124.87 ? 19 GLN A CG 1 ATOM 94 C CD . GLN A 1 20 ? -64.297 -3.693 -37.572 1.00 145.34 ? 19 GLN A CD 1 ATOM 95 O OE1 . GLN A 1 20 ? -65.442 -3.885 -38.002 1.00 141.34 ? 19 GLN A OE1 1 ATOM 96 N NE2 . GLN A 1 20 ? -63.663 -2.547 -37.764 1.00 137.87 ? 19 GLN A NE2 1 ATOM 97 N N . PRO A 1 21 ? -61.692 -9.390 -37.015 1.00 105.09 ? 20 PRO A N 1 ATOM 98 C CA . PRO A 1 21 ? -61.800 -10.731 -37.625 1.00 104.49 ? 20 PRO A CA 1 ATOM 99 C C . PRO A 1 21 ? -63.236 -11.280 -37.553 1.00 107.31 ? 20 PRO A C 1 ATOM 100 O O . PRO A 1 21 ? -63.962 -10.901 -36.631 1.00 106.92 ? 20 PRO A O 1 ATOM 101 C CB . PRO A 1 21 ? -60.796 -11.575 -36.834 1.00 106.07 ? 20 PRO A CB 1 ATOM 102 C CG . PRO A 1 21 ? -60.650 -10.892 -35.534 1.00 110.60 ? 20 PRO A CG 1 ATOM 103 C CD . PRO A 1 21 ? -61.024 -9.445 -35.697 1.00 106.39 ? 20 PRO A CD 1 ATOM 104 N N . PRO A 1 22 ? -63.687 -12.135 -38.510 1.00 103.08 ? 21 PRO A N 1 ATOM 105 C CA . PRO A 1 22 ? -65.084 -12.617 -38.470 1.00 102.81 ? 21 PRO A CA 1 ATOM 106 C C . PRO A 1 22 ? -65.462 -13.527 -37.298 1.00 105.37 ? 21 PRO A C 1 ATOM 107 O O . PRO A 1 22 ? -66.651 -13.687 -37.018 1.00 105.28 ? 21 PRO A O 1 ATOM 108 C CB . PRO A 1 22 ? -65.253 -13.325 -39.817 1.00 104.94 ? 21 PRO A CB 1 ATOM 109 C CG . PRO A 1 22 ? -63.884 -13.751 -40.190 1.00 109.27 ? 21 PRO A CG 1 ATOM 110 C CD . PRO A 1 22 ? -62.976 -12.665 -39.693 1.00 104.55 ? 21 PRO A CD 1 ATOM 111 N N . CYS A 1 23 ? -64.462 -14.113 -36.618 1.00 100.60 ? 22 CYS A N 1 ATOM 112 C CA . CYS A 1 23 ? -64.645 -15.017 -35.479 1.00 99.97 ? 22 CYS A CA 1 ATOM 113 C C . CYS A 1 23 ? -65.125 -14.336 -34.187 1.00 103.60 ? 22 CYS A C 1 ATOM 114 O O . CYS A 1 23 ? -65.632 -15.029 -33.301 1.00 103.34 ? 22 CYS A O 1 ATOM 115 C CB . CYS A 1 23 ? -63.387 -15.849 -35.241 1.00 99.73 ? 22 CYS A CB 1 ATOM 116 S SG . CYS A 1 23 ? -61.861 -14.878 -35.105 1.00 102.99 ? 22 CYS A SG 1 ATOM 117 N N . THR A 1 24 ? -64.935 -12.998 -34.067 1.00 99.89 ? 23 THR A N 1 ATOM 118 C CA . THR A 1 24 ? -65.295 -12.194 -32.885 1.00 99.78 ? 23 THR A CA 1 ATOM 119 C C . THR A 1 24 ? -66.774 -12.293 -32.474 1.00 103.72 ? 23 THR A C 1 ATOM 120 O O . THR A 1 24 ? -67.642 -12.270 -33.349 1.00 103.41 ? 23 THR A O 1 ATOM 121 C CB . THR A 1 24 ? -64.851 -10.728 -33.032 1.00 107.99 ? 23 THR A CB 1 ATOM 122 O OG1 . THR A 1 24 ? -65.295 -10.210 -34.286 1.00 107.68 ? 23 THR A OG1 1 ATOM 123 C CG2 . THR A 1 24 ? -63.348 -10.546 -32.869 1.00 106.37 ? 23 THR A CG2 1 ATOM 124 N N . PRO A 1 25 ? -67.094 -12.403 -31.161 1.00 100.35 ? 24 PRO A N 1 ATOM 125 C CA . PRO A 1 25 ? -66.188 -12.438 -29.998 1.00 100.03 ? 24 PRO A CA 1 ATOM 126 C C . PRO A 1 25 ? -65.670 -13.833 -29.642 1.00 103.46 ? 24 PRO A C 1 ATOM 127 O O . PRO A 1 25 ? -66.198 -14.828 -30.146 1.00 103.07 ? 24 PRO A O 1 ATOM 128 C CB . PRO A 1 25 ? -67.055 -11.842 -28.888 1.00 102.38 ? 24 PRO A CB 1 ATOM 129 C CG . PRO A 1 25 ? -68.461 -12.276 -29.233 1.00 107.26 ? 24 PRO A CG 1 ATOM 130 C CD . PRO A 1 25 ? -68.507 -12.483 -30.736 1.00 102.47 ? 24 PRO A CD 1 ATOM 131 N N . CYS A 1 26 ? -64.644 -13.897 -28.755 1.00 99.71 ? 25 CYS A N 1 ATOM 132 C CA . CYS A 1 26 ? -64.016 -15.129 -28.253 1.00 99.39 ? 25 CYS A CA 1 ATOM 133 C C . CYS A 1 26 ? -63.487 -16.019 -29.396 1.00 102.92 ? 25 CYS A C 1 ATOM 134 O O . CYS A 1 26 ? -63.903 -17.174 -29.501 1.00 102.66 ? 25 CYS A O 1 ATOM 135 C CB . CYS A 1 26 ? -64.980 -15.895 -27.341 1.00 100.19 ? 25 CYS A CB 1 ATOM 136 S SG . CYS A 1 26 ? -64.686 -15.683 -25.565 1.00 104.57 ? 25 CYS A SG 1 ATOM 137 N N . CYS A 1 27 ? -62.590 -15.484 -30.257 1.00 99.08 ? 26 CYS A N 1 ATOM 138 C CA . CYS A 1 27 ? -62.022 -16.226 -31.395 1.00 98.61 ? 26 CYS A CA 1 ATOM 139 C C . CYS A 1 27 ? -61.347 -17.527 -30.961 1.00 101.35 ? 26 CYS A C 1 ATOM 140 O O . CYS A 1 27 ? -61.654 -18.592 -31.505 1.00 100.94 ? 26 CYS A O 1 ATOM 141 C CB . CYS A 1 27 ? -61.069 -15.351 -32.206 1.00 98.86 ? 26 CYS A CB 1 ATOM 142 S SG . CYS A 1 27 ? -61.887 -14.099 -33.226 1.00 102.97 ? 26 CYS A SG 1 ATOM 143 N N . TYR A 1 28 ? -60.439 -17.432 -29.973 1.00 97.07 ? 27 TYR A N 1 ATOM 144 C CA . TYR A 1 28 ? -59.685 -18.563 -29.440 1.00 96.50 ? 27 TYR A CA 1 ATOM 145 C C . TYR A 1 28 ? -60.558 -19.553 -28.662 1.00 99.87 ? 27 TYR A C 1 ATOM 146 O O . TYR A 1 28 ? -60.331 -20.758 -28.767 1.00 99.46 ? 27 TYR A O 1 ATOM 147 C CB . TYR A 1 28 ? -58.499 -18.077 -28.585 1.00 97.61 ? 27 TYR A CB 1 ATOM 148 C CG . TYR A 1 28 ? -57.580 -19.195 -28.141 1.00 99.31 ? 27 TYR A CG 1 ATOM 149 C CD1 . TYR A 1 28 ? -56.556 -19.652 -28.965 1.00 100.90 ? 27 TYR A CD1 1 ATOM 150 C CD2 . TYR A 1 28 ? -57.747 -19.812 -26.904 1.00 100.51 ? 27 TYR A CD2 1 ATOM 151 C CE1 . TYR A 1 28 ? -55.721 -20.696 -28.570 1.00 101.68 ? 27 TYR A CE1 1 ATOM 152 C CE2 . TYR A 1 28 ? -56.930 -20.869 -26.506 1.00 101.47 ? 27 TYR A CE2 1 ATOM 153 C CZ . TYR A 1 28 ? -55.913 -21.303 -27.340 1.00 108.38 ? 27 TYR A CZ 1 ATOM 154 O OH . TYR A 1 28 ? -55.088 -22.328 -26.944 1.00 109.36 ? 27 TYR A OH 1 ATOM 155 N N . GLU A 1 29 ? -61.524 -19.055 -27.866 1.00 96.11 ? 28 GLU A N 1 ATOM 156 C CA . GLU A 1 29 ? -62.408 -19.903 -27.057 1.00 96.16 ? 28 GLU A CA 1 ATOM 157 C C . GLU A 1 29 ? -63.338 -20.770 -27.913 1.00 99.12 ? 28 GLU A C 1 ATOM 158 O O . GLU A 1 29 ? -63.533 -21.943 -27.592 1.00 98.97 ? 28 GLU A O 1 ATOM 159 C CB . GLU A 1 29 ? -63.209 -19.074 -26.033 1.00 98.10 ? 28 GLU A CB 1 ATOM 160 C CG . GLU A 1 29 ? -62.374 -18.422 -24.936 1.00 108.95 ? 28 GLU A CG 1 ATOM 161 C CD . GLU A 1 29 ? -61.831 -19.337 -23.857 1.00 130.32 ? 28 GLU A CD 1 ATOM 162 O OE1 . GLU A 1 29 ? -62.509 -19.494 -22.817 1.00 125.90 ? 28 GLU A OE1 1 ATOM 163 O OE2 . GLU A 1 29 ? -60.710 -19.866 -24.034 1.00 124.26 ? 28 GLU A OE2 1 ATOM 164 N N . LYS A 1 30 ? -63.886 -20.200 -29.007 1.00 94.76 ? 29 LYS A N 1 ATOM 165 C CA . LYS A 1 30 ? -64.794 -20.887 -29.932 1.00 94.40 ? 29 LYS A CA 1 ATOM 166 C C . LYS A 1 30 ? -64.083 -21.984 -30.723 1.00 97.13 ? 29 LYS A C 1 ATOM 167 O O . LYS A 1 30 ? -64.552 -23.123 -30.737 1.00 97.05 ? 29 LYS A O 1 ATOM 168 C CB . LYS A 1 30 ? -65.493 -19.889 -30.880 1.00 96.83 ? 29 LYS A CB 1 ATOM 169 C CG . LYS A 1 30 ? -66.575 -19.032 -30.215 1.00 111.92 ? 29 LYS A CG 1 ATOM 170 C CD . LYS A 1 30 ? -67.932 -19.739 -30.088 1.00 122.87 ? 29 LYS A CD 1 ATOM 171 C CE . LYS A 1 30 ? -68.688 -19.341 -28.838 1.00 134.27 ? 29 LYS A CE 1 ATOM 172 N NZ . LYS A 1 30 ? -69.258 -17.968 -28.927 1.00 143.28 ? 29 LYS A NZ 1 ATOM 173 N N . GLU A 1 31 ? -62.952 -21.643 -31.370 1.00 92.46 ? 30 GLU A N 1 ATOM 174 C CA . GLU A 1 31 ? -62.149 -22.577 -32.156 1.00 91.74 ? 30 GLU A CA 1 ATOM 175 C C . GLU A 1 31 ? -60.657 -22.211 -32.035 1.00 94.16 ? 30 GLU A C 1 ATOM 176 O O . GLU A 1 31 ? -60.179 -21.340 -32.768 1.00 93.37 ? 30 GLU A O 1 ATOM 177 C CB . GLU A 1 31 ? -62.625 -22.617 -33.621 1.00 93.19 ? 30 GLU A CB 1 ATOM 178 C CG . GLU A 1 31 ? -62.684 -24.018 -34.210 1.00 104.23 ? 30 GLU A CG 1 ATOM 179 C CD . GLU A 1 31 ? -63.855 -24.869 -33.756 1.00 125.32 ? 30 GLU A CD 1 ATOM 180 O OE1 . GLU A 1 31 ? -65.008 -24.539 -34.115 1.00 120.39 ? 30 GLU A OE1 1 ATOM 181 O OE2 . GLU A 1 31 ? -63.616 -25.882 -33.059 1.00 119.13 ? 30 GLU A OE2 1 ATOM 182 N N . PRO A 1 32 ? -59.916 -22.839 -31.087 1.00 90.04 ? 31 PRO A N 1 ATOM 183 C CA . PRO A 1 32 ? -58.495 -22.484 -30.904 1.00 89.19 ? 31 PRO A CA 1 ATOM 184 C C . PRO A 1 32 ? -57.565 -22.803 -32.073 1.00 91.91 ? 31 PRO A C 1 ATOM 185 O O . PRO A 1 32 ? -56.647 -22.024 -32.332 1.00 91.16 ? 31 PRO A O 1 ATOM 186 C CB . PRO A 1 32 ? -58.100 -23.237 -29.629 1.00 91.21 ? 31 PRO A CB 1 ATOM 187 C CG . PRO A 1 32 ? -59.054 -24.363 -29.539 1.00 96.15 ? 31 PRO A CG 1 ATOM 188 C CD . PRO A 1 32 ? -60.343 -23.868 -30.115 1.00 91.92 ? 31 PRO A CD 1 ATOM 189 N N . GLU A 1 33 ? -57.803 -23.931 -32.775 1.00 88.03 ? 32 GLU A N 1 ATOM 190 C CA . GLU A 1 33 ? -56.993 -24.383 -33.910 1.00 87.41 ? 32 GLU A CA 1 ATOM 191 C C . GLU A 1 33 ? -57.019 -23.409 -35.097 1.00 90.40 ? 32 GLU A C 1 ATOM 192 O O . GLU A 1 33 ? -55.953 -22.975 -35.535 1.00 89.71 ? 32 GLU A O 1 ATOM 193 C CB . GLU A 1 33 ? -57.391 -25.806 -34.340 1.00 89.12 ? 32 GLU A CB 1 ATOM 194 C CG . GLU A 1 33 ? -56.310 -26.534 -35.125 1.00 99.45 ? 32 GLU A CG 1 ATOM 195 C CD . GLU A 1 33 ? -56.674 -27.928 -35.600 1.00 119.84 ? 32 GLU A CD 1 ATOM 196 O OE1 . GLU A 1 33 ? -57.073 -28.763 -34.756 1.00 114.21 ? 32 GLU A OE1 1 ATOM 197 O OE2 . GLU A 1 33 ? -56.521 -28.197 -36.813 1.00 113.80 ? 32 GLU A OE2 1 ATOM 198 N N . GLU A 1 34 ? -58.223 -23.052 -35.595 1.00 86.64 ? 33 GLU A N 1 ATOM 199 C CA . GLU A 1 34 ? -58.411 -22.143 -36.734 1.00 86.18 ? 33 GLU A CA 1 ATOM 200 C C . GLU A 1 34 ? -57.982 -20.695 -36.440 1.00 88.97 ? 33 GLU A C 1 ATOM 201 O O . GLU A 1 34 ? -57.620 -19.975 -37.372 1.00 88.43 ? 33 GLU A O 1 ATOM 202 C CB . GLU A 1 34 ? -59.863 -22.203 -37.238 1.00 87.96 ? 33 GLU A CB 1 ATOM 203 C CG . GLU A 1 34 ? -60.029 -21.905 -38.716 1.00 98.89 ? 33 GLU A CG 1 ATOM 204 C CD . GLU A 1 34 ? -61.473 -21.868 -39.176 1.00 119.72 ? 33 GLU A CD 1 ATOM 205 O OE1 . GLU A 1 34 ? -62.148 -20.842 -38.932 1.00 113.92 ? 33 GLU A OE1 1 ATOM 206 O OE2 . GLU A 1 34 ? -61.928 -22.861 -39.788 1.00 114.05 ? 33 GLU A OE2 1 ATOM 207 N N . THR A 1 35 ? -58.016 -20.275 -35.153 1.00 84.87 ? 34 THR A N 1 ATOM 208 C CA . THR A 1 35 ? -57.606 -18.936 -34.709 1.00 84.24 ? 34 THR A CA 1 ATOM 209 C C . THR A 1 35 ? -56.086 -18.786 -34.866 1.00 87.27 ? 34 THR A C 1 ATOM 210 O O . THR A 1 35 ? -55.631 -17.797 -35.444 1.00 86.79 ? 34 THR A O 1 ATOM 211 C CB . THR A 1 35 ? -58.119 -18.650 -33.279 1.00 92.32 ? 34 THR A CB 1 ATOM 212 O OG1 . THR A 1 35 ? -59.540 -18.797 -33.258 1.00 92.15 ? 34 THR A OG1 1 ATOM 213 C CG2 . THR A 1 35 ? -57.750 -17.252 -32.780 1.00 90.93 ? 34 THR A CG2 1 ATOM 214 N N . LEU A 1 36 ? -55.316 -19.782 -34.378 1.00 83.25 ? 35 LEU A N 1 ATOM 215 C CA . LEU A 1 36 ? -53.854 -19.825 -34.460 1.00 82.64 ? 35 LEU A CA 1 ATOM 216 C C . LEU A 1 36 ? -53.380 -19.934 -35.909 1.00 85.95 ? 35 LEU A C 1 ATOM 217 O O . LEU A 1 36 ? -52.403 -19.278 -36.271 1.00 85.43 ? 35 LEU A O 1 ATOM 218 C CB . LEU A 1 36 ? -53.306 -20.994 -33.622 1.00 82.71 ? 35 LEU A CB 1 ATOM 219 C CG . LEU A 1 36 ? -52.670 -20.663 -32.268 1.00 87.45 ? 35 LEU A CG 1 ATOM 220 C CD1 . LEU A 1 36 ? -53.627 -19.915 -31.351 1.00 87.76 ? 35 LEU A CD1 1 ATOM 221 C CD2 . LEU A 1 36 ? -52.204 -21.923 -31.579 1.00 89.97 ? 35 LEU A CD2 1 ATOM 222 N N . ARG A 1 37 ? -54.092 -20.736 -36.738 1.00 82.32 ? 36 ARG A N 1 ATOM 223 C CA . ARG A 1 37 ? -53.803 -20.923 -38.165 1.00 82.17 ? 36 ARG A CA 1 ATOM 224 C C . ARG A 1 37 ? -53.941 -19.594 -38.913 1.00 85.71 ? 36 ARG A C 1 ATOM 225 O O . ARG A 1 37 ? -53.077 -19.261 -39.725 1.00 85.35 ? 36 ARG A O 1 ATOM 226 C CB . ARG A 1 37 ? -54.724 -21.995 -38.782 1.00 82.76 ? 36 ARG A CB 1 ATOM 227 C CG . ARG A 1 37 ? -54.372 -23.433 -38.395 1.00 93.31 ? 36 ARG A CG 1 ATOM 228 C CD . ARG A 1 37 ? -53.380 -24.081 -39.341 1.00 103.75 ? 36 ARG A CD 1 ATOM 229 N NE . ARG A 1 37 ? -54.032 -25.051 -40.221 1.00 113.08 ? 36 ARG A NE 1 ATOM 230 C CZ . ARG A 1 37 ? -53.391 -25.834 -41.083 1.00 127.69 ? 36 ARG A CZ 1 ATOM 231 N NH1 . ARG A 1 37 ? -52.069 -25.773 -41.192 1.00 114.88 ? 36 ARG A NH1 1 ATOM 232 N NH2 . ARG A 1 37 ? -54.067 -26.686 -41.842 1.00 115.09 ? 36 ARG A NH2 1 ATOM 233 N N . MET A 1 38 ? -55.005 -18.822 -38.594 1.00 82.03 ? 37 MET A N 1 ATOM 234 C CA . MET A 1 38 ? -55.298 -17.500 -39.156 1.00 81.81 ? 37 MET A CA 1 ATOM 235 C C . MET A 1 38 ? -54.189 -16.505 -38.781 1.00 85.05 ? 37 MET A C 1 ATOM 236 O O . MET A 1 38 ? -53.745 -15.740 -39.640 1.00 84.74 ? 37 MET A O 1 ATOM 237 C CB . MET A 1 38 ? -56.675 -17.012 -38.665 1.00 84.17 ? 37 MET A CB 1 ATOM 238 C CG . MET A 1 38 ? -57.076 -15.638 -39.182 1.00 87.97 ? 37 MET A CG 1 ATOM 239 S SD . MET A 1 38 ? -58.586 -14.997 -38.413 1.00 92.22 ? 37 MET A SD 1 ATOM 240 C CE . MET A 1 38 ? -58.008 -14.687 -36.737 1.00 88.64 ? 37 MET A CE 1 ATOM 241 N N . LEU A 1 39 ? -53.738 -16.535 -37.507 1.00 81.08 ? 38 LEU A N 1 ATOM 242 C CA . LEU A 1 39 ? -52.670 -15.673 -36.992 1.00 80.70 ? 38 LEU A CA 1 ATOM 243 C C . LEU A 1 39 ? -51.332 -15.987 -37.666 1.00 84.36 ? 38 LEU A C 1 ATOM 244 O O . LEU A 1 39 ? -50.596 -15.063 -38.012 1.00 84.03 ? 38 LEU A O 1 ATOM 245 C CB . LEU A 1 39 ? -52.551 -15.784 -35.459 1.00 80.62 ? 38 LEU A CB 1 ATOM 246 C CG . LEU A 1 39 ? -53.682 -15.155 -34.632 1.00 85.30 ? 38 LEU A CG 1 ATOM 247 C CD1 . LEU A 1 39 ? -53.684 -15.689 -33.213 1.00 85.48 ? 38 LEU A CD1 1 ATOM 248 C CD2 . LEU A 1 39 ? -53.591 -13.639 -34.622 1.00 87.81 ? 38 LEU A CD2 1 ATOM 249 N N . GLU A 1 40 ? -51.049 -17.289 -37.895 1.00 80.73 ? 39 GLU A N 1 ATOM 250 C CA . GLU A 1 40 ? -49.836 -17.780 -38.559 1.00 80.63 ? 39 GLU A CA 1 ATOM 251 C C . GLU A 1 40 ? -49.747 -17.304 -40.014 1.00 84.64 ? 39 GLU A C 1 ATOM 252 O O . GLU A 1 40 ? -48.648 -17.049 -40.505 1.00 84.36 ? 39 GLU A O 1 ATOM 253 C CB . GLU A 1 40 ? -49.772 -19.314 -38.500 1.00 81.96 ? 39 GLU A CB 1 ATOM 254 C CG . GLU A 1 40 ? -49.259 -19.858 -37.176 1.00 92.06 ? 39 GLU A CG 1 ATOM 255 C CD . GLU A 1 40 ? -49.633 -21.293 -36.853 1.00 111.52 ? 39 GLU A CD 1 ATOM 256 O OE1 . GLU A 1 40 ? -49.816 -22.099 -37.794 1.00 106.12 ? 39 GLU A OE1 1 ATOM 257 O OE2 . GLU A 1 40 ? -49.711 -21.621 -35.647 1.00 104.49 ? 39 GLU A OE2 1 ATOM 258 N N . ASP A 1 41 ? -50.904 -17.171 -40.691 1.00 81.29 ? 40 ASP A N 1 ATOM 259 C CA . ASP A 1 41 ? -50.996 -16.714 -42.080 1.00 81.53 ? 40 ASP A CA 1 ATOM 260 C C . ASP A 1 41 ? -50.790 -15.197 -42.226 1.00 85.33 ? 40 ASP A C 1 ATOM 261 O O . ASP A 1 41 ? -50.588 -14.721 -43.346 1.00 85.35 ? 40 ASP A O 1 ATOM 262 C CB . ASP A 1 41 ? -52.347 -17.130 -42.697 1.00 83.54 ? 40 ASP A CB 1 ATOM 263 C CG . ASP A 1 41 ? -52.582 -18.627 -42.806 1.00 93.48 ? 40 ASP A CG 1 ATOM 264 O OD1 . ASP A 1 41 ? -51.612 -19.364 -43.090 1.00 94.06 ? 40 ASP A OD1 1 ATOM 265 O OD2 . ASP A 1 41 ? -53.746 -19.056 -42.655 1.00 99.36 ? 40 ASP A OD2 1 ATOM 266 N N . ASN A 1 42 ? -50.834 -14.445 -41.104 1.00 81.40 ? 41 ASN A N 1 ATOM 267 C CA . ASN A 1 42 ? -50.699 -12.986 -41.097 1.00 81.25 ? 41 ASN A CA 1 ATOM 268 C C . ASN A 1 42 ? -49.457 -12.419 -40.387 1.00 84.84 ? 41 ASN A C 1 ATOM 269 O O . ASN A 1 42 ? -49.437 -11.223 -40.085 1.00 84.51 ? 41 ASN A O 1 ATOM 270 C CB . ASN A 1 42 ? -51.974 -12.344 -40.549 1.00 81.86 ? 41 ASN A CB 1 ATOM 271 C CG . ASN A 1 42 ? -53.146 -12.458 -41.477 1.00 104.64 ? 41 ASN A CG 1 ATOM 272 O OD1 . ASN A 1 42 ? -53.295 -11.674 -42.416 1.00 99.19 ? 41 ASN A OD1 1 ATOM 273 N ND2 . ASN A 1 42 ? -54.001 -13.438 -41.235 1.00 96.36 ? 41 ASN A ND2 1 ATOM 274 N N . VAL A 1 43 ? -48.417 -13.246 -40.151 1.00 81.18 ? 42 VAL A N 1 ATOM 275 C CA . VAL A 1 43 ? -47.181 -12.798 -39.483 1.00 81.02 ? 42 VAL A CA 1 ATOM 276 C C . VAL A 1 43 ? -46.380 -11.741 -40.242 1.00 85.32 ? 42 VAL A C 1 ATOM 277 O O . VAL A 1 43 ? -45.800 -10.854 -39.614 1.00 85.02 ? 42 VAL A O 1 ATOM 278 C CB . VAL A 1 43 ? -46.280 -13.931 -38.937 1.00 84.77 ? 42 VAL A CB 1 ATOM 279 C CG1 . VAL A 1 43 ? -46.875 -14.533 -37.675 1.00 84.13 ? 42 VAL A CG1 1 ATOM 280 C CG2 . VAL A 1 43 ? -46.001 -15.003 -39.990 1.00 84.75 ? 42 VAL A CG2 1 ATOM 281 N N . MET A 1 44 ? -46.352 -11.834 -41.582 1.00 82.30 ? 43 MET A N 1 ATOM 282 C CA . MET A 1 44 ? -45.635 -10.896 -42.452 1.00 82.78 ? 43 MET A CA 1 ATOM 283 C C . MET A 1 44 ? -46.406 -9.580 -42.648 1.00 86.71 ? 43 MET A C 1 ATOM 284 O O . MET A 1 44 ? -45.806 -8.577 -43.042 1.00 86.77 ? 43 MET A O 1 ATOM 285 C CB . MET A 1 44 ? -45.307 -11.543 -43.814 1.00 85.66 ? 43 MET A CB 1 ATOM 286 C CG . MET A 1 44 ? -44.432 -12.786 -43.726 1.00 89.36 ? 43 MET A CG 1 ATOM 287 S SD . MET A 1 44 ? -42.768 -12.481 -43.086 1.00 93.90 ? 43 MET A SD 1 ATOM 288 C CE . MET A 1 44 ? -42.025 -14.063 -43.383 1.00 90.67 ? 43 MET A CE 1 ATOM 289 N N . ARG A 1 45 ? -47.727 -9.589 -42.367 1.00 82.83 ? 44 ARG A N 1 ATOM 290 C CA . ARG A 1 45 ? -48.616 -8.432 -42.502 1.00 82.73 ? 44 ARG A CA 1 ATOM 291 C C . ARG A 1 45 ? -48.330 -7.352 -41.444 1.00 86.68 ? 44 ARG A C 1 ATOM 292 O O . ARG A 1 45 ? -48.156 -7.694 -40.270 1.00 85.83 ? 44 ARG A O 1 ATOM 293 C CB . ARG A 1 45 ? -50.101 -8.856 -42.466 1.00 82.50 ? 44 ARG A CB 1 ATOM 294 C CG . ARG A 1 45 ? -50.548 -9.846 -43.561 1.00 92.73 ? 44 ARG A CG 1 ATOM 295 C CD . ARG A 1 45 ? -50.163 -9.489 -44.998 1.00 102.90 ? 44 ARG A CD 1 ATOM 296 N NE . ARG A 1 45 ? -50.779 -8.246 -45.467 1.00 111.38 ? 44 ARG A NE 1 ATOM 297 C CZ . ARG A 1 45 ? -51.704 -8.178 -46.420 1.00 125.74 ? 44 ARG A CZ 1 ATOM 298 N NH1 . ARG A 1 45 ? -52.136 -9.283 -47.017 1.00 113.21 ? 44 ARG A NH1 1 ATOM 299 N NH2 . ARG A 1 45 ? -52.206 -7.005 -46.783 1.00 112.82 ? 44 ARG A NH2 1 ATOM 300 N N . PRO A 1 46 ? -48.297 -6.049 -41.830 1.00 83.85 ? 45 PRO A N 1 ATOM 301 C CA . PRO A 1 46 ? -48.006 -4.990 -40.840 1.00 83.81 ? 45 PRO A CA 1 ATOM 302 C C . PRO A 1 46 ? -49.015 -4.845 -39.696 1.00 87.30 ? 45 PRO A C 1 ATOM 303 O O . PRO A 1 46 ? -48.643 -4.383 -38.615 1.00 86.89 ? 45 PRO A O 1 ATOM 304 C CB . PRO A 1 46 ? -47.920 -3.717 -41.688 1.00 86.20 ? 45 PRO A CB 1 ATOM 305 C CG . PRO A 1 46 ? -48.682 -4.024 -42.925 1.00 90.69 ? 45 PRO A CG 1 ATOM 306 C CD . PRO A 1 46 ? -48.472 -5.482 -43.184 1.00 85.96 ? 45 PRO A CD 1 ATOM 307 N N . GLY A 1 47 ? -50.262 -5.247 -39.939 1.00 83.58 ? 46 GLY A N 1 ATOM 308 C CA . GLY A 1 47 ? -51.335 -5.186 -38.953 1.00 83.05 ? 46 GLY A CA 1 ATOM 309 C C . GLY A 1 47 ? -51.539 -6.473 -38.177 1.00 86.44 ? 46 GLY A C 1 ATOM 310 O O . GLY A 1 47 ? -52.653 -6.740 -37.718 1.00 85.67 ? 46 GLY A O 1 ATOM 311 N N . TYR A 1 48 ? -50.461 -7.274 -38.010 1.00 83.10 ? 47 TYR A N 1 ATOM 312 C CA . TYR A 1 48 ? -50.492 -8.546 -37.282 1.00 82.59 ? 47 TYR A CA 1 ATOM 313 C C . TYR A 1 48 ? -50.887 -8.378 -35.812 1.00 86.58 ? 47 TYR A C 1 ATOM 314 O O . TYR A 1 48 ? -51.709 -9.151 -35.316 1.00 85.81 ? 47 TYR A O 1 ATOM 315 C CB . TYR A 1 48 ? -49.151 -9.306 -37.406 1.00 83.78 ? 47 TYR A CB 1 ATOM 316 C CG . TYR A 1 48 ? -49.062 -10.511 -36.492 1.00 85.09 ? 47 TYR A CG 1 ATOM 317 C CD1 . TYR A 1 48 ? -49.675 -11.714 -36.829 1.00 86.74 ? 47 TYR A CD1 1 ATOM 318 C CD2 . TYR A 1 48 ? -48.423 -10.428 -35.258 1.00 85.89 ? 47 TYR A CD2 1 ATOM 319 C CE1 . TYR A 1 48 ? -49.645 -12.808 -35.966 1.00 87.24 ? 47 TYR A CE1 1 ATOM 320 C CE2 . TYR A 1 48 ? -48.396 -11.511 -34.383 1.00 86.56 ? 47 TYR A CE2 1 ATOM 321 C CZ . TYR A 1 48 ? -48.993 -12.706 -34.749 1.00 93.48 ? 47 TYR A CZ 1 ATOM 322 O OH . TYR A 1 48 ? -48.948 -13.786 -33.900 1.00 94.06 ? 47 TYR A OH 1 ATOM 323 N N . TYR A 1 49 ? -50.279 -7.398 -35.114 1.00 83.76 ? 48 TYR A N 1 ATOM 324 C CA . TYR A 1 49 ? -50.553 -7.147 -33.700 1.00 83.80 ? 48 TYR A CA 1 ATOM 325 C C . TYR A 1 49 ? -51.952 -6.612 -33.409 1.00 87.97 ? 48 TYR A C 1 ATOM 326 O O . TYR A 1 49 ? -52.445 -6.794 -32.296 1.00 87.47 ? 48 TYR A O 1 ATOM 327 C CB . TYR A 1 49 ? -49.432 -6.346 -33.022 1.00 85.46 ? 48 TYR A CB 1 ATOM 328 C CG . TYR A 1 49 ? -48.180 -7.171 -32.815 1.00 87.24 ? 48 TYR A CG 1 ATOM 329 C CD1 . TYR A 1 49 ? -48.120 -8.147 -31.823 1.00 89.08 ? 48 TYR A CD1 1 ATOM 330 C CD2 . TYR A 1 49 ? -47.061 -6.992 -33.623 1.00 88.24 ? 48 TYR A CD2 1 ATOM 331 C CE1 . TYR A 1 49 ? -46.981 -8.930 -31.646 1.00 89.92 ? 48 TYR A CE1 1 ATOM 332 C CE2 . TYR A 1 49 ? -45.910 -7.759 -33.445 1.00 89.23 ? 48 TYR A CE2 1 ATOM 333 C CZ . TYR A 1 49 ? -45.873 -8.725 -32.452 1.00 96.39 ? 48 TYR A CZ 1 ATOM 334 O OH . TYR A 1 49 ? -44.743 -9.484 -32.269 1.00 97.43 ? 48 TYR A OH 1 ATOM 335 N N . GLN A 1 50 ? -52.609 -6.005 -34.419 1.00 84.94 ? 49 GLN A N 1 ATOM 336 C CA . GLN A 1 50 ? -53.991 -5.537 -34.315 1.00 84.92 ? 49 GLN A CA 1 ATOM 337 C C . GLN A 1 50 ? -54.910 -6.759 -34.375 1.00 88.83 ? 49 GLN A C 1 ATOM 338 O O . GLN A 1 50 ? -55.917 -6.805 -33.668 1.00 88.37 ? 49 GLN A O 1 ATOM 339 C CB . GLN A 1 50 ? -54.325 -4.537 -35.429 1.00 86.47 ? 49 GLN A CB 1 ATOM 340 C CG . GLN A 1 50 ? -53.846 -3.124 -35.118 1.00 102.93 ? 49 GLN A CG 1 ATOM 341 C CD . GLN A 1 50 ? -54.287 -2.113 -36.145 1.00 122.99 ? 49 GLN A CD 1 ATOM 342 O OE1 . GLN A 1 50 ? -55.483 -1.903 -36.383 1.00 118.57 ? 49 GLN A OE1 1 ATOM 343 N NE2 . GLN A 1 50 ? -53.327 -1.420 -36.737 1.00 115.65 ? 49 GLN A NE2 1 ATOM 344 N N . LEU A 1 51 ? -54.524 -7.768 -35.189 1.00 85.56 ? 50 LEU A N 1 ATOM 345 C CA . LEU A 1 51 ? -55.237 -9.036 -35.332 1.00 85.32 ? 50 LEU A CA 1 ATOM 346 C C . LEU A 1 51 ? -55.030 -9.912 -34.090 1.00 89.72 ? 50 LEU A C 1 ATOM 347 O O . LEU A 1 51 ? -55.989 -10.528 -33.623 1.00 89.21 ? 50 LEU A O 1 ATOM 348 C CB . LEU A 1 51 ? -54.811 -9.774 -36.622 1.00 85.29 ? 50 LEU A CB 1 ATOM 349 C CG . LEU A 1 51 ? -55.454 -11.148 -36.906 1.00 89.82 ? 50 LEU A CG 1 ATOM 350 C CD1 . LEU A 1 51 ? -56.943 -11.029 -37.187 1.00 90.05 ? 50 LEU A CD1 1 ATOM 351 C CD2 . LEU A 1 51 ? -54.765 -11.842 -38.058 1.00 92.30 ? 50 LEU A CD2 1 ATOM 352 N N . LEU A 1 52 ? -53.787 -9.954 -33.557 1.00 86.88 ? 51 LEU A N 1 ATOM 353 C CA . LEU A 1 52 ? -53.426 -10.719 -32.358 1.00 86.98 ? 51 LEU A CA 1 ATOM 354 C C . LEU A 1 52 ? -54.196 -10.211 -31.135 1.00 91.80 ? 51 LEU A C 1 ATOM 355 O O . LEU A 1 52 ? -54.692 -11.020 -30.346 1.00 91.36 ? 51 LEU A O 1 ATOM 356 C CB . LEU A 1 52 ? -51.900 -10.676 -32.116 1.00 87.17 ? 51 LEU A CB 1 ATOM 357 C CG . LEU A 1 52 ? -51.339 -11.581 -31.005 1.00 91.96 ? 51 LEU A CG 1 ATOM 358 C CD1 . LEU A 1 52 ? -51.270 -13.038 -31.447 1.00 91.84 ? 51 LEU A CD1 1 ATOM 359 C CD2 . LEU A 1 52 ? -49.966 -11.117 -30.573 1.00 94.78 ? 51 LEU A CD2 1 ATOM 360 N N . GLN A 1 53 ? -54.319 -8.873 -31.008 1.00 89.24 ? 52 GLN A N 1 ATOM 361 C CA . GLN A 1 53 ? -55.039 -8.203 -29.927 1.00 89.69 ? 52 GLN A CA 1 ATOM 362 C C . GLN A 1 53 ? -56.522 -8.584 -29.954 1.00 94.12 ? 52 GLN A C 1 ATOM 363 O O . GLN A 1 53 ? -57.030 -9.045 -28.939 1.00 93.85 ? 52 GLN A O 1 ATOM 364 C CB . GLN A 1 53 ? -54.854 -6.676 -30.010 1.00 91.37 ? 52 GLN A CB 1 ATOM 365 C CG . GLN A 1 53 ? -55.267 -5.923 -28.749 1.00 107.79 ? 52 GLN A CG 1 ATOM 366 C CD . GLN A 1 53 ? -55.059 -4.434 -28.877 1.00 128.26 ? 52 GLN A CD 1 ATOM 367 O OE1 . GLN A 1 53 ? -55.694 -3.755 -29.693 1.00 124.01 ? 52 GLN A OE1 1 ATOM 368 N NE2 . GLN A 1 53 ? -54.183 -3.886 -28.049 1.00 120.97 ? 52 GLN A NE2 1 ATOM 369 N N . ALA A 1 54 ? -57.189 -8.445 -31.119 1.00 91.02 ? 53 ALA A N 1 ATOM 370 C CA . ALA A 1 54 ? -58.611 -8.756 -31.305 1.00 91.08 ? 53 ALA A CA 1 ATOM 371 C C . ALA A 1 54 ? -58.966 -10.241 -31.139 1.00 95.43 ? 53 ALA A C 1 ATOM 372 O O . ALA A 1 54 ? -60.014 -10.548 -30.565 1.00 95.22 ? 53 ALA A O 1 ATOM 373 C CB . ALA A 1 54 ? -59.084 -8.249 -32.658 1.00 91.69 ? 53 ALA A CB 1 ATOM 374 N N . SER A 1 55 ? -58.105 -11.153 -31.639 1.00 92.21 ? 54 SER A N 1 ATOM 375 C CA . SER A 1 55 ? -58.316 -12.606 -31.580 1.00 92.15 ? 54 SER A CA 1 ATOM 376 C C . SER A 1 55 ? -58.183 -13.195 -30.173 1.00 96.80 ? 54 SER A C 1 ATOM 377 O O . SER A 1 55 ? -58.876 -14.165 -29.853 1.00 96.43 ? 54 SER A O 1 ATOM 378 C CB . SER A 1 55 ? -57.379 -13.329 -32.544 1.00 95.38 ? 54 SER A CB 1 ATOM 379 O OG . SER A 1 55 ? -57.553 -12.875 -33.877 1.00 103.97 ? 54 SER A OG 1 ATOM 380 N N . LEU A 1 56 ? -57.285 -12.628 -29.345 1.00 94.08 ? 55 LEU A N 1 ATOM 381 C CA . LEU A 1 56 ? -57.046 -13.117 -27.985 1.00 94.49 ? 55 LEU A CA 1 ATOM 382 C C . LEU A 1 56 ? -57.728 -12.278 -26.886 1.00 99.48 ? 55 LEU A C 1 ATOM 383 O O . LEU A 1 56 ? -57.364 -12.379 -25.710 1.00 99.42 ? 55 LEU A O 1 ATOM 384 C CB . LEU A 1 56 ? -55.537 -13.335 -27.720 1.00 94.52 ? 55 LEU A CB 1 ATOM 385 C CG . LEU A 1 56 ? -54.804 -14.339 -28.635 1.00 98.86 ? 55 LEU A CG 1 ATOM 386 C CD1 . LEU A 1 56 ? -53.311 -14.305 -28.394 1.00 99.09 ? 55 LEU A CD1 1 ATOM 387 C CD2 . LEU A 1 56 ? -55.330 -15.765 -28.456 1.00 101.33 ? 55 LEU A CD2 1 ATOM 388 N N . THR A 1 57 ? -58.748 -11.485 -27.274 1.00 96.63 ? 56 THR A N 1 ATOM 389 C CA . THR A 1 57 ? -59.547 -10.651 -26.371 1.00 97.23 ? 56 THR A CA 1 ATOM 390 C C . THR A 1 57 ? -60.961 -11.215 -26.281 1.00 101.80 ? 56 THR A C 1 ATOM 391 O O . THR A 1 57 ? -61.560 -11.547 -27.311 1.00 100.98 ? 56 THR A O 1 ATOM 392 C CB . THR A 1 57 ? -59.526 -9.174 -26.822 1.00 105.45 ? 56 THR A CB 1 ATOM 393 O OG1 . THR A 1 57 ? -58.191 -8.689 -26.731 1.00 105.11 ? 56 THR A OG1 1 ATOM 394 C CG2 . THR A 1 57 ? -60.430 -8.268 -25.980 1.00 104.61 ? 56 THR A CG2 1 ATOM 395 N N . CYS A 1 58 ? -61.480 -11.315 -25.033 1.00 99.49 ? 57 CYS A N 1 ATOM 396 C CA . CYS A 1 58 ? -62.822 -11.778 -24.666 1.00 99.96 ? 57 CYS A CA 1 ATOM 397 C C . CYS A 1 58 ? -63.090 -11.578 -23.175 1.00 104.45 ? 57 CYS A C 1 ATOM 398 O O . CYS A 1 58 ? -62.184 -11.750 -22.357 1.00 104.19 ? 57 CYS A O 1 ATOM 399 C CB . CYS A 1 58 ? -63.046 -13.229 -25.074 1.00 100.25 ? 57 CYS A CB 1 ATOM 400 S SG . CYS A 1 58 ? -64.789 -13.684 -25.240 1.00 104.66 ? 57 CYS A SG 1 ATOM 401 N N . SER A 1 59 ? -64.345 -11.246 -22.825 1.00 101.44 ? 58 SER A N 1 ATOM 402 C CA . SER A 1 59 ? -64.779 -11.030 -21.443 1.00 102.18 ? 58 SER A CA 1 ATOM 403 C C . SER A 1 59 ? -65.832 -12.053 -21.011 1.00 106.41 ? 58 SER A C 1 ATOM 404 O O . SER A 1 59 ? -66.803 -12.292 -21.729 1.00 105.77 ? 58 SER A O 1 ATOM 405 C CB . SER A 1 59 ? -65.306 -9.610 -21.261 1.00 106.11 ? 58 SER A CB 1 ATOM 406 O OG . SER A 1 59 ? -66.373 -9.337 -22.154 1.00 114.68 ? 58 SER A OG 1 ATOM 407 N N . ASN B 2 5 ? -59.703 -7.378 -22.647 1.00 73.92 ? 5 ASN B N 1 ATOM 408 C CA . ASN B 2 5 ? -59.062 -8.198 -21.625 1.00 74.12 ? 5 ASN B CA 1 ATOM 409 C C . ASN B 2 5 ? -57.643 -8.605 -22.041 1.00 77.22 ? 5 ASN B C 1 ATOM 410 O O . ASN B 2 5 ? -56.722 -8.468 -21.236 1.00 77.32 ? 5 ASN B O 1 ATOM 411 C CB . ASN B 2 5 ? -59.922 -9.427 -21.303 1.00 75.25 ? 5 ASN B CB 1 ATOM 412 C CG . ASN B 2 5 ? -59.609 -10.074 -19.977 1.00 99.21 ? 5 ASN B CG 1 ATOM 413 O OD1 . ASN B 2 5 ? -59.866 -9.515 -18.906 1.00 94.65 ? 5 ASN B OD1 1 ATOM 414 N ND2 . ASN B 2 5 ? -59.088 -11.291 -20.020 1.00 90.70 ? 5 ASN B ND2 1 ATOM 415 N N . PHE B 2 6 ? -57.479 -9.069 -23.310 1.00 72.60 ? 6 PHE B N 1 ATOM 416 C CA . PHE B 2 6 ? -56.247 -9.537 -23.969 1.00 71.69 ? 6 PHE B CA 1 ATOM 417 C C . PHE B 2 6 ? -55.289 -10.375 -23.130 1.00 74.88 ? 6 PHE B C 1 ATOM 418 O O . PHE B 2 6 ? -54.547 -9.838 -22.304 1.00 75.05 ? 6 PHE B O 1 ATOM 419 C CB . PHE B 2 6 ? -55.511 -8.425 -24.756 1.00 73.40 ? 6 PHE B CB 1 ATOM 420 C CG . PHE B 2 6 ? -54.212 -8.866 -25.404 1.00 74.68 ? 6 PHE B CG 1 ATOM 421 C CD1 . PHE B 2 6 ? -54.213 -9.762 -26.468 1.00 77.24 ? 6 PHE B CD1 1 ATOM 422 C CD2 . PHE B 2 6 ? -52.989 -8.391 -24.943 1.00 77.29 ? 6 PHE B CD2 1 ATOM 423 C CE1 . PHE B 2 6 ? -53.014 -10.178 -27.056 1.00 77.93 ? 6 PHE B CE1 1 ATOM 424 C CE2 . PHE B 2 6 ? -51.790 -8.805 -25.535 1.00 79.91 ? 6 PHE B CE2 1 ATOM 425 C CZ . PHE B 2 6 ? -51.811 -9.693 -26.589 1.00 77.38 ? 6 PHE B CZ 1 ATOM 426 N N . ASN B 2 7 ? -55.272 -11.687 -23.387 1.00 70.28 ? 7 ASN B N 1 ATOM 427 C CA . ASN B 2 7 ? -54.381 -12.614 -22.702 1.00 69.89 ? 7 ASN B CA 1 ATOM 428 C C . ASN B 2 7 ? -53.698 -13.524 -23.720 1.00 72.08 ? 7 ASN B C 1 ATOM 429 O O . ASN B 2 7 ? -54.322 -14.449 -24.247 1.00 71.28 ? 7 ASN B O 1 ATOM 430 C CB . ASN B 2 7 ? -55.136 -13.407 -21.628 1.00 71.04 ? 7 ASN B CB 1 ATOM 431 C CG . ASN B 2 7 ? -54.273 -14.248 -20.714 1.00 93.94 ? 7 ASN B CG 1 ATOM 432 O OD1 . ASN B 2 7 ? -53.043 -14.112 -20.634 1.00 88.80 ? 7 ASN B OD1 1 ATOM 433 N ND2 . ASN B 2 7 ? -54.921 -15.125 -19.975 1.00 85.92 ? 7 ASN B ND2 1 ATOM 434 N N . VAL B 2 8 ? -52.415 -13.242 -24.006 1.00 67.78 ? 8 VAL B N 1 ATOM 435 C CA . VAL B 2 8 ? -51.594 -14.004 -24.953 1.00 66.68 ? 8 VAL B CA 1 ATOM 436 C C . VAL B 2 8 ? -51.301 -15.437 -24.443 1.00 69.46 ? 8 VAL B C 1 ATOM 437 O O . VAL B 2 8 ? -51.058 -16.345 -25.243 1.00 68.50 ? 8 VAL B O 1 ATOM 438 C CB . VAL B 2 8 ? -50.320 -13.208 -25.364 1.00 70.66 ? 8 VAL B CB 1 ATOM 439 C CG1 . VAL B 2 8 ? -49.178 -13.370 -24.357 1.00 70.99 ? 8 VAL B CG1 1 ATOM 440 C CG2 . VAL B 2 8 ? -49.868 -13.571 -26.771 1.00 69.91 ? 8 VAL B CG2 1 ATOM 441 N N . TYR B 2 9 ? -51.369 -15.626 -23.110 1.00 65.85 ? 9 TYR B N 1 ATOM 442 C CA . TYR B 2 9 ? -51.113 -16.887 -22.416 1.00 65.53 ? 9 TYR B CA 1 ATOM 443 C C . TYR B 2 9 ? -52.190 -17.960 -22.598 1.00 68.11 ? 9 TYR B C 1 ATOM 444 O O . TYR B 2 9 ? -51.971 -19.108 -22.205 1.00 67.80 ? 9 TYR B O 1 ATOM 445 C CB . TYR B 2 9 ? -50.742 -16.642 -20.941 1.00 67.64 ? 9 TYR B CB 1 ATOM 446 C CG . TYR B 2 9 ? -49.464 -15.842 -20.800 1.00 69.72 ? 9 TYR B CG 1 ATOM 447 C CD1 . TYR B 2 9 ? -48.218 -16.453 -20.926 1.00 71.64 ? 9 TYR B CD1 1 ATOM 448 C CD2 . TYR B 2 9 ? -49.498 -14.464 -20.606 1.00 70.84 ? 9 TYR B CD2 1 ATOM 449 C CE1 . TYR B 2 9 ? -47.039 -15.714 -20.849 1.00 72.74 ? 9 TYR B CE1 1 ATOM 450 C CE2 . TYR B 2 9 ? -48.325 -13.715 -20.522 1.00 72.06 ? 9 TYR B CE2 1 ATOM 451 C CZ . TYR B 2 9 ? -47.097 -14.346 -20.639 1.00 79.44 ? 9 TYR B CZ 1 ATOM 452 O OH . TYR B 2 9 ? -45.938 -13.612 -20.549 1.00 80.79 ? 9 TYR B OH 1 ATOM 453 N N . LYS B 2 10 ? -53.330 -17.602 -23.229 1.00 70.58 ? 10 LYS B N 1 ATOM 454 C CA . LYS B 2 10 ? -54.406 -18.545 -23.539 1.00 71.34 ? 10 LYS B CA 1 ATOM 455 C C . LYS B 2 10 ? -53.952 -19.463 -24.680 1.00 72.94 ? 10 LYS B C 1 ATOM 456 O O . LYS B 2 10 ? -54.297 -20.644 -24.688 1.00 72.22 ? 10 LYS B O 1 ATOM 457 C CB . LYS B 2 10 ? -55.700 -17.816 -23.941 1.00 77.23 ? 10 LYS B CB 1 ATOM 458 C CG . LYS B 2 10 ? -56.470 -17.179 -22.797 1.00 93.78 ? 10 LYS B CG 1 ATOM 459 C CD . LYS B 2 10 ? -57.941 -17.078 -23.143 1.00 107.21 ? 10 LYS B CD 1 ATOM 460 C CE . LYS B 2 10 ? -58.719 -16.292 -22.121 1.00 119.98 ? 10 LYS B CE 1 ATOM 461 N NZ . LYS B 2 10 ? -58.776 -14.848 -22.466 1.00 130.05 ? 10 LYS B NZ 1 ATOM 462 N N . ALA B 2 11 ? -53.152 -18.916 -25.621 1.00 68.14 ? 11 ALA B N 1 ATOM 463 C CA . ALA B 2 11 ? -52.610 -19.618 -26.787 1.00 66.77 ? 11 ALA B CA 1 ATOM 464 C C . ALA B 2 11 ? -51.280 -20.315 -26.497 1.00 67.00 ? 11 ALA B C 1 ATOM 465 O O . ALA B 2 11 ? -51.037 -21.398 -27.033 1.00 65.76 ? 11 ALA B O 1 ATOM 466 C CB . ALA B 2 11 ? -52.446 -18.646 -27.944 1.00 68.82 ? 11 ALA B CB 1 ATOM 467 N N . THR B 2 12 ? -50.418 -19.687 -25.671 1.00 61.71 ? 12 THR B N 1 ATOM 468 C CA . THR B 2 12 ? -49.103 -20.228 -25.310 1.00 58.93 ? 12 THR B CA 1 ATOM 469 C C . THR B 2 12 ? -49.194 -21.186 -24.116 1.00 61.42 ? 12 THR B C 1 ATOM 470 O O . THR B 2 12 ? -50.220 -21.223 -23.432 1.00 62.17 ? 12 THR B O 1 ATOM 471 C CB . THR B 2 12 ? -48.068 -19.105 -25.103 1.00 65.76 ? 12 THR B CB 1 ATOM 472 O OG1 . THR B 2 12 ? -48.416 -18.336 -23.952 1.00 65.38 ? 12 THR B OG1 1 ATOM 473 C CG2 . THR B 2 12 ? -47.912 -18.203 -26.328 1.00 65.32 ? 12 THR B CG2 1 ATOM 474 N N . ARG B 2 13 ? -48.124 -21.968 -23.877 1.00 55.84 ? 13 ARG B N 1 ATOM 475 C CA . ARG B 2 13 ? -48.062 -22.942 -22.785 1.00 54.83 ? 13 ARG B CA 1 ATOM 476 C C . ARG B 2 13 ? -46.624 -23.185 -22.282 1.00 56.46 ? 13 ARG B C 1 ATOM 477 O O . ARG B 2 13 ? -45.686 -23.069 -23.078 1.00 55.18 ? 13 ARG B O 1 ATOM 478 C CB . ARG B 2 13 ? -48.727 -24.280 -23.205 1.00 55.38 ? 13 ARG B CB 1 ATOM 479 C CG . ARG B 2 13 ? -48.008 -25.051 -24.318 1.00 64.64 ? 13 ARG B CG 1 ATOM 480 C CD . ARG B 2 13 ? -48.494 -26.482 -24.418 1.00 74.41 ? 13 ARG B CD 1 ATOM 481 N NE . ARG B 2 13 ? -47.530 -27.336 -25.114 1.00 82.33 ? 13 ARG B NE 1 ATOM 482 C CZ . ARG B 2 13 ? -47.658 -28.651 -25.260 1.00 97.19 ? 13 ARG B CZ 1 ATOM 483 N NH1 . ARG B 2 13 ? -48.712 -29.284 -24.757 1.00 85.61 ? 13 ARG B NH1 1 ATOM 484 N NH2 . ARG B 2 13 ? -46.730 -29.346 -25.902 1.00 83.77 ? 13 ARG B NH2 1 ATOM 485 N N . PRO B 2 14 ? -46.420 -23.573 -20.993 1.00 52.41 ? 14 PRO B N 1 ATOM 486 C CA . PRO B 2 14 ? -45.055 -23.912 -20.547 1.00 50.95 ? 14 PRO B CA 1 ATOM 487 C C . PRO B 2 14 ? -44.650 -25.260 -21.156 1.00 53.74 ? 14 PRO B C 1 ATOM 488 O O . PRO B 2 14 ? -45.527 -26.026 -21.562 1.00 53.87 ? 14 PRO B O 1 ATOM 489 C CB . PRO B 2 14 ? -45.189 -23.989 -19.027 1.00 53.34 ? 14 PRO B CB 1 ATOM 490 C CG . PRO B 2 14 ? -46.592 -24.393 -18.801 1.00 59.12 ? 14 PRO B CG 1 ATOM 491 C CD . PRO B 2 14 ? -47.407 -23.793 -19.913 1.00 55.10 ? 14 PRO B CD 1 ATOM 492 N N . TYR B 2 15 ? -43.346 -25.550 -21.250 1.00 48.96 ? 15 TYR B N 1 ATOM 493 C CA . TYR B 2 15 ? -42.909 -26.796 -21.886 1.00 48.38 ? 15 TYR B CA 1 ATOM 494 C C . TYR B 2 15 ? -41.712 -27.482 -21.231 1.00 51.61 ? 15 TYR B C 1 ATOM 495 O O . TYR B 2 15 ? -41.094 -26.925 -20.323 1.00 51.19 ? 15 TYR B O 1 ATOM 496 C CB . TYR B 2 15 ? -42.675 -26.576 -23.397 1.00 49.39 ? 15 TYR B CB 1 ATOM 497 C CG . TYR B 2 15 ? -41.625 -25.535 -23.717 1.00 50.69 ? 15 TYR B CG 1 ATOM 498 C CD1 . TYR B 2 15 ? -41.941 -24.178 -23.735 1.00 52.69 ? 15 TYR B CD1 1 ATOM 499 C CD2 . TYR B 2 15 ? -40.321 -25.905 -24.031 1.00 51.28 ? 15 TYR B CD2 1 ATOM 500 C CE1 . TYR B 2 15 ? -40.977 -23.216 -24.019 1.00 53.12 ? 15 TYR B CE1 1 ATOM 501 C CE2 . TYR B 2 15 ? -39.347 -24.950 -24.313 1.00 51.97 ? 15 TYR B CE2 1 ATOM 502 C CZ . TYR B 2 15 ? -39.680 -23.606 -24.304 1.00 59.17 ? 15 TYR B CZ 1 ATOM 503 O OH . TYR B 2 15 ? -38.732 -22.658 -24.590 1.00 60.14 ? 15 TYR B OH 1 ATOM 504 N N . LEU B 2 16 ? -41.404 -28.708 -21.692 1.00 47.91 ? 16 LEU B N 1 ATOM 505 C CA . LEU B 2 16 ? -40.258 -29.500 -21.255 1.00 47.77 ? 16 LEU B CA 1 ATOM 506 C C . LEU B 2 16 ? -39.218 -29.430 -22.370 1.00 50.71 ? 16 LEU B C 1 ATOM 507 O O . LEU B 2 16 ? -39.548 -29.658 -23.538 1.00 50.24 ? 16 LEU B O 1 ATOM 508 C CB . LEU B 2 16 ? -40.653 -30.967 -20.988 1.00 48.57 ? 16 LEU B CB 1 ATOM 509 C CG . LEU B 2 16 ? -41.483 -31.258 -19.733 1.00 53.91 ? 16 LEU B CG 1 ATOM 510 C CD1 . LEU B 2 16 ? -42.277 -32.538 -19.898 1.00 54.73 ? 16 LEU B CD1 1 ATOM 511 C CD2 . LEU B 2 16 ? -40.608 -31.352 -18.492 1.00 57.05 ? 16 LEU B CD2 1 ATOM 512 N N . ALA B 2 17 ? -37.976 -29.074 -22.017 1.00 46.92 ? 17 ALA B N 1 ATOM 513 C CA . ALA B 2 17 ? -36.874 -28.949 -22.971 1.00 46.83 ? 17 ALA B CA 1 ATOM 514 C C . ALA B 2 17 ? -35.566 -29.457 -22.367 1.00 51.05 ? 17 ALA B C 1 ATOM 515 O O . ALA B 2 17 ? -35.465 -29.590 -21.143 1.00 50.98 ? 17 ALA B O 1 ATOM 516 C CB . ALA B 2 17 ? -36.730 -27.500 -23.418 1.00 46.98 ? 17 ALA B CB 1 ATOM 517 N N . HIS B 2 18 ? -34.571 -29.751 -23.227 1.00 47.91 ? 18 HIS B N 1 ATOM 518 C CA . HIS B 2 18 ? -33.264 -30.256 -22.812 1.00 48.85 ? 18 HIS B CA 1 ATOM 519 C C . HIS B 2 18 ? -32.480 -29.277 -21.942 1.00 52.71 ? 18 HIS B C 1 ATOM 520 O O . HIS B 2 18 ? -32.418 -28.083 -22.241 1.00 51.44 ? 18 HIS B O 1 ATOM 521 C CB . HIS B 2 18 ? -32.423 -30.709 -24.021 1.00 50.75 ? 18 HIS B CB 1 ATOM 522 C CG . HIS B 2 18 ? -31.020 -31.096 -23.657 1.00 55.70 ? 18 HIS B CG 1 ATOM 523 N ND1 . HIS B 2 18 ? -30.745 -32.287 -23.005 1.00 58.76 ? 18 HIS B ND1 1 ATOM 524 C CD2 . HIS B 2 18 ? -29.864 -30.412 -23.821 1.00 58.07 ? 18 HIS B CD2 1 ATOM 525 C CE1 . HIS B 2 18 ? -29.437 -32.293 -22.804 1.00 59.72 ? 18 HIS B CE1 1 ATOM 526 N NE2 . HIS B 2 18 ? -28.864 -31.190 -23.284 1.00 59.70 ? 18 HIS B NE2 1 ATOM 527 N N . CYS B 2 19 ? -31.879 -29.809 -20.871 1.00 50.49 ? 19 CYS B N 1 ATOM 528 C CA . CYS B 2 19 ? -31.025 -29.096 -19.929 1.00 50.80 ? 19 CYS B CA 1 ATOM 529 C C . CYS B 2 19 ? -29.777 -29.959 -19.690 1.00 56.26 ? 19 CYS B C 1 ATOM 530 O O . CYS B 2 19 ? -29.927 -31.146 -19.392 1.00 56.92 ? 19 CYS B O 1 ATOM 531 C CB . CYS B 2 19 ? -31.769 -28.806 -18.629 1.00 50.86 ? 19 CYS B CB 1 ATOM 532 S SG . CYS B 2 19 ? -30.772 -27.959 -17.377 1.00 55.68 ? 19 CYS B SG 1 ATOM 533 N N . PRO B 2 20 ? -28.546 -29.413 -19.846 1.00 53.35 ? 20 PRO B N 1 ATOM 534 C CA . PRO B 2 20 ? -27.345 -30.248 -19.649 1.00 55.52 ? 20 PRO B CA 1 ATOM 535 C C . PRO B 2 20 ? -27.071 -30.656 -18.200 1.00 60.49 ? 20 PRO B C 1 ATOM 536 O O . PRO B 2 20 ? -26.442 -31.691 -17.976 1.00 62.33 ? 20 PRO B O 1 ATOM 537 C CB . PRO B 2 20 ? -26.216 -29.387 -20.220 1.00 57.83 ? 20 PRO B CB 1 ATOM 538 C CG . PRO B 2 20 ? -26.693 -27.993 -20.068 1.00 60.24 ? 20 PRO B CG 1 ATOM 539 C CD . PRO B 2 20 ? -28.185 -28.029 -20.220 1.00 53.91 ? 20 PRO B CD 1 ATOM 540 N N . ASP B 2 21 ? -27.539 -29.851 -17.226 1.00 55.85 ? 21 ASP B N 1 ATOM 541 C CA . ASP B 2 21 ? -27.339 -30.107 -15.800 1.00 57.19 ? 21 ASP B CA 1 ATOM 542 C C . ASP B 2 21 ? -28.611 -29.828 -14.988 1.00 59.65 ? 21 ASP B C 1 ATOM 543 O O . ASP B 2 21 ? -28.926 -28.674 -14.688 1.00 57.88 ? 21 ASP B O 1 ATOM 544 C CB . ASP B 2 21 ? -26.132 -29.296 -15.274 1.00 60.18 ? 21 ASP B CB 1 ATOM 545 C CG . ASP B 2 21 ? -25.645 -29.602 -13.862 1.00 72.57 ? 21 ASP B CG 1 ATOM 546 O OD1 . ASP B 2 21 ? -24.591 -29.059 -13.469 1.00 74.47 ? 21 ASP B OD1 1 ATOM 547 O OD2 . ASP B 2 21 ? -26.316 -30.386 -13.150 1.00 79.02 ? 21 ASP B OD2 1 ATOM 548 N N . CYS B 2 22 ? -29.328 -30.903 -14.625 1.00 56.85 ? 22 CYS B N 1 ATOM 549 C CA . CYS B 2 22 ? -30.549 -30.850 -13.816 1.00 56.12 ? 22 CYS B CA 1 ATOM 550 C C . CYS B 2 22 ? -30.231 -31.087 -12.331 1.00 62.37 ? 22 CYS B C 1 ATOM 551 O O . CYS B 2 22 ? -31.135 -31.089 -11.490 1.00 62.18 ? 22 CYS B O 1 ATOM 552 C CB . CYS B 2 22 ? -31.577 -31.853 -14.334 1.00 55.90 ? 22 CYS B CB 1 ATOM 553 S SG . CYS B 2 22 ? -32.234 -31.465 -15.976 1.00 57.07 ? 22 CYS B SG 1 ATOM 554 N N . GLY B 2 23 ? -28.946 -31.271 -12.039 1.00 60.98 ? 23 GLY B N 1 ATOM 555 C CA . GLY B 2 23 ? -28.418 -31.549 -10.710 1.00 63.72 ? 23 GLY B CA 1 ATOM 556 C C . GLY B 2 23 ? -27.411 -32.678 -10.771 1.00 70.34 ? 23 GLY B C 1 ATOM 557 O O . GLY B 2 23 ? -27.688 -33.719 -11.377 1.00 70.05 ? 23 GLY B O 1 ATOM 558 N N . GLU B 2 24 ? -26.223 -32.464 -10.167 1.00 69.26 ? 24 GLU B N 1 ATOM 559 C CA . GLU B 2 24 ? -25.091 -33.407 -10.119 1.00 72.39 ? 24 GLU B CA 1 ATOM 560 C C . GLU B 2 24 ? -24.472 -33.719 -11.505 1.00 75.42 ? 24 GLU B C 1 ATOM 561 O O . GLU B 2 24 ? -23.865 -34.777 -11.696 1.00 77.48 ? 24 GLU B O 1 ATOM 562 C CB . GLU B 2 24 ? -25.423 -34.687 -9.308 1.00 76.68 ? 24 GLU B CB 1 ATOM 563 C CG . GLU B 2 24 ? -25.844 -34.443 -7.865 1.00 88.79 ? 24 GLU B CG 1 ATOM 564 C CD . GLU B 2 24 ? -24.733 -34.036 -6.917 1.00 111.53 ? 24 GLU B CD 1 ATOM 565 O OE1 . GLU B 2 24 ? -24.444 -32.821 -6.825 1.00 104.47 ? 24 GLU B OE1 1 ATOM 566 O OE2 . GLU B 2 24 ? -24.166 -34.930 -6.247 1.00 108.69 ? 24 GLU B OE2 1 ATOM 567 N N . GLY B 2 25 ? -24.616 -32.775 -12.438 1.00 68.83 ? 25 GLY B N 1 ATOM 568 C CA . GLY B 2 25 ? -24.081 -32.864 -13.794 1.00 67.99 ? 25 GLY B CA 1 ATOM 569 C C . GLY B 2 25 ? -24.813 -33.790 -14.747 1.00 70.73 ? 25 GLY B C 1 ATOM 570 O O . GLY B 2 25 ? -24.291 -34.091 -15.824 1.00 70.63 ? 25 GLY B O 1 ATOM 571 N N . HIS B 2 26 ? -26.027 -34.238 -14.374 1.00 66.20 ? 26 HIS B N 1 ATOM 572 C CA . HIS B 2 26 ? -26.835 -35.147 -15.191 1.00 65.13 ? 26 HIS B CA 1 ATOM 573 C C . HIS B 2 26 ? -27.890 -34.413 -16.016 1.00 65.13 ? 26 HIS B C 1 ATOM 574 O O . HIS B 2 26 ? -28.618 -33.574 -15.480 1.00 62.89 ? 26 HIS B O 1 ATOM 575 C CB . HIS B 2 26 ? -27.479 -36.241 -14.324 1.00 67.49 ? 26 HIS B CB 1 ATOM 576 C CG . HIS B 2 26 ? -26.486 -37.114 -13.621 1.00 74.76 ? 26 HIS B CG 1 ATOM 577 N ND1 . HIS B 2 26 ? -25.834 -38.138 -14.281 1.00 78.57 ? 26 HIS B ND1 1 ATOM 578 C CD2 . HIS B 2 26 ? -26.068 -37.087 -12.334 1.00 78.93 ? 26 HIS B CD2 1 ATOM 579 C CE1 . HIS B 2 26 ? -25.042 -38.698 -13.381 1.00 81.58 ? 26 HIS B CE1 1 ATOM 580 N NE2 . HIS B 2 26 ? -25.149 -38.100 -12.195 1.00 82.31 ? 26 HIS B NE2 1 ATOM 581 N N . SER B 2 27 ? -27.967 -34.739 -17.322 1.00 60.83 ? 27 SER B N 1 ATOM 582 C CA . SER B 2 27 ? -28.918 -34.155 -18.272 1.00 57.79 ? 27 SER B CA 1 ATOM 583 C C . SER B 2 27 ? -30.328 -34.720 -18.083 1.00 60.39 ? 27 SER B C 1 ATOM 584 O O . SER B 2 27 ? -30.472 -35.897 -17.741 1.00 61.40 ? 27 SER B O 1 ATOM 585 C CB . SER B 2 27 ? -28.450 -34.375 -19.708 1.00 61.53 ? 27 SER B CB 1 ATOM 586 O OG . SER B 2 27 ? -28.361 -35.751 -20.039 1.00 72.15 ? 27 SER B OG 1 ATOM 587 N N . CYS B 2 28 ? -31.365 -33.881 -18.313 1.00 54.47 ? 28 CYS B N 1 ATOM 588 C CA . CYS B 2 28 ? -32.779 -34.263 -18.178 1.00 53.26 ? 28 CYS B CA 1 ATOM 589 C C . CYS B 2 28 ? -33.719 -33.402 -19.035 1.00 53.93 ? 28 CYS B C 1 ATOM 590 O O . CYS B 2 28 ? -33.313 -32.354 -19.541 1.00 52.51 ? 28 CYS B O 1 ATOM 591 C CB . CYS B 2 28 ? -33.205 -34.257 -16.708 1.00 54.47 ? 28 CYS B CB 1 ATOM 592 S SG . CYS B 2 28 ? -33.864 -32.670 -16.123 1.00 56.76 ? 28 CYS B SG 1 ATOM 593 N N . HIS B 2 29 ? -34.989 -33.841 -19.158 1.00 49.26 ? 29 HIS B N 1 ATOM 594 C CA . HIS B 2 29 ? -36.057 -33.117 -19.847 1.00 47.12 ? 29 HIS B CA 1 ATOM 595 C C . HIS B 2 29 ? -36.651 -32.226 -18.755 1.00 50.06 ? 29 HIS B C 1 ATOM 596 O O . HIS B 2 29 ? -37.490 -32.667 -17.965 1.00 50.15 ? 29 HIS B O 1 ATOM 597 C CB . HIS B 2 29 ? -37.097 -34.091 -20.435 1.00 47.79 ? 29 HIS B CB 1 ATOM 598 C CG . HIS B 2 29 ? -36.497 -35.133 -21.326 1.00 52.04 ? 29 HIS B CG 1 ATOM 599 N ND1 . HIS B 2 29 ? -36.178 -34.860 -22.643 1.00 53.47 ? 29 HIS B ND1 1 ATOM 600 C CD2 . HIS B 2 29 ? -36.153 -36.412 -21.049 1.00 55.23 ? 29 HIS B CD2 1 ATOM 601 C CE1 . HIS B 2 29 ? -35.659 -35.977 -23.125 1.00 54.17 ? 29 HIS B CE1 1 ATOM 602 N NE2 . HIS B 2 29 ? -35.628 -36.940 -22.204 1.00 55.57 ? 29 HIS B NE2 1 ATOM 603 N N . SER B 2 30 ? -36.123 -30.998 -18.659 1.00 45.59 ? 30 SER B N 1 ATOM 604 C CA . SER B 2 30 ? -36.439 -30.026 -17.616 1.00 45.05 ? 30 SER B CA 1 ATOM 605 C C . SER B 2 30 ? -37.678 -29.142 -17.820 1.00 47.30 ? 30 SER B C 1 ATOM 606 O O . SER B 2 30 ? -37.837 -28.551 -18.892 1.00 45.87 ? 30 SER B O 1 ATOM 607 C CB . SER B 2 30 ? -35.215 -29.160 -17.331 1.00 48.84 ? 30 SER B CB 1 ATOM 608 O OG . SER B 2 30 ? -35.441 -28.218 -16.296 1.00 58.26 ? 30 SER B OG 1 ATOM 609 N N . PRO B 2 31 ? -38.507 -28.953 -16.757 1.00 43.99 ? 31 PRO B N 1 ATOM 610 C CA . PRO B 2 31 ? -39.646 -28.024 -16.871 1.00 43.00 ? 31 PRO B CA 1 ATOM 611 C C . PRO B 2 31 ? -39.234 -26.574 -16.560 1.00 45.76 ? 31 PRO B C 1 ATOM 612 O O . PRO B 2 31 ? -40.070 -25.671 -16.611 1.00 45.02 ? 31 PRO B O 1 ATOM 613 C CB . PRO B 2 31 ? -40.644 -28.569 -15.844 1.00 46.01 ? 31 PRO B CB 1 ATOM 614 C CG . PRO B 2 31 ? -39.801 -29.276 -14.820 1.00 51.82 ? 31 PRO B CG 1 ATOM 615 C CD . PRO B 2 31 ? -38.438 -29.551 -15.405 1.00 47.05 ? 31 PRO B CD 1 ATOM 616 N N . VAL B 2 32 ? -37.938 -26.366 -16.238 1.00 41.97 ? 32 VAL B N 1 ATOM 617 C CA . VAL B 2 32 ? -37.299 -25.092 -15.892 1.00 41.24 ? 32 VAL B CA 1 ATOM 618 C C . VAL B 2 32 ? -36.011 -24.898 -16.757 1.00 43.96 ? 32 VAL B C 1 ATOM 619 O O . VAL B 2 32 ? -35.059 -24.230 -16.342 1.00 43.78 ? 32 VAL B O 1 ATOM 620 C CB . VAL B 2 32 ? -37.080 -25.000 -14.341 1.00 46.51 ? 32 VAL B CB 1 ATOM 621 C CG1 . VAL B 2 32 ? -36.039 -25.999 -13.831 1.00 47.55 ? 32 VAL B CG1 1 ATOM 622 C CG2 . VAL B 2 32 ? -36.767 -23.578 -13.879 1.00 46.11 ? 32 VAL B CG2 1 ATOM 623 N N . ALA B 2 33 ? -36.018 -25.470 -17.981 1.00 39.54 ? 33 ALA B N 1 ATOM 624 C CA . ALA B 2 33 ? -34.904 -25.418 -18.934 1.00 39.00 ? 33 ALA B CA 1 ATOM 625 C C . ALA B 2 33 ? -34.546 -23.995 -19.361 1.00 41.62 ? 33 ALA B C 1 ATOM 626 O O . ALA B 2 33 ? -35.438 -23.177 -19.598 1.00 40.53 ? 33 ALA B O 1 ATOM 627 C CB . ALA B 2 33 ? -35.214 -26.270 -20.153 1.00 39.68 ? 33 ALA B CB 1 ATOM 628 N N . LEU B 2 34 ? -33.237 -23.702 -19.437 1.00 38.27 ? 34 LEU B N 1 ATOM 629 C CA . LEU B 2 34 ? -32.732 -22.385 -19.825 1.00 37.47 ? 34 LEU B CA 1 ATOM 630 C C . LEU B 2 34 ? -32.609 -22.261 -21.334 1.00 40.84 ? 34 LEU B C 1 ATOM 631 O O . LEU B 2 34 ? -31.994 -23.114 -21.980 1.00 41.18 ? 34 LEU B O 1 ATOM 632 C CB . LEU B 2 34 ? -31.397 -22.059 -19.131 1.00 38.22 ? 34 LEU B CB 1 ATOM 633 C CG . LEU B 2 34 ? -31.436 -21.890 -17.610 1.00 43.40 ? 34 LEU B CG 1 ATOM 634 C CD1 . LEU B 2 34 ? -30.041 -21.783 -17.038 1.00 44.65 ? 34 LEU B CD1 1 ATOM 635 C CD2 . LEU B 2 34 ? -32.243 -20.675 -17.211 1.00 45.11 ? 34 LEU B CD2 1 ATOM 636 N N . GLU B 2 35 ? -33.215 -21.204 -21.892 1.00 36.50 ? 35 GLU B N 1 ATOM 637 C CA . GLU B 2 35 ? -33.226 -20.936 -23.327 1.00 36.49 ? 35 GLU B CA 1 ATOM 638 C C . GLU B 2 35 ? -32.145 -19.952 -23.749 1.00 40.23 ? 35 GLU B C 1 ATOM 639 O O . GLU B 2 35 ? -31.352 -20.262 -24.641 1.00 40.75 ? 35 GLU B O 1 ATOM 640 C CB . GLU B 2 35 ? -34.609 -20.426 -23.776 1.00 37.57 ? 35 GLU B CB 1 ATOM 641 C CG . GLU B 2 35 ? -35.693 -21.491 -23.820 1.00 48.74 ? 35 GLU B CG 1 ATOM 642 C CD . GLU B 2 35 ? -35.564 -22.571 -24.880 1.00 71.51 ? 35 GLU B CD 1 ATOM 643 O OE1 . GLU B 2 35 ? -34.916 -22.327 -25.924 1.00 66.57 ? 35 GLU B OE1 1 ATOM 644 O OE2 . GLU B 2 35 ? -36.152 -23.658 -24.677 1.00 67.02 ? 35 GLU B OE2 1 ATOM 645 N N . ARG B 2 36 ? -32.130 -18.759 -23.125 1.00 35.78 ? 36 ARG B N 1 ATOM 646 C CA . ARG B 2 36 ? -31.203 -17.674 -23.444 1.00 35.62 ? 36 ARG B CA 1 ATOM 647 C C . ARG B 2 36 ? -31.018 -16.748 -22.242 1.00 38.22 ? 36 ARG B C 1 ATOM 648 O O . ARG B 2 36 ? -31.991 -16.414 -21.562 1.00 37.17 ? 36 ARG B O 1 ATOM 649 C CB . ARG B 2 36 ? -31.753 -16.878 -24.647 1.00 36.24 ? 36 ARG B CB 1 ATOM 650 C CG . ARG B 2 36 ? -30.809 -15.846 -25.252 1.00 47.60 ? 36 ARG B CG 1 ATOM 651 C CD . ARG B 2 36 ? -31.537 -15.024 -26.297 1.00 57.87 ? 36 ARG B CD 1 ATOM 652 N NE . ARG B 2 36 ? -30.750 -13.878 -26.752 1.00 67.72 ? 36 ARG B NE 1 ATOM 653 C CZ . ARG B 2 36 ? -31.244 -12.859 -27.447 1.00 82.92 ? 36 ARG B CZ 1 ATOM 654 N NH1 . ARG B 2 36 ? -32.533 -12.824 -27.763 1.00 70.17 ? 36 ARG B NH1 1 ATOM 655 N NH2 . ARG B 2 36 ? -30.457 -11.859 -27.821 1.00 70.87 ? 36 ARG B NH2 1 ATOM 656 N N . ILE B 2 37 ? -29.764 -16.330 -21.997 1.00 34.72 ? 37 ILE B N 1 ATOM 657 C CA . ILE B 2 37 ? -29.405 -15.387 -20.936 1.00 33.99 ? 37 ILE B CA 1 ATOM 658 C C . ILE B 2 37 ? -28.866 -14.133 -21.628 1.00 37.22 ? 37 ILE B C 1 ATOM 659 O O . ILE B 2 37 ? -27.884 -14.211 -22.370 1.00 37.67 ? 37 ILE B O 1 ATOM 660 C CB . ILE B 2 37 ? -28.403 -15.970 -19.889 1.00 37.72 ? 37 ILE B CB 1 ATOM 661 C CG1 . ILE B 2 37 ? -28.884 -17.329 -19.321 1.00 38.31 ? 37 ILE B CG1 1 ATOM 662 C CG2 . ILE B 2 37 ? -28.148 -14.958 -18.755 1.00 38.32 ? 37 ILE B CG2 1 ATOM 663 C CD1 . ILE B 2 37 ? -27.761 -18.252 -18.793 1.00 46.75 ? 37 ILE B CD1 1 ATOM 664 N N . ARG B 2 38 ? -29.535 -12.992 -21.414 1.00 32.62 ? 38 ARG B N 1 ATOM 665 C CA . ARG B 2 38 ? -29.157 -11.706 -22.001 1.00 32.36 ? 38 ARG B CA 1 ATOM 666 C C . ARG B 2 38 ? -28.469 -10.826 -20.963 1.00 35.54 ? 38 ARG B C 1 ATOM 667 O O . ARG B 2 38 ? -28.982 -10.669 -19.853 1.00 34.55 ? 38 ARG B O 1 ATOM 668 C CB . ARG B 2 38 ? -30.378 -11.002 -22.610 1.00 32.22 ? 38 ARG B CB 1 ATOM 669 C CG . ARG B 2 38 ? -30.844 -11.623 -23.926 1.00 41.93 ? 38 ARG B CG 1 ATOM 670 C CD . ARG B 2 38 ? -32.150 -11.024 -24.416 1.00 51.21 ? 38 ARG B CD 1 ATOM 671 N NE . ARG B 2 38 ? -32.026 -9.602 -24.747 1.00 60.01 ? 38 ARG B NE 1 ATOM 672 C CZ . ARG B 2 38 ? -33.053 -8.800 -25.008 1.00 74.27 ? 38 ARG B CZ 1 ATOM 673 N NH1 . ARG B 2 38 ? -34.295 -9.270 -24.982 1.00 61.61 ? 38 ARG B NH1 1 ATOM 674 N NH2 . ARG B 2 38 ? -32.848 -7.520 -25.291 1.00 61.19 ? 38 ARG B NH2 1 ATOM 675 N N . ASN B 2 39 ? -27.294 -10.273 -21.320 1.00 32.50 ? 39 ASN B N 1 ATOM 676 C CA . ASN B 2 39 ? -26.483 -9.425 -20.441 1.00 32.26 ? 39 ASN B CA 1 ATOM 677 C C . ASN B 2 39 ? -26.006 -8.138 -21.135 1.00 36.27 ? 39 ASN B C 1 ATOM 678 O O . ASN B 2 39 ? -24.844 -7.739 -21.002 1.00 36.47 ? 39 ASN B O 1 ATOM 679 C CB . ASN B 2 39 ? -25.308 -10.231 -19.855 1.00 33.72 ? 39 ASN B CB 1 ATOM 680 C CG . ASN B 2 39 ? -24.360 -10.849 -20.862 1.00 57.51 ? 39 ASN B CG 1 ATOM 681 O OD1 . ASN B 2 39 ? -24.666 -11.011 -22.050 1.00 52.52 ? 39 ASN B OD1 1 ATOM 682 N ND2 . ASN B 2 39 ? -23.181 -11.226 -20.396 1.00 50.32 ? 39 ASN B ND2 1 ATOM 683 N N . GLU B 2 40 ? -26.923 -7.476 -21.852 1.00 32.52 ? 40 GLU B N 1 ATOM 684 C CA . GLU B 2 40 ? -26.639 -6.241 -22.585 1.00 32.95 ? 40 GLU B CA 1 ATOM 685 C C . GLU B 2 40 ? -26.710 -5.009 -21.686 1.00 36.36 ? 40 GLU B C 1 ATOM 686 O O . GLU B 2 40 ? -26.119 -3.978 -22.015 1.00 36.58 ? 40 GLU B O 1 ATOM 687 C CB . GLU B 2 40 ? -27.583 -6.093 -23.782 1.00 34.87 ? 40 GLU B CB 1 ATOM 688 C CG . GLU B 2 40 ? -27.629 -7.319 -24.682 1.00 45.61 ? 40 GLU B CG 1 ATOM 689 C CD . GLU B 2 40 ? -28.983 -7.993 -24.795 1.00 65.10 ? 40 GLU B CD 1 ATOM 690 O OE1 . GLU B 2 40 ? -29.998 -7.391 -24.373 1.00 57.10 ? 40 GLU B OE1 1 ATOM 691 O OE2 . GLU B 2 40 ? -29.029 -9.125 -25.329 1.00 60.16 ? 40 GLU B OE2 1 ATOM 692 N N . ALA B 2 41 ? -27.428 -5.122 -20.552 1.00 32.05 ? 41 ALA B N 1 ATOM 693 C CA . ALA B 2 41 ? -27.590 -4.054 -19.571 1.00 31.68 ? 41 ALA B CA 1 ATOM 694 C C . ALA B 2 41 ? -26.276 -3.789 -18.842 1.00 35.78 ? 41 ALA B C 1 ATOM 695 O O . ALA B 2 41 ? -25.716 -4.692 -18.214 1.00 35.15 ? 41 ALA B O 1 ATOM 696 C CB . ALA B 2 41 ? -28.683 -4.415 -18.580 1.00 31.97 ? 41 ALA B CB 1 ATOM 697 N N . THR B 2 42 ? -25.776 -2.548 -18.952 1.00 33.04 ? 42 THR B N 1 ATOM 698 C CA . THR B 2 42 ? -24.523 -2.116 -18.326 1.00 33.33 ? 42 THR B CA 1 ATOM 699 C C . THR B 2 42 ? -24.615 -2.032 -16.796 1.00 37.55 ? 42 THR B C 1 ATOM 700 O O . THR B 2 42 ? -23.584 -2.090 -16.124 1.00 37.70 ? 42 THR B O 1 ATOM 701 C CB . THR B 2 42 ? -23.985 -0.837 -18.976 1.00 41.26 ? 42 THR B CB 1 ATOM 702 O OG1 . THR B 2 42 ? -24.988 0.174 -18.923 1.00 40.39 ? 42 THR B OG1 1 ATOM 703 C CG2 . THR B 2 42 ? -23.523 -1.054 -20.413 1.00 40.65 ? 42 THR B CG2 1 ATOM 704 N N . ASP B 2 43 ? -25.844 -1.936 -16.243 1.00 34.04 ? 43 ASP B N 1 ATOM 705 C CA . ASP B 2 43 ? -26.067 -1.888 -14.796 1.00 34.19 ? 43 ASP B CA 1 ATOM 706 C C . ASP B 2 43 ? -25.903 -3.269 -14.119 1.00 38.43 ? 43 ASP B C 1 ATOM 707 O O . ASP B 2 43 ? -25.936 -3.359 -12.890 1.00 38.77 ? 43 ASP B O 1 ATOM 708 C CB . ASP B 2 43 ? -27.418 -1.216 -14.455 1.00 36.20 ? 43 ASP B CB 1 ATOM 709 C CG . ASP B 2 43 ? -28.666 -2.067 -14.637 1.00 45.95 ? 43 ASP B CG 1 ATOM 710 O OD1 . ASP B 2 43 ? -28.704 -2.875 -15.591 1.00 45.96 ? 43 ASP B OD1 1 ATOM 711 O OD2 . ASP B 2 43 ? -29.621 -1.891 -13.851 1.00 52.18 ? 43 ASP B OD2 1 ATOM 712 N N . GLY B 2 44 ? -25.719 -4.314 -14.929 1.00 34.68 ? 44 GLY B N 1 ATOM 713 C CA . GLY B 2 44 ? -25.506 -5.680 -14.463 1.00 34.73 ? 44 GLY B CA 1 ATOM 714 C C . GLY B 2 44 ? -26.716 -6.593 -14.478 1.00 38.18 ? 44 GLY B C 1 ATOM 715 O O . GLY B 2 44 ? -26.573 -7.791 -14.218 1.00 37.96 ? 44 GLY B O 1 ATOM 716 N N . THR B 2 45 ? -27.913 -6.043 -14.780 1.00 34.43 ? 45 THR B N 1 ATOM 717 C CA . THR B 2 45 ? -29.180 -6.786 -14.824 1.00 34.11 ? 45 THR B CA 1 ATOM 718 C C . THR B 2 45 ? -29.173 -7.860 -15.923 1.00 37.87 ? 45 THR B C 1 ATOM 719 O O . THR B 2 45 ? -28.791 -7.577 -17.060 1.00 37.24 ? 45 THR B O 1 ATOM 720 C CB . THR B 2 45 ? -30.377 -5.816 -14.931 1.00 41.62 ? 45 THR B CB 1 ATOM 721 O OG1 . THR B 2 45 ? -30.272 -4.821 -13.910 1.00 41.76 ? 45 THR B OG1 1 ATOM 722 C CG2 . THR B 2 45 ? -31.733 -6.524 -14.818 1.00 40.02 ? 45 THR B CG2 1 ATOM 723 N N . LEU B 2 46 ? -29.585 -9.089 -15.566 1.00 34.71 ? 46 LEU B N 1 ATOM 724 C CA . LEU B 2 46 ? -29.655 -10.222 -16.490 1.00 34.35 ? 46 LEU B CA 1 ATOM 725 C C . LEU B 2 46 ? -31.104 -10.517 -16.871 1.00 38.16 ? 46 LEU B C 1 ATOM 726 O O . LEU B 2 46 ? -31.961 -10.616 -15.990 1.00 38.10 ? 46 LEU B O 1 ATOM 727 C CB . LEU B 2 46 ? -29.020 -11.490 -15.874 1.00 34.94 ? 46 LEU B CB 1 ATOM 728 C CG . LEU B 2 46 ? -27.531 -11.457 -15.504 1.00 40.45 ? 46 LEU B CG 1 ATOM 729 C CD1 . LEU B 2 46 ? -27.189 -12.593 -14.570 1.00 41.61 ? 46 LEU B CD1 1 ATOM 730 C CD2 . LEU B 2 46 ? -26.649 -11.552 -16.730 1.00 42.86 ? 46 LEU B CD2 1 ATOM 731 N N . LYS B 2 47 ? -31.374 -10.657 -18.182 1.00 34.55 ? 47 LYS B N 1 ATOM 732 C CA . LYS B 2 47 ? -32.695 -11.018 -18.698 1.00 34.40 ? 47 LYS B CA 1 ATOM 733 C C . LYS B 2 47 ? -32.605 -12.500 -19.066 1.00 38.69 ? 47 LYS B C 1 ATOM 734 O O . LYS B 2 47 ? -31.954 -12.860 -20.050 1.00 38.36 ? 47 LYS B O 1 ATOM 735 C CB . LYS B 2 47 ? -33.101 -10.144 -19.902 1.00 36.98 ? 47 LYS B CB 1 ATOM 736 C CG . LYS B 2 47 ? -34.560 -10.324 -20.316 1.00 48.69 ? 47 LYS B CG 1 ATOM 737 C CD . LYS B 2 47 ? -34.957 -9.421 -21.471 1.00 57.46 ? 47 LYS B CD 1 ATOM 738 C CE . LYS B 2 47 ? -36.403 -9.620 -21.852 1.00 66.88 ? 47 LYS B CE 1 ATOM 739 N NZ . LYS B 2 47 ? -36.916 -8.502 -22.681 1.00 76.36 ? 47 LYS B NZ 1 ATOM 740 N N . ILE B 2 48 ? -33.204 -13.358 -18.228 1.00 35.65 ? 48 ILE B N 1 ATOM 741 C CA . ILE B 2 48 ? -33.155 -14.813 -18.376 1.00 35.67 ? 48 ILE B CA 1 ATOM 742 C C . ILE B 2 48 ? -34.457 -15.377 -18.965 1.00 39.60 ? 48 ILE B C 1 ATOM 743 O O . ILE B 2 48 ? -35.540 -15.046 -18.480 1.00 39.38 ? 48 ILE B O 1 ATOM 744 C CB . ILE B 2 48 ? -32.775 -15.477 -17.011 1.00 39.38 ? 48 ILE B CB 1 ATOM 745 C CG1 . ILE B 2 48 ? -31.505 -14.834 -16.393 1.00 40.27 ? 48 ILE B CG1 1 ATOM 746 C CG2 . ILE B 2 48 ? -32.607 -16.994 -17.142 1.00 40.34 ? 48 ILE B CG2 1 ATOM 747 C CD1 . ILE B 2 48 ? -31.481 -14.783 -14.856 1.00 48.85 ? 48 ILE B CD1 1 ATOM 748 N N . GLN B 2 49 ? -34.340 -16.232 -20.006 1.00 36.16 ? 49 GLN B N 1 ATOM 749 C CA . GLN B 2 49 ? -35.481 -16.904 -20.631 1.00 36.09 ? 49 GLN B CA 1 ATOM 750 C C . GLN B 2 49 ? -35.522 -18.366 -20.188 1.00 40.49 ? 49 GLN B C 1 ATOM 751 O O . GLN B 2 49 ? -34.525 -19.084 -20.306 1.00 40.42 ? 49 GLN B O 1 ATOM 752 C CB . GLN B 2 49 ? -35.474 -16.781 -22.163 1.00 37.60 ? 49 GLN B CB 1 ATOM 753 C CG . GLN B 2 49 ? -36.822 -17.162 -22.786 1.00 50.84 ? 49 GLN B CG 1 ATOM 754 C CD . GLN B 2 49 ? -36.871 -17.083 -24.294 1.00 68.54 ? 49 GLN B CD 1 ATOM 755 O OE1 . GLN B 2 49 ? -36.175 -16.290 -24.938 1.00 64.11 ? 49 GLN B OE1 1 ATOM 756 N NE2 . GLN B 2 49 ? -37.745 -17.879 -24.889 1.00 60.57 ? 49 GLN B NE2 1 ATOM 757 N N . VAL B 2 50 ? -36.683 -18.793 -19.675 1.00 37.29 ? 50 VAL B N 1 ATOM 758 C CA . VAL B 2 50 ? -36.924 -20.133 -19.143 1.00 37.39 ? 50 VAL B CA 1 ATOM 759 C C . VAL B 2 50 ? -38.089 -20.846 -19.877 1.00 41.08 ? 50 VAL B C 1 ATOM 760 O O . VAL B 2 50 ? -38.881 -20.185 -20.551 1.00 40.65 ? 50 VAL B O 1 ATOM 761 C CB . VAL B 2 50 ? -37.101 -20.039 -17.599 1.00 41.98 ? 50 VAL B CB 1 ATOM 762 C CG1 . VAL B 2 50 ? -38.500 -19.564 -17.203 1.00 42.25 ? 50 VAL B CG1 1 ATOM 763 C CG2 . VAL B 2 50 ? -36.732 -21.341 -16.902 1.00 42.45 ? 50 VAL B CG2 1 ATOM 764 N N . SER B 2 51 ? -38.174 -22.183 -19.759 1.00 37.79 ? 51 SER B N 1 ATOM 765 C CA . SER B 2 51 ? -39.208 -22.991 -20.407 1.00 37.78 ? 51 SER B CA 1 ATOM 766 C C . SER B 2 51 ? -40.601 -22.887 -19.751 1.00 42.28 ? 51 SER B C 1 ATOM 767 O O . SER B 2 51 ? -41.604 -23.152 -20.420 1.00 42.16 ? 51 SER B O 1 ATOM 768 C CB . SER B 2 51 ? -38.751 -24.439 -20.519 1.00 41.49 ? 51 SER B CB 1 ATOM 769 O OG . SER B 2 51 ? -39.736 -25.221 -21.158 1.00 50.44 ? 51 SER B OG 1 ATOM 770 N N . LEU B 2 52 ? -40.662 -22.506 -18.457 1.00 39.26 ? 52 LEU B N 1 ATOM 771 C CA . LEU B 2 52 ? -41.926 -22.336 -17.727 1.00 39.95 ? 52 LEU B CA 1 ATOM 772 C C . LEU B 2 52 ? -42.473 -20.899 -17.825 1.00 43.95 ? 52 LEU B C 1 ATOM 773 O O . LEU B 2 52 ? -41.791 -20.025 -18.364 1.00 42.82 ? 52 LEU B O 1 ATOM 774 C CB . LEU B 2 52 ? -41.835 -22.824 -16.259 1.00 40.99 ? 52 LEU B CB 1 ATOM 775 C CG . LEU B 2 52 ? -40.687 -22.335 -15.362 1.00 45.83 ? 52 LEU B CG 1 ATOM 776 C CD1 . LEU B 2 52 ? -40.992 -20.984 -14.747 1.00 46.42 ? 52 LEU B CD1 1 ATOM 777 C CD2 . LEU B 2 52 ? -40.481 -23.289 -14.222 1.00 49.54 ? 52 LEU B CD2 1 ATOM 778 N N . GLN B 2 53 ? -43.700 -20.661 -17.309 1.00 41.74 ? 53 GLN B N 1 ATOM 779 C CA . GLN B 2 53 ? -44.357 -19.348 -17.331 1.00 42.30 ? 53 GLN B CA 1 ATOM 780 C C . GLN B 2 53 ? -44.738 -18.863 -15.925 1.00 47.92 ? 53 GLN B C 1 ATOM 781 O O . GLN B 2 53 ? -45.540 -19.507 -15.246 1.00 48.63 ? 53 GLN B O 1 ATOM 782 C CB . GLN B 2 53 ? -45.568 -19.349 -18.280 1.00 44.25 ? 53 GLN B CB 1 ATOM 783 C CG . GLN B 2 53 ? -45.189 -19.485 -19.756 1.00 54.86 ? 53 GLN B CG 1 ATOM 784 C CD . GLN B 2 53 ? -46.363 -19.753 -20.669 1.00 72.68 ? 53 GLN B CD 1 ATOM 785 O OE1 . GLN B 2 53 ? -47.444 -20.186 -20.250 1.00 69.29 ? 53 GLN B OE1 1 ATOM 786 N NE2 . GLN B 2 53 ? -46.160 -19.535 -21.957 1.00 63.98 ? 53 GLN B NE2 1 ATOM 787 N N . ILE B 2 54 ? -44.151 -17.726 -15.493 1.00 44.87 ? 54 ILE B N 1 ATOM 788 C CA . ILE B 2 54 ? -44.369 -17.127 -14.167 1.00 46.32 ? 54 ILE B CA 1 ATOM 789 C C . ILE B 2 54 ? -45.462 -16.053 -14.204 1.00 52.14 ? 54 ILE B C 1 ATOM 790 O O . ILE B 2 54 ? -45.490 -15.230 -15.121 1.00 51.12 ? 54 ILE B O 1 ATOM 791 C CB . ILE B 2 54 ? -43.043 -16.572 -13.557 1.00 48.75 ? 54 ILE B CB 1 ATOM 792 C CG1 . ILE B 2 54 ? -41.870 -17.548 -13.739 1.00 47.85 ? 54 ILE B CG1 1 ATOM 793 C CG2 . ILE B 2 54 ? -43.205 -16.216 -12.079 1.00 51.28 ? 54 ILE B CG2 1 ATOM 794 C CD1 . ILE B 2 54 ? -40.711 -16.969 -14.439 1.00 53.55 ? 54 ILE B CD1 1 ATOM 795 N N . GLY B 2 55 ? -46.319 -16.060 -13.182 1.00 51.35 ? 55 GLY B N 1 ATOM 796 C CA . GLY B 2 55 ? -47.403 -15.099 -13.020 1.00 53.49 ? 55 GLY B CA 1 ATOM 797 C C . GLY B 2 55 ? -48.702 -15.467 -13.708 1.00 59.01 ? 55 GLY B C 1 ATOM 798 O O . GLY B 2 55 ? -49.619 -14.645 -13.762 1.00 60.59 ? 55 GLY B O 1 ATOM 799 N N . ILE B 2 56 ? -48.788 -16.699 -14.249 1.00 54.93 ? 56 ILE B N 1 ATOM 800 C CA . ILE B 2 56 ? -49.964 -17.206 -14.967 1.00 55.97 ? 56 ILE B CA 1 ATOM 801 C C . ILE B 2 56 ? -50.342 -18.590 -14.419 1.00 60.84 ? 56 ILE B C 1 ATOM 802 O O . ILE B 2 56 ? -49.461 -19.420 -14.199 1.00 59.00 ? 56 ILE B O 1 ATOM 803 C CB . ILE B 2 56 ? -49.728 -17.217 -16.519 1.00 57.53 ? 56 ILE B CB 1 ATOM 804 C CG1 . ILE B 2 56 ? -49.417 -15.809 -17.073 1.00 58.01 ? 56 ILE B CG1 1 ATOM 805 C CG2 . ILE B 2 56 ? -50.905 -17.826 -17.291 1.00 59.31 ? 56 ILE B CG2 1 ATOM 806 C CD1 . ILE B 2 56 ? -47.960 -15.541 -17.321 1.00 63.77 ? 56 ILE B CD1 1 ATOM 807 N N . LYS B 2 57 ? -51.648 -18.822 -14.187 1.00 60.04 ? 57 LYS B N 1 ATOM 808 C CA . LYS B 2 57 ? -52.189 -20.096 -13.706 1.00 60.89 ? 57 LYS B CA 1 ATOM 809 C C . LYS B 2 57 ? -52.562 -20.989 -14.901 1.00 64.15 ? 57 LYS B C 1 ATOM 810 O O . LYS B 2 57 ? -52.581 -20.503 -16.033 1.00 62.86 ? 57 LYS B O 1 ATOM 811 C CB . LYS B 2 57 ? -53.419 -19.855 -12.813 1.00 66.85 ? 57 LYS B CB 1 ATOM 812 C CG . LYS B 2 57 ? -53.092 -19.344 -11.411 1.00 82.71 ? 57 LYS B CG 1 ATOM 813 C CD . LYS B 2 57 ? -54.343 -18.884 -10.656 1.00 96.72 ? 57 LYS B CD 1 ATOM 814 C CE . LYS B 2 57 ? -55.086 -20.008 -9.972 1.00 109.70 ? 57 LYS B CE 1 ATOM 815 N NZ . LYS B 2 57 ? -56.367 -19.542 -9.383 1.00 122.98 ? 57 LYS B NZ 1 ATOM 816 N N . THR B 2 58 ? -52.875 -22.282 -14.649 1.00 61.45 ? 58 THR B N 1 ATOM 817 C CA . THR B 2 58 ? -53.259 -23.262 -15.682 1.00 60.76 ? 58 THR B CA 1 ATOM 818 C C . THR B 2 58 ? -54.530 -22.873 -16.452 1.00 66.96 ? 58 THR B C 1 ATOM 819 O O . THR B 2 58 ? -54.668 -23.228 -17.625 1.00 65.67 ? 58 THR B O 1 ATOM 820 C CB . THR B 2 58 ? -53.338 -24.681 -15.108 1.00 69.12 ? 58 THR B CB 1 ATOM 821 O OG1 . THR B 2 58 ? -54.224 -24.695 -13.988 1.00 71.92 ? 58 THR B OG1 1 ATOM 822 C CG2 . THR B 2 58 ? -51.976 -25.227 -14.716 1.00 65.64 ? 58 THR B CG2 1 ATOM 823 N N . ASP B 2 59 ? -55.439 -22.124 -15.795 1.00 66.69 ? 59 ASP B N 1 ATOM 824 C CA . ASP B 2 59 ? -56.693 -21.626 -16.371 1.00 69.05 ? 59 ASP B CA 1 ATOM 825 C C . ASP B 2 59 ? -56.490 -20.308 -17.155 1.00 73.08 ? 59 ASP B C 1 ATOM 826 O O . ASP B 2 59 ? -57.469 -19.685 -17.577 1.00 74.95 ? 59 ASP B O 1 ATOM 827 C CB . ASP B 2 59 ? -57.773 -21.484 -15.277 1.00 74.42 ? 59 ASP B CB 1 ATOM 828 C CG . ASP B 2 59 ? -57.334 -20.685 -14.065 1.00 85.40 ? 59 ASP B CG 1 ATOM 829 O OD1 . ASP B 2 59 ? -57.743 -19.513 -13.950 1.00 87.76 ? 59 ASP B OD1 1 ATOM 830 O OD2 . ASP B 2 59 ? -56.555 -21.226 -13.248 1.00 90.43 ? 59 ASP B OD2 1 ATOM 831 N N . ASP B 2 60 ? -55.206 -19.914 -17.365 1.00 67.44 ? 60 ASP B N 1 ATOM 832 C CA . ASP B 2 60 ? -54.707 -18.728 -18.087 1.00 66.79 ? 60 ASP B CA 1 ATOM 833 C C . ASP B 2 60 ? -54.749 -17.398 -17.318 1.00 72.34 ? 60 ASP B C 1 ATOM 834 O O . ASP B 2 60 ? -54.124 -16.430 -17.760 1.00 71.09 ? 60 ASP B O 1 ATOM 835 C CB . ASP B 2 60 ? -55.287 -18.598 -19.514 1.00 69.36 ? 60 ASP B CB 1 ATOM 836 C CG . ASP B 2 60 ? -55.227 -19.870 -20.339 1.00 78.83 ? 60 ASP B CG 1 ATOM 837 O OD1 . ASP B 2 60 ? -54.114 -20.417 -20.509 1.00 76.83 ? 60 ASP B OD1 1 ATOM 838 O OD2 . ASP B 2 60 ? -56.285 -20.293 -20.851 1.00 86.73 ? 60 ASP B OD2 1 ATOM 839 N N . SER B 2 61 ? -55.448 -17.356 -16.163 1.00 71.43 ? 61 SER B N 1 ATOM 840 C CA . SER B 2 61 ? -55.571 -16.158 -15.325 1.00 73.27 ? 61 SER B CA 1 ATOM 841 C C . SER B 2 61 ? -54.228 -15.691 -14.760 1.00 75.25 ? 61 SER B C 1 ATOM 842 O O . SER B 2 61 ? -53.386 -16.518 -14.402 1.00 72.70 ? 61 SER B O 1 ATOM 843 C CB . SER B 2 61 ? -56.565 -16.388 -14.191 1.00 80.11 ? 61 SER B CB 1 ATOM 844 O OG . SER B 2 61 ? -56.091 -17.349 -13.261 1.00 88.19 ? 61 SER B OG 1 ATOM 845 N N . HIS B 2 62 ? -54.037 -14.364 -14.687 1.00 72.85 ? 62 HIS B N 1 ATOM 846 C CA . HIS B 2 62 ? -52.814 -13.756 -14.169 1.00 71.10 ? 62 HIS B CA 1 ATOM 847 C C . HIS B 2 62 ? -52.827 -13.690 -12.646 1.00 76.38 ? 62 HIS B C 1 ATOM 848 O O . HIS B 2 62 ? -53.749 -13.122 -12.055 1.00 79.03 ? 62 HIS B O 1 ATOM 849 C CB . HIS B 2 62 ? -52.577 -12.371 -14.792 1.00 72.04 ? 62 HIS B CB 1 ATOM 850 C CG . HIS B 2 62 ? -52.205 -12.424 -16.241 1.00 73.64 ? 62 HIS B CG 1 ATOM 851 N ND1 . HIS B 2 62 ? -50.902 -12.219 -16.660 1.00 72.73 ? 62 HIS B ND1 1 ATOM 852 C CD2 . HIS B 2 62 ? -52.978 -12.671 -17.324 1.00 76.24 ? 62 HIS B CD2 1 ATOM 853 C CE1 . HIS B 2 62 ? -50.925 -12.341 -17.978 1.00 71.49 ? 62 HIS B CE1 1 ATOM 854 N NE2 . HIS B 2 62 ? -52.152 -12.615 -18.422 1.00 73.87 ? 62 HIS B NE2 1 ATOM 855 N N . ASP B 2 63 ? -51.811 -14.304 -12.017 1.00 71.00 ? 63 ASP B N 1 ATOM 856 C CA . ASP B 2 63 ? -51.635 -14.357 -10.567 1.00 72.25 ? 63 ASP B CA 1 ATOM 857 C C . ASP B 2 63 ? -50.135 -14.335 -10.263 1.00 73.32 ? 63 ASP B C 1 ATOM 858 O O . ASP B 2 63 ? -49.445 -15.327 -10.511 1.00 70.73 ? 63 ASP B O 1 ATOM 859 C CB . ASP B 2 63 ? -52.303 -15.624 -9.989 1.00 75.53 ? 63 ASP B CB 1 ATOM 860 C CG . ASP B 2 63 ? -52.612 -15.580 -8.502 1.00 88.38 ? 63 ASP B CG 1 ATOM 861 O OD1 . ASP B 2 63 ? -51.734 -15.150 -7.722 1.00 88.57 ? 63 ASP B OD1 1 ATOM 862 O OD2 . ASP B 2 63 ? -53.709 -16.031 -8.113 1.00 97.07 ? 63 ASP B OD2 1 ATOM 863 N N . TRP B 2 64 ? -49.637 -13.199 -9.733 1.00 70.20 ? 64 TRP B N 1 ATOM 864 C CA . TRP B 2 64 ? -48.222 -12.986 -9.406 1.00 67.99 ? 64 TRP B CA 1 ATOM 865 C C . TRP B 2 64 ? -47.629 -13.970 -8.388 1.00 71.99 ? 64 TRP B C 1 ATOM 866 O O . TRP B 2 64 ? -46.427 -14.229 -8.436 1.00 69.52 ? 64 TRP B O 1 ATOM 867 C CB . TRP B 2 64 ? -47.946 -11.523 -9.017 1.00 67.55 ? 64 TRP B CB 1 ATOM 868 C CG . TRP B 2 64 ? -48.530 -11.106 -7.700 1.00 71.87 ? 64 TRP B CG 1 ATOM 869 C CD1 . TRP B 2 64 ? -49.796 -10.654 -7.470 1.00 77.89 ? 64 TRP B CD1 1 ATOM 870 C CD2 . TRP B 2 64 ? -47.854 -11.070 -6.436 1.00 72.70 ? 64 TRP B CD2 1 ATOM 871 N NE1 . TRP B 2 64 ? -49.957 -10.353 -6.138 1.00 80.25 ? 64 TRP B NE1 1 ATOM 872 C CE2 . TRP B 2 64 ? -48.780 -10.598 -5.479 1.00 80.41 ? 64 TRP B CE2 1 ATOM 873 C CE3 . TRP B 2 64 ? -46.555 -11.402 -6.014 1.00 72.31 ? 64 TRP B CE3 1 ATOM 874 C CZ2 . TRP B 2 64 ? -48.449 -10.449 -4.127 1.00 81.93 ? 64 TRP B CZ2 1 ATOM 875 C CZ3 . TRP B 2 64 ? -46.228 -11.253 -4.675 1.00 75.95 ? 64 TRP B CZ3 1 ATOM 876 C CH2 . TRP B 2 64 ? -47.168 -10.783 -3.747 1.00 80.35 ? 64 TRP B CH2 1 ATOM 877 N N . THR B 2 65 ? -48.468 -14.532 -7.492 1.00 71.26 ? 65 THR B N 1 ATOM 878 C CA . THR B 2 65 ? -48.043 -15.506 -6.475 1.00 71.91 ? 65 THR B CA 1 ATOM 879 C C . THR B 2 65 ? -47.941 -16.931 -7.048 1.00 74.03 ? 65 THR B C 1 ATOM 880 O O . THR B 2 65 ? -47.453 -17.832 -6.359 1.00 73.96 ? 65 THR B O 1 ATOM 881 C CB . THR B 2 65 ? -48.967 -15.467 -5.239 1.00 83.80 ? 65 THR B CB 1 ATOM 882 O OG1 . THR B 2 65 ? -50.294 -15.843 -5.612 1.00 84.76 ? 65 THR B OG1 1 ATOM 883 C CG2 . THR B 2 65 ? -48.967 -14.116 -4.536 1.00 84.24 ? 65 THR B CG2 1 ATOM 884 N N . LYS B 2 66 ? -48.390 -17.130 -8.304 1.00 68.97 ? 66 LYS B N 1 ATOM 885 C CA . LYS B 2 66 ? -48.384 -18.434 -8.969 1.00 67.35 ? 66 LYS B CA 1 ATOM 886 C C . LYS B 2 66 ? -47.385 -18.551 -10.129 1.00 68.11 ? 66 LYS B C 1 ATOM 887 O O . LYS B 2 66 ? -46.913 -17.543 -10.661 1.00 66.40 ? 66 LYS B O 1 ATOM 888 C CB . LYS B 2 66 ? -49.810 -18.847 -9.398 1.00 71.22 ? 66 LYS B CB 1 ATOM 889 C CG . LYS B 2 66 ? -50.822 -18.956 -8.250 1.00 88.98 ? 66 LYS B CG 1 ATOM 890 C CD . LYS B 2 66 ? -50.619 -20.195 -7.369 1.00 99.57 ? 66 LYS B CD 1 ATOM 891 C CE . LYS B 2 66 ? -51.407 -20.128 -6.083 1.00 113.92 ? 66 LYS B CE 1 ATOM 892 N NZ . LYS B 2 66 ? -50.809 -19.176 -5.106 1.00 124.06 ? 66 LYS B NZ 1 ATOM 893 N N . LEU B 2 67 ? -47.071 -19.805 -10.500 1.00 63.74 ? 67 LEU B N 1 ATOM 894 C CA . LEU B 2 67 ? -46.138 -20.207 -11.554 1.00 60.94 ? 67 LEU B CA 1 ATOM 895 C C . LEU B 2 67 ? -46.729 -21.436 -12.270 1.00 64.50 ? 67 LEU B C 1 ATOM 896 O O . LEU B 2 67 ? -47.293 -22.317 -11.622 1.00 65.53 ? 67 LEU B O 1 ATOM 897 C CB . LEU B 2 67 ? -44.783 -20.548 -10.902 1.00 60.46 ? 67 LEU B CB 1 ATOM 898 C CG . LEU B 2 67 ? -43.595 -20.881 -11.801 1.00 62.89 ? 67 LEU B CG 1 ATOM 899 C CD1 . LEU B 2 67 ? -42.313 -20.364 -11.193 1.00 62.85 ? 67 LEU B CD1 1 ATOM 900 C CD2 . LEU B 2 67 ? -43.469 -22.385 -12.015 1.00 65.16 ? 67 LEU B CD2 1 ATOM 901 N N . ARG B 2 68 ? -46.556 -21.501 -13.593 1.00 59.30 ? 68 ARG B N 1 ATOM 902 C CA . ARG B 2 68 ? -47.077 -22.544 -14.477 1.00 58.65 ? 68 ARG B CA 1 ATOM 903 C C . ARG B 2 68 ? -45.914 -23.296 -15.141 1.00 61.07 ? 68 ARG B C 1 ATOM 904 O O . ARG B 2 68 ? -45.112 -22.672 -15.834 1.00 59.31 ? 68 ARG B O 1 ATOM 905 C CB . ARG B 2 68 ? -47.918 -21.813 -15.536 1.00 58.48 ? 68 ARG B CB 1 ATOM 906 C CG . ARG B 2 68 ? -48.685 -22.619 -16.546 1.00 67.04 ? 68 ARG B CG 1 ATOM 907 C CD . ARG B 2 68 ? -49.758 -21.732 -17.134 1.00 76.26 ? 68 ARG B CD 1 ATOM 908 N NE . ARG B 2 68 ? -49.503 -21.223 -18.485 1.00 82.41 ? 68 ARG B NE 1 ATOM 909 C CZ . ARG B 2 68 ? -50.473 -20.848 -19.316 1.00 97.03 ? 68 ARG B CZ 1 ATOM 910 N NH1 . ARG B 2 68 ? -51.746 -20.944 -18.948 1.00 86.35 ? 68 ARG B NH1 1 ATOM 911 N NH2 . ARG B 2 68 ? -50.180 -20.387 -20.524 1.00 82.66 ? 68 ARG B NH2 1 ATOM 912 N N . TYR B 2 69 ? -45.827 -24.621 -14.932 1.00 58.19 ? 69 TYR B N 1 ATOM 913 C CA . TYR B 2 69 ? -44.779 -25.481 -15.499 1.00 56.87 ? 69 TYR B CA 1 ATOM 914 C C . TYR B 2 69 ? -45.402 -26.725 -16.143 1.00 60.97 ? 69 TYR B C 1 ATOM 915 O O . TYR B 2 69 ? -46.486 -27.141 -15.733 1.00 61.63 ? 69 TYR B O 1 ATOM 916 C CB . TYR B 2 69 ? -43.759 -25.885 -14.407 1.00 58.66 ? 69 TYR B CB 1 ATOM 917 C CG . TYR B 2 69 ? -44.295 -26.879 -13.397 1.00 62.33 ? 69 TYR B CG 1 ATOM 918 C CD1 . TYR B 2 69 ? -43.995 -28.235 -13.495 1.00 64.51 ? 69 TYR B CD1 1 ATOM 919 C CD2 . TYR B 2 69 ? -45.114 -26.467 -12.349 1.00 64.99 ? 69 TYR B CD2 1 ATOM 920 C CE1 . TYR B 2 69 ? -44.502 -29.157 -12.581 1.00 67.27 ? 69 TYR B CE1 1 ATOM 921 C CE2 . TYR B 2 69 ? -45.635 -27.381 -11.435 1.00 67.92 ? 69 TYR B CE2 1 ATOM 922 C CZ . TYR B 2 69 ? -45.328 -28.726 -11.556 1.00 75.56 ? 69 TYR B CZ 1 ATOM 923 O OH . TYR B 2 69 ? -45.837 -29.633 -10.657 1.00 78.93 ? 69 TYR B OH 1 ATOM 924 N N . MET B 2 70 ? -44.703 -27.340 -17.114 1.00 56.79 ? 70 MET B N 1 ATOM 925 C CA . MET B 2 70 ? -45.185 -28.555 -17.772 1.00 56.82 ? 70 MET B CA 1 ATOM 926 C C . MET B 2 70 ? -44.906 -29.779 -16.896 1.00 62.22 ? 70 MET B C 1 ATOM 927 O O . MET B 2 70 ? -43.745 -30.134 -16.675 1.00 61.46 ? 70 MET B O 1 ATOM 928 C CB . MET B 2 70 ? -44.579 -28.703 -19.182 1.00 57.91 ? 70 MET B CB 1 ATOM 929 C CG . MET B 2 70 ? -45.069 -29.924 -19.950 1.00 61.69 ? 70 MET B CG 1 ATOM 930 S SD . MET B 2 70 ? -46.857 -29.974 -20.227 1.00 66.80 ? 70 MET B SD 1 ATOM 931 C CE . MET B 2 70 ? -46.980 -29.031 -21.703 1.00 62.91 ? 70 MET B CE 1 ATOM 932 N N . ASP B 2 71 ? -45.978 -30.408 -16.390 1.00 60.79 ? 71 ASP B N 1 ATOM 933 C CA . ASP B 2 71 ? -45.893 -31.592 -15.540 1.00 62.18 ? 71 ASP B CA 1 ATOM 934 C C . ASP B 2 71 ? -46.311 -32.842 -16.319 1.00 66.43 ? 71 ASP B C 1 ATOM 935 O O . ASP B 2 71 ? -47.502 -33.152 -16.393 1.00 66.74 ? 71 ASP B O 1 ATOM 936 C CB . ASP B 2 71 ? -46.749 -31.410 -14.273 1.00 66.03 ? 71 ASP B CB 1 ATOM 937 C CG . ASP B 2 71 ? -46.566 -32.488 -13.223 1.00 77.97 ? 71 ASP B CG 1 ATOM 938 O OD1 . ASP B 2 71 ? -45.456 -32.581 -12.652 1.00 78.82 ? 71 ASP B OD1 1 ATOM 939 O OD2 . ASP B 2 71 ? -47.546 -33.208 -12.939 1.00 85.16 ? 71 ASP B OD2 1 ATOM 940 N N . ASN B 2 72 ? -45.325 -33.533 -16.923 1.00 62.68 ? 72 ASN B N 1 ATOM 941 C CA . ASN B 2 72 ? -45.478 -34.780 -17.687 1.00 62.69 ? 72 ASN B CA 1 ATOM 942 C C . ASN B 2 72 ? -46.788 -34.885 -18.511 1.00 66.61 ? 72 ASN B C 1 ATOM 943 O O . ASN B 2 72 ? -47.712 -35.604 -18.115 1.00 67.29 ? 72 ASN B O 1 ATOM 944 C CB . ASN B 2 72 ? -45.301 -35.997 -16.757 1.00 65.73 ? 72 ASN B CB 1 ATOM 945 C CG . ASN B 2 72 ? -44.089 -35.968 -15.845 1.00 91.96 ? 72 ASN B CG 1 ATOM 946 O OD1 . ASN B 2 72 ? -44.149 -36.413 -14.695 1.00 88.38 ? 72 ASN B OD1 1 ATOM 947 N ND2 . ASN B 2 72 ? -42.952 -35.480 -16.333 1.00 83.41 ? 72 ASN B ND2 1 ATOM 948 N N . HIS B 2 73 ? -46.863 -34.124 -19.630 1.00 62.18 ? 73 HIS B N 1 ATOM 949 C CA . HIS B 2 73 ? -47.969 -34.013 -20.605 1.00 62.08 ? 73 HIS B CA 1 ATOM 950 C C . HIS B 2 73 ? -48.968 -32.877 -20.379 1.00 66.00 ? 73 HIS B C 1 ATOM 951 O O . HIS B 2 73 ? -49.447 -32.309 -21.360 1.00 65.43 ? 73 HIS B O 1 ATOM 952 C CB . HIS B 2 73 ? -48.676 -35.346 -20.923 1.00 63.71 ? 73 HIS B CB 1 ATOM 953 C CG . HIS B 2 73 ? -48.890 -35.581 -22.386 1.00 66.83 ? 73 HIS B CG 1 ATOM 954 N ND1 . HIS B 2 73 ? -49.901 -34.941 -23.082 1.00 68.98 ? 73 HIS B ND1 1 ATOM 955 C CD2 . HIS B 2 73 ? -48.221 -36.394 -23.237 1.00 68.32 ? 73 HIS B CD2 1 ATOM 956 C CE1 . HIS B 2 73 ? -49.810 -35.377 -24.328 1.00 68.27 ? 73 HIS B CE1 1 ATOM 957 N NE2 . HIS B 2 73 ? -48.814 -36.252 -24.470 1.00 68.19 ? 73 HIS B NE2 1 ATOM 958 N N . MET B 2 74 ? -49.278 -32.535 -19.113 1.00 63.11 ? 74 MET B N 1 ATOM 959 C CA . MET B 2 74 ? -50.217 -31.451 -18.796 1.00 63.61 ? 74 MET B CA 1 ATOM 960 C C . MET B 2 74 ? -49.615 -30.372 -17.880 1.00 66.49 ? 74 MET B C 1 ATOM 961 O O . MET B 2 74 ? -48.908 -30.723 -16.937 1.00 66.18 ? 74 MET B O 1 ATOM 962 C CB . MET B 2 74 ? -51.516 -32.008 -18.196 1.00 67.94 ? 74 MET B CB 1 ATOM 963 C CG . MET B 2 74 ? -52.468 -32.564 -19.231 1.00 72.06 ? 74 MET B CG 1 ATOM 964 S SD . MET B 2 74 ? -53.417 -31.274 -20.074 1.00 76.97 ? 74 MET B SD 1 ATOM 965 C CE . MET B 2 74 ? -52.691 -31.341 -21.691 1.00 71.99 ? 74 MET B CE 1 ATOM 966 N N . PRO B 2 75 ? -49.893 -29.062 -18.109 1.00 62.42 ? 75 PRO B N 1 ATOM 967 C CA . PRO B 2 75 ? -49.324 -28.029 -17.225 1.00 62.00 ? 75 PRO B CA 1 ATOM 968 C C . PRO B 2 75 ? -49.916 -28.050 -15.815 1.00 66.92 ? 75 PRO B C 1 ATOM 969 O O . PRO B 2 75 ? -51.089 -28.387 -15.646 1.00 67.89 ? 75 PRO B O 1 ATOM 970 C CB . PRO B 2 75 ? -49.642 -26.713 -17.952 1.00 63.60 ? 75 PRO B CB 1 ATOM 971 C CG . PRO B 2 75 ? -50.079 -27.106 -19.332 1.00 67.71 ? 75 PRO B CG 1 ATOM 972 C CD . PRO B 2 75 ? -50.708 -28.448 -19.175 1.00 64.05 ? 75 PRO B CD 1 ATOM 973 N N . ALA B 2 76 ? -49.094 -27.703 -14.807 1.00 63.17 ? 76 ALA B N 1 ATOM 974 C CA . ALA B 2 76 ? -49.491 -27.668 -13.396 1.00 64.94 ? 76 ALA B CA 1 ATOM 975 C C . ALA B 2 76 ? -49.071 -26.361 -12.710 1.00 68.56 ? 76 ALA B C 1 ATOM 976 O O . ALA B 2 76 ? -48.167 -25.674 -13.190 1.00 66.36 ? 76 ALA B O 1 ATOM 977 C CB . ALA B 2 76 ? -48.913 -28.866 -12.656 1.00 66.26 ? 76 ALA B CB 1 ATOM 978 N N . ASP B 2 77 ? -49.737 -26.020 -11.590 1.00 67.14 ? 77 ASP B N 1 ATOM 979 C CA . ASP B 2 77 ? -49.460 -24.813 -10.810 1.00 67.55 ? 77 ASP B CA 1 ATOM 980 C C . ASP B 2 77 ? -48.397 -25.043 -9.736 1.00 71.29 ? 77 ASP B C 1 ATOM 981 O O . ASP B 2 77 ? -48.374 -26.095 -9.094 1.00 72.10 ? 77 ASP B O 1 ATOM 982 C CB . ASP B 2 77 ? -50.743 -24.268 -10.165 1.00 72.24 ? 77 ASP B CB 1 ATOM 983 C CG . ASP B 2 77 ? -51.679 -23.574 -11.130 1.00 82.07 ? 77 ASP B CG 1 ATOM 984 O OD1 . ASP B 2 77 ? -52.647 -24.217 -11.579 1.00 83.36 ? 77 ASP B OD1 1 ATOM 985 O OD2 . ASP B 2 77 ? -51.472 -22.373 -11.392 1.00 87.49 ? 77 ASP B OD2 1 ATOM 986 N N . ALA B 2 78 ? -47.534 -24.035 -9.535 1.00 66.66 ? 78 ALA B N 1 ATOM 987 C CA . ALA B 2 78 ? -46.458 -24.015 -8.541 1.00 66.87 ? 78 ALA B CA 1 ATOM 988 C C . ALA B 2 78 ? -46.366 -22.616 -7.914 1.00 70.98 ? 78 ALA B C 1 ATOM 989 O O . ALA B 2 78 ? -46.891 -21.658 -8.484 1.00 69.99 ? 78 ALA B O 1 ATOM 990 C CB . ALA B 2 78 ? -45.135 -24.396 -9.192 1.00 65.24 ? 78 ALA B CB 1 ATOM 991 N N . GLU B 2 79 ? -45.720 -22.501 -6.739 1.00 68.73 ? 79 GLU B N 1 ATOM 992 C CA . GLU B 2 79 ? -45.579 -21.227 -6.026 1.00 69.46 ? 79 GLU B CA 1 ATOM 993 C C . GLU B 2 79 ? -44.442 -20.357 -6.563 1.00 70.25 ? 79 GLU B C 1 ATOM 994 O O . GLU B 2 79 ? -43.387 -20.878 -6.933 1.00 68.08 ? 79 GLU B O 1 ATOM 995 C CB . GLU B 2 79 ? -45.413 -21.452 -4.511 1.00 74.05 ? 79 GLU B CB 1 ATOM 996 C CG . GLU B 2 79 ? -46.651 -21.995 -3.809 1.00 87.74 ? 79 GLU B CG 1 ATOM 997 C CD . GLU B 2 79 ? -47.892 -21.121 -3.847 1.00 110.39 ? 79 GLU B CD 1 ATOM 998 O OE1 . GLU B 2 79 ? -47.798 -19.926 -3.484 1.00 106.81 ? 79 GLU B OE1 1 ATOM 999 O OE2 . GLU B 2 79 ? -48.967 -21.642 -4.220 1.00 105.53 ? 79 GLU B OE2 1 ATOM 1000 N N . ARG B 2 80 ? -44.662 -19.026 -6.586 1.00 66.46 ? 80 ARG B N 1 ATOM 1001 C CA . ARG B 2 80 ? -43.687 -18.022 -7.028 1.00 64.14 ? 80 ARG B CA 1 ATOM 1002 C C . ARG B 2 80 ? -42.534 -17.904 -6.018 1.00 68.42 ? 80 ARG B C 1 ATOM 1003 O O . ARG B 2 80 ? -41.388 -17.706 -6.425 1.00 66.13 ? 80 ARG B O 1 ATOM 1004 C CB . ARG B 2 80 ? -44.388 -16.661 -7.272 1.00 64.72 ? 80 ARG B CB 1 ATOM 1005 C CG . ARG B 2 80 ? -43.502 -15.402 -7.301 1.00 74.20 ? 80 ARG B CG 1 ATOM 1006 C CD . ARG B 2 80 ? -42.613 -15.300 -8.531 1.00 80.94 ? 80 ARG B CD 1 ATOM 1007 N NE . ARG B 2 80 ? -41.716 -14.144 -8.470 1.00 88.68 ? 80 ARG B NE 1 ATOM 1008 C CZ . ARG B 2 80 ? -40.506 -14.155 -7.916 1.00 102.67 ? 80 ARG B CZ 1 ATOM 1009 N NH1 . ARG B 2 80 ? -40.033 -15.263 -7.358 1.00 90.52 ? 80 ARG B NH1 1 ATOM 1010 N NH2 . ARG B 2 80 ? -39.764 -13.056 -7.909 1.00 88.92 ? 80 ARG B NH2 1 ATOM 1011 N N . ALA B 2 81 ? -42.841 -18.045 -4.710 1.00 67.77 ? 81 ALA B N 1 ATOM 1012 C CA . ALA B 2 81 ? -41.873 -17.976 -3.609 1.00 69.01 ? 81 ALA B CA 1 ATOM 1013 C C . ALA B 2 81 ? -40.774 -19.043 -3.711 1.00 71.57 ? 81 ALA B C 1 ATOM 1014 O O . ALA B 2 81 ? -39.643 -18.798 -3.288 1.00 71.22 ? 81 ALA B O 1 ATOM 1015 C CB . ALA B 2 81 ? -42.591 -18.090 -2.273 1.00 73.67 ? 81 ALA B CB 1 ATOM 1016 N N . GLY B 2 82 ? -41.118 -20.196 -4.286 1.00 67.17 ? 82 GLY B N 1 ATOM 1017 C CA . GLY B 2 82 ? -40.207 -21.318 -4.488 1.00 66.30 ? 82 GLY B CA 1 ATOM 1018 C C . GLY B 2 82 ? -39.207 -21.130 -5.614 1.00 66.89 ? 82 GLY B C 1 ATOM 1019 O O . GLY B 2 82 ? -38.224 -21.873 -5.686 1.00 66.28 ? 82 GLY B O 1 ATOM 1020 N N . LEU B 2 83 ? -39.453 -20.147 -6.510 1.00 61.17 ? 83 LEU B N 1 ATOM 1021 C CA . LEU B 2 83 ? -38.576 -19.835 -7.642 1.00 58.25 ? 83 LEU B CA 1 ATOM 1022 C C . LEU B 2 83 ? -37.279 -19.183 -7.155 1.00 62.02 ? 83 LEU B C 1 ATOM 1023 O O . LEU B 2 83 ? -37.323 -18.251 -6.347 1.00 62.81 ? 83 LEU B O 1 ATOM 1024 C CB . LEU B 2 83 ? -39.301 -18.938 -8.671 1.00 56.63 ? 83 LEU B CB 1 ATOM 1025 C CG . LEU B 2 83 ? -38.521 -18.510 -9.926 1.00 58.90 ? 83 LEU B CG 1 ATOM 1026 C CD1 . LEU B 2 83 ? -38.565 -19.582 -11.006 1.00 57.81 ? 83 LEU B CD1 1 ATOM 1027 C CD2 . LEU B 2 83 ? -39.068 -17.212 -10.480 1.00 60.63 ? 83 LEU B CD2 1 ATOM 1028 N N . PHE B 2 84 ? -36.130 -19.690 -7.638 1.00 57.39 ? 84 PHE B N 1 ATOM 1029 C CA . PHE B 2 84 ? -34.808 -19.187 -7.267 1.00 57.41 ? 84 PHE B CA 1 ATOM 1030 C C . PHE B 2 84 ? -33.854 -19.088 -8.454 1.00 59.12 ? 84 PHE B C 1 ATOM 1031 O O . PHE B 2 84 ? -33.937 -19.890 -9.386 1.00 57.62 ? 84 PHE B O 1 ATOM 1032 C CB . PHE B 2 84 ? -34.190 -20.028 -6.130 1.00 61.70 ? 84 PHE B CB 1 ATOM 1033 C CG . PHE B 2 84 ? -33.859 -21.467 -6.464 1.00 63.44 ? 84 PHE B CG 1 ATOM 1034 C CD1 . PHE B 2 84 ? -32.588 -21.821 -6.906 1.00 66.16 ? 84 PHE B CD1 1 ATOM 1035 C CD2 . PHE B 2 84 ? -34.801 -22.474 -6.288 1.00 66.45 ? 84 PHE B CD2 1 ATOM 1036 C CE1 . PHE B 2 84 ? -32.278 -23.152 -7.202 1.00 67.64 ? 84 PHE B CE1 1 ATOM 1037 C CE2 . PHE B 2 84 ? -34.487 -23.807 -6.575 1.00 69.66 ? 84 PHE B CE2 1 ATOM 1038 C CZ . PHE B 2 84 ? -33.228 -24.137 -7.032 1.00 67.45 ? 84 PHE B CZ 1 ATOM 1039 N N . VAL B 2 85 ? -32.945 -18.099 -8.405 1.00 55.25 ? 85 VAL B N 1 ATOM 1040 C CA . VAL B 2 85 ? -31.902 -17.849 -9.408 1.00 53.55 ? 85 VAL B CA 1 ATOM 1041 C C . VAL B 2 85 ? -30.571 -17.739 -8.644 1.00 58.63 ? 85 VAL B C 1 ATOM 1042 O O . VAL B 2 85 ? -30.519 -17.063 -7.615 1.00 59.49 ? 85 VAL B O 1 ATOM 1043 C CB . VAL B 2 85 ? -32.180 -16.590 -10.291 1.00 55.69 ? 85 VAL B CB 1 ATOM 1044 C CG1 . VAL B 2 85 ? -31.109 -16.417 -11.369 1.00 54.36 ? 85 VAL B CG1 1 ATOM 1045 C CG2 . VAL B 2 85 ? -33.567 -16.641 -10.932 1.00 54.63 ? 85 VAL B CG2 1 ATOM 1046 N N . ARG B 2 86 ? -29.514 -18.428 -9.123 1.00 55.12 ? 86 ARG B N 1 ATOM 1047 C CA . ARG B 2 86 ? -28.188 -18.406 -8.490 1.00 56.52 ? 86 ARG B CA 1 ATOM 1048 C C . ARG B 2 86 ? -27.029 -18.629 -9.463 1.00 59.72 ? 86 ARG B C 1 ATOM 1049 O O . ARG B 2 86 ? -27.181 -19.340 -10.457 1.00 58.39 ? 86 ARG B O 1 ATOM 1050 C CB . ARG B 2 86 ? -28.103 -19.376 -7.287 1.00 59.52 ? 86 ARG B CB 1 ATOM 1051 C CG . ARG B 2 86 ? -28.354 -20.850 -7.612 1.00 70.20 ? 86 ARG B CG 1 ATOM 1052 C CD . ARG B 2 86 ? -28.067 -21.761 -6.431 1.00 82.52 ? 86 ARG B CD 1 ATOM 1053 N NE . ARG B 2 86 ? -26.630 -21.938 -6.200 1.00 92.03 ? 86 ARG B NE 1 ATOM 1054 C CZ . ARG B 2 86 ? -25.959 -21.407 -5.182 1.00 107.53 ? 86 ARG B CZ 1 ATOM 1055 N NH1 . ARG B 2 86 ? -26.586 -20.665 -4.277 1.00 94.99 ? 86 ARG B NH1 1 ATOM 1056 N NH2 . ARG B 2 86 ? -24.656 -21.621 -5.056 1.00 95.92 ? 86 ARG B NH2 1 ATOM 1057 N N . THR B 2 87 ? -25.870 -18.017 -9.163 1.00 57.06 ? 87 THR B N 1 ATOM 1058 C CA . THR B 2 87 ? -24.634 -18.162 -9.936 1.00 57.06 ? 87 THR B CA 1 ATOM 1059 C C . THR B 2 87 ? -23.643 -18.916 -9.046 1.00 63.74 ? 87 THR B C 1 ATOM 1060 O O . THR B 2 87 ? -23.709 -20.145 -8.983 1.00 64.54 ? 87 THR B O 1 ATOM 1061 C CB . THR B 2 87 ? -24.140 -16.807 -10.491 1.00 63.56 ? 87 THR B CB 1 ATOM 1062 O OG1 . THR B 2 87 ? -24.065 -15.848 -9.435 1.00 63.27 ? 87 THR B OG1 1 ATOM 1063 C CG2 . THR B 2 87 ? -25.015 -16.284 -11.622 1.00 59.73 ? 87 THR B CG2 1 ATOM 1064 N N . SER B 2 88 ? -22.778 -18.189 -8.315 1.00 61.49 ? 88 SER B N 1 ATOM 1065 C CA . SER B 2 88 ? -21.843 -18.760 -7.346 1.00 64.44 ? 88 SER B CA 1 ATOM 1066 C C . SER B 2 88 ? -22.506 -18.674 -5.964 1.00 69.39 ? 88 SER B C 1 ATOM 1067 O O . SER B 2 88 ? -22.141 -19.407 -5.044 1.00 71.89 ? 88 SER B O 1 ATOM 1068 C CB . SER B 2 88 ? -20.529 -17.985 -7.349 1.00 68.92 ? 88 SER B CB 1 ATOM 1069 O OG . SER B 2 88 ? -20.728 -16.626 -6.994 1.00 76.34 ? 88 SER B OG 1 ATOM 1070 N N . ALA B 2 89 ? -23.494 -17.763 -5.847 1.00 63.90 ? 89 ALA B N 1 ATOM 1071 C CA . ALA B 2 89 ? -24.298 -17.462 -4.662 1.00 64.75 ? 89 ALA B CA 1 ATOM 1072 C C . ALA B 2 89 ? -25.722 -17.037 -5.119 1.00 65.86 ? 89 ALA B C 1 ATOM 1073 O O . ALA B 2 89 ? -25.885 -16.746 -6.309 1.00 62.84 ? 89 ALA B O 1 ATOM 1074 C CB . ALA B 2 89 ? -23.634 -16.338 -3.874 1.00 66.66 ? 89 ALA B CB 1 ATOM 1075 N N . PRO B 2 90 ? -26.762 -16.991 -4.235 1.00 63.25 ? 90 PRO B N 1 ATOM 1076 C CA . PRO B 2 90 ? -28.109 -16.602 -4.704 1.00 60.97 ? 90 PRO B CA 1 ATOM 1077 C C . PRO B 2 90 ? -28.215 -15.199 -5.301 1.00 62.64 ? 90 PRO B C 1 ATOM 1078 O O . PRO B 2 90 ? -27.518 -14.282 -4.865 1.00 62.76 ? 90 PRO B O 1 ATOM 1079 C CB . PRO B 2 90 ? -28.982 -16.744 -3.451 1.00 65.01 ? 90 PRO B CB 1 ATOM 1080 C CG . PRO B 2 90 ? -28.222 -17.648 -2.549 1.00 72.51 ? 90 PRO B CG 1 ATOM 1081 C CD . PRO B 2 90 ? -26.785 -17.325 -2.796 1.00 68.10 ? 90 PRO B CD 1 ATOM 1082 N N . CYS B 2 91 ? -29.088 -15.049 -6.313 1.00 56.95 ? 91 CYS B N 1 ATOM 1083 C CA . CYS B 2 91 ? -29.349 -13.792 -7.019 1.00 54.85 ? 91 CYS B CA 1 ATOM 1084 C C . CYS B 2 91 ? -30.570 -13.079 -6.447 1.00 59.37 ? 91 CYS B C 1 ATOM 1085 O O . CYS B 2 91 ? -31.407 -13.705 -5.792 1.00 60.22 ? 91 CYS B O 1 ATOM 1086 C CB . CYS B 2 91 ? -29.517 -14.038 -8.516 1.00 52.82 ? 91 CYS B CB 1 ATOM 1087 S SG . CYS B 2 91 ? -28.067 -14.755 -9.326 1.00 56.43 ? 91 CYS B SG 1 ATOM 1088 N N . THR B 2 92 ? -30.684 -11.774 -6.730 1.00 55.31 ? 92 THR B N 1 ATOM 1089 C CA . THR B 2 92 ? -31.821 -10.953 -6.323 1.00 55.75 ? 92 THR B CA 1 ATOM 1090 C C . THR B 2 92 ? -32.739 -10.783 -7.532 1.00 58.05 ? 92 THR B C 1 ATOM 1091 O O . THR B 2 92 ? -32.357 -10.128 -8.504 1.00 56.19 ? 92 THR B O 1 ATOM 1092 C CB . THR B 2 92 ? -31.367 -9.626 -5.682 1.00 64.22 ? 92 THR B CB 1 ATOM 1093 O OG1 . THR B 2 92 ? -30.209 -9.126 -6.354 1.00 62.36 ? 92 THR B OG1 1 ATOM 1094 C CG2 . THR B 2 92 ? -31.077 -9.770 -4.196 1.00 65.41 ? 92 THR B CG2 1 ATOM 1095 N N . ILE B 2 93 ? -33.921 -11.426 -7.496 1.00 55.02 ? 93 ILE B N 1 ATOM 1096 C CA . ILE B 2 93 ? -34.899 -11.365 -8.586 1.00 53.55 ? 93 ILE B CA 1 ATOM 1097 C C . ILE B 2 93 ? -35.635 -10.022 -8.531 1.00 57.81 ? 93 ILE B C 1 ATOM 1098 O O . ILE B 2 93 ? -36.253 -9.699 -7.514 1.00 59.35 ? 93 ILE B O 1 ATOM 1099 C CB . ILE B 2 93 ? -35.855 -12.597 -8.605 1.00 57.14 ? 93 ILE B CB 1 ATOM 1100 C CG1 . ILE B 2 93 ? -35.059 -13.928 -8.659 1.00 57.36 ? 93 ILE B CG1 1 ATOM 1101 C CG2 . ILE B 2 93 ? -36.845 -12.502 -9.777 1.00 56.78 ? 93 ILE B CG2 1 ATOM 1102 C CD1 . ILE B 2 93 ? -35.761 -15.151 -8.035 1.00 66.07 ? 93 ILE B CD1 1 ATOM 1103 N N . THR B 2 94 ? -35.541 -9.238 -9.619 1.00 52.78 ? 94 THR B N 1 ATOM 1104 C CA . THR B 2 94 ? -36.151 -7.907 -9.725 1.00 52.91 ? 94 THR B CA 1 ATOM 1105 C C . THR B 2 94 ? -37.501 -7.866 -10.458 1.00 56.59 ? 94 THR B C 1 ATOM 1106 O O . THR B 2 94 ? -38.285 -6.946 -10.223 1.00 57.57 ? 94 THR B O 1 ATOM 1107 C CB . THR B 2 94 ? -35.138 -6.868 -10.241 1.00 60.05 ? 94 THR B CB 1 ATOM 1108 O OG1 . THR B 2 94 ? -34.502 -7.360 -11.422 1.00 57.84 ? 94 THR B OG1 1 ATOM 1109 C CG2 . THR B 2 94 ? -34.083 -6.508 -9.198 1.00 59.55 ? 94 THR B CG2 1 ATOM 1110 N N . GLY B 2 95 ? -37.758 -8.852 -11.319 1.00 51.70 ? 95 GLY B N 1 ATOM 1111 C CA . GLY B 2 95 ? -38.997 -8.945 -12.087 1.00 51.59 ? 95 GLY B CA 1 ATOM 1112 C C . GLY B 2 95 ? -39.225 -10.298 -12.729 1.00 54.15 ? 95 GLY B C 1 ATOM 1113 O O . GLY B 2 95 ? -38.270 -10.941 -13.172 1.00 52.41 ? 95 GLY B O 1 ATOM 1114 N N . THR B 2 96 ? -40.499 -10.743 -12.773 1.00 51.33 ? 96 THR B N 1 ATOM 1115 C CA . THR B 2 96 ? -40.922 -12.026 -13.355 1.00 50.42 ? 96 THR B CA 1 ATOM 1116 C C . THR B 2 96 ? -42.249 -11.891 -14.106 1.00 54.41 ? 96 THR B C 1 ATOM 1117 O O . THR B 2 96 ? -43.211 -11.347 -13.558 1.00 55.76 ? 96 THR B O 1 ATOM 1118 C CB . THR B 2 96 ? -41.042 -13.128 -12.279 1.00 59.55 ? 96 THR B CB 1 ATOM 1119 O OG1 . THR B 2 96 ? -41.763 -12.636 -11.148 1.00 61.68 ? 96 THR B OG1 1 ATOM 1120 C CG2 . THR B 2 96 ? -39.702 -13.700 -11.855 1.00 57.38 ? 96 THR B CG2 1 ATOM 1121 N N . MET B 2 97 ? -42.296 -12.402 -15.355 1.00 49.43 ? 97 MET B N 1 ATOM 1122 C CA . MET B 2 97 ? -43.476 -12.414 -16.229 1.00 49.83 ? 97 MET B CA 1 ATOM 1123 C C . MET B 2 97 ? -43.264 -13.396 -17.381 1.00 51.86 ? 97 MET B C 1 ATOM 1124 O O . MET B 2 97 ? -42.350 -13.210 -18.191 1.00 50.32 ? 97 MET B O 1 ATOM 1125 C CB . MET B 2 97 ? -43.821 -11.002 -16.755 1.00 53.07 ? 97 MET B CB 1 ATOM 1126 C CG . MET B 2 97 ? -45.205 -10.893 -17.393 1.00 58.38 ? 97 MET B CG 1 ATOM 1127 S SD . MET B 2 97 ? -46.596 -11.338 -16.310 1.00 64.82 ? 97 MET B SD 1 ATOM 1128 C CE . MET B 2 97 ? -46.565 -9.976 -15.154 1.00 63.09 ? 97 MET B CE 1 ATOM 1129 N N . GLY B 2 98 ? -44.108 -14.430 -17.424 1.00 48.39 ? 98 GLY B N 1 ATOM 1130 C CA . GLY B 2 98 ? -44.073 -15.486 -18.430 1.00 47.08 ? 98 GLY B CA 1 ATOM 1131 C C . GLY B 2 98 ? -42.771 -16.259 -18.422 1.00 48.70 ? 98 GLY B C 1 ATOM 1132 O O . GLY B 2 98 ? -42.323 -16.707 -17.364 1.00 48.03 ? 98 GLY B O 1 ATOM 1133 N N . HIS B 2 99 ? -42.132 -16.371 -19.597 1.00 44.07 ? 99 HIS B N 1 ATOM 1134 C CA . HIS B 2 99 ? -40.854 -17.067 -19.770 1.00 42.58 ? 99 HIS B CA 1 ATOM 1135 C C . HIS B 2 99 ? -39.643 -16.244 -19.286 1.00 45.70 ? 99 HIS B C 1 ATOM 1136 O O . HIS B 2 99 ? -38.525 -16.761 -19.298 1.00 44.68 ? 99 HIS B O 1 ATOM 1137 C CB . HIS B 2 99 ? -40.656 -17.453 -21.250 1.00 43.01 ? 99 HIS B CB 1 ATOM 1138 C CG . HIS B 2 99 ? -41.600 -18.502 -21.755 1.00 46.74 ? 99 HIS B CG 1 ATOM 1139 N ND1 . HIS B 2 99 ? -41.560 -19.802 -21.278 1.00 48.21 ? 99 HIS B ND1 1 ATOM 1140 C CD2 . HIS B 2 99 ? -42.540 -18.423 -22.725 1.00 49.20 ? 99 HIS B CD2 1 ATOM 1141 C CE1 . HIS B 2 99 ? -42.492 -20.460 -21.949 1.00 48.06 ? 99 HIS B CE1 1 ATOM 1142 N NE2 . HIS B 2 99 ? -43.107 -19.673 -22.832 1.00 49.06 ? 99 HIS B NE2 1 ATOM 1143 N N . PHE B 2 100 ? -39.858 -15.053 -18.760 1.00 42.49 ? 100 PHE B N 1 ATOM 1144 C CA . PHE B 2 100 ? -38.754 -14.194 -18.386 1.00 41.80 ? 100 PHE B CA 1 ATOM 1145 C C . PHE B 2 100 ? -38.559 -13.852 -16.936 1.00 45.90 ? 100 PHE B C 1 ATOM 1146 O O . PHE B 2 100 ? -39.475 -13.703 -16.200 1.00 46.37 ? 100 PHE B O 1 ATOM 1147 C CB . PHE B 2 100 ? -38.871 -12.915 -19.157 1.00 43.82 ? 100 PHE B CB 1 ATOM 1148 C CG . PHE B 2 100 ? -38.920 -13.112 -20.618 1.00 45.16 ? 100 PHE B CG 1 ATOM 1149 C CD1 . PHE B 2 100 ? -37.785 -13.321 -21.332 1.00 47.71 ? 100 PHE B CD1 1 ATOM 1150 C CD2 . PHE B 2 100 ? -40.093 -13.089 -21.278 1.00 47.91 ? 100 PHE B CD2 1 ATOM 1151 C CE1 . PHE B 2 100 ? -37.839 -13.500 -22.641 1.00 48.82 ? 100 PHE B CE1 1 ATOM 1152 C CE2 . PHE B 2 100 ? -40.119 -13.265 -22.598 1.00 50.88 ? 100 PHE B CE2 1 ATOM 1153 C CZ . PHE B 2 100 ? -39.000 -13.471 -23.267 1.00 48.53 ? 100 PHE B CZ 1 ATOM 1154 N N . ILE B 2 101 ? -37.305 -13.697 -16.570 1.00 42.04 ? 101 ILE B N 1 ATOM 1155 C CA . ILE B 2 101 ? -36.849 -13.377 -15.211 1.00 42.43 ? 101 ILE B CA 1 ATOM 1156 C C . ILE B 2 101 ? -35.767 -12.291 -15.287 1.00 45.95 ? 101 ILE B C 1 ATOM 1157 O O . ILE B 2 101 ? -34.848 -12.391 -16.104 1.00 44.85 ? 101 ILE B O 1 ATOM 1158 C CB . ILE B 2 101 ? -36.298 -14.636 -14.456 1.00 45.79 ? 101 ILE B CB 1 ATOM 1159 C CG1 . ILE B 2 101 ? -37.292 -15.810 -14.461 1.00 46.57 ? 101 ILE B CG1 1 ATOM 1160 C CG2 . ILE B 2 101 ? -35.860 -14.301 -13.015 1.00 47.59 ? 101 ILE B CG2 1 ATOM 1161 C CD1 . ILE B 2 101 ? -36.652 -17.180 -14.582 1.00 53.39 ? 101 ILE B CD1 1 ATOM 1162 N N . LEU B 2 102 ? -35.867 -11.279 -14.411 1.00 43.20 ? 102 LEU B N 1 ATOM 1163 C CA . LEU B 2 102 ? -34.877 -10.214 -14.270 1.00 42.85 ? 102 LEU B CA 1 ATOM 1164 C C . LEU B 2 102 ? -34.142 -10.460 -12.957 1.00 47.47 ? 102 LEU B C 1 ATOM 1165 O O . LEU B 2 102 ? -34.790 -10.627 -11.920 1.00 48.08 ? 102 LEU B O 1 ATOM 1166 C CB . LEU B 2 102 ? -35.529 -8.819 -14.266 1.00 43.47 ? 102 LEU B CB 1 ATOM 1167 C CG . LEU B 2 102 ? -36.195 -8.316 -15.549 1.00 48.03 ? 102 LEU B CG 1 ATOM 1168 C CD1 . LEU B 2 102 ? -36.474 -6.833 -15.444 1.00 48.89 ? 102 LEU B CD1 1 ATOM 1169 C CD2 . LEU B 2 102 ? -35.336 -8.590 -16.782 1.00 49.64 ? 102 LEU B CD2 1 ATOM 1170 N N . ALA B 2 103 ? -32.800 -10.534 -13.000 1.00 43.92 ? 103 ALA B N 1 ATOM 1171 C CA . ALA B 2 103 ? -32.007 -10.806 -11.801 1.00 44.88 ? 103 ALA B CA 1 ATOM 1172 C C . ALA B 2 103 ? -30.673 -10.078 -11.733 1.00 49.15 ? 103 ALA B C 1 ATOM 1173 O O . ALA B 2 103 ? -30.017 -9.875 -12.756 1.00 47.81 ? 103 ALA B O 1 ATOM 1174 C CB . ALA B 2 103 ? -31.786 -12.305 -11.646 1.00 45.94 ? 103 ALA B CB 1 ATOM 1175 N N . ARG B 2 104 ? -30.275 -9.701 -10.505 1.00 47.33 ? 104 ARG B N 1 ATOM 1176 C CA . ARG B 2 104 ? -28.993 -9.074 -10.188 1.00 47.73 ? 104 ARG B CA 1 ATOM 1177 C C . ARG B 2 104 ? -28.168 -10.172 -9.522 1.00 53.02 ? 104 ARG B C 1 ATOM 1178 O O . ARG B 2 104 ? -28.524 -10.643 -8.438 1.00 53.99 ? 104 ARG B O 1 ATOM 1179 C CB . ARG B 2 104 ? -29.173 -7.852 -9.270 1.00 49.26 ? 104 ARG B CB 1 ATOM 1180 C CG . ARG B 2 104 ? -29.767 -6.638 -9.977 1.00 59.44 ? 104 ARG B CG 1 ATOM 1181 C CD . ARG B 2 104 ? -29.556 -5.349 -9.200 1.00 70.50 ? 104 ARG B CD 1 ATOM 1182 N NE . ARG B 2 104 ? -28.162 -4.895 -9.242 1.00 79.43 ? 104 ARG B NE 1 ATOM 1183 C CZ . ARG B 2 104 ? -27.657 -4.093 -10.174 1.00 92.75 ? 104 ARG B CZ 1 ATOM 1184 N NH1 . ARG B 2 104 ? -28.424 -3.644 -11.161 1.00 79.16 ? 104 ARG B NH1 1 ATOM 1185 N NH2 . ARG B 2 104 ? -26.381 -3.736 -10.130 1.00 79.86 ? 104 ARG B NH2 1 ATOM 1186 N N . CYS B 2 105 ? -27.119 -10.637 -10.220 1.00 49.53 ? 105 CYS B N 1 ATOM 1187 C CA . CYS B 2 105 ? -26.281 -11.757 -9.800 1.00 50.77 ? 105 CYS B CA 1 ATOM 1188 C C . CYS B 2 105 ? -24.841 -11.399 -9.437 1.00 55.27 ? 105 CYS B C 1 ATOM 1189 O O . CYS B 2 105 ? -24.230 -10.590 -10.138 1.00 54.14 ? 105 CYS B O 1 ATOM 1190 C CB . CYS B 2 105 ? -26.313 -12.850 -10.864 1.00 50.58 ? 105 CYS B CB 1 ATOM 1191 S SG . CYS B 2 105 ? -27.914 -13.673 -11.038 1.00 53.91 ? 105 CYS B SG 1 ATOM 1192 N N . PRO B 2 106 ? -24.235 -12.075 -8.426 1.00 53.50 ? 106 PRO B N 1 ATOM 1193 C CA . PRO B 2 106 ? -22.809 -11.830 -8.143 1.00 54.61 ? 106 PRO B CA 1 ATOM 1194 C C . PRO B 2 106 ? -21.923 -12.569 -9.158 1.00 58.23 ? 106 PRO B C 1 ATOM 1195 O O . PRO B 2 106 ? -22.447 -13.331 -9.975 1.00 56.76 ? 106 PRO B O 1 ATOM 1196 C CB . PRO B 2 106 ? -22.635 -12.372 -6.722 1.00 58.95 ? 106 PRO B CB 1 ATOM 1197 C CG . PRO B 2 106 ? -23.663 -13.437 -6.593 1.00 63.44 ? 106 PRO B CG 1 ATOM 1198 C CD . PRO B 2 106 ? -24.798 -13.105 -7.523 1.00 56.45 ? 106 PRO B CD 1 ATOM 1199 N N . LYS B 2 107 ? -20.590 -12.341 -9.114 1.00 56.03 ? 107 LYS B N 1 ATOM 1200 C CA . LYS B 2 107 ? -19.600 -12.969 -10.006 1.00 56.47 ? 107 LYS B CA 1 ATOM 1201 C C . LYS B 2 107 ? -19.708 -14.500 -9.985 1.00 61.43 ? 107 LYS B C 1 ATOM 1202 O O . LYS B 2 107 ? -19.758 -15.093 -8.907 1.00 62.87 ? 107 LYS B O 1 ATOM 1203 C CB . LYS B 2 107 ? -18.177 -12.550 -9.607 1.00 61.04 ? 107 LYS B CB 1 ATOM 1204 C CG . LYS B 2 107 ? -17.592 -11.409 -10.419 1.00 74.16 ? 107 LYS B CG 1 ATOM 1205 C CD . LYS B 2 107 ? -16.269 -10.905 -9.823 1.00 86.01 ? 107 LYS B CD 1 ATOM 1206 C CE . LYS B 2 107 ? -15.028 -11.578 -10.372 1.00 97.88 ? 107 LYS B CE 1 ATOM 1207 N NZ . LYS B 2 107 ? -14.825 -12.943 -9.824 1.00 108.34 ? 107 LYS B NZ 1 ATOM 1208 N N . GLY B 2 108 ? -19.766 -15.113 -11.167 1.00 56.94 ? 108 GLY B N 1 ATOM 1209 C CA . GLY B 2 108 ? -19.886 -16.561 -11.308 1.00 57.62 ? 108 GLY B CA 1 ATOM 1210 C C . GLY B 2 108 ? -19.476 -17.120 -12.656 1.00 61.05 ? 108 GLY B C 1 ATOM 1211 O O . GLY B 2 108 ? -19.167 -16.366 -13.585 1.00 59.63 ? 108 GLY B O 1 ATOM 1212 N N . GLU B 2 109 ? -19.477 -18.462 -12.763 1.00 58.60 ? 109 GLU B N 1 ATOM 1213 C CA . GLU B 2 109 ? -19.113 -19.196 -13.980 1.00 58.69 ? 109 GLU B CA 1 ATOM 1214 C C . GLU B 2 109 ? -20.264 -20.065 -14.514 1.00 60.84 ? 109 GLU B C 1 ATOM 1215 O O . GLU B 2 109 ? -20.179 -20.576 -15.633 1.00 60.30 ? 109 GLU B O 1 ATOM 1216 C CB . GLU B 2 109 ? -17.834 -20.028 -13.763 1.00 63.42 ? 109 GLU B CB 1 ATOM 1217 C CG . GLU B 2 109 ? -16.578 -19.204 -13.506 1.00 75.88 ? 109 GLU B CG 1 ATOM 1218 C CD . GLU B 2 109 ? -16.130 -18.268 -14.615 1.00 96.42 ? 109 GLU B CD 1 ATOM 1219 O OE1 . GLU B 2 109 ? -16.115 -18.694 -15.793 1.00 90.89 ? 109 GLU B OE1 1 ATOM 1220 O OE2 . GLU B 2 109 ? -15.766 -17.113 -14.298 1.00 90.78 ? 109 GLU B OE2 1 ATOM 1221 N N . THR B 2 110 ? -21.345 -20.204 -13.722 1.00 56.32 ? 110 THR B N 1 ATOM 1222 C CA . THR B 2 110 ? -22.556 -20.961 -14.068 1.00 54.82 ? 110 THR B CA 1 ATOM 1223 C C . THR B 2 110 ? -23.804 -20.148 -13.704 1.00 56.44 ? 110 THR B C 1 ATOM 1224 O O . THR B 2 110 ? -23.708 -19.204 -12.919 1.00 55.95 ? 110 THR B O 1 ATOM 1225 C CB . THR B 2 110 ? -22.585 -22.330 -13.352 1.00 65.01 ? 110 THR B CB 1 ATOM 1226 O OG1 . THR B 2 110 ? -22.426 -22.143 -11.944 1.00 66.37 ? 110 THR B OG1 1 ATOM 1227 C CG2 . THR B 2 110 ? -21.546 -23.312 -13.887 1.00 65.72 ? 110 THR B CG2 1 ATOM 1228 N N . LEU B 2 111 ? -24.968 -20.510 -14.275 1.00 51.43 ? 111 LEU B N 1 ATOM 1229 C CA . LEU B 2 111 ? -26.247 -19.862 -13.977 1.00 49.64 ? 111 LEU B CA 1 ATOM 1230 C C . LEU B 2 111 ? -27.310 -20.935 -13.756 1.00 53.51 ? 111 LEU B C 1 ATOM 1231 O O . LEU B 2 111 ? -27.555 -21.756 -14.643 1.00 52.72 ? 111 LEU B O 1 ATOM 1232 C CB . LEU B 2 111 ? -26.665 -18.863 -15.075 1.00 47.81 ? 111 LEU B CB 1 ATOM 1233 C CG . LEU B 2 111 ? -27.703 -17.813 -14.657 1.00 51.32 ? 111 LEU B CG 1 ATOM 1234 C CD1 . LEU B 2 111 ? -27.313 -16.433 -15.141 1.00 50.80 ? 111 LEU B CD1 1 ATOM 1235 C CD2 . LEU B 2 111 ? -29.095 -18.175 -15.150 1.00 52.66 ? 111 LEU B CD2 1 ATOM 1236 N N . THR B 2 112 ? -27.915 -20.938 -12.557 1.00 50.83 ? 112 THR B N 1 ATOM 1237 C CA . THR B 2 112 ? -28.939 -21.900 -12.154 1.00 51.08 ? 112 THR B CA 1 ATOM 1238 C C . THR B 2 112 ? -30.276 -21.209 -11.891 1.00 54.06 ? 112 THR B C 1 ATOM 1239 O O . THR B 2 112 ? -30.323 -20.203 -11.183 1.00 53.73 ? 112 THR B O 1 ATOM 1240 C CB . THR B 2 112 ? -28.452 -22.721 -10.939 1.00 61.45 ? 112 THR B CB 1 ATOM 1241 O OG1 . THR B 2 112 ? -27.186 -23.306 -11.240 1.00 62.16 ? 112 THR B OG1 1 ATOM 1242 C CG2 . THR B 2 112 ? -29.439 -23.814 -10.516 1.00 60.84 ? 112 THR B CG2 1 ATOM 1243 N N . VAL B 2 113 ? -31.356 -21.758 -12.471 1.00 50.01 ? 113 VAL B N 1 ATOM 1244 C CA . VAL B 2 113 ? -32.733 -21.294 -12.289 1.00 49.37 ? 113 VAL B CA 1 ATOM 1245 C C . VAL B 2 113 ? -33.557 -22.519 -11.875 1.00 54.74 ? 113 VAL B C 1 ATOM 1246 O O . VAL B 2 113 ? -33.555 -23.533 -12.580 1.00 54.10 ? 113 VAL B O 1 ATOM 1247 C CB . VAL B 2 113 ? -33.308 -20.554 -13.534 1.00 51.38 ? 113 VAL B CB 1 ATOM 1248 C CG1 . VAL B 2 113 ? -34.811 -20.311 -13.401 1.00 50.97 ? 113 VAL B CG1 1 ATOM 1249 C CG2 . VAL B 2 113 ? -32.580 -19.232 -13.773 1.00 50.58 ? 113 VAL B CG2 1 ATOM 1250 N N . GLY B 2 114 ? -34.208 -22.424 -10.720 1.00 53.05 ? 114 GLY B N 1 ATOM 1251 C CA . GLY B 2 114 ? -35.012 -23.512 -10.178 1.00 54.39 ? 114 GLY B CA 1 ATOM 1252 C C . GLY B 2 114 ? -36.315 -23.102 -9.526 1.00 59.50 ? 114 GLY B C 1 ATOM 1253 O O . GLY B 2 114 ? -36.606 -21.909 -9.404 1.00 58.67 ? 114 GLY B O 1 ATOM 1254 N N . PHE B 2 115 ? -37.108 -24.110 -9.101 1.00 57.80 ? 115 PHE B N 1 ATOM 1255 C CA . PHE B 2 115 ? -38.412 -23.953 -8.444 1.00 59.04 ? 115 PHE B CA 1 ATOM 1256 C C . PHE B 2 115 ? -38.828 -25.227 -7.682 1.00 65.54 ? 115 PHE B C 1 ATOM 1257 O O . PHE B 2 115 ? -38.222 -26.287 -7.863 1.00 65.33 ? 115 PHE B O 1 ATOM 1258 C CB . PHE B 2 115 ? -39.500 -23.546 -9.471 1.00 59.18 ? 115 PHE B CB 1 ATOM 1259 C CG . PHE B 2 115 ? -40.071 -24.669 -10.309 1.00 60.12 ? 115 PHE B CG 1 ATOM 1260 C CD1 . PHE B 2 115 ? -41.342 -25.172 -10.054 1.00 64.32 ? 115 PHE B CD1 1 ATOM 1261 C CD2 . PHE B 2 115 ? -39.337 -25.226 -11.351 1.00 60.78 ? 115 PHE B CD2 1 ATOM 1262 C CE1 . PHE B 2 115 ? -41.867 -26.213 -10.824 1.00 64.69 ? 115 PHE B CE1 1 ATOM 1263 C CE2 . PHE B 2 115 ? -39.866 -26.264 -12.124 1.00 63.14 ? 115 PHE B CE2 1 ATOM 1264 C CZ . PHE B 2 115 ? -41.126 -26.751 -11.854 1.00 62.19 ? 115 PHE B CZ 1 ATOM 1265 N N . THR B 2 116 ? -39.883 -25.114 -6.853 1.00 64.27 ? 116 THR B N 1 ATOM 1266 C CA . THR B 2 116 ? -40.465 -26.208 -6.073 1.00 66.67 ? 116 THR B CA 1 ATOM 1267 C C . THR B 2 116 ? -41.889 -26.461 -6.595 1.00 70.39 ? 116 THR B C 1 ATOM 1268 O O . THR B 2 116 ? -42.688 -25.525 -6.671 1.00 69.79 ? 116 THR B O 1 ATOM 1269 C CB . THR B 2 116 ? -40.391 -25.883 -4.567 1.00 78.01 ? 116 THR B CB 1 ATOM 1270 O OG1 . THR B 2 116 ? -39.022 -25.716 -4.198 1.00 77.75 ? 116 THR B OG1 1 ATOM 1271 C CG2 . THR B 2 116 ? -41.018 -26.961 -3.692 1.00 80.02 ? 116 THR B CG2 1 ATOM 1272 N N . ASP B 2 117 ? -42.193 -27.718 -6.971 1.00 67.19 ? 117 ASP B N 1 ATOM 1273 C CA . ASP B 2 117 ? -43.503 -28.102 -7.506 1.00 66.83 ? 117 ASP B CA 1 ATOM 1274 C C . ASP B 2 117 ? -44.566 -28.391 -6.420 1.00 73.82 ? 117 ASP B C 1 ATOM 1275 O O . ASP B 2 117 ? -44.432 -27.913 -5.291 1.00 75.61 ? 117 ASP B O 1 ATOM 1276 C CB . ASP B 2 117 ? -43.373 -29.235 -8.555 1.00 67.18 ? 117 ASP B CB 1 ATOM 1277 C CG . ASP B 2 117 ? -42.892 -30.589 -8.053 1.00 79.12 ? 117 ASP B CG 1 ATOM 1278 O OD1 . ASP B 2 117 ? -43.494 -31.119 -7.094 1.00 82.20 ? 117 ASP B OD1 1 ATOM 1279 O OD2 . ASP B 2 117 ? -42.000 -31.174 -8.696 1.00 84.02 ? 117 ASP B OD2 1 ATOM 1280 N N . SER B 2 118 ? -45.622 -29.155 -6.773 1.00 70.78 ? 118 SER B N 1 ATOM 1281 C CA . SER B 2 118 ? -46.718 -29.532 -5.876 1.00 73.71 ? 118 SER B CA 1 ATOM 1282 C C . SER B 2 118 ? -46.251 -30.530 -4.805 1.00 80.20 ? 118 SER B C 1 ATOM 1283 O O . SER B 2 118 ? -46.461 -30.286 -3.616 1.00 82.82 ? 118 SER B O 1 ATOM 1284 C CB . SER B 2 118 ? -47.884 -30.114 -6.672 1.00 76.86 ? 118 SER B CB 1 ATOM 1285 O OG . SER B 2 118 ? -48.286 -29.253 -7.726 1.00 83.49 ? 118 SER B OG 1 ATOM 1286 N N . ARG B 2 119 ? -45.594 -31.634 -5.231 1.00 75.81 ? 119 ARG B N 1 ATOM 1287 C CA . ARG B 2 119 ? -45.067 -32.706 -4.375 1.00 78.18 ? 119 ARG B CA 1 ATOM 1288 C C . ARG B 2 119 ? -43.657 -32.402 -3.809 1.00 82.44 ? 119 ARG B C 1 ATOM 1289 O O . ARG B 2 119 ? -42.891 -33.332 -3.539 1.00 83.27 ? 119 ARG B O 1 ATOM 1290 C CB . ARG B 2 119 ? -45.064 -34.046 -5.137 1.00 77.59 ? 119 ARG B CB 1 ATOM 1291 C CG . ARG B 2 119 ? -46.441 -34.586 -5.503 1.00 88.50 ? 119 ARG B CG 1 ATOM 1292 C CD . ARG B 2 119 ? -46.349 -35.952 -6.157 1.00 97.84 ? 119 ARG B CD 1 ATOM 1293 N NE . ARG B 2 119 ? -45.798 -35.889 -7.513 1.00 102.51 ? 119 ARG B NE 1 ATOM 1294 C CZ . ARG B 2 119 ? -45.564 -36.950 -8.280 1.00 115.37 ? 119 ARG B CZ 1 ATOM 1295 N NH1 . ARG B 2 119 ? -45.829 -38.172 -7.834 1.00 104.95 ? 119 ARG B NH1 1 ATOM 1296 N NH2 . ARG B 2 119 ? -45.063 -36.797 -9.498 1.00 98.77 ? 119 ARG B NH2 1 ATOM 1297 N N . LYS B 2 120 ? -43.319 -31.104 -3.645 1.00 78.10 ? 120 LYS B N 1 ATOM 1298 C CA . LYS B 2 120 ? -42.057 -30.572 -3.096 1.00 78.37 ? 120 LYS B CA 1 ATOM 1299 C C . LYS B 2 120 ? -40.720 -30.986 -3.772 1.00 80.26 ? 120 LYS B C 1 ATOM 1300 O O . LYS B 2 120 ? -39.657 -30.750 -3.191 1.00 81.01 ? 120 LYS B O 1 ATOM 1301 C CB . LYS B 2 120 ? -41.993 -30.757 -1.555 1.00 85.30 ? 120 LYS B CB 1 ATOM 1302 C CG . LYS B 2 120 ? -43.236 -30.287 -0.787 1.00 101.44 ? 120 LYS B CG 1 ATOM 1303 C CD . LYS B 2 120 ? -43.262 -28.777 -0.524 1.00 110.75 ? 120 LYS B CD 1 ATOM 1304 C CE . LYS B 2 120 ? -44.623 -28.292 -0.079 1.00 123.10 ? 120 LYS B CE 1 ATOM 1305 N NZ . LYS B 2 120 ? -44.936 -28.681 1.324 1.00 136.78 ? 120 LYS B NZ 1 ATOM 1306 N N . ILE B 2 121 ? -40.764 -31.575 -4.982 1.00 74.09 ? 121 ILE B N 1 ATOM 1307 C CA . ILE B 2 121 ? -39.578 -32.016 -5.732 1.00 72.32 ? 121 ILE B CA 1 ATOM 1308 C C . ILE B 2 121 ? -38.915 -30.800 -6.417 1.00 73.22 ? 121 ILE B C 1 ATOM 1309 O O . ILE B 2 121 ? -39.494 -30.231 -7.344 1.00 70.24 ? 121 ILE B O 1 ATOM 1310 C CB . ILE B 2 121 ? -39.986 -33.145 -6.736 1.00 74.19 ? 121 ILE B CB 1 ATOM 1311 C CG1 . ILE B 2 121 ? -40.713 -34.342 -6.048 1.00 77.38 ? 121 ILE B CG1 1 ATOM 1312 C CG2 . ILE B 2 121 ? -38.834 -33.595 -7.648 1.00 73.51 ? 121 ILE B CG2 1 ATOM 1313 C CD1 . ILE B 2 121 ? -39.891 -35.232 -5.018 1.00 88.18 ? 121 ILE B CD1 1 ATOM 1314 N N . SER B 2 122 ? -37.715 -30.401 -5.956 1.00 70.38 ? 122 SER B N 1 ATOM 1315 C CA . SER B 2 122 ? -36.994 -29.251 -6.510 1.00 67.94 ? 122 SER B CA 1 ATOM 1316 C C . SER B 2 122 ? -36.401 -29.538 -7.892 1.00 68.87 ? 122 SER B C 1 ATOM 1317 O O . SER B 2 122 ? -35.624 -30.483 -8.049 1.00 69.26 ? 122 SER B O 1 ATOM 1318 C CB . SER B 2 122 ? -35.912 -28.774 -5.545 1.00 73.58 ? 122 SER B CB 1 ATOM 1319 O OG . SER B 2 122 ? -34.985 -29.808 -5.256 1.00 84.75 ? 122 SER B OG 1 ATOM 1320 N N . HIS B 2 123 ? -36.790 -28.728 -8.894 1.00 62.34 ? 123 HIS B N 1 ATOM 1321 C CA . HIS B 2 123 ? -36.306 -28.837 -10.272 1.00 59.78 ? 123 HIS B CA 1 ATOM 1322 C C . HIS B 2 123 ? -35.431 -27.629 -10.585 1.00 61.62 ? 123 HIS B C 1 ATOM 1323 O O . HIS B 2 123 ? -35.882 -26.498 -10.415 1.00 60.45 ? 123 HIS B O 1 ATOM 1324 C CB . HIS B 2 123 ? -37.475 -28.907 -11.271 1.00 58.84 ? 123 HIS B CB 1 ATOM 1325 C CG . HIS B 2 123 ? -38.388 -30.073 -11.075 1.00 63.30 ? 123 HIS B CG 1 ATOM 1326 N ND1 . HIS B 2 123 ? -38.025 -31.348 -11.469 1.00 65.56 ? 123 HIS B ND1 1 ATOM 1327 C CD2 . HIS B 2 123 ? -39.637 -30.113 -10.559 1.00 65.86 ? 123 HIS B CD2 1 ATOM 1328 C CE1 . HIS B 2 123 ? -39.053 -32.123 -11.163 1.00 65.94 ? 123 HIS B CE1 1 ATOM 1329 N NE2 . HIS B 2 123 ? -40.047 -31.424 -10.615 1.00 66.54 ? 123 HIS B NE2 1 ATOM 1330 N N . SER B 2 124 ? -34.186 -27.866 -11.031 1.00 57.61 ? 124 SER B N 1 ATOM 1331 C CA . SER B 2 124 ? -33.234 -26.804 -11.371 1.00 56.23 ? 124 SER B CA 1 ATOM 1332 C C . SER B 2 124 ? -32.520 -27.076 -12.697 1.00 58.26 ? 124 SER B C 1 ATOM 1333 O O . SER B 2 124 ? -32.425 -28.230 -13.117 1.00 58.37 ? 124 SER B O 1 ATOM 1334 C CB . SER B 2 124 ? -32.218 -26.616 -10.248 1.00 61.85 ? 124 SER B CB 1 ATOM 1335 O OG . SER B 2 124 ? -31.437 -27.783 -10.050 1.00 72.43 ? 124 SER B OG 1 ATOM 1336 N N . CYS B 2 125 ? -32.025 -26.010 -13.355 1.00 52.95 ? 125 CYS B N 1 ATOM 1337 C CA . CYS B 2 125 ? -31.294 -26.106 -14.619 1.00 51.79 ? 125 CYS B CA 1 ATOM 1338 C C . CYS B 2 125 ? -30.040 -25.238 -14.581 1.00 55.58 ? 125 CYS B C 1 ATOM 1339 O O . CYS B 2 125 ? -30.140 -24.017 -14.447 1.00 54.17 ? 125 CYS B O 1 ATOM 1340 C CB . CYS B 2 125 ? -32.189 -25.763 -15.808 1.00 50.13 ? 125 CYS B CB 1 ATOM 1341 S SG . CYS B 2 125 ? -31.415 -26.029 -17.427 1.00 53.61 ? 125 CYS B SG 1 ATOM 1342 N N . THR B 2 126 ? -28.861 -25.877 -14.681 1.00 53.50 ? 126 THR B N 1 ATOM 1343 C CA . THR B 2 126 ? -27.560 -25.207 -14.646 1.00 53.97 ? 126 THR B CA 1 ATOM 1344 C C . THR B 2 126 ? -26.922 -25.164 -16.038 1.00 57.16 ? 126 THR B C 1 ATOM 1345 O O . THR B 2 126 ? -26.793 -26.198 -16.698 1.00 57.40 ? 126 THR B O 1 ATOM 1346 C CB . THR B 2 126 ? -26.654 -25.841 -13.569 1.00 64.69 ? 126 THR B CB 1 ATOM 1347 O OG1 . THR B 2 126 ? -27.345 -25.843 -12.318 1.00 64.82 ? 126 THR B OG1 1 ATOM 1348 C CG2 . THR B 2 126 ? -25.314 -25.120 -13.415 1.00 64.31 ? 126 THR B CG2 1 ATOM 1349 N N . HIS B 2 127 ? -26.527 -23.956 -16.468 1.00 52.69 ? 127 HIS B N 1 ATOM 1350 C CA . HIS B 2 127 ? -25.875 -23.685 -17.749 1.00 52.39 ? 127 HIS B CA 1 ATOM 1351 C C . HIS B 2 127 ? -24.548 -22.961 -17.510 1.00 57.33 ? 127 HIS B C 1 ATOM 1352 O O . HIS B 2 127 ? -24.501 -22.083 -16.642 1.00 56.51 ? 127 HIS B O 1 ATOM 1353 C CB . HIS B 2 127 ? -26.775 -22.805 -18.631 1.00 51.10 ? 127 HIS B CB 1 ATOM 1354 C CG . HIS B 2 127 ? -27.708 -23.566 -19.518 1.00 53.87 ? 127 HIS B CG 1 ATOM 1355 N ND1 . HIS B 2 127 ? -27.638 -23.457 -20.895 1.00 55.49 ? 127 HIS B ND1 1 ATOM 1356 C CD2 . HIS B 2 127 ? -28.712 -24.415 -19.198 1.00 55.32 ? 127 HIS B CD2 1 ATOM 1357 C CE1 . HIS B 2 127 ? -28.594 -24.240 -21.366 1.00 54.49 ? 127 HIS B CE1 1 ATOM 1358 N NE2 . HIS B 2 127 ? -29.270 -24.833 -20.383 1.00 54.63 ? 127 HIS B NE2 1 ATOM 1359 N N . PRO B 2 128 ? -23.464 -23.275 -18.264 1.00 55.48 ? 128 PRO B N 1 ATOM 1360 C CA . PRO B 2 128 ? -22.208 -22.534 -18.059 1.00 56.57 ? 128 PRO B CA 1 ATOM 1361 C C . PRO B 2 128 ? -22.323 -21.116 -18.619 1.00 58.88 ? 128 PRO B C 1 ATOM 1362 O O . PRO B 2 128 ? -22.568 -20.935 -19.814 1.00 57.86 ? 128 PRO B O 1 ATOM 1363 C CB . PRO B 2 128 ? -21.153 -23.390 -18.768 1.00 60.72 ? 128 PRO B CB 1 ATOM 1364 C CG . PRO B 2 128 ? -21.899 -24.210 -19.747 1.00 64.58 ? 128 PRO B CG 1 ATOM 1365 C CD . PRO B 2 128 ? -23.344 -24.272 -19.349 1.00 57.90 ? 128 PRO B CD 1 ATOM 1366 N N . PHE B 2 129 ? -22.229 -20.113 -17.731 1.00 54.89 ? 129 PHE B N 1 ATOM 1367 C CA . PHE B 2 129 ? -22.353 -18.704 -18.092 1.00 53.33 ? 129 PHE B CA 1 ATOM 1368 C C . PHE B 2 129 ? -21.390 -17.840 -17.284 1.00 57.97 ? 129 PHE B C 1 ATOM 1369 O O . PHE B 2 129 ? -21.519 -17.744 -16.062 1.00 57.69 ? 129 PHE B O 1 ATOM 1370 C CB . PHE B 2 129 ? -23.814 -18.227 -17.932 1.00 52.99 ? 129 PHE B CB 1 ATOM 1371 C CG . PHE B 2 129 ? -24.057 -16.765 -18.233 1.00 53.31 ? 129 PHE B CG 1 ATOM 1372 C CD1 . PHE B 2 129 ? -24.169 -16.317 -19.544 1.00 56.02 ? 129 PHE B CD1 1 ATOM 1373 C CD2 . PHE B 2 129 ? -24.197 -15.841 -17.204 1.00 54.97 ? 129 PHE B CD2 1 ATOM 1374 C CE1 . PHE B 2 129 ? -24.395 -14.966 -19.821 1.00 56.08 ? 129 PHE B CE1 1 ATOM 1375 C CE2 . PHE B 2 129 ? -24.422 -14.490 -17.482 1.00 56.84 ? 129 PHE B CE2 1 ATOM 1376 C CZ . PHE B 2 129 ? -24.519 -14.062 -18.788 1.00 54.56 ? 129 PHE B CZ 1 ATOM 1377 N N . HIS B 2 130 ? -20.436 -17.200 -17.976 1.00 55.28 ? 130 HIS B N 1 ATOM 1378 C CA . HIS B 2 130 ? -19.456 -16.322 -17.347 1.00 56.05 ? 130 HIS B CA 1 ATOM 1379 C C . HIS B 2 130 ? -20.104 -14.977 -17.013 1.00 58.14 ? 130 HIS B C 1 ATOM 1380 O O . HIS B 2 130 ? -20.419 -14.196 -17.916 1.00 56.60 ? 130 HIS B O 1 ATOM 1381 C CB . HIS B 2 130 ? -18.211 -16.156 -18.239 1.00 58.58 ? 130 HIS B CB 1 ATOM 1382 C CG . HIS B 2 130 ? -17.192 -15.212 -17.684 1.00 62.98 ? 130 HIS B CG 1 ATOM 1383 N ND1 . HIS B 2 130 ? -16.315 -15.600 -16.688 1.00 66.82 ? 130 HIS B ND1 1 ATOM 1384 C CD2 . HIS B 2 130 ? -16.949 -13.919 -18.001 1.00 64.07 ? 130 HIS B CD2 1 ATOM 1385 C CE1 . HIS B 2 130 ? -15.569 -14.538 -16.433 1.00 66.72 ? 130 HIS B CE1 1 ATOM 1386 N NE2 . HIS B 2 130 ? -15.913 -13.503 -17.200 1.00 65.38 ? 130 HIS B NE2 1 ATOM 1387 N N . HIS B 2 131 ? -20.333 -14.733 -15.712 1.00 54.66 ? 131 HIS B N 1 ATOM 1388 C CA . HIS B 2 131 ? -20.934 -13.495 -15.227 1.00 53.03 ? 131 HIS B CA 1 ATOM 1389 C C . HIS B 2 131 ? -19.961 -12.709 -14.356 1.00 57.85 ? 131 HIS B C 1 ATOM 1390 O O . HIS B 2 131 ? -19.541 -13.166 -13.292 1.00 58.91 ? 131 HIS B O 1 ATOM 1391 C CB . HIS B 2 131 ? -22.280 -13.747 -14.520 1.00 52.71 ? 131 HIS B CB 1 ATOM 1392 C CG . HIS B 2 131 ? -22.979 -12.496 -14.080 1.00 54.91 ? 131 HIS B CG 1 ATOM 1393 N ND1 . HIS B 2 131 ? -23.587 -11.648 -14.989 1.00 55.24 ? 131 HIS B ND1 1 ATOM 1394 C CD2 . HIS B 2 131 ? -23.151 -11.995 -12.835 1.00 57.03 ? 131 HIS B CD2 1 ATOM 1395 C CE1 . HIS B 2 131 ? -24.099 -10.660 -14.273 1.00 54.16 ? 131 HIS B CE1 1 ATOM 1396 N NE2 . HIS B 2 131 ? -23.867 -10.829 -12.972 1.00 55.54 ? 131 HIS B NE2 1 ATOM 1397 N N . ASP B 2 132 ? -19.577 -11.538 -14.862 1.00 53.81 ? 132 ASP B N 1 ATOM 1398 C CA . ASP B 2 132 ? -18.686 -10.570 -14.239 1.00 54.43 ? 132 ASP B CA 1 ATOM 1399 C C . ASP B 2 132 ? -19.047 -9.233 -14.909 1.00 56.49 ? 132 ASP B C 1 ATOM 1400 O O . ASP B 2 132 ? -18.434 -8.867 -15.918 1.00 56.43 ? 132 ASP B O 1 ATOM 1401 C CB . ASP B 2 132 ? -17.204 -10.964 -14.459 1.00 58.55 ? 132 ASP B CB 1 ATOM 1402 C CG . ASP B 2 132 ? -16.179 -10.279 -13.567 1.00 69.82 ? 132 ASP B CG 1 ATOM 1403 O OD1 . ASP B 2 132 ? -16.552 -9.329 -12.845 1.00 69.38 ? 132 ASP B OD1 1 ATOM 1404 O OD2 . ASP B 2 132 ? -14.999 -10.680 -13.608 1.00 77.92 ? 132 ASP B OD2 1 ATOM 1405 N N . PRO B 2 133 ? -20.121 -8.551 -14.430 1.00 51.36 ? 133 PRO B N 1 ATOM 1406 C CA . PRO B 2 133 ? -20.545 -7.298 -15.083 1.00 49.91 ? 133 PRO B CA 1 ATOM 1407 C C . PRO B 2 133 ? -19.515 -6.166 -15.010 1.00 54.17 ? 133 PRO B C 1 ATOM 1408 O O . PRO B 2 133 ? -18.895 -5.988 -13.958 1.00 54.63 ? 133 PRO B O 1 ATOM 1409 C CB . PRO B 2 133 ? -21.855 -6.947 -14.372 1.00 50.60 ? 133 PRO B CB 1 ATOM 1410 C CG . PRO B 2 133 ? -21.768 -7.623 -13.056 1.00 56.00 ? 133 PRO B CG 1 ATOM 1411 C CD . PRO B 2 133 ? -20.989 -8.878 -13.278 1.00 52.65 ? 133 PRO B CD 1 ATOM 1412 N N . PRO B 2 134 ? -19.295 -5.412 -16.118 1.00 50.32 ? 134 PRO B N 1 ATOM 1413 C CA . PRO B 2 134 ? -18.296 -4.327 -16.084 1.00 50.74 ? 134 PRO B CA 1 ATOM 1414 C C . PRO B 2 134 ? -18.655 -3.186 -15.138 1.00 53.20 ? 134 PRO B C 1 ATOM 1415 O O . PRO B 2 134 ? -19.835 -2.925 -14.896 1.00 51.53 ? 134 PRO B O 1 ATOM 1416 C CB . PRO B 2 134 ? -18.226 -3.858 -17.540 1.00 52.57 ? 134 PRO B CB 1 ATOM 1417 C CG . PRO B 2 134 ? -19.536 -4.230 -18.121 1.00 55.89 ? 134 PRO B CG 1 ATOM 1418 C CD . PRO B 2 134 ? -19.935 -5.509 -17.447 1.00 51.22 ? 134 PRO B CD 1 ATOM 1419 N N . VAL B 2 135 ? -17.623 -2.522 -14.597 1.00 50.31 ? 135 VAL B N 1 ATOM 1420 C CA . VAL B 2 135 ? -17.758 -1.411 -13.656 1.00 49.79 ? 135 VAL B CA 1 ATOM 1421 C C . VAL B 2 135 ? -18.308 -0.139 -14.328 1.00 52.22 ? 135 VAL B C 1 ATOM 1422 O O . VAL B 2 135 ? -17.861 0.230 -15.416 1.00 51.91 ? 135 VAL B O 1 ATOM 1423 C CB . VAL B 2 135 ? -16.456 -1.183 -12.825 1.00 55.34 ? 135 VAL B CB 1 ATOM 1424 C CG1 . VAL B 2 135 ? -15.263 -0.800 -13.703 1.00 56.19 ? 135 VAL B CG1 1 ATOM 1425 C CG2 . VAL B 2 135 ? -16.664 -0.169 -11.703 1.00 55.20 ? 135 VAL B CG2 1 ATOM 1426 N N . ILE B 2 136 ? -19.309 0.493 -13.688 1.00 47.81 ? 136 ILE B N 1 ATOM 1427 C CA . ILE B 2 136 ? -19.926 1.734 -14.152 1.00 46.98 ? 136 ILE B CA 1 ATOM 1428 C C . ILE B 2 136 ? -19.211 2.888 -13.448 1.00 51.06 ? 136 ILE B C 1 ATOM 1429 O O . ILE B 2 136 ? -19.245 2.991 -12.219 1.00 51.07 ? 136 ILE B O 1 ATOM 1430 C CB . ILE B 2 136 ? -21.484 1.712 -13.985 1.00 49.35 ? 136 ILE B CB 1 ATOM 1431 C CG1 . ILE B 2 136 ? -22.167 0.857 -15.089 1.00 49.21 ? 136 ILE B CG1 1 ATOM 1432 C CG2 . ILE B 2 136 ? -22.113 3.115 -13.891 1.00 50.12 ? 136 ILE B CG2 1 ATOM 1433 C CD1 . ILE B 2 136 ? -22.092 1.406 -16.585 1.00 57.38 ? 136 ILE B CD1 1 ATOM 1434 N N . GLY B 2 137 ? -18.509 3.691 -14.239 1.00 47.57 ? 137 GLY B N 1 ATOM 1435 C CA . GLY B 2 137 ? -17.731 4.820 -13.749 1.00 47.90 ? 137 GLY B CA 1 ATOM 1436 C C . GLY B 2 137 ? -16.265 4.492 -13.570 1.00 52.34 ? 137 GLY B C 1 ATOM 1437 O O . GLY B 2 137 ? -15.685 3.769 -14.385 1.00 52.28 ? 137 GLY B O 1 ATOM 1438 N N . ARG B 2 138 ? -15.660 5.020 -12.493 1.00 49.32 ? 138 ARG B N 1 ATOM 1439 C CA . ARG B 2 138 ? -14.241 4.832 -12.177 1.00 50.45 ? 138 ARG B CA 1 ATOM 1440 C C . ARG B 2 138 ? -13.992 4.278 -10.759 1.00 55.05 ? 138 ARG B C 1 ATOM 1441 O O . ARG B 2 138 ? -12.849 4.279 -10.293 1.00 56.09 ? 138 ARG B O 1 ATOM 1442 C CB . ARG B 2 138 ? -13.479 6.151 -12.395 1.00 51.07 ? 138 ARG B CB 1 ATOM 1443 C CG . ARG B 2 138 ? -13.241 6.496 -13.863 1.00 60.12 ? 138 ARG B CG 1 ATOM 1444 C CD . ARG B 2 138 ? -12.802 7.939 -14.055 1.00 68.42 ? 138 ARG B CD 1 ATOM 1445 N NE . ARG B 2 138 ? -11.588 8.258 -13.298 1.00 76.74 ? 138 ARG B NE 1 ATOM 1446 C CZ . ARG B 2 138 ? -10.351 8.130 -13.766 1.00 91.48 ? 138 ARG B CZ 1 ATOM 1447 N NH1 . ARG B 2 138 ? -10.142 7.695 -15.003 1.00 78.76 ? 138 ARG B NH1 1 ATOM 1448 N NH2 . ARG B 2 138 ? -9.312 8.439 -13.002 1.00 79.31 ? 138 ARG B NH2 1 ATOM 1449 N N . GLU B 2 139 ? -15.052 3.792 -10.084 1.00 51.00 ? 139 GLU B N 1 ATOM 1450 C CA . GLU B 2 139 ? -14.958 3.242 -8.729 1.00 52.03 ? 139 GLU B CA 1 ATOM 1451 C C . GLU B 2 139 ? -15.708 1.917 -8.598 1.00 55.60 ? 139 GLU B C 1 ATOM 1452 O O . GLU B 2 139 ? -16.880 1.836 -8.973 1.00 53.69 ? 139 GLU B O 1 ATOM 1453 C CB . GLU B 2 139 ? -15.466 4.258 -7.691 1.00 53.65 ? 139 GLU B CB 1 ATOM 1454 C CG . GLU B 2 139 ? -14.494 5.389 -7.398 1.00 65.09 ? 139 GLU B CG 1 ATOM 1455 C CD . GLU B 2 139 ? -15.055 6.501 -6.532 1.00 85.64 ? 139 GLU B CD 1 ATOM 1456 O OE1 . GLU B 2 139 ? -15.413 6.227 -5.364 1.00 81.14 ? 139 GLU B OE1 1 ATOM 1457 O OE2 . GLU B 2 139 ? -15.113 7.655 -7.014 1.00 78.95 ? 139 GLU B OE2 1 ATOM 1458 N N . LYS B 2 140 ? -15.029 0.883 -8.063 1.00 53.86 ? 140 LYS B N 1 ATOM 1459 C CA . LYS B 2 140 ? -15.605 -0.448 -7.851 1.00 53.81 ? 140 LYS B CA 1 ATOM 1460 C C . LYS B 2 140 ? -16.295 -0.510 -6.482 1.00 59.04 ? 140 LYS B C 1 ATOM 1461 O O . LYS B 2 140 ? -15.685 -0.916 -5.490 1.00 60.63 ? 140 LYS B O 1 ATOM 1462 C CB . LYS B 2 140 ? -14.536 -1.551 -8.004 1.00 57.80 ? 140 LYS B CB 1 ATOM 1463 C CG . LYS B 2 140 ? -14.061 -1.760 -9.436 1.00 70.27 ? 140 LYS B CG 1 ATOM 1464 C CD . LYS B 2 140 ? -13.051 -2.890 -9.533 1.00 81.66 ? 140 LYS B CD 1 ATOM 1465 C CE . LYS B 2 140 ? -12.591 -3.104 -10.953 1.00 91.66 ? 140 LYS B CE 1 ATOM 1466 N NZ . LYS B 2 140 ? -11.622 -4.226 -11.055 1.00 102.71 ? 140 LYS B NZ 1 ATOM 1467 N N . PHE B 2 141 ? -17.565 -0.076 -6.435 1.00 54.86 ? 141 PHE B N 1 ATOM 1468 C CA . PHE B 2 141 ? -18.381 -0.041 -5.219 1.00 55.86 ? 141 PHE B CA 1 ATOM 1469 C C . PHE B 2 141 ? -19.327 -1.243 -5.105 1.00 60.46 ? 141 PHE B C 1 ATOM 1470 O O . PHE B 2 141 ? -19.586 -1.920 -6.104 1.00 58.56 ? 141 PHE B O 1 ATOM 1471 C CB . PHE B 2 141 ? -19.137 1.299 -5.104 1.00 56.89 ? 141 PHE B CB 1 ATOM 1472 C CG . PHE B 2 141 ? -20.134 1.595 -6.203 1.00 56.29 ? 141 PHE B CG 1 ATOM 1473 C CD1 . PHE B 2 141 ? -19.726 2.168 -7.402 1.00 58.07 ? 141 PHE B CD1 1 ATOM 1474 C CD2 . PHE B 2 141 ? -21.488 1.344 -6.020 1.00 58.02 ? 141 PHE B CD2 1 ATOM 1475 C CE1 . PHE B 2 141 ? -20.650 2.452 -8.412 1.00 57.42 ? 141 PHE B CE1 1 ATOM 1476 C CE2 . PHE B 2 141 ? -22.412 1.631 -7.029 1.00 59.20 ? 141 PHE B CE2 1 ATOM 1477 C CZ . PHE B 2 141 ? -21.987 2.185 -8.217 1.00 56.13 ? 141 PHE B CZ 1 ATOM 1478 N N . HIS B 2 142 ? -19.834 -1.506 -3.884 1.00 59.53 ? 142 HIS B N 1 ATOM 1479 C CA . HIS B 2 142 ? -20.733 -2.626 -3.595 1.00 60.06 ? 142 HIS B CA 1 ATOM 1480 C C . HIS B 2 142 ? -22.214 -2.235 -3.591 1.00 63.59 ? 142 HIS B C 1 ATOM 1481 O O . HIS B 2 142 ? -23.000 -2.848 -4.315 1.00 61.81 ? 142 HIS B O 1 ATOM 1482 C CB . HIS B 2 142 ? -20.344 -3.319 -2.277 1.00 63.86 ? 142 HIS B CB 1 ATOM 1483 C CG . HIS B 2 142 ? -18.974 -3.924 -2.293 1.00 68.67 ? 142 HIS B CG 1 ATOM 1484 N ND1 . HIS B 2 142 ? -17.848 -3.160 -2.048 1.00 71.53 ? 142 HIS B ND1 1 ATOM 1485 C CD2 . HIS B 2 142 ? -18.595 -5.204 -2.516 1.00 71.08 ? 142 HIS B CD2 1 ATOM 1486 C CE1 . HIS B 2 142 ? -16.824 -3.993 -2.135 1.00 72.32 ? 142 HIS B CE1 1 ATOM 1487 N NE2 . HIS B 2 142 ? -17.224 -5.234 -2.414 1.00 72.50 ? 142 HIS B NE2 1 ATOM 1488 N N . SER B 2 143 ? -22.594 -1.228 -2.777 1.00 61.60 ? 143 SER B N 1 ATOM 1489 C CA . SER B 2 143 ? -23.980 -0.768 -2.647 1.00 61.34 ? 143 SER B CA 1 ATOM 1490 C C . SER B 2 143 ? -24.273 0.506 -3.437 1.00 64.01 ? 143 SER B C 1 ATOM 1491 O O . SER B 2 143 ? -23.445 1.419 -3.460 1.00 63.62 ? 143 SER B O 1 ATOM 1492 C CB . SER B 2 143 ? -24.345 -0.577 -1.179 1.00 67.67 ? 143 SER B CB 1 ATOM 1493 O OG . SER B 2 143 ? -23.568 0.448 -0.585 1.00 77.49 ? 143 SER B OG 1 ATOM 1494 N N . ARG B 2 144 ? -25.465 0.573 -4.063 1.00 59.75 ? 144 ARG B N 1 ATOM 1495 C CA . ARG B 2 144 ? -25.887 1.725 -4.860 1.00 58.54 ? 144 ARG B CA 1 ATOM 1496 C C . ARG B 2 144 ? -26.262 2.955 -4.009 1.00 64.15 ? 144 ARG B C 1 ATOM 1497 O O . ARG B 2 144 ? -27.070 2.829 -3.088 1.00 65.36 ? 144 ARG B O 1 ATOM 1498 C CB . ARG B 2 144 ? -26.979 1.357 -5.892 1.00 57.58 ? 144 ARG B CB 1 ATOM 1499 C CG . ARG B 2 144 ? -28.272 0.755 -5.323 1.00 69.62 ? 144 ARG B CG 1 ATOM 1500 C CD . ARG B 2 144 ? -29.439 0.862 -6.296 1.00 79.52 ? 144 ARG B CD 1 ATOM 1501 N NE . ARG B 2 144 ? -29.802 2.255 -6.575 1.00 89.25 ? 144 ARG B NE 1 ATOM 1502 C CZ . ARG B 2 144 ? -30.714 2.949 -5.900 1.00 105.80 ? 144 ARG B CZ 1 ATOM 1503 N NH1 . ARG B 2 144 ? -31.383 2.386 -4.900 1.00 94.94 ? 144 ARG B NH1 1 ATOM 1504 N NH2 . ARG B 2 144 ? -30.970 4.209 -6.224 1.00 93.25 ? 144 ARG B NH2 1 ATOM 1505 N N . PRO B 2 145 ? -25.681 4.148 -4.280 1.00 60.60 ? 145 PRO B N 1 ATOM 1506 C CA . PRO B 2 145 ? -26.036 5.328 -3.474 1.00 62.13 ? 145 PRO B CA 1 ATOM 1507 C C . PRO B 2 145 ? -27.273 6.070 -3.985 1.00 66.09 ? 145 PRO B C 1 ATOM 1508 O O . PRO B 2 145 ? -27.624 5.958 -5.163 1.00 64.01 ? 145 PRO B O 1 ATOM 1509 C CB . PRO B 2 145 ? -24.781 6.198 -3.556 1.00 63.69 ? 145 PRO B CB 1 ATOM 1510 C CG . PRO B 2 145 ? -24.105 5.792 -4.833 1.00 65.96 ? 145 PRO B CG 1 ATOM 1511 C CD . PRO B 2 145 ? -24.683 4.488 -5.316 1.00 60.57 ? 145 PRO B CD 1 ATOM 1512 N N . GLN B 2 146 ? -27.928 6.837 -3.093 1.00 64.95 ? 146 GLN B N 1 ATOM 1513 C CA . GLN B 2 146 ? -29.107 7.638 -3.434 1.00 65.49 ? 146 GLN B CA 1 ATOM 1514 C C . GLN B 2 146 ? -28.686 8.854 -4.259 1.00 68.65 ? 146 GLN B C 1 ATOM 1515 O O . GLN B 2 146 ? -29.302 9.137 -5.288 1.00 67.42 ? 146 GLN B O 1 ATOM 1516 C CB . GLN B 2 146 ? -29.873 8.068 -2.172 1.00 69.84 ? 146 GLN B CB 1 ATOM 1517 C CG . GLN B 2 146 ? -30.810 6.993 -1.628 1.00 87.18 ? 146 GLN B CG 1 ATOM 1518 C CD . GLN B 2 146 ? -31.682 7.504 -0.507 1.00 110.36 ? 146 GLN B CD 1 ATOM 1519 O OE1 . GLN B 2 146 ? -32.504 8.411 -0.684 1.00 107.07 ? 146 GLN B OE1 1 ATOM 1520 N NE2 . GLN B 2 146 ? -31.549 6.903 0.666 1.00 104.74 ? 146 GLN B NE2 1 ATOM 1521 N N . HIS B 2 147 ? -27.614 9.543 -3.823 1.00 65.66 ? 147 HIS B N 1 ATOM 1522 C CA . HIS B 2 147 ? -27.055 10.710 -4.503 1.00 64.94 ? 147 HIS B CA 1 ATOM 1523 C C . HIS B 2 147 ? -25.638 10.422 -5.005 1.00 66.83 ? 147 HIS B C 1 ATOM 1524 O O . HIS B 2 147 ? -24.884 9.693 -4.356 1.00 66.52 ? 147 HIS B O 1 ATOM 1525 C CB . HIS B 2 147 ? -27.099 11.947 -3.593 1.00 67.98 ? 147 HIS B CB 1 ATOM 1526 C CG . HIS B 2 147 ? -28.476 12.261 -3.089 1.00 73.55 ? 147 HIS B CG 1 ATOM 1527 N ND1 . HIS B 2 147 ? -28.837 12.016 -1.775 1.00 77.63 ? 147 HIS B ND1 1 ATOM 1528 C CD2 . HIS B 2 147 ? -29.550 12.750 -3.753 1.00 75.75 ? 147 HIS B CD2 1 ATOM 1529 C CE1 . HIS B 2 147 ? -30.104 12.385 -1.676 1.00 78.74 ? 147 HIS B CE1 1 ATOM 1530 N NE2 . HIS B 2 147 ? -30.576 12.833 -2.840 1.00 78.03 ? 147 HIS B NE2 1 ATOM 1531 N N . GLY B 2 148 ? -25.313 10.970 -6.172 1.00 62.02 ? 148 GLY B N 1 ATOM 1532 C CA . GLY B 2 148 ? -24.016 10.799 -6.819 1.00 60.55 ? 148 GLY B CA 1 ATOM 1533 C C . GLY B 2 148 ? -23.969 11.342 -8.233 1.00 63.28 ? 148 GLY B C 1 ATOM 1534 O O . GLY B 2 148 ? -24.905 12.018 -8.671 1.00 63.31 ? 148 GLY B O 1 ATOM 1535 N N . LYS B 2 149 ? -22.868 11.053 -8.955 1.00 58.67 ? 149 LYS B N 1 ATOM 1536 C CA . LYS B 2 149 ? -22.659 11.495 -10.337 1.00 57.73 ? 149 LYS B CA 1 ATOM 1537 C C . LYS B 2 149 ? -23.576 10.718 -11.285 1.00 60.66 ? 149 LYS B C 1 ATOM 1538 O O . LYS B 2 149 ? -23.642 9.489 -11.213 1.00 59.50 ? 149 LYS B O 1 ATOM 1539 C CB . LYS B 2 149 ? -21.182 11.336 -10.742 1.00 59.83 ? 149 LYS B CB 1 ATOM 1540 C CG . LYS B 2 149 ? -20.793 12.074 -12.018 1.00 73.73 ? 149 LYS B CG 1 ATOM 1541 C CD . LYS B 2 149 ? -19.441 11.609 -12.533 1.00 83.38 ? 149 LYS B CD 1 ATOM 1542 C CE . LYS B 2 149 ? -19.012 12.361 -13.767 1.00 95.09 ? 149 LYS B CE 1 ATOM 1543 N NZ . LYS B 2 149 ? -17.688 11.898 -14.256 1.00 104.81 ? 149 LYS B NZ 1 ATOM 1544 N N . GLU B 2 150 ? -24.298 11.443 -12.151 1.00 57.56 ? 150 GLU B N 1 ATOM 1545 C CA . GLU B 2 150 ? -25.222 10.859 -13.120 1.00 57.00 ? 150 GLU B CA 1 ATOM 1546 C C . GLU B 2 150 ? -24.478 10.414 -14.380 1.00 59.97 ? 150 GLU B C 1 ATOM 1547 O O . GLU B 2 150 ? -24.000 11.254 -15.147 1.00 60.03 ? 150 GLU B O 1 ATOM 1548 C CB . GLU B 2 150 ? -26.354 11.844 -13.454 1.00 59.63 ? 150 GLU B CB 1 ATOM 1549 C CG . GLU B 2 150 ? -27.457 11.882 -12.411 1.00 71.64 ? 150 GLU B CG 1 ATOM 1550 C CD . GLU B 2 150 ? -28.764 12.484 -12.889 1.00 95.12 ? 150 GLU B CD 1 ATOM 1551 O OE1 . GLU B 2 150 ? -28.787 13.694 -13.210 1.00 91.24 ? 150 GLU B OE1 1 ATOM 1552 O OE2 . GLU B 2 150 ? -29.771 11.741 -12.938 1.00 89.72 ? 150 GLU B OE2 1 ATOM 1553 N N . LEU B 2 151 ? -24.357 9.089 -14.573 1.00 55.47 ? 151 LEU B N 1 ATOM 1554 C CA . LEU B 2 151 ? -23.680 8.499 -15.730 1.00 54.81 ? 151 LEU B CA 1 ATOM 1555 C C . LEU B 2 151 ? -24.625 7.638 -16.584 1.00 57.98 ? 151 LEU B C 1 ATOM 1556 O O . LEU B 2 151 ? -25.490 6.962 -16.021 1.00 57.00 ? 151 LEU B O 1 ATOM 1557 C CB . LEU B 2 151 ? -22.435 7.698 -15.306 1.00 54.46 ? 151 LEU B CB 1 ATOM 1558 C CG . LEU B 2 151 ? -21.167 8.507 -14.991 1.00 59.85 ? 151 LEU B CG 1 ATOM 1559 C CD1 . LEU B 2 151 ? -20.111 7.629 -14.369 1.00 59.92 ? 151 LEU B CD1 1 ATOM 1560 C CD2 . LEU B 2 151 ? -20.589 9.166 -16.244 1.00 63.19 ? 151 LEU B CD2 1 ATOM 1561 N N . PRO B 2 152 ? -24.488 7.644 -17.935 1.00 54.82 ? 152 PRO B N 1 ATOM 1562 C CA . PRO B 2 152 ? -25.400 6.839 -18.768 1.00 54.45 ? 152 PRO B CA 1 ATOM 1563 C C . PRO B 2 152 ? -25.184 5.334 -18.639 1.00 57.01 ? 152 PRO B C 1 ATOM 1564 O O . PRO B 2 152 ? -24.047 4.863 -18.683 1.00 56.34 ? 152 PRO B O 1 ATOM 1565 C CB . PRO B 2 152 ? -25.130 7.338 -20.197 1.00 57.35 ? 152 PRO B CB 1 ATOM 1566 C CG . PRO B 2 152 ? -24.268 8.552 -20.054 1.00 62.56 ? 152 PRO B CG 1 ATOM 1567 C CD . PRO B 2 152 ? -23.531 8.393 -18.772 1.00 57.22 ? 152 PRO B CD 1 ATOM 1568 N N . CYS B 2 153 ? -26.290 4.587 -18.458 1.00 52.97 ? 153 CYS B N 1 ATOM 1569 C CA . CYS B 2 153 ? -26.308 3.126 -18.319 1.00 51.84 ? 153 CYS B CA 1 ATOM 1570 C C . CYS B 2 153 ? -27.621 2.532 -18.864 1.00 55.17 ? 153 CYS B C 1 ATOM 1571 O O . CYS B 2 153 ? -28.602 3.261 -19.016 1.00 55.54 ? 153 CYS B O 1 ATOM 1572 C CB . CYS B 2 153 ? -26.058 2.709 -16.870 1.00 51.73 ? 153 CYS B CB 1 ATOM 1573 S SG . CYS B 2 153 ? -27.456 3.008 -15.756 1.00 55.94 ? 153 CYS B SG 1 ATOM 1574 N N . SER B 2 154 ? -27.642 1.217 -19.151 1.00 50.61 ? 154 SER B N 1 ATOM 1575 C CA . SER B 2 154 ? -28.839 0.537 -19.658 1.00 50.15 ? 154 SER B CA 1 ATOM 1576 C C . SER B 2 154 ? -29.363 -0.510 -18.678 1.00 52.92 ? 154 SER B C 1 ATOM 1577 O O . SER B 2 154 ? -28.585 -1.069 -17.905 1.00 51.86 ? 154 SER B O 1 ATOM 1578 C CB . SER B 2 154 ? -28.573 -0.091 -21.022 1.00 53.81 ? 154 SER B CB 1 ATOM 1579 O OG . SER B 2 154 ? -27.464 -0.975 -20.986 1.00 61.78 ? 154 SER B OG 1 ATOM 1580 N N . THR B 2 155 ? -30.688 -0.760 -18.709 1.00 49.57 ? 155 THR B N 1 ATOM 1581 C CA . THR B 2 155 ? -31.389 -1.737 -17.866 1.00 48.88 ? 155 THR B CA 1 ATOM 1582 C C . THR B 2 155 ? -32.631 -2.297 -18.573 1.00 52.84 ? 155 THR B C 1 ATOM 1583 O O . THR B 2 155 ? -33.084 -1.732 -19.570 1.00 53.09 ? 155 THR B O 1 ATOM 1584 C CB . THR B 2 155 ? -31.734 -1.131 -16.480 1.00 57.19 ? 155 THR B CB 1 ATOM 1585 O OG1 . THR B 2 155 ? -31.912 -2.192 -15.541 1.00 56.49 ? 155 THR B OG1 1 ATOM 1586 C CG2 . THR B 2 155 ? -32.990 -0.245 -16.501 1.00 56.83 ? 155 THR B CG2 1 ATOM 1587 N N . TYR B 2 156 ? -33.187 -3.391 -18.036 1.00 49.05 ? 156 TYR B N 1 ATOM 1588 C CA . TYR B 2 156 ? -34.423 -3.980 -18.535 1.00 49.22 ? 156 TYR B CA 1 ATOM 1589 C C . TYR B 2 156 ? -35.522 -3.449 -17.612 1.00 54.94 ? 156 TYR B C 1 ATOM 1590 O O . TYR B 2 156 ? -35.485 -3.694 -16.402 1.00 54.43 ? 156 TYR B O 1 ATOM 1591 C CB . TYR B 2 156 ? -34.355 -5.517 -18.527 1.00 49.21 ? 156 TYR B CB 1 ATOM 1592 C CG . TYR B 2 156 ? -33.214 -6.092 -19.340 1.00 49.70 ? 156 TYR B CG 1 ATOM 1593 C CD1 . TYR B 2 156 ? -33.304 -6.202 -20.725 1.00 51.88 ? 156 TYR B CD1 1 ATOM 1594 C CD2 . TYR B 2 156 ? -32.055 -6.551 -18.723 1.00 49.69 ? 156 TYR B CD2 1 ATOM 1595 C CE1 . TYR B 2 156 ? -32.262 -6.742 -21.478 1.00 52.18 ? 156 TYR B CE1 1 ATOM 1596 C CE2 . TYR B 2 156 ? -31.007 -7.095 -19.465 1.00 50.24 ? 156 TYR B CE2 1 ATOM 1597 C CZ . TYR B 2 156 ? -31.112 -7.181 -20.844 1.00 57.44 ? 156 TYR B CZ 1 ATOM 1598 O OH . TYR B 2 156 ? -30.081 -7.710 -21.581 1.00 58.07 ? 156 TYR B OH 1 ATOM 1599 N N . VAL B 2 157 ? -36.438 -2.640 -18.169 1.00 53.54 ? 157 VAL B N 1 ATOM 1600 C CA . VAL B 2 157 ? -37.527 -1.993 -17.423 1.00 55.27 ? 157 VAL B CA 1 ATOM 1601 C C . VAL B 2 157 ? -38.508 -2.963 -16.756 1.00 60.62 ? 157 VAL B C 1 ATOM 1602 O O . VAL B 2 157 ? -38.863 -3.980 -17.345 1.00 59.69 ? 157 VAL B O 1 ATOM 1603 C CB . VAL B 2 157 ? -38.239 -0.856 -18.206 1.00 60.88 ? 157 VAL B CB 1 ATOM 1604 C CG1 . VAL B 2 157 ? -37.339 0.370 -18.337 1.00 60.77 ? 157 VAL B CG1 1 ATOM 1605 C CG2 . VAL B 2 157 ? -38.730 -1.327 -19.575 1.00 61.04 ? 157 VAL B CG2 1 ATOM 1606 N N . GLN B 2 158 ? -38.944 -2.635 -15.527 1.00 59.13 ? 158 GLN B N 1 ATOM 1607 C CA . GLN B 2 158 ? -39.873 -3.441 -14.727 1.00 60.14 ? 158 GLN B CA 1 ATOM 1608 C C . GLN B 2 158 ? -41.308 -3.518 -15.282 1.00 66.51 ? 158 GLN B C 1 ATOM 1609 O O . GLN B 2 158 ? -42.106 -4.316 -14.783 1.00 66.83 ? 158 GLN B O 1 ATOM 1610 C CB . GLN B 2 158 ? -39.889 -2.947 -13.273 1.00 62.70 ? 158 GLN B CB 1 ATOM 1611 C CG . GLN B 2 158 ? -38.779 -3.531 -12.420 1.00 77.54 ? 158 GLN B CG 1 ATOM 1612 C CD . GLN B 2 158 ? -39.205 -3.615 -10.978 1.00 99.63 ? 158 GLN B CD 1 ATOM 1613 O OE1 . GLN B 2 158 ? -38.968 -2.704 -10.180 1.00 96.57 ? 158 GLN B OE1 1 ATOM 1614 N NE2 . GLN B 2 158 ? -39.871 -4.703 -10.616 1.00 92.55 ? 158 GLN B NE2 1 ATOM 1615 N N . SER B 2 159 ? -41.628 -2.700 -16.306 1.00 64.61 ? 159 SER B N 1 ATOM 1616 C CA . SER B 2 159 ? -42.947 -2.614 -16.939 1.00 66.70 ? 159 SER B CA 1 ATOM 1617 C C . SER B 2 159 ? -43.435 -3.915 -17.580 1.00 70.73 ? 159 SER B C 1 ATOM 1618 O O . SER B 2 159 ? -42.680 -4.581 -18.291 1.00 68.50 ? 159 SER B O 1 ATOM 1619 C CB . SER B 2 159 ? -42.984 -1.473 -17.950 1.00 71.53 ? 159 SER B CB 1 ATOM 1620 O OG . SER B 2 159 ? -42.065 -1.690 -19.008 1.00 79.02 ? 159 SER B OG 1 ATOM 1621 N N . THR B 2 160 ? -44.708 -4.267 -17.310 1.00 69.62 ? 160 THR B N 1 ATOM 1622 C CA . THR B 2 160 ? -45.391 -5.459 -17.824 1.00 69.54 ? 160 THR B CA 1 ATOM 1623 C C . THR B 2 160 ? -45.672 -5.309 -19.326 1.00 73.96 ? 160 THR B C 1 ATOM 1624 O O . THR B 2 160 ? -45.516 -6.283 -20.067 1.00 72.24 ? 160 THR B O 1 ATOM 1625 C CB . THR B 2 160 ? -46.686 -5.726 -17.011 1.00 80.97 ? 160 THR B CB 1 ATOM 1626 O OG1 . THR B 2 160 ? -46.355 -5.942 -15.638 1.00 80.82 ? 160 THR B OG1 1 ATOM 1627 C CG2 . THR B 2 160 ? -47.488 -6.923 -17.528 1.00 80.07 ? 160 THR B CG2 1 ATOM 1628 N N . ALA B 2 161 ? -46.084 -4.085 -19.752 1.00 72.65 ? 161 ALA B N 1 ATOM 1629 C CA . ALA B 2 161 ? -46.466 -3.673 -21.113 1.00 73.91 ? 161 ALA B CA 1 ATOM 1630 C C . ALA B 2 161 ? -45.805 -4.431 -22.261 1.00 76.05 ? 161 ALA B C 1 ATOM 1631 O O . ALA B 2 161 ? -44.579 -4.573 -22.294 1.00 73.53 ? 161 ALA B O 1 ATOM 1632 C CB . ALA B 2 161 ? -46.288 -2.172 -21.290 1.00 76.19 ? 161 ALA B CB 1 ATOM 1633 N N . ALA B 2 162 ? -46.640 -4.924 -23.194 1.00 73.76 ? 162 ALA B N 1 ATOM 1634 C CA . ALA B 2 162 ? -46.213 -5.708 -24.348 1.00 72.51 ? 162 ALA B CA 1 ATOM 1635 C C . ALA B 2 162 ? -45.977 -4.849 -25.599 1.00 77.45 ? 162 ALA B C 1 ATOM 1636 O O . ALA B 2 162 ? -46.883 -4.667 -26.418 1.00 79.58 ? 162 ALA B O 1 ATOM 1637 C CB . ALA B 2 162 ? -47.217 -6.819 -24.624 1.00 73.89 ? 162 ALA B CB 1 ATOM 1638 N N . THR B 2 163 ? -44.750 -4.302 -25.720 1.00 72.29 ? 163 THR B N 1 ATOM 1639 C CA . THR B 2 163 ? -44.293 -3.468 -26.840 1.00 73.23 ? 163 THR B CA 1 ATOM 1640 C C . THR B 2 163 ? -42.818 -3.775 -27.172 1.00 74.07 ? 163 THR B C 1 ATOM 1641 O O . THR B 2 163 ? -42.139 -4.460 -26.403 1.00 71.09 ? 163 THR B O 1 ATOM 1642 C CB . THR B 2 163 ? -44.476 -1.961 -26.535 1.00 83.63 ? 163 THR B CB 1 ATOM 1643 O OG1 . THR B 2 163 ? -43.992 -1.663 -25.225 1.00 81.84 ? 163 THR B OG1 1 ATOM 1644 C CG2 . THR B 2 163 ? -45.912 -1.481 -26.704 1.00 85.60 ? 163 THR B CG2 1 ATOM 1645 N N . THR B 2 164 ? -42.332 -3.245 -28.312 1.00 71.36 ? 164 THR B N 1 ATOM 1646 C CA . THR B 2 164 ? -40.960 -3.343 -28.827 1.00 69.74 ? 164 THR B CA 1 ATOM 1647 C C . THR B 2 164 ? -40.421 -4.768 -29.065 1.00 70.94 ? 164 THR B C 1 ATOM 1648 O O . THR B 2 164 ? -40.555 -5.275 -30.179 1.00 71.69 ? 164 THR B O 1 ATOM 1649 C CB . THR B 2 164 ? -40.000 -2.357 -28.107 1.00 76.97 ? 164 THR B CB 1 ATOM 1650 O OG1 . THR B 2 164 ? -40.638 -1.087 -27.957 1.00 78.54 ? 164 THR B OG1 1 ATOM 1651 C CG2 . THR B 2 164 ? -38.672 -2.176 -28.842 1.00 75.47 ? 164 THR B CG2 1 ATOM 1652 N N . GLU B 2 165 ? -39.791 -5.389 -28.041 1.00 64.24 ? 165 GLU B N 1 ATOM 1653 C CA . GLU B 2 165 ? -39.170 -6.717 -28.131 1.00 62.03 ? 165 GLU B CA 1 ATOM 1654 C C . GLU B 2 165 ? -40.166 -7.864 -28.364 1.00 65.13 ? 165 GLU B C 1 ATOM 1655 O O . GLU B 2 165 ? -41.315 -7.776 -27.925 1.00 65.33 ? 165 GLU B O 1 ATOM 1656 C CB . GLU B 2 165 ? -38.248 -6.981 -26.926 1.00 61.05 ? 165 GLU B CB 1 ATOM 1657 C CG . GLU B 2 165 ? -36.979 -6.135 -26.925 1.00 71.19 ? 165 GLU B CG 1 ATOM 1658 C CD . GLU B 2 165 ? -35.987 -6.367 -25.799 1.00 88.34 ? 165 GLU B CD 1 ATOM 1659 O OE1 . GLU B 2 165 ? -36.177 -7.328 -25.020 1.00 81.10 ? 165 GLU B OE1 1 ATOM 1660 O OE2 . GLU B 2 165 ? -35.016 -5.581 -25.694 1.00 81.58 ? 165 GLU B OE2 1 ATOM 1661 N N . GLU B 2 166 ? -39.724 -8.932 -29.072 1.00 60.60 ? 166 GLU B N 1 ATOM 1662 C CA . GLU B 2 166 ? -40.564 -10.092 -29.419 1.00 60.27 ? 166 GLU B CA 1 ATOM 1663 C C . GLU B 2 166 ? -39.818 -11.436 -29.514 1.00 61.65 ? 166 GLU B C 1 ATOM 1664 O O . GLU B 2 166 ? -38.591 -11.457 -29.627 1.00 60.72 ? 166 GLU B O 1 ATOM 1665 C CB . GLU B 2 166 ? -41.354 -9.829 -30.724 1.00 64.38 ? 166 GLU B CB 1 ATOM 1666 C CG . GLU B 2 166 ? -40.491 -9.572 -31.955 1.00 76.54 ? 166 GLU B CG 1 ATOM 1667 C CD . GLU B 2 166 ? -41.220 -9.425 -33.278 1.00 100.07 ? 166 GLU B CD 1 ATOM 1668 O OE1 . GLU B 2 166 ? -42.318 -8.822 -33.299 1.00 95.82 ? 166 GLU B OE1 1 ATOM 1669 O OE2 . GLU B 2 166 ? -40.668 -9.879 -34.306 1.00 95.01 ? 166 GLU B OE2 1 ATOM 1670 N N . ILE B 2 167 ? -40.583 -12.553 -29.492 1.00 56.93 ? 167 ILE B N 1 ATOM 1671 C CA . ILE B 2 167 ? -40.093 -13.933 -29.643 1.00 55.27 ? 167 ILE B CA 1 ATOM 1672 C C . ILE B 2 167 ? -40.944 -14.695 -30.668 1.00 59.51 ? 167 ILE B C 1 ATOM 1673 O O . ILE B 2 167 ? -42.127 -14.388 -30.838 1.00 60.10 ? 167 ILE B O 1 ATOM 1674 C CB . ILE B 2 167 ? -39.959 -14.729 -28.306 1.00 56.28 ? 167 ILE B CB 1 ATOM 1675 C CG1 . ILE B 2 167 ? -41.325 -14.917 -27.586 1.00 56.70 ? 167 ILE B CG1 1 ATOM 1676 C CG2 . ILE B 2 167 ? -38.859 -14.151 -27.400 1.00 55.75 ? 167 ILE B CG2 1 ATOM 1677 C CD1 . ILE B 2 167 ? -41.398 -16.031 -26.522 1.00 62.02 ? 167 ILE B CD1 1 ATOM 1678 N N . GLU B 2 168 ? -40.342 -15.692 -31.336 1.00 55.62 ? 168 GLU B N 1 ATOM 1679 C CA . GLU B 2 168 ? -41.033 -16.529 -32.315 1.00 56.55 ? 168 GLU B CA 1 ATOM 1680 C C . GLU B 2 168 ? -41.711 -17.707 -31.623 1.00 58.69 ? 168 GLU B C 1 ATOM 1681 O O . GLU B 2 168 ? -41.131 -18.312 -30.720 1.00 56.42 ? 168 GLU B O 1 ATOM 1682 C CB . GLU B 2 168 ? -40.071 -17.018 -33.406 1.00 58.95 ? 168 GLU B CB 1 ATOM 1683 C CG . GLU B 2 168 ? -39.789 -15.976 -34.477 1.00 71.26 ? 168 GLU B CG 1 ATOM 1684 C CD . GLU B 2 168 ? -38.986 -16.423 -35.686 1.00 91.87 ? 168 GLU B CD 1 ATOM 1685 O OE1 . GLU B 2 168 ? -38.570 -17.603 -35.741 1.00 84.05 ? 168 GLU B OE1 1 ATOM 1686 O OE2 . GLU B 2 168 ? -38.758 -15.574 -36.578 1.00 87.65 ? 168 GLU B OE2 1 ATOM 1687 N N . VAL B 2 169 ? -42.955 -18.007 -32.027 1.00 56.13 ? 169 VAL B N 1 ATOM 1688 C CA . VAL B 2 169 ? -43.762 -19.108 -31.485 1.00 55.02 ? 169 VAL B CA 1 ATOM 1689 C C . VAL B 2 169 ? -44.340 -19.981 -32.610 1.00 60.18 ? 169 VAL B C 1 ATOM 1690 O O . VAL B 2 169 ? -44.523 -19.495 -33.723 1.00 61.87 ? 169 VAL B O 1 ATOM 1691 C CB . VAL B 2 169 ? -44.863 -18.652 -30.476 1.00 58.73 ? 169 VAL B CB 1 ATOM 1692 C CG1 . VAL B 2 169 ? -44.260 -18.147 -29.168 1.00 56.78 ? 169 VAL B CG1 1 ATOM 1693 C CG2 . VAL B 2 169 ? -45.802 -17.611 -31.081 1.00 60.83 ? 169 VAL B CG2 1 ATOM 1694 N N . HIS B 2 170 ? -44.608 -21.267 -32.320 1.00 79.22 ? 170 HIS B N 1 ATOM 1695 C CA . HIS B 2 170 ? -45.211 -22.228 -33.252 1.00 76.74 ? 170 HIS B CA 1 ATOM 1696 C C . HIS B 2 170 ? -45.866 -23.391 -32.513 1.00 77.57 ? 170 HIS B C 1 ATOM 1697 O O . HIS B 2 170 ? -45.665 -23.539 -31.306 1.00 76.60 ? 170 HIS B O 1 ATOM 1698 C CB . HIS B 2 170 ? -44.213 -22.729 -34.326 1.00 76.86 ? 170 HIS B CB 1 ATOM 1699 C CG . HIS B 2 170 ? -42.966 -23.377 -33.802 1.00 78.90 ? 170 HIS B CG 1 ATOM 1700 N ND1 . HIS B 2 170 ? -43.013 -24.495 -32.984 1.00 77.96 ? 170 HIS B ND1 1 ATOM 1701 C CD2 . HIS B 2 170 ? -41.673 -23.094 -34.076 1.00 81.76 ? 170 HIS B CD2 1 ATOM 1702 C CE1 . HIS B 2 170 ? -41.753 -24.817 -32.744 1.00 77.06 ? 170 HIS B CE1 1 ATOM 1703 N NE2 . HIS B 2 170 ? -40.911 -24.007 -33.384 1.00 79.58 ? 170 HIS B NE2 1 ATOM 1704 N N . MET B 2 171 ? -46.640 -24.219 -33.240 1.00 72.45 ? 171 MET B N 1 ATOM 1705 C CA . MET B 2 171 ? -47.313 -25.398 -32.692 1.00 69.62 ? 171 MET B CA 1 ATOM 1706 C C . MET B 2 171 ? -46.277 -26.432 -32.213 1.00 71.23 ? 171 MET B C 1 ATOM 1707 O O . MET B 2 171 ? -45.248 -26.599 -32.874 1.00 70.76 ? 171 MET B O 1 ATOM 1708 C CB . MET B 2 171 ? -48.269 -26.015 -33.727 1.00 71.06 ? 171 MET B CB 1 ATOM 1709 C CG . MET B 2 171 ? -49.493 -25.162 -33.996 1.00 76.63 ? 171 MET B CG 1 ATOM 1710 S SD . MET B 2 171 ? -50.594 -25.867 -35.242 1.00 80.14 ? 171 MET B SD 1 ATOM 1711 C CE . MET B 2 171 ? -51.688 -24.488 -35.510 1.00 79.89 ? 171 MET B CE 1 ATOM 1712 N N . PRO B 2 172 ? -46.496 -27.094 -31.051 1.00 66.31 ? 172 PRO B N 1 ATOM 1713 C CA . PRO B 2 172 ? -45.504 -28.068 -30.560 1.00 64.60 ? 172 PRO B CA 1 ATOM 1714 C C . PRO B 2 172 ? -45.437 -29.361 -31.388 1.00 66.38 ? 172 PRO B C 1 ATOM 1715 O O . PRO B 2 172 ? -46.427 -29.699 -32.042 1.00 65.29 ? 172 PRO B O 1 ATOM 1716 C CB . PRO B 2 172 ? -45.964 -28.351 -29.121 1.00 65.82 ? 172 PRO B CB 1 ATOM 1717 C CG . PRO B 2 172 ? -47.030 -27.333 -28.817 1.00 71.79 ? 172 PRO B CG 1 ATOM 1718 C CD . PRO B 2 172 ? -47.642 -27.000 -30.128 1.00 67.78 ? 172 PRO B CD 1 ATOM 1719 N N . PRO B 2 173 ? -44.302 -30.113 -31.365 1.00 62.07 ? 173 PRO B N 1 ATOM 1720 C CA . PRO B 2 173 ? -44.232 -31.370 -32.139 1.00 60.17 ? 173 PRO B CA 1 ATOM 1721 C C . PRO B 2 173 ? -45.054 -32.502 -31.510 1.00 62.28 ? 173 PRO B C 1 ATOM 1722 O O . PRO B 2 173 ? -45.566 -32.329 -30.401 1.00 61.89 ? 173 PRO B O 1 ATOM 1723 C CB . PRO B 2 173 ? -42.738 -31.702 -32.103 1.00 61.94 ? 173 PRO B CB 1 ATOM 1724 C CG . PRO B 2 173 ? -42.288 -31.164 -30.787 1.00 67.23 ? 173 PRO B CG 1 ATOM 1725 C CD . PRO B 2 173 ? -43.034 -29.867 -30.643 1.00 64.38 ? 173 PRO B CD 1 ATOM 1726 N N . ASP B 2 174 ? -45.160 -33.667 -32.205 1.00 57.49 ? 174 ASP B N 1 ATOM 1727 C CA . ASP B 2 174 ? -45.869 -34.855 -31.704 1.00 55.82 ? 174 ASP B CA 1 ATOM 1728 C C . ASP B 2 174 ? -45.111 -35.388 -30.487 1.00 59.09 ? 174 ASP B C 1 ATOM 1729 O O . ASP B 2 174 ? -43.902 -35.618 -30.571 1.00 58.79 ? 174 ASP B O 1 ATOM 1730 C CB . ASP B 2 174 ? -45.987 -35.957 -32.785 1.00 56.85 ? 174 ASP B CB 1 ATOM 1731 C CG . ASP B 2 174 ? -46.619 -35.550 -34.108 1.00 68.14 ? 174 ASP B CG 1 ATOM 1732 O OD1 . ASP B 2 174 ? -46.343 -36.219 -35.125 1.00 68.57 ? 174 ASP B OD1 1 ATOM 1733 O OD2 . ASP B 2 174 ? -47.390 -34.562 -34.125 1.00 75.04 ? 174 ASP B OD2 1 ATOM 1734 N N . THR B 2 175 ? -45.809 -35.520 -29.347 1.00 55.37 ? 175 THR B N 1 ATOM 1735 C CA . THR B 2 175 ? -45.221 -35.966 -28.084 1.00 55.17 ? 175 THR B CA 1 ATOM 1736 C C . THR B 2 175 ? -45.246 -37.502 -27.976 1.00 57.71 ? 175 THR B C 1 ATOM 1737 O O . THR B 2 175 ? -46.330 -38.068 -27.815 1.00 56.58 ? 175 THR B O 1 ATOM 1738 C CB . THR B 2 175 ? -45.889 -35.244 -26.892 1.00 64.54 ? 175 THR B CB 1 ATOM 1739 O OG1 . THR B 2 175 ? -45.989 -33.846 -27.172 1.00 65.57 ? 175 THR B OG1 1 ATOM 1740 C CG2 . THR B 2 175 ? -45.137 -35.452 -25.581 1.00 64.04 ? 175 THR B CG2 1 ATOM 1741 N N . PRO B 2 176 ? -44.078 -38.195 -28.051 1.00 54.11 ? 176 PRO B N 1 ATOM 1742 C CA . PRO B 2 176 ? -44.093 -39.666 -27.938 1.00 53.20 ? 176 PRO B CA 1 ATOM 1743 C C . PRO B 2 176 ? -44.517 -40.143 -26.552 1.00 57.18 ? 176 PRO B C 1 ATOM 1744 O O . PRO B 2 176 ? -44.136 -39.540 -25.548 1.00 57.50 ? 176 PRO B O 1 ATOM 1745 C CB . PRO B 2 176 ? -42.657 -40.073 -28.280 1.00 55.22 ? 176 PRO B CB 1 ATOM 1746 C CG . PRO B 2 176 ? -41.840 -38.881 -27.986 1.00 60.59 ? 176 PRO B CG 1 ATOM 1747 C CD . PRO B 2 176 ? -42.704 -37.683 -28.238 1.00 56.36 ? 176 PRO B CD 1 ATOM 1748 N N . ASP B 2 177 ? -45.353 -41.189 -26.507 1.00 53.25 ? 177 ASP B N 1 ATOM 1749 C CA . ASP B 2 177 ? -45.869 -41.759 -25.266 1.00 53.41 ? 177 ASP B CA 1 ATOM 1750 C C . ASP B 2 177 ? -46.126 -43.254 -25.448 1.00 57.35 ? 177 ASP B C 1 ATOM 1751 O O . ASP B 2 177 ? -47.013 -43.643 -26.213 1.00 56.28 ? 177 ASP B O 1 ATOM 1752 C CB . ASP B 2 177 ? -47.140 -41.005 -24.812 1.00 55.18 ? 177 ASP B CB 1 ATOM 1753 C CG . ASP B 2 177 ? -47.709 -41.409 -23.463 1.00 64.70 ? 177 ASP B CG 1 ATOM 1754 O OD1 . ASP B 2 177 ? -46.932 -41.888 -22.604 1.00 65.87 ? 177 ASP B OD1 1 ATOM 1755 O OD2 . ASP B 2 177 ? -48.923 -41.212 -23.251 1.00 70.02 ? 177 ASP B OD2 1 ATOM 1756 N N . ARG B 2 178 ? -45.320 -44.088 -24.769 1.00 54.96 ? 178 ARG B N 1 ATOM 1757 C CA . ARG B 2 178 ? -45.418 -45.548 -24.844 1.00 55.13 ? 178 ARG B CA 1 ATOM 1758 C C . ARG B 2 178 ? -46.560 -46.142 -24.010 1.00 59.47 ? 178 ARG B C 1 ATOM 1759 O O . ARG B 2 178 ? -46.932 -47.297 -24.233 1.00 59.21 ? 178 ARG B O 1 ATOM 1760 C CB . ARG B 2 178 ? -44.070 -46.218 -24.533 1.00 56.66 ? 178 ARG B CB 1 ATOM 1761 C CG . ARG B 2 178 ? -43.070 -46.104 -25.678 1.00 68.13 ? 178 ARG B CG 1 ATOM 1762 C CD . ARG B 2 178 ? -42.057 -47.232 -25.662 1.00 80.82 ? 178 ARG B CD 1 ATOM 1763 N NE . ARG B 2 178 ? -41.234 -47.241 -26.873 1.00 90.66 ? 178 ARG B NE 1 ATOM 1764 C CZ . ARG B 2 178 ? -41.527 -47.918 -27.980 1.00 105.74 ? 178 ARG B CZ 1 ATOM 1765 N NH1 . ARG B 2 178 ? -42.633 -48.651 -28.046 1.00 93.10 ? 178 ARG B NH1 1 ATOM 1766 N NH2 . ARG B 2 178 ? -40.719 -47.865 -29.030 1.00 93.35 ? 178 ARG B NH2 1 ATOM 1767 N N . THR B 2 179 ? -47.140 -45.347 -23.083 1.00 56.50 ? 179 THR B N 1 ATOM 1768 C CA . THR B 2 179 ? -48.258 -45.770 -22.228 1.00 56.90 ? 179 THR B CA 1 ATOM 1769 C C . THR B 2 179 ? -49.574 -45.902 -23.014 1.00 60.35 ? 179 THR B C 1 ATOM 1770 O O . THR B 2 179 ? -50.512 -46.536 -22.527 1.00 60.29 ? 179 THR B O 1 ATOM 1771 C CB . THR B 2 179 ? -48.391 -44.884 -20.975 1.00 65.41 ? 179 THR B CB 1 ATOM 1772 O OG1 . THR B 2 179 ? -48.698 -43.547 -21.362 1.00 64.34 ? 179 THR B OG1 1 ATOM 1773 C CG2 . THR B 2 179 ? -47.150 -44.916 -20.087 1.00 65.02 ? 179 THR B CG2 1 ATOM 1774 N N . LEU B 2 180 ? -49.629 -45.324 -24.236 1.00 56.34 ? 180 LEU B N 1 ATOM 1775 C CA . LEU B 2 180 ? -50.782 -45.385 -25.143 1.00 55.71 ? 180 LEU B CA 1 ATOM 1776 C C . LEU B 2 180 ? -50.968 -46.799 -25.699 1.00 60.04 ? 180 LEU B C 1 ATOM 1777 O O . LEU B 2 180 ? -52.077 -47.157 -26.098 1.00 59.56 ? 180 LEU B O 1 ATOM 1778 C CB . LEU B 2 180 ? -50.605 -44.410 -26.324 1.00 55.13 ? 180 LEU B CB 1 ATOM 1779 C CG . LEU B 2 180 ? -50.596 -42.910 -26.033 1.00 59.94 ? 180 LEU B CG 1 ATOM 1780 C CD1 . LEU B 2 180 ? -49.919 -42.161 -27.156 1.00 59.86 ? 180 LEU B CD1 1 ATOM 1781 C CD2 . LEU B 2 180 ? -52.008 -42.370 -25.833 1.00 62.57 ? 180 LEU B CD2 1 ATOM 1782 N N . MET B 2 181 ? -49.878 -47.588 -25.743 1.00 57.29 ? 181 MET B N 1 ATOM 1783 C CA . MET B 2 181 ? -49.871 -48.953 -26.266 1.00 57.77 ? 181 MET B CA 1 ATOM 1784 C C . MET B 2 181 ? -49.875 -50.005 -25.165 1.00 63.04 ? 181 MET B C 1 ATOM 1785 O O . MET B 2 181 ? -49.161 -49.871 -24.169 1.00 63.17 ? 181 MET B O 1 ATOM 1786 C CB . MET B 2 181 ? -48.681 -49.174 -27.210 1.00 60.09 ? 181 MET B CB 1 ATOM 1787 C CG . MET B 2 181 ? -48.644 -48.207 -28.375 1.00 62.89 ? 181 MET B CG 1 ATOM 1788 S SD . MET B 2 181 ? -47.089 -48.273 -29.289 1.00 67.24 ? 181 MET B SD 1 ATOM 1789 C CE . MET B 2 181 ? -45.987 -47.442 -28.148 1.00 64.10 ? 181 MET B CE 1 ATOM 1790 N N . SER B 2 182 ? -50.682 -51.058 -25.363 1.00 60.40 ? 182 SER B N 1 ATOM 1791 C CA . SER B 2 182 ? -50.834 -52.194 -24.453 1.00 61.81 ? 182 SER B CA 1 ATOM 1792 C C . SER B 2 182 ? -51.007 -53.487 -25.263 1.00 66.62 ? 182 SER B C 1 ATOM 1793 O O . SER B 2 182 ? -51.229 -53.424 -26.475 1.00 65.50 ? 182 SER B O 1 ATOM 1794 C CB . SER B 2 182 ? -52.019 -51.974 -23.515 1.00 65.71 ? 182 SER B CB 1 ATOM 1795 O OG . SER B 2 182 ? -53.230 -51.804 -24.232 1.00 74.11 ? 182 SER B OG 1 ATOM 1796 N N . GLN B 2 183 ? -50.890 -54.654 -24.603 1.00 65.00 ? 183 GLN B N 1 ATOM 1797 C CA . GLN B 2 183 ? -51.021 -55.944 -25.279 1.00 66.11 ? 183 GLN B CA 1 ATOM 1798 C C . GLN B 2 183 ? -52.385 -56.586 -25.065 1.00 70.99 ? 183 GLN B C 1 ATOM 1799 O O . GLN B 2 183 ? -52.766 -56.867 -23.925 1.00 71.59 ? 183 GLN B O 1 ATOM 1800 C CB . GLN B 2 183 ? -49.868 -56.900 -24.925 1.00 69.14 ? 183 GLN B CB 1 ATOM 1801 C CG . GLN B 2 183 ? -48.499 -56.371 -25.350 1.00 82.52 ? 183 GLN B CG 1 ATOM 1802 C CD . GLN B 2 183 ? -47.646 -57.393 -26.058 1.00 102.23 ? 183 GLN B CD 1 ATOM 1803 O OE1 . GLN B 2 183 ? -48.050 -58.011 -27.051 1.00 97.75 ? 183 GLN B OE1 1 ATOM 1804 N NE2 . GLN B 2 183 ? -46.410 -57.537 -25.606 1.00 95.27 ? 183 GLN B NE2 1 ATOM 1805 N N . GLN B 2 184 ? -53.132 -56.792 -26.163 1.00 67.40 ? 184 GLN B N 1 ATOM 1806 C CA . GLN B 2 184 ? -54.454 -57.398 -26.091 1.00 68.25 ? 184 GLN B CA 1 ATOM 1807 C C . GLN B 2 184 ? -54.362 -58.877 -26.462 1.00 74.37 ? 184 GLN B C 1 ATOM 1808 O O . GLN B 2 184 ? -54.550 -59.260 -27.623 1.00 74.33 ? 184 GLN B O 1 ATOM 1809 C CB . GLN B 2 184 ? -55.487 -56.603 -26.904 1.00 68.22 ? 184 GLN B CB 1 ATOM 1810 C CG . GLN B 2 184 ? -56.830 -56.497 -26.188 1.00 83.60 ? 184 GLN B CG 1 ATOM 1811 C CD . GLN B 2 184 ? -57.870 -55.739 -26.977 1.00 101.06 ? 184 GLN B CD 1 ATOM 1812 O OE1 . GLN B 2 184 ? -58.221 -56.102 -28.105 1.00 97.12 ? 184 GLN B OE1 1 ATOM 1813 N NE2 . GLN B 2 184 ? -58.442 -54.711 -26.369 1.00 91.33 ? 184 GLN B NE2 1 ATOM 1814 N N . SER B 2 185 ? -54.003 -59.691 -25.434 1.00 72.56 ? 185 SER B N 1 ATOM 1815 C CA . SER B 2 185 ? -53.741 -61.140 -25.408 1.00 74.95 ? 185 SER B CA 1 ATOM 1816 C C . SER B 2 185 ? -52.337 -61.501 -25.887 1.00 78.81 ? 185 SER B C 1 ATOM 1817 O O . SER B 2 185 ? -51.721 -62.418 -25.345 1.00 80.67 ? 185 SER B O 1 ATOM 1818 C CB . SER B 2 185 ? -54.822 -61.953 -26.116 1.00 79.91 ? 185 SER B CB 1 ATOM 1819 O OG . SER B 2 185 ? -55.939 -62.161 -25.267 1.00 89.88 ? 185 SER B OG 1 ATOM 1820 N N . GLY B 2 186 ? -51.840 -60.752 -26.863 1.00 73.02 ? 186 GLY B N 1 ATOM 1821 C CA . GLY B 2 186 ? -50.512 -60.917 -27.437 1.00 72.80 ? 186 GLY B CA 1 ATOM 1822 C C . GLY B 2 186 ? -50.337 -60.094 -28.694 1.00 74.22 ? 186 GLY B C 1 ATOM 1823 O O . GLY B 2 186 ? -49.471 -60.398 -29.519 1.00 74.22 ? 186 GLY B O 1 ATOM 1824 N N . ASN B 2 187 ? -51.172 -59.047 -28.843 1.00 68.38 ? 187 ASN B N 1 ATOM 1825 C CA . ASN B 2 187 ? -51.195 -58.131 -29.985 1.00 66.19 ? 187 ASN B CA 1 ATOM 1826 C C . ASN B 2 187 ? -50.970 -56.683 -29.506 1.00 67.18 ? 187 ASN B C 1 ATOM 1827 O O . ASN B 2 187 ? -50.551 -56.493 -28.365 1.00 66.76 ? 187 ASN B O 1 ATOM 1828 C CB . ASN B 2 187 ? -52.523 -58.279 -30.748 1.00 67.19 ? 187 ASN B CB 1 ATOM 1829 C CG . ASN B 2 187 ? -52.881 -59.705 -31.097 1.00 91.54 ? 187 ASN B CG 1 ATOM 1830 O OD1 . ASN B 2 187 ? -52.205 -60.374 -31.890 1.00 86.59 ? 187 ASN B OD1 1 ATOM 1831 N ND2 . ASN B 2 187 ? -53.956 -60.201 -30.504 1.00 84.41 ? 187 ASN B ND2 1 ATOM 1832 N N . VAL B 2 188 ? -51.209 -55.670 -30.371 1.00 61.62 ? 188 VAL B N 1 ATOM 1833 C CA . VAL B 2 188 ? -51.016 -54.256 -30.013 1.00 59.36 ? 188 VAL B CA 1 ATOM 1834 C C . VAL B 2 188 ? -52.349 -53.500 -29.954 1.00 61.47 ? 188 VAL B C 1 ATOM 1835 O O . VAL B 2 188 ? -53.074 -53.439 -30.949 1.00 60.92 ? 188 VAL B O 1 ATOM 1836 C CB . VAL B 2 188 ? -49.952 -53.533 -30.896 1.00 62.42 ? 188 VAL B CB 1 ATOM 1837 C CG1 . VAL B 2 188 ? -49.835 -52.048 -30.543 1.00 60.75 ? 188 VAL B CG1 1 ATOM 1838 C CG2 . VAL B 2 188 ? -48.590 -54.208 -30.782 1.00 63.12 ? 188 VAL B CG2 1 ATOM 1839 N N . LYS B 2 189 ? -52.651 -52.915 -28.783 1.00 56.94 ? 189 LYS B N 1 ATOM 1840 C CA . LYS B 2 189 ? -53.852 -52.118 -28.559 1.00 55.75 ? 189 LYS B CA 1 ATOM 1841 C C . LYS B 2 189 ? -53.451 -50.665 -28.283 1.00 57.69 ? 189 LYS B C 1 ATOM 1842 O O . LYS B 2 189 ? -52.699 -50.404 -27.342 1.00 57.19 ? 189 LYS B O 1 ATOM 1843 C CB . LYS B 2 189 ? -54.696 -52.700 -27.411 1.00 59.05 ? 189 LYS B CB 1 ATOM 1844 C CG . LYS B 2 189 ? -56.178 -52.388 -27.564 1.00 71.86 ? 189 LYS B CG 1 ATOM 1845 C CD . LYS B 2 189 ? -56.637 -51.244 -26.685 1.00 80.21 ? 189 LYS B CD 1 ATOM 1846 C CE . LYS B 2 189 ? -57.976 -50.708 -27.130 1.00 90.13 ? 189 LYS B CE 1 ATOM 1847 N NZ . LYS B 2 189 ? -59.097 -51.536 -26.619 1.00 100.29 ? 189 LYS B NZ 1 ATOM 1848 N N . ILE B 2 190 ? -53.929 -49.729 -29.122 1.00 52.97 ? 190 ILE B N 1 ATOM 1849 C CA . ILE B 2 190 ? -53.638 -48.298 -28.984 1.00 51.64 ? 190 ILE B CA 1 ATOM 1850 C C . ILE B 2 190 ? -54.894 -47.588 -28.459 1.00 54.88 ? 190 ILE B C 1 ATOM 1851 O O . ILE B 2 190 ? -55.902 -47.520 -29.167 1.00 54.49 ? 190 ILE B O 1 ATOM 1852 C CB . ILE B 2 190 ? -53.076 -47.678 -30.308 1.00 54.27 ? 190 ILE B CB 1 ATOM 1853 C CG1 . ILE B 2 190 ? -51.817 -48.431 -30.800 1.00 54.97 ? 190 ILE B CG1 1 ATOM 1854 C CG2 . ILE B 2 190 ? -52.782 -46.178 -30.153 1.00 54.38 ? 190 ILE B CG2 1 ATOM 1855 C CD1 . ILE B 2 190 ? -51.817 -48.753 -32.287 1.00 62.38 ? 190 ILE B CD1 1 ATOM 1856 N N . THR B 2 191 ? -54.840 -47.103 -27.201 1.00 51.23 ? 191 THR B N 1 ATOM 1857 C CA . THR B 2 191 ? -55.949 -46.394 -26.556 1.00 51.02 ? 191 THR B CA 1 ATOM 1858 C C . THR B 2 191 ? -55.754 -44.890 -26.732 1.00 54.30 ? 191 THR B C 1 ATOM 1859 O O . THR B 2 191 ? -54.814 -44.311 -26.183 1.00 53.76 ? 191 THR B O 1 ATOM 1860 C CB . THR B 2 191 ? -56.148 -46.850 -25.098 1.00 59.60 ? 191 THR B CB 1 ATOM 1861 O OG1 . THR B 2 191 ? -56.112 -48.276 -25.041 1.00 59.99 ? 191 THR B OG1 1 ATOM 1862 C CG2 . THR B 2 191 ? -57.467 -46.370 -24.514 1.00 58.45 ? 191 THR B CG2 1 ATOM 1863 N N . VAL B 2 192 ? -56.639 -44.276 -27.527 1.00 50.78 ? 192 VAL B N 1 ATOM 1864 C CA . VAL B 2 192 ? -56.625 -42.859 -27.883 1.00 50.48 ? 192 VAL B CA 1 ATOM 1865 C C . VAL B 2 192 ? -56.850 -41.880 -26.709 1.00 54.55 ? 192 VAL B C 1 ATOM 1866 O O . VAL B 2 192 ? -56.189 -40.840 -26.664 1.00 54.16 ? 192 VAL B O 1 ATOM 1867 C CB . VAL B 2 192 ? -57.486 -42.603 -29.156 1.00 54.57 ? 192 VAL B CB 1 ATOM 1868 C CG1 . VAL B 2 192 ? -58.608 -41.590 -28.931 1.00 54.90 ? 192 VAL B CG1 1 ATOM 1869 C CG2 . VAL B 2 192 ? -56.614 -42.219 -30.346 1.00 54.28 ? 192 VAL B CG2 1 ATOM 1870 N N . ASN B 2 193 ? -57.751 -42.233 -25.758 1.00 51.48 ? 193 ASN B N 1 ATOM 1871 C CA . ASN B 2 193 ? -58.116 -41.440 -24.571 1.00 51.83 ? 193 ASN B CA 1 ATOM 1872 C C . ASN B 2 193 ? -58.576 -39.999 -24.879 1.00 55.67 ? 193 ASN B C 1 ATOM 1873 O O . ASN B 2 193 ? -58.210 -39.057 -24.170 1.00 55.70 ? 193 ASN B O 1 ATOM 1874 C CB . ASN B 2 193 ? -57.013 -41.483 -23.495 1.00 53.43 ? 193 ASN B CB 1 ATOM 1875 C CG . ASN B 2 193 ? -56.872 -42.789 -22.748 1.00 79.04 ? 193 ASN B CG 1 ATOM 1876 O OD1 . ASN B 2 193 ? -55.852 -43.035 -22.099 1.00 74.56 ? 193 ASN B OD1 1 ATOM 1877 N ND2 . ASN B 2 193 ? -57.908 -43.619 -22.742 1.00 71.28 ? 193 ASN B ND2 1 ATOM 1878 N N . GLY B 2 194 ? -59.386 -39.859 -25.928 1.00 52.09 ? 194 GLY B N 1 ATOM 1879 C CA . GLY B 2 194 ? -59.931 -38.582 -26.380 1.00 52.52 ? 194 GLY B CA 1 ATOM 1880 C C . GLY B 2 194 ? -58.904 -37.613 -26.934 1.00 56.41 ? 194 GLY B C 1 ATOM 1881 O O . GLY B 2 194 ? -59.067 -36.397 -26.805 1.00 56.86 ? 194 GLY B O 1 ATOM 1882 N N . GLN B 2 195 ? -57.839 -38.151 -27.555 1.00 52.23 ? 195 GLN B N 1 ATOM 1883 C CA . GLN B 2 195 ? -56.736 -37.384 -28.143 1.00 52.15 ? 195 GLN B CA 1 ATOM 1884 C C . GLN B 2 195 ? -56.472 -37.832 -29.585 1.00 55.87 ? 195 GLN B C 1 ATOM 1885 O O . GLN B 2 195 ? -56.953 -38.886 -30.001 1.00 54.90 ? 195 GLN B O 1 ATOM 1886 C CB . GLN B 2 195 ? -55.453 -37.564 -27.307 1.00 53.15 ? 195 GLN B CB 1 ATOM 1887 C CG . GLN B 2 195 ? -55.513 -36.976 -25.899 1.00 67.71 ? 195 GLN B CG 1 ATOM 1888 C CD . GLN B 2 195 ? -54.336 -37.409 -25.061 1.00 86.05 ? 195 GLN B CD 1 ATOM 1889 O OE1 . GLN B 2 195 ? -54.175 -38.589 -24.726 1.00 80.63 ? 195 GLN B OE1 1 ATOM 1890 N NE2 . GLN B 2 195 ? -53.495 -36.458 -24.686 1.00 79.05 ? 195 GLN B NE2 1 ATOM 1891 N N . THR B 2 196 ? -55.703 -37.035 -30.341 1.00 53.14 ? 196 THR B N 1 ATOM 1892 C CA . THR B 2 196 ? -55.328 -37.363 -31.714 1.00 52.98 ? 196 THR B CA 1 ATOM 1893 C C . THR B 2 196 ? -53.923 -37.974 -31.644 1.00 56.32 ? 196 THR B C 1 ATOM 1894 O O . THR B 2 196 ? -52.962 -37.275 -31.316 1.00 56.24 ? 196 THR B O 1 ATOM 1895 C CB . THR B 2 196 ? -55.482 -36.133 -32.624 1.00 62.80 ? 196 THR B CB 1 ATOM 1896 O OG1 . THR B 2 196 ? -56.782 -35.567 -32.437 1.00 63.66 ? 196 THR B OG1 1 ATOM 1897 C CG2 . THR B 2 196 ? -55.290 -36.466 -34.086 1.00 61.59 ? 196 THR B CG2 1 ATOM 1898 N N . VAL B 2 197 ? -53.827 -39.296 -31.883 1.00 52.21 ? 197 VAL B N 1 ATOM 1899 C CA . VAL B 2 197 ? -52.587 -40.074 -31.778 1.00 51.53 ? 197 VAL B CA 1 ATOM 1900 C C . VAL B 2 197 ? -52.055 -40.523 -33.148 1.00 55.76 ? 197 VAL B C 1 ATOM 1901 O O . VAL B 2 197 ? -52.803 -41.094 -33.944 1.00 55.33 ? 197 VAL B O 1 ATOM 1902 C CB . VAL B 2 197 ? -52.765 -41.275 -30.792 1.00 54.87 ? 197 VAL B CB 1 ATOM 1903 C CG1 . VAL B 2 197 ? -51.503 -42.133 -30.697 1.00 54.42 ? 197 VAL B CG1 1 ATOM 1904 C CG2 . VAL B 2 197 ? -53.193 -40.801 -29.402 1.00 54.81 ? 197 VAL B CG2 1 ATOM 1905 N N . ARG B 2 198 ? -50.755 -40.281 -33.402 1.00 52.81 ? 198 ARG B N 1 ATOM 1906 C CA . ARG B 2 198 ? -50.068 -40.706 -34.621 1.00 53.01 ? 198 ARG B CA 1 ATOM 1907 C C . ARG B 2 198 ? -49.276 -41.983 -34.290 1.00 56.87 ? 198 ARG B C 1 ATOM 1908 O O . ARG B 2 198 ? -48.444 -41.969 -33.376 1.00 56.12 ? 198 ARG B O 1 ATOM 1909 C CB . ARG B 2 198 ? -49.148 -39.594 -35.146 1.00 53.91 ? 198 ARG B CB 1 ATOM 1910 C CG . ARG B 2 198 ? -48.861 -39.714 -36.636 1.00 64.83 ? 198 ARG B CG 1 ATOM 1911 C CD . ARG B 2 198 ? -47.871 -38.669 -37.126 1.00 75.22 ? 198 ARG B CD 1 ATOM 1912 N NE . ARG B 2 198 ? -48.411 -37.306 -37.090 1.00 84.83 ? 198 ARG B NE 1 ATOM 1913 C CZ . ARG B 2 198 ? -49.110 -36.742 -38.072 1.00 100.44 ? 198 ARG B CZ 1 ATOM 1914 N NH1 . ARG B 2 198 ? -49.378 -37.420 -39.182 1.00 88.04 ? 198 ARG B NH1 1 ATOM 1915 N NH2 . ARG B 2 198 ? -49.543 -35.494 -37.953 1.00 88.50 ? 198 ARG B NH2 1 ATOM 1916 N N . TYR B 2 199 ? -49.566 -43.091 -35.002 1.00 54.07 ? 199 TYR B N 1 ATOM 1917 C CA . TYR B 2 199 ? -48.934 -44.391 -34.747 1.00 54.09 ? 199 TYR B CA 1 ATOM 1918 C C . TYR B 2 199 ? -48.242 -45.045 -35.952 1.00 59.04 ? 199 TYR B C 1 ATOM 1919 O O . TYR B 2 199 ? -48.688 -44.878 -37.089 1.00 59.07 ? 199 TYR B O 1 ATOM 1920 C CB . TYR B 2 199 ? -49.931 -45.361 -34.076 1.00 55.24 ? 199 TYR B CB 1 ATOM 1921 C CG . TYR B 2 199 ? -51.015 -45.892 -34.993 1.00 57.55 ? 199 TYR B CG 1 ATOM 1922 C CD1 . TYR B 2 199 ? -52.173 -45.156 -35.238 1.00 59.59 ? 199 TYR B CD1 1 ATOM 1923 C CD2 . TYR B 2 199 ? -50.901 -47.146 -35.587 1.00 58.96 ? 199 TYR B CD2 1 ATOM 1924 C CE1 . TYR B 2 199 ? -53.170 -45.636 -36.086 1.00 61.03 ? 199 TYR B CE1 1 ATOM 1925 C CE2 . TYR B 2 199 ? -51.894 -47.640 -36.432 1.00 60.57 ? 199 TYR B CE2 1 ATOM 1926 C CZ . TYR B 2 199 ? -53.029 -46.883 -36.675 1.00 68.14 ? 199 TYR B CZ 1 ATOM 1927 O OH . TYR B 2 199 ? -54.016 -47.370 -37.497 1.00 70.22 ? 199 TYR B OH 1 ATOM 1928 N N . LYS B 2 200 ? -47.173 -45.826 -35.679 1.00 56.24 ? 200 LYS B N 1 ATOM 1929 C CA . LYS B 2 200 ? -46.379 -46.556 -36.672 1.00 56.99 ? 200 LYS B CA 1 ATOM 1930 C C . LYS B 2 200 ? -45.920 -47.903 -36.092 1.00 61.91 ? 200 LYS B C 1 ATOM 1931 O O . LYS B 2 200 ? -45.296 -47.927 -35.030 1.00 61.24 ? 200 LYS B O 1 ATOM 1932 C CB . LYS B 2 200 ? -45.179 -45.704 -37.124 1.00 59.67 ? 200 LYS B CB 1 ATOM 1933 C CG . LYS B 2 200 ? -44.634 -46.049 -38.501 1.00 74.70 ? 200 LYS B CG 1 ATOM 1934 C CD . LYS B 2 200 ? -43.636 -44.989 -38.964 1.00 84.92 ? 200 LYS B CD 1 ATOM 1935 C CE . LYS B 2 200 ? -42.925 -45.363 -40.240 1.00 96.61 ? 200 LYS B CE 1 ATOM 1936 N NZ . LYS B 2 200 ? -43.806 -45.223 -41.425 1.00 106.70 ? 200 LYS B NZ 1 ATOM 1937 N N . CYS B 2 201 ? -46.250 -49.017 -36.779 1.00 59.92 ? 201 CYS B N 1 ATOM 1938 C CA . CYS B 2 201 ? -45.904 -50.383 -36.363 1.00 60.82 ? 201 CYS B CA 1 ATOM 1939 C C . CYS B 2 201 ? -45.041 -51.104 -37.401 1.00 66.90 ? 201 CYS B C 1 ATOM 1940 O O . CYS B 2 201 ? -45.239 -50.915 -38.601 1.00 66.85 ? 201 CYS B O 1 ATOM 1941 C CB . CYS B 2 201 ? -47.162 -51.185 -36.036 1.00 61.36 ? 201 CYS B CB 1 ATOM 1942 S SG . CYS B 2 201 ? -47.978 -50.699 -34.493 1.00 64.25 ? 201 CYS B SG 1 ATOM 1943 N N . ASN B 2 202 ? -44.108 -51.961 -36.940 1.00 65.11 ? 202 ASN B N 1 ATOM 1944 C CA . ASN B 2 202 ? -43.234 -52.744 -37.823 1.00 66.67 ? 202 ASN B CA 1 ATOM 1945 C C . ASN B 2 202 ? -43.913 -54.082 -38.185 1.00 72.96 ? 202 ASN B C 1 ATOM 1946 O O . ASN B 2 202 ? -43.298 -55.150 -38.106 1.00 73.87 ? 202 ASN B O 1 ATOM 1947 C CB . ASN B 2 202 ? -41.848 -52.951 -37.182 1.00 67.97 ? 202 ASN B CB 1 ATOM 1948 C CG . ASN B 2 202 ? -40.677 -52.894 -38.145 1.00 92.94 ? 202 ASN B CG 1 ATOM 1949 O OD1 . ASN B 2 202 ? -40.779 -53.199 -39.343 1.00 88.65 ? 202 ASN B OD1 1 ATOM 1950 N ND2 . ASN B 2 202 ? -39.523 -52.489 -37.637 1.00 84.84 ? 202 ASN B ND2 1 ATOM 1951 N N . CYS B 2 203 ? -45.201 -54.004 -38.575 1.00 70.21 ? 203 CYS B N 1 ATOM 1952 C CA . CYS B 2 203 ? -46.058 -55.131 -38.948 1.00 71.81 ? 203 CYS B CA 1 ATOM 1953 C C . CYS B 2 203 ? -46.880 -54.807 -40.203 1.00 76.95 ? 203 CYS B C 1 ATOM 1954 O O . CYS B 2 203 ? -46.984 -53.640 -40.589 1.00 75.48 ? 203 CYS B O 1 ATOM 1955 C CB . CYS B 2 203 ? -46.957 -55.524 -37.778 1.00 71.88 ? 203 CYS B CB 1 ATOM 1956 S SG . CYS B 2 203 ? -46.067 -56.151 -36.330 1.00 76.05 ? 203 CYS B SG 1 ATOM 1957 N N . GLY B 2 204 ? -47.460 -55.842 -40.813 1.00 75.91 ? 204 GLY B N 1 ATOM 1958 C CA . GLY B 2 204 ? -48.286 -55.721 -42.010 1.00 76.89 ? 204 GLY B CA 1 ATOM 1959 C C . GLY B 2 204 ? -49.690 -55.208 -41.749 1.00 80.65 ? 204 GLY B C 1 ATOM 1960 O O . GLY B 2 204 ? -50.070 -54.964 -40.599 1.00 78.95 ? 204 GLY B O 1 ATOM 1961 N N . GLY B 2 205 ? -50.455 -55.052 -42.827 1.00 78.73 ? 205 GLY B N 1 ATOM 1962 C CA . GLY B 2 205 ? -51.831 -54.572 -42.782 1.00 78.50 ? 205 GLY B CA 1 ATOM 1963 C C . GLY B 2 205 ? -51.936 -53.067 -42.646 1.00 81.24 ? 205 GLY B C 1 ATOM 1964 O O . GLY B 2 205 ? -51.745 -52.342 -43.626 1.00 81.14 ? 205 GLY B O 1 ATOM 1965 N N . SER B 2 206 ? -52.245 -52.591 -41.424 1.00 76.64 ? 206 SER B N 1 ATOM 1966 C CA . SER B 2 206 ? -52.383 -51.166 -41.112 1.00 75.16 ? 206 SER B CA 1 ATOM 1967 C C . SER B 2 206 ? -51.326 -50.726 -40.097 1.00 77.84 ? 206 SER B C 1 ATOM 1968 O O . SER B 2 206 ? -51.217 -51.319 -39.020 1.00 76.99 ? 206 SER B O 1 ATOM 1969 C CB . SER B 2 206 ? -53.788 -50.859 -40.600 1.00 78.47 ? 206 SER B CB 1 ATOM 1970 O OG . SER B 2 206 ? -53.980 -49.468 -40.402 1.00 86.33 ? 206 SER B OG 1 ATOM 1971 N N . ASN B 2 207 ? -50.536 -49.696 -40.458 1.00 74.06 ? 207 ASN B N 1 ATOM 1972 C CA . ASN B 2 207 ? -49.461 -49.159 -39.619 1.00 72.85 ? 207 ASN B CA 1 ATOM 1973 C C . ASN B 2 207 ? -49.234 -47.652 -39.786 1.00 76.03 ? 207 ASN B C 1 ATOM 1974 O O . ASN B 2 207 ? -48.217 -47.127 -39.335 1.00 75.04 ? 207 ASN B O 1 ATOM 1975 C CB . ASN B 2 207 ? -48.159 -49.948 -39.822 1.00 74.47 ? 207 ASN B CB 1 ATOM 1976 C CG . ASN B 2 207 ? -47.685 -50.028 -41.254 1.00 99.12 ? 207 ASN B CG 1 ATOM 1977 O OD1 . ASN B 2 207 ? -47.200 -49.051 -41.837 1.00 93.58 ? 207 ASN B OD1 1 ATOM 1978 N ND2 . ASN B 2 207 ? -47.799 -51.208 -41.844 1.00 92.27 ? 207 ASN B ND2 1 ATOM 1979 N N . GLU B 2 208 ? -50.166 -46.954 -40.430 1.00 72.84 ? 208 GLU B N 1 ATOM 1980 C CA . GLU B 2 208 ? -50.032 -45.510 -40.576 1.00 72.35 ? 208 GLU B CA 1 ATOM 1981 C C . GLU B 2 208 ? -51.276 -44.806 -40.049 1.00 75.54 ? 208 GLU B C 1 ATOM 1982 O O . GLU B 2 208 ? -52.160 -45.453 -39.477 1.00 74.91 ? 208 GLU B O 1 ATOM 1983 C CB . GLU B 2 208 ? -49.638 -45.099 -42.015 1.00 74.97 ? 208 GLU B CB 1 ATOM 1984 C CG . GLU B 2 208 ? -50.677 -45.360 -43.095 1.00 87.11 ? 208 GLU B CG 1 ATOM 1985 C CD . GLU B 2 208 ? -50.276 -44.902 -44.485 1.00 109.02 ? 208 GLU B CD 1 ATOM 1986 O OE1 . GLU B 2 208 ? -49.814 -43.746 -44.628 1.00 103.43 ? 208 GLU B OE1 1 ATOM 1987 O OE2 . GLU B 2 208 ? -50.451 -45.692 -45.440 1.00 104.00 ? 208 GLU B OE2 1 ATOM 1988 N N . GLY B 2 209 ? -51.307 -43.491 -40.191 1.00 71.90 ? 209 GLY B N 1 ATOM 1989 C CA . GLY B 2 209 ? -52.457 -42.704 -39.790 1.00 71.50 ? 209 GLY B CA 1 ATOM 1990 C C . GLY B 2 209 ? -52.349 -41.928 -38.502 1.00 73.92 ? 209 GLY B C 1 ATOM 1991 O O . GLY B 2 209 ? -51.525 -42.213 -37.626 1.00 72.60 ? 209 GLY B O 1 ATOM 1992 N N . LEU B 2 210 ? -53.222 -40.928 -38.437 1.00 70.54 ? 210 LEU B N 1 ATOM 1993 C CA . LEU B 2 210 ? -53.499 -39.962 -37.391 1.00 69.82 ? 210 LEU B CA 1 ATOM 1994 C C . LEU B 2 210 ? -54.926 -40.377 -36.991 1.00 72.96 ? 210 LEU B C 1 ATOM 1995 O O . LEU B 2 210 ? -55.855 -40.238 -37.795 1.00 73.39 ? 210 LEU B O 1 ATOM 1996 C CB . LEU B 2 210 ? -53.479 -38.580 -38.088 1.00 71.10 ? 210 LEU B CB 1 ATOM 1997 C CG . LEU B 2 210 ? -53.820 -37.344 -37.282 1.00 76.16 ? 210 LEU B CG 1 ATOM 1998 C CD1 . LEU B 2 210 ? -52.583 -36.635 -36.854 1.00 76.34 ? 210 LEU B CD1 1 ATOM 1999 C CD2 . LEU B 2 210 ? -54.689 -36.394 -38.086 1.00 80.24 ? 210 LEU B CD2 1 ATOM 2000 N N . THR B 2 211 ? -55.080 -40.981 -35.802 1.00 68.15 ? 211 THR B N 1 ATOM 2001 C CA . THR B 2 211 ? -56.367 -41.514 -35.350 1.00 67.69 ? 211 THR B CA 1 ATOM 2002 C C . THR B 2 211 ? -57.026 -40.750 -34.200 1.00 70.90 ? 211 THR B C 1 ATOM 2003 O O . THR B 2 211 ? -56.343 -40.313 -33.273 1.00 69.99 ? 211 THR B O 1 ATOM 2004 C CB . THR B 2 211 ? -56.280 -43.043 -35.157 1.00 74.99 ? 211 THR B CB 1 ATOM 2005 O OG1 . THR B 2 211 ? -57.591 -43.575 -34.979 1.00 74.76 ? 211 THR B OG1 1 ATOM 2006 C CG2 . THR B 2 211 ? -55.381 -43.451 -33.989 1.00 72.70 ? 211 THR B CG2 1 ATOM 2007 N N . THR B 2 212 ? -58.358 -40.597 -34.272 1.00 67.73 ? 212 THR B N 1 ATOM 2008 C CA . THR B 2 212 ? -59.170 -39.922 -33.255 1.00 67.52 ? 212 THR B CA 1 ATOM 2009 C C . THR B 2 212 ? -59.940 -40.977 -32.435 1.00 70.51 ? 212 THR B C 1 ATOM 2010 O O . THR B 2 212 ? -60.628 -40.639 -31.469 1.00 70.19 ? 212 THR B O 1 ATOM 2011 C CB . THR B 2 212 ? -60.095 -38.867 -33.905 1.00 76.91 ? 212 THR B CB 1 ATOM 2012 O OG1 . THR B 2 212 ? -59.524 -38.395 -35.126 1.00 77.35 ? 212 THR B OG1 1 ATOM 2013 C CG2 . THR B 2 212 ? -60.382 -37.692 -32.982 1.00 76.02 ? 212 THR B CG2 1 ATOM 2014 N N . THR B 2 213 ? -59.802 -42.260 -32.829 1.00 66.51 ? 213 THR B N 1 ATOM 2015 C CA . THR B 2 213 ? -60.445 -43.423 -32.204 1.00 66.16 ? 213 THR B CA 1 ATOM 2016 C C . THR B 2 213 ? -59.416 -44.522 -31.883 1.00 69.21 ? 213 THR B C 1 ATOM 2017 O O . THR B 2 213 ? -58.309 -44.503 -32.428 1.00 68.47 ? 213 THR B O 1 ATOM 2018 C CB . THR B 2 213 ? -61.571 -43.966 -33.110 1.00 74.95 ? 213 THR B CB 1 ATOM 2019 O OG1 . THR B 2 213 ? -61.058 -44.230 -34.417 1.00 74.89 ? 213 THR B OG1 1 ATOM 2020 C CG2 . THR B 2 213 ? -62.781 -43.033 -33.187 1.00 74.11 ? 213 THR B CG2 1 ATOM 2021 N N . ASP B 2 214 ? -59.790 -45.480 -31.005 1.00 65.71 ? 214 ASP B N 1 ATOM 2022 C CA . ASP B 2 214 ? -58.947 -46.611 -30.600 1.00 65.34 ? 214 ASP B CA 1 ATOM 2023 C C . ASP B 2 214 ? -58.700 -47.570 -31.768 1.00 69.27 ? 214 ASP B C 1 ATOM 2024 O O . ASP B 2 214 ? -59.627 -47.871 -32.524 1.00 69.53 ? 214 ASP B O 1 ATOM 2025 C CB . ASP B 2 214 ? -59.578 -47.368 -29.414 1.00 67.62 ? 214 ASP B CB 1 ATOM 2026 C CG . ASP B 2 214 ? -59.425 -46.713 -28.049 1.00 77.62 ? 214 ASP B CG 1 ATOM 2027 O OD1 . ASP B 2 214 ? -59.126 -45.497 -27.997 1.00 77.82 ? 214 ASP B OD1 1 ATOM 2028 O OD2 . ASP B 2 214 ? -59.627 -47.410 -27.033 1.00 83.92 ? 214 ASP B OD2 1 ATOM 2029 N N . LYS B 2 215 ? -57.446 -48.033 -31.920 1.00 65.35 ? 215 LYS B N 1 ATOM 2030 C CA . LYS B 2 215 ? -57.043 -48.954 -32.986 1.00 65.65 ? 215 LYS B CA 1 ATOM 2031 C C . LYS B 2 215 ? -56.331 -50.193 -32.441 1.00 69.52 ? 215 LYS B C 1 ATOM 2032 O O . LYS B 2 215 ? -55.622 -50.108 -31.436 1.00 68.64 ? 215 LYS B O 1 ATOM 2033 C CB . LYS B 2 215 ? -56.173 -48.242 -34.038 1.00 67.92 ? 215 LYS B CB 1 ATOM 2034 C CG . LYS B 2 215 ? -56.822 -48.194 -35.415 1.00 83.76 ? 215 LYS B CG 1 ATOM 2035 C CD . LYS B 2 215 ? -57.318 -46.803 -35.760 1.00 94.29 ? 215 LYS B CD 1 ATOM 2036 C CE . LYS B 2 215 ? -58.209 -46.794 -36.975 1.00 107.05 ? 215 LYS B CE 1 ATOM 2037 N NZ . LYS B 2 215 ? -58.420 -45.417 -37.492 1.00 116.65 ? 215 LYS B NZ 1 ATOM 2038 N N . VAL B 2 216 ? -56.524 -51.341 -33.114 1.00 66.91 ? 216 VAL B N 1 ATOM 2039 C CA . VAL B 2 216 ? -55.911 -52.617 -32.741 1.00 67.50 ? 216 VAL B CA 1 ATOM 2040 C C . VAL B 2 216 ? -55.066 -53.199 -33.892 1.00 71.77 ? 216 VAL B C 1 ATOM 2041 O O . VAL B 2 216 ? -55.495 -53.177 -35.048 1.00 71.77 ? 216 VAL B O 1 ATOM 2042 C CB . VAL B 2 216 ? -56.932 -53.616 -32.114 1.00 72.57 ? 216 VAL B CB 1 ATOM 2043 C CG1 . VAL B 2 216 ? -57.913 -54.178 -33.145 1.00 73.58 ? 216 VAL B CG1 1 ATOM 2044 C CG2 . VAL B 2 216 ? -56.231 -54.736 -31.350 1.00 73.38 ? 216 VAL B CG2 1 ATOM 2045 N N . ILE B 2 217 ? -53.843 -53.659 -33.570 1.00 68.33 ? 217 ILE B N 1 ATOM 2046 C CA . ILE B 2 217 ? -52.903 -54.247 -34.529 1.00 68.82 ? 217 ILE B CA 1 ATOM 2047 C C . ILE B 2 217 ? -52.642 -55.706 -34.123 1.00 74.15 ? 217 ILE B C 1 ATOM 2048 O O . ILE B 2 217 ? -51.903 -55.962 -33.167 1.00 73.71 ? 217 ILE B O 1 ATOM 2049 C CB . ILE B 2 217 ? -51.584 -53.409 -34.680 1.00 70.89 ? 217 ILE B CB 1 ATOM 2050 C CG1 . ILE B 2 217 ? -51.815 -51.861 -34.728 1.00 69.84 ? 217 ILE B CG1 1 ATOM 2051 C CG2 . ILE B 2 217 ? -50.699 -53.913 -35.835 1.00 72.48 ? 217 ILE B CG2 1 ATOM 2052 C CD1 . ILE B 2 217 ? -52.691 -51.263 -35.910 1.00 77.19 ? 217 ILE B CD1 1 ATOM 2053 N N . ASN B 2 218 ? -53.281 -56.653 -34.832 1.00 72.24 ? 218 ASN B N 1 ATOM 2054 C CA . ASN B 2 218 ? -53.145 -58.087 -34.570 1.00 74.05 ? 218 ASN B CA 1 ATOM 2055 C C . ASN B 2 218 ? -51.817 -58.637 -35.088 1.00 78.66 ? 218 ASN B C 1 ATOM 2056 O O . ASN B 2 218 ? -51.320 -58.178 -36.120 1.00 77.71 ? 218 ASN B O 1 ATOM 2057 C CB . ASN B 2 218 ? -54.329 -58.864 -35.142 1.00 76.53 ? 218 ASN B CB 1 ATOM 2058 C CG . ASN B 2 218 ? -55.612 -58.639 -34.383 1.00 99.65 ? 218 ASN B CG 1 ATOM 2059 O OD1 . ASN B 2 218 ? -56.292 -57.621 -34.548 1.00 92.79 ? 218 ASN B OD1 1 ATOM 2060 N ND2 . ASN B 2 218 ? -55.972 -59.588 -33.532 1.00 93.05 ? 218 ASN B ND2 1 ATOM 2061 N N . ASN B 2 219 ? -51.250 -59.624 -34.357 1.00 76.69 ? 219 ASN B N 1 ATOM 2062 C CA . ASN B 2 219 ? -49.971 -60.297 -34.632 1.00 77.75 ? 219 ASN B CA 1 ATOM 2063 C C . ASN B 2 219 ? -48.790 -59.313 -34.705 1.00 79.72 ? 219 ASN B C 1 ATOM 2064 O O . ASN B 2 219 ? -48.031 -59.297 -35.680 1.00 79.55 ? 219 ASN B O 1 ATOM 2065 C CB . ASN B 2 219 ? -50.058 -61.235 -35.852 1.00 81.10 ? 219 ASN B CB 1 ATOM 2066 C CG . ASN B 2 219 ? -51.037 -62.372 -35.683 1.00 108.21 ? 219 ASN B CG 1 ATOM 2067 O OD1 . ASN B 2 219 ? -50.925 -63.201 -34.772 1.00 104.61 ? 219 ASN B OD1 1 ATOM 2068 N ND2 . ASN B 2 219 ? -52.010 -62.448 -36.577 1.00 100.87 ? 219 ASN B ND2 1 ATOM 2069 N N . CYS B 2 220 ? -48.657 -58.483 -33.656 1.00 74.52 ? 220 CYS B N 1 ATOM 2070 C CA . CYS B 2 220 ? -47.615 -57.464 -33.525 1.00 72.70 ? 220 CYS B CA 1 ATOM 2071 C C . CYS B 2 220 ? -47.168 -57.343 -32.068 1.00 75.55 ? 220 CYS B C 1 ATOM 2072 O O . CYS B 2 220 ? -47.988 -57.501 -31.159 1.00 75.19 ? 220 CYS B O 1 ATOM 2073 C CB . CYS B 2 220 ? -48.109 -56.126 -34.070 1.00 71.22 ? 220 CYS B CB 1 ATOM 2074 S SG . CYS B 2 220 ? -46.807 -55.076 -34.769 1.00 74.08 ? 220 CYS B SG 1 ATOM 2075 N N . LYS B 2 221 ? -45.868 -57.072 -31.851 1.00 71.46 ? 221 LYS B N 1 ATOM 2076 C CA . LYS B 2 221 ? -45.287 -56.901 -30.517 1.00 71.06 ? 221 LYS B CA 1 ATOM 2077 C C . LYS B 2 221 ? -45.268 -55.415 -30.145 1.00 72.27 ? 221 LYS B C 1 ATOM 2078 O O . LYS B 2 221 ? -45.154 -54.565 -31.031 1.00 70.56 ? 221 LYS B O 1 ATOM 2079 C CB . LYS B 2 221 ? -43.873 -57.501 -30.458 1.00 74.92 ? 221 LYS B CB 1 ATOM 2080 C CG . LYS B 2 221 ? -43.480 -58.001 -29.071 1.00 90.43 ? 221 LYS B CG 1 ATOM 2081 C CD . LYS B 2 221 ? -42.130 -58.710 -29.083 1.00 101.96 ? 221 LYS B CD 1 ATOM 2082 C CE . LYS B 2 221 ? -41.754 -59.278 -27.732 1.00 114.12 ? 221 LYS B CE 1 ATOM 2083 N NZ . LYS B 2 221 ? -42.512 -60.517 -27.410 1.00 125.23 ? 221 LYS B NZ 1 ATOM 2084 N N . VAL B 2 222 ? -45.398 -55.106 -28.838 1.00 68.33 ? 222 VAL B N 1 ATOM 2085 C CA . VAL B 2 222 ? -45.415 -53.736 -28.306 1.00 66.46 ? 222 VAL B CA 1 ATOM 2086 C C . VAL B 2 222 ? -44.110 -52.950 -28.585 1.00 69.29 ? 222 VAL B C 1 ATOM 2087 O O . VAL B 2 222 ? -44.158 -51.732 -28.771 1.00 67.54 ? 222 VAL B O 1 ATOM 2088 C CB . VAL B 2 222 ? -45.900 -53.682 -26.825 1.00 70.75 ? 222 VAL B CB 1 ATOM 2089 C CG1 . VAL B 2 222 ? -44.822 -54.143 -25.842 1.00 71.98 ? 222 VAL B CG1 1 ATOM 2090 C CG2 . VAL B 2 222 ? -46.440 -52.302 -26.454 1.00 69.10 ? 222 VAL B CG2 1 ATOM 2091 N N . ASP B 2 223 ? -42.967 -53.663 -28.659 1.00 66.71 ? 223 ASP B N 1 ATOM 2092 C CA . ASP B 2 223 ? -41.645 -53.095 -28.943 1.00 66.18 ? 223 ASP B CA 1 ATOM 2093 C C . ASP B 2 223 ? -41.507 -52.691 -30.418 1.00 68.51 ? 223 ASP B C 1 ATOM 2094 O O . ASP B 2 223 ? -40.706 -51.811 -30.736 1.00 67.50 ? 223 ASP B O 1 ATOM 2095 C CB . ASP B 2 223 ? -40.536 -54.089 -28.557 1.00 69.91 ? 223 ASP B CB 1 ATOM 2096 C CG . ASP B 2 223 ? -40.540 -54.476 -27.092 1.00 81.94 ? 223 ASP B CG 1 ATOM 2097 O OD1 . ASP B 2 223 ? -39.713 -53.929 -26.333 1.00 82.88 ? 223 ASP B OD1 1 ATOM 2098 O OD2 . ASP B 2 223 ? -41.366 -55.332 -26.707 1.00 88.90 ? 223 ASP B OD2 1 ATOM 2099 N N . GLN B 2 224 ? -42.290 -53.335 -31.309 1.00 64.72 ? 224 GLN B N 1 ATOM 2100 C CA . GLN B 2 224 ? -42.299 -53.085 -32.754 1.00 63.91 ? 224 GLN B CA 1 ATOM 2101 C C . GLN B 2 224 ? -43.117 -51.843 -33.150 1.00 65.67 ? 224 GLN B C 1 ATOM 2102 O O . GLN B 2 224 ? -43.074 -51.442 -34.314 1.00 64.99 ? 224 GLN B O 1 ATOM 2103 C CB . GLN B 2 224 ? -42.821 -54.322 -33.511 1.00 66.47 ? 224 GLN B CB 1 ATOM 2104 C CG . GLN B 2 224 ? -41.837 -55.481 -33.592 1.00 83.99 ? 224 GLN B CG 1 ATOM 2105 C CD . GLN B 2 224 ? -42.409 -56.621 -34.395 1.00 105.25 ? 224 GLN B CD 1 ATOM 2106 O OE1 . GLN B 2 224 ? -43.166 -57.457 -33.888 1.00 101.69 ? 224 GLN B OE1 1 ATOM 2107 N NE2 . GLN B 2 224 ? -42.069 -56.675 -35.672 1.00 98.25 ? 224 GLN B NE2 1 ATOM 2108 N N . CYS B 2 225 ? -43.862 -51.242 -32.198 1.00 61.05 ? 225 CYS B N 1 ATOM 2109 C CA . CYS B 2 225 ? -44.714 -50.075 -32.448 1.00 59.50 ? 225 CYS B CA 1 ATOM 2110 C C . CYS B 2 225 ? -44.221 -48.770 -31.801 1.00 61.37 ? 225 CYS B C 1 ATOM 2111 O O . CYS B 2 225 ? -43.487 -48.802 -30.812 1.00 61.19 ? 225 CYS B O 1 ATOM 2112 C CB . CYS B 2 225 ? -46.163 -50.374 -32.074 1.00 59.86 ? 225 CYS B CB 1 ATOM 2113 S SG . CYS B 2 225 ? -46.931 -51.688 -33.056 1.00 64.88 ? 225 CYS B SG 1 ATOM 2114 N N . HIS B 2 226 ? -44.651 -47.624 -32.370 1.00 56.30 ? 226 HIS B N 1 ATOM 2115 C CA . HIS B 2 226 ? -44.333 -46.264 -31.924 1.00 55.27 ? 226 HIS B CA 1 ATOM 2116 C C . HIS B 2 226 ? -45.615 -45.416 -31.927 1.00 57.84 ? 226 HIS B C 1 ATOM 2117 O O . HIS B 2 226 ? -46.320 -45.377 -32.937 1.00 57.22 ? 226 HIS B O 1 ATOM 2118 C CB . HIS B 2 226 ? -43.256 -45.640 -32.834 1.00 56.12 ? 226 HIS B CB 1 ATOM 2119 C CG . HIS B 2 226 ? -42.887 -44.232 -32.478 1.00 59.31 ? 226 HIS B CG 1 ATOM 2120 N ND1 . HIS B 2 226 ? -43.517 -43.150 -33.069 1.00 60.84 ? 226 HIS B ND1 1 ATOM 2121 C CD2 . HIS B 2 226 ? -41.955 -43.775 -31.611 1.00 61.29 ? 226 HIS B CD2 1 ATOM 2122 C CE1 . HIS B 2 226 ? -42.956 -42.075 -32.540 1.00 60.47 ? 226 HIS B CE1 1 ATOM 2123 N NE2 . HIS B 2 226 ? -42.010 -42.401 -31.658 1.00 61.08 ? 226 HIS B NE2 1 ATOM 2124 N N . ALA B 2 227 ? -45.914 -44.749 -30.796 1.00 53.82 ? 227 ALA B N 1 ATOM 2125 C CA . ALA B 2 227 ? -47.103 -43.907 -30.635 1.00 53.12 ? 227 ALA B CA 1 ATOM 2126 C C . ALA B 2 227 ? -46.754 -42.513 -30.109 1.00 56.54 ? 227 ALA B C 1 ATOM 2127 O O . ALA B 2 227 ? -45.895 -42.384 -29.233 1.00 56.37 ? 227 ALA B O 1 ATOM 2128 C CB . ALA B 2 227 ? -48.100 -44.584 -29.708 1.00 53.83 ? 227 ALA B CB 1 ATOM 2129 N N . ALA B 2 228 ? -47.424 -41.471 -30.647 1.00 52.80 ? 228 ALA B N 1 ATOM 2130 C CA . ALA B 2 228 ? -47.214 -40.071 -30.260 1.00 52.94 ? 228 ALA B CA 1 ATOM 2131 C C . ALA B 2 228 ? -48.501 -39.242 -30.301 1.00 56.60 ? 228 ALA B C 1 ATOM 2132 O O . ALA B 2 228 ? -49.274 -39.358 -31.253 1.00 55.96 ? 228 ALA B O 1 ATOM 2133 C CB . ALA B 2 228 ? -46.149 -39.431 -31.142 1.00 54.12 ? 228 ALA B CB 1 ATOM 2134 N N . VAL B 2 229 ? -48.721 -38.362 -29.349 1.00 53.50 ? 229 VAL B N 1 ATOM 2135 C CA . VAL B 2 229 ? -49.931 -37.559 -29.350 1.00 53.65 ? 229 VAL B CA 1 ATOM 2136 C C . VAL B 2 229 ? -49.709 -36.258 -30.073 1.00 58.37 ? 229 VAL B C 1 ATOM 2137 O O . VAL B 2 229 ? -48.681 -35.650 -29.903 1.00 58.63 ? 229 VAL B O 1 ATOM 2138 C CB . VAL B 2 229 ? -50.354 -37.214 -27.936 1.00 57.85 ? 229 VAL B CB 1 ATOM 2139 C CG1 . VAL B 2 229 ? -51.642 -36.536 -27.933 1.00 58.30 ? 229 VAL B CG1 1 ATOM 2140 C CG2 . VAL B 2 229 ? -50.436 -38.405 -27.120 1.00 57.03 ? 229 VAL B CG2 1 ATOM 2141 N N . THR B 2 230 ? -50.683 -35.815 -30.856 1.00 55.20 ? 230 THR B N 1 ATOM 2142 C CA . THR B 2 230 ? -50.567 -34.556 -31.571 1.00 56.26 ? 230 THR B CA 1 ATOM 2143 C C . THR B 2 230 ? -51.270 -33.357 -30.948 1.00 61.34 ? 230 THR B C 1 ATOM 2144 O O . THR B 2 230 ? -52.462 -33.373 -30.748 1.00 60.63 ? 230 THR B O 1 ATOM 2145 C CB . THR B 2 230 ? -51.135 -34.675 -32.923 1.00 64.07 ? 230 THR B CB 1 ATOM 2146 O OG1 . THR B 2 230 ? -52.489 -34.241 -32.876 1.00 63.54 ? 230 THR B OG1 1 ATOM 2147 C CG2 . THR B 2 230 ? -51.063 -36.056 -33.345 1.00 61.65 ? 230 THR B CG2 1 ATOM 2148 N N . ASN B 2 231 ? -50.511 -32.296 -30.704 1.00 59.45 ? 231 ASN B N 1 ATOM 2149 C CA . ASN B 2 231 ? -50.995 -31.103 -30.040 1.00 60.79 ? 231 ASN B CA 1 ATOM 2150 C C . ASN B 2 231 ? -51.122 -29.908 -30.943 1.00 66.21 ? 231 ASN B C 1 ATOM 2151 O O . ASN B 2 231 ? -50.285 -29.059 -30.917 1.00 66.74 ? 231 ASN B O 1 ATOM 2152 C CB . ASN B 2 231 ? -50.011 -30.719 -28.945 1.00 62.58 ? 231 ASN B CB 1 ATOM 2153 C CG . ASN B 2 231 ? -49.102 -31.861 -28.540 1.00 86.92 ? 231 ASN B CG 1 ATOM 2154 O OD1 . ASN B 2 231 ? -48.104 -32.139 -29.187 1.00 82.46 ? 231 ASN B OD1 1 ATOM 2155 N ND2 . ASN B 2 231 ? -49.428 -32.502 -27.438 1.00 77.78 ? 231 ASN B ND2 1 ATOM 2156 N N . HIS B 2 232 ? -52.166 -29.836 -31.742 1.00 63.21 ? 232 HIS B N 1 ATOM 2157 C CA . HIS B 2 232 ? -52.287 -28.784 -32.730 1.00 65.00 ? 232 HIS B CA 1 ATOM 2158 C C . HIS B 2 232 ? -53.119 -27.643 -32.188 1.00 70.20 ? 232 HIS B C 1 ATOM 2159 O O . HIS B 2 232 ? -53.520 -26.765 -32.916 1.00 71.89 ? 232 HIS B O 1 ATOM 2160 C CB . HIS B 2 232 ? -52.926 -29.320 -34.012 1.00 65.54 ? 232 HIS B CB 1 ATOM 2161 C CG . HIS B 2 232 ? -51.996 -30.099 -34.893 1.00 67.61 ? 232 HIS B CG 1 ATOM 2162 N ND1 . HIS B 2 232 ? -51.041 -30.960 -34.408 1.00 67.77 ? 232 HIS B ND1 1 ATOM 2163 C CD2 . HIS B 2 232 ? -51.888 -30.153 -36.239 1.00 69.64 ? 232 HIS B CD2 1 ATOM 2164 C CE1 . HIS B 2 232 ? -50.389 -31.517 -35.411 1.00 66.55 ? 232 HIS B CE1 1 ATOM 2165 N NE2 . HIS B 2 232 ? -50.882 -31.040 -36.534 1.00 67.93 ? 232 HIS B NE2 1 ATOM 2166 N N . LYS B 2 233 ? -53.373 -27.648 -30.895 1.00 60.97 ? 233 LYS B N 1 ATOM 2167 C CA . LYS B 2 233 ? -54.194 -26.601 -30.323 1.00 61.73 ? 233 LYS B CA 1 ATOM 2168 C C . LYS B 2 233 ? -53.434 -25.440 -29.687 1.00 63.94 ? 233 LYS B C 1 ATOM 2169 O O . LYS B 2 233 ? -53.985 -24.380 -29.507 1.00 64.80 ? 233 LYS B O 1 ATOM 2170 C CB . LYS B 2 233 ? -55.162 -27.192 -29.311 1.00 64.61 ? 233 LYS B CB 1 ATOM 2171 C CG . LYS B 2 233 ? -56.474 -27.587 -29.896 1.00 80.33 ? 233 LYS B CG 1 ATOM 2172 C CD . LYS B 2 233 ? -57.354 -28.234 -28.858 1.00 90.60 ? 233 LYS B CD 1 ATOM 2173 C CE . LYS B 2 233 ? -57.459 -29.737 -29.070 1.00 103.26 ? 233 LYS B CE 1 ATOM 2174 N NZ . LYS B 2 233 ? -58.803 -30.178 -29.553 1.00 112.79 ? 233 LYS B NZ 1 ATOM 2175 N N . LYS B 2 234 ? -52.179 -25.611 -29.325 1.00 57.92 ? 234 LYS B N 1 ATOM 2176 C CA . LYS B 2 234 ? -51.522 -24.502 -28.683 1.00 56.36 ? 234 LYS B CA 1 ATOM 2177 C C . LYS B 2 234 ? -50.214 -24.071 -29.277 1.00 59.24 ? 234 LYS B C 1 ATOM 2178 O O . LYS B 2 234 ? -49.734 -24.659 -30.200 1.00 59.09 ? 234 LYS B O 1 ATOM 2179 C CB . LYS B 2 234 ? -51.417 -24.743 -27.195 1.00 57.11 ? 234 LYS B CB 1 ATOM 2180 C CG . LYS B 2 234 ? -52.742 -24.567 -26.527 1.00 71.15 ? 234 LYS B CG 1 ATOM 2181 C CD . LYS B 2 234 ? -52.641 -24.525 -25.046 1.00 80.88 ? 234 LYS B CD 1 ATOM 2182 C CE . LYS B 2 234 ? -54.002 -24.256 -24.423 1.00 92.54 ? 234 LYS B CE 1 ATOM 2183 N NZ . LYS B 2 234 ? -54.614 -22.961 -24.825 1.00 102.64 ? 234 LYS B NZ 1 ATOM 2184 N N . TRP B 2 235 ? -49.678 -22.994 -28.741 1.00 54.91 ? 235 TRP B N 1 ATOM 2185 C CA . TRP B 2 235 ? -48.461 -22.349 -29.229 1.00 53.96 ? 235 TRP B CA 1 ATOM 2186 C C . TRP B 2 235 ? -47.335 -22.583 -28.231 1.00 55.08 ? 235 TRP B C 1 ATOM 2187 O O . TRP B 2 235 ? -47.587 -22.759 -27.037 1.00 53.89 ? 235 TRP B O 1 ATOM 2188 C CB . TRP B 2 235 ? -48.674 -20.840 -29.448 1.00 54.06 ? 235 TRP B CB 1 ATOM 2189 C CG . TRP B 2 235 ? -48.845 -20.416 -30.881 1.00 57.07 ? 235 TRP B CG 1 ATOM 2190 C CD1 . TRP B 2 235 ? -48.704 -21.192 -31.996 1.00 60.70 ? 235 TRP B CD1 1 ATOM 2191 C CD2 . TRP B 2 235 ? -49.155 -19.096 -31.347 1.00 58.81 ? 235 TRP B CD2 1 ATOM 2192 N NE1 . TRP B 2 235 ? -48.938 -20.444 -33.125 1.00 62.50 ? 235 TRP B NE1 1 ATOM 2193 C CE2 . TRP B 2 235 ? -49.213 -19.152 -32.757 1.00 64.68 ? 235 TRP B CE2 1 ATOM 2194 C CE3 . TRP B 2 235 ? -49.412 -17.870 -30.707 1.00 60.57 ? 235 TRP B CE3 1 ATOM 2195 C CZ2 . TRP B 2 235 ? -49.505 -18.028 -33.540 1.00 66.50 ? 235 TRP B CZ2 1 ATOM 2196 C CZ3 . TRP B 2 235 ? -49.691 -16.755 -31.484 1.00 64.40 ? 235 TRP B CZ3 1 ATOM 2197 C CH2 . TRP B 2 235 ? -49.744 -16.841 -32.882 1.00 67.03 ? 235 TRP B CH2 1 ATOM 2198 N N . GLN B 2 236 ? -46.094 -22.586 -28.725 1.00 50.58 ? 236 GLN B N 1 ATOM 2199 C CA . GLN B 2 236 ? -44.892 -22.825 -27.933 1.00 48.58 ? 236 GLN B CA 1 ATOM 2200 C C . GLN B 2 236 ? -43.745 -22.023 -28.528 1.00 51.86 ? 236 GLN B C 1 ATOM 2201 O O . GLN B 2 236 ? -43.689 -21.882 -29.750 1.00 52.67 ? 236 GLN B O 1 ATOM 2202 C CB . GLN B 2 236 ? -44.556 -24.324 -27.985 1.00 49.44 ? 236 GLN B CB 1 ATOM 2203 C CG . GLN B 2 236 ? -43.732 -24.827 -26.816 1.00 63.87 ? 236 GLN B CG 1 ATOM 2204 C CD . GLN B 2 236 ? -43.629 -26.328 -26.847 1.00 82.53 ? 236 GLN B CD 1 ATOM 2205 O OE1 . GLN B 2 236 ? -42.688 -26.900 -27.405 1.00 78.32 ? 236 GLN B OE1 1 ATOM 2206 N NE2 . GLN B 2 236 ? -44.599 -27.000 -26.245 1.00 74.23 ? 236 GLN B NE2 1 ATOM 2207 N N . TYR B 2 237 ? -42.822 -21.517 -27.682 1.00 46.78 ? 237 TYR B N 1 ATOM 2208 C CA . TYR B 2 237 ? -41.652 -20.759 -28.142 1.00 46.32 ? 237 TYR B CA 1 ATOM 2209 C C . TYR B 2 237 ? -40.838 -21.597 -29.126 1.00 49.89 ? 237 TYR B C 1 ATOM 2210 O O . TYR B 2 237 ? -40.668 -22.799 -28.907 1.00 48.98 ? 237 TYR B O 1 ATOM 2211 C CB . TYR B 2 237 ? -40.776 -20.293 -26.953 1.00 46.31 ? 237 TYR B CB 1 ATOM 2212 C CG . TYR B 2 237 ? -39.390 -19.806 -27.336 1.00 48.05 ? 237 TYR B CG 1 ATOM 2213 C CD1 . TYR B 2 237 ? -39.214 -18.611 -28.028 1.00 50.86 ? 237 TYR B CD1 1 ATOM 2214 C CD2 . TYR B 2 237 ? -38.254 -20.538 -27.000 1.00 48.23 ? 237 TYR B CD2 1 ATOM 2215 C CE1 . TYR B 2 237 ? -37.944 -18.165 -28.392 1.00 51.86 ? 237 TYR B CE1 1 ATOM 2216 C CE2 . TYR B 2 237 ? -36.978 -20.099 -27.354 1.00 49.37 ? 237 TYR B CE2 1 ATOM 2217 C CZ . TYR B 2 237 ? -36.828 -18.911 -28.050 1.00 57.66 ? 237 TYR B CZ 1 ATOM 2218 O OH . TYR B 2 237 ? -35.573 -18.473 -28.401 1.00 59.22 ? 237 TYR B OH 1 ATOM 2219 N N . ASN B 2 238 ? -40.368 -20.966 -30.222 1.00 47.06 ? 238 ASN B N 1 ATOM 2220 C CA . ASN B 2 238 ? -39.550 -21.599 -31.260 1.00 47.57 ? 238 ASN B CA 1 ATOM 2221 C C . ASN B 2 238 ? -38.169 -21.919 -30.653 1.00 49.74 ? 238 ASN B C 1 ATOM 2222 O O . ASN B 2 238 ? -37.177 -21.223 -30.895 1.00 49.71 ? 238 ASN B O 1 ATOM 2223 C CB . ASN B 2 238 ? -39.457 -20.684 -32.495 1.00 50.51 ? 238 ASN B CB 1 ATOM 2224 C CG . ASN B 2 238 ? -38.791 -21.283 -33.715 1.00 75.78 ? 238 ASN B CG 1 ATOM 2225 O OD1 . ASN B 2 238 ? -38.528 -22.489 -33.809 1.00 69.96 ? 238 ASN B OD1 1 ATOM 2226 N ND2 . ASN B 2 238 ? -38.534 -20.441 -34.704 1.00 70.00 ? 238 ASN B ND2 1 ATOM 2227 N N . SER B 2 239 ? -38.147 -22.970 -29.817 1.00 44.64 ? 239 SER B N 1 ATOM 2228 C CA . SER B 2 239 ? -37.000 -23.438 -29.050 1.00 43.44 ? 239 SER B CA 1 ATOM 2229 C C . SER B 2 239 ? -36.089 -24.385 -29.829 1.00 47.68 ? 239 SER B C 1 ATOM 2230 O O . SER B 2 239 ? -36.576 -25.374 -30.382 1.00 47.78 ? 239 SER B O 1 ATOM 2231 C CB . SER B 2 239 ? -37.474 -24.105 -27.760 1.00 45.77 ? 239 SER B CB 1 ATOM 2232 O OG . SER B 2 239 ? -36.436 -24.802 -27.090 1.00 54.27 ? 239 SER B OG 1 ATOM 2233 N N . PRO B 2 240 ? -34.754 -24.154 -29.812 1.00 44.18 ? 240 PRO B N 1 ATOM 2234 C CA . PRO B 2 240 ? -33.845 -25.096 -30.489 1.00 45.27 ? 240 PRO B CA 1 ATOM 2235 C C . PRO B 2 240 ? -33.639 -26.391 -29.688 1.00 48.27 ? 240 PRO B C 1 ATOM 2236 O O . PRO B 2 240 ? -32.989 -27.313 -30.179 1.00 49.11 ? 240 PRO B O 1 ATOM 2237 C CB . PRO B 2 240 ? -32.550 -24.294 -30.640 1.00 47.79 ? 240 PRO B CB 1 ATOM 2238 C CG . PRO B 2 240 ? -32.575 -23.316 -29.525 1.00 50.66 ? 240 PRO B CG 1 ATOM 2239 C CD . PRO B 2 240 ? -34.013 -23.045 -29.171 1.00 45.04 ? 240 PRO B CD 1 ATOM 2240 N N . LEU B 2 241 ? -34.210 -26.459 -28.465 1.00 43.05 ? 241 LEU B N 1 ATOM 2241 C CA . LEU B 2 241 ? -34.134 -27.599 -27.544 1.00 42.54 ? 241 LEU B CA 1 ATOM 2242 C C . LEU B 2 241 ? -35.344 -28.542 -27.682 1.00 46.29 ? 241 LEU B C 1 ATOM 2243 O O . LEU B 2 241 ? -35.394 -29.581 -27.018 1.00 45.85 ? 241 LEU B O 1 ATOM 2244 C CB . LEU B 2 241 ? -34.011 -27.100 -26.087 1.00 41.49 ? 241 LEU B CB 1 ATOM 2245 C CG . LEU B 2 241 ? -32.866 -26.132 -25.761 1.00 46.22 ? 241 LEU B CG 1 ATOM 2246 C CD1 . LEU B 2 241 ? -33.159 -25.355 -24.491 1.00 45.23 ? 241 LEU B CD1 1 ATOM 2247 C CD2 . LEU B 2 241 ? -31.530 -26.859 -25.643 1.00 49.94 ? 241 LEU B CD2 1 ATOM 2248 N N . VAL B 2 242 ? -36.320 -28.168 -28.535 1.00 43.04 ? 242 VAL B N 1 ATOM 2249 C CA . VAL B 2 242 ? -37.554 -28.919 -28.814 1.00 42.91 ? 242 VAL B CA 1 ATOM 2250 C C . VAL B 2 242 ? -37.618 -29.142 -30.348 1.00 48.40 ? 242 VAL B C 1 ATOM 2251 O O . VAL B 2 242 ? -37.322 -28.198 -31.084 1.00 48.53 ? 242 VAL B O 1 ATOM 2252 C CB . VAL B 2 242 ? -38.815 -28.168 -28.276 1.00 45.87 ? 242 VAL B CB 1 ATOM 2253 C CG1 . VAL B 2 242 ? -40.081 -29.008 -28.426 1.00 45.86 ? 242 VAL B CG1 1 ATOM 2254 C CG2 . VAL B 2 242 ? -38.640 -27.737 -26.819 1.00 44.65 ? 242 VAL B CG2 1 ATOM 2255 N N . PRO B 2 243 ? -37.965 -30.350 -30.868 1.00 46.10 ? 243 PRO B N 1 ATOM 2256 C CA . PRO B 2 243 ? -37.994 -30.524 -32.333 1.00 47.78 ? 243 PRO B CA 1 ATOM 2257 C C . PRO B 2 243 ? -39.129 -29.776 -33.035 1.00 52.53 ? 243 PRO B C 1 ATOM 2258 O O . PRO B 2 243 ? -40.135 -29.444 -32.411 1.00 50.99 ? 243 PRO B O 1 ATOM 2259 C CB . PRO B 2 243 ? -38.103 -32.040 -32.512 1.00 50.18 ? 243 PRO B CB 1 ATOM 2260 C CG . PRO B 2 243 ? -38.758 -32.519 -31.280 1.00 53.04 ? 243 PRO B CG 1 ATOM 2261 C CD . PRO B 2 243 ? -38.330 -31.603 -30.171 1.00 47.30 ? 243 PRO B CD 1 ATOM 2262 N N . ARG B 2 244 ? -38.945 -29.491 -34.334 1.00 51.46 ? 244 ARG B N 1 ATOM 2263 C CA . ARG B 2 244 ? -39.925 -28.798 -35.172 1.00 52.56 ? 244 ARG B CA 1 ATOM 2264 C C . ARG B 2 244 ? -41.067 -29.758 -35.529 1.00 57.95 ? 244 ARG B C 1 ATOM 2265 O O . ARG B 2 244 ? -40.861 -30.975 -35.524 1.00 57.71 ? 244 ARG B O 1 ATOM 2266 C CB . ARG B 2 244 ? -39.241 -28.296 -36.454 1.00 54.80 ? 244 ARG B CB 1 ATOM 2267 C CG . ARG B 2 244 ? -39.867 -27.041 -37.054 1.00 64.76 ? 244 ARG B CG 1 ATOM 2268 C CD . ARG B 2 244 ? -39.204 -26.654 -38.363 1.00 74.94 ? 244 ARG B CD 1 ATOM 2269 N NE . ARG B 2 244 ? -37.839 -26.161 -38.166 1.00 81.04 ? 244 ARG B NE 1 ATOM 2270 C CZ . ARG B 2 244 ? -36.998 -25.853 -39.148 1.00 95.74 ? 244 ARG B CZ 1 ATOM 2271 N NH1 . ARG B 2 244 ? -35.777 -25.417 -38.871 1.00 82.40 ? 244 ARG B NH1 1 ATOM 2272 N NH2 . ARG B 2 244 ? -37.368 -25.985 -40.416 1.00 84.51 ? 244 ARG B NH2 1 ATOM 2273 N N . ASN B 2 245 ? -42.265 -29.218 -35.835 1.00 55.75 ? 245 ASN B N 1 ATOM 2274 C CA . ASN B 2 245 ? -43.416 -30.033 -36.227 1.00 56.69 ? 245 ASN B CA 1 ATOM 2275 C C . ASN B 2 245 ? -43.197 -30.526 -37.663 1.00 64.08 ? 245 ASN B C 1 ATOM 2276 O O . ASN B 2 245 ? -42.976 -29.716 -38.567 1.00 65.45 ? 245 ASN B O 1 ATOM 2277 C CB . ASN B 2 245 ? -44.726 -29.252 -36.079 1.00 57.44 ? 245 ASN B CB 1 ATOM 2278 C CG . ASN B 2 245 ? -45.961 -30.119 -36.077 1.00 79.93 ? 245 ASN B CG 1 ATOM 2279 O OD1 . ASN B 2 245 ? -46.361 -30.685 -37.103 1.00 75.55 ? 245 ASN B OD1 1 ATOM 2280 N ND2 . ASN B 2 245 ? -46.609 -30.221 -34.923 1.00 70.34 ? 245 ASN B ND2 1 ATOM 2281 N N . ALA B 2 246 ? -43.198 -31.857 -37.851 1.00 61.73 ? 246 ALA B N 1 ATOM 2282 C CA . ALA B 2 246 ? -42.953 -32.520 -39.135 1.00 64.48 ? 246 ALA B CA 1 ATOM 2283 C C . ALA B 2 246 ? -44.032 -32.299 -40.206 1.00 71.51 ? 246 ALA B C 1 ATOM 2284 O O . ALA B 2 246 ? -43.689 -32.160 -41.382 1.00 73.77 ? 246 ALA B O 1 ATOM 2285 C CB . ALA B 2 246 ? -42.720 -34.006 -38.918 1.00 64.94 ? 246 ALA B CB 1 ATOM 2286 N N . GLU B 2 247 ? -45.322 -32.272 -39.801 1.00 67.99 ? 247 GLU B N 1 ATOM 2287 C CA . GLU B 2 247 ? -46.502 -32.100 -40.669 1.00 70.31 ? 247 GLU B CA 1 ATOM 2288 C C . GLU B 2 247 ? -46.934 -30.629 -40.840 1.00 75.54 ? 247 GLU B C 1 ATOM 2289 O O . GLU B 2 247 ? -48.123 -30.335 -40.983 1.00 76.24 ? 247 GLU B O 1 ATOM 2290 C CB . GLU B 2 247 ? -47.666 -32.944 -40.116 1.00 70.79 ? 247 GLU B CB 1 ATOM 2291 C CG . GLU B 2 247 ? -47.881 -34.259 -40.848 1.00 83.31 ? 247 GLU B CG 1 ATOM 2292 C CD . GLU B 2 247 ? -46.715 -35.231 -40.834 1.00 104.40 ? 247 GLU B CD 1 ATOM 2293 O OE1 . GLU B 2 247 ? -46.546 -35.948 -39.821 1.00 97.62 ? 247 GLU B OE1 1 ATOM 2294 O OE2 . GLU B 2 247 ? -45.982 -35.291 -41.847 1.00 100.87 ? 247 GLU B OE2 1 ATOM 2295 N N . LEU B 2 248 ? -45.956 -29.729 -40.853 1.00 72.21 ? 248 LEU B N 1 ATOM 2296 C CA . LEU B 2 248 ? -46.067 -28.276 -40.949 1.00 72.89 ? 248 LEU B CA 1 ATOM 2297 C C . LEU B 2 248 ? -44.724 -27.826 -41.532 1.00 78.05 ? 248 LEU B C 1 ATOM 2298 O O . LEU B 2 248 ? -43.679 -28.359 -41.137 1.00 76.28 ? 248 LEU B O 1 ATOM 2299 C CB . LEU B 2 248 ? -46.271 -27.762 -39.496 1.00 69.94 ? 248 LEU B CB 1 ATOM 2300 C CG . LEU B 2 248 ? -45.788 -26.386 -39.036 1.00 73.95 ? 248 LEU B CG 1 ATOM 2301 C CD1 . LEU B 2 248 ? -46.723 -25.842 -37.992 1.00 72.73 ? 248 LEU B CD1 1 ATOM 2302 C CD2 . LEU B 2 248 ? -44.390 -26.451 -38.437 1.00 74.48 ? 248 LEU B CD2 1 ATOM 2303 N N . GLY B 2 249 ? -44.761 -26.879 -42.464 1.00 77.42 ? 249 GLY B N 1 ATOM 2304 C CA . GLY B 2 249 ? -43.563 -26.330 -43.091 1.00 78.81 ? 249 GLY B CA 1 ATOM 2305 C C . GLY B 2 249 ? -42.877 -25.304 -42.211 1.00 80.59 ? 249 GLY B C 1 ATOM 2306 O O . GLY B 2 249 ? -42.545 -25.596 -41.059 1.00 77.03 ? 249 GLY B O 1 ATOM 2307 N N . ASP B 2 250 ? -42.668 -24.086 -42.741 1.00 79.02 ? 250 ASP B N 1 ATOM 2308 C CA . ASP B 2 250 ? -42.040 -22.996 -41.989 1.00 77.11 ? 250 ASP B CA 1 ATOM 2309 C C . ASP B 2 250 ? -43.104 -22.064 -41.366 1.00 79.63 ? 250 ASP B C 1 ATOM 2310 O O . ASP B 2 250 ? -42.943 -20.840 -41.362 1.00 79.75 ? 250 ASP B O 1 ATOM 2311 C CB . ASP B 2 250 ? -41.036 -22.228 -42.878 1.00 81.67 ? 250 ASP B CB 1 ATOM 2312 C CG . ASP B 2 250 ? -39.725 -21.867 -42.195 1.00 90.54 ? 250 ASP B CG 1 ATOM 2313 O OD1 . ASP B 2 250 ? -39.756 -21.490 -41.000 1.00 88.10 ? 250 ASP B OD1 1 ATOM 2314 O OD2 . ASP B 2 250 ? -38.671 -21.930 -42.864 1.00 98.47 ? 250 ASP B OD2 1 ATOM 2315 N N . ARG B 2 251 ? -44.188 -22.659 -40.825 1.00 74.65 ? 251 ARG B N 1 ATOM 2316 C CA . ARG B 2 251 ? -45.288 -21.921 -40.201 1.00 73.86 ? 251 ARG B CA 1 ATOM 2317 C C . ARG B 2 251 ? -44.881 -21.417 -38.819 1.00 74.32 ? 251 ARG B C 1 ATOM 2318 O O . ARG B 2 251 ? -44.564 -22.214 -37.932 1.00 71.27 ? 251 ARG B O 1 ATOM 2319 C CB . ARG B 2 251 ? -46.574 -22.766 -40.137 1.00 74.19 ? 251 ARG B CB 1 ATOM 2320 C CG . ARG B 2 251 ? -47.137 -23.151 -41.507 1.00 87.72 ? 251 ARG B CG 1 ATOM 2321 C CD . ARG B 2 251 ? -48.483 -23.853 -41.432 1.00 97.26 ? 251 ARG B CD 1 ATOM 2322 N NE . ARG B 2 251 ? -49.563 -22.962 -40.995 1.00 105.44 ? 251 ARG B NE 1 ATOM 2323 C CZ . ARG B 2 251 ? -50.319 -22.232 -41.809 1.00 122.31 ? 251 ARG B CZ 1 ATOM 2324 N NH1 . ARG B 2 251 ? -50.121 -22.268 -43.122 1.00 112.69 ? 251 ARG B NH1 1 ATOM 2325 N NH2 . ARG B 2 251 ? -51.276 -21.458 -41.318 1.00 109.33 ? 251 ARG B NH2 1 ATOM 2326 N N . LYS B 2 252 ? -44.846 -20.091 -38.655 1.00 71.20 ? 252 LYS B N 1 ATOM 2327 C CA . LYS B 2 252 ? -44.475 -19.463 -37.389 1.00 68.30 ? 252 LYS B CA 1 ATOM 2328 C C . LYS B 2 252 ? -45.351 -18.282 -36.993 1.00 72.71 ? 252 LYS B C 1 ATOM 2329 O O . LYS B 2 252 ? -46.019 -17.692 -37.841 1.00 75.13 ? 252 LYS B O 1 ATOM 2330 C CB . LYS B 2 252 ? -42.955 -19.175 -37.253 1.00 69.73 ? 252 LYS B CB 1 ATOM 2331 C CG . LYS B 2 252 ? -42.202 -18.707 -38.503 1.00 86.79 ? 252 LYS B CG 1 ATOM 2332 C CD . LYS B 2 252 ? -40.700 -18.596 -38.221 1.00 95.68 ? 252 LYS B CD 1 ATOM 2333 C CE . LYS B 2 252 ? -39.878 -18.226 -39.434 1.00 109.86 ? 252 LYS B CE 1 ATOM 2334 N NZ . LYS B 2 252 ? -40.055 -16.801 -39.827 1.00 121.10 ? 252 LYS B NZ 1 ATOM 2335 N N . GLY B 2 253 ? -45.371 -18.006 -35.693 1.00 66.85 ? 253 GLY B N 1 ATOM 2336 C CA . GLY B 2 253 ? -46.097 -16.915 -35.056 1.00 66.96 ? 253 GLY B CA 1 ATOM 2337 C C . GLY B 2 253 ? -45.151 -16.062 -34.235 1.00 68.92 ? 253 GLY B C 1 ATOM 2338 O O . GLY B 2 253 ? -43.993 -16.441 -34.039 1.00 66.80 ? 253 GLY B O 1 ATOM 2339 N N . LYS B 2 254 ? -45.624 -14.902 -33.753 1.00 65.98 ? 254 LYS B N 1 ATOM 2340 C CA . LYS B 2 254 ? -44.803 -14.000 -32.937 1.00 64.25 ? 254 LYS B CA 1 ATOM 2341 C C . LYS B 2 254 ? -45.597 -13.288 -31.847 1.00 67.86 ? 254 LYS B C 1 ATOM 2342 O O . LYS B 2 254 ? -46.753 -12.925 -32.063 1.00 69.49 ? 254 LYS B O 1 ATOM 2343 C CB . LYS B 2 254 ? -43.967 -13.020 -33.792 1.00 68.16 ? 254 LYS B CB 1 ATOM 2344 C CG . LYS B 2 254 ? -44.764 -12.082 -34.699 1.00 85.22 ? 254 LYS B CG 1 ATOM 2345 C CD . LYS B 2 254 ? -43.854 -11.126 -35.457 1.00 96.49 ? 254 LYS B CD 1 ATOM 2346 C CE . LYS B 2 254 ? -44.638 -10.126 -36.269 1.00 110.97 ? 254 LYS B CE 1 ATOM 2347 N NZ . LYS B 2 254 ? -43.746 -9.207 -37.023 1.00 122.10 ? 254 LYS B NZ 1 ATOM 2348 N N . ILE B 2 255 ? -44.987 -13.132 -30.659 1.00 62.17 ? 255 ILE B N 1 ATOM 2349 C CA . ILE B 2 255 ? -45.620 -12.483 -29.504 1.00 61.80 ? 255 ILE B CA 1 ATOM 2350 C C . ILE B 2 255 ? -44.674 -11.458 -28.853 1.00 64.49 ? 255 ILE B C 1 ATOM 2351 O O . ILE B 2 255 ? -43.465 -11.696 -28.801 1.00 62.37 ? 255 ILE B O 1 ATOM 2352 C CB . ILE B 2 255 ? -46.198 -13.519 -28.478 1.00 63.63 ? 255 ILE B CB 1 ATOM 2353 C CG1 . ILE B 2 255 ? -45.089 -14.338 -27.772 1.00 61.39 ? 255 ILE B CG1 1 ATOM 2354 C CG2 . ILE B 2 255 ? -47.254 -14.448 -29.122 1.00 65.66 ? 255 ILE B CG2 1 ATOM 2355 C CD1 . ILE B 2 255 ? -45.429 -14.792 -26.355 1.00 67.67 ? 255 ILE B CD1 1 ATOM 2356 N N . HIS B 2 256 ? -45.218 -10.320 -28.370 1.00 62.20 ? 256 HIS B N 1 ATOM 2357 C CA . HIS B 2 256 ? -44.418 -9.294 -27.691 1.00 61.19 ? 256 HIS B CA 1 ATOM 2358 C C . HIS B 2 256 ? -43.994 -9.799 -26.310 1.00 62.62 ? 256 HIS B C 1 ATOM 2359 O O . HIS B 2 256 ? -44.728 -10.575 -25.692 1.00 61.82 ? 256 HIS B O 1 ATOM 2360 C CB . HIS B 2 256 ? -45.170 -7.955 -27.588 1.00 64.22 ? 256 HIS B CB 1 ATOM 2361 C CG . HIS B 2 256 ? -45.086 -7.095 -28.817 1.00 69.85 ? 256 HIS B CG 1 ATOM 2362 N ND1 . HIS B 2 256 ? -43.878 -6.832 -29.438 1.00 71.04 ? 256 HIS B ND1 1 ATOM 2363 C CD2 . HIS B 2 256 ? -46.064 -6.419 -29.465 1.00 74.65 ? 256 HIS B CD2 1 ATOM 2364 C CE1 . HIS B 2 256 ? -44.163 -6.040 -30.459 1.00 73.16 ? 256 HIS B CE1 1 ATOM 2365 N NE2 . HIS B 2 256 ? -45.464 -5.763 -30.515 1.00 75.79 ? 256 HIS B NE2 1 ATOM 2366 N N . ILE B 2 257 ? -42.792 -9.402 -25.851 1.00 57.80 ? 257 ILE B N 1 ATOM 2367 C CA . ILE B 2 257 ? -42.232 -9.860 -24.572 1.00 55.68 ? 257 ILE B CA 1 ATOM 2368 C C . ILE B 2 257 ? -42.022 -8.750 -23.532 1.00 59.59 ? 257 ILE B C 1 ATOM 2369 O O . ILE B 2 257 ? -41.732 -7.614 -23.921 1.00 59.92 ? 257 ILE B O 1 ATOM 2370 C CB . ILE B 2 257 ? -40.970 -10.752 -24.761 1.00 57.03 ? 257 ILE B CB 1 ATOM 2371 C CG1 . ILE B 2 257 ? -39.821 -9.998 -25.474 1.00 57.43 ? 257 ILE B CG1 1 ATOM 2372 C CG2 . ILE B 2 257 ? -41.336 -12.053 -25.465 1.00 57.75 ? 257 ILE B CG2 1 ATOM 2373 C CD1 . ILE B 2 257 ? -38.403 -10.481 -25.157 1.00 62.72 ? 257 ILE B CD1 1 ATOM 2374 N N . PRO B 2 258 ? -42.131 -9.052 -22.210 1.00 55.56 ? 258 PRO B N 1 ATOM 2375 C CA . PRO B 2 258 ? -41.916 -7.999 -21.208 1.00 55.65 ? 258 PRO B CA 1 ATOM 2376 C C . PRO B 2 258 ? -40.438 -7.679 -20.985 1.00 58.14 ? 258 PRO B C 1 ATOM 2377 O O . PRO B 2 258 ? -39.560 -8.381 -21.493 1.00 56.55 ? 258 PRO B O 1 ATOM 2378 C CB . PRO B 2 258 ? -42.568 -8.583 -19.950 1.00 57.53 ? 258 PRO B CB 1 ATOM 2379 C CG . PRO B 2 258 ? -42.382 -10.044 -20.086 1.00 60.76 ? 258 PRO B CG 1 ATOM 2380 C CD . PRO B 2 258 ? -42.467 -10.342 -21.561 1.00 56.41 ? 258 PRO B CD 1 ATOM 2381 N N . PHE B 2 259 ? -40.181 -6.615 -20.204 1.00 55.03 ? 259 PHE B N 1 ATOM 2382 C CA . PHE B 2 259 ? -38.863 -6.120 -19.795 1.00 53.80 ? 259 PHE B CA 1 ATOM 2383 C C . PHE B 2 259 ? -37.873 -5.775 -20.940 1.00 57.19 ? 259 PHE B C 1 ATOM 2384 O O . PHE B 2 259 ? -36.769 -6.330 -20.956 1.00 55.54 ? 259 PHE B O 1 ATOM 2385 C CB . PHE B 2 259 ? -38.219 -7.036 -18.724 1.00 54.39 ? 259 PHE B CB 1 ATOM 2386 C CG . PHE B 2 259 ? -39.150 -7.765 -17.777 1.00 56.44 ? 259 PHE B CG 1 ATOM 2387 C CD1 . PHE B 2 259 ? -39.912 -7.066 -16.845 1.00 60.84 ? 259 PHE B CD1 1 ATOM 2388 C CD2 . PHE B 2 259 ? -39.224 -9.155 -17.780 1.00 57.96 ? 259 PHE B CD2 1 ATOM 2389 C CE1 . PHE B 2 259 ? -40.755 -7.741 -15.959 1.00 62.56 ? 259 PHE B CE1 1 ATOM 2390 C CE2 . PHE B 2 259 ? -40.064 -9.830 -16.889 1.00 61.48 ? 259 PHE B CE2 1 ATOM 2391 C CZ . PHE B 2 259 ? -40.819 -9.119 -15.981 1.00 60.99 ? 259 PHE B CZ 1 ATOM 2392 N N . PRO B 2 260 ? -38.196 -4.846 -21.880 1.00 55.01 ? 260 PRO B N 1 ATOM 2393 C CA . PRO B 2 260 ? -37.217 -4.510 -22.931 1.00 54.71 ? 260 PRO B CA 1 ATOM 2394 C C . PRO B 2 260 ? -36.082 -3.616 -22.425 1.00 57.37 ? 260 PRO B C 1 ATOM 2395 O O . PRO B 2 260 ? -36.230 -2.944 -21.402 1.00 56.91 ? 260 PRO B O 1 ATOM 2396 C CB . PRO B 2 260 ? -38.059 -3.808 -24.011 1.00 58.56 ? 260 PRO B CB 1 ATOM 2397 C CG . PRO B 2 260 ? -39.487 -3.836 -23.522 1.00 64.08 ? 260 PRO B CG 1 ATOM 2398 C CD . PRO B 2 260 ? -39.431 -4.056 -22.046 1.00 58.51 ? 260 PRO B CD 1 ATOM 2399 N N . LEU B 2 261 ? -34.944 -3.622 -23.138 1.00 53.22 ? 261 LEU B N 1 ATOM 2400 C CA . LEU B 2 261 ? -33.772 -2.821 -22.781 1.00 52.50 ? 261 LEU B CA 1 ATOM 2401 C C . LEU B 2 261 ? -33.961 -1.352 -23.183 1.00 57.68 ? 261 LEU B C 1 ATOM 2402 O O . LEU B 2 261 ? -34.461 -1.075 -24.274 1.00 58.73 ? 261 LEU B O 1 ATOM 2403 C CB . LEU B 2 261 ? -32.496 -3.411 -23.417 1.00 52.03 ? 261 LEU B CB 1 ATOM 2404 C CG . LEU B 2 261 ? -31.152 -2.832 -22.947 1.00 56.18 ? 261 LEU B CG 1 ATOM 2405 C CD1 . LEU B 2 261 ? -30.737 -3.396 -21.600 1.00 55.08 ? 261 LEU B CD1 1 ATOM 2406 C CD2 . LEU B 2 261 ? -30.069 -3.104 -23.953 1.00 58.89 ? 261 LEU B CD2 1 ATOM 2407 N N . ALA B 2 262 ? -33.562 -0.419 -22.291 1.00 53.94 ? 262 ALA B N 1 ATOM 2408 C CA . ALA B 2 262 ? -33.651 1.035 -22.487 1.00 55.08 ? 262 ALA B CA 1 ATOM 2409 C C . ALA B 2 262 ? -32.575 1.790 -21.690 1.00 58.10 ? 262 ALA B C 1 ATOM 2410 O O . ALA B 2 262 ? -32.151 1.317 -20.635 1.00 56.33 ? 262 ALA B O 1 ATOM 2411 C CB . ALA B 2 262 ? -35.033 1.531 -22.086 1.00 57.05 ? 262 ALA B CB 1 ATOM 2412 N N . ASN B 2 263 ? -32.140 2.962 -22.192 1.00 55.69 ? 263 ASN B N 1 ATOM 2413 C CA . ASN B 2 263 ? -31.130 3.782 -21.516 1.00 55.07 ? 263 ASN B CA 1 ATOM 2414 C C . ASN B 2 263 ? -31.709 4.563 -20.345 1.00 58.94 ? 263 ASN B C 1 ATOM 2415 O O . ASN B 2 263 ? -32.751 5.206 -20.478 1.00 59.88 ? 263 ASN B O 1 ATOM 2416 C CB . ASN B 2 263 ? -30.361 4.705 -22.476 1.00 57.28 ? 263 ASN B CB 1 ATOM 2417 C CG . ASN B 2 263 ? -31.027 5.004 -23.799 1.00 84.45 ? 263 ASN B CG 1 ATOM 2418 O OD1 . ASN B 2 263 ? -32.049 5.697 -23.873 1.00 80.63 ? 263 ASN B OD1 1 ATOM 2419 N ND2 . ASN B 2 263 ? -30.426 4.497 -24.863 1.00 77.81 ? 263 ASN B ND2 1 ATOM 2420 N N . VAL B 2 264 ? -31.031 4.482 -19.192 1.00 54.35 ? 264 VAL B N 1 ATOM 2421 C CA . VAL B 2 264 ? -31.392 5.154 -17.938 1.00 54.52 ? 264 VAL B CA 1 ATOM 2422 C C . VAL B 2 264 ? -30.149 5.846 -17.337 1.00 58.08 ? 264 VAL B C 1 ATOM 2423 O O . VAL B 2 264 ? -29.141 6.001 -18.030 1.00 57.39 ? 264 VAL B O 1 ATOM 2424 C CB . VAL B 2 264 ? -32.087 4.199 -16.919 1.00 57.91 ? 264 VAL B CB 1 ATOM 2425 C CG1 . VAL B 2 264 ? -33.476 3.773 -17.394 1.00 58.47 ? 264 VAL B CG1 1 ATOM 2426 C CG2 . VAL B 2 264 ? -31.215 2.988 -16.587 1.00 56.23 ? 264 VAL B CG2 1 ATOM 2427 N N . THR B 2 265 ? -30.222 6.249 -16.055 1.00 55.00 ? 265 THR B N 1 ATOM 2428 C CA . THR B 2 265 ? -29.109 6.885 -15.352 1.00 54.70 ? 265 THR B CA 1 ATOM 2429 C C . THR B 2 265 ? -28.709 6.065 -14.126 1.00 57.88 ? 265 THR B C 1 ATOM 2430 O O . THR B 2 265 ? -29.578 5.605 -13.382 1.00 57.82 ? 265 THR B O 1 ATOM 2431 C CB . THR B 2 265 ? -29.416 8.351 -15.018 1.00 64.45 ? 265 THR B CB 1 ATOM 2432 O OG1 . THR B 2 265 ? -30.374 8.875 -15.940 1.00 65.68 ? 265 THR B OG1 1 ATOM 2433 C CG2 . THR B 2 265 ? -28.179 9.206 -15.041 1.00 63.07 ? 265 THR B CG2 1 ATOM 2434 N N . CYS B 2 266 ? -27.393 5.862 -13.941 1.00 53.74 ? 266 CYS B N 1 ATOM 2435 C CA . CYS B 2 266 ? -26.819 5.114 -12.820 1.00 53.27 ? 266 CYS B CA 1 ATOM 2436 C C . CYS B 2 266 ? -26.093 6.070 -11.871 1.00 57.52 ? 266 CYS B C 1 ATOM 2437 O O . CYS B 2 266 ? -25.231 6.836 -12.309 1.00 57.08 ? 266 CYS B O 1 ATOM 2438 C CB . CYS B 2 266 ? -25.896 4.003 -13.319 1.00 52.77 ? 266 CYS B CB 1 ATOM 2439 S SG . CYS B 2 266 ? -26.760 2.520 -13.908 1.00 55.96 ? 266 CYS B SG 1 ATOM 2440 N N . ARG B 2 267 ? -26.468 6.045 -10.581 1.00 54.63 ? 267 ARG B N 1 ATOM 2441 C CA . ARG B 2 267 ? -25.865 6.898 -9.552 1.00 55.24 ? 267 ARG B CA 1 ATOM 2442 C C . ARG B 2 267 ? -24.557 6.272 -9.071 1.00 58.40 ? 267 ARG B C 1 ATOM 2443 O O . ARG B 2 267 ? -24.546 5.107 -8.661 1.00 57.91 ? 267 ARG B O 1 ATOM 2444 C CB . ARG B 2 267 ? -26.828 7.123 -8.365 1.00 57.06 ? 267 ARG B CB 1 ATOM 2445 C CG . ARG B 2 267 ? -28.150 7.815 -8.710 1.00 68.25 ? 267 ARG B CG 1 ATOM 2446 C CD . ARG B 2 267 ? -28.021 9.320 -8.819 1.00 78.94 ? 267 ARG B CD 1 ATOM 2447 N NE . ARG B 2 267 ? -29.328 9.971 -8.784 1.00 89.00 ? 267 ARG B NE 1 ATOM 2448 C CZ . ARG B 2 267 ? -29.519 11.277 -8.931 1.00 104.71 ? 267 ARG B CZ 1 ATOM 2449 N NH1 . ARG B 2 267 ? -28.485 12.090 -9.114 1.00 91.81 ? 267 ARG B NH1 1 ATOM 2450 N NH2 . ARG B 2 267 ? -30.743 11.783 -8.887 1.00 93.69 ? 267 ARG B NH2 1 ATOM 2451 N N . VAL B 2 268 ? -23.452 7.034 -9.151 1.00 54.68 ? 268 VAL B N 1 ATOM 2452 C CA . VAL B 2 268 ? -22.122 6.574 -8.732 1.00 54.56 ? 268 VAL B CA 1 ATOM 2453 C C . VAL B 2 268 ? -21.512 7.467 -7.630 1.00 59.36 ? 268 VAL B C 1 ATOM 2454 O O . VAL B 2 268 ? -21.617 8.692 -7.726 1.00 59.05 ? 268 VAL B O 1 ATOM 2455 C CB . VAL B 2 268 ? -21.135 6.311 -9.907 1.00 57.68 ? 268 VAL B CB 1 ATOM 2456 C CG1 . VAL B 2 268 ? -21.588 5.136 -10.766 1.00 56.51 ? 268 VAL B CG1 1 ATOM 2457 C CG2 . VAL B 2 268 ? -20.912 7.557 -10.759 1.00 57.41 ? 268 VAL B CG2 1 ATOM 2458 N N . PRO B 2 269 ? -20.866 6.889 -6.585 1.00 67.08 ? 269 PRO B N 1 ATOM 2459 C CA . PRO B 2 269 ? -20.285 7.735 -5.530 1.00 66.57 ? 269 PRO B CA 1 ATOM 2460 C C . PRO B 2 269 ? -18.920 8.319 -5.881 1.00 67.45 ? 269 PRO B C 1 ATOM 2461 O O . PRO B 2 269 ? -18.190 7.760 -6.703 1.00 65.56 ? 269 PRO B O 1 ATOM 2462 C CB . PRO B 2 269 ? -20.193 6.790 -4.337 1.00 71.16 ? 269 PRO B CB 1 ATOM 2463 C CG . PRO B 2 269 ? -20.000 5.445 -4.939 1.00 76.15 ? 269 PRO B CG 1 ATOM 2464 C CD . PRO B 2 269 ? -20.655 5.454 -6.296 1.00 70.57 ? 269 PRO B CD 1 ATOM 2465 N N . LYS B 2 270 ? -18.574 9.437 -5.230 1.00 63.44 ? 270 LYS B N 1 ATOM 2466 C CA . LYS B 2 270 ? -17.304 10.129 -5.422 1.00 60.83 ? 270 LYS B CA 1 ATOM 2467 C C . LYS B 2 270 ? -16.392 9.869 -4.226 1.00 65.58 ? 270 LYS B C 1 ATOM 2468 O O . LYS B 2 270 ? -16.795 10.116 -3.086 1.00 66.96 ? 270 LYS B O 1 ATOM 2469 C CB . LYS B 2 270 ? -17.536 11.637 -5.626 1.00 62.22 ? 270 LYS B CB 1 ATOM 2470 C CG . LYS B 2 270 ? -18.112 11.991 -6.991 1.00 73.90 ? 270 LYS B CG 1 ATOM 2471 C CD . LYS B 2 270 ? -18.317 13.487 -7.141 1.00 82.67 ? 270 LYS B CD 1 ATOM 2472 C CE . LYS B 2 270 ? -18.822 13.840 -8.516 1.00 92.25 ? 270 LYS B CE 1 ATOM 2473 N NZ . LYS B 2 270 ? -19.024 15.304 -8.666 1.00 100.83 ? 270 LYS B NZ 1 ATOM 2474 N N . ALA B 2 271 ? -15.176 9.343 -4.486 1.00 61.09 ? 271 ALA B N 1 ATOM 2475 C CA . ALA B 2 271 ? -14.166 9.040 -3.465 1.00 61.50 ? 271 ALA B CA 1 ATOM 2476 C C . ALA B 2 271 ? -13.743 10.312 -2.730 1.00 65.01 ? 271 ALA B C 1 ATOM 2477 O O . ALA B 2 271 ? -13.662 11.374 -3.352 1.00 62.98 ? 271 ALA B O 1 ATOM 2478 C CB . ALA B 2 271 ? -12.953 8.378 -4.104 1.00 60.79 ? 271 ALA B CB 1 ATOM 2479 N N . ARG B 2 272 ? -13.508 10.212 -1.407 1.00 63.33 ? 272 ARG B N 1 ATOM 2480 C CA . ARG B 2 272 ? -13.118 11.354 -0.571 1.00 63.08 ? 272 ARG B CA 1 ATOM 2481 C C . ARG B 2 272 ? -11.815 12.015 -1.023 1.00 64.72 ? 272 ARG B C 1 ATOM 2482 O O . ARG B 2 272 ? -10.858 11.317 -1.367 1.00 63.30 ? 272 ARG B O 1 ATOM 2483 C CB . ARG B 2 272 ? -13.123 11.009 0.935 1.00 65.90 ? 272 ARG B CB 1 ATOM 2484 C CG . ARG B 2 272 ? -12.127 9.931 1.382 1.00 76.74 ? 272 ARG B CG 1 ATOM 2485 C CD . ARG B 2 272 ? -12.622 9.150 2.591 1.00 89.59 ? 272 ARG B CD 1 ATOM 2486 N NE . ARG B 2 272 ? -12.603 9.940 3.825 1.00 99.03 ? 272 ARG B NE 1 ATOM 2487 C CZ . ARG B 2 272 ? -13.061 9.516 4.999 1.00 115.84 ? 272 ARG B CZ 1 ATOM 2488 N NH1 . ARG B 2 272 ? -13.581 8.300 5.118 1.00 105.38 ? 272 ARG B NH1 1 ATOM 2489 N NH2 . ARG B 2 272 ? -13.004 10.305 6.063 1.00 103.39 ? 272 ARG B NH2 1 ATOM 2490 N N . ASN B 2 273 ? -11.812 13.363 -1.070 1.00 60.81 ? 273 ASN B N 1 ATOM 2491 C CA . ASN B 2 273 ? -10.677 14.180 -1.504 1.00 59.00 ? 273 ASN B CA 1 ATOM 2492 C C . ASN B 2 273 ? -9.421 13.926 -0.658 1.00 63.35 ? 273 ASN B C 1 ATOM 2493 O O . ASN B 2 273 ? -9.479 14.055 0.569 1.00 64.36 ? 273 ASN B O 1 ATOM 2494 C CB . ASN B 2 273 ? -11.043 15.670 -1.537 1.00 59.62 ? 273 ASN B CB 1 ATOM 2495 C CG . ASN B 2 273 ? -12.100 16.032 -2.557 1.00 81.88 ? 273 ASN B CG 1 ATOM 2496 O OD1 . ASN B 2 273 ? -12.031 15.659 -3.736 1.00 75.02 ? 273 ASN B OD1 1 ATOM 2497 N ND2 . ASN B 2 273 ? -13.085 16.807 -2.131 1.00 74.83 ? 273 ASN B ND2 1 ATOM 2498 N N . PRO B 2 274 ? -8.297 13.511 -1.290 1.00 58.96 ? 274 PRO B N 1 ATOM 2499 C CA . PRO B 2 274 ? -7.080 13.224 -0.508 1.00 59.16 ? 274 PRO B CA 1 ATOM 2500 C C . PRO B 2 274 ? -6.401 14.470 0.061 1.00 63.41 ? 274 PRO B C 1 ATOM 2501 O O . PRO B 2 274 ? -6.584 15.567 -0.474 1.00 62.34 ? 274 PRO B O 1 ATOM 2502 C CB . PRO B 2 274 ? -6.178 12.507 -1.515 1.00 59.64 ? 274 PRO B CB 1 ATOM 2503 C CG . PRO B 2 274 ? -6.605 13.030 -2.839 1.00 62.76 ? 274 PRO B CG 1 ATOM 2504 C CD . PRO B 2 274 ? -8.080 13.279 -2.735 1.00 59.00 ? 274 PRO B CD 1 ATOM 2505 N N . THR B 2 275 ? -5.613 14.293 1.146 1.00 61.22 ? 275 THR B N 1 ATOM 2506 C CA . THR B 2 275 ? -4.858 15.370 1.796 1.00 61.37 ? 275 THR B CA 1 ATOM 2507 C C . THR B 2 275 ? -3.727 15.770 0.845 1.00 64.16 ? 275 THR B C 1 ATOM 2508 O O . THR B 2 275 ? -2.840 14.960 0.564 1.00 63.25 ? 275 THR B O 1 ATOM 2509 C CB . THR B 2 275 ? -4.365 14.938 3.195 1.00 71.07 ? 275 THR B CB 1 ATOM 2510 O OG1 . THR B 2 275 ? -5.439 14.339 3.924 1.00 72.44 ? 275 THR B OG1 1 ATOM 2511 C CG2 . THR B 2 275 ? -3.783 16.095 3.998 1.00 70.28 ? 275 THR B CG2 1 ATOM 2512 N N . VAL B 2 276 ? -3.803 16.997 0.308 1.00 60.60 ? 276 VAL B N 1 ATOM 2513 C CA . VAL B 2 276 ? -2.849 17.511 -0.673 1.00 59.65 ? 276 VAL B CA 1 ATOM 2514 C C . VAL B 2 276 ? -1.726 18.393 -0.090 1.00 64.21 ? 276 VAL B C 1 ATOM 2515 O O . VAL B 2 276 ? -1.993 19.327 0.670 1.00 64.74 ? 276 VAL B O 1 ATOM 2516 C CB . VAL B 2 276 ? -3.563 18.102 -1.928 1.00 63.06 ? 276 VAL B CB 1 ATOM 2517 C CG1 . VAL B 2 276 ? -4.286 19.417 -1.627 1.00 63.76 ? 276 VAL B CG1 1 ATOM 2518 C CG2 . VAL B 2 276 ? -2.609 18.252 -3.107 1.00 62.22 ? 276 VAL B CG2 1 ATOM 2519 N N . THR B 2 277 ? -0.469 18.057 -0.438 1.00 60.46 ? 277 THR B N 1 ATOM 2520 C CA . THR B 2 277 ? 0.748 18.776 -0.040 1.00 60.94 ? 277 THR B CA 1 ATOM 2521 C C . THR B 2 277 ? 1.562 19.105 -1.292 1.00 64.44 ? 277 THR B C 1 ATOM 2522 O O . THR B 2 277 ? 1.695 18.255 -2.177 1.00 63.16 ? 277 THR B O 1 ATOM 2523 C CB . THR B 2 277 ? 1.559 17.996 1.010 1.00 69.82 ? 277 THR B CB 1 ATOM 2524 O OG1 . THR B 2 277 ? 1.735 16.647 0.578 1.00 69.52 ? 277 THR B OG1 1 ATOM 2525 C CG2 . THR B 2 277 ? 0.918 18.028 2.392 1.00 69.19 ? 277 THR B CG2 1 ATOM 2526 N N . TYR B 2 278 ? 2.084 20.343 -1.377 1.00 61.97 ? 278 TYR B N 1 ATOM 2527 C CA . TYR B 2 278 ? 2.837 20.819 -2.541 1.00 62.14 ? 278 TYR B CA 1 ATOM 2528 C C . TYR B 2 278 ? 4.347 20.958 -2.316 1.00 66.81 ? 278 TYR B C 1 ATOM 2529 O O . TYR B 2 278 ? 4.797 21.146 -1.185 1.00 66.94 ? 278 TYR B O 1 ATOM 2530 C CB . TYR B 2 278 ? 2.250 22.144 -3.073 1.00 64.22 ? 278 TYR B CB 1 ATOM 2531 C CG . TYR B 2 278 ? 0.742 22.162 -3.217 1.00 65.35 ? 278 TYR B CG 1 ATOM 2532 C CD1 . TYR B 2 278 ? -0.050 22.929 -2.368 1.00 68.03 ? 278 TYR B CD1 1 ATOM 2533 C CD2 . TYR B 2 278 ? 0.107 21.425 -4.213 1.00 65.06 ? 278 TYR B CD2 1 ATOM 2534 C CE1 . TYR B 2 278 ? -1.437 22.962 -2.505 1.00 68.52 ? 278 TYR B CE1 1 ATOM 2535 C CE2 . TYR B 2 278 ? -1.279 21.453 -4.362 1.00 65.57 ? 278 TYR B CE2 1 ATOM 2536 C CZ . TYR B 2 278 ? -2.048 22.219 -3.502 1.00 73.72 ? 278 TYR B CZ 1 ATOM 2537 O OH . TYR B 2 278 ? -3.415 22.244 -3.640 1.00 74.43 ? 278 TYR B OH 1 ATOM 2538 N N . GLY B 2 279 ? 5.096 20.878 -3.415 1.00 63.65 ? 279 GLY B N 1 ATOM 2539 C CA . GLY B 2 279 ? 6.549 21.012 -3.460 1.00 64.66 ? 279 GLY B CA 1 ATOM 2540 C C . GLY B 2 279 ? 7.024 21.666 -4.745 1.00 69.68 ? 279 GLY B C 1 ATOM 2541 O O . GLY B 2 279 ? 6.201 22.025 -5.594 1.00 69.14 ? 279 GLY B O 1 ATOM 2542 N N . LYS B 2 280 ? 8.357 21.823 -4.902 1.00 67.64 ? 280 LYS B N 1 ATOM 2543 C CA . LYS B 2 280 ? 8.979 22.434 -6.085 1.00 69.32 ? 280 LYS B CA 1 ATOM 2544 C C . LYS B 2 280 ? 8.710 21.589 -7.342 1.00 72.24 ? 280 LYS B C 1 ATOM 2545 O O . LYS B 2 280 ? 9.268 20.497 -7.484 1.00 71.36 ? 280 LYS B O 1 ATOM 2546 C CB . LYS B 2 280 ? 10.489 22.657 -5.856 1.00 73.96 ? 280 LYS B CB 1 ATOM 2547 C CG . LYS B 2 280 ? 11.128 23.686 -6.795 1.00 92.41 ? 280 LYS B CG 1 ATOM 2548 C CD . LYS B 2 280 ? 11.932 23.044 -7.938 1.00 104.08 ? 280 LYS B CD 1 ATOM 2549 C CE . LYS B 2 280 ? 13.382 22.771 -7.595 1.00 116.72 ? 280 LYS B CE 1 ATOM 2550 N NZ . LYS B 2 280 ? 14.198 24.014 -7.578 1.00 128.95 ? 280 LYS B NZ 1 ATOM 2551 N N . ASN B 2 281 ? 7.814 22.094 -8.225 1.00 68.59 ? 281 ASN B N 1 ATOM 2552 C CA . ASN B 2 281 ? 7.369 21.466 -9.481 1.00 67.67 ? 281 ASN B CA 1 ATOM 2553 C C . ASN B 2 281 ? 6.789 20.046 -9.305 1.00 68.53 ? 281 ASN B C 1 ATOM 2554 O O . ASN B 2 281 ? 6.845 19.232 -10.231 1.00 67.80 ? 281 ASN B O 1 ATOM 2555 C CB . ASN B 2 281 ? 8.461 21.526 -10.564 1.00 71.09 ? 281 ASN B CB 1 ATOM 2556 C CG . ASN B 2 281 ? 8.743 22.918 -11.068 1.00 99.59 ? 281 ASN B CG 1 ATOM 2557 O OD1 . ASN B 2 281 ? 7.907 23.553 -11.722 1.00 95.02 ? 281 ASN B OD1 1 ATOM 2558 N ND2 . ASN B 2 281 ? 9.945 23.410 -10.810 1.00 94.37 ? 281 ASN B ND2 1 ATOM 2559 N N . GLN B 2 282 ? 6.219 19.764 -8.113 1.00 63.29 ? 282 GLN B N 1 ATOM 2560 C CA . GLN B 2 282 ? 5.631 18.464 -7.776 1.00 61.12 ? 282 GLN B CA 1 ATOM 2561 C C . GLN B 2 282 ? 4.465 18.535 -6.783 1.00 63.35 ? 282 GLN B C 1 ATOM 2562 O O . GLN B 2 282 ? 4.409 19.444 -5.953 1.00 63.44 ? 282 GLN B O 1 ATOM 2563 C CB . GLN B 2 282 ? 6.701 17.450 -7.311 1.00 62.54 ? 282 GLN B CB 1 ATOM 2564 C CG . GLN B 2 282 ? 7.457 17.835 -6.033 1.00 79.27 ? 282 GLN B CG 1 ATOM 2565 C CD . GLN B 2 282 ? 8.190 16.673 -5.402 1.00 99.27 ? 282 GLN B CD 1 ATOM 2566 O OE1 . GLN B 2 282 ? 8.822 15.848 -6.075 1.00 95.12 ? 282 GLN B OE1 1 ATOM 2567 N NE2 . GLN B 2 282 ? 8.155 16.606 -4.080 1.00 91.80 ? 282 GLN B NE2 1 ATOM 2568 N N . VAL B 2 283 ? 3.550 17.551 -6.867 1.00 58.27 ? 283 VAL B N 1 ATOM 2569 C CA . VAL B 2 283 ? 2.374 17.422 -6.005 1.00 57.14 ? 283 VAL B CA 1 ATOM 2570 C C . VAL B 2 283 ? 2.366 16.056 -5.278 1.00 60.03 ? 283 VAL B C 1 ATOM 2571 O O . VAL B 2 283 ? 2.667 15.029 -5.892 1.00 59.25 ? 283 VAL B O 1 ATOM 2572 C CB . VAL B 2 283 ? 1.051 17.767 -6.758 1.00 60.58 ? 283 VAL B CB 1 ATOM 2573 C CG1 . VAL B 2 283 ? 0.673 16.710 -7.797 1.00 59.64 ? 283 VAL B CG1 1 ATOM 2574 C CG2 . VAL B 2 283 ? -0.098 18.024 -5.792 1.00 60.18 ? 283 VAL B CG2 1 ATOM 2575 N N . ILE B 2 284 ? 2.071 16.063 -3.962 1.00 56.50 ? 284 ILE B N 1 ATOM 2576 C CA . ILE B 2 284 ? 2.040 14.855 -3.128 1.00 56.14 ? 284 ILE B CA 1 ATOM 2577 C C . ILE B 2 284 ? 0.619 14.620 -2.593 1.00 59.51 ? 284 ILE B C 1 ATOM 2578 O O . ILE B 2 284 ? 0.057 15.500 -1.936 1.00 59.49 ? 284 ILE B O 1 ATOM 2579 C CB . ILE B 2 284 ? 3.124 14.884 -1.999 1.00 60.04 ? 284 ILE B CB 1 ATOM 2580 C CG1 . ILE B 2 284 ? 4.545 15.110 -2.564 1.00 60.89 ? 284 ILE B CG1 1 ATOM 2581 C CG2 . ILE B 2 284 ? 3.088 13.617 -1.136 1.00 61.07 ? 284 ILE B CG2 1 ATOM 2582 C CD1 . ILE B 2 284 ? 5.099 16.505 -2.330 1.00 69.48 ? 284 ILE B CD1 1 ATOM 2583 N N . MET B 2 285 ? 0.048 13.431 -2.878 1.00 55.49 ? 285 MET B N 1 ATOM 2584 C CA . MET B 2 285 ? -1.303 13.044 -2.454 1.00 55.40 ? 285 MET B CA 1 ATOM 2585 C C . MET B 2 285 ? -1.300 11.788 -1.581 1.00 59.74 ? 285 MET B C 1 ATOM 2586 O O . MET B 2 285 ? -0.730 10.767 -1.972 1.00 59.35 ? 285 MET B O 1 ATOM 2587 C CB . MET B 2 285 ? -2.222 12.823 -3.670 1.00 57.05 ? 285 MET B CB 1 ATOM 2588 C CG . MET B 2 285 ? -2.526 14.080 -4.447 1.00 60.16 ? 285 MET B CG 1 ATOM 2589 S SD . MET B 2 285 ? -3.408 13.718 -5.979 1.00 63.65 ? 285 MET B SD 1 ATOM 2590 C CE . MET B 2 285 ? -2.568 14.809 -7.070 1.00 60.06 ? 285 MET B CE 1 ATOM 2591 N N . LEU B 2 286 ? -1.957 11.865 -0.410 1.00 56.96 ? 286 LEU B N 1 ATOM 2592 C CA . LEU B 2 286 ? -2.095 10.754 0.534 1.00 58.10 ? 286 LEU B CA 1 ATOM 2593 C C . LEU B 2 286 ? -3.488 10.145 0.318 1.00 61.90 ? 286 LEU B C 1 ATOM 2594 O O . LEU B 2 286 ? -4.490 10.675 0.808 1.00 62.11 ? 286 LEU B O 1 ATOM 2595 C CB . LEU B 2 286 ? -1.898 11.260 1.979 1.00 59.43 ? 286 LEU B CB 1 ATOM 2596 C CG . LEU B 2 286 ? -1.268 10.303 2.998 1.00 65.85 ? 286 LEU B CG 1 ATOM 2597 C CD1 . LEU B 2 286 ? 0.214 10.077 2.725 1.00 65.49 ? 286 LEU B CD1 1 ATOM 2598 C CD2 . LEU B 2 286 ? -1.407 10.857 4.399 1.00 69.90 ? 286 LEU B CD2 1 ATOM 2599 N N . LEU B 2 287 ? -3.544 9.068 -0.485 1.00 57.85 ? 287 LEU B N 1 ATOM 2600 C CA . LEU B 2 287 ? -4.790 8.399 -0.870 1.00 58.08 ? 287 LEU B CA 1 ATOM 2601 C C . LEU B 2 287 ? -5.281 7.380 0.153 1.00 64.02 ? 287 LEU B C 1 ATOM 2602 O O . LEU B 2 287 ? -4.536 6.480 0.549 1.00 64.61 ? 287 LEU B O 1 ATOM 2603 C CB . LEU B 2 287 ? -4.680 7.751 -2.271 1.00 57.09 ? 287 LEU B CB 1 ATOM 2604 C CG . LEU B 2 287 ? -4.148 8.614 -3.427 1.00 59.69 ? 287 LEU B CG 1 ATOM 2605 C CD1 . LEU B 2 287 ? -3.705 7.749 -4.580 1.00 59.36 ? 287 LEU B CD1 1 ATOM 2606 C CD2 . LEU B 2 287 ? -5.178 9.630 -3.901 1.00 61.35 ? 287 LEU B CD2 1 ATOM 2607 N N . TYR B 2 288 ? -6.553 7.523 0.559 1.00 61.54 ? 288 TYR B N 1 ATOM 2608 C CA . TYR B 2 288 ? -7.230 6.639 1.503 1.00 64.11 ? 288 TYR B CA 1 ATOM 2609 C C . TYR B 2 288 ? -8.519 6.074 0.867 1.00 68.04 ? 288 TYR B C 1 ATOM 2610 O O . TYR B 2 288 ? -9.611 6.584 1.136 1.00 68.37 ? 288 TYR B O 1 ATOM 2611 C CB . TYR B 2 288 ? -7.515 7.375 2.825 1.00 66.88 ? 288 TYR B CB 1 ATOM 2612 C CG . TYR B 2 288 ? -6.294 7.532 3.703 1.00 69.07 ? 288 TYR B CG 1 ATOM 2613 C CD1 . TYR B 2 288 ? -5.456 8.636 3.575 1.00 69.04 ? 288 TYR B CD1 1 ATOM 2614 C CD2 . TYR B 2 288 ? -5.988 6.589 4.680 1.00 72.44 ? 288 TYR B CD2 1 ATOM 2615 C CE1 . TYR B 2 288 ? -4.334 8.789 4.387 1.00 70.26 ? 288 TYR B CE1 1 ATOM 2616 C CE2 . TYR B 2 288 ? -4.872 6.733 5.501 1.00 73.67 ? 288 TYR B CE2 1 ATOM 2617 C CZ . TYR B 2 288 ? -4.045 7.835 5.350 1.00 79.08 ? 288 TYR B CZ 1 ATOM 2618 O OH . TYR B 2 288 ? -2.942 7.978 6.157 1.00 80.62 ? 288 TYR B OH 1 ATOM 2619 N N . PRO B 2 289 ? -8.422 5.039 -0.003 1.00 63.97 ? 289 PRO B N 1 ATOM 2620 C CA . PRO B 2 289 ? -9.642 4.507 -0.630 1.00 64.42 ? 289 PRO B CA 1 ATOM 2621 C C . PRO B 2 289 ? -10.387 3.484 0.224 1.00 70.99 ? 289 PRO B C 1 ATOM 2622 O O . PRO B 2 289 ? -9.765 2.670 0.909 1.00 72.40 ? 289 PRO B O 1 ATOM 2623 C CB . PRO B 2 289 ? -9.133 3.906 -1.941 1.00 64.73 ? 289 PRO B CB 1 ATOM 2624 C CG . PRO B 2 289 ? -7.702 3.561 -1.680 1.00 68.99 ? 289 PRO B CG 1 ATOM 2625 C CD . PRO B 2 289 ? -7.219 4.315 -0.468 1.00 64.81 ? 289 PRO B CD 1 ATOM 2626 N N . ASP B 2 290 ? -11.728 3.530 0.170 1.00 68.14 ? 290 ASP B N 1 ATOM 2627 C CA . ASP B 2 290 ? -12.617 2.614 0.892 1.00 71.53 ? 290 ASP B CA 1 ATOM 2628 C C . ASP B 2 290 ? -12.918 1.385 0.024 1.00 75.32 ? 290 ASP B C 1 ATOM 2629 O O . ASP B 2 290 ? -13.394 0.367 0.531 1.00 78.52 ? 290 ASP B O 1 ATOM 2630 C CB . ASP B 2 290 ? -13.926 3.327 1.282 1.00 74.65 ? 290 ASP B CB 1 ATOM 2631 C CG . ASP B 2 290 ? -13.735 4.617 2.059 1.00 84.12 ? 290 ASP B CG 1 ATOM 2632 O OD1 . ASP B 2 290 ? -14.112 5.685 1.534 1.00 82.55 ? 290 ASP B OD1 1 ATOM 2633 O OD2 . ASP B 2 290 ? -13.213 4.555 3.194 1.00 91.78 ? 290 ASP B OD2 1 ATOM 2634 N N . HIS B 2 291 ? -12.632 1.496 -1.288 1.00 68.08 ? 291 HIS B N 1 ATOM 2635 C CA . HIS B 2 291 ? -12.839 0.477 -2.321 1.00 67.87 ? 291 HIS B CA 1 ATOM 2636 C C . HIS B 2 291 ? -11.892 0.753 -3.518 1.00 67.05 ? 291 HIS B C 1 ATOM 2637 O O . HIS B 2 291 ? -11.351 1.862 -3.576 1.00 63.94 ? 291 HIS B O 1 ATOM 2638 C CB . HIS B 2 291 ? -14.316 0.477 -2.772 1.00 69.73 ? 291 HIS B CB 1 ATOM 2639 C CG . HIS B 2 291 ? -14.846 1.827 -3.149 1.00 70.65 ? 291 HIS B CG 1 ATOM 2640 N ND1 . HIS B 2 291 ? -15.545 2.605 -2.244 1.00 73.48 ? 291 HIS B ND1 1 ATOM 2641 C CD2 . HIS B 2 291 ? -14.765 2.491 -4.325 1.00 69.27 ? 291 HIS B CD2 1 ATOM 2642 C CE1 . HIS B 2 291 ? -15.865 3.712 -2.893 1.00 70.36 ? 291 HIS B CE1 1 ATOM 2643 N NE2 . HIS B 2 291 ? -15.419 3.689 -4.149 1.00 68.16 ? 291 HIS B NE2 1 ATOM 2644 N N . PRO B 2 292 ? -11.663 -0.197 -4.476 1.00 62.87 ? 292 PRO B N 1 ATOM 2645 C CA . PRO B 2 292 ? -10.761 0.105 -5.610 1.00 59.31 ? 292 PRO B CA 1 ATOM 2646 C C . PRO B 2 292 ? -11.150 1.381 -6.357 1.00 59.11 ? 292 PRO B C 1 ATOM 2647 O O . PRO B 2 292 ? -12.303 1.536 -6.766 1.00 58.93 ? 292 PRO B O 1 ATOM 2648 C CB . PRO B 2 292 ? -10.865 -1.142 -6.494 1.00 62.42 ? 292 PRO B CB 1 ATOM 2649 C CG . PRO B 2 292 ? -11.278 -2.223 -5.571 1.00 70.79 ? 292 PRO B CG 1 ATOM 2650 C CD . PRO B 2 292 ? -12.194 -1.573 -4.580 1.00 67.46 ? 292 PRO B CD 1 ATOM 2651 N N . THR B 2 293 ? -10.193 2.319 -6.469 1.00 52.34 ? 293 THR B N 1 ATOM 2652 C CA . THR B 2 293 ? -10.392 3.632 -7.081 1.00 49.30 ? 293 THR B CA 1 ATOM 2653 C C . THR B 2 293 ? -9.349 3.903 -8.171 1.00 49.87 ? 293 THR B C 1 ATOM 2654 O O . THR B 2 293 ? -8.147 3.778 -7.923 1.00 49.09 ? 293 THR B O 1 ATOM 2655 C CB . THR B 2 293 ? -10.414 4.707 -5.973 1.00 57.16 ? 293 THR B CB 1 ATOM 2656 O OG1 . THR B 2 293 ? -11.361 4.334 -4.970 1.00 59.12 ? 293 THR B OG1 1 ATOM 2657 C CG2 . THR B 2 293 ? -10.747 6.094 -6.494 1.00 53.91 ? 293 THR B CG2 1 ATOM 2658 N N . LEU B 2 294 ? -9.818 4.287 -9.370 1.00 44.38 ? 294 LEU B N 1 ATOM 2659 C CA . LEU B 2 294 ? -8.960 4.590 -10.510 1.00 42.23 ? 294 LEU B CA 1 ATOM 2660 C C . LEU B 2 294 ? -8.321 5.975 -10.363 1.00 44.20 ? 294 LEU B C 1 ATOM 2661 O O . LEU B 2 294 ? -9.025 6.968 -10.157 1.00 43.37 ? 294 LEU B O 1 ATOM 2662 C CB . LEU B 2 294 ? -9.761 4.470 -11.824 1.00 41.85 ? 294 LEU B CB 1 ATOM 2663 C CG . LEU B 2 294 ? -8.996 4.409 -13.157 1.00 45.46 ? 294 LEU B CG 1 ATOM 2664 C CD1 . LEU B 2 294 ? -7.934 3.314 -13.181 1.00 46.40 ? 294 LEU B CD1 1 ATOM 2665 C CD2 . LEU B 2 294 ? -9.949 4.249 -14.318 1.00 47.80 ? 294 LEU B CD2 1 ATOM 2666 N N . LEU B 2 295 ? -6.979 6.021 -10.434 1.00 39.80 ? 295 LEU B N 1 ATOM 2667 C CA . LEU B 2 295 ? -6.182 7.245 -10.352 1.00 38.23 ? 295 LEU B CA 1 ATOM 2668 C C . LEU B 2 295 ? -5.495 7.445 -11.710 1.00 40.66 ? 295 LEU B C 1 ATOM 2669 O O . LEU B 2 295 ? -4.717 6.592 -12.145 1.00 40.60 ? 295 LEU B O 1 ATOM 2670 C CB . LEU B 2 295 ? -5.162 7.160 -9.188 1.00 38.75 ? 295 LEU B CB 1 ATOM 2671 C CG . LEU B 2 295 ? -4.208 8.354 -8.968 1.00 42.80 ? 295 LEU B CG 1 ATOM 2672 C CD1 . LEU B 2 295 ? -4.870 9.501 -8.218 1.00 42.80 ? 295 LEU B CD1 1 ATOM 2673 C CD2 . LEU B 2 295 ? -2.939 7.918 -8.267 1.00 45.85 ? 295 LEU B CD2 1 ATOM 2674 N N . SER B 2 296 ? -5.841 8.541 -12.402 1.00 35.99 ? 296 SER B N 1 ATOM 2675 C CA . SER B 2 296 ? -5.286 8.867 -13.715 1.00 35.32 ? 296 SER B CA 1 ATOM 2676 C C . SER B 2 296 ? -4.734 10.287 -13.750 1.00 38.19 ? 296 SER B C 1 ATOM 2677 O O . SER B 2 296 ? -5.243 11.165 -13.048 1.00 37.49 ? 296 SER B O 1 ATOM 2678 C CB . SER B 2 296 ? -6.328 8.663 -14.812 1.00 38.95 ? 296 SER B CB 1 ATOM 2679 O OG . SER B 2 296 ? -7.415 9.566 -14.694 1.00 47.66 ? 296 SER B OG 1 ATOM 2680 N N . TYR B 2 297 ? -3.684 10.505 -14.559 1.00 34.63 ? 297 TYR B N 1 ATOM 2681 C CA . TYR B 2 297 ? -3.033 11.808 -14.702 1.00 34.49 ? 297 TYR B CA 1 ATOM 2682 C C . TYR B 2 297 ? -2.424 12.044 -16.081 1.00 38.68 ? 297 TYR B C 1 ATOM 2683 O O . TYR B 2 297 ? -2.048 11.091 -16.769 1.00 38.47 ? 297 TYR B O 1 ATOM 2684 C CB . TYR B 2 297 ? -2.024 12.082 -13.564 1.00 35.81 ? 297 TYR B CB 1 ATOM 2685 C CG . TYR B 2 297 ? -0.985 11.000 -13.361 1.00 37.90 ? 297 TYR B CG 1 ATOM 2686 C CD1 . TYR B 2 297 ? 0.270 11.092 -13.956 1.00 40.68 ? 297 TYR B CD1 1 ATOM 2687 C CD2 . TYR B 2 297 ? -1.232 9.916 -12.523 1.00 38.55 ? 297 TYR B CD2 1 ATOM 2688 C CE1 . TYR B 2 297 ? 1.238 10.109 -13.758 1.00 42.06 ? 297 TYR B CE1 1 ATOM 2689 C CE2 . TYR B 2 297 ? -0.276 8.921 -12.327 1.00 40.04 ? 297 TYR B CE2 1 ATOM 2690 C CZ . TYR B 2 297 ? 0.962 9.027 -12.939 1.00 48.16 ? 297 TYR B CZ 1 ATOM 2691 O OH . TYR B 2 297 ? 1.920 8.064 -12.733 1.00 49.93 ? 297 TYR B OH 1 ATOM 2692 N N . ARG B 2 298 ? -2.353 13.325 -16.487 1.00 35.70 ? 298 ARG B N 1 ATOM 2693 C CA . ARG B 2 298 ? -1.812 13.763 -17.777 1.00 36.73 ? 298 ARG B CA 1 ATOM 2694 C C . ARG B 2 298 ? -1.273 15.193 -17.723 1.00 42.07 ? 298 ARG B C 1 ATOM 2695 O O . ARG B 2 298 ? -1.773 16.017 -16.954 1.00 41.25 ? 298 ARG B O 1 ATOM 2696 C CB . ARG B 2 298 ? -2.863 13.631 -18.904 1.00 36.60 ? 298 ARG B CB 1 ATOM 2697 C CG . ARG B 2 298 ? -4.160 14.407 -18.665 1.00 45.13 ? 298 ARG B CG 1 ATOM 2698 C CD . ARG B 2 298 ? -4.913 14.685 -19.947 1.00 53.96 ? 298 ARG B CD 1 ATOM 2699 N NE . ARG B 2 298 ? -6.110 15.489 -19.696 1.00 61.08 ? 298 ARG B NE 1 ATOM 2700 C CZ . ARG B 2 298 ? -7.084 15.692 -20.578 1.00 75.55 ? 298 ARG B CZ 1 ATOM 2701 N NH1 . ARG B 2 298 ? -7.023 15.141 -21.785 1.00 63.36 ? 298 ARG B NH1 1 ATOM 2702 N NH2 . ARG B 2 298 ? -8.132 16.437 -20.257 1.00 62.80 ? 298 ARG B NH2 1 ATOM 2703 N N . ASN B 2 299 ? -0.266 15.484 -18.560 1.00 40.68 ? 299 ASN B N 1 ATOM 2704 C CA . ASN B 2 299 ? 0.319 16.817 -18.689 1.00 42.39 ? 299 ASN B CA 1 ATOM 2705 C C . ASN B 2 299 ? -0.570 17.616 -19.645 1.00 47.28 ? 299 ASN B C 1 ATOM 2706 O O . ASN B 2 299 ? -1.095 17.053 -20.610 1.00 46.65 ? 299 ASN B O 1 ATOM 2707 C CB . ASN B 2 299 ? 1.752 16.740 -19.236 1.00 45.63 ? 299 ASN B CB 1 ATOM 2708 C CG . ASN B 2 299 ? 2.696 15.863 -18.444 1.00 70.75 ? 299 ASN B CG 1 ATOM 2709 O OD1 . ASN B 2 299 ? 2.798 15.950 -17.213 1.00 65.28 ? 299 ASN B OD1 1 ATOM 2710 N ND2 . ASN B 2 299 ? 3.441 15.020 -19.145 1.00 63.69 ? 299 ASN B ND2 1 ATOM 2711 N N . MET B 2 300 ? -0.748 18.919 -19.373 1.00 45.07 ? 300 MET B N 1 ATOM 2712 C CA . MET B 2 300 ? -1.579 19.802 -20.198 1.00 46.11 ? 300 MET B CA 1 ATOM 2713 C C . MET B 2 300 ? -0.777 20.535 -21.296 1.00 52.95 ? 300 MET B C 1 ATOM 2714 O O . MET B 2 300 ? -1.035 21.706 -21.592 1.00 54.32 ? 300 MET B O 1 ATOM 2715 C CB . MET B 2 300 ? -2.415 20.755 -19.323 1.00 48.08 ? 300 MET B CB 1 ATOM 2716 C CG . MET B 2 300 ? -3.575 20.065 -18.627 1.00 49.41 ? 300 MET B CG 1 ATOM 2717 S SD . MET B 2 300 ? -4.634 21.181 -17.672 1.00 53.58 ? 300 MET B SD 1 ATOM 2718 C CE . MET B 2 300 ? -3.698 21.312 -16.170 1.00 49.86 ? 300 MET B CE 1 ATOM 2719 N N . GLY B 2 301 ? 0.166 19.813 -21.902 1.00 50.29 ? 301 GLY B N 1 ATOM 2720 C CA . GLY B 2 301 ? 1.019 20.307 -22.977 1.00 53.33 ? 301 GLY B CA 1 ATOM 2721 C C . GLY B 2 301 ? 1.012 19.417 -24.204 1.00 57.72 ? 301 GLY B C 1 ATOM 2722 O O . GLY B 2 301 ? 0.076 18.635 -24.400 1.00 55.25 ? 301 GLY B O 1 ATOM 2723 N N . GLU B 2 302 ? 2.066 19.537 -25.039 1.00 57.27 ? 302 GLU B N 1 ATOM 2724 C CA . GLU B 2 302 ? 2.257 18.781 -26.283 1.00 58.32 ? 302 GLU B CA 1 ATOM 2725 C C . GLU B 2 302 ? 2.361 17.270 -26.036 1.00 59.66 ? 302 GLU B C 1 ATOM 2726 O O . GLU B 2 302 ? 1.807 16.489 -26.811 1.00 58.63 ? 302 GLU B O 1 ATOM 2727 C CB . GLU B 2 302 ? 3.492 19.303 -27.038 1.00 63.79 ? 302 GLU B CB 1 ATOM 2728 C CG . GLU B 2 302 ? 3.508 18.965 -28.521 1.00 77.23 ? 302 GLU B CG 1 ATOM 2729 C CD . GLU B 2 302 ? 4.670 19.546 -29.305 1.00 103.81 ? 302 GLU B CD 1 ATOM 2730 O OE1 . GLU B 2 302 ? 5.830 19.398 -28.857 1.00 100.04 ? 302 GLU B OE1 1 ATOM 2731 O OE2 . GLU B 2 302 ? 4.421 20.125 -30.388 1.00 101.60 ? 302 GLU B OE2 1 ATOM 2732 N N . GLU B 2 303 ? 3.070 16.869 -24.963 1.00 55.09 ? 303 GLU B N 1 ATOM 2733 C CA . GLU B 2 303 ? 3.243 15.473 -24.565 1.00 53.02 ? 303 GLU B CA 1 ATOM 2734 C C . GLU B 2 303 ? 2.422 15.202 -23.292 1.00 53.65 ? 303 GLU B C 1 ATOM 2735 O O . GLU B 2 303 ? 2.882 15.524 -22.191 1.00 52.59 ? 303 GLU B O 1 ATOM 2736 C CB . GLU B 2 303 ? 4.733 15.131 -24.371 1.00 55.93 ? 303 GLU B CB 1 ATOM 2737 C CG . GLU B 2 303 ? 5.449 14.739 -25.652 1.00 69.74 ? 303 GLU B CG 1 ATOM 2738 C CD . GLU B 2 303 ? 5.127 13.352 -26.175 1.00 90.75 ? 303 GLU B CD 1 ATOM 2739 O OE1 . GLU B 2 303 ? 5.548 12.359 -25.538 1.00 84.48 ? 303 GLU B OE1 1 ATOM 2740 O OE2 . GLU B 2 303 ? 4.459 13.259 -27.229 1.00 86.26 ? 303 GLU B OE2 1 ATOM 2741 N N . PRO B 2 304 ? 1.182 14.664 -23.419 1.00 48.41 ? 304 PRO B N 1 ATOM 2742 C CA . PRO B 2 304 ? 0.361 14.428 -22.217 1.00 45.73 ? 304 PRO B CA 1 ATOM 2743 C C . PRO B 2 304 ? 0.866 13.311 -21.305 1.00 48.69 ? 304 PRO B C 1 ATOM 2744 O O . PRO B 2 304 ? 0.740 13.433 -20.086 1.00 46.94 ? 304 PRO B O 1 ATOM 2745 C CB . PRO B 2 304 ? -1.031 14.138 -22.782 1.00 46.44 ? 304 PRO B CB 1 ATOM 2746 C CG . PRO B 2 304 ? -0.788 13.618 -24.144 1.00 52.30 ? 304 PRO B CG 1 ATOM 2747 C CD . PRO B 2 304 ? 0.471 14.256 -24.650 1.00 50.34 ? 304 PRO B CD 1 ATOM 2748 N N . ASN B 2 305 ? 1.450 12.239 -21.895 1.00 46.28 ? 305 ASN B N 1 ATOM 2749 C CA . ASN B 2 305 ? 1.999 11.062 -21.207 1.00 45.65 ? 305 ASN B CA 1 ATOM 2750 C C . ASN B 2 305 ? 1.009 10.488 -20.176 1.00 47.65 ? 305 ASN B C 1 ATOM 2751 O O . ASN B 2 305 ? 1.249 10.543 -18.964 1.00 46.48 ? 305 ASN B O 1 ATOM 2752 C CB . ASN B 2 305 ? 3.391 11.364 -20.612 1.00 47.90 ? 305 ASN B CB 1 ATOM 2753 C CG . ASN B 2 305 ? 4.154 10.152 -20.123 1.00 72.71 ? 305 ASN B CG 1 ATOM 2754 O OD1 . ASN B 2 305 ? 4.272 9.129 -20.810 1.00 68.41 ? 305 ASN B OD1 1 ATOM 2755 N ND2 . ASN B 2 305 ? 4.723 10.258 -18.932 1.00 64.48 ? 305 ASN B ND2 1 ATOM 2756 N N . TYR B 2 306 ? -0.135 9.987 -20.678 1.00 43.71 ? 306 TYR B N 1 ATOM 2757 C CA . TYR B 2 306 ? -1.208 9.427 -19.859 1.00 42.11 ? 306 TYR B CA 1 ATOM 2758 C C . TYR B 2 306 ? -0.781 8.176 -19.107 1.00 46.54 ? 306 TYR B C 1 ATOM 2759 O O . TYR B 2 306 ? -0.270 7.231 -19.709 1.00 46.99 ? 306 TYR B O 1 ATOM 2760 C CB . TYR B 2 306 ? -2.477 9.159 -20.696 1.00 42.81 ? 306 TYR B CB 1 ATOM 2761 C CG . TYR B 2 306 ? -3.594 8.508 -19.906 1.00 43.13 ? 306 TYR B CG 1 ATOM 2762 C CD1 . TYR B 2 306 ? -4.431 9.263 -19.091 1.00 44.12 ? 306 TYR B CD1 1 ATOM 2763 C CD2 . TYR B 2 306 ? -3.799 7.132 -19.955 1.00 44.00 ? 306 TYR B CD2 1 ATOM 2764 C CE1 . TYR B 2 306 ? -5.451 8.669 -18.352 1.00 44.22 ? 306 TYR B CE1 1 ATOM 2765 C CE2 . TYR B 2 306 ? -4.805 6.523 -19.207 1.00 44.34 ? 306 TYR B CE2 1 ATOM 2766 C CZ . TYR B 2 306 ? -5.634 7.297 -18.411 1.00 50.56 ? 306 TYR B CZ 1 ATOM 2767 O OH . TYR B 2 306 ? -6.641 6.707 -17.686 1.00 50.88 ? 306 TYR B OH 1 ATOM 2768 N N . GLN B 2 307 ? -1.019 8.175 -17.788 1.00 42.86 ? 307 GLN B N 1 ATOM 2769 C CA . GLN B 2 307 ? -0.719 7.058 -16.894 1.00 43.12 ? 307 GLN B CA 1 ATOM 2770 C C . GLN B 2 307 ? -1.927 6.791 -15.994 1.00 46.84 ? 307 GLN B C 1 ATOM 2771 O O . GLN B 2 307 ? -2.580 7.735 -15.542 1.00 45.51 ? 307 GLN B O 1 ATOM 2772 C CB . GLN B 2 307 ? 0.534 7.339 -16.040 1.00 44.84 ? 307 GLN B CB 1 ATOM 2773 C CG . GLN B 2 307 ? 1.830 7.621 -16.816 1.00 63.60 ? 307 GLN B CG 1 ATOM 2774 C CD . GLN B 2 307 ? 2.393 6.416 -17.531 1.00 87.26 ? 307 GLN B CD 1 ATOM 2775 O OE1 . GLN B 2 307 ? 2.336 6.309 -18.758 1.00 84.34 ? 307 GLN B OE1 1 ATOM 2776 N NE2 . GLN B 2 307 ? 2.987 5.496 -16.781 1.00 80.76 ? 307 GLN B NE2 1 ATOM 2777 N N . GLU B 2 308 ? -2.232 5.505 -15.753 1.00 44.66 ? 308 GLU B N 1 ATOM 2778 C CA . GLU B 2 308 ? -3.356 5.089 -14.910 1.00 44.72 ? 308 GLU B CA 1 ATOM 2779 C C . GLU B 2 308 ? -3.023 3.901 -14.013 1.00 50.26 ? 308 GLU B C 1 ATOM 2780 O O . GLU B 2 308 ? -2.249 3.023 -14.405 1.00 50.77 ? 308 GLU B O 1 ATOM 2781 C CB . GLU B 2 308 ? -4.636 4.835 -15.735 1.00 46.12 ? 308 GLU B CB 1 ATOM 2782 C CG . GLU B 2 308 ? -4.551 3.690 -16.737 1.00 57.91 ? 308 GLU B CG 1 ATOM 2783 C CD . GLU B 2 308 ? -5.871 3.211 -17.312 1.00 80.46 ? 308 GLU B CD 1 ATOM 2784 O OE1 . GLU B 2 308 ? -5.958 3.079 -18.554 1.00 76.64 ? 308 GLU B OE1 1 ATOM 2785 O OE2 . GLU B 2 308 ? -6.809 2.942 -16.527 1.00 75.56 ? 308 GLU B OE2 1 ATOM 2786 N N . GLU B 2 309 ? -3.613 3.885 -12.805 1.00 47.40 ? 309 GLU B N 1 ATOM 2787 C CA . GLU B 2 309 ? -3.433 2.829 -11.808 1.00 48.84 ? 309 GLU B CA 1 ATOM 2788 C C . GLU B 2 309 ? -4.619 2.724 -10.854 1.00 53.65 ? 309 GLU B C 1 ATOM 2789 O O . GLU B 2 309 ? -5.154 3.745 -10.415 1.00 52.28 ? 309 GLU B O 1 ATOM 2790 C CB . GLU B 2 309 ? -2.101 2.978 -11.037 1.00 50.41 ? 309 GLU B CB 1 ATOM 2791 C CG . GLU B 2 309 ? -1.905 4.295 -10.299 1.00 60.35 ? 309 GLU B CG 1 ATOM 2792 C CD . GLU B 2 309 ? -0.574 4.433 -9.586 1.00 83.49 ? 309 GLU B CD 1 ATOM 2793 O OE1 . GLU B 2 309 ? -0.189 3.502 -8.842 1.00 81.05 ? 309 GLU B OE1 1 ATOM 2794 O OE2 . GLU B 2 309 ? 0.091 5.475 -9.779 1.00 77.46 ? 309 GLU B OE2 1 ATOM 2795 N N . TRP B 2 310 ? -5.034 1.486 -10.549 1.00 52.37 ? 310 TRP B N 1 ATOM 2796 C CA . TRP B 2 310 ? -6.131 1.221 -9.625 1.00 53.62 ? 310 TRP B CA 1 ATOM 2797 C C . TRP B 2 310 ? -5.568 1.180 -8.209 1.00 59.41 ? 310 TRP B C 1 ATOM 2798 O O . TRP B 2 310 ? -4.720 0.337 -7.903 1.00 60.22 ? 310 TRP B O 1 ATOM 2799 C CB . TRP B 2 310 ? -6.847 -0.093 -9.975 1.00 54.22 ? 310 TRP B CB 1 ATOM 2800 C CG . TRP B 2 310 ? -7.840 0.029 -11.090 1.00 54.48 ? 310 TRP B CG 1 ATOM 2801 C CD1 . TRP B 2 310 ? -7.634 -0.262 -12.406 1.00 56.88 ? 310 TRP B CD1 1 ATOM 2802 C CD2 . TRP B 2 310 ? -9.207 0.445 -10.979 1.00 54.36 ? 310 TRP B CD2 1 ATOM 2803 N NE1 . TRP B 2 310 ? -8.788 -0.054 -13.123 1.00 55.99 ? 310 TRP B NE1 1 ATOM 2804 C CE2 . TRP B 2 310 ? -9.771 0.383 -12.273 1.00 57.70 ? 310 TRP B CE2 1 ATOM 2805 C CE3 . TRP B 2 310 ? -10.015 0.869 -9.910 1.00 56.26 ? 310 TRP B CE3 1 ATOM 2806 C CZ2 . TRP B 2 310 ? -11.098 0.745 -12.530 1.00 56.97 ? 310 TRP B CZ2 1 ATOM 2807 C CZ3 . TRP B 2 310 ? -11.333 1.217 -10.164 1.00 57.83 ? 310 TRP B CZ3 1 ATOM 2808 C CH2 . TRP B 2 310 ? -11.862 1.154 -11.460 1.00 57.81 ? 310 TRP B CH2 1 ATOM 2809 N N . VAL B 2 311 ? -6.002 2.126 -7.364 1.00 56.28 ? 311 VAL B N 1 ATOM 2810 C CA . VAL B 2 311 ? -5.555 2.235 -5.974 1.00 57.40 ? 311 VAL B CA 1 ATOM 2811 C C . VAL B 2 311 ? -6.498 1.403 -5.098 1.00 64.88 ? 311 VAL B C 1 ATOM 2812 O O . VAL B 2 311 ? -7.703 1.667 -5.055 1.00 64.82 ? 311 VAL B O 1 ATOM 2813 C CB . VAL B 2 311 ? -5.402 3.712 -5.504 1.00 59.65 ? 311 VAL B CB 1 ATOM 2814 C CG1 . VAL B 2 311 ? -4.783 3.790 -4.110 1.00 60.47 ? 311 VAL B CG1 1 ATOM 2815 C CG2 . VAL B 2 311 ? -4.566 4.523 -6.495 1.00 57.32 ? 311 VAL B CG2 1 ATOM 2816 N N . MET B 2 312 ? -5.947 0.367 -4.446 1.00 64.32 ? 312 MET B N 1 ATOM 2817 C CA . MET B 2 312 ? -6.704 -0.563 -3.607 1.00 67.68 ? 312 MET B CA 1 ATOM 2818 C C . MET B 2 312 ? -6.674 -0.201 -2.125 1.00 73.04 ? 312 MET B C 1 ATOM 2819 O O . MET B 2 312 ? -7.725 -0.196 -1.479 1.00 74.47 ? 312 MET B O 1 ATOM 2820 C CB . MET B 2 312 ? -6.236 -2.009 -3.841 1.00 72.35 ? 312 MET B CB 1 ATOM 2821 C CG . MET B 2 312 ? -6.616 -2.538 -5.211 1.00 75.78 ? 312 MET B CG 1 ATOM 2822 S SD . MET B 2 312 ? -5.722 -4.038 -5.675 1.00 82.23 ? 312 MET B SD 1 ATOM 2823 C CE . MET B 2 312 ? -4.255 -3.325 -6.389 1.00 75.86 ? 312 MET B CE 1 ATOM 2824 N N . HIS B 2 313 ? -5.475 0.104 -1.592 1.00 68.96 ? 313 HIS B N 1 ATOM 2825 C CA . HIS B 2 313 ? -5.267 0.453 -0.183 1.00 70.02 ? 313 HIS B CA 1 ATOM 2826 C C . HIS B 2 313 ? -4.539 1.803 -0.035 1.00 71.01 ? 313 HIS B C 1 ATOM 2827 O O . HIS B 2 313 ? -4.374 2.521 -1.022 1.00 67.96 ? 313 HIS B O 1 ATOM 2828 C CB . HIS B 2 313 ? -4.498 -0.667 0.558 1.00 73.55 ? 313 HIS B CB 1 ATOM 2829 C CG . HIS B 2 313 ? -4.516 -2.000 -0.123 1.00 78.67 ? 313 HIS B CG 1 ATOM 2830 N ND1 . HIS B 2 313 ? -3.474 -2.407 -0.936 1.00 79.37 ? 313 HIS B ND1 1 ATOM 2831 C CD2 . HIS B 2 313 ? -5.456 -2.973 -0.096 1.00 83.31 ? 313 HIS B CD2 1 ATOM 2832 C CE1 . HIS B 2 313 ? -3.809 -3.610 -1.373 1.00 80.98 ? 313 HIS B CE1 1 ATOM 2833 N NE2 . HIS B 2 313 ? -4.993 -3.992 -0.894 1.00 83.76 ? 313 HIS B NE2 1 ATOM 2834 N N . LYS B 2 314 ? -4.111 2.139 1.202 1.00 68.40 ? 314 LYS B N 1 ATOM 2835 C CA . LYS B 2 314 ? -3.396 3.369 1.567 1.00 66.26 ? 314 LYS B CA 1 ATOM 2836 C C . LYS B 2 314 ? -2.093 3.504 0.770 1.00 67.86 ? 314 LYS B C 1 ATOM 2837 O O . LYS B 2 314 ? -1.237 2.618 0.837 1.00 68.48 ? 314 LYS B O 1 ATOM 2838 C CB . LYS B 2 314 ? -3.108 3.392 3.082 1.00 70.91 ? 314 LYS B CB 1 ATOM 2839 C CG . LYS B 2 314 ? -4.360 3.363 3.956 1.00 88.42 ? 314 LYS B CG 1 ATOM 2840 C CD . LYS B 2 314 ? -4.029 3.052 5.408 1.00 101.53 ? 314 LYS B CD 1 ATOM 2841 C CE . LYS B 2 314 ? -5.264 2.972 6.269 1.00 114.84 ? 314 LYS B CE 1 ATOM 2842 N NZ . LYS B 2 314 ? -4.926 2.652 7.680 1.00 126.41 ? 314 LYS B NZ 1 ATOM 2843 N N . LYS B 2 315 ? -1.967 4.593 -0.017 1.00 61.62 ? 315 LYS B N 1 ATOM 2844 C CA . LYS B 2 315 ? -0.798 4.837 -0.867 1.00 59.65 ? 315 LYS B CA 1 ATOM 2845 C C . LYS B 2 315 ? -0.515 6.327 -1.073 1.00 61.24 ? 315 LYS B C 1 ATOM 2846 O O . LYS B 2 315 ? -1.433 7.100 -1.358 1.00 59.96 ? 315 LYS B O 1 ATOM 2847 C CB . LYS B 2 315 ? -0.976 4.129 -2.226 1.00 61.71 ? 315 LYS B CB 1 ATOM 2848 C CG . LYS B 2 315 ? 0.300 4.019 -3.062 1.00 75.38 ? 315 LYS B CG 1 ATOM 2849 C CD . LYS B 2 315 ? 0.126 3.104 -4.266 1.00 85.48 ? 315 LYS B CD 1 ATOM 2850 C CE . LYS B 2 315 ? -0.586 3.740 -5.436 1.00 95.01 ? 315 LYS B CE 1 ATOM 2851 N NZ . LYS B 2 315 ? -1.058 2.715 -6.399 1.00 105.20 ? 315 LYS B NZ 1 ATOM 2852 N N . GLU B 2 316 ? 0.768 6.712 -0.958 1.00 57.10 ? 316 GLU B N 1 ATOM 2853 C CA . GLU B 2 316 ? 1.240 8.080 -1.172 1.00 55.39 ? 316 GLU B CA 1 ATOM 2854 C C . GLU B 2 316 ? 1.779 8.185 -2.603 1.00 57.47 ? 316 GLU B C 1 ATOM 2855 O O . GLU B 2 316 ? 2.615 7.371 -3.008 1.00 57.49 ? 316 GLU B O 1 ATOM 2856 C CB . GLU B 2 316 ? 2.323 8.455 -0.142 1.00 57.42 ? 316 GLU B CB 1 ATOM 2857 C CG . GLU B 2 316 ? 2.662 9.937 -0.119 1.00 67.76 ? 316 GLU B CG 1 ATOM 2858 C CD . GLU B 2 316 ? 3.870 10.306 0.719 1.00 90.39 ? 316 GLU B CD 1 ATOM 2859 O OE1 . GLU B 2 316 ? 5.007 10.006 0.288 1.00 85.42 ? 316 GLU B OE1 1 ATOM 2860 O OE2 . GLU B 2 316 ? 3.683 10.922 1.793 1.00 85.68 ? 316 GLU B OE2 1 ATOM 2861 N N . VAL B 2 317 ? 1.285 9.172 -3.370 1.00 52.33 ? 317 VAL B N 1 ATOM 2862 C CA . VAL B 2 317 ? 1.702 9.381 -4.761 1.00 51.11 ? 317 VAL B CA 1 ATOM 2863 C C . VAL B 2 317 ? 2.402 10.725 -4.990 1.00 53.71 ? 317 VAL B C 1 ATOM 2864 O O . VAL B 2 317 ? 1.868 11.772 -4.617 1.00 52.95 ? 317 VAL B O 1 ATOM 2865 C CB . VAL B 2 317 ? 0.598 9.077 -5.815 1.00 54.54 ? 317 VAL B CB 1 ATOM 2866 C CG1 . VAL B 2 317 ? 0.311 7.579 -5.902 1.00 55.15 ? 317 VAL B CG1 1 ATOM 2867 C CG2 . VAL B 2 317 ? -0.686 9.865 -5.552 1.00 53.96 ? 317 VAL B CG2 1 ATOM 2868 N N . VAL B 2 318 ? 3.608 10.684 -5.584 1.00 49.90 ? 318 VAL B N 1 ATOM 2869 C CA . VAL B 2 318 ? 4.407 11.874 -5.894 1.00 49.54 ? 318 VAL B CA 1 ATOM 2870 C C . VAL B 2 318 ? 4.362 12.094 -7.412 1.00 52.58 ? 318 VAL B C 1 ATOM 2871 O O . VAL B 2 318 ? 4.878 11.270 -8.172 1.00 52.51 ? 318 VAL B O 1 ATOM 2872 C CB . VAL B 2 318 ? 5.859 11.794 -5.335 1.00 54.38 ? 318 VAL B CB 1 ATOM 2873 C CG1 . VAL B 2 318 ? 6.631 13.086 -5.604 1.00 54.71 ? 318 VAL B CG1 1 ATOM 2874 C CG2 . VAL B 2 318 ? 5.864 11.474 -3.842 1.00 54.53 ? 318 VAL B CG2 1 ATOM 2875 N N . LEU B 2 319 ? 3.705 13.186 -7.843 1.00 48.23 ? 319 LEU B N 1 ATOM 2876 C CA . LEU B 2 319 ? 3.546 13.537 -9.257 1.00 47.81 ? 319 LEU B CA 1 ATOM 2877 C C . LEU B 2 319 ? 4.254 14.837 -9.608 1.00 51.78 ? 319 LEU B C 1 ATOM 2878 O O . LEU B 2 319 ? 4.127 15.814 -8.874 1.00 51.47 ? 319 LEU B O 1 ATOM 2879 C CB . LEU B 2 319 ? 2.057 13.652 -9.636 1.00 47.05 ? 319 LEU B CB 1 ATOM 2880 C CG . LEU B 2 319 ? 1.199 12.382 -9.676 1.00 51.20 ? 319 LEU B CG 1 ATOM 2881 C CD1 . LEU B 2 319 ? -0.169 12.681 -10.233 1.00 50.84 ? 319 LEU B CD1 1 ATOM 2882 C CD2 . LEU B 2 319 ? 1.867 11.264 -10.445 1.00 54.09 ? 319 LEU B CD2 1 ATOM 2883 N N . THR B 2 320 ? 4.976 14.857 -10.744 1.00 48.67 ? 320 THR B N 1 ATOM 2884 C CA . THR B 2 320 ? 5.692 16.042 -11.228 1.00 49.70 ? 320 THR B CA 1 ATOM 2885 C C . THR B 2 320 ? 4.724 16.956 -11.991 1.00 52.61 ? 320 THR B C 1 ATOM 2886 O O . THR B 2 320 ? 4.044 16.502 -12.916 1.00 51.68 ? 320 THR B O 1 ATOM 2887 C CB . THR B 2 320 ? 6.931 15.635 -12.054 1.00 59.77 ? 320 THR B CB 1 ATOM 2888 O OG1 . THR B 2 320 ? 7.735 14.731 -11.294 1.00 59.60 ? 320 THR B OG1 1 ATOM 2889 C CG2 . THR B 2 320 ? 7.780 16.830 -12.482 1.00 60.47 ? 320 THR B CG2 1 ATOM 2890 N N . VAL B 2 321 ? 4.662 18.239 -11.592 1.00 49.13 ? 321 VAL B N 1 ATOM 2891 C CA . VAL B 2 321 ? 3.795 19.245 -12.211 1.00 49.02 ? 321 VAL B CA 1 ATOM 2892 C C . VAL B 2 321 ? 4.616 20.094 -13.209 1.00 54.61 ? 321 VAL B C 1 ATOM 2893 O O . VAL B 2 321 ? 5.436 20.910 -12.776 1.00 55.65 ? 321 VAL B O 1 ATOM 2894 C CB . VAL B 2 321 ? 3.029 20.112 -11.165 1.00 52.44 ? 321 VAL B CB 1 ATOM 2895 C CG1 . VAL B 2 321 ? 2.086 21.105 -11.844 1.00 52.91 ? 321 VAL B CG1 1 ATOM 2896 C CG2 . VAL B 2 321 ? 2.259 19.241 -10.176 1.00 50.32 ? 321 VAL B CG2 1 ATOM 2897 N N . PRO B 2 322 ? 4.427 19.909 -14.541 1.00 51.43 ? 322 PRO B N 1 ATOM 2898 C CA . PRO B 2 322 ? 5.191 20.723 -15.503 1.00 53.94 ? 322 PRO B CA 1 ATOM 2899 C C . PRO B 2 322 ? 4.607 22.128 -15.668 1.00 58.94 ? 322 PRO B C 1 ATOM 2900 O O . PRO B 2 322 ? 3.469 22.363 -15.258 1.00 57.08 ? 322 PRO B O 1 ATOM 2901 C CB . PRO B 2 322 ? 5.106 19.910 -16.796 1.00 55.87 ? 322 PRO B CB 1 ATOM 2902 C CG . PRO B 2 322 ? 3.821 19.168 -16.694 1.00 57.76 ? 322 PRO B CG 1 ATOM 2903 C CD . PRO B 2 322 ? 3.500 18.984 -15.231 1.00 51.42 ? 322 PRO B CD 1 ATOM 2904 N N . THR B 2 323 ? 5.377 23.049 -16.291 1.00 58.54 ? 323 THR B N 1 ATOM 2905 C CA . THR B 2 323 ? 4.987 24.448 -16.547 1.00 60.52 ? 323 THR B CA 1 ATOM 2906 C C . THR B 2 323 ? 3.657 24.576 -17.299 1.00 63.26 ? 323 THR B C 1 ATOM 2907 O O . THR B 2 323 ? 2.892 25.504 -17.033 1.00 63.21 ? 323 THR B O 1 ATOM 2908 C CB . THR B 2 323 ? 6.113 25.224 -17.249 1.00 73.43 ? 323 THR B CB 1 ATOM 2909 O OG1 . THR B 2 323 ? 6.506 24.528 -18.434 1.00 74.35 ? 323 THR B OG1 1 ATOM 2910 C CG2 . THR B 2 323 ? 7.319 25.461 -16.344 1.00 73.38 ? 323 THR B CG2 1 ATOM 2911 N N . GLU B 2 324 ? 3.383 23.630 -18.219 1.00 58.58 ? 324 GLU B N 1 ATOM 2912 C CA . GLU B 2 324 ? 2.150 23.556 -19.009 1.00 57.50 ? 324 GLU B CA 1 ATOM 2913 C C . GLU B 2 324 ? 0.929 23.175 -18.157 1.00 57.67 ? 324 GLU B C 1 ATOM 2914 O O . GLU B 2 324 ? -0.197 23.533 -18.510 1.00 57.02 ? 324 GLU B O 1 ATOM 2915 C CB . GLU B 2 324 ? 2.306 22.606 -20.214 1.00 59.02 ? 324 GLU B CB 1 ATOM 2916 C CG . GLU B 2 324 ? 2.932 21.256 -19.892 1.00 67.91 ? 324 GLU B CG 1 ATOM 2917 C CD . GLU B 2 324 ? 4.410 21.138 -20.209 1.00 91.77 ? 324 GLU B CD 1 ATOM 2918 O OE1 . GLU B 2 324 ? 5.199 21.986 -19.731 1.00 88.35 ? 324 GLU B OE1 1 ATOM 2919 O OE2 . GLU B 2 324 ? 4.784 20.177 -20.919 1.00 86.56 ? 324 GLU B OE2 1 ATOM 2920 N N . GLY B 2 325 ? 1.168 22.457 -17.057 1.00 51.68 ? 325 GLY B N 1 ATOM 2921 C CA . GLY B 2 325 ? 0.131 22.030 -16.125 1.00 48.73 ? 325 GLY B CA 1 ATOM 2922 C C . GLY B 2 325 ? -0.081 20.532 -16.048 1.00 49.84 ? 325 GLY B C 1 ATOM 2923 O O . GLY B 2 325 ? 0.276 19.800 -16.976 1.00 49.67 ? 325 GLY B O 1 ATOM 2924 N N . LEU B 2 326 ? -0.678 20.072 -14.933 1.00 44.04 ? 326 LEU B N 1 ATOM 2925 C CA . LEU B 2 326 ? -0.983 18.663 -14.685 1.00 41.72 ? 326 LEU B CA 1 ATOM 2926 C C . LEU B 2 326 ? -2.446 18.487 -14.263 1.00 43.60 ? 326 LEU B C 1 ATOM 2927 O O . LEU B 2 326 ? -2.922 19.195 -13.373 1.00 43.17 ? 326 LEU B O 1 ATOM 2928 C CB . LEU B 2 326 ? -0.027 18.081 -13.623 1.00 41.35 ? 326 LEU B CB 1 ATOM 2929 C CG . LEU B 2 326 ? -0.079 16.563 -13.388 1.00 44.83 ? 326 LEU B CG 1 ATOM 2930 C CD1 . LEU B 2 326 ? 0.745 15.807 -14.427 1.00 45.64 ? 326 LEU B CD1 1 ATOM 2931 C CD2 . LEU B 2 326 ? 0.415 16.218 -11.998 1.00 46.92 ? 326 LEU B CD2 1 ATOM 2932 N N . GLU B 2 327 ? -3.152 17.549 -14.919 1.00 38.73 ? 327 GLU B N 1 ATOM 2933 C CA . GLU B 2 327 ? -4.552 17.221 -14.645 1.00 37.25 ? 327 GLU B CA 1 ATOM 2934 C C . GLU B 2 327 ? -4.608 15.840 -13.985 1.00 39.62 ? 327 GLU B C 1 ATOM 2935 O O . GLU B 2 327 ? -4.086 14.877 -14.548 1.00 39.13 ? 327 GLU B O 1 ATOM 2936 C CB . GLU B 2 327 ? -5.378 17.249 -15.945 1.00 38.80 ? 327 GLU B CB 1 ATOM 2937 C CG . GLU B 2 327 ? -6.879 17.274 -15.714 1.00 48.15 ? 327 GLU B CG 1 ATOM 2938 C CD . GLU B 2 327 ? -7.725 16.850 -16.898 1.00 67.76 ? 327 GLU B CD 1 ATOM 2939 O OE1 . GLU B 2 327 ? -7.607 15.679 -17.327 1.00 61.81 ? 327 GLU B OE1 1 ATOM 2940 O OE2 . GLU B 2 327 ? -8.542 17.674 -17.367 1.00 61.72 ? 327 GLU B OE2 1 ATOM 2941 N N . VAL B 2 328 ? -5.206 15.754 -12.778 1.00 35.37 ? 328 VAL B N 1 ATOM 2942 C CA . VAL B 2 328 ? -5.311 14.508 -12.003 1.00 34.49 ? 328 VAL B CA 1 ATOM 2943 C C . VAL B 2 328 ? -6.783 14.149 -11.745 1.00 37.93 ? 328 VAL B C 1 ATOM 2944 O O . VAL B 2 328 ? -7.534 14.980 -11.233 1.00 37.73 ? 328 VAL B O 1 ATOM 2945 C CB . VAL B 2 328 ? -4.497 14.562 -10.671 1.00 38.47 ? 328 VAL B CB 1 ATOM 2946 C CG1 . VAL B 2 328 ? -4.431 13.189 -10.005 1.00 38.17 ? 328 VAL B CG1 1 ATOM 2947 C CG2 . VAL B 2 328 ? -3.089 15.114 -10.886 1.00 38.70 ? 328 VAL B CG2 1 ATOM 2948 N N . THR B 2 329 ? -7.181 12.907 -12.079 1.00 34.22 ? 329 THR B N 1 ATOM 2949 C CA . THR B 2 329 ? -8.540 12.411 -11.852 1.00 34.20 ? 329 THR B CA 1 ATOM 2950 C C . THR B 2 329 ? -8.503 11.266 -10.833 1.00 38.49 ? 329 THR B C 1 ATOM 2951 O O . THR B 2 329 ? -7.863 10.239 -11.075 1.00 38.22 ? 329 THR B O 1 ATOM 2952 C CB . THR B 2 329 ? -9.242 12.052 -13.178 1.00 41.97 ? 329 THR B CB 1 ATOM 2953 O OG1 . THR B 2 329 ? -9.069 13.121 -14.110 1.00 41.79 ? 329 THR B OG1 1 ATOM 2954 C CG2 . THR B 2 329 ? -10.732 11.775 -12.997 1.00 40.74 ? 329 THR B CG2 1 ATOM 2955 N N . TRP B 2 330 ? -9.171 11.468 -9.685 1.00 35.49 ? 330 TRP B N 1 ATOM 2956 C CA . TRP B 2 330 ? -9.250 10.503 -8.588 1.00 36.18 ? 330 TRP B CA 1 ATOM 2957 C C . TRP B 2 330 ? -10.679 9.962 -8.492 1.00 40.90 ? 330 TRP B C 1 ATOM 2958 O O . TRP B 2 330 ? -11.558 10.615 -7.926 1.00 41.11 ? 330 TRP B O 1 ATOM 2959 C CB . TRP B 2 330 ? -8.756 11.155 -7.275 1.00 35.26 ? 330 TRP B CB 1 ATOM 2960 C CG . TRP B 2 330 ? -8.992 10.374 -6.011 1.00 37.62 ? 330 TRP B CG 1 ATOM 2961 C CD1 . TRP B 2 330 ? -9.742 10.763 -4.941 1.00 41.67 ? 330 TRP B CD1 1 ATOM 2962 C CD2 . TRP B 2 330 ? -8.420 9.104 -5.661 1.00 38.24 ? 330 TRP B CD2 1 ATOM 2963 N NE1 . TRP B 2 330 ? -9.692 9.806 -3.953 1.00 42.66 ? 330 TRP B NE1 1 ATOM 2964 C CE2 . TRP B 2 330 ? -8.888 8.776 -4.368 1.00 43.87 ? 330 TRP B CE2 1 ATOM 2965 C CE3 . TRP B 2 330 ? -7.578 8.195 -6.325 1.00 39.17 ? 330 TRP B CE3 1 ATOM 2966 C CZ2 . TRP B 2 330 ? -8.530 7.586 -3.721 1.00 44.65 ? 330 TRP B CZ2 1 ATOM 2967 C CZ3 . TRP B 2 330 ? -7.218 7.022 -5.681 1.00 41.98 ? 330 TRP B CZ3 1 ATOM 2968 C CH2 . TRP B 2 330 ? -7.692 6.726 -4.395 1.00 44.39 ? 330 TRP B CH2 1 ATOM 2969 N N . GLY B 2 331 ? -10.894 8.794 -9.097 1.00 37.73 ? 331 GLY B N 1 ATOM 2970 C CA . GLY B 2 331 ? -12.191 8.127 -9.149 1.00 38.76 ? 331 GLY B CA 1 ATOM 2971 C C . GLY B 2 331 ? -13.234 8.898 -9.932 1.00 42.24 ? 331 GLY B C 1 ATOM 2972 O O . GLY B 2 331 ? -12.928 9.462 -10.987 1.00 40.41 ? 331 GLY B O 1 ATOM 2973 N N . ASN B 2 332 ? -14.466 8.958 -9.394 1.00 40.37 ? 332 ASN B N 1 ATOM 2974 C CA . ASN B 2 332 ? -15.598 9.655 -10.013 1.00 40.26 ? 332 ASN B CA 1 ATOM 2975 C C . ASN B 2 332 ? -15.621 11.175 -9.769 1.00 43.82 ? 332 ASN B C 1 ATOM 2976 O O . ASN B 2 332 ? -16.544 11.853 -10.231 1.00 43.56 ? 332 ASN B O 1 ATOM 2977 C CB . ASN B 2 332 ? -16.925 8.997 -9.621 1.00 42.89 ? 332 ASN B CB 1 ATOM 2978 C CG . ASN B 2 332 ? -17.075 7.576 -10.107 1.00 65.90 ? 332 ASN B CG 1 ATOM 2979 O OD1 . ASN B 2 332 ? -16.857 7.261 -11.283 1.00 58.98 ? 332 ASN B OD1 1 ATOM 2980 N ND2 . ASN B 2 332 ? -17.482 6.690 -9.214 1.00 60.07 ? 332 ASN B ND2 1 ATOM 2981 N N . ASN B 2 333 ? -14.598 11.711 -9.072 1.00 40.16 ? 333 ASN B N 1 ATOM 2982 C CA . ASN B 2 333 ? -14.468 13.143 -8.795 1.00 39.80 ? 333 ASN B CA 1 ATOM 2983 C C . ASN B 2 333 ? -14.072 13.895 -10.060 1.00 42.76 ? 333 ASN B C 1 ATOM 2984 O O . ASN B 2 333 ? -13.455 13.309 -10.955 1.00 41.39 ? 333 ASN B O 1 ATOM 2985 C CB . ASN B 2 333 ? -13.411 13.397 -7.716 1.00 40.67 ? 333 ASN B CB 1 ATOM 2986 C CG . ASN B 2 333 ? -13.762 12.857 -6.358 1.00 66.00 ? 333 ASN B CG 1 ATOM 2987 O OD1 . ASN B 2 333 ? -14.646 13.370 -5.664 1.00 62.46 ? 333 ASN B OD1 1 ATOM 2988 N ND2 . ASN B 2 333 ? -13.037 11.838 -5.929 1.00 57.97 ? 333 ASN B ND2 1 ATOM 2989 N N . GLU B 2 334 ? -14.410 15.200 -10.120 1.00 39.97 ? 334 GLU B N 1 ATOM 2990 C CA . GLU B 2 334 ? -14.052 16.081 -11.234 1.00 39.40 ? 334 GLU B CA 1 ATOM 2991 C C . GLU B 2 334 ? -12.523 16.245 -11.251 1.00 42.83 ? 334 GLU B C 1 ATOM 2992 O O . GLU B 2 334 ? -11.918 16.260 -10.173 1.00 42.64 ? 334 GLU B O 1 ATOM 2993 C CB . GLU B 2 334 ? -14.749 17.448 -11.109 1.00 41.67 ? 334 GLU B CB 1 ATOM 2994 C CG . GLU B 2 334 ? -16.254 17.414 -11.339 1.00 54.07 ? 334 GLU B CG 1 ATOM 2995 C CD . GLU B 2 334 ? -16.713 16.992 -12.723 1.00 76.47 ? 334 GLU B CD 1 ATOM 2996 O OE1 . GLU B 2 334 ? -16.384 17.696 -13.705 1.00 72.18 ? 334 GLU B OE1 1 ATOM 2997 O OE2 . GLU B 2 334 ? -17.422 15.964 -12.821 1.00 71.25 ? 334 GLU B OE2 1 ATOM 2998 N N . PRO B 2 335 ? -11.869 16.305 -12.437 1.00 38.84 ? 335 PRO B N 1 ATOM 2999 C CA . PRO B 2 335 ? -10.398 16.393 -12.459 1.00 38.31 ? 335 PRO B CA 1 ATOM 3000 C C . PRO B 2 335 ? -9.800 17.606 -11.753 1.00 42.77 ? 335 PRO B C 1 ATOM 3001 O O . PRO B 2 335 ? -10.311 18.718 -11.895 1.00 43.05 ? 335 PRO B O 1 ATOM 3002 C CB . PRO B 2 335 ? -10.064 16.383 -13.954 1.00 39.92 ? 335 PRO B CB 1 ATOM 3003 C CG . PRO B 2 335 ? -11.310 16.834 -14.631 1.00 44.70 ? 335 PRO B CG 1 ATOM 3004 C CD . PRO B 2 335 ? -12.417 16.262 -13.808 1.00 40.28 ? 335 PRO B CD 1 ATOM 3005 N N . TYR B 2 336 ? -8.734 17.372 -10.965 1.00 39.20 ? 336 TYR B N 1 ATOM 3006 C CA . TYR B 2 336 ? -8.000 18.421 -10.258 1.00 39.63 ? 336 TYR B CA 1 ATOM 3007 C C . TYR B 2 336 ? -6.929 18.942 -11.213 1.00 43.53 ? 336 TYR B C 1 ATOM 3008 O O . TYR B 2 336 ? -6.260 18.143 -11.872 1.00 42.66 ? 336 TYR B O 1 ATOM 3009 C CB . TYR B 2 336 ? -7.312 17.894 -8.976 1.00 40.85 ? 336 TYR B CB 1 ATOM 3010 C CG . TYR B 2 336 ? -8.117 16.961 -8.094 1.00 42.87 ? 336 TYR B CG 1 ATOM 3011 C CD1 . TYR B 2 336 ? -9.296 17.387 -7.485 1.00 45.59 ? 336 TYR B CD1 1 ATOM 3012 C CD2 . TYR B 2 336 ? -7.636 15.697 -7.763 1.00 43.37 ? 336 TYR B CD2 1 ATOM 3013 C CE1 . TYR B 2 336 ? -10.018 16.547 -6.636 1.00 46.85 ? 336 TYR B CE1 1 ATOM 3014 C CE2 . TYR B 2 336 ? -8.344 14.851 -6.909 1.00 44.77 ? 336 TYR B CE2 1 ATOM 3015 C CZ . TYR B 2 336 ? -9.536 15.280 -6.348 1.00 52.84 ? 336 TYR B CZ 1 ATOM 3016 O OH . TYR B 2 336 ? -10.237 14.447 -5.508 1.00 54.64 ? 336 TYR B OH 1 ATOM 3017 N N . LYS B 2 337 ? -6.766 20.270 -11.291 1.00 40.89 ? 337 LYS B N 1 ATOM 3018 C CA . LYS B 2 337 ? -5.763 20.886 -12.158 1.00 41.43 ? 337 LYS B CA 1 ATOM 3019 C C . LYS B 2 337 ? -4.689 21.582 -11.331 1.00 45.83 ? 337 LYS B C 1 ATOM 3020 O O . LYS B 2 337 ? -5.012 22.331 -10.407 1.00 45.97 ? 337 LYS B O 1 ATOM 3021 C CB . LYS B 2 337 ? -6.415 21.843 -13.164 1.00 45.07 ? 337 LYS B CB 1 ATOM 3022 C CG . LYS B 2 337 ? -7.072 21.134 -14.341 1.00 58.98 ? 337 LYS B CG 1 ATOM 3023 C CD . LYS B 2 337 ? -7.775 22.116 -15.264 1.00 70.95 ? 337 LYS B CD 1 ATOM 3024 C CE . LYS B 2 337 ? -8.420 21.427 -16.439 1.00 81.89 ? 337 LYS B CE 1 ATOM 3025 N NZ . LYS B 2 337 ? -9.137 22.391 -17.313 1.00 93.28 ? 337 LYS B NZ 1 ATOM 3026 N N . TYR B 2 338 ? -3.413 21.306 -11.646 1.00 42.42 ? 338 TYR B N 1 ATOM 3027 C CA . TYR B 2 338 ? -2.260 21.864 -10.940 1.00 43.08 ? 338 TYR B CA 1 ATOM 3028 C C . TYR B 2 338 ? -1.307 22.590 -11.886 1.00 48.39 ? 338 TYR B C 1 ATOM 3029 O O . TYR B 2 338 ? -1.032 22.099 -12.981 1.00 48.04 ? 338 TYR B O 1 ATOM 3030 C CB . TYR B 2 338 ? -1.510 20.765 -10.165 1.00 43.30 ? 338 TYR B CB 1 ATOM 3031 C CG . TYR B 2 338 ? -2.361 20.010 -9.165 1.00 43.94 ? 338 TYR B CG 1 ATOM 3032 C CD1 . TYR B 2 338 ? -2.627 20.539 -7.905 1.00 46.24 ? 338 TYR B CD1 1 ATOM 3033 C CD2 . TYR B 2 338 ? -2.870 18.750 -9.464 1.00 43.60 ? 338 TYR B CD2 1 ATOM 3034 C CE1 . TYR B 2 338 ? -3.404 19.845 -6.978 1.00 46.41 ? 338 TYR B CE1 1 ATOM 3035 C CE2 . TYR B 2 338 ? -3.644 18.044 -8.544 1.00 43.89 ? 338 TYR B CE2 1 ATOM 3036 C CZ . TYR B 2 338 ? -3.909 18.596 -7.301 1.00 51.98 ? 338 TYR B CZ 1 ATOM 3037 O OH . TYR B 2 338 ? -4.673 17.905 -6.391 1.00 53.14 ? 338 TYR B OH 1 ATOM 3038 N N . TRP B 2 339 ? -0.802 23.757 -11.450 1.00 46.40 ? 339 TRP B N 1 ATOM 3039 C CA . TRP B 2 339 ? 0.138 24.602 -12.193 1.00 48.44 ? 339 TRP B CA 1 ATOM 3040 C C . TRP B 2 339 ? 1.259 25.103 -11.268 1.00 53.59 ? 339 TRP B C 1 ATOM 3041 O O . TRP B 2 339 ? 0.970 25.458 -10.124 1.00 52.77 ? 339 TRP B O 1 ATOM 3042 C CB . TRP B 2 339 ? -0.585 25.811 -12.803 1.00 48.90 ? 339 TRP B CB 1 ATOM 3043 C CG . TRP B 2 339 ? -1.392 25.509 -14.028 1.00 49.51 ? 339 TRP B CG 1 ATOM 3044 C CD1 . TRP B 2 339 ? -0.932 25.402 -15.307 1.00 53.63 ? 339 TRP B CD1 1 ATOM 3045 C CD2 . TRP B 2 339 ? -2.816 25.364 -14.099 1.00 48.09 ? 339 TRP B CD2 1 ATOM 3046 N NE1 . TRP B 2 339 ? -1.977 25.161 -16.168 1.00 52.53 ? 339 TRP B NE1 1 ATOM 3047 C CE2 . TRP B 2 339 ? -3.147 25.135 -15.454 1.00 52.37 ? 339 TRP B CE2 1 ATOM 3048 C CE3 . TRP B 2 339 ? -3.848 25.385 -13.145 1.00 48.11 ? 339 TRP B CE3 1 ATOM 3049 C CZ2 . TRP B 2 339 ? -4.465 24.933 -15.879 1.00 50.75 ? 339 TRP B CZ2 1 ATOM 3050 C CZ3 . TRP B 2 339 ? -5.153 25.191 -13.568 1.00 48.83 ? 339 TRP B CZ3 1 ATOM 3051 C CH2 . TRP B 2 339 ? -5.451 24.964 -14.919 1.00 49.72 ? 339 TRP B CH2 1 ATOM 3052 N N . PRO B 2 340 ? 2.531 25.178 -11.729 1.00 51.95 ? 340 PRO B N 1 ATOM 3053 C CA . PRO B 2 340 ? 3.594 25.685 -10.844 1.00 53.08 ? 340 PRO B CA 1 ATOM 3054 C C . PRO B 2 340 ? 3.595 27.209 -10.742 1.00 59.71 ? 340 PRO B C 1 ATOM 3055 O O . PRO B 2 340 ? 3.244 27.893 -11.707 1.00 60.99 ? 340 PRO B O 1 ATOM 3056 C CB . PRO B 2 340 ? 4.888 25.160 -11.485 1.00 55.81 ? 340 PRO B CB 1 ATOM 3057 C CG . PRO B 2 340 ? 4.475 24.426 -12.737 1.00 59.59 ? 340 PRO B CG 1 ATOM 3058 C CD . PRO B 2 340 ? 3.072 24.817 -13.052 1.00 54.51 ? 340 PRO B CD 1 ATOM 3059 N N . GLN B 2 341 ? 3.986 27.739 -9.568 1.00 56.92 ? 341 GLN B N 1 ATOM 3060 C CA . GLN B 2 341 ? 4.058 29.180 -9.315 1.00 59.55 ? 341 GLN B CA 1 ATOM 3061 C C . GLN B 2 341 ? 5.297 29.780 -9.977 1.00 66.91 ? 341 GLN B C 1 ATOM 3062 O O . GLN B 2 341 ? 6.382 29.198 -9.897 1.00 66.49 ? 341 GLN B O 1 ATOM 3063 C CB . GLN B 2 341 ? 4.045 29.482 -7.806 1.00 60.42 ? 341 GLN B CB 1 ATOM 3064 C CG . GLN B 2 341 ? 2.664 29.370 -7.160 1.00 72.03 ? 341 GLN B CG 1 ATOM 3065 C CD . GLN B 2 341 ? 1.928 30.689 -7.080 1.00 91.60 ? 341 GLN B CD 1 ATOM 3066 O OE1 . GLN B 2 341 ? 1.721 31.387 -8.080 1.00 88.66 ? 341 GLN B OE1 1 ATOM 3067 N NE2 . GLN B 2 341 ? 1.476 31.041 -5.886 1.00 83.14 ? 341 GLN B NE2 1 ATOM 3068 N N . LEU B 2 342 ? 5.122 30.941 -10.638 1.00 66.69 ? 342 LEU B N 1 ATOM 3069 C CA . LEU B 2 342 ? 6.173 31.676 -11.349 1.00 73.34 ? 342 LEU B CA 1 ATOM 3070 C C . LEU B 2 342 ? 7.229 32.221 -10.389 1.00 86.24 ? 342 LEU B C 1 ATOM 3071 O O . LEU B 2 342 ? 8.433 32.066 -10.681 1.00 89.34 ? 342 LEU B O 1 ATOM 3072 C CB . LEU B 2 342 ? 5.566 32.831 -12.164 1.00 76.55 ? 342 LEU B CB 1 ATOM 3073 C CG . LEU B 2 342 ? 4.807 32.459 -13.437 1.00 80.84 ? 342 LEU B CG 1 ATOM 3074 C CD1 . LEU B 2 342 ? 3.304 32.445 -13.197 1.00 78.69 ? 342 LEU B CD1 1 ATOM 3075 C CD2 . LEU B 2 342 ? 5.132 33.429 -14.557 1.00 88.04 ? 342 LEU B CD2 1 ATOM 3076 N N . GLY C 3 21 ? -18.044 54.735 -38.478 1.00 54.75 ? -1 GLY F N 1 ATOM 3077 C CA . GLY C 3 21 ? -18.486 55.580 -37.374 1.00 55.04 ? -1 GLY F CA 1 ATOM 3078 C C . GLY C 3 21 ? -18.029 55.022 -36.027 1.00 57.54 ? -1 GLY F C 1 ATOM 3079 O O . GLY C 3 21 ? -18.865 54.734 -35.169 1.00 57.19 ? -1 GLY F O 1 ATOM 3080 N N . GLY C 3 22 ? -16.703 54.878 -35.845 1.00 52.99 ? 0 GLY F N 1 ATOM 3081 C CA . GLY C 3 22 ? -16.100 54.362 -34.614 1.00 51.65 ? 0 GLY F CA 1 ATOM 3082 C C . GLY C 3 22 ? -14.624 53.991 -34.788 1.00 54.17 ? 0 GLY F C 1 ATOM 3083 O O . GLY C 3 22 ? -14.016 54.319 -35.810 1.00 53.95 ? 0 GLY F O 1 ATOM 3084 N N . TYR C 3 23 ? -14.054 53.312 -33.775 1.00 49.41 ? 1 TYR F N 1 ATOM 3085 C CA . TYR C 3 23 ? -12.658 52.870 -33.753 1.00 48.05 ? 1 TYR F CA 1 ATOM 3086 C C . TYR C 3 23 ? -12.561 51.345 -33.607 1.00 50.61 ? 1 TYR F C 1 ATOM 3087 O O . TYR C 3 23 ? -13.204 50.764 -32.729 1.00 50.01 ? 1 TYR F O 1 ATOM 3088 C CB . TYR C 3 23 ? -11.885 53.597 -32.632 1.00 49.02 ? 1 TYR F CB 1 ATOM 3089 C CG . TYR C 3 23 ? -10.439 53.176 -32.460 1.00 49.95 ? 1 TYR F CG 1 ATOM 3090 C CD1 . TYR C 3 23 ? -10.066 52.291 -31.453 1.00 51.29 ? 1 TYR F CD1 1 ATOM 3091 C CD2 . TYR C 3 23 ? -9.437 53.699 -33.273 1.00 50.74 ? 1 TYR F CD2 1 ATOM 3092 C CE1 . TYR C 3 23 ? -8.736 51.908 -31.281 1.00 51.66 ? 1 TYR F CE1 1 ATOM 3093 C CE2 . TYR C 3 23 ? -8.103 53.327 -33.108 1.00 51.08 ? 1 TYR F CE2 1 ATOM 3094 C CZ . TYR C 3 23 ? -7.757 52.431 -32.109 1.00 57.93 ? 1 TYR F CZ 1 ATOM 3095 O OH . TYR C 3 23 ? -6.445 52.061 -31.938 1.00 58.45 ? 1 TYR F OH 1 ATOM 3096 N N . GLU C 3 24 ? -11.744 50.708 -34.467 1.00 46.38 ? 2 GLU F N 1 ATOM 3097 C CA . GLU C 3 24 ? -11.519 49.264 -34.447 1.00 45.37 ? 2 GLU F CA 1 ATOM 3098 C C . GLU C 3 24 ? -10.262 48.931 -33.641 1.00 47.89 ? 2 GLU F C 1 ATOM 3099 O O . GLU C 3 24 ? -9.163 49.375 -33.985 1.00 47.30 ? 2 GLU F O 1 ATOM 3100 C CB . GLU C 3 24 ? -11.429 48.693 -35.875 1.00 47.02 ? 2 GLU F CB 1 ATOM 3101 C CG . GLU C 3 24 ? -11.357 47.172 -35.931 1.00 57.61 ? 2 GLU F CG 1 ATOM 3102 C CD . GLU C 3 24 ? -11.159 46.597 -37.320 1.00 79.21 ? 2 GLU F CD 1 ATOM 3103 O OE1 . GLU C 3 24 ? -10.125 45.929 -37.552 1.00 72.80 ? 2 GLU F OE1 1 ATOM 3104 O OE2 . GLU C 3 24 ? -12.041 46.818 -38.182 1.00 74.60 ? 2 GLU F OE2 1 ATOM 3105 N N . HIS C 3 25 ? -10.438 48.148 -32.569 1.00 43.62 ? 3 HIS F N 1 ATOM 3106 C CA . HIS C 3 25 ? -9.357 47.702 -31.697 1.00 42.78 ? 3 HIS F CA 1 ATOM 3107 C C . HIS C 3 25 ? -9.035 46.240 -32.010 1.00 45.68 ? 3 HIS F C 1 ATOM 3108 O O . HIS C 3 25 ? -9.917 45.381 -31.938 1.00 45.13 ? 3 HIS F O 1 ATOM 3109 C CB . HIS C 3 25 ? -9.735 47.899 -30.219 1.00 43.54 ? 3 HIS F CB 1 ATOM 3110 C CG . HIS C 3 25 ? -8.681 47.448 -29.258 1.00 46.66 ? 3 HIS F CG 1 ATOM 3111 N ND1 . HIS C 3 25 ? -7.561 48.218 -29.000 1.00 48.53 ? 3 HIS F ND1 1 ATOM 3112 C CD2 . HIS C 3 25 ? -8.618 46.321 -28.513 1.00 48.12 ? 3 HIS F CD2 1 ATOM 3113 C CE1 . HIS C 3 25 ? -6.853 47.535 -28.116 1.00 47.79 ? 3 HIS F CE1 1 ATOM 3114 N NE2 . HIS C 3 25 ? -7.449 46.387 -27.793 1.00 47.91 ? 3 HIS F NE2 1 ATOM 3115 N N . VAL C 3 26 ? -7.778 45.974 -32.400 1.00 41.70 ? 4 VAL F N 1 ATOM 3116 C CA . VAL C 3 26 ? -7.299 44.634 -32.749 1.00 41.13 ? 4 VAL F CA 1 ATOM 3117 C C . VAL C 3 26 ? -6.268 44.175 -31.713 1.00 44.30 ? 4 VAL F C 1 ATOM 3118 O O . VAL C 3 26 ? -5.284 44.871 -31.466 1.00 44.04 ? 4 VAL F O 1 ATOM 3119 C CB . VAL C 3 26 ? -6.757 44.558 -34.208 1.00 45.40 ? 4 VAL F CB 1 ATOM 3120 C CG1 . VAL C 3 26 ? -6.271 43.151 -34.553 1.00 45.34 ? 4 VAL F CG1 1 ATOM 3121 C CG2 . VAL C 3 26 ? -7.808 45.017 -35.216 1.00 45.54 ? 4 VAL F CG2 1 ATOM 3122 N N . THR C 3 27 ? -6.515 43.016 -31.092 1.00 40.32 ? 5 THR F N 1 ATOM 3123 C CA . THR C 3 27 ? -5.631 42.425 -30.084 1.00 40.08 ? 5 THR F CA 1 ATOM 3124 C C . THR C 3 27 ? -5.580 40.900 -30.213 1.00 43.83 ? 5 THR F C 1 ATOM 3125 O O . THR C 3 27 ? -6.422 40.313 -30.893 1.00 43.22 ? 5 THR F O 1 ATOM 3126 C CB . THR C 3 27 ? -5.945 42.955 -28.665 1.00 47.89 ? 5 THR F CB 1 ATOM 3127 O OG1 . THR C 3 27 ? -5.025 42.387 -27.729 1.00 47.46 ? 5 THR F OG1 1 ATOM 3128 C CG2 . THR C 3 27 ? -7.378 42.680 -28.227 1.00 46.15 ? 5 THR F CG2 1 ATOM 3129 N N . VAL C 3 28 ? -4.566 40.267 -29.596 1.00 40.69 ? 6 VAL F N 1 ATOM 3130 C CA . VAL C 3 28 ? -4.373 38.815 -29.633 1.00 40.76 ? 6 VAL F CA 1 ATOM 3131 C C . VAL C 3 28 ? -4.184 38.287 -28.206 1.00 44.53 ? 6 VAL F C 1 ATOM 3132 O O . VAL C 3 28 ? -3.303 38.762 -27.486 1.00 44.55 ? 6 VAL F O 1 ATOM 3133 C CB . VAL C 3 28 ? -3.208 38.398 -30.582 1.00 45.34 ? 6 VAL F CB 1 ATOM 3134 C CG1 . VAL C 3 28 ? -2.944 36.896 -30.519 1.00 45.66 ? 6 VAL F CG1 1 ATOM 3135 C CG2 . VAL C 3 28 ? -3.474 38.827 -32.023 1.00 45.24 ? 6 VAL F CG2 1 ATOM 3136 N N . ILE C 3 29 ? -5.019 37.316 -27.802 1.00 40.60 ? 7 ILE F N 1 ATOM 3137 C CA . ILE C 3 29 ? -4.947 36.688 -26.478 1.00 40.50 ? 7 ILE F CA 1 ATOM 3138 C C . ILE C 3 29 ? -4.630 35.187 -26.614 1.00 44.75 ? 7 ILE F C 1 ATOM 3139 O O . ILE C 3 29 ? -5.047 34.588 -27.610 1.00 44.27 ? 7 ILE F O 1 ATOM 3140 C CB . ILE C 3 29 ? -6.204 36.960 -25.594 1.00 43.10 ? 7 ILE F CB 1 ATOM 3141 C CG1 . ILE C 3 29 ? -7.498 36.358 -26.194 1.00 43.09 ? 7 ILE F CG1 1 ATOM 3142 C CG2 . ILE C 3 29 ? -6.348 38.451 -25.266 1.00 43.61 ? 7 ILE F CG2 1 ATOM 3143 C CD1 . ILE C 3 29 ? -8.524 35.876 -25.165 1.00 49.68 ? 7 ILE F CD1 1 ATOM 3144 N N . PRO C 3 30 ? -3.907 34.548 -25.656 1.00 41.79 ? 8 PRO F N 1 ATOM 3145 C CA . PRO C 3 30 ? -3.641 33.104 -25.792 1.00 42.18 ? 8 PRO F CA 1 ATOM 3146 C C . PRO C 3 30 ? -4.925 32.290 -25.664 1.00 45.36 ? 8 PRO F C 1 ATOM 3147 O O . PRO C 3 30 ? -5.844 32.703 -24.953 1.00 44.37 ? 8 PRO F O 1 ATOM 3148 C CB . PRO C 3 30 ? -2.674 32.799 -24.639 1.00 44.76 ? 8 PRO F CB 1 ATOM 3149 C CG . PRO C 3 30 ? -2.214 34.124 -24.130 1.00 49.07 ? 8 PRO F CG 1 ATOM 3150 C CD . PRO C 3 30 ? -3.325 35.077 -24.407 1.00 43.61 ? 8 PRO F CD 1 ATOM 3151 N N . ASN C 3 31 ? -4.997 31.147 -26.367 1.00 42.04 ? 9 ASN F N 1 ATOM 3152 C CA . ASN C 3 31 ? -6.167 30.272 -26.338 1.00 41.48 ? 9 ASN F CA 1 ATOM 3153 C C . ASN C 3 31 ? -6.208 29.479 -25.019 1.00 45.31 ? 9 ASN F C 1 ATOM 3154 O O . ASN C 3 31 ? -5.913 28.283 -24.989 1.00 45.65 ? 9 ASN F O 1 ATOM 3155 C CB . ASN C 3 31 ? -6.203 29.370 -27.586 1.00 42.91 ? 9 ASN F CB 1 ATOM 3156 C CG . ASN C 3 31 ? -7.450 28.533 -27.748 1.00 66.39 ? 9 ASN F CG 1 ATOM 3157 O OD1 . ASN C 3 31 ? -8.536 28.867 -27.260 1.00 60.55 ? 9 ASN F OD1 1 ATOM 3158 N ND2 . ASN C 3 31 ? -7.320 27.425 -28.460 1.00 59.07 ? 9 ASN F ND2 1 ATOM 3159 N N . THR C 3 32 ? -6.541 30.183 -23.919 1.00 41.20 ? 10 THR F N 1 ATOM 3160 C CA . THR C 3 32 ? -6.633 29.631 -22.564 1.00 41.29 ? 10 THR F CA 1 ATOM 3161 C C . THR C 3 32 ? -7.916 30.134 -21.900 1.00 44.13 ? 10 THR F C 1 ATOM 3162 O O . THR C 3 32 ? -8.124 31.342 -21.776 1.00 43.21 ? 10 THR F O 1 ATOM 3163 C CB . THR C 3 32 ? -5.355 29.936 -21.751 1.00 49.93 ? 10 THR F CB 1 ATOM 3164 O OG1 . THR C 3 32 ? -4.200 29.609 -22.527 1.00 50.11 ? 10 THR F OG1 1 ATOM 3165 C CG2 . THR C 3 32 ? -5.306 29.181 -20.424 1.00 49.20 ? 10 THR F CG2 1 ATOM 3166 N N . VAL C 3 33 ? -8.775 29.191 -21.492 1.00 40.63 ? 11 VAL F N 1 ATOM 3167 C CA . VAL C 3 33 ? -10.073 29.436 -20.860 1.00 40.02 ? 11 VAL F CA 1 ATOM 3168 C C . VAL C 3 33 ? -9.917 29.708 -19.348 1.00 44.13 ? 11 VAL F C 1 ATOM 3169 O O . VAL C 3 33 ? -9.069 29.098 -18.693 1.00 44.43 ? 11 VAL F O 1 ATOM 3170 C CB . VAL C 3 33 ? -11.047 28.262 -21.199 1.00 43.93 ? 11 VAL F CB 1 ATOM 3171 C CG1 . VAL C 3 33 ? -12.280 28.235 -20.297 1.00 43.74 ? 11 VAL F CG1 1 ATOM 3172 C CG2 . VAL C 3 33 ? -11.459 28.301 -22.669 1.00 43.24 ? 11 VAL F CG2 1 ATOM 3173 N N . GLY C 3 34 ? -10.721 30.641 -18.835 1.00 40.29 ? 12 GLY F N 1 ATOM 3174 C CA . GLY C 3 34 ? -10.752 31.015 -17.425 1.00 40.65 ? 12 GLY F CA 1 ATOM 3175 C C . GLY C 3 34 ? -9.677 31.982 -16.972 1.00 44.64 ? 12 GLY F C 1 ATOM 3176 O O . GLY C 3 34 ? -9.424 32.096 -15.769 1.00 44.93 ? 12 GLY F O 1 ATOM 3177 N N . VAL C 3 35 ? -9.034 32.685 -17.925 1.00 40.63 ? 13 VAL F N 1 ATOM 3178 C CA . VAL C 3 35 ? -7.982 33.663 -17.629 1.00 40.63 ? 13 VAL F CA 1 ATOM 3179 C C . VAL C 3 35 ? -8.419 35.057 -18.127 1.00 43.61 ? 13 VAL F C 1 ATOM 3180 O O . VAL C 3 35 ? -8.513 35.256 -19.340 1.00 42.57 ? 13 VAL F O 1 ATOM 3181 C CB . VAL C 3 35 ? -6.580 33.250 -18.175 1.00 44.87 ? 13 VAL F CB 1 ATOM 3182 C CG1 . VAL C 3 35 ? -5.505 34.249 -17.752 1.00 45.14 ? 13 VAL F CG1 1 ATOM 3183 C CG2 . VAL C 3 35 ? -6.194 31.840 -17.734 1.00 45.47 ? 13 VAL F CG2 1 ATOM 3184 N N . PRO C 3 36 ? -8.700 36.031 -17.226 1.00 40.20 ? 14 PRO F N 1 ATOM 3185 C CA . PRO C 3 36 ? -9.106 37.366 -17.698 1.00 39.47 ? 14 PRO F CA 1 ATOM 3186 C C . PRO C 3 36 ? -7.910 38.183 -18.189 1.00 42.89 ? 14 PRO F C 1 ATOM 3187 O O . PRO C 3 36 ? -6.903 38.289 -17.487 1.00 43.11 ? 14 PRO F O 1 ATOM 3188 C CB . PRO C 3 36 ? -9.778 38.002 -16.468 1.00 41.89 ? 14 PRO F CB 1 ATOM 3189 C CG . PRO C 3 36 ? -9.736 36.952 -15.376 1.00 47.12 ? 14 PRO F CG 1 ATOM 3190 C CD . PRO C 3 36 ? -8.666 35.982 -15.753 1.00 42.66 ? 14 PRO F CD 1 ATOM 3191 N N . TYR C 3 37 ? -8.013 38.735 -19.411 1.00 38.58 ? 15 TYR F N 1 ATOM 3192 C CA . TYR C 3 37 ? -6.962 39.543 -20.034 1.00 38.23 ? 15 TYR F CA 1 ATOM 3193 C C . TYR C 3 37 ? -7.387 41.001 -20.171 1.00 41.46 ? 15 TYR F C 1 ATOM 3194 O O . TYR C 3 37 ? -8.523 41.278 -20.557 1.00 40.71 ? 15 TYR F O 1 ATOM 3195 C CB . TYR C 3 37 ? -6.558 38.974 -21.407 1.00 39.11 ? 15 TYR F CB 1 ATOM 3196 C CG . TYR C 3 37 ? -6.070 37.542 -21.371 1.00 41.39 ? 15 TYR F CG 1 ATOM 3197 C CD1 . TYR C 3 37 ? -4.799 37.228 -20.897 1.00 44.11 ? 15 TYR F CD1 1 ATOM 3198 C CD2 . TYR C 3 37 ? -6.861 36.503 -21.854 1.00 41.94 ? 15 TYR F CD2 1 ATOM 3199 C CE1 . TYR C 3 37 ? -4.341 35.912 -20.869 1.00 45.48 ? 15 TYR F CE1 1 ATOM 3200 C CE2 . TYR C 3 37 ? -6.413 35.184 -21.835 1.00 43.29 ? 15 TYR F CE2 1 ATOM 3201 C CZ . TYR C 3 37 ? -5.154 34.891 -21.335 1.00 51.83 ? 15 TYR F CZ 1 ATOM 3202 O OH . TYR C 3 37 ? -4.706 33.593 -21.318 1.00 53.73 ? 15 TYR F OH 1 ATOM 3203 N N . LYS C 3 38 ? -6.467 41.927 -19.863 1.00 38.02 ? 16 LYS F N 1 ATOM 3204 C CA . LYS C 3 38 ? -6.706 43.369 -19.937 1.00 37.74 ? 16 LYS F CA 1 ATOM 3205 C C . LYS C 3 38 ? -6.128 43.949 -21.221 1.00 40.89 ? 16 LYS F C 1 ATOM 3206 O O . LYS C 3 38 ? -4.962 43.700 -21.541 1.00 40.59 ? 16 LYS F O 1 ATOM 3207 C CB . LYS C 3 38 ? -6.114 44.089 -18.712 1.00 41.05 ? 16 LYS F CB 1 ATOM 3208 C CG . LYS C 3 38 ? -6.767 43.704 -17.393 1.00 55.46 ? 16 LYS F CG 1 ATOM 3209 C CD . LYS C 3 38 ? -7.812 44.721 -16.949 1.00 65.23 ? 16 LYS F CD 1 ATOM 3210 C CE . LYS C 3 38 ? -8.887 44.116 -16.081 1.00 76.32 ? 16 LYS F CE 1 ATOM 3211 N NZ . LYS C 3 38 ? -8.342 43.478 -14.852 1.00 86.37 ? 16 LYS F NZ 1 ATOM 3212 N N . THR C 3 39 ? -6.947 44.715 -21.957 1.00 36.85 ? 17 THR F N 1 ATOM 3213 C CA . THR C 3 39 ? -6.537 45.360 -23.204 1.00 36.17 ? 17 THR F CA 1 ATOM 3214 C C . THR C 3 39 ? -6.779 46.869 -23.170 1.00 39.83 ? 17 THR F C 1 ATOM 3215 O O . THR C 3 39 ? -7.867 47.312 -22.795 1.00 39.61 ? 17 THR F O 1 ATOM 3216 C CB . THR C 3 39 ? -7.066 44.609 -24.447 1.00 43.79 ? 17 THR F CB 1 ATOM 3217 O OG1 . THR C 3 39 ? -6.418 45.119 -25.612 1.00 43.45 ? 17 THR F OG1 1 ATOM 3218 C CG2 . THR C 3 39 ? -8.590 44.683 -24.606 1.00 42.18 ? 17 THR F CG2 1 ATOM 3219 N N . LEU C 3 40 ? -5.749 47.654 -23.524 1.00 36.20 ? 18 LEU F N 1 ATOM 3220 C CA . LEU C 3 40 ? -5.830 49.112 -23.534 1.00 36.21 ? 18 LEU F CA 1 ATOM 3221 C C . LEU C 3 40 ? -6.192 49.634 -24.923 1.00 39.85 ? 18 LEU F C 1 ATOM 3222 O O . LEU C 3 40 ? -5.443 49.434 -25.883 1.00 39.10 ? 18 LEU F O 1 ATOM 3223 C CB . LEU C 3 40 ? -4.525 49.749 -23.004 1.00 36.64 ? 18 LEU F CB 1 ATOM 3224 C CG . LEU C 3 40 ? -4.484 51.283 -22.878 1.00 41.77 ? 18 LEU F CG 1 ATOM 3225 C CD1 . LEU C 3 40 ? -5.348 51.778 -21.726 1.00 42.59 ? 18 LEU F CD1 1 ATOM 3226 C CD2 . LEU C 3 40 ? -3.064 51.769 -22.688 1.00 44.41 ? 18 LEU F CD2 1 ATOM 3227 N N . VAL C 3 41 ? -7.357 50.289 -25.017 1.00 36.73 ? 19 VAL F N 1 ATOM 3228 C CA . VAL C 3 41 ? -7.867 50.886 -26.249 1.00 36.58 ? 19 VAL F CA 1 ATOM 3229 C C . VAL C 3 41 ? -7.453 52.357 -26.241 1.00 41.11 ? 19 VAL F C 1 ATOM 3230 O O . VAL C 3 41 ? -7.925 53.128 -25.401 1.00 41.32 ? 19 VAL F O 1 ATOM 3231 C CB . VAL C 3 41 ? -9.402 50.706 -26.415 1.00 40.62 ? 19 VAL F CB 1 ATOM 3232 C CG1 . VAL C 3 41 ? -9.892 51.323 -27.724 1.00 40.62 ? 19 VAL F CG1 1 ATOM 3233 C CG2 . VAL C 3 41 ? -9.803 49.234 -26.330 1.00 39.96 ? 19 VAL F CG2 1 ATOM 3234 N N . ASN C 3 42 ? -6.543 52.729 -27.154 1.00 37.59 ? 20 ASN F N 1 ATOM 3235 C CA . ASN C 3 42 ? -6.046 54.095 -27.261 1.00 37.90 ? 20 ASN F CA 1 ATOM 3236 C C . ASN C 3 42 ? -6.373 54.712 -28.619 1.00 41.87 ? 20 ASN F C 1 ATOM 3237 O O . ASN C 3 42 ? -5.656 54.498 -29.601 1.00 41.28 ? 20 ASN F O 1 ATOM 3238 C CB . ASN C 3 42 ? -4.549 54.168 -26.939 1.00 38.70 ? 20 ASN F CB 1 ATOM 3239 C CG . ASN C 3 42 ? -4.005 55.571 -26.833 1.00 61.70 ? 20 ASN F CG 1 ATOM 3240 O OD1 . ASN C 3 42 ? -4.295 56.309 -25.886 1.00 56.23 ? 20 ASN F OD1 1 ATOM 3241 N ND2 . ASN C 3 42 ? -3.186 55.962 -27.797 1.00 53.71 ? 20 ASN F ND2 1 ATOM 3242 N N . ARG C 3 43 ? -7.482 55.462 -28.665 1.00 38.78 ? 21 ARG F N 1 ATOM 3243 C CA . ARG C 3 43 ? -7.939 56.176 -29.852 1.00 38.83 ? 21 ARG F CA 1 ATOM 3244 C C . ARG C 3 43 ? -7.290 57.572 -29.789 1.00 43.21 ? 21 ARG F C 1 ATOM 3245 O O . ARG C 3 43 ? -7.459 58.257 -28.775 1.00 43.28 ? 21 ARG F O 1 ATOM 3246 C CB . ARG C 3 43 ? -9.476 56.272 -29.863 1.00 39.31 ? 21 ARG F CB 1 ATOM 3247 C CG . ARG C 3 43 ? -10.061 56.716 -31.196 1.00 49.32 ? 21 ARG F CG 1 ATOM 3248 C CD . ARG C 3 43 ? -11.548 56.979 -31.087 1.00 59.29 ? 21 ARG F CD 1 ATOM 3249 N NE . ARG C 3 43 ? -12.108 57.453 -32.352 1.00 67.70 ? 21 ARG F NE 1 ATOM 3250 C CZ . ARG C 3 43 ? -13.358 57.875 -32.510 1.00 83.21 ? 21 ARG F CZ 1 ATOM 3251 N NH1 . ARG C 3 43 ? -14.195 57.894 -31.480 1.00 71.39 ? 21 ARG F NH1 1 ATOM 3252 N NH2 . ARG C 3 43 ? -13.780 58.286 -33.697 1.00 71.25 ? 21 ARG F NH2 1 ATOM 3253 N N . PRO C 3 44 ? -6.502 57.990 -30.815 1.00 39.75 ? 22 PRO F N 1 ATOM 3254 C CA . PRO C 3 44 ? -5.835 59.308 -30.742 1.00 40.07 ? 22 PRO F CA 1 ATOM 3255 C C . PRO C 3 44 ? -6.790 60.487 -30.560 1.00 44.75 ? 22 PRO F C 1 ATOM 3256 O O . PRO C 3 44 ? -7.787 60.596 -31.277 1.00 44.82 ? 22 PRO F O 1 ATOM 3257 C CB . PRO C 3 44 ? -5.034 59.388 -32.047 1.00 41.72 ? 22 PRO F CB 1 ATOM 3258 C CG . PRO C 3 44 ? -5.643 58.372 -32.948 1.00 45.87 ? 22 PRO F CG 1 ATOM 3259 C CD . PRO C 3 44 ? -6.166 57.285 -32.069 1.00 40.87 ? 22 PRO F CD 1 ATOM 3260 N N . GLY C 3 45 ? -6.490 61.320 -29.563 1.00 41.60 ? 23 GLY F N 1 ATOM 3261 C CA . GLY C 3 45 ? -7.284 62.490 -29.200 1.00 42.51 ? 23 GLY F CA 1 ATOM 3262 C C . GLY C 3 45 ? -8.448 62.184 -28.277 1.00 46.58 ? 23 GLY F C 1 ATOM 3263 O O . GLY C 3 45 ? -9.260 63.069 -27.994 1.00 47.28 ? 23 GLY F O 1 ATOM 3264 N N . TYR C 3 46 ? -8.537 60.924 -27.801 1.00 42.19 ? 24 TYR F N 1 ATOM 3265 C CA . TYR C 3 46 ? -9.596 60.436 -26.914 1.00 42.22 ? 24 TYR F CA 1 ATOM 3266 C C . TYR C 3 46 ? -9.005 59.703 -25.711 1.00 45.49 ? 24 TYR F C 1 ATOM 3267 O O . TYR C 3 46 ? -7.955 59.068 -25.834 1.00 44.12 ? 24 TYR F O 1 ATOM 3268 C CB . TYR C 3 46 ? -10.558 59.512 -27.683 1.00 42.98 ? 24 TYR F CB 1 ATOM 3269 C CG . TYR C 3 46 ? -11.348 60.204 -28.774 1.00 45.50 ? 24 TYR F CG 1 ATOM 3270 C CD1 . TYR C 3 46 ? -12.631 60.685 -28.534 1.00 48.70 ? 24 TYR F CD1 1 ATOM 3271 C CD2 . TYR C 3 46 ? -10.825 60.351 -30.055 1.00 45.99 ? 24 TYR F CD2 1 ATOM 3272 C CE1 . TYR C 3 46 ? -13.368 61.313 -29.538 1.00 50.48 ? 24 TYR F CE1 1 ATOM 3273 C CE2 . TYR C 3 46 ? -11.548 60.982 -31.065 1.00 47.79 ? 24 TYR F CE2 1 ATOM 3274 C CZ . TYR C 3 46 ? -12.822 61.459 -30.803 1.00 56.57 ? 24 TYR F CZ 1 ATOM 3275 O OH . TYR C 3 46 ? -13.541 62.076 -31.797 1.00 58.72 ? 24 TYR F OH 1 ATOM 3276 N N . SER C 3 47 ? -9.686 59.794 -24.552 1.00 42.83 ? 25 SER F N 1 ATOM 3277 C CA . SER C 3 47 ? -9.287 59.176 -23.284 1.00 42.52 ? 25 SER F CA 1 ATOM 3278 C C . SER C 3 47 ? -9.148 57.646 -23.396 1.00 45.18 ? 25 SER F C 1 ATOM 3279 O O . SER C 3 47 ? -9.996 57.013 -24.031 1.00 44.54 ? 25 SER F O 1 ATOM 3280 C CB . SER C 3 47 ? -10.275 59.541 -22.180 1.00 47.41 ? 25 SER F CB 1 ATOM 3281 O OG . SER C 3 47 ? -9.791 59.167 -20.901 1.00 56.85 ? 25 SER F OG 1 ATOM 3282 N N . PRO C 3 48 ? -8.086 57.040 -22.800 1.00 41.05 ? 26 PRO F N 1 ATOM 3283 C CA . PRO C 3 48 ? -7.910 55.578 -22.906 1.00 39.86 ? 26 PRO F CA 1 ATOM 3284 C C . PRO C 3 48 ? -9.055 54.756 -22.314 1.00 43.92 ? 26 PRO F C 1 ATOM 3285 O O . PRO C 3 48 ? -9.711 55.197 -21.370 1.00 44.33 ? 26 PRO F O 1 ATOM 3286 C CB . PRO C 3 48 ? -6.590 55.326 -22.167 1.00 41.46 ? 26 PRO F CB 1 ATOM 3287 C CG . PRO C 3 48 ? -5.886 56.638 -22.179 1.00 46.45 ? 26 PRO F CG 1 ATOM 3288 C CD . PRO C 3 48 ? -6.979 57.646 -22.034 1.00 42.93 ? 26 PRO F CD 1 ATOM 3289 N N . MET C 3 49 ? -9.299 53.569 -22.895 1.00 39.83 ? 27 MET F N 1 ATOM 3290 C CA . MET C 3 49 ? -10.361 52.644 -22.493 1.00 39.70 ? 27 MET F CA 1 ATOM 3291 C C . MET C 3 49 ? -9.768 51.266 -22.175 1.00 42.93 ? 27 MET F C 1 ATOM 3292 O O . MET C 3 49 ? -9.014 50.725 -22.984 1.00 41.77 ? 27 MET F O 1 ATOM 3293 C CB . MET C 3 49 ? -11.404 52.538 -23.622 1.00 41.94 ? 27 MET F CB 1 ATOM 3294 C CG . MET C 3 49 ? -12.687 51.833 -23.223 1.00 45.93 ? 27 MET F CG 1 ATOM 3295 S SD . MET C 3 49 ? -13.758 51.483 -24.641 1.00 50.03 ? 27 MET F SD 1 ATOM 3296 C CE . MET C 3 49 ? -14.486 53.097 -24.912 1.00 47.95 ? 27 MET F CE 1 ATOM 3297 N N . VAL C 3 50 ? -10.113 50.698 -21.006 1.00 39.91 ? 28 VAL F N 1 ATOM 3298 C CA . VAL C 3 50 ? -9.621 49.377 -20.597 1.00 39.27 ? 28 VAL F CA 1 ATOM 3299 C C . VAL C 3 50 ? -10.749 48.348 -20.674 1.00 43.11 ? 28 VAL F C 1 ATOM 3300 O O . VAL C 3 50 ? -11.788 48.520 -20.032 1.00 43.37 ? 28 VAL F O 1 ATOM 3301 C CB . VAL C 3 50 ? -8.908 49.382 -19.213 1.00 43.80 ? 28 VAL F CB 1 ATOM 3302 C CG1 . VAL C 3 50 ? -8.378 47.993 -18.854 1.00 43.23 ? 28 VAL F CG1 1 ATOM 3303 C CG2 . VAL C 3 50 ? -7.774 50.402 -19.180 1.00 43.91 ? 28 VAL F CG2 1 ATOM 3304 N N . LEU C 3 51 ? -10.538 47.285 -21.467 1.00 39.06 ? 29 LEU F N 1 ATOM 3305 C CA . LEU C 3 51 ? -11.501 46.198 -21.637 1.00 38.70 ? 29 LEU F CA 1 ATOM 3306 C C . LEU C 3 51 ? -10.942 44.887 -21.094 1.00 42.36 ? 29 LEU F C 1 ATOM 3307 O O . LEU C 3 51 ? -9.809 44.523 -21.415 1.00 41.50 ? 29 LEU F O 1 ATOM 3308 C CB . LEU C 3 51 ? -11.899 46.025 -23.119 1.00 38.25 ? 29 LEU F CB 1 ATOM 3309 C CG . LEU C 3 51 ? -12.665 47.172 -23.795 1.00 43.46 ? 29 LEU F CG 1 ATOM 3310 C CD1 . LEU C 3 51 ? -12.698 46.981 -25.297 1.00 43.23 ? 29 LEU F CD1 1 ATOM 3311 C CD2 . LEU C 3 51 ? -14.092 47.284 -23.266 1.00 46.71 ? 29 LEU F CD2 1 ATOM 3312 N N . GLU C 3 52 ? -11.731 44.188 -20.261 1.00 39.40 ? 30 GLU F N 1 ATOM 3313 C CA . GLU C 3 52 ? -11.357 42.889 -19.701 1.00 39.21 ? 30 GLU F CA 1 ATOM 3314 C C . GLU C 3 52 ? -12.028 41.807 -20.549 1.00 42.55 ? 30 GLU F C 1 ATOM 3315 O O . GLU C 3 52 ? -13.247 41.841 -20.734 1.00 42.20 ? 30 GLU F O 1 ATOM 3316 C CB . GLU C 3 52 ? -11.761 42.777 -18.215 1.00 41.45 ? 30 GLU F CB 1 ATOM 3317 C CG . GLU C 3 52 ? -11.281 41.507 -17.529 1.00 52.66 ? 30 GLU F CG 1 ATOM 3318 C CD . GLU C 3 52 ? -11.760 41.327 -16.102 1.00 76.82 ? 30 GLU F CD 1 ATOM 3319 O OE1 . GLU C 3 52 ? -11.210 41.996 -15.199 1.00 73.90 ? 30 GLU F OE1 1 ATOM 3320 O OE2 . GLU C 3 52 ? -12.666 40.493 -15.881 1.00 72.61 ? 30 GLU F OE2 1 ATOM 3321 N N . MET C 3 53 ? -11.228 40.875 -21.093 1.00 38.64 ? 31 MET F N 1 ATOM 3322 C CA . MET C 3 53 ? -11.722 39.784 -21.938 1.00 38.01 ? 31 MET F CA 1 ATOM 3323 C C . MET C 3 53 ? -11.366 38.430 -21.339 1.00 41.50 ? 31 MET F C 1 ATOM 3324 O O . MET C 3 53 ? -10.222 38.220 -20.934 1.00 41.18 ? 31 MET F O 1 ATOM 3325 C CB . MET C 3 53 ? -11.168 39.881 -23.368 1.00 39.98 ? 31 MET F CB 1 ATOM 3326 C CG . MET C 3 53 ? -11.500 41.180 -24.081 1.00 43.72 ? 31 MET F CG 1 ATOM 3327 S SD . MET C 3 53 ? -10.902 41.219 -25.789 1.00 47.64 ? 31 MET F SD 1 ATOM 3328 C CE . MET C 3 53 ? -9.148 41.008 -25.528 1.00 44.35 ? 31 MET F CE 1 ATOM 3329 N N . GLU C 3 54 ? -12.340 37.507 -21.301 1.00 37.79 ? 32 GLU F N 1 ATOM 3330 C CA . GLU C 3 54 ? -12.149 36.163 -20.759 1.00 37.65 ? 32 GLU F CA 1 ATOM 3331 C C . GLU C 3 54 ? -12.850 35.120 -21.624 1.00 40.50 ? 32 GLU F C 1 ATOM 3332 O O . GLU C 3 54 ? -14.050 35.243 -21.885 1.00 40.06 ? 32 GLU F O 1 ATOM 3333 C CB . GLU C 3 54 ? -12.664 36.091 -19.311 1.00 39.72 ? 32 GLU F CB 1 ATOM 3334 C CG . GLU C 3 54 ? -12.167 34.884 -18.530 1.00 51.65 ? 32 GLU F CG 1 ATOM 3335 C CD . GLU C 3 54 ? -13.032 34.468 -17.355 1.00 74.84 ? 32 GLU F CD 1 ATOM 3336 O OE1 . GLU C 3 54 ? -13.379 35.338 -16.522 1.00 70.31 ? 32 GLU F OE1 1 ATOM 3337 O OE2 . GLU C 3 54 ? -13.339 33.259 -17.251 1.00 70.72 ? 32 GLU F OE2 1 ATOM 3338 N N . LEU C 3 55 ? -12.100 34.091 -22.063 1.00 36.41 ? 33 LEU F N 1 ATOM 3339 C CA . LEU C 3 55 ? -12.658 32.996 -22.852 1.00 35.76 ? 33 LEU F CA 1 ATOM 3340 C C . LEU C 3 55 ? -13.408 32.061 -21.914 1.00 39.38 ? 33 LEU F C 1 ATOM 3341 O O . LEU C 3 55 ? -12.818 31.528 -20.971 1.00 39.31 ? 33 LEU F O 1 ATOM 3342 C CB . LEU C 3 55 ? -11.569 32.238 -23.635 1.00 35.81 ? 33 LEU F CB 1 ATOM 3343 C CG . LEU C 3 55 ? -11.136 32.850 -24.969 1.00 40.16 ? 33 LEU F CG 1 ATOM 3344 C CD1 . LEU C 3 55 ? -9.826 32.248 -25.441 1.00 40.63 ? 33 LEU F CD1 1 ATOM 3345 C CD2 . LEU C 3 55 ? -12.211 32.673 -26.042 1.00 42.40 ? 33 LEU F CD2 1 ATOM 3346 N N . LEU C 3 56 ? -14.722 31.925 -22.132 1.00 35.60 ? 34 LEU F N 1 ATOM 3347 C CA . LEU C 3 56 ? -15.589 31.077 -21.315 1.00 35.67 ? 34 LEU F CA 1 ATOM 3348 C C . LEU C 3 56 ? -15.536 29.626 -21.798 1.00 39.52 ? 34 LEU F C 1 ATOM 3349 O O . LEU C 3 56 ? -15.535 28.712 -20.972 1.00 39.54 ? 34 LEU F O 1 ATOM 3350 C CB . LEU C 3 56 ? -17.036 31.615 -21.287 1.00 35.79 ? 34 LEU F CB 1 ATOM 3351 C CG . LEU C 3 56 ? -17.246 33.040 -20.723 1.00 40.65 ? 34 LEU F CG 1 ATOM 3352 C CD1 . LEU C 3 56 ? -18.625 33.570 -21.075 1.00 41.07 ? 34 LEU F CD1 1 ATOM 3353 C CD2 . LEU C 3 56 ? -17.039 33.093 -19.214 1.00 43.49 ? 34 LEU F CD2 1 ATOM 3354 N N . SER C 3 57 ? -15.475 29.422 -23.135 1.00 35.67 ? 35 SER F N 1 ATOM 3355 C CA . SER C 3 57 ? -15.377 28.115 -23.799 1.00 35.61 ? 35 SER F CA 1 ATOM 3356 C C . SER C 3 57 ? -14.953 28.248 -25.261 1.00 39.12 ? 35 SER F C 1 ATOM 3357 O O . SER C 3 57 ? -15.345 29.204 -25.934 1.00 38.42 ? 35 SER F O 1 ATOM 3358 C CB . SER C 3 57 ? -16.692 27.344 -23.712 1.00 39.40 ? 35 SER F CB 1 ATOM 3359 O OG . SER C 3 57 ? -17.730 27.975 -24.442 1.00 48.24 ? 35 SER F OG 1 ATOM 3360 N N . VAL C 3 58 ? -14.146 27.282 -25.744 1.00 35.83 ? 36 VAL F N 1 ATOM 3361 C CA . VAL C 3 58 ? -13.668 27.199 -27.130 1.00 35.61 ? 36 VAL F CA 1 ATOM 3362 C C . VAL C 3 58 ? -14.020 25.793 -27.623 1.00 39.38 ? 36 VAL F C 1 ATOM 3363 O O . VAL C 3 58 ? -13.493 24.806 -27.106 1.00 39.40 ? 36 VAL F O 1 ATOM 3364 C CB . VAL C 3 58 ? -12.156 27.535 -27.294 1.00 39.77 ? 36 VAL F CB 1 ATOM 3365 C CG1 . VAL C 3 58 ? -11.724 27.436 -28.757 1.00 39.85 ? 36 VAL F CG1 1 ATOM 3366 C CG2 . VAL C 3 58 ? -11.832 28.920 -26.740 1.00 39.14 ? 36 VAL F CG2 1 ATOM 3367 N N . THR C 3 59 ? -14.938 25.713 -28.597 1.00 35.46 ? 37 THR F N 1 ATOM 3368 C CA . THR C 3 59 ? -15.452 24.456 -29.142 1.00 35.50 ? 37 THR F CA 1 ATOM 3369 C C . THR C 3 59 ? -14.937 24.151 -30.554 1.00 39.39 ? 37 THR F C 1 ATOM 3370 O O . THR C 3 59 ? -15.025 25.003 -31.439 1.00 38.84 ? 37 THR F O 1 ATOM 3371 C CB . THR C 3 59 ? -16.989 24.461 -29.033 1.00 42.45 ? 37 THR F CB 1 ATOM 3372 O OG1 . THR C 3 59 ? -17.360 24.670 -27.667 1.00 41.53 ? 37 THR F OG1 1 ATOM 3373 C CG2 . THR C 3 59 ? -17.633 23.188 -29.566 1.00 41.38 ? 37 THR F CG2 1 ATOM 3374 N N . LEU C 3 60 ? -14.419 22.922 -30.754 1.00 36.39 ? 38 LEU F N 1 ATOM 3375 C CA . LEU C 3 60 ? -13.930 22.413 -32.039 1.00 36.85 ? 38 LEU F CA 1 ATOM 3376 C C . LEU C 3 60 ? -14.803 21.219 -32.440 1.00 40.89 ? 38 LEU F C 1 ATOM 3377 O O . LEU C 3 60 ? -14.588 20.103 -31.959 1.00 41.08 ? 38 LEU F O 1 ATOM 3378 C CB . LEU C 3 60 ? -12.448 21.988 -31.956 1.00 37.59 ? 38 LEU F CB 1 ATOM 3379 C CG . LEU C 3 60 ? -11.402 23.075 -31.724 1.00 41.98 ? 38 LEU F CG 1 ATOM 3380 C CD1 . LEU C 3 60 ? -10.135 22.477 -31.132 1.00 42.89 ? 38 LEU F CD1 1 ATOM 3381 C CD2 . LEU C 3 60 ? -11.080 23.825 -33.015 1.00 44.64 ? 38 LEU F CD2 1 ATOM 3382 N N . GLU C 3 61 ? -15.815 21.467 -33.283 1.00 37.02 ? 39 GLU F N 1 ATOM 3383 C CA . GLU C 3 61 ? -16.752 20.441 -33.735 1.00 37.32 ? 39 GLU F CA 1 ATOM 3384 C C . GLU C 3 61 ? -16.389 19.931 -35.152 1.00 42.00 ? 39 GLU F C 1 ATOM 3385 O O . GLU C 3 61 ? -16.604 20.661 -36.125 1.00 41.65 ? 39 GLU F O 1 ATOM 3386 C CB . GLU C 3 61 ? -18.191 20.984 -33.672 1.00 38.21 ? 39 GLU F CB 1 ATOM 3387 C CG . GLU C 3 61 ? -19.270 19.917 -33.718 1.00 49.43 ? 39 GLU F CG 1 ATOM 3388 C CD . GLU C 3 61 ? -20.653 20.439 -34.055 1.00 69.32 ? 39 GLU F CD 1 ATOM 3389 O OE1 . GLU C 3 61 ? -21.234 19.967 -35.058 1.00 63.66 ? 39 GLU F OE1 1 ATOM 3390 O OE2 . GLU C 3 61 ? -21.158 21.318 -33.319 1.00 62.78 ? 39 GLU F OE2 1 ATOM 3391 N N . PRO C 3 62 ? -15.833 18.697 -35.297 1.00 43.97 ? 40 PRO F N 1 ATOM 3392 C CA . PRO C 3 62 ? -15.491 18.208 -36.648 1.00 44.08 ? 40 PRO F CA 1 ATOM 3393 C C . PRO C 3 62 ? -16.707 17.709 -37.424 1.00 47.90 ? 40 PRO F C 1 ATOM 3394 O O . PRO C 3 62 ? -17.698 17.304 -36.814 1.00 46.45 ? 40 PRO F O 1 ATOM 3395 C CB . PRO C 3 62 ? -14.496 17.075 -36.376 1.00 43.66 ? 40 PRO F CB 1 ATOM 3396 C CG . PRO C 3 62 ? -14.853 16.570 -35.025 1.00 46.13 ? 40 PRO F CG 1 ATOM 3397 C CD . PRO C 3 62 ? -15.505 17.695 -34.259 1.00 42.89 ? 40 PRO F CD 1 ATOM 3398 N N . THR C 3 63 ? -16.630 17.734 -38.768 1.00 46.00 ? 41 THR F N 1 ATOM 3399 C CA . THR C 3 63 ? -17.710 17.251 -39.631 1.00 46.49 ? 41 THR F CA 1 ATOM 3400 C C . THR C 3 63 ? -17.652 15.723 -39.649 1.00 47.65 ? 41 THR F C 1 ATOM 3401 O O . THR C 3 63 ? -16.603 15.144 -39.948 1.00 46.37 ? 41 THR F O 1 ATOM 3402 C CB . THR C 3 63 ? -17.660 17.910 -41.023 1.00 57.90 ? 41 THR F CB 1 ATOM 3403 O OG1 . THR C 3 63 ? -17.591 19.329 -40.868 1.00 60.09 ? 41 THR F OG1 1 ATOM 3404 C CG2 . THR C 3 63 ? -18.872 17.557 -41.888 1.00 57.98 ? 41 THR F CG2 1 ATOM 3405 N N . LEU C 3 64 ? -18.770 15.080 -39.283 1.00 43.05 ? 42 LEU F N 1 ATOM 3406 C CA . LEU C 3 64 ? -18.864 13.626 -39.203 1.00 40.48 ? 42 LEU F CA 1 ATOM 3407 C C . LEU C 3 64 ? -19.592 13.000 -40.376 1.00 45.04 ? 42 LEU F C 1 ATOM 3408 O O . LEU C 3 64 ? -20.575 13.552 -40.876 1.00 46.74 ? 42 LEU F O 1 ATOM 3409 C CB . LEU C 3 64 ? -19.547 13.181 -37.898 1.00 38.80 ? 42 LEU F CB 1 ATOM 3410 C CG . LEU C 3 64 ? -18.944 13.615 -36.562 1.00 42.51 ? 42 LEU F CG 1 ATOM 3411 C CD1 . LEU C 3 64 ? -19.858 13.215 -35.427 1.00 41.76 ? 42 LEU F CD1 1 ATOM 3412 C CD2 . LEU C 3 64 ? -17.551 13.031 -36.350 1.00 43.32 ? 42 LEU F CD2 1 ATOM 3413 N N . SER C 3 65 ? -19.123 11.815 -40.778 1.00 40.02 ? 43 SER F N 1 ATOM 3414 C CA . SER C 3 65 ? -19.707 10.996 -41.830 1.00 40.39 ? 43 SER F CA 1 ATOM 3415 C C . SER C 3 65 ? -19.782 9.575 -41.283 1.00 41.36 ? 43 SER F C 1 ATOM 3416 O O . SER C 3 65 ? -18.749 8.917 -41.122 1.00 39.63 ? 43 SER F O 1 ATOM 3417 C CB . SER C 3 65 ? -18.867 11.066 -43.102 1.00 45.76 ? 43 SER F CB 1 ATOM 3418 O OG . SER C 3 65 ? -18.878 12.376 -43.644 1.00 58.30 ? 43 SER F OG 1 ATOM 3419 N N . LEU C 3 66 ? -20.999 9.137 -40.914 1.00 37.25 ? 44 LEU F N 1 ATOM 3420 C CA . LEU C 3 66 ? -21.238 7.814 -40.341 1.00 34.90 ? 44 LEU F CA 1 ATOM 3421 C C . LEU C 3 66 ? -21.043 6.717 -41.379 1.00 38.51 ? 44 LEU F C 1 ATOM 3422 O O . LEU C 3 66 ? -21.767 6.672 -42.373 1.00 39.78 ? 44 LEU F O 1 ATOM 3423 C CB . LEU C 3 66 ? -22.640 7.735 -39.687 1.00 35.15 ? 44 LEU F CB 1 ATOM 3424 C CG . LEU C 3 66 ? -23.048 6.402 -39.030 1.00 38.11 ? 44 LEU F CG 1 ATOM 3425 C CD1 . LEU C 3 66 ? -22.354 6.197 -37.693 1.00 36.28 ? 44 LEU F CD1 1 ATOM 3426 C CD2 . LEU C 3 66 ? -24.547 6.333 -38.834 1.00 41.69 ? 44 LEU F CD2 1 ATOM 3427 N N . ASP C 3 67 ? -20.043 5.851 -41.151 1.00 33.36 ? 45 ASP F N 1 ATOM 3428 C CA . ASP C 3 67 ? -19.746 4.716 -42.021 1.00 33.19 ? 45 ASP F CA 1 ATOM 3429 C C . ASP C 3 67 ? -20.699 3.576 -41.669 1.00 36.10 ? 45 ASP F C 1 ATOM 3430 O O . ASP C 3 67 ? -21.394 3.061 -42.549 1.00 36.73 ? 45 ASP F O 1 ATOM 3431 C CB . ASP C 3 67 ? -18.270 4.278 -41.877 1.00 34.14 ? 45 ASP F CB 1 ATOM 3432 C CG . ASP C 3 67 ? -17.274 5.040 -42.737 1.00 45.51 ? 45 ASP F CG 1 ATOM 3433 O OD1 . ASP C 3 67 ? -17.711 5.792 -43.633 1.00 48.06 ? 45 ASP F OD1 1 ATOM 3434 O OD2 . ASP C 3 67 ? -16.055 4.846 -42.545 1.00 50.70 ? 45 ASP F OD2 1 ATOM 3435 N N . TYR C 3 68 ? -20.754 3.219 -40.368 1.00 30.98 ? 46 TYR F N 1 ATOM 3436 C CA . TYR C 3 68 ? -21.597 2.163 -39.815 1.00 30.14 ? 46 TYR F CA 1 ATOM 3437 C C . TYR C 3 68 ? -21.659 2.224 -38.289 1.00 33.06 ? 46 TYR F C 1 ATOM 3438 O O . TYR C 3 68 ? -20.871 2.927 -37.650 1.00 32.08 ? 46 TYR F O 1 ATOM 3439 C CB . TYR C 3 68 ? -21.087 0.766 -40.254 1.00 30.83 ? 46 TYR F CB 1 ATOM 3440 C CG . TYR C 3 68 ? -19.704 0.403 -39.744 1.00 31.32 ? 46 TYR F CG 1 ATOM 3441 C CD1 . TYR C 3 68 ? -18.569 0.656 -40.508 1.00 33.73 ? 46 TYR F CD1 1 ATOM 3442 C CD2 . TYR C 3 68 ? -19.536 -0.237 -38.518 1.00 31.03 ? 46 TYR F CD2 1 ATOM 3443 C CE1 . TYR C 3 68 ? -17.296 0.316 -40.049 1.00 33.94 ? 46 TYR F CE1 1 ATOM 3444 C CE2 . TYR C 3 68 ? -18.267 -0.567 -38.041 1.00 31.52 ? 46 TYR F CE2 1 ATOM 3445 C CZ . TYR C 3 68 ? -17.150 -0.296 -38.814 1.00 39.17 ? 46 TYR F CZ 1 ATOM 3446 O OH . TYR C 3 68 ? -15.901 -0.640 -38.355 1.00 40.12 ? 46 TYR F OH 1 ATOM 3447 N N . ILE C 3 69 ? -22.569 1.431 -37.715 1.00 29.70 ? 47 ILE F N 1 ATOM 3448 C CA . ILE C 3 69 ? -22.719 1.237 -36.279 1.00 28.82 ? 47 ILE F CA 1 ATOM 3449 C C . ILE C 3 69 ? -22.453 -0.240 -35.983 1.00 32.34 ? 47 ILE F C 1 ATOM 3450 O O . ILE C 3 69 ? -22.696 -1.099 -36.838 1.00 32.34 ? 47 ILE F O 1 ATOM 3451 C CB . ILE C 3 69 ? -24.083 1.729 -35.697 1.00 32.79 ? 47 ILE F CB 1 ATOM 3452 C CG1 . ILE C 3 69 ? -25.300 0.940 -36.233 1.00 34.37 ? 47 ILE F CG1 1 ATOM 3453 C CG2 . ILE C 3 69 ? -24.267 3.237 -35.850 1.00 34.32 ? 47 ILE F CG2 1 ATOM 3454 C CD1 . ILE C 3 69 ? -25.885 -0.053 -35.255 1.00 41.52 ? 47 ILE F CD1 1 ATOM 3455 N N . THR C 3 70 ? -21.944 -0.528 -34.785 1.00 28.31 ? 48 THR F N 1 ATOM 3456 C CA . THR C 3 70 ? -21.709 -1.893 -34.330 1.00 28.03 ? 48 THR F CA 1 ATOM 3457 C C . THR C 3 70 ? -22.332 -2.092 -32.957 1.00 32.35 ? 48 THR F C 1 ATOM 3458 O O . THR C 3 70 ? -22.471 -1.133 -32.194 1.00 32.01 ? 48 THR F O 1 ATOM 3459 C CB . THR C 3 70 ? -20.249 -2.332 -34.487 1.00 34.89 ? 48 THR F CB 1 ATOM 3460 O OG1 . THR C 3 70 ? -20.198 -3.757 -34.435 1.00 34.55 ? 48 THR F OG1 1 ATOM 3461 C CG2 . THR C 3 70 ? -19.338 -1.746 -33.428 1.00 33.13 ? 48 THR F CG2 1 ATOM 3462 N N . CYS C 3 71 ? -22.736 -3.330 -32.665 1.00 29.58 ? 49 CYS F N 1 ATOM 3463 C CA . CYS C 3 71 ? -23.410 -3.717 -31.428 1.00 30.29 ? 49 CYS F CA 1 ATOM 3464 C C . CYS C 3 71 ? -23.261 -5.224 -31.223 1.00 34.38 ? 49 CYS F C 1 ATOM 3465 O O . CYS C 3 71 ? -22.530 -5.876 -31.969 1.00 33.67 ? 49 CYS F O 1 ATOM 3466 C CB . CYS C 3 71 ? -24.881 -3.311 -31.496 1.00 31.56 ? 49 CYS F CB 1 ATOM 3467 S SG . CYS C 3 71 ? -25.719 -3.838 -33.015 1.00 36.11 ? 49 CYS F SG 1 ATOM 3468 N N . GLU C 3 72 ? -23.942 -5.774 -30.206 1.00 31.81 ? 50 GLU F N 1 ATOM 3469 C CA . GLU C 3 72 ? -23.936 -7.205 -29.919 1.00 32.74 ? 50 GLU F CA 1 ATOM 3470 C C . GLU C 3 72 ? -24.792 -7.915 -30.975 1.00 36.42 ? 50 GLU F C 1 ATOM 3471 O O . GLU C 3 72 ? -25.857 -7.412 -31.338 1.00 36.11 ? 50 GLU F O 1 ATOM 3472 C CB . GLU C 3 72 ? -24.494 -7.461 -28.512 1.00 35.68 ? 50 GLU F CB 1 ATOM 3473 C CG . GLU C 3 72 ? -24.079 -8.796 -27.920 1.00 48.91 ? 50 GLU F CG 1 ATOM 3474 C CD . GLU C 3 72 ? -24.568 -9.052 -26.508 1.00 74.18 ? 50 GLU F CD 1 ATOM 3475 O OE1 . GLU C 3 72 ? -24.428 -8.149 -25.651 1.00 69.15 ? 50 GLU F OE1 1 ATOM 3476 O OE2 . GLU C 3 72 ? -25.053 -10.177 -26.247 1.00 71.38 ? 50 GLU F OE2 1 ATOM 3477 N N . TYR C 3 73 ? -24.308 -9.050 -31.498 1.00 33.01 ? 51 TYR F N 1 ATOM 3478 C CA . TYR C 3 73 ? -25.041 -9.815 -32.507 1.00 33.28 ? 51 TYR F CA 1 ATOM 3479 C C . TYR C 3 73 ? -26.021 -10.801 -31.848 1.00 39.02 ? 51 TYR F C 1 ATOM 3480 O O . TYR C 3 73 ? -25.915 -11.057 -30.646 1.00 39.51 ? 51 TYR F O 1 ATOM 3481 C CB . TYR C 3 73 ? -24.072 -10.530 -33.482 1.00 34.16 ? 51 TYR F CB 1 ATOM 3482 C CG . TYR C 3 73 ? -23.226 -11.626 -32.863 1.00 36.72 ? 51 TYR F CG 1 ATOM 3483 C CD1 . TYR C 3 73 ? -23.766 -12.879 -32.588 1.00 40.39 ? 51 TYR F CD1 1 ATOM 3484 C CD2 . TYR C 3 73 ? -21.867 -11.438 -32.631 1.00 37.12 ? 51 TYR F CD2 1 ATOM 3485 C CE1 . TYR C 3 73 ? -22.996 -13.890 -32.019 1.00 42.61 ? 51 TYR F CE1 1 ATOM 3486 C CE2 . TYR C 3 73 ? -21.079 -12.453 -32.090 1.00 39.53 ? 51 TYR F CE2 1 ATOM 3487 C CZ . TYR C 3 73 ? -21.650 -13.675 -31.778 1.00 48.61 ? 51 TYR F CZ 1 ATOM 3488 O OH . TYR C 3 73 ? -20.889 -14.681 -31.236 1.00 51.64 ? 51 TYR F OH 1 ATOM 3489 N N . LYS C 3 74 ? -26.942 -11.379 -32.643 1.00 32.64 ? 52 LYS F N 1 ATOM 3490 C CA . LYS C 3 74 ? -27.915 -12.369 -32.179 1.00 31.67 ? 52 LYS F CA 1 ATOM 3491 C C . LYS C 3 74 ? -27.904 -13.579 -33.119 1.00 35.10 ? 52 LYS F C 1 ATOM 3492 O O . LYS C 3 74 ? -28.124 -13.421 -34.323 1.00 35.00 ? 52 LYS F O 1 ATOM 3493 C CB . LYS C 3 74 ? -29.327 -11.754 -32.084 1.00 34.40 ? 52 LYS F CB 1 ATOM 3494 C CG . LYS C 3 74 ? -30.365 -12.666 -31.433 1.00 47.87 ? 52 LYS F CG 1 ATOM 3495 C CD . LYS C 3 74 ? -31.792 -12.259 -31.798 1.00 58.18 ? 52 LYS F CD 1 ATOM 3496 C CE . LYS C 3 74 ? -32.848 -13.128 -31.151 1.00 69.60 ? 52 LYS F CE 1 ATOM 3497 N NZ . LYS C 3 74 ? -32.749 -14.566 -31.526 1.00 78.32 ? 52 LYS F NZ 1 ATOM 3498 N N . THR C 3 75 ? -27.632 -14.776 -32.574 1.00 31.10 ? 53 THR F N 1 ATOM 3499 C CA . THR C 3 75 ? -27.627 -16.010 -33.357 1.00 30.55 ? 53 THR F CA 1 ATOM 3500 C C . THR C 3 75 ? -29.042 -16.594 -33.309 1.00 34.27 ? 53 THR F C 1 ATOM 3501 O O . THR C 3 75 ? -29.443 -17.166 -32.292 1.00 33.45 ? 53 THR F O 1 ATOM 3502 C CB . THR C 3 75 ? -26.515 -16.974 -32.889 1.00 37.53 ? 53 THR F CB 1 ATOM 3503 O OG1 . THR C 3 75 ? -25.278 -16.264 -32.794 1.00 36.99 ? 53 THR F OG1 1 ATOM 3504 C CG2 . THR C 3 75 ? -26.345 -18.171 -33.821 1.00 35.54 ? 53 THR F CG2 1 ATOM 3505 N N . VAL C 3 76 ? -29.811 -16.398 -34.392 1.00 31.42 ? 54 VAL F N 1 ATOM 3506 C CA . VAL C 3 76 ? -31.186 -16.888 -34.485 1.00 31.23 ? 54 VAL F CA 1 ATOM 3507 C C . VAL C 3 76 ? -31.180 -18.372 -34.851 1.00 35.06 ? 54 VAL F C 1 ATOM 3508 O O . VAL C 3 76 ? -30.769 -18.746 -35.954 1.00 34.68 ? 54 VAL F O 1 ATOM 3509 C CB . VAL C 3 76 ? -32.085 -16.022 -35.412 1.00 35.73 ? 54 VAL F CB 1 ATOM 3510 C CG1 . VAL C 3 76 ? -33.474 -16.638 -35.577 1.00 35.54 ? 54 VAL F CG1 1 ATOM 3511 C CG2 . VAL C 3 76 ? -32.194 -14.590 -34.890 1.00 36.09 ? 54 VAL F CG2 1 ATOM 3512 N N . ILE C 3 77 ? -31.600 -19.215 -33.896 1.00 31.74 ? 55 ILE F N 1 ATOM 3513 C CA . ILE C 3 77 ? -31.646 -20.664 -34.075 1.00 31.39 ? 55 ILE F CA 1 ATOM 3514 C C . ILE C 3 77 ? -33.080 -21.187 -33.875 1.00 35.53 ? 55 ILE F C 1 ATOM 3515 O O . ILE C 3 77 ? -33.544 -21.260 -32.734 1.00 35.40 ? 55 ILE F O 1 ATOM 3516 C CB . ILE C 3 77 ? -30.610 -21.423 -33.189 1.00 34.35 ? 55 ILE F CB 1 ATOM 3517 C CG1 . ILE C 3 77 ? -29.213 -20.765 -33.204 1.00 34.89 ? 55 ILE F CG1 1 ATOM 3518 C CG2 . ILE C 3 77 ? -30.525 -22.884 -33.598 1.00 34.86 ? 55 ILE F CG2 1 ATOM 3519 C CD1 . ILE C 3 77 ? -28.643 -20.510 -31.831 1.00 42.88 ? 55 ILE F CD1 1 ATOM 3520 N N . PRO C 3 78 ? -33.793 -21.577 -34.958 1.00 32.26 ? 56 PRO F N 1 ATOM 3521 C CA . PRO C 3 78 ? -35.146 -22.127 -34.774 1.00 32.48 ? 56 PRO F CA 1 ATOM 3522 C C . PRO C 3 78 ? -35.102 -23.593 -34.331 1.00 36.30 ? 56 PRO F C 1 ATOM 3523 O O . PRO C 3 78 ? -34.014 -24.152 -34.163 1.00 35.47 ? 56 PRO F O 1 ATOM 3524 C CB . PRO C 3 78 ? -35.775 -21.968 -36.161 1.00 34.49 ? 56 PRO F CB 1 ATOM 3525 C CG . PRO C 3 78 ? -34.632 -22.064 -37.103 1.00 38.59 ? 56 PRO F CG 1 ATOM 3526 C CD . PRO C 3 78 ? -33.402 -21.569 -36.384 1.00 33.81 ? 56 PRO F CD 1 ATOM 3527 N N . SER C 3 79 ? -36.282 -24.214 -34.147 1.00 33.37 ? 57 SER F N 1 ATOM 3528 C CA . SER C 3 79 ? -36.406 -25.620 -33.762 1.00 33.30 ? 57 SER F CA 1 ATOM 3529 C C . SER C 3 79 ? -35.791 -26.514 -34.852 1.00 36.41 ? 57 SER F C 1 ATOM 3530 O O . SER C 3 79 ? -36.053 -26.269 -36.033 1.00 35.88 ? 57 SER F O 1 ATOM 3531 C CB . SER C 3 79 ? -37.870 -25.984 -33.540 1.00 37.76 ? 57 SER F CB 1 ATOM 3532 O OG . SER C 3 79 ? -38.406 -25.298 -32.421 1.00 47.09 ? 57 SER F OG 1 ATOM 3533 N N . PRO C 3 80 ? -34.925 -27.499 -34.500 1.00 32.56 ? 58 PRO F N 1 ATOM 3534 C CA . PRO C 3 80 ? -34.317 -28.340 -35.546 1.00 31.91 ? 58 PRO F CA 1 ATOM 3535 C C . PRO C 3 80 ? -35.311 -29.292 -36.205 1.00 35.96 ? 58 PRO F C 1 ATOM 3536 O O . PRO C 3 80 ? -36.181 -29.844 -35.527 1.00 36.10 ? 58 PRO F O 1 ATOM 3537 C CB . PRO C 3 80 ? -33.209 -29.093 -34.806 1.00 33.55 ? 58 PRO F CB 1 ATOM 3538 C CG . PRO C 3 80 ? -33.665 -29.149 -33.399 1.00 38.59 ? 58 PRO F CG 1 ATOM 3539 C CD . PRO C 3 80 ? -34.477 -27.906 -33.150 1.00 34.34 ? 58 PRO F CD 1 ATOM 3540 N N . TYR C 3 81 ? -35.193 -29.462 -37.531 1.00 32.20 ? 59 TYR F N 1 ATOM 3541 C CA . TYR C 3 81 ? -36.071 -30.350 -38.281 1.00 32.36 ? 59 TYR F CA 1 ATOM 3542 C C . TYR C 3 81 ? -35.580 -31.793 -38.202 1.00 35.99 ? 59 TYR F C 1 ATOM 3543 O O . TYR C 3 81 ? -34.666 -32.184 -38.933 1.00 35.14 ? 59 TYR F O 1 ATOM 3544 C CB . TYR C 3 81 ? -36.267 -29.871 -39.736 1.00 33.64 ? 59 TYR F CB 1 ATOM 3545 C CG . TYR C 3 81 ? -37.138 -30.785 -40.574 1.00 35.98 ? 59 TYR F CG 1 ATOM 3546 C CD1 . TYR C 3 81 ? -38.467 -31.023 -40.232 1.00 38.63 ? 59 TYR F CD1 1 ATOM 3547 C CD2 . TYR C 3 81 ? -36.642 -31.391 -41.724 1.00 36.85 ? 59 TYR F CD2 1 ATOM 3548 C CE1 . TYR C 3 81 ? -39.272 -31.865 -40.996 1.00 40.06 ? 59 TYR F CE1 1 ATOM 3549 C CE2 . TYR C 3 81 ? -37.442 -32.227 -42.504 1.00 38.41 ? 59 TYR F CE2 1 ATOM 3550 C CZ . TYR C 3 81 ? -38.757 -32.461 -42.134 1.00 46.35 ? 59 TYR F CZ 1 ATOM 3551 O OH . TYR C 3 81 ? -39.564 -33.279 -42.885 1.00 47.94 ? 59 TYR F OH 1 ATOM 3552 N N . VAL C 3 82 ? -36.178 -32.570 -37.286 1.00 33.10 ? 60 VAL F N 1 ATOM 3553 C CA . VAL C 3 82 ? -35.852 -33.982 -37.090 1.00 33.21 ? 60 VAL F CA 1 ATOM 3554 C C . VAL C 3 82 ? -36.767 -34.803 -38.006 1.00 37.85 ? 60 VAL F C 1 ATOM 3555 O O . VAL C 3 82 ? -37.948 -34.986 -37.700 1.00 38.21 ? 60 VAL F O 1 ATOM 3556 C CB . VAL C 3 82 ? -35.939 -34.428 -35.599 1.00 37.67 ? 60 VAL F CB 1 ATOM 3557 C CG1 . VAL C 3 82 ? -35.544 -35.893 -35.437 1.00 37.98 ? 60 VAL F CG1 1 ATOM 3558 C CG2 . VAL C 3 82 ? -35.083 -33.542 -34.697 1.00 37.02 ? 60 VAL F CG2 1 ATOM 3559 N N . LYS C 3 83 ? -36.203 -35.339 -39.064 1.00 34.48 ? 61 LYS F N 1 ATOM 3560 C CA . LYS C 3 83 ? -36.934 -36.145 -40.005 1.00 35.06 ? 61 LYS F CA 1 ATOM 3561 C C . LYS C 3 83 ? -36.813 -37.571 -39.618 1.00 40.37 ? 61 LYS F C 1 ATOM 3562 O O . LYS C 3 83 ? -35.801 -38.169 -39.748 1.00 39.57 ? 61 LYS F O 1 ATOM 3563 C CB . LYS C 3 83 ? -36.333 -35.985 -41.371 1.00 37.03 ? 61 LYS F CB 1 ATOM 3564 C CG . LYS C 3 83 ? -37.298 -35.806 -42.452 1.00 50.27 ? 61 LYS F CG 1 ATOM 3565 C CD . LYS C 3 83 ? -38.057 -37.036 -42.667 1.00 60.32 ? 61 LYS F CD 1 ATOM 3566 C CE . LYS C 3 83 ? -38.950 -36.903 -43.829 1.00 71.48 ? 61 LYS F CE 1 ATOM 3567 N NZ . LYS C 3 83 ? -39.937 -37.958 -43.848 1.00 81.92 ? 61 LYS F NZ 1 ATOM 3568 N N . CYS C 3 84 ? -37.876 -38.112 -39.109 1.00 38.81 ? 62 CYS F N 1 ATOM 3569 C CA . CYS C 3 84 ? -37.898 -39.519 -38.713 1.00 39.99 ? 62 CYS F CA 1 ATOM 3570 C C . CYS C 3 84 ? -38.141 -40.391 -39.933 1.00 44.51 ? 62 CYS F C 1 ATOM 3571 O O . CYS C 3 84 ? -39.034 -40.098 -40.733 1.00 44.28 ? 62 CYS F O 1 ATOM 3572 C CB . CYS C 3 84 ? -38.941 -39.772 -37.629 1.00 41.81 ? 62 CYS F CB 1 ATOM 3573 S SG . CYS C 3 84 ? -38.666 -38.842 -36.099 1.00 45.81 ? 62 CYS F SG 1 ATOM 3574 N N . CYS C 3 85 ? -37.320 -41.448 -40.084 1.00 41.53 ? 63 CYS F N 1 ATOM 3575 C CA . CYS C 3 85 ? -37.352 -42.424 -41.184 1.00 41.96 ? 63 CYS F CA 1 ATOM 3576 C C . CYS C 3 85 ? -37.130 -41.808 -42.586 1.00 45.18 ? 63 CYS F C 1 ATOM 3577 O O . CYS C 3 85 ? -37.522 -42.400 -43.596 1.00 45.29 ? 63 CYS F O 1 ATOM 3578 C CB . CYS C 3 85 ? -38.607 -43.295 -41.125 1.00 43.75 ? 63 CYS F CB 1 ATOM 3579 S SG . CYS C 3 85 ? -38.865 -44.118 -39.532 1.00 49.00 ? 63 CYS F SG 1 ATOM 3580 N N . GLY C 3 86 ? -36.473 -40.649 -42.629 1.00 40.77 ? 64 GLY F N 1 ATOM 3581 C CA . GLY C 3 86 ? -36.184 -39.946 -43.873 1.00 40.20 ? 64 GLY F CA 1 ATOM 3582 C C . GLY C 3 86 ? -34.966 -39.047 -43.837 1.00 43.07 ? 64 GLY F C 1 ATOM 3583 O O . GLY C 3 86 ? -34.346 -38.868 -42.784 1.00 41.99 ? 64 GLY F O 1 ATOM 3584 N N . THR C 3 87 ? -34.623 -38.473 -45.006 1.00 39.82 ? 65 THR F N 1 ATOM 3585 C CA . THR C 3 87 ? -33.474 -37.586 -45.199 1.00 39.30 ? 65 THR F CA 1 ATOM 3586 C C . THR C 3 87 ? -33.911 -36.146 -45.481 1.00 43.31 ? 65 THR F C 1 ATOM 3587 O O . THR C 3 87 ? -34.601 -35.887 -46.471 1.00 43.44 ? 65 THR F O 1 ATOM 3588 C CB . THR C 3 87 ? -32.536 -38.145 -46.287 1.00 47.46 ? 65 THR F CB 1 ATOM 3589 O OG1 . THR C 3 87 ? -32.293 -39.523 -46.024 1.00 47.67 ? 65 THR F OG1 1 ATOM 3590 C CG2 . THR C 3 87 ? -31.205 -37.399 -46.366 1.00 45.68 ? 65 THR F CG2 1 ATOM 3591 N N . ALA C 3 88 ? -33.493 -35.215 -44.608 1.00 39.47 ? 66 ALA F N 1 ATOM 3592 C CA . ALA C 3 88 ? -33.775 -33.787 -44.747 1.00 39.28 ? 66 ALA F CA 1 ATOM 3593 C C . ALA C 3 88 ? -32.786 -33.172 -45.744 1.00 43.88 ? 66 ALA F C 1 ATOM 3594 O O . ALA C 3 88 ? -31.684 -33.699 -45.913 1.00 43.50 ? 66 ALA F O 1 ATOM 3595 C CB . ALA C 3 88 ? -33.659 -33.099 -43.396 1.00 39.32 ? 66 ALA F CB 1 ATOM 3596 N N . GLU C 3 89 ? -33.179 -32.073 -46.409 1.00 41.28 ? 67 GLU F N 1 ATOM 3597 C CA . GLU C 3 89 ? -32.330 -31.395 -47.395 1.00 42.08 ? 67 GLU F CA 1 ATOM 3598 C C . GLU C 3 89 ? -32.137 -29.909 -47.105 1.00 45.98 ? 67 GLU F C 1 ATOM 3599 O O . GLU C 3 89 ? -33.114 -29.189 -46.894 1.00 45.44 ? 67 GLU F O 1 ATOM 3600 C CB . GLU C 3 89 ? -32.791 -31.656 -48.847 1.00 44.79 ? 67 GLU F CB 1 ATOM 3601 C CG . GLU C 3 89 ? -34.282 -31.502 -49.108 1.00 56.90 ? 67 GLU F CG 1 ATOM 3602 C CD . GLU C 3 89 ? -34.733 -32.025 -50.458 1.00 81.82 ? 67 GLU F CD 1 ATOM 3603 O OE1 . GLU C 3 89 ? -34.473 -31.347 -51.479 1.00 79.39 ? 67 GLU F OE1 1 ATOM 3604 O OE2 . GLU C 3 89 ? -35.354 -33.112 -50.496 1.00 77.31 ? 67 GLU F OE2 1 ATOM 3605 N N . CYS C 3 90 ? -30.867 -29.462 -47.084 1.00 42.88 ? 68 CYS F N 1 ATOM 3606 C CA . CYS C 3 90 ? -30.495 -28.073 -46.819 1.00 42.86 ? 68 CYS F CA 1 ATOM 3607 C C . CYS C 3 90 ? -30.757 -27.167 -48.013 1.00 47.94 ? 68 CYS F C 1 ATOM 3608 O O . CYS C 3 90 ? -30.348 -27.478 -49.134 1.00 48.70 ? 68 CYS F O 1 ATOM 3609 C CB . CYS C 3 90 ? -29.049 -27.970 -46.341 1.00 43.14 ? 68 CYS F CB 1 ATOM 3610 S SG . CYS C 3 90 ? -28.842 -28.200 -44.557 1.00 45.59 ? 68 CYS F SG 1 ATOM 3611 N N . LYS C 3 91 ? -31.443 -26.042 -47.757 1.00 44.34 ? 69 LYS F N 1 ATOM 3612 C CA . LYS C 3 91 ? -31.790 -25.026 -48.748 1.00 45.46 ? 69 LYS F CA 1 ATOM 3613 C C . LYS C 3 91 ? -30.892 -23.800 -48.543 1.00 49.32 ? 69 LYS F C 1 ATOM 3614 O O . LYS C 3 91 ? -30.731 -23.344 -47.408 1.00 47.90 ? 69 LYS F O 1 ATOM 3615 C CB . LYS C 3 91 ? -33.276 -24.647 -48.609 1.00 48.01 ? 69 LYS F CB 1 ATOM 3616 C CG . LYS C 3 91 ? -33.844 -23.861 -49.784 1.00 66.72 ? 69 LYS F CG 1 ATOM 3617 C CD . LYS C 3 91 ? -35.310 -23.523 -49.562 1.00 78.09 ? 69 LYS F CD 1 ATOM 3618 C CE . LYS C 3 91 ? -35.891 -22.747 -50.717 1.00 92.40 ? 69 LYS F CE 1 ATOM 3619 N NZ . LYS C 3 91 ? -37.324 -22.423 -50.492 1.00 102.44 ? 69 LYS F NZ 1 ATOM 3620 N N . ASP C 3 92 ? -30.301 -23.281 -49.635 1.00 47.17 ? 70 ASP F N 1 ATOM 3621 C CA . ASP C 3 92 ? -29.428 -22.108 -49.589 1.00 47.61 ? 70 ASP F CA 1 ATOM 3622 C C . ASP C 3 92 ? -30.266 -20.840 -49.392 1.00 50.71 ? 70 ASP F C 1 ATOM 3623 O O . ASP C 3 92 ? -30.983 -20.419 -50.304 1.00 51.65 ? 70 ASP F O 1 ATOM 3624 C CB . ASP C 3 92 ? -28.550 -22.026 -50.851 1.00 51.78 ? 70 ASP F CB 1 ATOM 3625 C CG . ASP C 3 92 ? -27.465 -20.971 -50.773 1.00 64.00 ? 70 ASP F CG 1 ATOM 3626 O OD1 . ASP C 3 92 ? -27.645 -19.891 -51.373 1.00 66.42 ? 70 ASP F OD1 1 ATOM 3627 O OD2 . ASP C 3 92 ? -26.436 -21.225 -50.109 1.00 69.45 ? 70 ASP F OD2 1 ATOM 3628 N N . LYS C 3 93 ? -30.201 -20.262 -48.181 1.00 45.29 ? 71 LYS F N 1 ATOM 3629 C CA . LYS C 3 93 ? -30.954 -19.063 -47.809 1.00 44.85 ? 71 LYS F CA 1 ATOM 3630 C C . LYS C 3 93 ? -30.068 -17.818 -47.780 1.00 49.02 ? 71 LYS F C 1 ATOM 3631 O O . LYS C 3 93 ? -28.960 -17.860 -47.239 1.00 48.21 ? 71 LYS F O 1 ATOM 3632 C CB . LYS C 3 93 ? -31.659 -19.256 -46.453 1.00 45.43 ? 71 LYS F CB 1 ATOM 3633 C CG . LYS C 3 93 ? -32.822 -20.245 -46.485 1.00 58.42 ? 71 LYS F CG 1 ATOM 3634 C CD . LYS C 3 93 ? -33.508 -20.350 -45.129 1.00 66.30 ? 71 LYS F CD 1 ATOM 3635 C CE . LYS C 3 93 ? -34.629 -21.360 -45.134 1.00 75.86 ? 71 LYS F CE 1 ATOM 3636 N NZ . LYS C 3 93 ? -35.314 -21.424 -43.817 1.00 83.65 ? 71 LYS F NZ 1 ATOM 3637 N N . ASN C 3 94 ? -30.565 -16.709 -48.356 1.00 46.51 ? 72 ASN F N 1 ATOM 3638 C CA . ASN C 3 94 ? -29.852 -15.433 -48.400 1.00 47.45 ? 72 ASN F CA 1 ATOM 3639 C C . ASN C 3 94 ? -30.021 -14.688 -47.066 1.00 49.55 ? 72 ASN F C 1 ATOM 3640 O O . ASN C 3 94 ? -30.806 -13.741 -46.957 1.00 49.63 ? 72 ASN F O 1 ATOM 3641 C CB . ASN C 3 94 ? -30.303 -14.593 -49.607 1.00 50.52 ? 72 ASN F CB 1 ATOM 3642 C CG . ASN C 3 94 ? -29.464 -13.361 -49.857 1.00 75.28 ? 72 ASN F CG 1 ATOM 3643 O OD1 . ASN C 3 94 ? -28.234 -13.420 -49.974 1.00 70.31 ? 72 ASN F OD1 1 ATOM 3644 N ND2 . ASN C 3 94 ? -30.119 -12.217 -49.974 1.00 68.20 ? 72 ASN F ND2 1 ATOM 3645 N N . LEU C 3 95 ? -29.293 -15.159 -46.041 1.00 44.14 ? 73 LEU F N 1 ATOM 3646 C CA . LEU C 3 95 ? -29.303 -14.613 -44.683 1.00 42.58 ? 73 LEU F CA 1 ATOM 3647 C C . LEU C 3 95 ? -27.860 -14.410 -44.189 1.00 46.13 ? 73 LEU F C 1 ATOM 3648 O O . LEU C 3 95 ? -26.983 -15.163 -44.621 1.00 45.95 ? 73 LEU F O 1 ATOM 3649 C CB . LEU C 3 95 ? -30.073 -15.554 -43.732 1.00 40.70 ? 73 LEU F CB 1 ATOM 3650 C CG . LEU C 3 95 ? -31.602 -15.583 -43.882 1.00 45.30 ? 73 LEU F CG 1 ATOM 3651 C CD1 . LEU C 3 95 ? -32.166 -16.928 -43.469 1.00 44.14 ? 73 LEU F CD1 1 ATOM 3652 C CD2 . LEU C 3 95 ? -32.264 -14.465 -43.088 1.00 47.65 ? 73 LEU F CD2 1 ATOM 3653 N N . PRO C 3 96 ? -27.573 -13.411 -43.309 1.00 42.45 ? 74 PRO F N 1 ATOM 3654 C CA . PRO C 3 96 ? -26.183 -13.215 -42.852 1.00 42.50 ? 74 PRO F CA 1 ATOM 3655 C C . PRO C 3 96 ? -25.687 -14.363 -41.979 1.00 44.65 ? 74 PRO F C 1 ATOM 3656 O O . PRO C 3 96 ? -26.385 -14.775 -41.050 1.00 42.62 ? 74 PRO F O 1 ATOM 3657 C CB . PRO C 3 96 ? -26.227 -11.879 -42.094 1.00 44.52 ? 74 PRO F CB 1 ATOM 3658 C CG . PRO C 3 96 ? -27.559 -11.273 -42.415 1.00 49.25 ? 74 PRO F CG 1 ATOM 3659 C CD . PRO C 3 96 ? -28.474 -12.415 -42.696 1.00 43.78 ? 74 PRO F CD 1 ATOM 3660 N N . ASP C 3 97 ? -24.495 -14.903 -42.321 1.00 41.91 ? 75 ASP F N 1 ATOM 3661 C CA . ASP C 3 97 ? -23.840 -16.045 -41.666 1.00 40.74 ? 75 ASP F CA 1 ATOM 3662 C C . ASP C 3 97 ? -24.741 -17.297 -41.624 1.00 43.56 ? 75 ASP F C 1 ATOM 3663 O O . ASP C 3 97 ? -24.720 -18.041 -40.638 1.00 41.88 ? 75 ASP F O 1 ATOM 3664 C CB . ASP C 3 97 ? -23.285 -15.670 -40.269 1.00 41.81 ? 75 ASP F CB 1 ATOM 3665 C CG . ASP C 3 97 ? -21.806 -15.320 -40.220 1.00 52.51 ? 75 ASP F CG 1 ATOM 3666 O OD1 . ASP C 3 97 ? -21.422 -14.488 -39.372 1.00 53.05 ? 75 ASP F OD1 1 ATOM 3667 O OD2 . ASP C 3 97 ? -21.027 -15.902 -41.010 1.00 59.24 ? 75 ASP F OD2 1 ATOM 3668 N N . TYR C 3 98 ? -25.534 -17.522 -42.700 1.00 40.81 ? 76 TYR F N 1 ATOM 3669 C CA . TYR C 3 98 ? -26.443 -18.663 -42.786 1.00 39.75 ? 76 TYR F CA 1 ATOM 3670 C C . TYR C 3 98 ? -25.687 -19.984 -42.807 1.00 43.88 ? 76 TYR F C 1 ATOM 3671 O O . TYR C 3 98 ? -24.789 -20.179 -43.629 1.00 44.61 ? 76 TYR F O 1 ATOM 3672 C CB . TYR C 3 98 ? -27.434 -18.550 -43.966 1.00 41.72 ? 76 TYR F CB 1 ATOM 3673 C CG . TYR C 3 98 ? -28.451 -19.674 -43.991 1.00 42.47 ? 76 TYR F CG 1 ATOM 3674 C CD1 . TYR C 3 98 ? -29.523 -19.691 -43.102 1.00 43.36 ? 76 TYR F CD1 1 ATOM 3675 C CD2 . TYR C 3 98 ? -28.321 -20.740 -44.876 1.00 43.54 ? 76 TYR F CD2 1 ATOM 3676 C CE1 . TYR C 3 98 ? -30.439 -20.742 -43.092 1.00 43.50 ? 76 TYR F CE1 1 ATOM 3677 C CE2 . TYR C 3 98 ? -29.231 -21.797 -44.876 1.00 43.62 ? 76 TYR F CE2 1 ATOM 3678 C CZ . TYR C 3 98 ? -30.291 -21.792 -43.984 1.00 50.25 ? 76 TYR F CZ 1 ATOM 3679 O OH . TYR C 3 98 ? -31.196 -22.826 -43.985 1.00 51.09 ? 76 TYR F OH 1 ATOM 3680 N N . SER C 3 99 ? -26.042 -20.872 -41.873 1.00 39.65 ? 77 SER F N 1 ATOM 3681 C CA . SER C 3 99 ? -25.432 -22.186 -41.722 1.00 39.36 ? 77 SER F CA 1 ATOM 3682 C C . SER C 3 99 ? -26.508 -23.263 -41.684 1.00 43.21 ? 77 SER F C 1 ATOM 3683 O O . SER C 3 99 ? -27.496 -23.124 -40.960 1.00 42.04 ? 77 SER F O 1 ATOM 3684 C CB . SER C 3 99 ? -24.582 -22.235 -40.455 1.00 42.30 ? 77 SER F CB 1 ATOM 3685 O OG . SER C 3 99 ? -23.610 -21.203 -40.435 1.00 51.84 ? 77 SER F OG 1 ATOM 3686 N N . CYS C 3 100 ? -26.326 -24.320 -42.493 1.00 40.83 ? 78 CYS F N 1 ATOM 3687 C CA . CYS C 3 100 ? -27.239 -25.460 -42.579 1.00 40.42 ? 78 CYS F CA 1 ATOM 3688 C C . CYS C 3 100 ? -26.445 -26.755 -42.666 1.00 44.07 ? 78 CYS F C 1 ATOM 3689 O O . CYS C 3 100 ? -25.482 -26.839 -43.433 1.00 44.64 ? 78 CYS F O 1 ATOM 3690 C CB . CYS C 3 100 ? -28.206 -25.314 -43.752 1.00 41.66 ? 78 CYS F CB 1 ATOM 3691 S SG . CYS C 3 100 ? -29.585 -26.494 -43.730 1.00 45.14 ? 78 CYS F SG 1 ATOM 3692 N N . LYS C 3 101 ? -26.858 -27.770 -41.887 1.00 39.57 ? 79 LYS F N 1 ATOM 3693 C CA . LYS C 3 101 ? -26.203 -29.075 -41.850 1.00 39.28 ? 79 LYS F CA 1 ATOM 3694 C C . LYS C 3 101 ? -27.197 -30.185 -41.508 1.00 42.11 ? 79 LYS F C 1 ATOM 3695 O O . LYS C 3 101 ? -27.958 -30.060 -40.545 1.00 41.00 ? 79 LYS F O 1 ATOM 3696 C CB . LYS C 3 101 ? -25.035 -29.058 -40.849 1.00 41.86 ? 79 LYS F CB 1 ATOM 3697 C CG . LYS C 3 101 ? -23.875 -29.969 -41.237 1.00 58.86 ? 79 LYS F CG 1 ATOM 3698 C CD . LYS C 3 101 ? -22.580 -29.595 -40.515 1.00 70.36 ? 79 LYS F CD 1 ATOM 3699 C CE . LYS C 3 101 ? -21.675 -28.727 -41.363 1.00 83.44 ? 79 LYS F CE 1 ATOM 3700 N NZ . LYS C 3 101 ? -20.381 -28.446 -40.686 1.00 93.58 ? 79 LYS F NZ 1 ATOM 3701 N N . VAL C 3 102 ? -27.193 -31.263 -42.311 1.00 38.82 ? 80 VAL F N 1 ATOM 3702 C CA . VAL C 3 102 ? -28.051 -32.434 -42.115 1.00 38.24 ? 80 VAL F CA 1 ATOM 3703 C C . VAL C 3 102 ? -27.191 -33.547 -41.502 1.00 41.86 ? 80 VAL F C 1 ATOM 3704 O O . VAL C 3 102 ? -26.207 -33.973 -42.112 1.00 42.01 ? 80 VAL F O 1 ATOM 3705 C CB . VAL C 3 102 ? -28.781 -32.875 -43.418 1.00 42.59 ? 80 VAL F CB 1 ATOM 3706 C CG1 . VAL C 3 102 ? -29.542 -34.187 -43.221 1.00 42.30 ? 80 VAL F CG1 1 ATOM 3707 C CG2 . VAL C 3 102 ? -29.723 -31.785 -43.916 1.00 42.47 ? 80 VAL F CG2 1 ATOM 3708 N N . PHE C 3 103 ? -27.551 -33.989 -40.286 1.00 37.80 ? 81 PHE F N 1 ATOM 3709 C CA . PHE C 3 103 ? -26.828 -35.031 -39.554 1.00 37.74 ? 81 PHE F CA 1 ATOM 3710 C C . PHE C 3 103 ? -27.534 -36.378 -39.673 1.00 41.47 ? 81 PHE F C 1 ATOM 3711 O O . PHE C 3 103 ? -28.713 -36.486 -39.334 1.00 40.92 ? 81 PHE F O 1 ATOM 3712 C CB . PHE C 3 103 ? -26.615 -34.627 -38.082 1.00 39.34 ? 81 PHE F CB 1 ATOM 3713 C CG . PHE C 3 103 ? -25.935 -33.288 -37.912 1.00 40.73 ? 81 PHE F CG 1 ATOM 3714 C CD1 . PHE C 3 103 ? -24.560 -33.163 -38.067 1.00 44.26 ? 81 PHE F CD1 1 ATOM 3715 C CD2 . PHE C 3 103 ? -26.673 -32.148 -37.616 1.00 42.60 ? 81 PHE F CD2 1 ATOM 3716 C CE1 . PHE C 3 103 ? -23.936 -31.920 -37.940 1.00 45.21 ? 81 PHE F CE1 1 ATOM 3717 C CE2 . PHE C 3 103 ? -26.045 -30.906 -37.473 1.00 45.41 ? 81 PHE F CE2 1 ATOM 3718 C CZ . PHE C 3 103 ? -24.681 -30.802 -37.632 1.00 43.90 ? 81 PHE F CZ 1 ATOM 3719 N N . THR C 3 104 ? -26.809 -37.395 -40.177 1.00 38.15 ? 82 THR F N 1 ATOM 3720 C CA . THR C 3 104 ? -27.315 -38.757 -40.393 1.00 38.15 ? 82 THR F CA 1 ATOM 3721 C C . THR C 3 104 ? -27.050 -39.678 -39.196 1.00 41.90 ? 82 THR F C 1 ATOM 3722 O O . THR C 3 104 ? -26.120 -39.438 -38.425 1.00 41.50 ? 82 THR F O 1 ATOM 3723 C CB . THR C 3 104 ? -26.748 -39.350 -41.696 1.00 46.14 ? 82 THR F CB 1 ATOM 3724 O OG1 . THR C 3 104 ? -25.321 -39.306 -41.655 1.00 46.20 ? 82 THR F OG1 1 ATOM 3725 C CG2 . THR C 3 104 ? -27.266 -38.645 -42.943 1.00 44.49 ? 82 THR F CG2 1 ATOM 3726 N N . GLY C 3 105 ? -27.871 -40.723 -39.071 1.00 38.60 ? 83 GLY F N 1 ATOM 3727 C CA . GLY C 3 105 ? -27.778 -41.726 -38.014 1.00 39.04 ? 83 GLY F CA 1 ATOM 3728 C C . GLY C 3 105 ? -28.099 -41.221 -36.621 1.00 42.60 ? 83 GLY F C 1 ATOM 3729 O O . GLY C 3 105 ? -27.477 -41.661 -35.649 1.00 42.86 ? 83 GLY F O 1 ATOM 3730 N N . VAL C 3 106 ? -29.075 -40.299 -36.510 1.00 38.25 ? 84 VAL F N 1 ATOM 3731 C CA . VAL C 3 106 ? -29.501 -39.721 -35.228 1.00 38.04 ? 84 VAL F CA 1 ATOM 3732 C C . VAL C 3 106 ? -30.682 -40.476 -34.611 1.00 42.68 ? 84 VAL F C 1 ATOM 3733 O O . VAL C 3 106 ? -31.568 -40.928 -35.338 1.00 42.42 ? 84 VAL F O 1 ATOM 3734 C CB . VAL C 3 106 ? -29.733 -38.183 -35.264 1.00 40.96 ? 84 VAL F CB 1 ATOM 3735 C CG1 . VAL C 3 106 ? -28.418 -37.426 -35.428 1.00 40.18 ? 84 VAL F CG1 1 ATOM 3736 C CG2 . VAL C 3 106 ? -30.740 -37.776 -36.341 1.00 40.31 ? 84 VAL F CG2 1 ATOM 3737 N N . TYR C 3 107 ? -30.684 -40.617 -33.274 1.00 39.94 ? 85 TYR F N 1 ATOM 3738 C CA . TYR C 3 107 ? -31.748 -41.303 -32.539 1.00 41.08 ? 85 TYR F CA 1 ATOM 3739 C C . TYR C 3 107 ? -32.150 -40.451 -31.323 1.00 45.26 ? 85 TYR F C 1 ATOM 3740 O O . TYR C 3 107 ? -31.712 -40.731 -30.205 1.00 45.78 ? 85 TYR F O 1 ATOM 3741 C CB . TYR C 3 107 ? -31.302 -42.723 -32.143 1.00 43.60 ? 85 TYR F CB 1 ATOM 3742 C CG . TYR C 3 107 ? -32.436 -43.628 -31.716 1.00 46.97 ? 85 TYR F CG 1 ATOM 3743 C CD1 . TYR C 3 107 ? -33.252 -44.248 -32.659 1.00 49.06 ? 85 TYR F CD1 1 ATOM 3744 C CD2 . TYR C 3 107 ? -32.667 -43.903 -30.372 1.00 49.38 ? 85 TYR F CD2 1 ATOM 3745 C CE1 . TYR C 3 107 ? -34.286 -45.099 -32.273 1.00 51.56 ? 85 TYR F CE1 1 ATOM 3746 C CE2 . TYR C 3 107 ? -33.699 -44.752 -29.974 1.00 52.11 ? 85 TYR F CE2 1 ATOM 3747 C CZ . TYR C 3 107 ? -34.505 -45.349 -30.929 1.00 59.60 ? 85 TYR F CZ 1 ATOM 3748 O OH . TYR C 3 107 ? -35.522 -46.188 -30.542 1.00 62.57 ? 85 TYR F OH 1 ATOM 3749 N N . PRO C 3 108 ? -32.948 -39.375 -31.528 1.00 41.23 ? 86 PRO F N 1 ATOM 3750 C CA . PRO C 3 108 ? -33.288 -38.498 -30.399 1.00 41.54 ? 86 PRO F CA 1 ATOM 3751 C C . PRO C 3 108 ? -34.358 -39.026 -29.454 1.00 47.58 ? 86 PRO F C 1 ATOM 3752 O O . PRO C 3 108 ? -35.312 -39.676 -29.886 1.00 47.85 ? 86 PRO F O 1 ATOM 3753 C CB . PRO C 3 108 ? -33.712 -37.201 -31.080 1.00 41.95 ? 86 PRO F CB 1 ATOM 3754 C CG . PRO C 3 108 ? -34.247 -37.620 -32.388 1.00 45.93 ? 86 PRO F CG 1 ATOM 3755 C CD . PRO C 3 108 ? -33.536 -38.878 -32.791 1.00 41.72 ? 86 PRO F CD 1 ATOM 3756 N N . PHE C 3 109 ? -34.192 -38.722 -28.157 1.00 45.42 ? 87 PHE F N 1 ATOM 3757 C CA . PHE C 3 109 ? -35.108 -39.119 -27.091 1.00 47.58 ? 87 PHE F CA 1 ATOM 3758 C C . PHE C 3 109 ? -35.834 -37.916 -26.506 1.00 51.98 ? 87 PHE F C 1 ATOM 3759 O O . PHE C 3 109 ? -35.219 -36.875 -26.256 1.00 50.53 ? 87 PHE F O 1 ATOM 3760 C CB . PHE C 3 109 ? -34.354 -39.842 -25.963 1.00 51.00 ? 87 PHE F CB 1 ATOM 3761 C CG . PHE C 3 109 ? -34.085 -41.312 -26.179 1.00 53.54 ? 87 PHE F CG 1 ATOM 3762 C CD1 . PHE C 3 109 ? -35.032 -42.267 -25.829 1.00 58.84 ? 87 PHE F CD1 1 ATOM 3763 C CD2 . PHE C 3 109 ? -32.862 -41.746 -26.675 1.00 54.74 ? 87 PHE F CD2 1 ATOM 3764 C CE1 . PHE C 3 109 ? -34.774 -43.630 -26.008 1.00 60.83 ? 87 PHE F CE1 1 ATOM 3765 C CE2 . PHE C 3 109 ? -32.603 -43.109 -26.849 1.00 58.64 ? 87 PHE F CE2 1 ATOM 3766 C CZ . PHE C 3 109 ? -33.559 -44.041 -26.511 1.00 58.82 ? 87 PHE F CZ 1 ATOM 3767 N N . MET C 3 110 ? -37.143 -38.073 -26.279 1.00 50.33 ? 88 MET F N 1 ATOM 3768 C CA . MET C 3 110 ? -37.999 -37.077 -25.645 1.00 51.04 ? 88 MET F CA 1 ATOM 3769 C C . MET C 3 110 ? -38.494 -37.656 -24.312 1.00 57.78 ? 88 MET F C 1 ATOM 3770 O O . MET C 3 110 ? -38.024 -38.722 -23.903 1.00 58.56 ? 88 MET F O 1 ATOM 3771 C CB . MET C 3 110 ? -39.158 -36.661 -26.571 1.00 52.97 ? 88 MET F CB 1 ATOM 3772 C CG . MET C 3 110 ? -38.854 -35.416 -27.386 1.00 54.44 ? 88 MET F CG 1 ATOM 3773 S SD . MET C 3 110 ? -40.204 -34.875 -28.466 1.00 58.39 ? 88 MET F SD 1 ATOM 3774 C CE . MET C 3 110 ? -41.228 -33.993 -27.297 1.00 56.92 ? 88 MET F CE 1 ATOM 3775 N N . TRP C 3 111 ? -39.413 -36.946 -23.631 1.00 55.67 ? 89 TRP F N 1 ATOM 3776 C CA . TRP C 3 111 ? -40.002 -37.319 -22.342 1.00 58.65 ? 89 TRP F CA 1 ATOM 3777 C C . TRP C 3 111 ? -40.602 -38.740 -22.287 1.00 64.52 ? 89 TRP F C 1 ATOM 3778 O O . TRP C 3 111 ? -40.400 -39.438 -21.296 1.00 66.36 ? 89 TRP F O 1 ATOM 3779 C CB . TRP C 3 111 ? -41.008 -36.242 -21.881 1.00 58.40 ? 89 TRP F CB 1 ATOM 3780 C CG . TRP C 3 111 ? -41.998 -36.708 -20.856 1.00 63.01 ? 89 TRP F CG 1 ATOM 3781 C CD1 . TRP C 3 111 ? -41.832 -36.729 -19.504 1.00 68.38 ? 89 TRP F CD1 1 ATOM 3782 C CD2 . TRP C 3 111 ? -43.295 -37.261 -21.112 1.00 64.72 ? 89 TRP F CD2 1 ATOM 3783 N NE1 . TRP C 3 111 ? -42.944 -37.266 -18.899 1.00 71.20 ? 89 TRP F NE1 1 ATOM 3784 C CE2 . TRP C 3 111 ? -43.861 -37.597 -19.863 1.00 72.31 ? 89 TRP F CE2 1 ATOM 3785 C CE3 . TRP C 3 111 ? -44.032 -37.518 -22.281 1.00 65.10 ? 89 TRP F CE3 1 ATOM 3786 C CZ2 . TRP C 3 111 ? -45.135 -38.164 -19.748 1.00 74.44 ? 89 TRP F CZ2 1 ATOM 3787 C CZ3 . TRP C 3 111 ? -45.291 -38.083 -22.166 1.00 69.24 ? 89 TRP F CZ3 1 ATOM 3788 C CH2 . TRP C 3 111 ? -45.833 -38.396 -20.912 1.00 73.52 ? 89 TRP F CH2 1 ATOM 3789 N N . GLY C 3 112 ? -41.337 -39.138 -23.321 1.00 60.47 ? 90 GLY F N 1 ATOM 3790 C CA . GLY C 3 112 ? -41.980 -40.448 -23.356 1.00 62.38 ? 90 GLY F CA 1 ATOM 3791 C C . GLY C 3 112 ? -41.300 -41.471 -24.240 1.00 64.77 ? 90 GLY F C 1 ATOM 3792 O O . GLY C 3 112 ? -41.977 -42.293 -24.862 1.00 65.03 ? 90 GLY F O 1 ATOM 3793 N N . GLY C 3 113 ? -39.970 -41.429 -24.275 1.00 59.54 ? 91 GLY F N 1 ATOM 3794 C CA . GLY C 3 113 ? -39.156 -42.335 -25.077 1.00 58.05 ? 91 GLY F CA 1 ATOM 3795 C C . GLY C 3 113 ? -38.613 -41.705 -26.344 1.00 58.34 ? 91 GLY F C 1 ATOM 3796 O O . GLY C 3 113 ? -38.519 -40.478 -26.438 1.00 56.31 ? 91 GLY F O 1 ATOM 3797 N N . ALA C 3 114 ? -38.252 -42.553 -27.329 1.00 53.93 ? 92 ALA F N 1 ATOM 3798 C CA . ALA C 3 114 ? -37.696 -42.142 -28.622 1.00 51.05 ? 92 ALA F CA 1 ATOM 3799 C C . ALA C 3 114 ? -38.703 -41.378 -29.480 1.00 53.83 ? 92 ALA F C 1 ATOM 3800 O O . ALA C 3 114 ? -39.862 -41.783 -29.585 1.00 54.80 ? 92 ALA F O 1 ATOM 3801 C CB . ALA C 3 114 ? -37.171 -43.353 -29.379 1.00 51.63 ? 92 ALA F CB 1 ATOM 3802 N N . TYR C 3 115 ? -38.249 -40.269 -30.086 1.00 48.12 ? 93 TYR F N 1 ATOM 3803 C CA . TYR C 3 115 ? -39.058 -39.410 -30.953 1.00 46.91 ? 93 TYR F CA 1 ATOM 3804 C C . TYR C 3 115 ? -39.312 -40.059 -32.321 1.00 49.78 ? 93 TYR F C 1 ATOM 3805 O O . TYR C 3 115 ? -40.375 -39.843 -32.906 1.00 49.52 ? 93 TYR F O 1 ATOM 3806 C CB . TYR C 3 115 ? -38.398 -38.020 -31.091 1.00 46.36 ? 93 TYR F CB 1 ATOM 3807 C CG . TYR C 3 115 ? -39.097 -37.062 -32.035 1.00 47.28 ? 93 TYR F CG 1 ATOM 3808 C CD1 . TYR C 3 115 ? -40.333 -36.507 -31.711 1.00 50.26 ? 93 TYR F CD1 1 ATOM 3809 C CD2 . TYR C 3 115 ? -38.499 -36.670 -33.229 1.00 46.43 ? 93 TYR F CD2 1 ATOM 3810 C CE1 . TYR C 3 115 ? -40.975 -35.617 -32.571 1.00 50.37 ? 93 TYR F CE1 1 ATOM 3811 C CE2 . TYR C 3 115 ? -39.130 -35.778 -34.096 1.00 46.77 ? 93 TYR F CE2 1 ATOM 3812 C CZ . TYR C 3 115 ? -40.369 -35.254 -33.763 1.00 55.47 ? 93 TYR F CZ 1 ATOM 3813 O OH . TYR C 3 115 ? -40.993 -34.372 -34.612 1.00 56.40 ? 93 TYR F OH 1 ATOM 3814 N N . CYS C 3 116 ? -38.349 -40.865 -32.814 1.00 45.56 ? 94 CYS F N 1 ATOM 3815 C CA . CYS C 3 116 ? -38.441 -41.550 -34.106 1.00 44.87 ? 94 CYS F CA 1 ATOM 3816 C C . CYS C 3 116 ? -38.712 -43.048 -33.975 1.00 50.36 ? 94 CYS F C 1 ATOM 3817 O O . CYS C 3 116 ? -38.226 -43.686 -33.040 1.00 50.89 ? 94 CYS F O 1 ATOM 3818 C CB . CYS C 3 116 ? -37.197 -41.286 -34.950 1.00 43.37 ? 94 CYS F CB 1 ATOM 3819 S SG . CYS C 3 116 ? -36.908 -39.538 -35.345 1.00 45.50 ? 94 CYS F SG 1 ATOM 3820 N N . PHE C 3 117 ? -39.464 -43.609 -34.939 1.00 47.39 ? 95 PHE F N 1 ATOM 3821 C CA . PHE C 3 117 ? -39.802 -45.034 -35.001 1.00 48.79 ? 95 PHE F CA 1 ATOM 3822 C C . PHE C 3 117 ? -38.596 -45.868 -35.455 1.00 52.01 ? 95 PHE F C 1 ATOM 3823 O O . PHE C 3 117 ? -38.395 -46.974 -34.952 1.00 52.89 ? 95 PHE F O 1 ATOM 3824 C CB . PHE C 3 117 ? -41.019 -45.257 -35.927 1.00 51.18 ? 95 PHE F CB 1 ATOM 3825 C CG . PHE C 3 117 ? -41.228 -46.669 -36.430 1.00 53.93 ? 95 PHE F CG 1 ATOM 3826 C CD1 . PHE C 3 117 ? -41.797 -47.639 -35.614 1.00 59.24 ? 95 PHE F CD1 1 ATOM 3827 C CD2 . PHE C 3 117 ? -40.866 -47.024 -37.725 1.00 55.18 ? 95 PHE F CD2 1 ATOM 3828 C CE1 . PHE C 3 117 ? -41.990 -48.942 -36.081 1.00 61.33 ? 95 PHE F CE1 1 ATOM 3829 C CE2 . PHE C 3 117 ? -41.062 -48.326 -38.192 1.00 59.15 ? 95 PHE F CE2 1 ATOM 3830 C CZ . PHE C 3 117 ? -41.623 -49.276 -37.367 1.00 59.34 ? 95 PHE F CZ 1 ATOM 3831 N N . CYS C 3 118 ? -37.820 -45.341 -36.423 1.00 46.83 ? 96 CYS F N 1 ATOM 3832 C CA . CYS C 3 118 ? -36.639 -45.987 -37.002 1.00 46.09 ? 96 CYS F CA 1 ATOM 3833 C C . CYS C 3 118 ? -35.411 -45.887 -36.103 1.00 49.73 ? 96 CYS F C 1 ATOM 3834 O O . CYS C 3 118 ? -35.243 -44.893 -35.394 1.00 48.82 ? 96 CYS F O 1 ATOM 3835 C CB . CYS C 3 118 ? -36.355 -45.442 -38.399 1.00 45.01 ? 96 CYS F CB 1 ATOM 3836 S SG . CYS C 3 118 ? -37.669 -45.763 -39.607 1.00 49.48 ? 96 CYS F SG 1 ATOM 3837 N N . ASP C 3 119 ? -34.546 -46.913 -36.152 1.00 46.81 ? 97 ASP F N 1 ATOM 3838 C CA . ASP C 3 119 ? -33.326 -46.977 -35.352 1.00 46.65 ? 97 ASP F CA 1 ATOM 3839 C C . ASP C 3 119 ? -32.179 -46.155 -35.943 1.00 48.37 ? 97 ASP F C 1 ATOM 3840 O O . ASP C 3 119 ? -31.495 -45.462 -35.191 1.00 47.57 ? 97 ASP F O 1 ATOM 3841 C CB . ASP C 3 119 ? -32.884 -48.437 -35.134 1.00 50.04 ? 97 ASP F CB 1 ATOM 3842 C CG . ASP C 3 119 ? -33.874 -49.282 -34.356 1.00 63.04 ? 97 ASP F CG 1 ATOM 3843 O OD1 . ASP C 3 119 ? -33.974 -49.096 -33.123 1.00 64.80 ? 97 ASP F OD1 1 ATOM 3844 O OD2 . ASP C 3 119 ? -34.524 -50.151 -34.974 1.00 69.69 ? 97 ASP F OD2 1 ATOM 3845 N N . ALA C 3 120 ? -31.956 -46.232 -37.272 1.00 43.78 ? 98 ALA F N 1 ATOM 3846 C CA . ALA C 3 120 ? -30.828 -45.538 -37.909 1.00 42.23 ? 98 ALA F CA 1 ATOM 3847 C C . ALA C 3 120 ? -31.116 -44.572 -39.066 1.00 44.36 ? 98 ALA F C 1 ATOM 3848 O O . ALA C 3 120 ? -30.305 -43.676 -39.316 1.00 43.18 ? 98 ALA F O 1 ATOM 3849 C CB . ALA C 3 120 ? -29.781 -46.554 -38.342 1.00 43.48 ? 98 ALA F CB 1 ATOM 3850 N N . GLU C 3 121 ? -32.229 -44.760 -39.785 1.00 40.48 ? 99 GLU F N 1 ATOM 3851 C CA . GLU C 3 121 ? -32.589 -43.977 -40.975 1.00 39.27 ? 99 GLU F CA 1 ATOM 3852 C C . GLU C 3 121 ? -33.201 -42.564 -40.728 1.00 41.49 ? 99 GLU F C 1 ATOM 3853 O O . GLU C 3 121 ? -33.947 -42.059 -41.576 1.00 40.88 ? 99 GLU F O 1 ATOM 3854 C CB . GLU C 3 121 ? -33.476 -44.828 -41.911 1.00 41.39 ? 99 GLU F CB 1 ATOM 3855 C CG . GLU C 3 121 ? -32.791 -46.053 -42.501 1.00 52.87 ? 99 GLU F CG 1 ATOM 3856 C CD . GLU C 3 121 ? -32.814 -47.316 -41.658 1.00 75.69 ? 99 GLU F CD 1 ATOM 3857 O OE1 . GLU C 3 121 ? -33.849 -47.590 -41.007 1.00 71.14 ? 99 GLU F OE1 1 ATOM 3858 O OE2 . GLU C 3 121 ? -31.799 -48.049 -41.670 1.00 70.81 ? 99 GLU F OE2 1 ATOM 3859 N N . ASN C 3 122 ? -32.870 -41.929 -39.588 1.00 37.04 ? 100 ASN F N 1 ATOM 3860 C CA . ASN C 3 122 ? -33.395 -40.616 -39.193 1.00 35.99 ? 100 ASN F CA 1 ATOM 3861 C C . ASN C 3 122 ? -32.351 -39.528 -39.364 1.00 38.31 ? 100 ASN F C 1 ATOM 3862 O O . ASN C 3 122 ? -31.169 -39.778 -39.125 1.00 37.78 ? 100 ASN F O 1 ATOM 3863 C CB . ASN C 3 122 ? -33.868 -40.645 -37.738 1.00 36.91 ? 100 ASN F CB 1 ATOM 3864 C CG . ASN C 3 122 ? -34.644 -41.878 -37.363 1.00 58.18 ? 100 ASN F CG 1 ATOM 3865 O OD1 . ASN C 3 122 ? -35.754 -42.120 -37.856 1.00 52.44 ? 100 ASN F OD1 1 ATOM 3866 N ND2 . ASN C 3 122 ? -34.073 -42.677 -36.473 1.00 50.10 ? 100 ASN F ND2 1 ATOM 3867 N N . THR C 3 123 ? -32.783 -38.316 -39.760 1.00 33.94 ? 101 THR F N 1 ATOM 3868 C CA . THR C 3 123 ? -31.885 -37.172 -39.962 1.00 32.87 ? 101 THR F CA 1 ATOM 3869 C C . THR C 3 123 ? -32.332 -35.921 -39.204 1.00 35.74 ? 101 THR F C 1 ATOM 3870 O O . THR C 3 123 ? -33.532 -35.700 -39.037 1.00 35.34 ? 101 THR F O 1 ATOM 3871 C CB . THR C 3 123 ? -31.721 -36.844 -41.458 1.00 40.78 ? 101 THR F CB 1 ATOM 3872 O OG1 . THR C 3 123 ? -33.004 -36.593 -42.033 1.00 40.37 ? 101 THR F OG1 1 ATOM 3873 C CG2 . THR C 3 123 ? -30.986 -37.932 -42.235 1.00 39.73 ? 101 THR F CG2 1 ATOM 3874 N N . GLN C 3 124 ? -31.365 -35.091 -38.769 1.00 31.65 ? 102 GLN F N 1 ATOM 3875 C CA . GLN C 3 124 ? -31.645 -33.818 -38.103 1.00 30.98 ? 102 GLN F CA 1 ATOM 3876 C C . GLN C 3 124 ? -31.079 -32.672 -38.933 1.00 34.16 ? 102 GLN F C 1 ATOM 3877 O O . GLN C 3 124 ? -29.882 -32.654 -39.232 1.00 33.52 ? 102 GLN F O 1 ATOM 3878 C CB . GLN C 3 124 ? -31.103 -33.766 -36.659 1.00 32.33 ? 102 GLN F CB 1 ATOM 3879 C CG . GLN C 3 124 ? -31.634 -32.556 -35.878 1.00 46.83 ? 102 GLN F CG 1 ATOM 3880 C CD . GLN C 3 124 ? -30.863 -32.241 -34.620 1.00 66.93 ? 102 GLN F CD 1 ATOM 3881 O OE1 . GLN C 3 124 ? -30.045 -31.315 -34.582 1.00 62.56 ? 102 GLN F OE1 1 ATOM 3882 N NE2 . GLN C 3 124 ? -31.158 -32.956 -33.542 1.00 59.70 ? 102 GLN F NE2 1 ATOM 3883 N N . LEU C 3 125 ? -31.951 -31.724 -39.310 1.00 30.64 ? 103 LEU F N 1 ATOM 3884 C CA . LEU C 3 125 ? -31.574 -30.536 -40.067 1.00 30.31 ? 103 LEU F CA 1 ATOM 3885 C C . LEU C 3 125 ? -31.396 -29.386 -39.077 1.00 33.75 ? 103 LEU F C 1 ATOM 3886 O O . LEU C 3 125 ? -32.367 -28.936 -38.464 1.00 33.16 ? 103 LEU F O 1 ATOM 3887 C CB . LEU C 3 125 ? -32.634 -30.198 -41.137 1.00 30.72 ? 103 LEU F CB 1 ATOM 3888 C CG . LEU C 3 125 ? -32.320 -29.020 -42.068 1.00 35.70 ? 103 LEU F CG 1 ATOM 3889 C CD1 . LEU C 3 125 ? -32.629 -29.366 -43.502 1.00 36.60 ? 103 LEU F CD1 1 ATOM 3890 C CD2 . LEU C 3 125 ? -33.095 -27.776 -41.667 1.00 38.16 ? 103 LEU F CD2 1 ATOM 3891 N N . SER C 3 126 ? -30.149 -28.937 -38.907 1.00 30.38 ? 104 SER F N 1 ATOM 3892 C CA . SER C 3 126 ? -29.816 -27.830 -38.019 1.00 30.13 ? 104 SER F CA 1 ATOM 3893 C C . SER C 3 126 ? -29.660 -26.551 -38.833 1.00 34.48 ? 104 SER F C 1 ATOM 3894 O O . SER C 3 126 ? -28.913 -26.539 -39.813 1.00 34.45 ? 104 SER F O 1 ATOM 3895 C CB . SER C 3 126 ? -28.526 -28.125 -37.257 1.00 33.63 ? 104 SER F CB 1 ATOM 3896 O OG . SER C 3 126 ? -28.742 -29.000 -36.162 1.00 42.53 ? 104 SER F OG 1 ATOM 3897 N N . GLU C 3 127 ? -30.383 -25.486 -38.454 1.00 31.17 ? 105 GLU F N 1 ATOM 3898 C CA . GLU C 3 127 ? -30.245 -24.203 -39.138 1.00 31.42 ? 105 GLU F CA 1 ATOM 3899 C C . GLU C 3 127 ? -30.027 -23.009 -38.213 1.00 35.10 ? 105 GLU F C 1 ATOM 3900 O O . GLU C 3 127 ? -30.501 -23.014 -37.075 1.00 34.44 ? 105 GLU F O 1 ATOM 3901 C CB . GLU C 3 127 ? -31.224 -23.985 -40.315 1.00 33.36 ? 105 GLU F CB 1 ATOM 3902 C CG . GLU C 3 127 ? -32.651 -23.593 -39.976 1.00 44.64 ? 105 GLU F CG 1 ATOM 3903 C CD . GLU C 3 127 ? -33.577 -23.516 -41.178 1.00 68.19 ? 105 GLU F CD 1 ATOM 3904 O OE1 . GLU C 3 127 ? -33.339 -22.681 -42.083 1.00 65.54 ? 105 GLU F OE1 1 ATOM 3905 O OE2 . GLU C 3 127 ? -34.577 -24.269 -41.185 1.00 63.22 ? 105 GLU F OE2 1 ATOM 3906 N N . ALA C 3 128 ? -29.214 -22.037 -38.675 1.00 32.00 ? 106 ALA F N 1 ATOM 3907 C CA . ALA C 3 128 ? -28.829 -20.841 -37.923 1.00 31.85 ? 106 ALA F CA 1 ATOM 3908 C C . ALA C 3 128 ? -28.414 -19.684 -38.829 1.00 36.45 ? 106 ALA F C 1 ATOM 3909 O O . ALA C 3 128 ? -27.852 -19.906 -39.904 1.00 36.68 ? 106 ALA F O 1 ATOM 3910 C CB . ALA C 3 128 ? -27.682 -21.176 -36.978 1.00 32.34 ? 106 ALA F CB 1 ATOM 3911 N N . HIS C 3 129 ? -28.679 -18.447 -38.375 1.00 33.09 ? 107 HIS F N 1 ATOM 3912 C CA . HIS C 3 129 ? -28.299 -17.206 -39.052 1.00 33.80 ? 107 HIS F CA 1 ATOM 3913 C C . HIS C 3 129 ? -28.033 -16.091 -38.033 1.00 37.26 ? 107 HIS F C 1 ATOM 3914 O O . HIS C 3 129 ? -28.507 -16.169 -36.896 1.00 35.88 ? 107 HIS F O 1 ATOM 3915 C CB . HIS C 3 129 ? -29.305 -16.799 -40.153 1.00 35.25 ? 107 HIS F CB 1 ATOM 3916 C CG . HIS C 3 129 ? -30.513 -16.052 -39.675 1.00 38.50 ? 107 HIS F CG 1 ATOM 3917 N ND1 . HIS C 3 129 ? -31.684 -16.708 -39.347 1.00 39.60 ? 107 HIS F ND1 1 ATOM 3918 C CD2 . HIS C 3 129 ? -30.707 -14.720 -39.540 1.00 40.89 ? 107 HIS F CD2 1 ATOM 3919 C CE1 . HIS C 3 129 ? -32.541 -15.761 -39.000 1.00 39.32 ? 107 HIS F CE1 1 ATOM 3920 N NE2 . HIS C 3 129 ? -31.996 -14.549 -39.096 1.00 40.39 ? 107 HIS F NE2 1 ATOM 3921 N N . VAL C 3 130 ? -27.261 -15.072 -38.437 1.00 34.79 ? 108 VAL F N 1 ATOM 3922 C CA . VAL C 3 130 ? -26.899 -13.944 -37.575 1.00 34.80 ? 108 VAL F CA 1 ATOM 3923 C C . VAL C 3 130 ? -27.649 -12.674 -38.001 1.00 39.57 ? 108 VAL F C 1 ATOM 3924 O O . VAL C 3 130 ? -27.760 -12.387 -39.193 1.00 40.20 ? 108 VAL F O 1 ATOM 3925 C CB . VAL C 3 130 ? -25.354 -13.767 -37.474 1.00 39.26 ? 108 VAL F CB 1 ATOM 3926 C CG1 . VAL C 3 130 ? -24.969 -12.524 -36.672 1.00 39.55 ? 108 VAL F CG1 1 ATOM 3927 C CG2 . VAL C 3 130 ? -24.704 -15.006 -36.864 1.00 38.21 ? 108 VAL F CG2 1 ATOM 3928 N N . GLU C 3 131 ? -28.185 -11.944 -37.010 1.00 35.86 ? 109 GLU F N 1 ATOM 3929 C CA . GLU C 3 131 ? -28.945 -10.704 -37.162 1.00 36.50 ? 109 GLU F CA 1 ATOM 3930 C C . GLU C 3 131 ? -28.591 -9.766 -35.997 1.00 40.04 ? 109 GLU F C 1 ATOM 3931 O O . GLU C 3 131 ? -27.890 -10.184 -35.069 1.00 38.97 ? 109 GLU F O 1 ATOM 3932 C CB . GLU C 3 131 ? -30.447 -11.033 -37.130 1.00 37.47 ? 109 GLU F CB 1 ATOM 3933 C CG . GLU C 3 131 ? -31.250 -10.434 -38.266 1.00 50.43 ? 109 GLU F CG 1 ATOM 3934 C CD . GLU C 3 131 ? -32.730 -10.750 -38.177 1.00 72.22 ? 109 GLU F CD 1 ATOM 3935 O OE1 . GLU C 3 131 ? -33.437 -10.063 -37.405 1.00 68.33 ? 109 GLU F OE1 1 ATOM 3936 O OE2 . GLU C 3 131 ? -33.182 -11.691 -38.869 1.00 66.10 ? 109 GLU F OE2 1 ATOM 3937 N N . LYS C 3 132 ? -29.072 -8.507 -36.038 1.00 37.19 ? 110 LYS F N 1 ATOM 3938 C CA . LYS C 3 132 ? -28.833 -7.538 -34.965 1.00 37.12 ? 110 LYS F CA 1 ATOM 3939 C C . LYS C 3 132 ? -29.630 -7.911 -33.719 1.00 40.15 ? 110 LYS F C 1 ATOM 3940 O O . LYS C 3 132 ? -30.772 -8.365 -33.835 1.00 39.40 ? 110 LYS F O 1 ATOM 3941 C CB . LYS C 3 132 ? -29.231 -6.124 -35.402 1.00 40.78 ? 110 LYS F CB 1 ATOM 3942 C CG . LYS C 3 132 ? -28.144 -5.373 -36.155 1.00 52.64 ? 110 LYS F CG 1 ATOM 3943 C CD . LYS C 3 132 ? -28.468 -3.883 -36.328 1.00 61.79 ? 110 LYS F CD 1 ATOM 3944 C CE . LYS C 3 132 ? -29.584 -3.604 -37.311 1.00 70.66 ? 110 LYS F CE 1 ATOM 3945 N NZ . LYS C 3 132 ? -29.664 -2.166 -37.661 1.00 80.59 ? 110 LYS F NZ 1 ATOM 3946 N N . SER C 3 133 ? -29.042 -7.700 -32.530 1.00 37.58 ? 111 SER F N 1 ATOM 3947 C CA . SER C 3 133 ? -29.726 -7.977 -31.269 1.00 38.88 ? 111 SER F CA 1 ATOM 3948 C C . SER C 3 133 ? -30.730 -6.858 -30.980 1.00 43.53 ? 111 SER F C 1 ATOM 3949 O O . SER C 3 133 ? -30.624 -5.769 -31.552 1.00 42.38 ? 111 SER F O 1 ATOM 3950 C CB . SER C 3 133 ? -28.724 -8.104 -30.125 1.00 42.04 ? 111 SER F CB 1 ATOM 3951 O OG . SER C 3 133 ? -29.365 -8.386 -28.891 1.00 52.81 ? 111 SER F OG 1 ATOM 3952 N N . GLU C 3 134 ? -31.697 -7.126 -30.085 1.00 41.87 ? 112 GLU F N 1 ATOM 3953 C CA . GLU C 3 134 ? -32.730 -6.174 -29.657 1.00 43.16 ? 112 GLU F CA 1 ATOM 3954 C C . GLU C 3 134 ? -32.085 -4.958 -28.973 1.00 45.67 ? 112 GLU F C 1 ATOM 3955 O O . GLU C 3 134 ? -32.660 -3.868 -28.968 1.00 45.94 ? 112 GLU F O 1 ATOM 3956 C CB . GLU C 3 134 ? -33.720 -6.851 -28.689 1.00 47.22 ? 112 GLU F CB 1 ATOM 3957 C CG . GLU C 3 134 ? -34.417 -8.089 -29.242 1.00 59.94 ? 112 GLU F CG 1 ATOM 3958 C CD . GLU C 3 134 ? -33.711 -9.425 -29.072 1.00 80.42 ? 112 GLU F CD 1 ATOM 3959 O OE1 . GLU C 3 134 ? -32.504 -9.442 -28.735 1.00 73.99 ? 112 GLU F OE1 1 ATOM 3960 O OE2 . GLU C 3 134 ? -34.373 -10.464 -29.295 1.00 75.74 ? 112 GLU F OE2 1 ATOM 3961 N N . SER C 3 135 ? -30.877 -5.166 -28.417 1.00 40.54 ? 113 SER F N 1 ATOM 3962 C CA . SER C 3 135 ? -30.051 -4.192 -27.710 1.00 39.15 ? 113 SER F CA 1 ATOM 3963 C C . SER C 3 135 ? -29.408 -3.138 -28.609 1.00 41.04 ? 113 SER F C 1 ATOM 3964 O O . SER C 3 135 ? -29.008 -2.090 -28.103 1.00 40.16 ? 113 SER F O 1 ATOM 3965 C CB . SER C 3 135 ? -28.949 -4.918 -26.948 1.00 42.24 ? 113 SER F CB 1 ATOM 3966 O OG . SER C 3 135 ? -28.083 -5.642 -27.808 1.00 49.96 ? 113 SER F OG 1 ATOM 3967 N N . CYS C 3 136 ? -29.271 -3.424 -29.921 1.00 36.67 ? 114 CYS F N 1 ATOM 3968 C CA . CYS C 3 136 ? -28.624 -2.549 -30.908 1.00 35.05 ? 114 CYS F CA 1 ATOM 3969 C C . CYS C 3 136 ? -29.103 -1.092 -30.974 1.00 38.93 ? 114 CYS F C 1 ATOM 3970 O O . CYS C 3 136 ? -28.318 -0.216 -31.342 1.00 37.50 ? 114 CYS F O 1 ATOM 3971 C CB . CYS C 3 136 ? -28.584 -3.205 -32.285 1.00 35.23 ? 114 CYS F CB 1 ATOM 3972 S SG . CYS C 3 136 ? -27.477 -4.636 -32.384 1.00 38.20 ? 114 CYS F SG 1 ATOM 3973 N N . LYS C 3 137 ? -30.367 -0.832 -30.591 1.00 36.94 ? 115 LYS F N 1 ATOM 3974 C CA . LYS C 3 137 ? -30.952 0.512 -30.556 1.00 37.69 ? 115 LYS F CA 1 ATOM 3975 C C . LYS C 3 137 ? -30.521 1.261 -29.287 1.00 40.80 ? 115 LYS F C 1 ATOM 3976 O O . LYS C 3 137 ? -30.469 2.492 -29.294 1.00 40.70 ? 115 LYS F O 1 ATOM 3977 C CB . LYS C 3 137 ? -32.485 0.439 -30.632 1.00 42.99 ? 115 LYS F CB 1 ATOM 3978 C CG . LYS C 3 137 ? -33.018 0.051 -32.010 1.00 59.10 ? 115 LYS F CG 1 ATOM 3979 C CD . LYS C 3 137 ? -34.526 -0.190 -32.005 1.00 72.77 ? 115 LYS F CD 1 ATOM 3980 C CE . LYS C 3 137 ? -34.889 -1.638 -31.766 1.00 84.73 ? 115 LYS F CE 1 ATOM 3981 N NZ . LYS C 3 137 ? -36.359 -1.851 -31.819 1.00 97.62 ? 115 LYS F NZ 1 ATOM 3982 N N . THR C 3 138 ? -30.215 0.512 -28.204 1.00 36.67 ? 116 THR F N 1 ATOM 3983 C CA . THR C 3 138 ? -29.803 1.038 -26.899 1.00 36.37 ? 116 THR F CA 1 ATOM 3984 C C . THR C 3 138 ? -28.277 0.986 -26.705 1.00 37.83 ? 116 THR F C 1 ATOM 3985 O O . THR C 3 138 ? -27.674 2.008 -26.366 1.00 37.06 ? 116 THR F O 1 ATOM 3986 C CB . THR C 3 138 ? -30.578 0.317 -25.778 1.00 45.90 ? 116 THR F CB 1 ATOM 3987 O OG1 . THR C 3 138 ? -31.981 0.456 -26.014 1.00 47.48 ? 116 THR F OG1 1 ATOM 3988 C CG2 . THR C 3 138 ? -30.233 0.839 -24.382 1.00 44.99 ? 116 THR F CG2 1 ATOM 3989 N N . GLU C 3 139 ? -27.669 -0.203 -26.896 1.00 32.97 ? 117 GLU F N 1 ATOM 3990 C CA . GLU C 3 139 ? -26.232 -0.440 -26.735 1.00 31.18 ? 117 GLU F CA 1 ATOM 3991 C C . GLU C 3 139 ? -25.536 -0.586 -28.088 1.00 32.83 ? 117 GLU F C 1 ATOM 3992 O O . GLU C 3 139 ? -25.666 -1.623 -28.743 1.00 32.37 ? 117 GLU F O 1 ATOM 3993 C CB . GLU C 3 139 ? -25.979 -1.675 -25.847 1.00 33.35 ? 117 GLU F CB 1 ATOM 3994 C CG . GLU C 3 139 ? -26.243 -1.447 -24.367 1.00 45.68 ? 117 GLU F CG 1 ATOM 3995 C CD . GLU C 3 139 ? -25.279 -0.523 -23.645 1.00 66.34 ? 117 GLU F CD 1 ATOM 3996 O OE1 . GLU C 3 139 ? -24.074 -0.522 -23.986 1.00 60.43 ? 117 GLU F OE1 1 ATOM 3997 O OE2 . GLU C 3 139 ? -25.729 0.187 -22.718 1.00 61.65 ? 117 GLU F OE2 1 ATOM 3998 N N . PHE C 3 140 ? -24.805 0.465 -28.508 1.00 27.88 ? 118 PHE F N 1 ATOM 3999 C CA . PHE C 3 140 ? -24.096 0.496 -29.789 1.00 26.34 ? 118 PHE F CA 1 ATOM 4000 C C . PHE C 3 140 ? -22.916 1.475 -29.820 1.00 29.13 ? 118 PHE F C 1 ATOM 4001 O O . PHE C 3 140 ? -22.891 2.451 -29.066 1.00 28.88 ? 118 PHE F O 1 ATOM 4002 C CB . PHE C 3 140 ? -25.077 0.788 -30.951 1.00 28.51 ? 118 PHE F CB 1 ATOM 4003 C CG . PHE C 3 140 ? -25.623 2.199 -31.019 1.00 30.66 ? 118 PHE F CG 1 ATOM 4004 C CD1 . PHE C 3 140 ? -25.089 3.127 -31.904 1.00 33.32 ? 118 PHE F CD1 1 ATOM 4005 C CD2 . PHE C 3 140 ? -26.689 2.590 -30.218 1.00 34.06 ? 118 PHE F CD2 1 ATOM 4006 C CE1 . PHE C 3 140 ? -25.596 4.428 -31.971 1.00 35.24 ? 118 PHE F CE1 1 ATOM 4007 C CE2 . PHE C 3 140 ? -27.192 3.894 -30.282 1.00 37.87 ? 118 PHE F CE2 1 ATOM 4008 C CZ . PHE C 3 140 ? -26.644 4.803 -31.159 1.00 35.67 ? 118 PHE F CZ 1 ATOM 4009 N N . ALA C 3 141 ? -21.953 1.211 -30.722 1.00 24.92 ? 119 ALA F N 1 ATOM 4010 C CA . ALA C 3 141 ? -20.781 2.048 -30.980 1.00 24.33 ? 119 ALA F CA 1 ATOM 4011 C C . ALA C 3 141 ? -20.867 2.522 -32.427 1.00 28.11 ? 119 ALA F C 1 ATOM 4012 O O . ALA C 3 141 ? -21.223 1.732 -33.303 1.00 27.61 ? 119 ALA F O 1 ATOM 4013 C CB . ALA C 3 141 ? -19.500 1.257 -30.761 1.00 24.85 ? 119 ALA F CB 1 ATOM 4014 N N . SER C 3 142 ? -20.554 3.781 -32.683 1.00 24.95 ? 120 SER F N 1 ATOM 4015 C CA . SER C 3 142 ? -20.623 4.332 -34.025 1.00 25.22 ? 120 SER F CA 1 ATOM 4016 C C . SER C 3 142 ? -19.272 4.634 -34.613 1.00 28.91 ? 120 SER F C 1 ATOM 4017 O O . SER C 3 142 ? -18.445 5.170 -33.951 1.00 28.30 ? 120 SER F O 1 ATOM 4018 C CB . SER C 3 142 ? -21.469 5.580 -34.030 1.00 29.79 ? 120 SER F CB 1 ATOM 4019 O OG . SER C 3 142 ? -22.406 5.541 -32.998 1.00 39.20 ? 120 SER F OG 1 ATOM 4020 N N . ALA C 3 143 ? -19.069 4.261 -35.867 1.00 25.96 ? 121 ALA F N 1 ATOM 4021 C CA . ALA C 3 143 ? -17.823 4.483 -36.599 1.00 26.20 ? 121 ALA F CA 1 ATOM 4022 C C . ALA C 3 143 ? -17.996 5.687 -37.529 1.00 31.54 ? 121 ALA F C 1 ATOM 4023 O O . ALA C 3 143 ? -18.799 5.634 -38.465 1.00 31.86 ? 121 ALA F O 1 ATOM 4024 C CB . ALA C 3 143 ? -17.449 3.237 -37.390 1.00 26.90 ? 121 ALA F CB 1 ATOM 4025 N N . TYR C 3 144 ? -17.278 6.789 -37.234 1.00 28.93 ? 122 TYR F N 1 ATOM 4026 C CA . TYR C 3 144 ? -17.353 8.040 -37.994 1.00 30.45 ? 122 TYR F CA 1 ATOM 4027 C C . TYR C 3 144 ? -16.054 8.397 -38.707 1.00 36.03 ? 122 TYR F C 1 ATOM 4028 O O . TYR C 3 144 ? -14.967 8.064 -38.228 1.00 34.99 ? 122 TYR F O 1 ATOM 4029 C CB . TYR C 3 144 ? -17.715 9.218 -37.070 1.00 31.79 ? 122 TYR F CB 1 ATOM 4030 C CG . TYR C 3 144 ? -19.119 9.215 -36.509 1.00 33.25 ? 122 TYR F CG 1 ATOM 4031 C CD1 . TYR C 3 144 ? -20.201 9.625 -37.283 1.00 36.69 ? 122 TYR F CD1 1 ATOM 4032 C CD2 . TYR C 3 144 ? -19.353 8.919 -35.170 1.00 32.90 ? 122 TYR F CD2 1 ATOM 4033 C CE1 . TYR C 3 144 ? -21.491 9.676 -36.755 1.00 37.90 ? 122 TYR F CE1 1 ATOM 4034 C CE2 . TYR C 3 144 ? -20.635 8.978 -34.628 1.00 34.12 ? 122 TYR F CE2 1 ATOM 4035 C CZ . TYR C 3 144 ? -21.704 9.342 -35.428 1.00 42.86 ? 122 TYR F CZ 1 ATOM 4036 O OH . TYR C 3 144 ? -22.972 9.387 -34.900 1.00 44.23 ? 122 TYR F OH 1 ATOM 4037 N N . ARG C 3 145 ? -16.181 9.140 -39.822 1.00 35.06 ? 123 ARG F N 1 ATOM 4038 C CA . ARG C 3 145 ? -15.067 9.682 -40.594 1.00 36.73 ? 123 ARG F CA 1 ATOM 4039 C C . ARG C 3 145 ? -15.006 11.175 -40.269 1.00 42.51 ? 123 ARG F C 1 ATOM 4040 O O . ARG C 3 145 ? -15.897 11.933 -40.665 1.00 43.54 ? 123 ARG F O 1 ATOM 4041 C CB . ARG C 3 145 ? -15.254 9.444 -42.104 1.00 39.02 ? 123 ARG F CB 1 ATOM 4042 C CG . ARG C 3 145 ? -14.831 8.053 -42.550 1.00 50.35 ? 123 ARG F CG 1 ATOM 4043 C CD . ARG C 3 145 ? -14.608 7.972 -44.045 1.00 64.62 ? 123 ARG F CD 1 ATOM 4044 N NE . ARG C 3 145 ? -13.616 6.947 -44.369 1.00 74.25 ? 123 ARG F NE 1 ATOM 4045 C CZ . ARG C 3 145 ? -13.818 5.930 -45.200 1.00 88.99 ? 123 ARG F CZ 1 ATOM 4046 N NH1 . ARG C 3 145 ? -14.979 5.798 -45.831 1.00 76.36 ? 123 ARG F NH1 1 ATOM 4047 N NH2 . ARG C 3 145 ? -12.852 5.048 -45.424 1.00 76.36 ? 123 ARG F NH2 1 ATOM 4048 N N . ALA C 3 146 ? -14.000 11.576 -39.478 1.00 39.30 ? 124 ALA F N 1 ATOM 4049 C CA . ALA C 3 146 ? -13.825 12.961 -39.047 1.00 40.59 ? 124 ALA F CA 1 ATOM 4050 C C . ALA C 3 146 ? -12.887 13.711 -39.986 1.00 47.57 ? 124 ALA F C 1 ATOM 4051 O O . ALA C 3 146 ? -11.788 13.229 -40.276 1.00 47.44 ? 124 ALA F O 1 ATOM 4052 C CB . ALA C 3 146 ? -13.296 13.003 -37.620 1.00 40.08 ? 124 ALA F CB 1 ATOM 4053 N N . HIS C 3 147 ? -13.328 14.874 -40.483 1.00 46.80 ? 125 HIS F N 1 ATOM 4054 C CA . HIS C 3 147 ? -12.495 15.680 -41.373 1.00 49.57 ? 125 HIS F CA 1 ATOM 4055 C C . HIS C 3 147 ? -12.230 17.106 -40.846 1.00 55.24 ? 125 HIS F C 1 ATOM 4056 O O . HIS C 3 147 ? -11.817 17.211 -39.689 1.00 53.64 ? 125 HIS F O 1 ATOM 4057 C CB . HIS C 3 147 ? -12.850 15.534 -42.873 1.00 52.41 ? 125 HIS F CB 1 ATOM 4058 C CG . HIS C 3 147 ? -14.235 15.036 -43.168 1.00 55.30 ? 125 HIS F CG 1 ATOM 4059 N ND1 . HIS C 3 147 ? -14.544 13.681 -43.154 1.00 54.93 ? 125 HIS F ND1 1 ATOM 4060 C CD2 . HIS C 3 147 ? -15.338 15.728 -43.531 1.00 58.85 ? 125 HIS F CD2 1 ATOM 4061 C CE1 . HIS C 3 147 ? -15.826 13.603 -43.479 1.00 54.77 ? 125 HIS F CE1 1 ATOM 4062 N NE2 . HIS C 3 147 ? -16.345 14.808 -43.714 1.00 57.54 ? 125 HIS F NE2 1 ATOM 4063 N N . THR C 3 148 ? -12.449 18.182 -41.640 1.00 54.80 ? 126 THR F N 1 ATOM 4064 C CA . THR C 3 148 ? -12.224 19.572 -41.191 1.00 56.56 ? 126 THR F CA 1 ATOM 4065 C C . THR C 3 148 ? -13.065 19.949 -39.952 1.00 58.73 ? 126 THR F C 1 ATOM 4066 O O . THR C 3 148 ? -14.176 19.437 -39.796 1.00 57.00 ? 126 THR F O 1 ATOM 4067 C CB . THR C 3 148 ? -12.329 20.567 -42.360 1.00 69.82 ? 126 THR F CB 1 ATOM 4068 O OG1 . THR C 3 148 ? -11.856 21.844 -41.930 1.00 72.18 ? 126 THR F OG1 1 ATOM 4069 C CG2 . THR C 3 148 ? -13.746 20.692 -42.922 1.00 69.91 ? 126 THR F CG2 1 ATOM 4070 N N . ALA C 3 149 ? -12.524 20.798 -39.060 1.00 44.67 ? 127 ALA F N 1 ATOM 4071 C CA . ALA C 3 149 ? -13.210 21.192 -37.826 1.00 42.92 ? 127 ALA F CA 1 ATOM 4072 C C . ALA C 3 149 ? -13.632 22.657 -37.804 1.00 45.27 ? 127 ALA F C 1 ATOM 4073 O O . ALA C 3 149 ? -12.853 23.532 -38.193 1.00 44.85 ? 127 ALA F O 1 ATOM 4074 C CB . ALA C 3 149 ? -12.340 20.876 -36.618 1.00 43.38 ? 127 ALA F CB 1 ATOM 4075 N N . SER C 3 150 ? -14.869 22.918 -37.338 1.00 40.61 ? 128 SER F N 1 ATOM 4076 C CA . SER C 3 150 ? -15.422 24.265 -37.218 1.00 39.32 ? 128 SER F CA 1 ATOM 4077 C C . SER C 3 150 ? -15.187 24.790 -35.801 1.00 41.64 ? 128 SER F C 1 ATOM 4078 O O . SER C 3 150 ? -15.681 24.209 -34.830 1.00 40.91 ? 128 SER F O 1 ATOM 4079 C CB . SER C 3 150 ? -16.906 24.282 -37.578 1.00 43.01 ? 128 SER F CB 1 ATOM 4080 O OG . SER C 3 150 ? -17.665 23.432 -36.735 1.00 52.15 ? 128 SER F OG 1 ATOM 4081 N N . ALA C 3 151 ? -14.389 25.860 -35.686 1.00 37.35 ? 129 ALA F N 1 ATOM 4082 C CA . ALA C 3 151 ? -14.050 26.470 -34.404 1.00 36.10 ? 129 ALA F CA 1 ATOM 4083 C C . ALA C 3 151 ? -15.046 27.560 -34.015 1.00 38.84 ? 129 ALA F C 1 ATOM 4084 O O . ALA C 3 151 ? -15.433 28.373 -34.856 1.00 38.45 ? 129 ALA F O 1 ATOM 4085 C CB . ALA C 3 151 ? -12.639 27.035 -34.451 1.00 36.82 ? 129 ALA F CB 1 ATOM 4086 N N . SER C 3 152 ? -15.463 27.562 -32.739 1.00 34.60 ? 130 SER F N 1 ATOM 4087 C CA . SER C 3 152 ? -16.399 28.534 -32.167 1.00 33.87 ? 130 SER F CA 1 ATOM 4088 C C . SER C 3 152 ? -15.971 28.906 -30.746 1.00 37.16 ? 130 SER F C 1 ATOM 4089 O O . SER C 3 152 ? -15.429 28.060 -30.028 1.00 36.67 ? 130 SER F O 1 ATOM 4090 C CB . SER C 3 152 ? -17.822 27.987 -32.176 1.00 37.76 ? 130 SER F CB 1 ATOM 4091 O OG . SER C 3 152 ? -17.925 26.795 -31.415 1.00 47.24 ? 130 SER F OG 1 ATOM 4092 N N . ALA C 3 153 ? -16.205 30.170 -30.344 1.00 33.34 ? 131 ALA F N 1 ATOM 4093 C CA . ALA C 3 153 ? -15.806 30.668 -29.027 1.00 32.73 ? 131 ALA F CA 1 ATOM 4094 C C . ALA C 3 153 ? -16.864 31.502 -28.309 1.00 36.28 ? 131 ALA F C 1 ATOM 4095 O O . ALA C 3 153 ? -17.596 32.266 -28.940 1.00 36.00 ? 131 ALA F O 1 ATOM 4096 C CB . ALA C 3 153 ? -14.517 31.465 -29.146 1.00 33.30 ? 131 ALA F CB 1 ATOM 4097 N N . LYS C 3 154 ? -16.909 31.364 -26.974 1.00 32.70 ? 132 LYS F N 1 ATOM 4098 C CA . LYS C 3 154 ? -17.783 32.105 -26.066 1.00 32.62 ? 132 LYS F CA 1 ATOM 4099 C C . LYS C 3 154 ? -16.853 33.020 -25.258 1.00 36.40 ? 132 LYS F C 1 ATOM 4100 O O . LYS C 3 154 ? -15.981 32.526 -24.537 1.00 35.85 ? 132 LYS F O 1 ATOM 4101 C CB . LYS C 3 154 ? -18.553 31.131 -25.154 1.00 35.44 ? 132 LYS F CB 1 ATOM 4102 C CG . LYS C 3 154 ? -19.730 31.746 -24.405 1.00 49.96 ? 132 LYS F CG 1 ATOM 4103 C CD . LYS C 3 154 ? -20.406 30.705 -23.522 1.00 60.41 ? 132 LYS F CD 1 ATOM 4104 C CE . LYS C 3 154 ? -21.564 31.272 -22.738 1.00 72.17 ? 132 LYS F CE 1 ATOM 4105 N NZ . LYS C 3 154 ? -22.216 30.235 -21.896 1.00 82.04 ? 132 LYS F NZ 1 ATOM 4106 N N . LEU C 3 155 ? -16.996 34.348 -25.433 1.00 33.14 ? 133 LEU F N 1 ATOM 4107 C CA . LEU C 3 155 ? -16.134 35.340 -24.788 1.00 32.97 ? 133 LEU F CA 1 ATOM 4108 C C . LEU C 3 155 ? -16.893 36.330 -23.896 1.00 37.61 ? 133 LEU F C 1 ATOM 4109 O O . LEU C 3 155 ? -17.889 36.916 -24.325 1.00 37.56 ? 133 LEU F O 1 ATOM 4110 C CB . LEU C 3 155 ? -15.319 36.083 -25.870 1.00 32.75 ? 133 LEU F CB 1 ATOM 4111 C CG . LEU C 3 155 ? -14.227 37.063 -25.416 1.00 37.41 ? 133 LEU F CG 1 ATOM 4112 C CD1 . LEU C 3 155 ? -12.936 36.336 -25.066 1.00 37.54 ? 133 LEU F CD1 1 ATOM 4113 C CD2 . LEU C 3 155 ? -13.941 38.082 -26.502 1.00 39.72 ? 133 LEU F CD2 1 ATOM 4114 N N . ARG C 3 156 ? -16.399 36.518 -22.657 1.00 34.49 ? 134 ARG F N 1 ATOM 4115 C CA . ARG C 3 156 ? -16.947 37.463 -21.683 1.00 34.89 ? 134 ARG F CA 1 ATOM 4116 C C . ARG C 3 156 ? -16.150 38.764 -21.795 1.00 38.93 ? 134 ARG F C 1 ATOM 4117 O O . ARG C 3 156 ? -14.922 38.736 -21.706 1.00 38.28 ? 134 ARG F O 1 ATOM 4118 C CB . ARG C 3 156 ? -16.866 36.890 -20.252 1.00 35.50 ? 134 ARG F CB 1 ATOM 4119 C CG . ARG C 3 156 ? -17.380 37.846 -19.169 1.00 45.92 ? 134 ARG F CG 1 ATOM 4120 C CD . ARG C 3 156 ? -17.082 37.375 -17.753 1.00 56.30 ? 134 ARG F CD 1 ATOM 4121 N NE . ARG C 3 156 ? -15.647 37.319 -17.456 1.00 65.37 ? 134 ARG F NE 1 ATOM 4122 C CZ . ARG C 3 156 ? -14.924 38.337 -16.996 1.00 80.15 ? 134 ARG F CZ 1 ATOM 4123 N NH1 . ARG C 3 156 ? -15.487 39.521 -16.786 1.00 68.33 ? 134 ARG F NH1 1 ATOM 4124 N NH2 . ARG C 3 156 ? -13.630 38.182 -16.752 1.00 66.83 ? 134 ARG F NH2 1 ATOM 4125 N N . VAL C 3 157 ? -16.845 39.895 -22.018 1.00 36.09 ? 135 VAL F N 1 ATOM 4126 C CA . VAL C 3 157 ? -16.212 41.213 -22.155 1.00 36.08 ? 135 VAL F CA 1 ATOM 4127 C C . VAL C 3 157 ? -16.776 42.195 -21.120 1.00 41.15 ? 135 VAL F C 1 ATOM 4128 O O . VAL C 3 157 ? -17.992 42.385 -21.054 1.00 41.14 ? 135 VAL F O 1 ATOM 4129 C CB . VAL C 3 157 ? -16.298 41.796 -23.602 1.00 39.70 ? 135 VAL F CB 1 ATOM 4130 C CG1 . VAL C 3 157 ? -15.473 43.078 -23.740 1.00 39.54 ? 135 VAL F CG1 1 ATOM 4131 C CG2 . VAL C 3 157 ? -15.867 40.774 -24.651 1.00 38.91 ? 135 VAL F CG2 1 ATOM 4132 N N . LEU C 3 158 ? -15.889 42.824 -20.327 1.00 38.36 ? 136 LEU F N 1 ATOM 4133 C CA . LEU C 3 158 ? -16.278 43.842 -19.355 1.00 39.31 ? 136 LEU F CA 1 ATOM 4134 C C . LEU C 3 158 ? -16.353 45.150 -20.156 1.00 43.58 ? 136 LEU F C 1 ATOM 4135 O O . LEU C 3 158 ? -15.333 45.805 -20.394 1.00 42.85 ? 136 LEU F O 1 ATOM 4136 C CB . LEU C 3 158 ? -15.257 43.918 -18.208 1.00 39.67 ? 136 LEU F CB 1 ATOM 4137 C CG . LEU C 3 158 ? -15.775 44.468 -16.889 1.00 45.66 ? 136 LEU F CG 1 ATOM 4138 C CD1 . LEU C 3 158 ? -15.631 43.456 -15.773 1.00 46.27 ? 136 LEU F CD1 1 ATOM 4139 C CD2 . LEU C 3 158 ? -15.073 45.757 -16.533 1.00 48.55 ? 136 LEU F CD2 1 ATOM 4140 N N . TYR C 3 159 ? -17.561 45.457 -20.661 1.00 40.85 ? 137 TYR F N 1 ATOM 4141 C CA . TYR C 3 159 ? -17.839 46.607 -21.518 1.00 41.08 ? 137 TYR F CA 1 ATOM 4142 C C . TYR C 3 159 ? -18.803 47.587 -20.845 1.00 46.35 ? 137 TYR F C 1 ATOM 4143 O O . TYR C 3 159 ? -19.952 47.232 -20.567 1.00 46.61 ? 137 TYR F O 1 ATOM 4144 C CB . TYR C 3 159 ? -18.380 46.109 -22.874 1.00 41.91 ? 137 TYR F CB 1 ATOM 4145 C CG . TYR C 3 159 ? -18.591 47.183 -23.920 1.00 44.15 ? 137 TYR F CG 1 ATOM 4146 C CD1 . TYR C 3 159 ? -17.526 47.671 -24.672 1.00 45.56 ? 137 TYR F CD1 1 ATOM 4147 C CD2 . TYR C 3 159 ? -19.867 47.653 -24.215 1.00 46.00 ? 137 TYR F CD2 1 ATOM 4148 C CE1 . TYR C 3 159 ? -17.719 48.641 -25.656 1.00 46.84 ? 137 TYR F CE1 1 ATOM 4149 C CE2 . TYR C 3 159 ? -20.073 48.620 -25.199 1.00 47.40 ? 137 TYR F CE2 1 ATOM 4150 C CZ . TYR C 3 159 ? -18.995 49.112 -25.917 1.00 54.25 ? 137 TYR F CZ 1 ATOM 4151 O OH . TYR C 3 159 ? -19.195 50.063 -26.889 1.00 55.82 ? 137 TYR F OH 1 ATOM 4152 N N . GLN C 3 160 ? -18.316 48.823 -20.585 1.00 43.44 ? 138 GLN F N 1 ATOM 4153 C CA . GLN C 3 160 ? -19.040 49.933 -19.942 1.00 44.78 ? 138 GLN F CA 1 ATOM 4154 C C . GLN C 3 160 ? -19.562 49.583 -18.532 1.00 49.73 ? 138 GLN F C 1 ATOM 4155 O O . GLN C 3 160 ? -20.706 49.892 -18.183 1.00 50.53 ? 138 GLN F O 1 ATOM 4156 C CB . GLN C 3 160 ? -20.140 50.515 -20.859 1.00 46.85 ? 138 GLN F CB 1 ATOM 4157 C CG . GLN C 3 160 ? -19.613 51.123 -22.158 1.00 59.82 ? 138 GLN F CG 1 ATOM 4158 C CD . GLN C 3 160 ? -20.715 51.651 -23.046 1.00 78.44 ? 138 GLN F CD 1 ATOM 4159 O OE1 . GLN C 3 160 ? -21.651 50.935 -23.427 1.00 74.10 ? 138 GLN F OE1 1 ATOM 4160 N NE2 . GLN C 3 160 ? -20.602 52.911 -23.434 1.00 70.25 ? 138 GLN F NE2 1 ATOM 4161 N N . GLY C 3 161 ? -18.705 48.931 -17.746 1.00 45.92 ? 139 GLY F N 1 ATOM 4162 C CA . GLY C 3 161 ? -19.003 48.508 -16.381 1.00 46.67 ? 139 GLY F CA 1 ATOM 4163 C C . GLY C 3 161 ? -19.939 47.319 -16.262 1.00 50.67 ? 139 GLY F C 1 ATOM 4164 O O . GLY C 3 161 ? -20.351 46.972 -15.151 1.00 51.19 ? 139 GLY F O 1 ATOM 4165 N N . ASN C 3 162 ? -20.275 46.680 -17.401 1.00 46.34 ? 140 ASN F N 1 ATOM 4166 C CA . ASN C 3 162 ? -21.170 45.523 -17.471 1.00 46.06 ? 140 ASN F CA 1 ATOM 4167 C C . ASN C 3 162 ? -20.533 44.368 -18.240 1.00 48.24 ? 140 ASN F C 1 ATOM 4168 O O . ASN C 3 162 ? -19.780 44.601 -19.187 1.00 46.91 ? 140 ASN F O 1 ATOM 4169 C CB . ASN C 3 162 ? -22.500 45.911 -18.121 1.00 47.88 ? 140 ASN F CB 1 ATOM 4170 C CG . ASN C 3 162 ? -23.303 46.902 -17.320 1.00 73.41 ? 140 ASN F CG 1 ATOM 4171 O OD1 . ASN C 3 162 ? -24.032 46.541 -16.390 1.00 69.01 ? 140 ASN F OD1 1 ATOM 4172 N ND2 . ASN C 3 162 ? -23.192 48.175 -17.670 1.00 66.02 ? 140 ASN F ND2 1 ATOM 4173 N N . ASN C 3 163 ? -20.846 43.125 -17.838 1.00 44.51 ? 141 ASN F N 1 ATOM 4174 C CA . ASN C 3 163 ? -20.328 41.924 -18.489 1.00 43.04 ? 141 ASN F CA 1 ATOM 4175 C C . ASN C 3 163 ? -21.220 41.497 -19.651 1.00 46.87 ? 141 ASN F C 1 ATOM 4176 O O . ASN C 3 163 ? -22.406 41.219 -19.453 1.00 47.23 ? 141 ASN F O 1 ATOM 4177 C CB . ASN C 3 163 ? -20.152 40.781 -17.485 1.00 43.43 ? 141 ASN F CB 1 ATOM 4178 C CG . ASN C 3 163 ? -18.880 40.837 -16.675 1.00 65.67 ? 141 ASN F CG 1 ATOM 4179 O OD1 . ASN C 3 163 ? -17.782 41.093 -17.189 1.00 59.45 ? 141 ASN F OD1 1 ATOM 4180 N ND2 . ASN C 3 163 ? -19.009 40.565 -15.385 1.00 58.40 ? 141 ASN F ND2 1 ATOM 4181 N N . ILE C 3 164 ? -20.647 41.465 -20.865 1.00 42.60 ? 142 ILE F N 1 ATOM 4182 C CA . ILE C 3 164 ? -21.352 41.055 -22.083 1.00 42.25 ? 142 ILE F CA 1 ATOM 4183 C C . ILE C 3 164 ? -20.786 39.738 -22.621 1.00 45.36 ? 142 ILE F C 1 ATOM 4184 O O . ILE C 3 164 ? -19.575 39.517 -22.551 1.00 44.26 ? 142 ILE F O 1 ATOM 4185 C CB . ILE C 3 164 ? -21.455 42.179 -23.163 1.00 45.50 ? 142 ILE F CB 1 ATOM 4186 C CG1 . ILE C 3 164 ? -20.067 42.652 -23.671 1.00 45.07 ? 142 ILE F CG1 1 ATOM 4187 C CG2 . ILE C 3 164 ? -22.307 43.355 -22.659 1.00 47.55 ? 142 ILE F CG2 1 ATOM 4188 C CD1 . ILE C 3 164 ? -20.046 43.248 -25.089 1.00 51.76 ? 142 ILE F CD1 1 ATOM 4189 N N . THR C 3 165 ? -21.665 38.853 -23.120 1.00 42.26 ? 143 THR F N 1 ATOM 4190 C CA . THR C 3 165 ? -21.268 37.550 -23.660 1.00 41.46 ? 143 THR F CA 1 ATOM 4191 C C . THR C 3 165 ? -21.380 37.542 -25.184 1.00 45.08 ? 143 THR F C 1 ATOM 4192 O O . THR C 3 165 ? -22.435 37.872 -25.732 1.00 45.26 ? 143 THR F O 1 ATOM 4193 C CB . THR C 3 165 ? -22.029 36.409 -22.959 1.00 50.43 ? 143 THR F CB 1 ATOM 4194 O OG1 . THR C 3 165 ? -21.854 36.536 -21.547 1.00 50.82 ? 143 THR F OG1 1 ATOM 4195 C CG2 . THR C 3 165 ? -21.563 35.023 -23.404 1.00 48.75 ? 143 THR F CG2 1 ATOM 4196 N N . VAL C 3 166 ? -20.276 37.180 -25.861 1.00 40.92 ? 144 VAL F N 1 ATOM 4197 C CA . VAL C 3 166 ? -20.198 37.118 -27.321 1.00 40.60 ? 144 VAL F CA 1 ATOM 4198 C C . VAL C 3 166 ? -19.889 35.679 -27.760 1.00 44.15 ? 144 VAL F C 1 ATOM 4199 O O . VAL C 3 166 ? -18.860 35.121 -27.372 1.00 43.25 ? 144 VAL F O 1 ATOM 4200 C CB . VAL C 3 166 ? -19.194 38.156 -27.912 1.00 44.20 ? 144 VAL F CB 1 ATOM 4201 C CG1 . VAL C 3 166 ? -19.121 38.057 -29.434 1.00 44.04 ? 144 VAL F CG1 1 ATOM 4202 C CG2 . VAL C 3 166 ? -19.546 39.582 -27.487 1.00 44.50 ? 144 VAL F CG2 1 ATOM 4203 N N . THR C 3 167 ? -20.797 35.084 -28.552 1.00 41.10 ? 145 THR F N 1 ATOM 4204 C CA . THR C 3 167 ? -20.648 33.733 -29.094 1.00 40.80 ? 145 THR F CA 1 ATOM 4205 C C . THR C 3 167 ? -20.470 33.857 -30.608 1.00 44.80 ? 145 THR F C 1 ATOM 4206 O O . THR C 3 167 ? -21.384 34.310 -31.303 1.00 45.00 ? 145 THR F O 1 ATOM 4207 C CB . THR C 3 167 ? -21.812 32.825 -28.651 1.00 49.47 ? 145 THR F CB 1 ATOM 4208 O OG1 . THR C 3 167 ? -21.919 32.864 -27.226 1.00 49.12 ? 145 THR F OG1 1 ATOM 4209 C CG2 . THR C 3 167 ? -21.637 31.378 -29.105 1.00 48.02 ? 145 THR F CG2 1 ATOM 4210 N N . ALA C 3 168 ? -19.273 33.498 -31.105 1.00 40.97 ? 146 ALA F N 1 ATOM 4211 C CA . ALA C 3 168 ? -18.930 33.599 -32.525 1.00 41.00 ? 146 ALA F CA 1 ATOM 4212 C C . ALA C 3 168 ? -17.987 32.491 -32.996 1.00 44.57 ? 146 ALA F C 1 ATOM 4213 O O . ALA C 3 168 ? -17.235 31.931 -32.195 1.00 43.75 ? 146 ALA F O 1 ATOM 4214 C CB . ALA C 3 168 ? -18.301 34.959 -32.804 1.00 41.60 ? 146 ALA F CB 1 ATOM 4215 N N . TYR C 3 169 ? -18.011 32.202 -34.312 1.00 41.52 ? 147 TYR F N 1 ATOM 4216 C CA . TYR C 3 169 ? -17.118 31.232 -34.941 1.00 41.54 ? 147 TYR F CA 1 ATOM 4217 C C . TYR C 3 169 ? -15.731 31.866 -35.043 1.00 45.03 ? 147 TYR F C 1 ATOM 4218 O O . TYR C 3 169 ? -15.609 32.997 -35.522 1.00 44.62 ? 147 TYR F O 1 ATOM 4219 C CB . TYR C 3 169 ? -17.629 30.830 -36.336 1.00 43.62 ? 147 TYR F CB 1 ATOM 4220 C CG . TYR C 3 169 ? -18.782 29.851 -36.315 1.00 45.78 ? 147 TYR F CG 1 ATOM 4221 C CD1 . TYR C 3 169 ? -18.562 28.487 -36.139 1.00 47.94 ? 147 TYR F CD1 1 ATOM 4222 C CD2 . TYR C 3 169 ? -20.090 30.280 -36.514 1.00 46.88 ? 147 TYR F CD2 1 ATOM 4223 C CE1 . TYR C 3 169 ? -19.619 27.578 -36.129 1.00 49.16 ? 147 TYR F CE1 1 ATOM 4224 C CE2 . TYR C 3 169 ? -21.156 29.381 -36.509 1.00 48.26 ? 147 TYR F CE2 1 ATOM 4225 C CZ . TYR C 3 169 ? -20.915 28.030 -36.317 1.00 55.73 ? 147 TYR F CZ 1 ATOM 4226 O OH . TYR C 3 169 ? -21.962 27.140 -36.314 1.00 57.19 ? 147 TYR F OH 1 ATOM 4227 N N . ALA C 3 170 ? -14.695 31.153 -34.567 1.00 41.43 ? 148 ALA F N 1 ATOM 4228 C CA . ALA C 3 170 ? -13.306 31.623 -34.561 1.00 41.09 ? 148 ALA F CA 1 ATOM 4229 C C . ALA C 3 170 ? -12.604 31.444 -35.927 1.00 45.71 ? 148 ALA F C 1 ATOM 4230 O O . ALA C 3 170 ? -11.498 30.897 -36.004 1.00 45.69 ? 148 ALA F O 1 ATOM 4231 C CB . ALA C 3 170 ? -12.528 30.940 -33.442 1.00 41.62 ? 148 ALA F CB 1 ATOM 4232 N N . ASN C 3 171 ? -13.253 31.936 -37.001 1.00 42.62 ? 149 ASN F N 1 ATOM 4233 C CA . ASN C 3 171 ? -12.762 31.867 -38.381 1.00 43.34 ? 149 ASN F CA 1 ATOM 4234 C C . ASN C 3 171 ? -12.288 33.220 -38.933 1.00 47.44 ? 149 ASN F C 1 ATOM 4235 O O . ASN C 3 171 ? -11.615 33.261 -39.966 1.00 47.80 ? 149 ASN F O 1 ATOM 4236 C CB . ASN C 3 171 ? -13.823 31.240 -39.307 1.00 44.74 ? 149 ASN F CB 1 ATOM 4237 C CG . ASN C 3 171 ? -15.181 31.921 -39.341 1.00 66.68 ? 149 ASN F CG 1 ATOM 4238 O OD1 . ASN C 3 171 ? -15.387 33.038 -38.847 1.00 60.45 ? 149 ASN F OD1 1 ATOM 4239 N ND2 . ASN C 3 171 ? -16.148 31.255 -39.951 1.00 58.90 ? 149 ASN F ND2 1 ATOM 4240 N N . GLY C 3 172 ? -12.658 34.302 -38.248 1.00 43.37 ? 150 GLY F N 1 ATOM 4241 C CA . GLY C 3 172 ? -12.315 35.664 -38.641 1.00 43.19 ? 150 GLY F CA 1 ATOM 4242 C C . GLY C 3 172 ? -13.248 36.248 -39.684 1.00 47.80 ? 150 GLY F C 1 ATOM 4243 O O . GLY C 3 172 ? -12.957 37.308 -40.245 1.00 47.52 ? 150 GLY F O 1 ATOM 4244 N N . ASP C 3 173 ? -14.376 35.556 -39.954 1.00 45.00 ? 151 ASP F N 1 ATOM 4245 C CA . ASP C 3 173 ? -15.395 35.969 -40.923 1.00 45.73 ? 151 ASP F CA 1 ATOM 4246 C C . ASP C 3 173 ? -16.818 35.729 -40.375 1.00 49.39 ? 151 ASP F C 1 ATOM 4247 O O . ASP C 3 173 ? -17.690 35.195 -41.070 1.00 49.88 ? 151 ASP F O 1 ATOM 4248 C CB . ASP C 3 173 ? -15.165 35.288 -42.290 1.00 48.77 ? 151 ASP F CB 1 ATOM 4249 C CG . ASP C 3 173 ? -15.913 35.941 -43.441 1.00 60.30 ? 151 ASP F CG 1 ATOM 4250 O OD1 . ASP C 3 173 ? -15.701 37.151 -43.678 1.00 60.93 ? 151 ASP F OD1 1 ATOM 4251 O OD2 . ASP C 3 173 ? -16.710 35.242 -44.105 1.00 67.19 ? 151 ASP F OD2 1 ATOM 4252 N N . HIS C 3 174 ? -17.040 36.131 -39.110 1.00 44.81 ? 152 HIS F N 1 ATOM 4253 C CA . HIS C 3 174 ? -18.324 36.011 -38.420 1.00 44.45 ? 152 HIS F CA 1 ATOM 4254 C C . HIS C 3 174 ? -18.472 37.160 -37.426 1.00 47.54 ? 152 HIS F C 1 ATOM 4255 O O . HIS C 3 174 ? -17.948 37.094 -36.309 1.00 46.31 ? 152 HIS F O 1 ATOM 4256 C CB . HIS C 3 174 ? -18.464 34.637 -37.740 1.00 44.85 ? 152 HIS F CB 1 ATOM 4257 C CG . HIS C 3 174 ? -19.841 34.359 -37.226 1.00 48.39 ? 152 HIS F CG 1 ATOM 4258 N ND1 . HIS C 3 174 ? -20.191 34.628 -35.918 1.00 49.54 ? 152 HIS F ND1 1 ATOM 4259 C CD2 . HIS C 3 174 ? -20.911 33.835 -37.866 1.00 50.94 ? 152 HIS F CD2 1 ATOM 4260 C CE1 . HIS C 3 174 ? -21.458 34.264 -35.805 1.00 49.43 ? 152 HIS F CE1 1 ATOM 4261 N NE2 . HIS C 3 174 ? -21.934 33.785 -36.951 1.00 50.61 ? 152 HIS F NE2 1 ATOM 4262 N N . ALA C 3 175 ? -19.150 38.236 -37.861 1.00 44.46 ? 153 ALA F N 1 ATOM 4263 C CA . ALA C 3 175 ? -19.364 39.438 -37.060 1.00 43.96 ? 153 ALA F CA 1 ATOM 4264 C C . ALA C 3 175 ? -20.586 39.303 -36.156 1.00 47.74 ? 153 ALA F C 1 ATOM 4265 O O . ALA C 3 175 ? -21.677 38.972 -36.628 1.00 48.12 ? 153 ALA F O 1 ATOM 4266 C CB . ALA C 3 175 ? -19.494 40.658 -37.960 1.00 45.45 ? 153 ALA F CB 1 ATOM 4267 N N . VAL C 3 176 ? -20.382 39.520 -34.846 1.00 43.45 ? 154 VAL F N 1 ATOM 4268 C CA . VAL C 3 176 ? -21.430 39.467 -33.823 1.00 43.40 ? 154 VAL F CA 1 ATOM 4269 C C . VAL C 3 176 ? -21.451 40.829 -33.121 1.00 47.07 ? 154 VAL F C 1 ATOM 4270 O O . VAL C 3 176 ? -20.429 41.262 -32.582 1.00 46.04 ? 154 VAL F O 1 ATOM 4271 C CB . VAL C 3 176 ? -21.261 38.267 -32.840 1.00 46.72 ? 154 VAL F CB 1 ATOM 4272 C CG1 . VAL C 3 176 ? -22.259 38.339 -31.685 1.00 46.87 ? 154 VAL F CG1 1 ATOM 4273 C CG2 . VAL C 3 176 ? -21.402 36.937 -33.569 1.00 46.63 ? 154 VAL F CG2 1 ATOM 4274 N N . THR C 3 177 ? -22.606 41.514 -33.167 1.00 44.33 ? 155 THR F N 1 ATOM 4275 C CA . THR C 3 177 ? -22.776 42.841 -32.575 1.00 44.47 ? 155 THR F CA 1 ATOM 4276 C C . THR C 3 177 ? -23.576 42.793 -31.269 1.00 48.21 ? 155 THR F C 1 ATOM 4277 O O . THR C 3 177 ? -24.736 42.375 -31.262 1.00 48.60 ? 155 THR F O 1 ATOM 4278 C CB . THR C 3 177 ? -23.323 43.835 -33.619 1.00 54.10 ? 155 THR F CB 1 ATOM 4279 O OG1 . THR C 3 177 ? -22.546 43.733 -34.814 1.00 53.86 ? 155 THR F OG1 1 ATOM 4280 C CG2 . THR C 3 177 ? -23.308 45.278 -33.126 1.00 53.35 ? 155 THR F CG2 1 ATOM 4281 N N . VAL C 3 178 ? -22.930 43.208 -30.163 1.00 43.85 ? 156 VAL F N 1 ATOM 4282 C CA . VAL C 3 178 ? -23.508 43.275 -28.815 1.00 43.87 ? 156 VAL F CA 1 ATOM 4283 C C . VAL C 3 178 ? -23.261 44.698 -28.291 1.00 47.83 ? 156 VAL F C 1 ATOM 4284 O O . VAL C 3 178 ? -22.107 45.135 -28.241 1.00 46.54 ? 156 VAL F O 1 ATOM 4285 C CB . VAL C 3 178 ? -22.947 42.179 -27.855 1.00 46.80 ? 156 VAL F CB 1 ATOM 4286 C CG1 . VAL C 3 178 ? -23.532 42.315 -26.450 1.00 47.18 ? 156 VAL F CG1 1 ATOM 4287 C CG2 . VAL C 3 178 ? -23.198 40.772 -28.397 1.00 46.24 ? 156 VAL F CG2 1 ATOM 4288 N N . LYS C 3 179 ? -24.349 45.419 -27.927 1.00 45.62 ? 157 LYS F N 1 ATOM 4289 C CA . LYS C 3 179 ? -24.338 46.808 -27.436 1.00 46.20 ? 157 LYS F CA 1 ATOM 4290 C C . LYS C 3 179 ? -23.627 47.769 -28.415 1.00 49.68 ? 157 LYS F C 1 ATOM 4291 O O . LYS C 3 179 ? -22.834 48.620 -28.001 1.00 49.03 ? 157 LYS F O 1 ATOM 4292 C CB . LYS C 3 179 ? -23.785 46.903 -25.994 1.00 48.45 ? 157 LYS F CB 1 ATOM 4293 C CG . LYS C 3 179 ? -24.846 47.198 -24.937 1.00 64.18 ? 157 LYS F CG 1 ATOM 4294 C CD . LYS C 3 179 ? -25.420 45.930 -24.312 1.00 74.05 ? 157 LYS F CD 1 ATOM 4295 C CE . LYS C 3 179 ? -26.451 46.239 -23.254 1.00 86.16 ? 157 LYS F CE 1 ATOM 4296 N NZ . LYS C 3 179 ? -27.011 45.000 -22.656 1.00 95.00 ? 157 LYS F NZ 1 ATOM 4297 N N . ASP C 3 180 ? -23.920 47.600 -29.727 1.00 46.30 ? 158 ASP F N 1 ATOM 4298 C CA . ASP C 3 180 ? -23.382 48.354 -30.871 1.00 46.09 ? 158 ASP F CA 1 ATOM 4299 C C . ASP C 3 180 ? -21.892 48.106 -31.197 1.00 48.13 ? 158 ASP F C 1 ATOM 4300 O O . ASP C 3 180 ? -21.376 48.677 -32.162 1.00 47.80 ? 158 ASP F O 1 ATOM 4301 C CB . ASP C 3 180 ? -23.747 49.855 -30.817 1.00 49.30 ? 158 ASP F CB 1 ATOM 4302 C CG . ASP C 3 180 ? -24.045 50.473 -32.170 1.00 60.51 ? 158 ASP F CG 1 ATOM 4303 O OD1 . ASP C 3 180 ? -23.400 51.488 -32.513 1.00 61.23 ? 158 ASP F OD1 1 ATOM 4304 O OD2 . ASP C 3 180 ? -24.935 49.952 -32.880 1.00 67.16 ? 158 ASP F OD2 1 ATOM 4305 N N . ALA C 3 181 ? -21.220 47.226 -30.427 1.00 43.15 ? 159 ALA F N 1 ATOM 4306 C CA . ALA C 3 181 ? -19.817 46.871 -30.640 1.00 41.57 ? 159 ALA F CA 1 ATOM 4307 C C . ALA C 3 181 ? -19.731 45.596 -31.482 1.00 44.38 ? 159 ALA F C 1 ATOM 4308 O O . ALA C 3 181 ? -20.250 44.553 -31.077 1.00 43.73 ? 159 ALA F O 1 ATOM 4309 C CB . ALA C 3 181 ? -19.108 46.682 -29.305 1.00 41.65 ? 159 ALA F CB 1 ATOM 4310 N N . LYS C 3 182 ? -19.110 45.696 -32.671 1.00 40.45 ? 160 LYS F N 1 ATOM 4311 C CA . LYS C 3 182 ? -18.954 44.580 -33.605 1.00 39.81 ? 160 LYS F CA 1 ATOM 4312 C C . LYS C 3 182 ? -17.728 43.744 -33.243 1.00 42.32 ? 160 LYS F C 1 ATOM 4313 O O . LYS C 3 182 ? -16.621 44.279 -33.153 1.00 41.35 ? 160 LYS F O 1 ATOM 4314 C CB . LYS C 3 182 ? -18.872 45.095 -35.053 1.00 42.91 ? 160 LYS F CB 1 ATOM 4315 C CG . LYS C 3 182 ? -19.009 44.005 -36.117 1.00 57.26 ? 160 LYS F CG 1 ATOM 4316 C CD . LYS C 3 182 ? -18.925 44.570 -37.534 1.00 68.15 ? 160 LYS F CD 1 ATOM 4317 C CE . LYS C 3 182 ? -17.523 44.618 -38.095 1.00 78.52 ? 160 LYS F CE 1 ATOM 4318 N NZ . LYS C 3 182 ? -17.489 45.250 -39.440 1.00 88.75 ? 160 LYS F NZ 1 ATOM 4319 N N . PHE C 3 183 ? -17.935 42.429 -33.040 1.00 38.51 ? 161 PHE F N 1 ATOM 4320 C CA . PHE C 3 183 ? -16.882 41.485 -32.665 1.00 37.46 ? 161 PHE F CA 1 ATOM 4321 C C . PHE C 3 183 ? -16.562 40.490 -33.773 1.00 41.18 ? 161 PHE F C 1 ATOM 4322 O O . PHE C 3 183 ? -17.466 39.851 -34.312 1.00 41.10 ? 161 PHE F O 1 ATOM 4323 C CB . PHE C 3 183 ? -17.269 40.720 -31.388 1.00 38.98 ? 161 PHE F CB 1 ATOM 4324 C CG . PHE C 3 183 ? -17.252 41.520 -30.109 1.00 40.53 ? 161 PHE F CG 1 ATOM 4325 C CD1 . PHE C 3 183 ? -16.157 41.474 -29.256 1.00 43.17 ? 161 PHE F CD1 1 ATOM 4326 C CD2 . PHE C 3 183 ? -18.349 42.286 -29.734 1.00 43.36 ? 161 PHE F CD2 1 ATOM 4327 C CE1 . PHE C 3 183 ? -16.151 42.198 -28.060 1.00 44.23 ? 161 PHE F CE1 1 ATOM 4328 C CE2 . PHE C 3 183 ? -18.338 43.018 -28.544 1.00 46.36 ? 161 PHE F CE2 1 ATOM 4329 C CZ . PHE C 3 183 ? -17.239 42.969 -27.715 1.00 43.95 ? 161 PHE F CZ 1 ATOM 4330 N N . ILE C 3 184 ? -15.267 40.355 -34.096 1.00 37.51 ? 162 ILE F N 1 ATOM 4331 C CA . ILE C 3 184 ? -14.745 39.406 -35.081 1.00 37.58 ? 162 ILE F CA 1 ATOM 4332 C C . ILE C 3 184 ? -13.681 38.572 -34.359 1.00 41.15 ? 162 ILE F C 1 ATOM 4333 O O . ILE C 3 184 ? -12.639 39.099 -33.965 1.00 40.44 ? 162 ILE F O 1 ATOM 4334 C CB . ILE C 3 184 ? -14.239 40.087 -36.391 1.00 41.20 ? 162 ILE F CB 1 ATOM 4335 C CG1 . ILE C 3 184 ? -15.406 40.757 -37.160 1.00 42.33 ? 162 ILE F CG1 1 ATOM 4336 C CG2 . ILE C 3 184 ? -13.496 39.079 -37.292 1.00 42.26 ? 162 ILE F CG2 1 ATOM 4337 C CD1 . ILE C 3 184 ? -15.002 41.882 -38.116 1.00 50.48 ? 162 ILE F CD1 1 ATOM 4338 N N . VAL C 3 185 ? -13.985 37.284 -34.144 1.00 37.92 ? 163 VAL F N 1 ATOM 4339 C CA . VAL C 3 185 ? -13.135 36.328 -33.430 1.00 37.57 ? 163 VAL F CA 1 ATOM 4340 C C . VAL C 3 185 ? -12.370 35.431 -34.420 1.00 42.11 ? 163 VAL F C 1 ATOM 4341 O O . VAL C 3 185 ? -12.962 34.919 -35.373 1.00 42.24 ? 163 VAL F O 1 ATOM 4342 C CB . VAL C 3 185 ? -13.986 35.523 -32.400 1.00 41.32 ? 163 VAL F CB 1 ATOM 4343 C CG1 . VAL C 3 185 ? -13.219 34.344 -31.810 1.00 41.10 ? 163 VAL F CG1 1 ATOM 4344 C CG2 . VAL C 3 185 ? -14.505 36.430 -31.287 1.00 40.88 ? 163 VAL F CG2 1 ATOM 4345 N N . GLY C 3 186 ? -11.068 35.268 -34.182 1.00 38.67 ? 164 GLY F N 1 ATOM 4346 C CA . GLY C 3 186 ? -10.191 34.435 -34.997 1.00 39.10 ? 164 GLY F CA 1 ATOM 4347 C C . GLY C 3 186 ? -9.583 35.128 -36.205 1.00 43.46 ? 164 GLY F C 1 ATOM 4348 O O . GLY C 3 186 ? -9.620 36.360 -36.284 1.00 42.78 ? 164 GLY F O 1 ATOM 4349 N N . PRO C 3 187 ? -8.996 34.379 -37.176 1.00 40.82 ? 165 PRO F N 1 ATOM 4350 C CA . PRO C 3 187 ? -8.863 32.908 -37.246 1.00 41.14 ? 165 PRO F CA 1 ATOM 4351 C C . PRO C 3 187 ? -7.835 32.328 -36.275 1.00 44.93 ? 165 PRO F C 1 ATOM 4352 O O . PRO C 3 187 ? -6.845 32.990 -35.961 1.00 44.50 ? 165 PRO F O 1 ATOM 4353 C CB . PRO C 3 187 ? -8.480 32.668 -38.712 1.00 43.96 ? 165 PRO F CB 1 ATOM 4354 C CG . PRO C 3 187 ? -7.724 33.899 -39.102 1.00 48.41 ? 165 PRO F CG 1 ATOM 4355 C CD . PRO C 3 187 ? -8.398 35.029 -38.362 1.00 42.96 ? 165 PRO F CD 1 ATOM 4356 N N . MET C 3 188 ? -8.081 31.087 -35.808 1.00 41.43 ? 166 MET F N 1 ATOM 4357 C CA . MET C 3 188 ? -7.231 30.344 -34.865 1.00 41.32 ? 166 MET F CA 1 ATOM 4358 C C . MET C 3 188 ? -5.813 30.167 -35.403 1.00 45.49 ? 166 MET F C 1 ATOM 4359 O O . MET C 3 188 ? -5.643 29.808 -36.571 1.00 46.02 ? 166 MET F O 1 ATOM 4360 C CB . MET C 3 188 ? -7.839 28.962 -34.555 1.00 44.03 ? 166 MET F CB 1 ATOM 4361 C CG . MET C 3 188 ? -9.237 29.019 -33.966 1.00 47.01 ? 166 MET F CG 1 ATOM 4362 S SD . MET C 3 188 ? -9.266 29.424 -32.205 1.00 50.52 ? 166 MET F SD 1 ATOM 4363 C CE . MET C 3 188 ? -9.010 27.813 -31.503 1.00 47.87 ? 166 MET F CE 1 ATOM 4364 N N . SER C 3 189 ? -4.801 30.431 -34.555 1.00 41.40 ? 167 SER F N 1 ATOM 4365 C CA . SER C 3 189 ? -3.386 30.300 -34.912 1.00 41.95 ? 167 SER F CA 1 ATOM 4366 C C . SER C 3 189 ? -3.012 28.836 -35.149 1.00 46.19 ? 167 SER F C 1 ATOM 4367 O O . SER C 3 189 ? -2.191 28.547 -36.022 1.00 47.02 ? 167 SER F O 1 ATOM 4368 C CB . SER C 3 189 ? -2.504 30.901 -33.824 1.00 45.38 ? 167 SER F CB 1 ATOM 4369 O OG . SER C 3 189 ? -1.137 30.913 -34.196 1.00 55.97 ? 167 SER F OG 1 ATOM 4370 N N . SER C 3 190 ? -3.629 27.919 -34.380 1.00 41.85 ? 168 SER F N 1 ATOM 4371 C CA . SER C 3 190 ? -3.407 26.480 -34.483 1.00 42.47 ? 168 SER F CA 1 ATOM 4372 C C . SER C 3 190 ? -4.649 25.784 -35.035 1.00 45.39 ? 168 SER F C 1 ATOM 4373 O O . SER C 3 190 ? -5.762 26.022 -34.557 1.00 44.01 ? 168 SER F O 1 ATOM 4374 C CB . SER C 3 190 ? -3.025 25.896 -33.126 1.00 45.93 ? 168 SER F CB 1 ATOM 4375 O OG . SER C 3 190 ? -2.624 24.541 -33.238 1.00 55.44 ? 168 SER F OG 1 ATOM 4376 N N . ALA C 3 191 ? -4.447 24.932 -36.054 1.00 42.36 ? 169 ALA F N 1 ATOM 4377 C CA . ALA C 3 191 ? -5.494 24.141 -36.704 1.00 41.98 ? 169 ALA F CA 1 ATOM 4378 C C . ALA C 3 191 ? -5.521 22.705 -36.136 1.00 45.42 ? 169 ALA F C 1 ATOM 4379 O O . ALA C 3 191 ? -6.170 21.821 -36.704 1.00 45.64 ? 169 ALA F O 1 ATOM 4380 C CB . ALA C 3 191 ? -5.264 24.118 -38.211 1.00 43.85 ? 169 ALA F CB 1 ATOM 4381 N N . TRP C 3 192 ? -4.826 22.493 -34.997 1.00 40.92 ? 170 TRP F N 1 ATOM 4382 C CA . TRP C 3 192 ? -4.710 21.215 -34.294 1.00 41.00 ? 170 TRP F CA 1 ATOM 4383 C C . TRP C 3 192 ? -6.049 20.732 -33.733 1.00 42.90 ? 170 TRP F C 1 ATOM 4384 O O . TRP C 3 192 ? -6.832 21.529 -33.210 1.00 40.93 ? 170 TRP F O 1 ATOM 4385 C CB . TRP C 3 192 ? -3.656 21.311 -33.174 1.00 39.97 ? 170 TRP F CB 1 ATOM 4386 C CG . TRP C 3 192 ? -3.400 20.017 -32.456 1.00 42.00 ? 170 TRP F CG 1 ATOM 4387 C CD1 . TRP C 3 192 ? -2.498 19.054 -32.799 1.00 46.82 ? 170 TRP F CD1 1 ATOM 4388 C CD2 . TRP C 3 192 ? -4.079 19.535 -31.288 1.00 41.25 ? 170 TRP F CD2 1 ATOM 4389 N NE1 . TRP C 3 192 ? -2.569 18.002 -31.915 1.00 46.92 ? 170 TRP F NE1 1 ATOM 4390 C CE2 . TRP C 3 192 ? -3.534 18.269 -30.979 1.00 46.79 ? 170 TRP F CE2 1 ATOM 4391 C CE3 . TRP C 3 192 ? -5.102 20.049 -30.472 1.00 40.90 ? 170 TRP F CE3 1 ATOM 4392 C CZ2 . TRP C 3 192 ? -3.974 17.512 -29.886 1.00 46.09 ? 170 TRP F CZ2 1 ATOM 4393 C CZ3 . TRP C 3 192 ? -5.538 19.297 -29.394 1.00 42.39 ? 170 TRP F CZ3 1 ATOM 4394 C CH2 . TRP C 3 192 ? -4.974 18.047 -29.105 1.00 44.58 ? 170 TRP F CH2 1 ATOM 4395 N N . THR C 3 193 ? -6.288 19.412 -33.832 1.00 39.77 ? 171 THR F N 1 ATOM 4396 C CA . THR C 3 193 ? -7.481 18.719 -33.332 1.00 38.72 ? 171 THR F CA 1 ATOM 4397 C C . THR C 3 193 ? -7.076 17.394 -32.661 1.00 42.81 ? 171 THR F C 1 ATOM 4398 O O . THR C 3 193 ? -6.202 16.699 -33.189 1.00 43.92 ? 171 THR F O 1 ATOM 4399 C CB . THR C 3 193 ? -8.496 18.455 -34.460 1.00 47.21 ? 171 THR F CB 1 ATOM 4400 O OG1 . THR C 3 193 ? -7.843 17.811 -35.557 1.00 49.08 ? 171 THR F OG1 1 ATOM 4401 C CG2 . THR C 3 193 ? -9.218 19.710 -34.918 1.00 44.48 ? 171 THR F CG2 1 ATOM 4402 N N . PRO C 3 194 ? -7.700 17.001 -31.520 1.00 38.56 ? 172 PRO F N 1 ATOM 4403 C CA . PRO C 3 194 ? -7.332 15.717 -30.890 1.00 37.11 ? 172 PRO F CA 1 ATOM 4404 C C . PRO C 3 194 ? -7.875 14.488 -31.629 1.00 38.95 ? 172 PRO F C 1 ATOM 4405 O O . PRO C 3 194 ? -7.466 13.363 -31.334 1.00 37.95 ? 172 PRO F O 1 ATOM 4406 C CB . PRO C 3 194 ? -7.918 15.836 -29.481 1.00 38.18 ? 172 PRO F CB 1 ATOM 4407 C CG . PRO C 3 194 ? -9.074 16.747 -29.631 1.00 42.32 ? 172 PRO F CG 1 ATOM 4408 C CD . PRO C 3 194 ? -8.761 17.693 -30.756 1.00 39.49 ? 172 PRO F CD 1 ATOM 4409 N N . PHE C 3 195 ? -8.796 14.709 -32.587 1.00 34.81 ? 173 PHE F N 1 ATOM 4410 C CA . PHE C 3 195 ? -9.435 13.666 -33.386 1.00 33.19 ? 173 PHE F CA 1 ATOM 4411 C C . PHE C 3 195 ? -8.642 13.334 -34.647 1.00 38.31 ? 173 PHE F C 1 ATOM 4412 O O . PHE C 3 195 ? -8.150 14.239 -35.327 1.00 39.76 ? 173 PHE F O 1 ATOM 4413 C CB . PHE C 3 195 ? -10.867 14.084 -33.779 1.00 34.32 ? 173 PHE F CB 1 ATOM 4414 C CG . PHE C 3 195 ? -11.766 14.547 -32.655 1.00 35.28 ? 173 PHE F CG 1 ATOM 4415 C CD1 . PHE C 3 195 ? -12.283 13.641 -31.737 1.00 36.81 ? 173 PHE F CD1 1 ATOM 4416 C CD2 . PHE C 3 195 ? -12.140 15.882 -32.547 1.00 38.73 ? 173 PHE F CD2 1 ATOM 4417 C CE1 . PHE C 3 195 ? -13.127 14.068 -30.707 1.00 37.55 ? 173 PHE F CE1 1 ATOM 4418 C CE2 . PHE C 3 195 ? -12.987 16.308 -31.519 1.00 41.37 ? 173 PHE F CE2 1 ATOM 4419 C CZ . PHE C 3 195 ? -13.475 15.398 -30.606 1.00 37.97 ? 173 PHE F CZ 1 ATOM 4420 N N . ASP C 3 196 ? -8.547 12.031 -34.969 1.00 34.05 ? 174 ASP F N 1 ATOM 4421 C CA . ASP C 3 196 ? -7.888 11.534 -36.179 1.00 34.90 ? 174 ASP F CA 1 ATOM 4422 C C . ASP C 3 196 ? -8.933 11.445 -37.305 1.00 38.33 ? 174 ASP F C 1 ATOM 4423 O O . ASP C 3 196 ? -10.073 11.875 -37.106 1.00 37.04 ? 174 ASP F O 1 ATOM 4424 C CB . ASP C 3 196 ? -7.228 10.162 -35.919 1.00 36.45 ? 174 ASP F CB 1 ATOM 4425 C CG . ASP C 3 196 ? -5.997 10.194 -35.028 1.00 48.04 ? 174 ASP F CG 1 ATOM 4426 O OD1 . ASP C 3 196 ? -5.188 11.142 -35.160 1.00 50.38 ? 174 ASP F OD1 1 ATOM 4427 O OD2 . ASP C 3 196 ? -5.807 9.238 -34.247 1.00 53.85 ? 174 ASP F OD2 1 ATOM 4428 N N . ASN C 3 197 ? -8.551 10.904 -38.481 1.00 35.88 ? 175 ASN F N 1 ATOM 4429 C CA . ASN C 3 197 ? -9.446 10.748 -39.635 1.00 35.78 ? 175 ASN F CA 1 ATOM 4430 C C . ASN C 3 197 ? -10.591 9.766 -39.358 1.00 37.22 ? 175 ASN F C 1 ATOM 4431 O O . ASN C 3 197 ? -11.710 9.985 -39.826 1.00 36.69 ? 175 ASN F O 1 ATOM 4432 C CB . ASN C 3 197 ? -8.662 10.341 -40.883 1.00 39.01 ? 175 ASN F CB 1 ATOM 4433 C CG . ASN C 3 197 ? -7.706 11.407 -41.362 1.00 67.49 ? 175 ASN F CG 1 ATOM 4434 O OD1 . ASN C 3 197 ? -6.664 11.664 -40.749 1.00 62.65 ? 175 ASN F OD1 1 ATOM 4435 N ND2 . ASN C 3 197 ? -8.043 12.058 -42.466 1.00 62.03 ? 175 ASN F ND2 1 ATOM 4436 N N . LYS C 3 198 ? -10.311 8.705 -38.576 1.00 32.25 ? 176 LYS F N 1 ATOM 4437 C CA . LYS C 3 198 ? -11.282 7.680 -38.188 1.00 30.20 ? 176 LYS F CA 1 ATOM 4438 C C . LYS C 3 198 ? -11.509 7.692 -36.672 1.00 32.73 ? 176 LYS F C 1 ATOM 4439 O O . LYS C 3 198 ? -10.545 7.592 -35.907 1.00 32.76 ? 176 LYS F O 1 ATOM 4440 C CB . LYS C 3 198 ? -10.817 6.290 -38.654 1.00 32.75 ? 176 LYS F CB 1 ATOM 4441 C CG . LYS C 3 198 ? -11.104 6.001 -40.119 1.00 47.95 ? 176 LYS F CG 1 ATOM 4442 C CD . LYS C 3 198 ? -10.838 4.541 -40.457 1.00 57.99 ? 176 LYS F CD 1 ATOM 4443 C CE . LYS C 3 198 ? -11.249 4.213 -41.870 1.00 70.83 ? 176 LYS F CE 1 ATOM 4444 N NZ . LYS C 3 198 ? -11.054 2.775 -42.186 1.00 80.41 ? 176 LYS F NZ 1 ATOM 4445 N N . ILE C 3 199 ? -12.780 7.842 -36.241 1.00 27.95 ? 177 ILE F N 1 ATOM 4446 C CA . ILE C 3 199 ? -13.163 7.871 -34.818 1.00 26.71 ? 177 ILE F CA 1 ATOM 4447 C C . ILE C 3 199 ? -14.316 6.915 -34.482 1.00 28.86 ? 177 ILE F C 1 ATOM 4448 O O . ILE C 3 199 ? -15.148 6.626 -35.345 1.00 28.28 ? 177 ILE F O 1 ATOM 4449 C CB . ILE C 3 199 ? -13.412 9.308 -34.257 1.00 30.39 ? 177 ILE F CB 1 ATOM 4450 C CG1 . ILE C 3 199 ? -14.572 10.038 -34.972 1.00 31.16 ? 177 ILE F CG1 1 ATOM 4451 C CG2 . ILE C 3 199 ? -12.136 10.152 -34.230 1.00 32.51 ? 177 ILE F CG2 1 ATOM 4452 C CD1 . ILE C 3 199 ? -15.484 10.816 -34.028 1.00 37.72 ? 177 ILE F CD1 1 ATOM 4453 N N . VAL C 3 200 ? -14.363 6.443 -33.219 1.00 24.51 ? 178 VAL F N 1 ATOM 4454 C CA . VAL C 3 200 ? -15.405 5.547 -32.696 1.00 23.36 ? 178 VAL F CA 1 ATOM 4455 C C . VAL C 3 200 ? -16.086 6.218 -31.490 1.00 26.81 ? 178 VAL F C 1 ATOM 4456 O O . VAL C 3 200 ? -15.397 6.685 -30.582 1.00 26.77 ? 178 VAL F O 1 ATOM 4457 C CB . VAL C 3 200 ? -14.865 4.118 -32.388 1.00 27.07 ? 178 VAL F CB 1 ATOM 4458 C CG1 . VAL C 3 200 ? -15.878 3.283 -31.606 1.00 26.34 ? 178 VAL F CG1 1 ATOM 4459 C CG2 . VAL C 3 200 ? -14.461 3.398 -33.672 1.00 27.05 ? 178 VAL F CG2 1 ATOM 4460 N N . VAL C 3 201 ? -17.434 6.288 -31.501 1.00 22.94 ? 179 VAL F N 1 ATOM 4461 C CA . VAL C 3 201 ? -18.219 6.929 -30.437 1.00 23.02 ? 179 VAL F CA 1 ATOM 4462 C C . VAL C 3 201 ? -19.134 5.932 -29.708 1.00 26.76 ? 179 VAL F C 1 ATOM 4463 O O . VAL C 3 201 ? -19.974 5.286 -30.339 1.00 25.98 ? 179 VAL F O 1 ATOM 4464 C CB . VAL C 3 201 ? -19.010 8.172 -30.954 1.00 27.59 ? 179 VAL F CB 1 ATOM 4465 C CG1 . VAL C 3 201 ? -19.747 8.882 -29.818 1.00 28.05 ? 179 VAL F CG1 1 ATOM 4466 C CG2 . VAL C 3 201 ? -18.099 9.151 -31.691 1.00 27.94 ? 179 VAL F CG2 1 ATOM 4467 N N . TYR C 3 202 ? -18.978 5.839 -28.374 1.00 23.91 ? 180 TYR F N 1 ATOM 4468 C CA . TYR C 3 202 ? -19.808 5.013 -27.497 1.00 24.10 ? 180 TYR F CA 1 ATOM 4469 C C . TYR C 3 202 ? -20.313 5.881 -26.344 1.00 29.36 ? 180 TYR F C 1 ATOM 4470 O O . TYR C 3 202 ? -19.527 6.267 -25.472 1.00 29.38 ? 180 TYR F O 1 ATOM 4471 C CB . TYR C 3 202 ? -19.061 3.761 -26.990 1.00 25.19 ? 180 TYR F CB 1 ATOM 4472 C CG . TYR C 3 202 ? -19.829 2.977 -25.944 1.00 27.57 ? 180 TYR F CG 1 ATOM 4473 C CD1 . TYR C 3 202 ? -20.917 2.182 -26.298 1.00 29.49 ? 180 TYR F CD1 1 ATOM 4474 C CD2 . TYR C 3 202 ? -19.474 3.037 -24.599 1.00 29.38 ? 180 TYR F CD2 1 ATOM 4475 C CE1 . TYR C 3 202 ? -21.640 1.475 -25.337 1.00 31.23 ? 180 TYR F CE1 1 ATOM 4476 C CE2 . TYR C 3 202 ? -20.188 2.333 -23.630 1.00 31.42 ? 180 TYR F CE2 1 ATOM 4477 C CZ . TYR C 3 202 ? -21.269 1.551 -24.004 1.00 38.78 ? 180 TYR F CZ 1 ATOM 4478 O OH . TYR C 3 202 ? -21.974 0.853 -23.052 1.00 41.17 ? 180 TYR F OH 1 ATOM 4479 N N . LYS C 3 203 ? -21.629 6.194 -26.361 1.00 26.82 ? 181 LYS F N 1 ATOM 4480 C CA . LYS C 3 203 ? -22.323 7.038 -25.381 1.00 28.06 ? 181 LYS F CA 1 ATOM 4481 C C . LYS C 3 203 ? -21.645 8.413 -25.228 1.00 32.48 ? 181 LYS F C 1 ATOM 4482 O O . LYS C 3 203 ? -21.722 9.223 -26.152 1.00 32.06 ? 181 LYS F O 1 ATOM 4483 C CB . LYS C 3 203 ? -22.539 6.306 -24.035 1.00 31.46 ? 181 LYS F CB 1 ATOM 4484 C CG . LYS C 3 203 ? -23.907 5.642 -23.893 1.00 46.50 ? 181 LYS F CG 1 ATOM 4485 C CD . LYS C 3 203 ? -23.851 4.144 -24.149 1.00 55.86 ? 181 LYS F CD 1 ATOM 4486 C CE . LYS C 3 203 ? -24.711 3.346 -23.198 1.00 68.06 ? 181 LYS F CE 1 ATOM 4487 N NZ . LYS C 3 203 ? -26.109 3.214 -23.683 1.00 77.97 ? 181 LYS F NZ 1 ATOM 4488 N N . GLY C 3 204 ? -20.957 8.633 -24.106 1.00 29.66 ? 182 GLY F N 1 ATOM 4489 C CA . GLY C 3 204 ? -20.248 9.876 -23.821 1.00 30.13 ? 182 GLY F CA 1 ATOM 4490 C C . GLY C 3 204 ? -18.749 9.804 -24.032 1.00 33.44 ? 182 GLY F C 1 ATOM 4491 O O . GLY C 3 204 ? -18.031 10.737 -23.659 1.00 33.69 ? 182 GLY F O 1 ATOM 4492 N N . ASP C 3 205 ? -18.267 8.701 -24.639 1.00 29.07 ? 183 ASP F N 1 ATOM 4493 C CA . ASP C 3 205 ? -16.845 8.471 -24.891 1.00 28.74 ? 183 ASP F CA 1 ATOM 4494 C C . ASP C 3 205 ? -16.503 8.391 -26.378 1.00 31.56 ? 183 ASP F C 1 ATOM 4495 O O . ASP C 3 205 ? -17.206 7.728 -27.143 1.00 30.37 ? 183 ASP F O 1 ATOM 4496 C CB . ASP C 3 205 ? -16.364 7.210 -24.156 1.00 31.00 ? 183 ASP F CB 1 ATOM 4497 C CG . ASP C 3 205 ? -16.416 7.320 -22.645 1.00 43.49 ? 183 ASP F CG 1 ATOM 4498 O OD1 . ASP C 3 205 ? -15.560 8.031 -22.070 1.00 45.08 ? 183 ASP F OD1 1 ATOM 4499 O OD2 . ASP C 3 205 ? -17.294 6.674 -22.033 1.00 50.33 ? 183 ASP F OD2 1 ATOM 4500 N N . VAL C 3 206 ? -15.416 9.077 -26.776 1.00 28.45 ? 184 VAL F N 1 ATOM 4501 C CA . VAL C 3 206 ? -14.899 9.120 -28.152 1.00 27.81 ? 184 VAL F CA 1 ATOM 4502 C C . VAL C 3 206 ? -13.508 8.467 -28.161 1.00 31.99 ? 184 VAL F C 1 ATOM 4503 O O . VAL C 3 206 ? -12.706 8.720 -27.260 1.00 32.48 ? 184 VAL F O 1 ATOM 4504 C CB . VAL C 3 206 ? -14.883 10.564 -28.744 1.00 32.27 ? 184 VAL F CB 1 ATOM 4505 C CG1 . VAL C 3 206 ? -14.431 10.568 -30.205 1.00 31.99 ? 184 VAL F CG1 1 ATOM 4506 C CG2 . VAL C 3 206 ? -16.251 11.231 -28.617 1.00 32.29 ? 184 VAL F CG2 1 ATOM 4507 N N . TYR C 3 207 ? -13.238 7.620 -29.165 1.00 28.18 ? 185 TYR F N 1 ATOM 4508 C CA . TYR C 3 207 ? -11.971 6.903 -29.301 1.00 28.74 ? 185 TYR F CA 1 ATOM 4509 C C . TYR C 3 207 ? -11.362 7.103 -30.687 1.00 33.39 ? 185 TYR F C 1 ATOM 4510 O O . TYR C 3 207 ? -12.077 7.026 -31.690 1.00 32.31 ? 185 TYR F O 1 ATOM 4511 C CB . TYR C 3 207 ? -12.180 5.393 -29.042 1.00 29.45 ? 185 TYR F CB 1 ATOM 4512 C CG . TYR C 3 207 ? -12.581 5.047 -27.623 1.00 31.26 ? 185 TYR F CG 1 ATOM 4513 C CD1 . TYR C 3 207 ? -11.628 4.680 -26.678 1.00 34.67 ? 185 TYR F CD1 1 ATOM 4514 C CD2 . TYR C 3 207 ? -13.918 5.049 -27.234 1.00 31.18 ? 185 TYR F CD2 1 ATOM 4515 C CE1 . TYR C 3 207 ? -11.992 4.347 -25.374 1.00 36.07 ? 185 TYR F CE1 1 ATOM 4516 C CE2 . TYR C 3 207 ? -14.293 4.732 -25.929 1.00 32.71 ? 185 TYR F CE2 1 ATOM 4517 C CZ . TYR C 3 207 ? -13.325 4.387 -25.000 1.00 41.44 ? 185 TYR F CZ 1 ATOM 4518 O OH . TYR C 3 207 ? -13.689 4.076 -23.713 1.00 43.36 ? 185 TYR F OH 1 ATOM 4519 N N . ASN C 3 208 ? -10.039 7.347 -30.743 1.00 31.58 ? 186 ASN F N 1 ATOM 4520 C CA . ASN C 3 208 ? -9.306 7.468 -32.003 1.00 32.29 ? 186 ASN F CA 1 ATOM 4521 C C . ASN C 3 208 ? -8.969 6.032 -32.405 1.00 36.95 ? 186 ASN F C 1 ATOM 4522 O O . ASN C 3 208 ? -8.117 5.401 -31.773 1.00 37.56 ? 186 ASN F O 1 ATOM 4523 C CB . ASN C 3 208 ? -8.032 8.317 -31.832 1.00 34.23 ? 186 ASN F CB 1 ATOM 4524 C CG . ASN C 3 208 ? -8.192 9.806 -32.070 1.00 52.98 ? 186 ASN F CG 1 ATOM 4525 O OD1 . ASN C 3 208 ? -9.156 10.284 -32.679 1.00 45.44 ? 186 ASN F OD1 1 ATOM 4526 N ND2 . ASN C 3 208 ? -7.205 10.575 -31.640 1.00 45.48 ? 186 ASN F ND2 1 ATOM 4527 N N . MET C 3 209 ? -9.705 5.483 -33.388 1.00 33.29 ? 187 MET F N 1 ATOM 4528 C CA . MET C 3 209 ? -9.529 4.094 -33.811 1.00 33.58 ? 187 MET F CA 1 ATOM 4529 C C . MET C 3 209 ? -9.618 3.916 -35.319 1.00 37.88 ? 187 MET F C 1 ATOM 4530 O O . MET C 3 209 ? -10.581 4.367 -35.942 1.00 36.75 ? 187 MET F O 1 ATOM 4531 C CB . MET C 3 209 ? -10.559 3.189 -33.106 1.00 34.83 ? 187 MET F CB 1 ATOM 4532 C CG . MET C 3 209 ? -10.211 1.708 -33.148 1.00 39.29 ? 187 MET F CG 1 ATOM 4533 S SD . MET C 3 209 ? -11.601 0.645 -33.627 1.00 42.40 ? 187 MET F SD 1 ATOM 4534 C CE . MET C 3 209 ? -12.478 0.558 -32.111 1.00 38.39 ? 187 MET F CE 1 ATOM 4535 N N . ASP C 3 210 ? -8.632 3.205 -35.891 1.00 36.02 ? 188 ASP F N 1 ATOM 4536 C CA . ASP C 3 210 ? -8.586 2.870 -37.311 1.00 36.57 ? 188 ASP F CA 1 ATOM 4537 C C . ASP C 3 210 ? -9.449 1.609 -37.494 1.00 39.62 ? 188 ASP F C 1 ATOM 4538 O O . ASP C 3 210 ? -8.930 0.504 -37.681 1.00 40.23 ? 188 ASP F O 1 ATOM 4539 C CB . ASP C 3 210 ? -7.125 2.662 -37.768 1.00 40.78 ? 188 ASP F CB 1 ATOM 4540 C CG . ASP C 3 210 ? -6.946 2.437 -39.257 1.00 52.63 ? 188 ASP F CG 1 ATOM 4541 O OD1 . ASP C 3 210 ? -7.361 3.315 -40.046 1.00 53.38 ? 188 ASP F OD1 1 ATOM 4542 O OD2 . ASP C 3 210 ? -6.349 1.406 -39.632 1.00 60.05 ? 188 ASP F OD2 1 ATOM 4543 N N . TYR C 3 211 ? -10.780 1.787 -37.369 1.00 34.55 ? 189 TYR F N 1 ATOM 4544 C CA . TYR C 3 211 ? -11.784 0.726 -37.464 1.00 33.45 ? 189 TYR F CA 1 ATOM 4545 C C . TYR C 3 211 ? -11.794 0.027 -38.836 1.00 38.34 ? 189 TYR F C 1 ATOM 4546 O O . TYR C 3 211 ? -11.497 0.686 -39.837 1.00 38.71 ? 189 TYR F O 1 ATOM 4547 C CB . TYR C 3 211 ? -13.190 1.257 -37.094 1.00 33.14 ? 189 TYR F CB 1 ATOM 4548 C CG . TYR C 3 211 ? -13.686 2.424 -37.927 1.00 34.85 ? 189 TYR F CG 1 ATOM 4549 C CD1 . TYR C 3 211 ? -14.311 2.216 -39.154 1.00 37.13 ? 189 TYR F CD1 1 ATOM 4550 C CD2 . TYR C 3 211 ? -13.608 3.729 -37.450 1.00 35.64 ? 189 TYR F CD2 1 ATOM 4551 C CE1 . TYR C 3 211 ? -14.781 3.283 -39.918 1.00 38.46 ? 189 TYR F CE1 1 ATOM 4552 C CE2 . TYR C 3 211 ? -14.096 4.803 -38.195 1.00 37.12 ? 189 TYR F CE2 1 ATOM 4553 C CZ . TYR C 3 211 ? -14.679 4.575 -39.430 1.00 45.00 ? 189 TYR F CZ 1 ATOM 4554 O OH . TYR C 3 211 ? -15.156 5.629 -40.170 1.00 47.27 ? 189 TYR F OH 1 ATOM 4555 N N . PRO C 3 212 ? -12.128 -1.289 -38.921 1.00 35.21 ? 190 PRO F N 1 ATOM 4556 C CA . PRO C 3 212 ? -12.169 -1.940 -40.243 1.00 36.07 ? 190 PRO F CA 1 ATOM 4557 C C . PRO C 3 212 ? -13.320 -1.398 -41.098 1.00 39.81 ? 190 PRO F C 1 ATOM 4558 O O . PRO C 3 212 ? -14.372 -1.082 -40.538 1.00 38.20 ? 190 PRO F O 1 ATOM 4559 C CB . PRO C 3 212 ? -12.362 -3.423 -39.908 1.00 37.90 ? 190 PRO F CB 1 ATOM 4560 C CG . PRO C 3 212 ? -13.022 -3.432 -38.582 1.00 40.99 ? 190 PRO F CG 1 ATOM 4561 C CD . PRO C 3 212 ? -12.504 -2.231 -37.844 1.00 36.23 ? 190 PRO F CD 1 ATOM 4562 N N . PRO C 3 213 ? -13.025 -1.293 -42.379 1.00 37.86 ? 191 PRO F N 1 ATOM 4563 C CA . PRO C 3 213 ? -13.904 -0.743 -43.367 1.00 37.84 ? 191 PRO F CA 1 ATOM 4564 C C . PRO C 3 213 ? -15.096 -1.541 -43.223 1.00 41.06 ? 191 PRO F C 1 ATOM 4565 O O . PRO C 3 213 ? -15.123 -2.292 -42.310 1.00 40.25 ? 191 PRO F O 1 ATOM 4566 C CB . PRO C 3 213 ? -13.212 -1.071 -44.676 1.00 41.66 ? 191 PRO F CB 1 ATOM 4567 C CG . PRO C 3 213 ? -12.169 -1.976 -44.355 1.00 46.89 ? 191 PRO F CG 1 ATOM 4568 C CD . PRO C 3 213 ? -11.784 -1.772 -42.981 1.00 41.26 ? 191 PRO F CD 1 ATOM 4569 N N . PHE C 3 214 ? -16.052 -1.339 -44.093 1.00 37.90 ? 192 PHE F N 1 ATOM 4570 C CA . PHE C 3 214 ? -17.386 -1.788 -43.933 1.00 37.63 ? 192 PHE F CA 1 ATOM 4571 C C . PHE C 3 214 ? -17.491 -2.907 -44.872 1.00 42.19 ? 192 PHE F C 1 ATOM 4572 O O . PHE C 3 214 ? -17.401 -2.705 -46.050 1.00 43.23 ? 192 PHE F O 1 ATOM 4573 C CB . PHE C 3 214 ? -18.306 -0.687 -44.397 1.00 40.33 ? 192 PHE F CB 1 ATOM 4574 C CG . PHE C 3 214 ? -19.733 -1.039 -44.351 1.00 42.02 ? 192 PHE F CG 1 ATOM 4575 C CD1 . PHE C 3 214 ? -20.428 -0.991 -43.184 1.00 44.24 ? 192 PHE F CD1 1 ATOM 4576 C CD2 . PHE C 3 214 ? -20.389 -1.419 -45.469 1.00 45.68 ? 192 PHE F CD2 1 ATOM 4577 C CE1 . PHE C 3 214 ? -21.751 -1.323 -43.145 1.00 45.53 ? 192 PHE F CE1 1 ATOM 4578 C CE2 . PHE C 3 214 ? -21.710 -1.741 -45.430 1.00 48.78 ? 192 PHE F CE2 1 ATOM 4579 C CZ . PHE C 3 214 ? -22.384 -1.691 -44.277 1.00 45.91 ? 192 PHE F CZ 1 ATOM 4580 N N . GLY C 3 215 ? -17.663 -4.097 -44.344 1.00 38.00 ? 193 GLY F N 1 ATOM 4581 C CA . GLY C 3 215 ? -17.746 -5.270 -45.151 1.00 38.86 ? 193 GLY F CA 1 ATOM 4582 C C . GLY C 3 215 ? -16.486 -6.022 -44.954 1.00 42.88 ? 193 GLY F C 1 ATOM 4583 O O . GLY C 3 215 ? -16.125 -6.824 -45.755 1.00 43.95 ? 193 GLY F O 1 ATOM 4584 N N . ALA C 3 216 ? -15.802 -5.749 -43.877 1.00 38.40 ? 194 ALA F N 1 ATOM 4585 C CA . ALA C 3 216 ? -14.546 -6.387 -43.665 1.00 39.04 ? 194 ALA F CA 1 ATOM 4586 C C . ALA C 3 216 ? -14.259 -6.604 -42.232 1.00 42.12 ? 194 ALA F C 1 ATOM 4587 O O . ALA C 3 216 ? -13.144 -6.512 -41.842 1.00 42.72 ? 194 ALA F O 1 ATOM 4588 C CB . ALA C 3 216 ? -13.500 -5.562 -44.211 1.00 40.59 ? 194 ALA F CB 1 ATOM 4589 N N . GLY C 3 217 ? -15.250 -6.899 -41.435 1.00 37.33 ? 195 GLY F N 1 ATOM 4590 C CA . GLY C 3 217 ? -15.004 -7.047 -40.036 1.00 36.58 ? 195 GLY F CA 1 ATOM 4591 C C . GLY C 3 217 ? -14.468 -8.406 -39.777 1.00 41.74 ? 195 GLY F C 1 ATOM 4592 O O . GLY C 3 217 ? -14.693 -9.277 -40.560 1.00 41.91 ? 195 GLY F O 1 ATOM 4593 N N . ARG C 3 218 ? -13.735 -8.569 -38.685 1.00 39.08 ? 196 ARG F N 1 ATOM 4594 C CA . ARG C 3 218 ? -13.233 -9.886 -38.277 1.00 40.68 ? 196 ARG F CA 1 ATOM 4595 C C . ARG C 3 218 ? -14.022 -10.513 -37.109 1.00 44.24 ? 196 ARG F C 1 ATOM 4596 O O . ARG C 3 218 ? -14.558 -9.769 -36.284 1.00 42.52 ? 196 ARG F O 1 ATOM 4597 C CB . ARG C 3 218 ? -11.737 -9.801 -37.927 1.00 42.89 ? 196 ARG F CB 1 ATOM 4598 C CG . ARG C 3 218 ? -10.831 -9.623 -39.138 1.00 54.85 ? 196 ARG F CG 1 ATOM 4599 C CD . ARG C 3 218 ? -9.384 -9.881 -38.779 1.00 67.59 ? 196 ARG F CD 1 ATOM 4600 N NE . ARG C 3 218 ? -8.480 -9.507 -39.867 1.00 77.94 ? 196 ARG F NE 1 ATOM 4601 C CZ . ARG C 3 218 ? -7.867 -8.331 -39.967 1.00 92.38 ? 196 ARG F CZ 1 ATOM 4602 N NH1 . ARG C 3 218 ? -8.051 -7.397 -39.041 1.00 78.36 ? 196 ARG F NH1 1 ATOM 4603 N NH2 . ARG C 3 218 ? -7.064 -8.080 -40.991 1.00 81.06 ? 196 ARG F NH2 1 ATOM 4604 N N . PRO C 3 219 ? -14.081 -11.869 -36.997 1.00 42.36 ? 197 PRO F N 1 ATOM 4605 C CA . PRO C 3 219 ? -14.822 -12.485 -35.879 1.00 42.40 ? 197 PRO F CA 1 ATOM 4606 C C . PRO C 3 219 ? -14.174 -12.253 -34.515 1.00 46.87 ? 197 PRO F C 1 ATOM 4607 O O . PRO C 3 219 ? -12.948 -12.266 -34.402 1.00 47.84 ? 197 PRO F O 1 ATOM 4608 C CB . PRO C 3 219 ? -14.854 -13.976 -36.246 1.00 46.19 ? 197 PRO F CB 1 ATOM 4609 C CG . PRO C 3 219 ? -14.450 -14.049 -37.686 1.00 50.95 ? 197 PRO F CG 1 ATOM 4610 C CD . PRO C 3 219 ? -13.516 -12.906 -37.883 1.00 45.86 ? 197 PRO F CD 1 ATOM 4611 N N . GLY C 3 220 ? -15.009 -12.007 -33.507 1.00 42.74 ? 198 GLY F N 1 ATOM 4612 C CA . GLY C 3 220 ? -14.580 -11.749 -32.134 1.00 43.37 ? 198 GLY F CA 1 ATOM 4613 C C . GLY C 3 220 ? -13.930 -10.397 -31.908 1.00 46.14 ? 198 GLY F C 1 ATOM 4614 O O . GLY C 3 220 ? -13.469 -10.108 -30.798 1.00 46.62 ? 198 GLY F O 1 ATOM 4615 N N . GLN C 3 221 ? -13.898 -9.558 -32.958 1.00 41.08 ? 199 GLN F N 1 ATOM 4616 C CA . GLN C 3 221 ? -13.294 -8.228 -32.946 1.00 40.05 ? 199 GLN F CA 1 ATOM 4617 C C . GLN C 3 221 ? -14.322 -7.152 -33.296 1.00 41.61 ? 199 GLN F C 1 ATOM 4618 O O . GLN C 3 221 ? -15.407 -7.476 -33.791 1.00 40.47 ? 199 GLN F O 1 ATOM 4619 C CB . GLN C 3 221 ? -12.124 -8.172 -33.942 1.00 42.37 ? 199 GLN F CB 1 ATOM 4620 C CG . GLN C 3 221 ? -10.944 -9.062 -33.581 1.00 62.05 ? 199 GLN F CG 1 ATOM 4621 C CD . GLN C 3 221 ? -9.702 -8.617 -34.304 1.00 84.21 ? 199 GLN F CD 1 ATOM 4622 O OE1 . GLN C 3 221 ? -9.396 -9.072 -35.412 1.00 80.95 ? 199 GLN F OE1 1 ATOM 4623 N NE2 . GLN C 3 221 ? -8.962 -7.706 -33.694 1.00 77.18 ? 199 GLN F NE2 1 ATOM 4624 N N . PHE C 3 222 ? -13.970 -5.870 -33.045 1.00 37.36 ? 200 PHE F N 1 ATOM 4625 C CA . PHE C 3 222 ? -14.805 -4.704 -33.346 1.00 35.51 ? 200 PHE F CA 1 ATOM 4626 C C . PHE C 3 222 ? -15.167 -4.723 -34.838 1.00 38.80 ? 200 PHE F C 1 ATOM 4627 O O . PHE C 3 222 ? -14.279 -4.697 -35.693 1.00 39.02 ? 200 PHE F O 1 ATOM 4628 C CB . PHE C 3 222 ? -14.068 -3.400 -32.965 1.00 37.14 ? 200 PHE F CB 1 ATOM 4629 C CG . PHE C 3 222 ? -14.862 -2.127 -33.150 1.00 37.44 ? 200 PHE F CG 1 ATOM 4630 C CD1 . PHE C 3 222 ? -15.555 -1.560 -32.087 1.00 40.10 ? 200 PHE F CD1 1 ATOM 4631 C CD2 . PHE C 3 222 ? -14.898 -1.481 -34.382 1.00 39.31 ? 200 PHE F CD2 1 ATOM 4632 C CE1 . PHE C 3 222 ? -16.281 -0.378 -32.257 1.00 40.29 ? 200 PHE F CE1 1 ATOM 4633 C CE2 . PHE C 3 222 ? -15.641 -0.311 -34.556 1.00 41.50 ? 200 PHE F CE2 1 ATOM 4634 C CZ . PHE C 3 222 ? -16.327 0.232 -33.493 1.00 39.17 ? 200 PHE F CZ 1 ATOM 4635 N N . GLY C 3 223 ? -16.461 -4.833 -35.120 1.00 34.48 ? 201 GLY F N 1 ATOM 4636 C CA . GLY C 3 223 ? -16.979 -4.881 -36.482 1.00 34.12 ? 201 GLY F CA 1 ATOM 4637 C C . GLY C 3 223 ? -17.366 -6.260 -36.981 1.00 38.49 ? 201 GLY F C 1 ATOM 4638 O O . GLY C 3 223 ? -17.588 -6.424 -38.183 1.00 38.46 ? 201 GLY F O 1 ATOM 4639 N N . ASP C 3 224 ? -17.481 -7.261 -36.067 1.00 35.32 ? 202 ASP F N 1 ATOM 4640 C CA . ASP C 3 224 ? -17.897 -8.633 -36.409 1.00 35.99 ? 202 ASP F CA 1 ATOM 4641 C C . ASP C 3 224 ? -19.301 -8.627 -37.039 1.00 39.25 ? 202 ASP F C 1 ATOM 4642 O O . ASP C 3 224 ? -19.608 -9.450 -37.903 1.00 39.70 ? 202 ASP F O 1 ATOM 4643 C CB . ASP C 3 224 ? -17.808 -9.575 -35.189 1.00 38.82 ? 202 ASP F CB 1 ATOM 4644 C CG . ASP C 3 224 ? -18.644 -9.214 -33.969 1.00 48.31 ? 202 ASP F CG 1 ATOM 4645 O OD1 . ASP C 3 224 ? -18.817 -10.086 -33.092 1.00 49.96 ? 202 ASP F OD1 1 ATOM 4646 O OD2 . ASP C 3 224 ? -19.107 -8.054 -33.880 1.00 53.13 ? 202 ASP F OD2 1 ATOM 4647 N N . ILE C 3 225 ? -20.121 -7.651 -36.621 1.00 34.61 ? 203 ILE F N 1 ATOM 4648 C CA . ILE C 3 225 ? -21.445 -7.334 -37.144 1.00 34.32 ? 203 ILE F CA 1 ATOM 4649 C C . ILE C 3 225 ? -21.440 -5.833 -37.476 1.00 37.20 ? 203 ILE F C 1 ATOM 4650 O O . ILE C 3 225 ? -21.059 -5.019 -36.631 1.00 36.08 ? 203 ILE F O 1 ATOM 4651 C CB . ILE C 3 225 ? -22.633 -7.798 -36.241 1.00 37.91 ? 203 ILE F CB 1 ATOM 4652 C CG1 . ILE C 3 225 ? -24.004 -7.424 -36.863 1.00 38.88 ? 203 ILE F CG1 1 ATOM 4653 C CG2 . ILE C 3 225 ? -22.507 -7.305 -34.796 1.00 38.15 ? 203 ILE F CG2 1 ATOM 4654 C CD1 . ILE C 3 225 ? -25.108 -8.452 -36.673 1.00 47.82 ? 203 ILE F CD1 1 ATOM 4655 N N . GLN C 3 226 ? -21.724 -5.438 -38.698 1.00 34.05 ? 204 GLN F N 1 ATOM 4656 C CA . GLN C 3 226 ? -21.726 -4.036 -39.055 1.00 33.63 ? 204 GLN F CA 1 ATOM 4657 C C . GLN C 3 226 ? -23.007 -3.684 -39.750 1.00 38.79 ? 204 GLN F C 1 ATOM 4658 O O . GLN C 3 226 ? -23.327 -4.255 -40.738 1.00 39.33 ? 204 GLN F O 1 ATOM 4659 C CB . GLN C 3 226 ? -20.625 -3.742 -40.035 1.00 35.10 ? 204 GLN F CB 1 ATOM 4660 C CG . GLN C 3 226 ? -19.256 -3.993 -39.567 1.00 47.18 ? 204 GLN F CG 1 ATOM 4661 C CD . GLN C 3 226 ? -18.282 -3.971 -40.686 1.00 64.25 ? 204 GLN F CD 1 ATOM 4662 O OE1 . GLN C 3 226 ? -18.650 -3.881 -41.811 1.00 59.41 ? 204 GLN F OE1 1 ATOM 4663 N NE2 . GLN C 3 226 ? -17.040 -4.047 -40.378 1.00 56.58 ? 204 GLN F NE2 1 ATOM 4664 N N . SER C 3 227 ? -23.727 -2.700 -39.268 1.00 35.70 ? 205 SER F N 1 ATOM 4665 C CA . SER C 3 227 ? -24.892 -2.242 -39.966 1.00 37.10 ? 205 SER F CA 1 ATOM 4666 C C . SER C 3 227 ? -24.780 -0.761 -40.116 1.00 41.77 ? 205 SER F C 1 ATOM 4667 O O . SER C 3 227 ? -24.013 -0.146 -39.439 1.00 40.40 ? 205 SER F O 1 ATOM 4668 C CB . SER C 3 227 ? -26.139 -2.588 -39.204 1.00 40.92 ? 205 SER F CB 1 ATOM 4669 O OG . SER C 3 227 ? -27.234 -1.866 -39.681 1.00 51.33 ? 205 SER F OG 1 ATOM 4670 N N . ARG C 3 228 ? -25.533 -0.178 -41.022 1.00 40.28 ? 206 ARG F N 1 ATOM 4671 C CA . ARG C 3 228 ? -25.378 1.227 -41.294 1.00 41.24 ? 206 ARG F CA 1 ATOM 4672 C C . ARG C 3 228 ? -26.012 2.155 -40.294 1.00 45.96 ? 206 ARG F C 1 ATOM 4673 O O . ARG C 3 228 ? -25.495 3.214 -40.064 1.00 45.44 ? 206 ARG F O 1 ATOM 4674 C CB . ARG C 3 228 ? -25.868 1.570 -42.685 1.00 43.55 ? 206 ARG F CB 1 ATOM 4675 C CG . ARG C 3 228 ? -25.616 2.998 -43.051 1.00 53.64 ? 206 ARG F CG 1 ATOM 4676 C CD . ARG C 3 228 ? -26.196 3.406 -44.384 1.00 64.21 ? 206 ARG F CD 1 ATOM 4677 N NE . ARG C 3 228 ? -27.482 2.828 -44.671 1.00 72.21 ? 206 ARG F NE 1 ATOM 4678 C CZ . ARG C 3 228 ? -28.641 3.381 -44.370 1.00 87.27 ? 206 ARG F CZ 1 ATOM 4679 N NH1 . ARG C 3 228 ? -28.704 4.525 -43.729 1.00 75.28 ? 206 ARG F NH1 1 ATOM 4680 N NH2 . ARG C 3 228 ? -29.749 2.758 -44.684 1.00 74.75 ? 206 ARG F NH2 1 ATOM 4681 N N . THR C 3 229 ? -27.131 1.773 -39.705 1.00 43.65 ? 207 THR F N 1 ATOM 4682 C CA . THR C 3 229 ? -27.830 2.603 -38.744 1.00 44.33 ? 207 THR F CA 1 ATOM 4683 C C . THR C 3 229 ? -28.334 1.648 -37.767 1.00 47.61 ? 207 THR F C 1 ATOM 4684 O O . THR C 3 229 ? -28.457 0.523 -38.090 1.00 46.90 ? 207 THR F O 1 ATOM 4685 C CB . THR C 3 229 ? -29.064 3.089 -39.324 1.00 56.28 ? 207 THR F CB 1 ATOM 4686 O OG1 . THR C 3 229 ? -29.592 2.024 -40.112 1.00 58.07 ? 207 THR F OG1 1 ATOM 4687 C CG2 . THR C 3 229 ? -28.797 4.265 -40.178 1.00 56.08 ? 207 THR F CG2 1 ATOM 4688 N N . PRO C 3 230 ? -28.674 2.087 -36.580 1.00 44.33 ? 208 PRO F N 1 ATOM 4689 C CA . PRO C 3 230 ? -29.177 1.163 -35.593 1.00 43.87 ? 208 PRO F CA 1 ATOM 4690 C C . PRO C 3 230 ? -30.461 0.546 -36.047 1.00 49.70 ? 208 PRO F C 1 ATOM 4691 O O . PRO C 3 230 ? -30.890 -0.401 -35.473 1.00 49.21 ? 208 PRO F O 1 ATOM 4692 C CB . PRO C 3 230 ? -29.396 2.059 -34.388 1.00 45.55 ? 208 PRO F CB 1 ATOM 4693 C CG . PRO C 3 230 ? -28.402 3.013 -34.498 1.00 49.66 ? 208 PRO F CG 1 ATOM 4694 C CD . PRO C 3 230 ? -28.258 3.328 -35.933 1.00 46.40 ? 208 PRO F CD 1 ATOM 4695 N N . GLU C 3 231 ? -31.066 1.068 -37.084 1.00 48.35 ? 209 GLU F N 1 ATOM 4696 C CA . GLU C 3 231 ? -32.313 0.508 -37.554 1.00 50.78 ? 209 GLU F CA 1 ATOM 4697 C C . GLU C 3 231 ? -32.307 0.132 -39.000 1.00 54.45 ? 209 GLU F C 1 ATOM 4698 O O . GLU C 3 231 ? -33.317 -0.195 -39.543 1.00 56.27 ? 209 GLU F O 1 ATOM 4699 C CB . GLU C 3 231 ? -33.426 1.486 -37.346 1.00 55.22 ? 209 GLU F CB 1 ATOM 4700 C CG . GLU C 3 231 ? -34.084 1.359 -36.025 1.00 67.49 ? 209 GLU F CG 1 ATOM 4701 C CD . GLU C 3 231 ? -33.963 2.619 -35.257 1.00 87.34 ? 209 GLU F CD 1 ATOM 4702 O OE1 . GLU C 3 231 ? -34.807 2.863 -34.371 1.00 82.53 ? 209 GLU F OE1 1 ATOM 4703 O OE2 . GLU C 3 231 ? -33.016 3.369 -35.567 1.00 80.34 ? 209 GLU F OE2 1 ATOM 4704 N N . SER C 3 232 ? -31.165 0.206 -39.634 1.00 48.76 ? 210 SER F N 1 ATOM 4705 C CA . SER C 3 232 ? -31.074 -0.284 -40.964 1.00 48.83 ? 210 SER F CA 1 ATOM 4706 C C . SER C 3 232 ? -31.628 -1.687 -40.875 1.00 52.62 ? 210 SER F C 1 ATOM 4707 O O . SER C 3 232 ? -32.062 -2.098 -39.828 1.00 50.69 ? 210 SER F O 1 ATOM 4708 C CB . SER C 3 232 ? -29.634 -0.258 -41.415 1.00 50.33 ? 210 SER F CB 1 ATOM 4709 O OG . SER C 3 232 ? -29.403 -1.097 -42.522 1.00 59.96 ? 210 SER F OG 1 ATOM 4710 N N . LYS C 3 233 ? -31.639 -2.407 -41.984 1.00 51.15 ? 211 LYS F N 1 ATOM 4711 C CA . LYS C 3 233 ? -32.343 -3.666 -42.096 1.00 51.68 ? 211 LYS F CA 1 ATOM 4712 C C . LYS C 3 233 ? -31.422 -4.714 -42.606 1.00 53.20 ? 211 LYS F C 1 ATOM 4713 O O . LYS C 3 233 ? -31.598 -5.885 -42.332 1.00 52.02 ? 211 LYS F O 1 ATOM 4714 C CB . LYS C 3 233 ? -33.493 -3.539 -43.079 1.00 57.75 ? 211 LYS F CB 1 ATOM 4715 C CG . LYS C 3 233 ? -34.841 -3.717 -42.449 1.00 74.87 ? 211 LYS F CG 1 ATOM 4716 C CD . LYS C 3 233 ? -35.899 -4.107 -43.450 1.00 87.09 ? 211 LYS F CD 1 ATOM 4717 C CE . LYS C 3 233 ? -36.956 -4.995 -42.796 1.00 101.13 ? 211 LYS F CE 1 ATOM 4718 N NZ . LYS C 3 233 ? -38.213 -5.130 -43.592 1.00 113.37 ? 211 LYS F NZ 1 ATOM 4719 N N . ASP C 3 234 ? -30.438 -4.298 -43.376 1.00 48.92 ? 212 ASP F N 1 ATOM 4720 C CA . ASP C 3 234 ? -29.411 -5.223 -43.765 1.00 47.09 ? 212 ASP F CA 1 ATOM 4721 C C . ASP C 3 234 ? -28.186 -4.986 -42.929 1.00 47.21 ? 212 ASP F C 1 ATOM 4722 O O . ASP C 3 234 ? -27.948 -3.894 -42.471 1.00 46.11 ? 212 ASP F O 1 ATOM 4723 C CB . ASP C 3 234 ? -29.088 -5.165 -45.253 1.00 50.56 ? 212 ASP F CB 1 ATOM 4724 C CG . ASP C 3 234 ? -28.526 -6.488 -45.778 1.00 59.98 ? 212 ASP F CG 1 ATOM 4725 O OD1 . ASP C 3 234 ? -29.043 -7.558 -45.402 1.00 60.84 ? 212 ASP F OD1 1 ATOM 4726 O OD2 . ASP C 3 234 ? -27.566 -6.471 -46.566 1.00 65.43 ? 212 ASP F OD2 1 ATOM 4727 N N . VAL C 3 235 ? -27.421 -6.049 -42.760 1.00 41.64 ? 213 VAL F N 1 ATOM 4728 C CA . VAL C 3 235 ? -26.339 -6.098 -41.843 1.00 38.88 ? 213 VAL F CA 1 ATOM 4729 C C . VAL C 3 235 ? -25.302 -7.049 -42.352 1.00 41.17 ? 213 VAL F C 1 ATOM 4730 O O . VAL C 3 235 ? -25.608 -7.926 -43.100 1.00 41.72 ? 213 VAL F O 1 ATOM 4731 C CB . VAL C 3 235 ? -26.875 -6.559 -40.552 1.00 41.89 ? 213 VAL F CB 1 ATOM 4732 C CG1 . VAL C 3 235 ? -28.168 -5.893 -40.362 1.00 41.95 ? 213 VAL F CG1 1 ATOM 4733 C CG2 . VAL C 3 235 ? -27.073 -8.004 -40.586 1.00 42.57 ? 213 VAL F CG2 1 ATOM 4734 N N . TYR C 3 236 ? -24.063 -6.835 -41.945 1.00 35.64 ? 214 TYR F N 1 ATOM 4735 C CA . TYR C 3 236 ? -22.946 -7.597 -42.420 1.00 34.97 ? 214 TYR F CA 1 ATOM 4736 C C . TYR C 3 236 ? -22.484 -8.396 -41.286 1.00 37.44 ? 214 TYR F C 1 ATOM 4737 O O . TYR C 3 236 ? -22.394 -7.889 -40.227 1.00 35.90 ? 214 TYR F O 1 ATOM 4738 C CB . TYR C 3 236 ? -21.828 -6.672 -42.797 1.00 35.64 ? 214 TYR F CB 1 ATOM 4739 C CG . TYR C 3 236 ? -20.537 -7.373 -42.857 1.00 37.20 ? 214 TYR F CG 1 ATOM 4740 C CD1 . TYR C 3 236 ? -20.192 -8.068 -43.953 1.00 40.51 ? 214 TYR F CD1 1 ATOM 4741 C CD2 . TYR C 3 236 ? -19.665 -7.355 -41.804 1.00 36.92 ? 214 TYR F CD2 1 ATOM 4742 C CE1 . TYR C 3 236 ? -19.044 -8.715 -44.009 1.00 41.66 ? 214 TYR F CE1 1 ATOM 4743 C CE2 . TYR C 3 236 ? -18.507 -7.996 -41.870 1.00 38.35 ? 214 TYR F CE2 1 ATOM 4744 C CZ . TYR C 3 236 ? -18.212 -8.675 -42.980 1.00 47.07 ? 214 TYR F CZ 1 ATOM 4745 O OH . TYR C 3 236 ? -17.068 -9.358 -43.089 1.00 48.99 ? 214 TYR F OH 1 ATOM 4746 N N . ALA C 3 237 ? -22.168 -9.654 -41.508 1.00 34.44 ? 215 ALA F N 1 ATOM 4747 C CA . ALA C 3 237 ? -21.803 -10.530 -40.399 1.00 33.89 ? 215 ALA F CA 1 ATOM 4748 C C . ALA C 3 237 ? -20.689 -11.507 -40.751 1.00 38.25 ? 215 ALA F C 1 ATOM 4749 O O . ALA C 3 237 ? -20.732 -12.157 -41.798 1.00 38.95 ? 215 ALA F O 1 ATOM 4750 C CB . ALA C 3 237 ? -23.024 -11.280 -39.889 1.00 35.28 ? 215 ALA F CB 1 ATOM 4751 N N . ASN C 3 238 ? -19.687 -11.591 -39.865 1.00 34.38 ? 216 ASN F N 1 ATOM 4752 C CA . ASN C 3 238 ? -18.543 -12.494 -39.955 1.00 35.38 ? 216 ASN F CA 1 ATOM 4753 C C . ASN C 3 238 ? -18.212 -12.914 -38.520 1.00 39.48 ? 216 ASN F C 1 ATOM 4754 O O . ASN C 3 238 ? -17.391 -12.277 -37.856 1.00 38.48 ? 216 ASN F O 1 ATOM 4755 C CB . ASN C 3 238 ? -17.355 -11.816 -40.659 1.00 35.81 ? 216 ASN F CB 1 ATOM 4756 C CG . ASN C 3 238 ? -16.165 -12.717 -40.910 1.00 59.01 ? 216 ASN F CG 1 ATOM 4757 O OD1 . ASN C 3 238 ? -16.265 -13.949 -40.959 1.00 55.09 ? 216 ASN F OD1 1 ATOM 4758 N ND2 . ASN C 3 238 ? -15.005 -12.112 -41.103 1.00 50.89 ? 216 ASN F ND2 1 ATOM 4759 N N . THR C 3 239 ? -18.919 -13.954 -38.025 1.00 38.65 ? 217 THR F N 1 ATOM 4760 C CA . THR C 3 239 ? -18.806 -14.457 -36.648 1.00 37.18 ? 217 THR F CA 1 ATOM 4761 C C . THR C 3 239 ? -18.196 -15.866 -36.524 1.00 40.72 ? 217 THR F C 1 ATOM 4762 O O . THR C 3 239 ? -18.041 -16.358 -35.400 1.00 39.48 ? 217 THR F O 1 ATOM 4763 C CB . THR C 3 239 ? -20.173 -14.375 -35.936 1.00 43.17 ? 217 THR F CB 1 ATOM 4764 O OG1 . THR C 3 239 ? -21.102 -15.242 -36.591 1.00 41.72 ? 217 THR F OG1 1 ATOM 4765 C CG2 . THR C 3 239 ? -20.728 -12.953 -35.866 1.00 42.16 ? 217 THR F CG2 1 ATOM 4766 N N . GLN C 3 240 ? -17.848 -16.504 -37.668 1.00 38.04 ? 218 GLN F N 1 ATOM 4767 C CA . GLN C 3 240 ? -17.281 -17.858 -37.758 1.00 37.70 ? 218 GLN F CA 1 ATOM 4768 C C . GLN C 3 240 ? -18.247 -18.911 -37.168 1.00 39.58 ? 218 GLN F C 1 ATOM 4769 O O . GLN C 3 240 ? -17.840 -19.802 -36.415 1.00 38.72 ? 218 GLN F O 1 ATOM 4770 C CB . GLN C 3 240 ? -15.865 -17.920 -37.144 1.00 40.10 ? 218 GLN F CB 1 ATOM 4771 C CG . GLN C 3 240 ? -14.926 -18.873 -37.865 1.00 58.90 ? 218 GLN F CG 1 ATOM 4772 C CD . GLN C 3 240 ? -13.500 -18.706 -37.403 1.00 82.43 ? 218 GLN F CD 1 ATOM 4773 O OE1 . GLN C 3 240 ? -13.133 -19.066 -36.278 1.00 78.12 ? 218 GLN F OE1 1 ATOM 4774 N NE2 . GLN C 3 240 ? -12.657 -18.175 -38.275 1.00 77.41 ? 218 GLN F NE2 1 ATOM 4775 N N . LEU C 3 241 ? -19.540 -18.785 -37.521 1.00 35.13 ? 219 LEU F N 1 ATOM 4776 C CA . LEU C 3 241 ? -20.607 -19.675 -37.071 1.00 33.40 ? 219 LEU F CA 1 ATOM 4777 C C . LEU C 3 241 ? -20.518 -21.033 -37.779 1.00 37.13 ? 219 LEU F C 1 ATOM 4778 O O . LEU C 3 241 ? -20.633 -21.104 -39.005 1.00 37.38 ? 219 LEU F O 1 ATOM 4779 C CB . LEU C 3 241 ? -21.983 -19.005 -37.285 1.00 32.94 ? 219 LEU F CB 1 ATOM 4780 C CG . LEU C 3 241 ? -23.245 -19.785 -36.881 1.00 36.36 ? 219 LEU F CG 1 ATOM 4781 C CD1 . LEU C 3 241 ? -23.325 -19.986 -35.376 1.00 35.78 ? 219 LEU F CD1 1 ATOM 4782 C CD2 . LEU C 3 241 ? -24.491 -19.066 -37.354 1.00 38.80 ? 219 LEU F CD2 1 ATOM 4783 N N . VAL C 3 242 ? -20.261 -22.100 -36.997 1.00 32.99 ? 220 VAL F N 1 ATOM 4784 C CA . VAL C 3 242 ? -20.140 -23.484 -37.476 1.00 32.60 ? 220 VAL F CA 1 ATOM 4785 C C . VAL C 3 242 ? -21.037 -24.380 -36.609 1.00 35.01 ? 220 VAL F C 1 ATOM 4786 O O . VAL C 3 242 ? -20.885 -24.409 -35.386 1.00 34.28 ? 220 VAL F O 1 ATOM 4787 C CB . VAL C 3 242 ? -18.666 -23.993 -37.515 1.00 37.45 ? 220 VAL F CB 1 ATOM 4788 C CG1 . VAL C 3 242 ? -18.583 -25.418 -38.058 1.00 37.23 ? 220 VAL F CG1 1 ATOM 4789 C CG2 . VAL C 3 242 ? -17.766 -23.062 -38.327 1.00 38.77 ? 220 VAL F CG2 1 ATOM 4790 N N . LEU C 3 243 ? -21.964 -25.106 -37.248 1.00 30.84 ? 221 LEU F N 1 ATOM 4791 C CA . LEU C 3 243 ? -22.905 -25.994 -36.566 1.00 29.67 ? 221 LEU F CA 1 ATOM 4792 C C . LEU C 3 243 ? -22.274 -27.357 -36.282 1.00 33.12 ? 221 LEU F C 1 ATOM 4793 O O . LEU C 3 243 ? -21.582 -27.907 -37.141 1.00 33.28 ? 221 LEU F O 1 ATOM 4794 C CB . LEU C 3 243 ? -24.191 -26.131 -37.399 1.00 29.42 ? 221 LEU F CB 1 ATOM 4795 C CG . LEU C 3 243 ? -25.305 -25.064 -37.243 1.00 33.90 ? 221 LEU F CG 1 ATOM 4796 C CD1 . LEU C 3 243 ? -24.786 -23.649 -36.979 1.00 34.53 ? 221 LEU F CD1 1 ATOM 4797 C CD2 . LEU C 3 243 ? -26.220 -25.074 -38.436 1.00 36.51 ? 221 LEU F CD2 1 ATOM 4798 N N . GLN C 3 244 ? -22.499 -27.887 -35.067 1.00 28.88 ? 222 GLN F N 1 ATOM 4799 C CA . GLN C 3 244 ? -21.945 -29.166 -34.610 1.00 28.75 ? 222 GLN F CA 1 ATOM 4800 C C . GLN C 3 244 ? -23.001 -30.275 -34.550 1.00 31.79 ? 222 GLN F C 1 ATOM 4801 O O . GLN C 3 244 ? -24.197 -29.985 -34.478 1.00 30.89 ? 222 GLN F O 1 ATOM 4802 C CB . GLN C 3 244 ? -21.276 -28.999 -33.233 1.00 30.42 ? 222 GLN F CB 1 ATOM 4803 C CG . GLN C 3 244 ? -20.078 -28.048 -33.227 1.00 44.92 ? 222 GLN F CG 1 ATOM 4804 C CD . GLN C 3 244 ? -19.535 -27.757 -31.845 1.00 63.56 ? 222 GLN F CD 1 ATOM 4805 O OE1 . GLN C 3 244 ? -20.226 -27.866 -30.823 1.00 58.34 ? 222 GLN F OE1 1 ATOM 4806 N NE2 . GLN C 3 244 ? -18.283 -27.333 -31.791 1.00 56.94 ? 222 GLN F NE2 1 ATOM 4807 N N . ARG C 3 245 ? -22.551 -31.545 -34.561 1.00 28.38 ? 223 ARG F N 1 ATOM 4808 C CA . ARG C 3 245 ? -23.423 -32.718 -34.480 1.00 28.02 ? 223 ARG F CA 1 ATOM 4809 C C . ARG C 3 245 ? -24.061 -32.821 -33.081 1.00 31.99 ? 223 ARG F C 1 ATOM 4810 O O . ARG C 3 245 ? -23.335 -32.732 -32.085 1.00 32.00 ? 223 ARG F O 1 ATOM 4811 C CB . ARG C 3 245 ? -22.646 -33.999 -34.836 1.00 28.59 ? 223 ARG F CB 1 ATOM 4812 C CG . ARG C 3 245 ? -23.508 -35.252 -34.867 1.00 38.03 ? 223 ARG F CG 1 ATOM 4813 C CD . ARG C 3 245 ? -22.726 -36.483 -35.262 1.00 47.59 ? 223 ARG F CD 1 ATOM 4814 N NE . ARG C 3 245 ? -23.528 -37.697 -35.110 1.00 55.00 ? 223 ARG F NE 1 ATOM 4815 C CZ . ARG C 3 245 ? -24.340 -38.187 -36.042 1.00 68.82 ? 223 ARG F CZ 1 ATOM 4816 N NH1 . ARG C 3 245 ? -24.472 -37.569 -37.210 1.00 56.19 ? 223 ARG F NH1 1 ATOM 4817 N NH2 . ARG C 3 245 ? -25.028 -39.297 -35.813 1.00 55.68 ? 223 ARG F NH2 1 ATOM 4818 N N . PRO C 3 246 ? -25.404 -32.997 -32.981 1.00 28.37 ? 224 PRO F N 1 ATOM 4819 C CA . PRO C 3 246 ? -26.036 -33.083 -31.651 1.00 28.65 ? 224 PRO F CA 1 ATOM 4820 C C . PRO C 3 246 ? -25.630 -34.308 -30.836 1.00 33.57 ? 224 PRO F C 1 ATOM 4821 O O . PRO C 3 246 ? -25.256 -35.337 -31.405 1.00 33.41 ? 224 PRO F O 1 ATOM 4822 C CB . PRO C 3 246 ? -27.534 -33.084 -31.965 1.00 30.16 ? 224 PRO F CB 1 ATOM 4823 C CG . PRO C 3 246 ? -27.629 -33.607 -33.351 1.00 34.25 ? 224 PRO F CG 1 ATOM 4824 C CD . PRO C 3 246 ? -26.411 -33.100 -34.059 1.00 29.49 ? 224 PRO F CD 1 ATOM 4825 N N . ALA C 3 247 ? -25.706 -34.181 -29.496 1.00 30.84 ? 225 ALA F N 1 ATOM 4826 C CA . ALA C 3 247 ? -25.376 -35.227 -28.526 1.00 31.87 ? 225 ALA F CA 1 ATOM 4827 C C . ALA C 3 247 ? -26.327 -36.418 -28.647 1.00 36.37 ? 225 ALA F C 1 ATOM 4828 O O . ALA C 3 247 ? -27.466 -36.249 -29.094 1.00 35.56 ? 225 ALA F O 1 ATOM 4829 C CB . ALA C 3 247 ? -25.423 -34.660 -27.116 1.00 33.40 ? 225 ALA F CB 1 ATOM 4830 N N . ALA C 3 248 ? -25.848 -37.619 -28.255 1.00 33.98 ? 226 ALA F N 1 ATOM 4831 C CA . ALA C 3 248 ? -26.590 -38.883 -28.302 1.00 34.64 ? 226 ALA F CA 1 ATOM 4832 C C . ALA C 3 248 ? -27.945 -38.796 -27.595 1.00 39.18 ? 226 ALA F C 1 ATOM 4833 O O . ALA C 3 248 ? -28.005 -38.481 -26.403 1.00 39.69 ? 226 ALA F O 1 ATOM 4834 C CB . ALA C 3 248 ? -25.754 -40.006 -27.706 1.00 36.77 ? 226 ALA F CB 1 ATOM 4835 N N . GLY C 3 249 ? -29.010 -39.020 -28.366 1.00 35.33 ? 227 GLY F N 1 ATOM 4836 C CA . GLY C 3 249 ? -30.397 -38.980 -27.908 1.00 35.94 ? 227 GLY F CA 1 ATOM 4837 C C . GLY C 3 249 ? -30.867 -37.642 -27.373 1.00 39.33 ? 227 GLY F C 1 ATOM 4838 O O . GLY C 3 249 ? -31.792 -37.595 -26.558 1.00 40.21 ? 227 GLY F O 1 ATOM 4839 N N . THR C 3 250 ? -30.243 -36.546 -27.841 1.00 34.15 ? 228 THR F N 1 ATOM 4840 C CA . THR C 3 250 ? -30.529 -35.187 -27.392 1.00 33.42 ? 228 THR F CA 1 ATOM 4841 C C . THR C 3 250 ? -30.993 -34.279 -28.534 1.00 35.63 ? 228 THR F C 1 ATOM 4842 O O . THR C 3 250 ? -30.325 -34.193 -29.568 1.00 34.00 ? 228 THR F O 1 ATOM 4843 C CB . THR C 3 250 ? -29.291 -34.634 -26.654 1.00 40.73 ? 228 THR F CB 1 ATOM 4844 O OG1 . THR C 3 250 ? -28.989 -35.478 -25.543 1.00 42.19 ? 228 THR F OG1 1 ATOM 4845 C CG2 . THR C 3 250 ? -29.471 -33.204 -26.176 1.00 38.67 ? 228 THR F CG2 1 ATOM 4846 N N . VAL C 3 251 ? -32.127 -33.583 -28.326 1.00 32.41 ? 229 VAL F N 1 ATOM 4847 C CA . VAL C 3 251 ? -32.651 -32.616 -29.292 1.00 31.09 ? 229 VAL F CA 1 ATOM 4848 C C . VAL C 3 251 ? -32.146 -31.235 -28.872 1.00 34.36 ? 229 VAL F C 1 ATOM 4849 O O . VAL C 3 251 ? -32.613 -30.679 -27.874 1.00 34.61 ? 229 VAL F O 1 ATOM 4850 C CB . VAL C 3 251 ? -34.195 -32.632 -29.472 1.00 35.56 ? 229 VAL F CB 1 ATOM 4851 C CG1 . VAL C 3 251 ? -34.606 -31.779 -30.670 1.00 34.25 ? 229 VAL F CG1 1 ATOM 4852 C CG2 . VAL C 3 251 ? -34.734 -34.051 -29.617 1.00 36.30 ? 229 VAL F CG2 1 ATOM 4853 N N . HIS C 3 252 ? -31.156 -30.718 -29.616 1.00 29.80 ? 230 HIS F N 1 ATOM 4854 C CA . HIS C 3 252 ? -30.525 -29.409 -29.428 1.00 29.06 ? 230 HIS F CA 1 ATOM 4855 C C . HIS C 3 252 ? -29.717 -29.040 -30.674 1.00 31.76 ? 230 HIS F C 1 ATOM 4856 O O . HIS C 3 252 ? -29.492 -29.900 -31.531 1.00 30.94 ? 230 HIS F O 1 ATOM 4857 C CB . HIS C 3 252 ? -29.677 -29.350 -28.128 1.00 30.53 ? 230 HIS F CB 1 ATOM 4858 C CG . HIS C 3 252 ? -28.318 -29.987 -28.193 1.00 33.86 ? 230 HIS F CG 1 ATOM 4859 N ND1 . HIS C 3 252 ? -27.237 -29.426 -27.538 1.00 35.80 ? 230 HIS F ND1 1 ATOM 4860 C CD2 . HIS C 3 252 ? -27.912 -31.126 -28.803 1.00 35.58 ? 230 HIS F CD2 1 ATOM 4861 C CE1 . HIS C 3 252 ? -26.212 -30.226 -27.781 1.00 35.28 ? 230 HIS F CE1 1 ATOM 4862 N NE2 . HIS C 3 252 ? -26.566 -31.256 -28.546 1.00 35.48 ? 230 HIS F NE2 1 ATOM 4863 N N . VAL C 3 253 ? -29.314 -27.763 -30.795 1.00 27.95 ? 231 VAL F N 1 ATOM 4864 C CA . VAL C 3 253 ? -28.525 -27.289 -31.933 1.00 27.11 ? 231 VAL F CA 1 ATOM 4865 C C . VAL C 3 253 ? -27.152 -26.780 -31.426 1.00 30.94 ? 231 VAL F C 1 ATOM 4866 O O . VAL C 3 253 ? -26.995 -25.577 -31.183 1.00 30.39 ? 231 VAL F O 1 ATOM 4867 C CB . VAL C 3 253 ? -29.275 -26.260 -32.834 1.00 30.68 ? 231 VAL F CB 1 ATOM 4868 C CG1 . VAL C 3 253 ? -28.498 -25.982 -34.120 1.00 30.29 ? 231 VAL F CG1 1 ATOM 4869 C CG2 . VAL C 3 253 ? -30.696 -26.719 -33.162 1.00 30.61 ? 231 VAL F CG2 1 ATOM 4870 N N . PRO C 3 254 ? -26.158 -27.681 -31.217 1.00 27.74 ? 232 PRO F N 1 ATOM 4871 C CA . PRO C 3 254 ? -24.840 -27.212 -30.752 1.00 27.78 ? 232 PRO F CA 1 ATOM 4872 C C . PRO C 3 254 ? -24.071 -26.506 -31.866 1.00 31.20 ? 232 PRO F C 1 ATOM 4873 O O . PRO C 3 254 ? -24.196 -26.878 -33.036 1.00 30.54 ? 232 PRO F O 1 ATOM 4874 C CB . PRO C 3 254 ? -24.147 -28.492 -30.283 1.00 30.11 ? 232 PRO F CB 1 ATOM 4875 C CG . PRO C 3 254 ? -24.771 -29.573 -31.076 1.00 34.38 ? 232 PRO F CG 1 ATOM 4876 C CD . PRO C 3 254 ? -26.166 -29.144 -31.437 1.00 29.47 ? 232 PRO F CD 1 ATOM 4877 N N . TYR C 3 255 ? -23.303 -25.466 -31.504 1.00 27.85 ? 233 TYR F N 1 ATOM 4878 C CA . TYR C 3 255 ? -22.540 -24.662 -32.459 1.00 27.72 ? 233 TYR F CA 1 ATOM 4879 C C . TYR C 3 255 ? -21.283 -24.038 -31.853 1.00 32.11 ? 233 TYR F C 1 ATOM 4880 O O . TYR C 3 255 ? -21.209 -23.839 -30.638 1.00 31.86 ? 233 TYR F O 1 ATOM 4881 C CB . TYR C 3 255 ? -23.440 -23.563 -33.079 1.00 28.54 ? 233 TYR F CB 1 ATOM 4882 C CG . TYR C 3 255 ? -23.939 -22.525 -32.093 1.00 30.12 ? 233 TYR F CG 1 ATOM 4883 C CD1 . TYR C 3 255 ? -23.291 -21.301 -31.950 1.00 32.44 ? 233 TYR F CD1 1 ATOM 4884 C CD2 . TYR C 3 255 ? -25.076 -22.754 -31.323 1.00 30.63 ? 233 TYR F CD2 1 ATOM 4885 C CE1 . TYR C 3 255 ? -23.746 -20.342 -31.046 1.00 33.25 ? 233 TYR F CE1 1 ATOM 4886 C CE2 . TYR C 3 255 ? -25.532 -21.809 -30.406 1.00 31.69 ? 233 TYR F CE2 1 ATOM 4887 C CZ . TYR C 3 255 ? -24.870 -20.599 -30.278 1.00 39.22 ? 233 TYR F CZ 1 ATOM 4888 O OH . TYR C 3 255 ? -25.326 -19.659 -29.386 1.00 40.07 ? 233 TYR F OH 1 ATOM 4889 N N . SER C 3 256 ? -20.310 -23.707 -32.719 1.00 29.18 ? 234 SER F N 1 ATOM 4890 C CA . SER C 3 256 ? -19.073 -23.019 -32.359 1.00 29.85 ? 234 SER F CA 1 ATOM 4891 C C . SER C 3 256 ? -19.111 -21.656 -33.046 1.00 33.84 ? 234 SER F C 1 ATOM 4892 O O . SER C 3 256 ? -19.394 -21.575 -34.245 1.00 33.48 ? 234 SER F O 1 ATOM 4893 C CB . SER C 3 256 ? -17.846 -23.821 -32.785 1.00 34.27 ? 234 SER F CB 1 ATOM 4894 O OG . SER C 3 256 ? -17.816 -24.040 -34.185 1.00 43.78 ? 234 SER F OG 1 ATOM 4895 N N . GLN C 3 257 ? -18.895 -20.584 -32.272 1.00 30.46 ? 235 GLN F N 1 ATOM 4896 C CA . GLN C 3 257 ? -18.952 -19.212 -32.773 1.00 30.59 ? 235 GLN F CA 1 ATOM 4897 C C . GLN C 3 257 ? -18.038 -18.316 -31.950 1.00 35.32 ? 235 GLN F C 1 ATOM 4898 O O . GLN C 3 257 ? -17.941 -18.489 -30.731 1.00 34.72 ? 235 GLN F O 1 ATOM 4899 C CB . GLN C 3 257 ? -20.403 -18.702 -32.696 1.00 31.01 ? 235 GLN F CB 1 ATOM 4900 C CG . GLN C 3 257 ? -20.710 -17.478 -33.554 1.00 43.87 ? 235 GLN F CG 1 ATOM 4901 C CD . GLN C 3 257 ? -22.138 -17.004 -33.401 1.00 59.71 ? 235 GLN F CD 1 ATOM 4902 O OE1 . GLN C 3 257 ? -22.787 -17.182 -32.361 1.00 53.96 ? 235 GLN F OE1 1 ATOM 4903 N NE2 . GLN C 3 257 ? -22.652 -16.350 -34.427 1.00 51.51 ? 235 GLN F NE2 1 ATOM 4904 N N . ALA C 3 258 ? -17.377 -17.352 -32.616 1.00 33.04 ? 236 ALA F N 1 ATOM 4905 C CA . ALA C 3 258 ? -16.496 -16.386 -31.963 1.00 33.89 ? 236 ALA F CA 1 ATOM 4906 C C . ALA C 3 258 ? -17.359 -15.414 -31.139 1.00 37.46 ? 236 ALA F C 1 ATOM 4907 O O . ALA C 3 258 ? -18.338 -14.891 -31.679 1.00 36.70 ? 236 ALA F O 1 ATOM 4908 C CB . ALA C 3 258 ? -15.685 -15.629 -33.003 1.00 36.10 ? 236 ALA F CB 1 ATOM 4909 N N . PRO C 3 259 ? -17.059 -15.199 -29.830 1.00 34.24 ? 237 PRO F N 1 ATOM 4910 C CA . PRO C 3 259 ? -17.907 -14.304 -29.012 1.00 33.76 ? 237 PRO F CA 1 ATOM 4911 C C . PRO C 3 259 ? -17.993 -12.859 -29.508 1.00 38.34 ? 237 PRO F C 1 ATOM 4912 O O . PRO C 3 259 ? -17.128 -12.420 -30.264 1.00 38.92 ? 237 PRO F O 1 ATOM 4913 C CB . PRO C 3 259 ? -17.285 -14.398 -27.614 1.00 35.92 ? 237 PRO F CB 1 ATOM 4914 C CG . PRO C 3 259 ? -15.895 -14.872 -27.839 1.00 41.22 ? 237 PRO F CG 1 ATOM 4915 C CD . PRO C 3 259 ? -15.956 -15.770 -29.030 1.00 36.36 ? 237 PRO F CD 1 ATOM 4916 N N . SER C 3 260 ? -19.051 -12.131 -29.086 1.00 37.66 ? 238 SER F N 1 ATOM 4917 C CA . SER C 3 260 ? -19.338 -10.740 -29.462 1.00 35.22 ? 238 SER F CA 1 ATOM 4918 C C . SER C 3 260 ? -18.121 -9.806 -29.447 1.00 38.74 ? 238 SER F C 1 ATOM 4919 O O . SER C 3 260 ? -17.473 -9.632 -28.409 1.00 39.47 ? 238 SER F O 1 ATOM 4920 C CB . SER C 3 260 ? -20.482 -10.174 -28.623 1.00 38.39 ? 238 SER F CB 1 ATOM 4921 O OG . SER C 3 260 ? -20.798 -8.840 -28.987 1.00 44.93 ? 238 SER F OG 1 ATOM 4922 N N . GLY C 3 261 ? -17.821 -9.246 -30.618 1.00 33.97 ? 239 GLY F N 1 ATOM 4923 C CA . GLY C 3 261 ? -16.721 -8.311 -30.824 1.00 33.24 ? 239 GLY F CA 1 ATOM 4924 C C . GLY C 3 261 ? -16.942 -6.987 -30.120 1.00 36.21 ? 239 GLY F C 1 ATOM 4925 O O . GLY C 3 261 ? -15.983 -6.370 -29.647 1.00 35.99 ? 239 GLY F O 1 ATOM 4926 N N . PHE C 3 262 ? -18.222 -6.553 -30.038 1.00 32.02 ? 240 PHE F N 1 ATOM 4927 C CA . PHE C 3 262 ? -18.649 -5.324 -29.364 1.00 31.15 ? 240 PHE F CA 1 ATOM 4928 C C . PHE C 3 262 ? -18.464 -5.460 -27.853 1.00 36.59 ? 240 PHE F C 1 ATOM 4929 O O . PHE C 3 262 ? -17.947 -4.535 -27.222 1.00 36.14 ? 240 PHE F O 1 ATOM 4930 C CB . PHE C 3 262 ? -20.107 -4.981 -29.723 1.00 32.21 ? 240 PHE F CB 1 ATOM 4931 C CG . PHE C 3 262 ? -20.705 -3.803 -28.987 1.00 33.43 ? 240 PHE F CG 1 ATOM 4932 C CD1 . PHE C 3 262 ? -20.293 -2.505 -29.265 1.00 35.56 ? 240 PHE F CD1 1 ATOM 4933 C CD2 . PHE C 3 262 ? -21.703 -3.990 -28.037 1.00 36.43 ? 240 PHE F CD2 1 ATOM 4934 C CE1 . PHE C 3 262 ? -20.848 -1.417 -28.587 1.00 36.51 ? 240 PHE F CE1 1 ATOM 4935 C CE2 . PHE C 3 262 ? -22.262 -2.900 -27.363 1.00 39.34 ? 240 PHE F CE2 1 ATOM 4936 C CZ . PHE C 3 262 ? -21.834 -1.621 -27.646 1.00 36.55 ? 240 PHE F CZ 1 ATOM 4937 N N . LYS C 3 263 ? -18.814 -6.605 -27.322 1.00 34.85 ? 241 LYS F N 1 ATOM 4938 C CA . LYS C 3 263 ? -18.774 -6.867 -25.916 1.00 36.77 ? 241 LYS F CA 1 ATOM 4939 C C . LYS C 3 263 ? -17.366 -7.006 -25.421 1.00 42.35 ? 241 LYS F C 1 ATOM 4940 O O . LYS C 3 263 ? -17.074 -6.799 -24.262 1.00 43.03 ? 241 LYS F O 1 ATOM 4941 C CB . LYS C 3 263 ? -19.497 -8.158 -25.674 1.00 41.01 ? 241 LYS F CB 1 ATOM 4942 C CG . LYS C 3 263 ? -20.885 -7.979 -25.217 1.00 55.92 ? 241 LYS F CG 1 ATOM 4943 C CD . LYS C 3 263 ? -21.426 -9.247 -24.639 1.00 68.91 ? 241 LYS F CD 1 ATOM 4944 C CE . LYS C 3 263 ? -22.582 -8.920 -23.776 1.00 82.35 ? 241 LYS F CE 1 ATOM 4945 N NZ . LYS C 3 263 ? -22.667 -7.461 -23.731 1.00 91.05 ? 241 LYS F NZ 1 ATOM 4946 N N . TYR C 3 264 ? -16.482 -7.364 -26.315 1.00 39.31 ? 242 TYR F N 1 ATOM 4947 C CA . TYR C 3 264 ? -15.100 -7.463 -25.986 1.00 40.69 ? 242 TYR F CA 1 ATOM 4948 C C . TYR C 3 264 ? -14.429 -6.119 -26.224 1.00 43.20 ? 242 TYR F C 1 ATOM 4949 O O . TYR C 3 264 ? -13.651 -5.703 -25.424 1.00 44.29 ? 242 TYR F O 1 ATOM 4950 C CB . TYR C 3 264 ? -14.515 -8.606 -26.782 1.00 42.62 ? 242 TYR F CB 1 ATOM 4951 C CG . TYR C 3 264 ? -13.037 -8.631 -26.862 1.00 46.80 ? 242 TYR F CG 1 ATOM 4952 C CD1 . TYR C 3 264 ? -12.261 -8.821 -25.747 1.00 51.91 ? 242 TYR F CD1 1 ATOM 4953 C CD2 . TYR C 3 264 ? -12.404 -8.488 -28.075 1.00 47.02 ? 242 TYR F CD2 1 ATOM 4954 C CE1 . TYR C 3 264 ? -10.912 -8.833 -25.848 1.00 55.31 ? 242 TYR F CE1 1 ATOM 4955 C CE2 . TYR C 3 264 ? -11.069 -8.506 -28.170 1.00 50.28 ? 242 TYR F CE2 1 ATOM 4956 C CZ . TYR C 3 264 ? -10.335 -8.676 -27.067 1.00 61.11 ? 242 TYR F CZ 1 ATOM 4957 O OH . TYR C 3 264 ? -8.993 -8.682 -27.226 1.00 65.42 ? 242 TYR F OH 1 ATOM 4958 N N . TRP C 3 265 ? -14.724 -5.378 -27.261 1.00 37.33 ? 243 TRP F N 1 ATOM 4959 C CA . TRP C 3 265 ? -14.131 -4.054 -27.326 1.00 36.08 ? 243 TRP F CA 1 ATOM 4960 C C . TRP C 3 265 ? -14.538 -3.267 -26.122 1.00 40.25 ? 243 TRP F C 1 ATOM 4961 O O . TRP C 3 265 ? -13.847 -2.423 -25.689 1.00 40.36 ? 243 TRP F O 1 ATOM 4962 C CB . TRP C 3 265 ? -14.562 -3.327 -28.585 1.00 32.68 ? 243 TRP F CB 1 ATOM 4963 C CG . TRP C 3 265 ? -14.118 -1.943 -28.672 1.00 32.84 ? 243 TRP F CG 1 ATOM 4964 C CD1 . TRP C 3 265 ? -12.919 -1.512 -29.035 1.00 36.30 ? 243 TRP F CD1 1 ATOM 4965 C CD2 . TRP C 3 265 ? -14.898 -0.791 -28.423 1.00 31.69 ? 243 TRP F CD2 1 ATOM 4966 N NE1 . TRP C 3 265 ? -12.868 -0.158 -29.011 1.00 35.04 ? 243 TRP F NE1 1 ATOM 4967 C CE2 . TRP C 3 265 ? -14.085 0.306 -28.632 1.00 35.48 ? 243 TRP F CE2 1 ATOM 4968 C CE3 . TRP C 3 265 ? -16.207 -0.583 -28.000 1.00 32.41 ? 243 TRP F CE3 1 ATOM 4969 C CZ2 . TRP C 3 265 ? -14.524 1.572 -28.456 1.00 34.20 ? 243 TRP F CZ2 1 ATOM 4970 C CZ3 . TRP C 3 265 ? -16.632 0.664 -27.818 1.00 33.35 ? 243 TRP F CZ3 1 ATOM 4971 C CH2 . TRP C 3 265 ? -15.805 1.734 -28.043 1.00 33.91 ? 243 TRP F CH2 1 ATOM 4972 N N . LEU C 3 266 ? -15.682 -3.543 -25.572 1.00 36.82 ? 244 LEU F N 1 ATOM 4973 C CA . LEU C 3 266 ? -16.166 -2.701 -24.545 1.00 37.26 ? 244 LEU F CA 1 ATOM 4974 C C . LEU C 3 266 ? -15.423 -2.956 -23.308 1.00 43.80 ? 244 LEU F C 1 ATOM 4975 O O . LEU C 3 266 ? -15.614 -2.294 -22.328 1.00 43.82 ? 244 LEU F O 1 ATOM 4976 C CB . LEU C 3 266 ? -17.599 -3.019 -24.278 1.00 37.46 ? 244 LEU F CB 1 ATOM 4977 C CG . LEU C 3 266 ? -18.614 -1.947 -24.536 1.00 41.23 ? 244 LEU F CG 1 ATOM 4978 C CD1 . LEU C 3 266 ? -18.382 -1.381 -25.845 1.00 39.38 ? 244 LEU F CD1 1 ATOM 4979 C CD2 . LEU C 3 266 ? -19.895 -2.608 -24.522 1.00 44.88 ? 244 LEU F CD2 1 ATOM 4980 N N . LYS C 3 267 ? -14.582 -3.965 -23.325 1.00 42.43 ? 245 LYS F N 1 ATOM 4981 C CA . LYS C 3 267 ? -13.874 -4.377 -22.135 1.00 45.17 ? 245 LYS F CA 1 ATOM 4982 C C . LYS C 3 267 ? -12.450 -3.965 -22.333 1.00 49.80 ? 245 LYS F C 1 ATOM 4983 O O . LYS C 3 267 ? -11.854 -3.369 -21.492 1.00 51.57 ? 245 LYS F O 1 ATOM 4984 C CB . LYS C 3 267 ? -13.986 -5.879 -21.993 1.00 50.08 ? 245 LYS F CB 1 ATOM 4985 C CG . LYS C 3 267 ? -13.523 -6.457 -20.679 1.00 69.89 ? 245 LYS F CG 1 ATOM 4986 C CD . LYS C 3 267 ? -13.179 -7.968 -20.802 1.00 83.21 ? 245 LYS F CD 1 ATOM 4987 C CE . LYS C 3 267 ? -11.720 -8.323 -20.464 1.00 95.66 ? 245 LYS F CE 1 ATOM 4988 N NZ . LYS C 3 267 ? -11.297 -9.620 -21.074 1.00 107.23 ? 245 LYS F NZ 1 ATOM 4989 N N . GLU C 3 268 ? -11.901 -4.252 -23.481 1.00 44.86 ? 246 GLU F N 1 ATOM 4990 C CA . GLU C 3 268 ? -10.542 -3.883 -23.711 1.00 45.49 ? 246 GLU F CA 1 ATOM 4991 C C . GLU C 3 268 ? -10.356 -2.584 -24.452 1.00 47.16 ? 246 GLU F C 1 ATOM 4992 O O . GLU C 3 268 ? -9.484 -2.505 -25.270 1.00 47.93 ? 246 GLU F O 1 ATOM 4993 C CB . GLU C 3 268 ? -9.861 -4.976 -24.518 1.00 47.04 ? 246 GLU F CB 1 ATOM 4994 C CG . GLU C 3 268 ? -10.122 -6.369 -24.032 1.00 60.79 ? 246 GLU F CG 1 ATOM 4995 C CD . GLU C 3 268 ? -9.440 -6.675 -22.722 1.00 87.79 ? 246 GLU F CD 1 ATOM 4996 O OE1 . GLU C 3 268 ? -8.476 -5.977 -22.350 1.00 85.58 ? 246 GLU F OE1 1 ATOM 4997 O OE2 . GLU C 3 268 ? -9.880 -7.624 -22.052 1.00 84.72 ? 246 GLU F OE2 1 ATOM 4998 N N . ARG C 3 269 ? -11.138 -1.557 -24.184 1.00 40.86 ? 247 ARG F N 1 ATOM 4999 C CA . ARG C 3 269 ? -11.046 -0.355 -25.004 1.00 38.91 ? 247 ARG F CA 1 ATOM 5000 C C . ARG C 3 269 ? -10.048 0.627 -24.494 1.00 43.83 ? 247 ARG F C 1 ATOM 5001 O O . ARG C 3 269 ? -9.451 1.359 -25.250 1.00 43.17 ? 247 ARG F O 1 ATOM 5002 C CB . ARG C 3 269 ? -12.382 0.357 -25.178 1.00 36.47 ? 247 ARG F CB 1 ATOM 5003 C CG . ARG C 3 269 ? -13.476 -0.072 -24.314 1.00 45.36 ? 247 ARG F CG 1 ATOM 5004 C CD . ARG C 3 269 ? -14.528 0.974 -24.264 1.00 51.34 ? 247 ARG F CD 1 ATOM 5005 N NE . ARG C 3 269 ? -15.350 0.812 -23.087 1.00 58.95 ? 247 ARG F NE 1 ATOM 5006 C CZ . ARG C 3 269 ? -16.307 1.635 -22.726 1.00 72.66 ? 247 ARG F CZ 1 ATOM 5007 N NH1 . ARG C 3 269 ? -16.569 2.683 -23.442 1.00 59.45 ? 247 ARG F NH1 1 ATOM 5008 N NH2 . ARG C 3 269 ? -16.988 1.405 -21.638 1.00 60.47 ? 247 ARG F NH2 1 ATOM 5009 N N . GLY C 3 270 ? -9.875 0.665 -23.202 1.00 41.74 ? 248 GLY F N 1 ATOM 5010 C CA . GLY C 3 270 ? -8.918 1.579 -22.673 1.00 43.15 ? 248 GLY F CA 1 ATOM 5011 C C . GLY C 3 270 ? -9.561 2.899 -22.462 1.00 45.16 ? 248 GLY F C 1 ATOM 5012 O O . GLY C 3 270 ? -10.741 3.058 -22.639 1.00 42.91 ? 248 GLY F O 1 ATOM 5013 N N . ALA C 3 271 ? -8.737 3.837 -22.055 1.00 42.58 ? 249 ALA F N 1 ATOM 5014 C CA . ALA C 3 271 ? -9.117 5.222 -21.760 1.00 41.52 ? 249 ALA F CA 1 ATOM 5015 C C . ALA C 3 271 ? -9.525 5.986 -23.016 1.00 42.68 ? 249 ALA F C 1 ATOM 5016 O O . ALA C 3 271 ? -8.853 5.891 -24.046 1.00 42.04 ? 249 ALA F O 1 ATOM 5017 C CB . ALA C 3 271 ? -7.982 5.946 -21.050 1.00 44.67 ? 249 ALA F CB 1 ATOM 5018 N N . SER C 3 272 ? -10.630 6.747 -22.922 1.00 37.58 ? 250 SER F N 1 ATOM 5019 C CA . SER C 3 272 ? -11.160 7.555 -24.022 1.00 35.51 ? 250 SER F CA 1 ATOM 5020 C C . SER C 3 272 ? -10.303 8.821 -24.171 1.00 39.98 ? 250 SER F C 1 ATOM 5021 O O . SER C 3 272 ? -9.450 9.090 -23.319 1.00 41.35 ? 250 SER F O 1 ATOM 5022 C CB . SER C 3 272 ? -12.640 7.858 -23.801 1.00 37.82 ? 250 SER F CB 1 ATOM 5023 O OG . SER C 3 272 ? -12.858 8.606 -22.617 1.00 47.45 ? 250 SER F OG 1 ATOM 5024 N N . LEU C 3 273 ? -10.531 9.596 -25.258 1.00 35.29 ? 251 LEU F N 1 ATOM 5025 C CA . LEU C 3 273 ? -9.809 10.843 -25.550 1.00 35.81 ? 251 LEU F CA 1 ATOM 5026 C C . LEU C 3 273 ? -9.956 11.950 -24.496 1.00 40.87 ? 251 LEU F C 1 ATOM 5027 O O . LEU C 3 273 ? -9.082 12.807 -24.392 1.00 42.01 ? 251 LEU F O 1 ATOM 5028 C CB . LEU C 3 273 ? -10.192 11.414 -26.923 1.00 34.82 ? 251 LEU F CB 1 ATOM 5029 C CG . LEU C 3 273 ? -9.807 10.564 -28.134 1.00 39.20 ? 251 LEU F CG 1 ATOM 5030 C CD1 . LEU C 3 273 ? -10.362 11.155 -29.406 1.00 38.42 ? 251 LEU F CD1 1 ATOM 5031 C CD2 . LEU C 3 273 ? -8.298 10.408 -28.247 1.00 43.37 ? 251 LEU F CD2 1 ATOM 5032 N N . GLN C 3 274 ? -11.033 11.891 -23.683 1.00 36.97 ? 252 GLN F N 1 ATOM 5033 C CA . GLN C 3 274 ? -11.312 12.813 -22.574 1.00 38.00 ? 252 GLN F CA 1 ATOM 5034 C C . GLN C 3 274 ? -10.135 12.714 -21.578 1.00 43.63 ? 252 GLN F C 1 ATOM 5035 O O . GLN C 3 274 ? -9.785 13.707 -20.936 1.00 44.85 ? 252 GLN F O 1 ATOM 5036 C CB . GLN C 3 274 ? -12.660 12.478 -21.888 1.00 38.86 ? 252 GLN F CB 1 ATOM 5037 C CG . GLN C 3 274 ? -12.940 13.156 -20.535 1.00 56.03 ? 252 GLN F CG 1 ATOM 5038 C CD . GLN C 3 274 ? -13.150 14.649 -20.633 1.00 76.31 ? 252 GLN F CD 1 ATOM 5039 O OE1 . GLN C 3 274 ? -14.063 15.133 -21.310 1.00 71.41 ? 252 GLN F OE1 1 ATOM 5040 N NE2 . GLN C 3 274 ? -12.332 15.412 -19.921 1.00 69.95 ? 252 GLN F NE2 1 ATOM 5041 N N . HIS C 3 275 ? -9.511 11.524 -21.496 1.00 40.12 ? 253 HIS F N 1 ATOM 5042 C CA . HIS C 3 275 ? -8.395 11.221 -20.601 1.00 42.09 ? 253 HIS F CA 1 ATOM 5043 C C . HIS C 3 275 ? -7.018 11.235 -21.279 1.00 46.44 ? 253 HIS F C 1 ATOM 5044 O O . HIS C 3 275 ? -6.032 11.554 -20.614 1.00 48.44 ? 253 HIS F O 1 ATOM 5045 C CB . HIS C 3 275 ? -8.623 9.863 -19.911 1.00 43.29 ? 253 HIS F CB 1 ATOM 5046 C CG . HIS C 3 275 ? -9.982 9.713 -19.297 1.00 45.82 ? 253 HIS F CG 1 ATOM 5047 N ND1 . HIS C 3 275 ? -10.241 10.136 -18.006 1.00 49.28 ? 253 HIS F ND1 1 ATOM 5048 C CD2 . HIS C 3 275 ? -11.117 9.199 -19.825 1.00 45.51 ? 253 HIS F CD2 1 ATOM 5049 C CE1 . HIS C 3 275 ? -11.518 9.865 -17.790 1.00 47.68 ? 253 HIS F CE1 1 ATOM 5050 N NE2 . HIS C 3 275 ? -12.086 9.301 -18.856 1.00 45.77 ? 253 HIS F NE2 1 ATOM 5051 N N . THR C 3 276 ? -6.941 10.885 -22.581 1.00 41.17 ? 254 THR F N 1 ATOM 5052 C CA . THR C 3 276 ? -5.667 10.785 -23.312 1.00 42.09 ? 254 THR F CA 1 ATOM 5053 C C . THR C 3 276 ? -5.232 11.991 -24.176 1.00 45.94 ? 254 THR F C 1 ATOM 5054 O O . THR C 3 276 ? -4.046 12.084 -24.503 1.00 47.27 ? 254 THR F O 1 ATOM 5055 C CB . THR C 3 276 ? -5.583 9.454 -24.090 1.00 48.72 ? 254 THR F CB 1 ATOM 5056 O OG1 . THR C 3 276 ? -6.585 9.437 -25.105 1.00 45.68 ? 254 THR F OG1 1 ATOM 5057 C CG2 . THR C 3 276 ? -5.715 8.222 -23.190 1.00 47.69 ? 254 THR F CG2 1 ATOM 5058 N N . ALA C 3 277 ? -6.165 12.896 -24.552 1.00 44.35 ? 255 ALA F N 1 ATOM 5059 C CA . ALA C 3 277 ? -5.881 14.052 -25.419 1.00 43.17 ? 255 ALA F CA 1 ATOM 5060 C C . ALA C 3 277 ? -4.925 15.116 -24.853 1.00 46.77 ? 255 ALA F C 1 ATOM 5061 O O . ALA C 3 277 ? -5.085 15.532 -23.702 1.00 45.67 ? 255 ALA F O 1 ATOM 5062 C CB . ALA C 3 277 ? -7.174 14.708 -25.886 1.00 42.11 ? 255 ALA F CB 1 ATOM 5063 N N . PRO C 3 278 ? -3.966 15.615 -25.677 1.00 43.87 ? 256 PRO F N 1 ATOM 5064 C CA . PRO C 3 278 ? -3.055 16.675 -25.202 1.00 43.53 ? 256 PRO F CA 1 ATOM 5065 C C . PRO C 3 278 ? -3.753 18.033 -25.060 1.00 45.50 ? 256 PRO F C 1 ATOM 5066 O O . PRO C 3 278 ? -4.925 18.160 -25.417 1.00 43.81 ? 256 PRO F O 1 ATOM 5067 C CB . PRO C 3 278 ? -1.966 16.725 -26.289 1.00 46.38 ? 256 PRO F CB 1 ATOM 5068 C CG . PRO C 3 278 ? -2.195 15.527 -27.160 1.00 51.92 ? 256 PRO F CG 1 ATOM 5069 C CD . PRO C 3 278 ? -3.651 15.239 -27.068 1.00 46.25 ? 256 PRO F CD 1 ATOM 5070 N N . PHE C 3 279 ? -3.029 19.044 -24.527 1.00 42.03 ? 257 PHE F N 1 ATOM 5071 C CA . PHE C 3 279 ? -3.487 20.429 -24.313 1.00 40.27 ? 257 PHE F CA 1 ATOM 5072 C C . PHE C 3 279 ? -4.717 20.595 -23.387 1.00 43.56 ? 257 PHE F C 1 ATOM 5073 O O . PHE C 3 279 ? -5.389 21.631 -23.430 1.00 41.79 ? 257 PHE F O 1 ATOM 5074 C CB . PHE C 3 279 ? -3.650 21.198 -25.648 1.00 41.13 ? 257 PHE F CB 1 ATOM 5075 C CG . PHE C 3 279 ? -2.467 21.130 -26.587 1.00 43.75 ? 257 PHE F CG 1 ATOM 5076 C CD1 . PHE C 3 279 ? -2.500 20.320 -27.716 1.00 47.55 ? 257 PHE F CD1 1 ATOM 5077 C CD2 . PHE C 3 279 ? -1.323 21.885 -26.349 1.00 46.26 ? 257 PHE F CD2 1 ATOM 5078 C CE1 . PHE C 3 279 ? -1.409 20.262 -28.589 1.00 49.65 ? 257 PHE F CE1 1 ATOM 5079 C CE2 . PHE C 3 279 ? -0.231 21.823 -27.220 1.00 50.23 ? 257 PHE F CE2 1 ATOM 5080 C CZ . PHE C 3 279 ? -0.282 21.013 -28.334 1.00 49.11 ? 257 PHE F CZ 1 ATOM 5081 N N . GLY C 3 280 ? -4.965 19.589 -22.544 1.00 41.33 ? 258 GLY F N 1 ATOM 5082 C CA . GLY C 3 280 ? -6.063 19.563 -21.581 1.00 40.70 ? 258 GLY F CA 1 ATOM 5083 C C . GLY C 3 280 ? -7.456 19.583 -22.178 1.00 44.10 ? 258 GLY F C 1 ATOM 5084 O O . GLY C 3 280 ? -8.370 20.157 -21.578 1.00 42.76 ? 258 GLY F O 1 ATOM 5085 N N . CYS C 3 281 ? -7.629 18.949 -23.359 1.00 41.58 ? 259 CYS F N 1 ATOM 5086 C CA . CYS C 3 281 ? -8.905 18.870 -24.079 1.00 40.92 ? 259 CYS F CA 1 ATOM 5087 C C . CYS C 3 281 ? -9.987 18.162 -23.281 1.00 44.90 ? 259 CYS F C 1 ATOM 5088 O O . CYS C 3 281 ? -9.738 17.106 -22.697 1.00 45.50 ? 259 CYS F O 1 ATOM 5089 C CB . CYS C 3 281 ? -8.727 18.216 -25.447 1.00 42.00 ? 259 CYS F CB 1 ATOM 5090 S SG . CYS C 3 281 ? -7.725 19.172 -26.612 1.00 45.96 ? 259 CYS F SG 1 ATOM 5091 N N . GLN C 3 282 ? -11.190 18.746 -23.277 1.00 40.56 ? 260 GLN F N 1 ATOM 5092 C CA . GLN C 3 282 ? -12.379 18.173 -22.654 1.00 40.41 ? 260 GLN F CA 1 ATOM 5093 C C . GLN C 3 282 ? -13.218 17.665 -23.825 1.00 44.31 ? 260 GLN F C 1 ATOM 5094 O O . GLN C 3 282 ? -13.442 18.411 -24.782 1.00 43.28 ? 260 GLN F O 1 ATOM 5095 C CB . GLN C 3 282 ? -13.155 19.223 -21.829 1.00 40.92 ? 260 GLN F CB 1 ATOM 5096 C CG . GLN C 3 282 ? -12.345 19.927 -20.732 1.00 58.21 ? 260 GLN F CG 1 ATOM 5097 C CD . GLN C 3 282 ? -11.951 19.009 -19.598 1.00 80.46 ? 260 GLN F CD 1 ATOM 5098 O OE1 . GLN C 3 282 ? -10.820 18.518 -19.530 1.00 77.35 ? 260 GLN F OE1 1 ATOM 5099 N NE2 . GLN C 3 282 ? -12.874 18.760 -18.680 1.00 73.07 ? 260 GLN F NE2 1 ATOM 5100 N N . ILE C 3 283 ? -13.615 16.388 -23.794 1.00 41.75 ? 261 ILE F N 1 ATOM 5101 C CA . ILE C 3 283 ? -14.379 15.796 -24.892 1.00 41.75 ? 261 ILE F CA 1 ATOM 5102 C C . ILE C 3 283 ? -15.845 15.575 -24.510 1.00 45.33 ? 261 ILE F C 1 ATOM 5103 O O . ILE C 3 283 ? -16.134 14.919 -23.508 1.00 45.36 ? 261 ILE F O 1 ATOM 5104 C CB . ILE C 3 283 ? -13.674 14.532 -25.481 1.00 46.25 ? 261 ILE F CB 1 ATOM 5105 C CG1 . ILE C 3 283 ? -12.175 14.789 -25.848 1.00 47.27 ? 261 ILE F CG1 1 ATOM 5106 C CG2 . ILE C 3 283 ? -14.454 13.915 -26.652 1.00 47.27 ? 261 ILE F CG2 1 ATOM 5107 C CD1 . ILE C 3 283 ? -11.848 15.845 -27.004 1.00 54.22 ? 261 ILE F CD1 1 ATOM 5108 N N . ALA C 3 284 ? -16.759 16.147 -25.315 1.00 41.25 ? 262 ALA F N 1 ATOM 5109 C CA . ALA C 3 284 ? -18.209 16.054 -25.141 1.00 40.83 ? 262 ALA F CA 1 ATOM 5110 C C . ALA C 3 284 ? -18.779 15.406 -26.404 1.00 45.24 ? 262 ALA F C 1 ATOM 5111 O O . ALA C 3 284 ? -18.108 15.377 -27.437 1.00 45.04 ? 262 ALA F O 1 ATOM 5112 C CB . ALA C 3 284 ? -18.799 17.441 -24.938 1.00 40.62 ? 262 ALA F CB 1 ATOM 5113 N N . THR C 3 285 ? -20.014 14.882 -26.314 1.00 42.12 ? 263 THR F N 1 ATOM 5114 C CA . THR C 3 285 ? -20.732 14.250 -27.419 1.00 42.54 ? 263 THR F CA 1 ATOM 5115 C C . THR C 3 285 ? -22.117 14.876 -27.599 1.00 46.22 ? 263 THR F C 1 ATOM 5116 O O . THR C 3 285 ? -22.521 15.694 -26.770 1.00 45.19 ? 263 THR F O 1 ATOM 5117 C CB . THR C 3 285 ? -20.745 12.719 -27.268 1.00 51.45 ? 263 THR F CB 1 ATOM 5118 O OG1 . THR C 3 285 ? -19.404 12.231 -27.287 1.00 51.71 ? 263 THR F OG1 1 ATOM 5119 C CG2 . THR C 3 285 ? -21.584 12.023 -28.349 1.00 50.05 ? 263 THR F CG2 1 ATOM 5120 N N . ASN C 3 286 ? -22.846 14.469 -28.664 1.00 43.44 ? 264 ASN F N 1 ATOM 5121 C CA . ASN C 3 286 ? -24.189 14.929 -29.036 1.00 43.22 ? 264 ASN F CA 1 ATOM 5122 C C . ASN C 3 286 ? -24.254 16.475 -29.227 1.00 46.08 ? 264 ASN F C 1 ATOM 5123 O O . ASN C 3 286 ? -24.998 17.143 -28.501 1.00 45.35 ? 264 ASN F O 1 ATOM 5124 C CB . ASN C 3 286 ? -25.334 14.380 -28.155 1.00 44.76 ? 264 ASN F CB 1 ATOM 5125 C CG . ASN C 3 286 ? -26.711 14.469 -28.772 1.00 70.73 ? 264 ASN F CG 1 ATOM 5126 O OD1 . ASN C 3 286 ? -26.958 14.004 -29.892 1.00 66.32 ? 264 ASN F OD1 1 ATOM 5127 N ND2 . ASN C 3 286 ? -27.655 15.026 -28.028 1.00 62.84 ? 264 ASN F ND2 1 ATOM 5128 N N . PRO C 3 287 ? -23.495 17.080 -30.180 1.00 42.23 ? 265 PRO F N 1 ATOM 5129 C CA . PRO C 3 287 ? -22.542 16.475 -31.132 1.00 42.51 ? 265 PRO F CA 1 ATOM 5130 C C . PRO C 3 287 ? -21.134 16.309 -30.549 1.00 45.83 ? 265 PRO F C 1 ATOM 5131 O O . PRO C 3 287 ? -20.810 16.958 -29.549 1.00 44.72 ? 265 PRO F O 1 ATOM 5132 C CB . PRO C 3 287 ? -22.569 17.466 -32.299 1.00 44.18 ? 265 PRO F CB 1 ATOM 5133 C CG . PRO C 3 287 ? -22.793 18.807 -31.639 1.00 47.65 ? 265 PRO F CG 1 ATOM 5134 C CD . PRO C 3 287 ? -23.570 18.546 -30.362 1.00 43.05 ? 265 PRO F CD 1 ATOM 5135 N N . VAL C 3 288 ? -20.293 15.448 -31.166 1.00 42.80 ? 266 VAL F N 1 ATOM 5136 C CA . VAL C 3 288 ? -18.921 15.253 -30.682 1.00 42.56 ? 266 VAL F CA 1 ATOM 5137 C C . VAL C 3 288 ? -18.074 16.503 -30.928 1.00 45.26 ? 266 VAL F C 1 ATOM 5138 O O . VAL C 3 288 ? -18.101 17.065 -32.028 1.00 44.84 ? 266 VAL F O 1 ATOM 5139 C CB . VAL C 3 288 ? -18.226 13.913 -31.061 1.00 47.77 ? 266 VAL F CB 1 ATOM 5140 C CG1 . VAL C 3 288 ? -19.102 12.713 -30.711 1.00 48.22 ? 266 VAL F CG1 1 ATOM 5141 C CG2 . VAL C 3 288 ? -17.802 13.871 -32.525 1.00 48.33 ? 266 VAL F CG2 1 ATOM 5142 N N . ARG C 3 289 ? -17.402 16.985 -29.873 1.00 40.94 ? 267 ARG F N 1 ATOM 5143 C CA . ARG C 3 289 ? -16.616 18.217 -29.922 1.00 39.98 ? 267 ARG F CA 1 ATOM 5144 C C . ARG C 3 289 ? -15.459 18.252 -28.925 1.00 43.42 ? 267 ARG F C 1 ATOM 5145 O O . ARG C 3 289 ? -15.521 17.604 -27.877 1.00 43.18 ? 267 ARG F O 1 ATOM 5146 C CB . ARG C 3 289 ? -17.538 19.445 -29.730 1.00 39.47 ? 267 ARG F CB 1 ATOM 5147 C CG . ARG C 3 289 ? -18.341 19.449 -28.424 1.00 50.04 ? 267 ARG F CG 1 ATOM 5148 C CD . ARG C 3 289 ? -19.644 20.212 -28.553 1.00 60.14 ? 267 ARG F CD 1 ATOM 5149 N NE . ARG C 3 289 ? -20.285 20.418 -27.254 1.00 69.26 ? 267 ARG F NE 1 ATOM 5150 C CZ . ARG C 3 289 ? -21.208 19.616 -26.733 1.00 84.66 ? 267 ARG F CZ 1 ATOM 5151 N NH1 . ARG C 3 289 ? -21.615 18.541 -27.397 1.00 73.08 ? 267 ARG F NH1 1 ATOM 5152 N NH2 . ARG C 3 289 ? -21.733 19.883 -25.545 1.00 71.80 ? 267 ARG F NH2 1 ATOM 5153 N N . ALA C 3 290 ? -14.415 19.031 -29.256 1.00 39.58 ? 268 ALA F N 1 ATOM 5154 C CA . ALA C 3 290 ? -13.243 19.250 -28.414 1.00 39.35 ? 268 ALA F CA 1 ATOM 5155 C C . ALA C 3 290 ? -13.431 20.603 -27.725 1.00 41.82 ? 268 ALA F C 1 ATOM 5156 O O . ALA C 3 290 ? -13.529 21.633 -28.399 1.00 40.90 ? 268 ALA F O 1 ATOM 5157 C CB . ALA C 3 290 ? -11.979 19.247 -29.261 1.00 40.78 ? 268 ALA F CB 1 ATOM 5158 N N . VAL C 3 291 ? -13.556 20.586 -26.389 1.00 37.92 ? 269 VAL F N 1 ATOM 5159 C CA . VAL C 3 291 ? -13.795 21.787 -25.583 1.00 36.86 ? 269 VAL F CA 1 ATOM 5160 C C . VAL C 3 291 ? -12.558 22.153 -24.753 1.00 40.60 ? 269 VAL F C 1 ATOM 5161 O O . VAL C 3 291 ? -11.952 21.283 -24.128 1.00 40.83 ? 269 VAL F O 1 ATOM 5162 C CB . VAL C 3 291 ? -15.082 21.675 -24.704 1.00 40.56 ? 269 VAL F CB 1 ATOM 5163 C CG1 . VAL C 3 291 ? -15.503 23.039 -24.152 1.00 39.67 ? 269 VAL F CG1 1 ATOM 5164 C CG2 . VAL C 3 291 ? -16.240 21.039 -25.475 1.00 40.45 ? 269 VAL F CG2 1 ATOM 5165 N N . ASN C 3 292 ? -12.197 23.452 -24.762 1.00 36.46 ? 270 ASN F N 1 ATOM 5166 C CA . ASN C 3 292 ? -11.093 24.056 -24.008 1.00 36.33 ? 270 ASN F CA 1 ATOM 5167 C C . ASN C 3 292 ? -9.695 23.454 -24.255 1.00 41.11 ? 270 ASN F C 1 ATOM 5168 O O . ASN C 3 292 ? -8.942 23.213 -23.305 1.00 41.24 ? 270 ASN F O 1 ATOM 5169 C CB . ASN C 3 292 ? -11.434 24.175 -22.505 1.00 36.71 ? 270 ASN F CB 1 ATOM 5170 C CG . ASN C 3 292 ? -12.806 24.738 -22.194 1.00 55.05 ? 270 ASN F CG 1 ATOM 5171 O OD1 . ASN C 3 292 ? -13.387 25.520 -22.954 1.00 47.56 ? 270 ASN F OD1 1 ATOM 5172 N ND2 . ASN C 3 292 ? -13.354 24.351 -21.055 1.00 46.75 ? 270 ASN F ND2 1 ATOM 5173 N N . CYS C 3 293 ? -9.341 23.239 -25.536 1.00 38.05 ? 271 CYS F N 1 ATOM 5174 C CA . CYS C 3 293 ? -8.021 22.737 -25.920 1.00 38.91 ? 271 CYS F CA 1 ATOM 5175 C C . CYS C 3 293 ? -7.059 23.924 -25.865 1.00 42.53 ? 271 CYS F C 1 ATOM 5176 O O . CYS C 3 293 ? -7.169 24.839 -26.684 1.00 41.43 ? 271 CYS F O 1 ATOM 5177 C CB . CYS C 3 293 ? -8.054 22.101 -27.308 1.00 39.71 ? 271 CYS F CB 1 ATOM 5178 S SG . CYS C 3 293 ? -8.992 20.555 -27.395 1.00 44.19 ? 271 CYS F SG 1 ATOM 5179 N N . ALA C 3 294 ? -6.161 23.940 -24.863 1.00 39.69 ? 272 ALA F N 1 ATOM 5180 C CA . ALA C 3 294 ? -5.202 25.029 -24.665 1.00 39.44 ? 272 ALA F CA 1 ATOM 5181 C C . ALA C 3 294 ? -4.028 24.969 -25.658 1.00 44.19 ? 272 ALA F C 1 ATOM 5182 O O . ALA C 3 294 ? -2.907 24.602 -25.292 1.00 44.84 ? 272 ALA F O 1 ATOM 5183 C CB . ALA C 3 294 ? -4.712 25.050 -23.222 1.00 40.67 ? 272 ALA F CB 1 ATOM 5184 N N . VAL C 3 295 ? -4.303 25.332 -26.925 1.00 40.49 ? 273 VAL F N 1 ATOM 5185 C CA . VAL C 3 295 ? -3.318 25.328 -28.009 1.00 41.17 ? 273 VAL F CA 1 ATOM 5186 C C . VAL C 3 295 ? -3.387 26.608 -28.864 1.00 44.55 ? 273 VAL F C 1 ATOM 5187 O O . VAL C 3 295 ? -4.461 26.991 -29.335 1.00 43.20 ? 273 VAL F O 1 ATOM 5188 C CB . VAL C 3 295 ? -3.319 23.999 -28.831 1.00 46.04 ? 273 VAL F CB 1 ATOM 5189 C CG1 . VAL C 3 295 ? -4.655 23.746 -29.534 1.00 45.09 ? 273 VAL F CG1 1 ATOM 5190 C CG2 . VAL C 3 295 ? -2.151 23.931 -29.816 1.00 47.03 ? 273 VAL F CG2 1 ATOM 5191 N N . GLY C 3 296 ? -2.236 27.260 -29.016 1.00 41.72 ? 274 GLY F N 1 ATOM 5192 C CA . GLY C 3 296 ? -2.086 28.483 -29.794 1.00 41.00 ? 274 GLY F CA 1 ATOM 5193 C C . GLY C 3 296 ? -2.707 29.714 -29.167 1.00 43.65 ? 274 GLY F C 1 ATOM 5194 O O . GLY C 3 296 ? -2.940 29.756 -27.955 1.00 42.84 ? 274 GLY F O 1 ATOM 5195 N N . ASN C 3 297 ? -2.964 30.730 -30.006 1.00 39.84 ? 275 ASN F N 1 ATOM 5196 C CA . ASN C 3 297 ? -3.549 32.014 -29.613 1.00 38.70 ? 275 ASN F CA 1 ATOM 5197 C C . ASN C 3 297 ? -4.832 32.333 -30.394 1.00 42.31 ? 275 ASN F C 1 ATOM 5198 O O . ASN C 3 297 ? -5.174 31.622 -31.344 1.00 42.06 ? 275 ASN F O 1 ATOM 5199 C CB . ASN C 3 297 ? -2.515 33.148 -29.742 1.00 39.13 ? 275 ASN F CB 1 ATOM 5200 C CG . ASN C 3 297 ? -1.842 33.239 -31.093 1.00 60.62 ? 275 ASN F CG 1 ATOM 5201 O OD1 . ASN C 3 297 ? -0.715 32.770 -31.284 1.00 55.37 ? 275 ASN F OD1 1 ATOM 5202 N ND2 . ASN C 3 297 ? -2.508 33.857 -32.058 1.00 51.72 ? 275 ASN F ND2 1 ATOM 5203 N N . MET C 3 298 ? -5.537 33.405 -29.989 1.00 38.60 ? 276 MET F N 1 ATOM 5204 C CA . MET C 3 298 ? -6.780 33.830 -30.622 1.00 38.09 ? 276 MET F CA 1 ATOM 5205 C C . MET C 3 298 ? -6.842 35.346 -30.890 1.00 41.44 ? 276 MET F C 1 ATOM 5206 O O . MET C 3 298 ? -6.936 36.134 -29.943 1.00 40.56 ? 276 MET F O 1 ATOM 5207 C CB . MET C 3 298 ? -7.989 33.364 -29.797 1.00 40.17 ? 276 MET F CB 1 ATOM 5208 C CG . MET C 3 298 ? -9.312 33.535 -30.514 1.00 43.72 ? 276 MET F CG 1 ATOM 5209 S SD . MET C 3 298 ? -10.713 33.238 -29.420 1.00 47.76 ? 276 MET F SD 1 ATOM 5210 C CE . MET C 3 298 ? -10.723 31.455 -29.391 1.00 44.97 ? 276 MET F CE 1 ATOM 5211 N N . PRO C 3 299 ? -6.842 35.765 -32.178 1.00 38.25 ? 277 PRO F N 1 ATOM 5212 C CA . PRO C 3 299 ? -6.960 37.200 -32.485 1.00 37.75 ? 277 PRO F CA 1 ATOM 5213 C C . PRO C 3 299 ? -8.396 37.682 -32.281 1.00 41.09 ? 277 PRO F C 1 ATOM 5214 O O . PRO C 3 299 ? -9.342 36.966 -32.616 1.00 40.56 ? 277 PRO F O 1 ATOM 5215 C CB . PRO C 3 299 ? -6.537 37.292 -33.962 1.00 40.04 ? 277 PRO F CB 1 ATOM 5216 C CG . PRO C 3 299 ? -6.073 35.910 -34.351 1.00 45.15 ? 277 PRO F CG 1 ATOM 5217 C CD . PRO C 3 299 ? -6.748 34.970 -33.414 1.00 40.43 ? 277 PRO F CD 1 ATOM 5218 N N . ILE C 3 300 ? -8.556 38.880 -31.697 1.00 37.51 ? 278 ILE F N 1 ATOM 5219 C CA . ILE C 3 300 ? -9.863 39.479 -31.417 1.00 37.20 ? 278 ILE F CA 1 ATOM 5220 C C . ILE C 3 300 ? -9.943 40.912 -31.962 1.00 41.37 ? 278 ILE F C 1 ATOM 5221 O O . ILE C 3 300 ? -9.090 41.744 -31.649 1.00 40.87 ? 278 ILE F O 1 ATOM 5222 C CB . ILE C 3 300 ? -10.240 39.347 -29.904 1.00 40.10 ? 278 ILE F CB 1 ATOM 5223 C CG1 . ILE C 3 300 ? -10.615 37.882 -29.560 1.00 40.55 ? 278 ILE F CG1 1 ATOM 5224 C CG2 . ILE C 3 300 ? -11.376 40.309 -29.499 1.00 40.82 ? 278 ILE F CG2 1 ATOM 5225 C CD1 . ILE C 3 300 ? -10.474 37.485 -28.100 1.00 47.77 ? 278 ILE F CD1 1 ATOM 5226 N N . SER C 3 301 ? -10.971 41.179 -32.786 1.00 38.44 ? 279 SER F N 1 ATOM 5227 C CA . SER C 3 301 ? -11.240 42.485 -33.388 1.00 38.64 ? 279 SER F CA 1 ATOM 5228 C C . SER C 3 301 ? -12.543 43.046 -32.817 1.00 42.87 ? 279 SER F C 1 ATOM 5229 O O . SER C 3 301 ? -13.578 42.377 -32.877 1.00 42.59 ? 279 SER F O 1 ATOM 5230 C CB . SER C 3 301 ? -11.325 42.367 -34.907 1.00 42.73 ? 279 SER F CB 1 ATOM 5231 O OG . SER C 3 301 ? -11.612 43.615 -35.518 1.00 52.05 ? 279 SER F OG 1 ATOM 5232 N N . ILE C 3 302 ? -12.480 44.254 -32.223 1.00 39.75 ? 280 ILE F N 1 ATOM 5233 C CA . ILE C 3 302 ? -13.645 44.925 -31.634 1.00 40.01 ? 280 ILE F CA 1 ATOM 5234 C C . ILE C 3 302 ? -13.824 46.314 -32.250 1.00 44.49 ? 280 ILE F C 1 ATOM 5235 O O . ILE C 3 302 ? -12.962 47.179 -32.082 1.00 43.95 ? 280 ILE F O 1 ATOM 5236 C CB . ILE C 3 302 ? -13.623 44.990 -30.071 1.00 43.00 ? 280 ILE F CB 1 ATOM 5237 C CG1 . ILE C 3 302 ? -13.111 43.683 -29.421 1.00 42.99 ? 280 ILE F CG1 1 ATOM 5238 C CG2 . ILE C 3 302 ? -15.007 45.383 -29.523 1.00 44.28 ? 280 ILE F CG2 1 ATOM 5239 C CD1 . ILE C 3 302 ? -12.381 43.868 -28.087 1.00 50.38 ? 280 ILE F CD1 1 ATOM 5240 N N . ASP C 3 303 ? -14.946 46.522 -32.954 1.00 41.76 ? 281 ASP F N 1 ATOM 5241 C CA . ASP C 3 303 ? -15.275 47.810 -33.554 1.00 42.33 ? 281 ASP F CA 1 ATOM 5242 C C . ASP C 3 303 ? -16.138 48.579 -32.548 1.00 46.68 ? 281 ASP F C 1 ATOM 5243 O O . ASP C 3 303 ? -17.359 48.400 -32.506 1.00 46.80 ? 281 ASP F O 1 ATOM 5244 C CB . ASP C 3 303 ? -15.992 47.623 -34.906 1.00 44.90 ? 281 ASP F CB 1 ATOM 5245 C CG . ASP C 3 303 ? -15.918 48.833 -35.819 1.00 56.63 ? 281 ASP F CG 1 ATOM 5246 O OD1 . ASP C 3 303 ? -16.482 49.890 -35.455 1.00 58.00 ? 281 ASP F OD1 1 ATOM 5247 O OD2 . ASP C 3 303 ? -15.323 48.716 -36.911 1.00 62.93 ? 281 ASP F OD2 1 ATOM 5248 N N . ILE C 3 304 ? -15.481 49.389 -31.696 1.00 38.34 ? 282 ILE F N 1 ATOM 5249 C CA . ILE C 3 304 ? -16.124 50.198 -30.652 1.00 38.29 ? 282 ILE F CA 1 ATOM 5250 C C . ILE C 3 304 ? -16.721 51.472 -31.286 1.00 42.56 ? 282 ILE F C 1 ATOM 5251 O O . ILE C 3 304 ? -15.995 52.183 -31.989 1.00 42.05 ? 282 ILE F O 1 ATOM 5252 C CB . ILE C 3 304 ? -15.143 50.508 -29.474 1.00 41.37 ? 282 ILE F CB 1 ATOM 5253 C CG1 . ILE C 3 304 ? -14.492 49.216 -28.930 1.00 41.72 ? 282 ILE F CG1 1 ATOM 5254 C CG2 . ILE C 3 304 ? -15.840 51.278 -28.339 1.00 42.17 ? 282 ILE F CG2 1 ATOM 5255 C CD1 . ILE C 3 304 ? -13.036 49.353 -28.552 1.00 48.40 ? 282 ILE F CD1 1 ATOM 5256 N N . PRO C 3 305 ? -18.030 51.774 -31.066 1.00 39.52 ? 283 PRO F N 1 ATOM 5257 C CA . PRO C 3 305 ? -18.618 52.981 -31.680 1.00 39.48 ? 283 PRO F CA 1 ATOM 5258 C C . PRO C 3 305 ? -18.068 54.295 -31.126 1.00 43.90 ? 283 PRO F C 1 ATOM 5259 O O . PRO C 3 305 ? -17.580 54.331 -29.994 1.00 43.42 ? 283 PRO F O 1 ATOM 5260 C CB . PRO C 3 305 ? -20.116 52.826 -31.409 1.00 41.17 ? 283 PRO F CB 1 ATOM 5261 C CG . PRO C 3 305 ? -20.193 51.980 -30.195 1.00 45.58 ? 283 PRO F CG 1 ATOM 5262 C CD . PRO C 3 305 ? -19.036 51.031 -30.277 1.00 41.08 ? 283 PRO F CD 1 ATOM 5263 N N . GLU C 3 306 ? -18.150 55.369 -31.938 1.00 40.99 ? 284 GLU F N 1 ATOM 5264 C CA . GLU C 3 306 ? -17.664 56.712 -31.602 1.00 41.10 ? 284 GLU F CA 1 ATOM 5265 C C . GLU C 3 306 ? -18.253 57.315 -30.321 1.00 45.66 ? 284 GLU F C 1 ATOM 5266 O O . GLU C 3 306 ? -17.524 57.974 -29.579 1.00 45.18 ? 284 GLU F O 1 ATOM 5267 C CB . GLU C 3 306 ? -17.745 57.679 -32.800 1.00 42.44 ? 284 GLU F CB 1 ATOM 5268 C CG . GLU C 3 306 ? -19.131 57.904 -33.388 1.00 52.56 ? 284 GLU F CG 1 ATOM 5269 C CD . GLU C 3 306 ? -19.165 58.787 -34.622 1.00 71.53 ? 284 GLU F CD 1 ATOM 5270 O OE1 . GLU C 3 306 ? -19.759 58.360 -35.638 1.00 65.11 ? 284 GLU F OE1 1 ATOM 5271 O OE2 . GLU C 3 306 ? -18.596 59.901 -34.578 1.00 64.72 ? 284 GLU F OE2 1 ATOM 5272 N N . ALA C 3 307 ? -19.546 57.042 -30.041 1.00 42.82 ? 285 ALA F N 1 ATOM 5273 C CA . ALA C 3 307 ? -20.276 57.521 -28.861 1.00 42.95 ? 285 ALA F CA 1 ATOM 5274 C C . ALA C 3 307 ? -19.689 57.037 -27.527 1.00 47.45 ? 285 ALA F C 1 ATOM 5275 O O . ALA C 3 307 ? -19.802 57.744 -26.523 1.00 47.25 ? 285 ALA F O 1 ATOM 5276 C CB . ALA C 3 307 ? -21.741 57.129 -28.960 1.00 43.67 ? 285 ALA F CB 1 ATOM 5277 N N . ALA C 3 308 ? -19.062 55.845 -27.520 1.00 44.27 ? 286 ALA F N 1 ATOM 5278 C CA . ALA C 3 308 ? -18.440 55.248 -26.335 1.00 44.29 ? 286 ALA F CA 1 ATOM 5279 C C . ALA C 3 308 ? -17.179 56.000 -25.886 1.00 48.65 ? 286 ALA F C 1 ATOM 5280 O O . ALA C 3 308 ? -16.851 55.979 -24.698 1.00 48.24 ? 286 ALA F O 1 ATOM 5281 C CB . ALA C 3 308 ? -18.113 53.787 -26.597 1.00 44.96 ? 286 ALA F CB 1 ATOM 5282 N N . PHE C 3 309 ? -16.483 56.664 -26.830 1.00 45.60 ? 287 PHE F N 1 ATOM 5283 C CA . PHE C 3 309 ? -15.257 57.420 -26.563 1.00 45.61 ? 287 PHE F CA 1 ATOM 5284 C C . PHE C 3 309 ? -15.515 58.853 -26.093 1.00 50.00 ? 287 PHE F C 1 ATOM 5285 O O . PHE C 3 309 ? -16.481 59.488 -26.521 1.00 49.47 ? 287 PHE F O 1 ATOM 5286 C CB . PHE C 3 309 ? -14.338 57.426 -27.796 1.00 47.33 ? 287 PHE F CB 1 ATOM 5287 C CG . PHE C 3 309 ? -13.757 56.081 -28.164 1.00 48.78 ? 287 PHE F CG 1 ATOM 5288 C CD1 . PHE C 3 309 ? -12.612 55.605 -27.536 1.00 51.86 ? 287 PHE F CD1 1 ATOM 5289 C CD2 . PHE C 3 309 ? -14.335 55.305 -29.161 1.00 50.86 ? 287 PHE F CD2 1 ATOM 5290 C CE1 . PHE C 3 309 ? -12.069 54.364 -27.884 1.00 52.75 ? 287 PHE F CE1 1 ATOM 5291 C CE2 . PHE C 3 309 ? -13.788 54.066 -29.511 1.00 53.67 ? 287 PHE F CE2 1 ATOM 5292 C CZ . PHE C 3 309 ? -12.661 53.603 -28.869 1.00 51.79 ? 287 PHE F CZ 1 ATOM 5293 N N . THR C 3 310 ? -14.628 59.355 -25.217 1.00 47.08 ? 288 THR F N 1 ATOM 5294 C CA . THR C 3 310 ? -14.655 60.715 -24.665 1.00 47.19 ? 288 THR F CA 1 ATOM 5295 C C . THR C 3 310 ? -13.290 61.365 -24.893 1.00 51.44 ? 288 THR F C 1 ATOM 5296 O O . THR C 3 310 ? -12.267 60.713 -24.673 1.00 50.99 ? 288 THR F O 1 ATOM 5297 C CB . THR C 3 310 ? -15.045 60.710 -23.174 1.00 55.98 ? 288 THR F CB 1 ATOM 5298 O OG1 . THR C 3 310 ? -14.249 59.755 -22.469 1.00 56.11 ? 288 THR F OG1 1 ATOM 5299 C CG2 . THR C 3 310 ? -16.527 60.430 -22.950 1.00 54.81 ? 288 THR F CG2 1 ATOM 5300 N N . ARG C 3 311 ? -13.271 62.635 -25.347 1.00 48.37 ? 289 ARG F N 1 ATOM 5301 C CA . ARG C 3 311 ? -12.033 63.378 -25.622 1.00 48.40 ? 289 ARG F CA 1 ATOM 5302 C C . ARG C 3 311 ? -11.202 63.627 -24.358 1.00 52.81 ? 289 ARG F C 1 ATOM 5303 O O . ARG C 3 311 ? -11.765 63.736 -23.266 1.00 52.49 ? 289 ARG F O 1 ATOM 5304 C CB . ARG C 3 311 ? -12.322 64.705 -26.341 1.00 48.68 ? 289 ARG F CB 1 ATOM 5305 C CG . ARG C 3 311 ? -12.770 64.558 -27.794 1.00 59.00 ? 289 ARG F CG 1 ATOM 5306 C CD . ARG C 3 311 ? -12.666 65.867 -28.559 1.00 68.99 ? 289 ARG F CD 1 ATOM 5307 N NE . ARG C 3 311 ? -13.569 66.898 -28.042 1.00 78.07 ? 289 ARG F NE 1 ATOM 5308 C CZ . ARG C 3 311 ? -13.464 68.194 -28.318 1.00 92.61 ? 289 ARG F CZ 1 ATOM 5309 N NH1 . ARG C 3 311 ? -12.493 68.637 -29.108 1.00 80.17 ? 289 ARG F NH1 1 ATOM 5310 N NH2 . ARG C 3 311 ? -14.327 69.059 -27.802 1.00 79.35 ? 289 ARG F NH2 1 ATOM 5311 N N . VAL C 3 312 ? -9.861 63.718 -24.522 1.00 49.71 ? 290 VAL F N 1 ATOM 5312 C CA . VAL C 3 312 ? -8.868 63.950 -23.455 1.00 49.71 ? 290 VAL F CA 1 ATOM 5313 C C . VAL C 3 312 ? -9.180 65.239 -22.663 1.00 54.20 ? 290 VAL F C 1 ATOM 5314 O O . VAL C 3 312 ? -9.029 65.254 -21.439 1.00 53.79 ? 290 VAL F O 1 ATOM 5315 C CB . VAL C 3 312 ? -7.399 63.927 -23.990 1.00 53.53 ? 290 VAL F CB 1 ATOM 5316 C CG1 . VAL C 3 312 ? -6.384 63.945 -22.849 1.00 53.32 ? 290 VAL F CG1 1 ATOM 5317 C CG2 . VAL C 3 312 ? -7.146 62.723 -24.896 1.00 53.29 ? 290 VAL F CG2 1 ATOM 5318 N N . VAL C 3 313 ? -9.634 66.298 -23.366 1.00 51.26 ? 291 VAL F N 1 ATOM 5319 C CA . VAL C 3 313 ? -10.007 67.594 -22.781 1.00 51.34 ? 291 VAL F CA 1 ATOM 5320 C C . VAL C 3 313 ? -11.307 67.433 -21.966 1.00 55.75 ? 291 VAL F C 1 ATOM 5321 O O . VAL C 3 313 ? -11.414 67.989 -20.872 1.00 55.40 ? 291 VAL F O 1 ATOM 5322 C CB . VAL C 3 313 ? -10.116 68.716 -23.857 1.00 55.27 ? 291 VAL F CB 1 ATOM 5323 C CG1 . VAL C 3 313 ? -10.306 70.090 -23.215 1.00 55.14 ? 291 VAL F CG1 1 ATOM 5324 C CG2 . VAL C 3 313 ? -8.897 68.728 -24.780 1.00 55.06 ? 291 VAL F CG2 1 ATOM 5325 N N . ASP C 3 314 ? -12.269 66.642 -22.490 1.00 52.68 ? 292 ASP F N 1 ATOM 5326 C CA . ASP C 3 314 ? -13.556 66.360 -21.844 1.00 52.70 ? 292 ASP F CA 1 ATOM 5327 C C . ASP C 3 314 ? -13.433 65.419 -20.634 1.00 56.77 ? 292 ASP F C 1 ATOM 5328 O O . ASP C 3 314 ? -14.345 65.375 -19.806 1.00 56.38 ? 292 ASP F O 1 ATOM 5329 C CB . ASP C 3 314 ? -14.571 65.813 -22.862 1.00 54.59 ? 292 ASP F CB 1 ATOM 5330 C CG . ASP C 3 314 ? -15.044 66.840 -23.872 1.00 65.11 ? 292 ASP F CG 1 ATOM 5331 O OD1 . ASP C 3 314 ? -15.724 67.809 -23.462 1.00 65.68 ? 292 ASP F OD1 1 ATOM 5332 O OD2 . ASP C 3 314 ? -14.770 66.655 -25.076 1.00 71.17 ? 292 ASP F OD2 1 ATOM 5333 N N . ALA C 3 315 ? -12.315 64.673 -20.537 1.00 53.48 ? 293 ALA F N 1 ATOM 5334 C CA . ALA C 3 315 ? -12.019 63.741 -19.444 1.00 53.34 ? 293 ALA F CA 1 ATOM 5335 C C . ALA C 3 315 ? -11.258 64.466 -18.311 1.00 57.29 ? 293 ALA F C 1 ATOM 5336 O O . ALA C 3 315 ? -10.594 65.464 -18.603 1.00 56.79 ? 293 ALA F O 1 ATOM 5337 C CB . ALA C 3 315 ? -11.189 62.578 -19.975 1.00 54.03 ? 293 ALA F CB 1 ATOM 5338 N N . PRO C 3 316 ? -11.318 64.006 -17.028 1.00 76.90 ? 294 PRO F N 1 ATOM 5339 C CA . PRO C 3 316 ? -10.582 64.717 -15.960 1.00 77.86 ? 294 PRO F CA 1 ATOM 5340 C C . PRO C 3 316 ? -9.062 64.672 -16.117 1.00 79.71 ? 294 PRO F C 1 ATOM 5341 O O . PRO C 3 316 ? -8.522 63.670 -16.589 1.00 75.99 ? 294 PRO F O 1 ATOM 5342 C CB . PRO C 3 316 ? -11.025 63.999 -14.678 1.00 78.82 ? 294 PRO F CB 1 ATOM 5343 C CG . PRO C 3 316 ? -12.268 63.252 -15.053 1.00 83.18 ? 294 PRO F CG 1 ATOM 5344 C CD . PRO C 3 316 ? -12.063 62.856 -16.474 1.00 76.90 ? 294 PRO F CD 1 ATOM 5345 N N . SER C 3 317 ? -8.379 65.767 -15.729 1.00 78.71 ? 295 SER F N 1 ATOM 5346 C CA . SER C 3 317 ? -6.921 65.877 -15.802 1.00 77.37 ? 295 SER F CA 1 ATOM 5347 C C . SER C 3 317 ? -6.286 65.476 -14.471 1.00 80.03 ? 295 SER F C 1 ATOM 5348 O O . SER C 3 317 ? -6.772 65.881 -13.411 1.00 81.41 ? 295 SER F O 1 ATOM 5349 C CB . SER C 3 317 ? -6.497 67.286 -16.214 1.00 84.45 ? 295 SER F CB 1 ATOM 5350 O OG . SER C 3 317 ? -6.306 68.157 -15.111 1.00 96.34 ? 295 SER F OG 1 ATOM 5351 N N . LEU C 3 318 ? -5.204 64.682 -14.528 1.00 73.79 ? 296 LEU F N 1 ATOM 5352 C CA . LEU C 3 318 ? -4.507 64.213 -13.333 1.00 72.22 ? 296 LEU F CA 1 ATOM 5353 C C . LEU C 3 318 ? -3.142 64.852 -13.113 1.00 77.01 ? 296 LEU F C 1 ATOM 5354 O O . LEU C 3 318 ? -2.303 64.858 -14.015 1.00 76.16 ? 296 LEU F O 1 ATOM 5355 C CB . LEU C 3 318 ? -4.439 62.679 -13.274 1.00 68.72 ? 296 LEU F CB 1 ATOM 5356 C CG . LEU C 3 318 ? -5.732 61.980 -12.848 1.00 72.88 ? 296 LEU F CG 1 ATOM 5357 C CD1 . LEU C 3 318 ? -5.581 60.536 -12.913 1.00 70.01 ? 296 LEU F CD1 1 ATOM 5358 C CD2 . LEU C 3 318 ? -6.153 62.363 -11.428 1.00 76.88 ? 296 LEU F CD2 1 ATOM 5359 N N . THR C 3 319 ? -2.939 65.398 -11.898 1.00 75.10 ? 297 THR F N 1 ATOM 5360 C CA . THR C 3 319 ? -1.728 66.095 -11.447 1.00 76.27 ? 297 THR F CA 1 ATOM 5361 C C . THR C 3 319 ? -1.381 65.647 -10.008 1.00 79.24 ? 297 THR F C 1 ATOM 5362 O O . THR C 3 319 ? -2.235 65.082 -9.320 1.00 77.86 ? 297 THR F O 1 ATOM 5363 C CB . THR C 3 319 ? -1.963 67.630 -11.538 1.00 88.67 ? 297 THR F CB 1 ATOM 5364 O OG1 . THR C 3 319 ? -2.513 67.968 -12.813 1.00 89.41 ? 297 THR F OG1 1 ATOM 5365 C CG2 . THR C 3 319 ? -0.702 68.453 -11.302 1.00 89.12 ? 297 THR F CG2 1 ATOM 5366 N N . ASP C 3 320 ? -0.123 65.906 -9.570 1.00 76.35 ? 298 ASP F N 1 ATOM 5367 C CA . ASP C 3 320 ? 0.422 65.618 -8.236 1.00 75.64 ? 298 ASP F CA 1 ATOM 5368 C C . ASP C 3 320 ? 0.139 64.185 -7.757 1.00 76.07 ? 298 ASP F C 1 ATOM 5369 O O . ASP C 3 320 ? -0.347 63.977 -6.640 1.00 75.57 ? 298 ASP F O 1 ATOM 5370 C CB . ASP C 3 320 ? -0.042 66.678 -7.211 1.00 80.73 ? 298 ASP F CB 1 ATOM 5371 C CG . ASP C 3 320 ? 0.370 68.097 -7.549 1.00 95.28 ? 298 ASP F CG 1 ATOM 5372 O OD1 . ASP C 3 320 ? 1.583 68.394 -7.486 1.00 96.50 ? 298 ASP F OD1 1 ATOM 5373 O OD2 . ASP C 3 320 ? -0.523 68.918 -7.847 1.00 104.16 ? 298 ASP F OD2 1 ATOM 5374 N N . MET C 3 321 ? 0.438 63.199 -8.619 1.00 70.12 ? 299 MET F N 1 ATOM 5375 C CA . MET C 3 321 ? 0.206 61.787 -8.321 1.00 67.06 ? 299 MET F CA 1 ATOM 5376 C C . MET C 3 321 ? 1.384 61.110 -7.635 1.00 69.40 ? 299 MET F C 1 ATOM 5377 O O . MET C 3 321 ? 2.538 61.325 -8.011 1.00 69.47 ? 299 MET F O 1 ATOM 5378 C CB . MET C 3 321 ? -0.209 61.009 -9.576 1.00 67.81 ? 299 MET F CB 1 ATOM 5379 C CG . MET C 3 321 ? -1.613 61.328 -10.052 1.00 72.32 ? 299 MET F CG 1 ATOM 5380 S SD . MET C 3 321 ? -2.414 59.948 -10.912 1.00 74.16 ? 299 MET F SD 1 ATOM 5381 C CE . MET C 3 321 ? -1.405 59.832 -12.369 1.00 70.31 ? 299 MET F CE 1 ATOM 5382 N N . SER C 3 322 ? 1.073 60.282 -6.628 1.00 64.45 ? 300 SER F N 1 ATOM 5383 C CA . SER C 3 322 ? 2.029 59.504 -5.841 1.00 63.05 ? 300 SER F CA 1 ATOM 5384 C C . SER C 3 322 ? 1.474 58.098 -5.623 1.00 64.52 ? 300 SER F C 1 ATOM 5385 O O . SER C 3 322 ? 0.255 57.929 -5.550 1.00 63.87 ? 300 SER F O 1 ATOM 5386 C CB . SER C 3 322 ? 2.302 60.184 -4.502 1.00 68.05 ? 300 SER F CB 1 ATOM 5387 O OG . SER C 3 322 ? 1.112 60.372 -3.754 1.00 77.31 ? 300 SER F OG 1 ATOM 5388 N N . CYS C 3 323 ? 2.361 57.093 -5.531 1.00 59.65 ? 301 CYS F N 1 ATOM 5389 C CA . CYS C 3 323 ? 1.960 55.698 -5.349 1.00 57.65 ? 301 CYS F CA 1 ATOM 5390 C C . CYS C 3 323 ? 2.724 55.004 -4.224 1.00 60.72 ? 301 CYS F C 1 ATOM 5391 O O . CYS C 3 323 ? 3.953 55.074 -4.169 1.00 60.73 ? 301 CYS F O 1 ATOM 5392 C CB . CYS C 3 323 ? 2.071 54.934 -6.666 1.00 57.08 ? 301 CYS F CB 1 ATOM 5393 S SG . CYS C 3 323 ? 1.694 53.166 -6.546 1.00 59.44 ? 301 CYS F SG 1 ATOM 5394 N N . GLU C 3 324 ? 1.980 54.322 -3.337 1.00 56.40 ? 302 GLU F N 1 ATOM 5395 C CA . GLU C 3 324 ? 2.517 53.577 -2.200 1.00 55.82 ? 302 GLU F CA 1 ATOM 5396 C C . GLU C 3 324 ? 1.951 52.151 -2.201 1.00 58.07 ? 302 GLU F C 1 ATOM 5397 O O . GLU C 3 324 ? 0.760 51.958 -2.461 1.00 57.30 ? 302 GLU F O 1 ATOM 5398 C CB . GLU C 3 324 ? 2.198 54.311 -0.883 1.00 58.14 ? 302 GLU F CB 1 ATOM 5399 C CG . GLU C 3 324 ? 2.902 53.765 0.351 1.00 69.38 ? 302 GLU F CG 1 ATOM 5400 C CD . GLU C 3 324 ? 1.990 53.247 1.450 1.00 90.67 ? 302 GLU F CD 1 ATOM 5401 O OE1 . GLU C 3 324 ? 2.266 52.143 1.972 1.00 85.48 ? 302 GLU F OE1 1 ATOM 5402 O OE2 . GLU C 3 324 ? 1.010 53.944 1.799 1.00 85.60 ? 302 GLU F OE2 1 ATOM 5403 N N . VAL C 3 325 ? 2.816 51.158 -1.931 1.00 54.03 ? 303 VAL F N 1 ATOM 5404 C CA . VAL C 3 325 ? 2.448 49.740 -1.887 1.00 53.12 ? 303 VAL F CA 1 ATOM 5405 C C . VAL C 3 325 ? 2.537 49.238 -0.422 1.00 56.89 ? 303 VAL F C 1 ATOM 5406 O O . VAL C 3 325 ? 3.630 48.901 0.048 1.00 56.84 ? 303 VAL F O 1 ATOM 5407 C CB . VAL C 3 325 ? 3.260 48.885 -2.910 1.00 57.09 ? 303 VAL F CB 1 ATOM 5408 C CG1 . VAL C 3 325 ? 2.909 47.400 -2.812 1.00 56.80 ? 303 VAL F CG1 1 ATOM 5409 C CG2 . VAL C 3 325 ? 3.049 49.387 -4.338 1.00 56.72 ? 303 VAL F CG2 1 ATOM 5410 N N . PRO C 3 326 ? 1.406 49.229 0.328 1.00 53.25 ? 304 PRO F N 1 ATOM 5411 C CA . PRO C 3 326 ? 1.464 48.784 1.731 1.00 53.41 ? 304 PRO F CA 1 ATOM 5412 C C . PRO C 3 326 ? 1.553 47.269 1.918 1.00 57.29 ? 304 PRO F C 1 ATOM 5413 O O . PRO C 3 326 ? 1.972 46.824 2.986 1.00 57.46 ? 304 PRO F O 1 ATOM 5414 C CB . PRO C 3 326 ? 0.177 49.351 2.330 1.00 55.51 ? 304 PRO F CB 1 ATOM 5415 C CG . PRO C 3 326 ? -0.774 49.379 1.194 1.00 59.62 ? 304 PRO F CG 1 ATOM 5416 C CD . PRO C 3 326 ? 0.034 49.631 -0.051 1.00 54.69 ? 304 PRO F CD 1 ATOM 5417 N N . ALA C 3 327 ? 1.136 46.481 0.903 1.00 53.45 ? 305 ALA F N 1 ATOM 5418 C CA . ALA C 3 327 ? 1.149 45.018 0.955 1.00 53.66 ? 305 ALA F CA 1 ATOM 5419 C C . ALA C 3 327 ? 1.335 44.388 -0.425 1.00 57.50 ? 305 ALA F C 1 ATOM 5420 O O . ALA C 3 327 ? 0.637 44.768 -1.369 1.00 56.37 ? 305 ALA F O 1 ATOM 5421 C CB . ALA C 3 327 ? -0.138 44.506 1.591 1.00 54.64 ? 305 ALA F CB 1 ATOM 5422 N N . CYS C 3 328 ? 2.280 43.426 -0.540 1.00 55.18 ? 306 CYS F N 1 ATOM 5423 C CA . CYS C 3 328 ? 2.539 42.682 -1.777 1.00 55.66 ? 306 CYS F CA 1 ATOM 5424 C C . CYS C 3 328 ? 3.082 41.276 -1.577 1.00 61.45 ? 306 CYS F C 1 ATOM 5425 O O . CYS C 3 328 ? 3.987 41.054 -0.769 1.00 61.92 ? 306 CYS F O 1 ATOM 5426 C CB . CYS C 3 328 ? 3.382 43.466 -2.780 1.00 55.82 ? 306 CYS F CB 1 ATOM 5427 S SG . CYS C 3 328 ? 3.348 42.770 -4.456 1.00 60.28 ? 306 CYS F SG 1 ATOM 5428 N N . THR C 3 329 ? 2.541 40.342 -2.369 1.00 58.89 ? 307 THR F N 1 ATOM 5429 C CA . THR C 3 329 ? 2.916 38.934 -2.428 1.00 60.90 ? 307 THR F CA 1 ATOM 5430 C C . THR C 3 329 ? 2.965 38.551 -3.909 1.00 65.52 ? 307 THR F C 1 ATOM 5431 O O . THR C 3 329 ? 1.957 38.698 -4.609 1.00 64.14 ? 307 THR F O 1 ATOM 5432 C CB . THR C 3 329 ? 1.936 38.075 -1.603 1.00 69.99 ? 307 THR F CB 1 ATOM 5433 O OG1 . THR C 3 329 ? 1.985 38.494 -0.238 1.00 69.49 ? 307 THR F OG1 1 ATOM 5434 C CG2 . THR C 3 329 ? 2.239 36.579 -1.688 1.00 71.37 ? 307 THR F CG2 1 ATOM 5435 N N . HIS C 3 330 ? 4.138 38.101 -4.396 1.00 64.04 ? 308 HIS F N 1 ATOM 5436 C CA . HIS C 3 330 ? 4.275 37.707 -5.796 1.00 64.96 ? 308 HIS F CA 1 ATOM 5437 C C . HIS C 3 330 ? 3.709 36.309 -6.054 1.00 70.57 ? 308 HIS F C 1 ATOM 5438 O O . HIS C 3 330 ? 4.321 35.303 -5.691 1.00 72.80 ? 308 HIS F O 1 ATOM 5439 C CB . HIS C 3 330 ? 5.701 37.919 -6.349 1.00 67.36 ? 308 HIS F CB 1 ATOM 5440 C CG . HIS C 3 330 ? 6.774 37.151 -5.643 1.00 73.51 ? 308 HIS F CG 1 ATOM 5441 N ND1 . HIS C 3 330 ? 7.045 35.833 -5.962 1.00 78.39 ? 308 HIS F ND1 1 ATOM 5442 C CD2 . HIS C 3 330 ? 7.642 37.557 -4.688 1.00 75.60 ? 308 HIS F CD2 1 ATOM 5443 C CE1 . HIS C 3 330 ? 8.048 35.473 -5.179 1.00 79.96 ? 308 HIS F CE1 1 ATOM 5444 N NE2 . HIS C 3 330 ? 8.442 36.477 -4.396 1.00 78.64 ? 308 HIS F NE2 1 ATOM 5445 N N . SER C 3 331 ? 2.494 36.264 -6.629 1.00 65.83 ? 309 SER F N 1 ATOM 5446 C CA . SER C 3 331 ? 1.765 35.029 -6.925 1.00 67.29 ? 309 SER F CA 1 ATOM 5447 C C . SER C 3 331 ? 0.951 35.139 -8.223 1.00 70.27 ? 309 SER F C 1 ATOM 5448 O O . SER C 3 331 ? 0.975 36.183 -8.880 1.00 67.91 ? 309 SER F O 1 ATOM 5449 C CB . SER C 3 331 ? 0.859 34.660 -5.751 1.00 70.60 ? 309 SER F CB 1 ATOM 5450 O OG . SER C 3 331 ? -0.098 35.674 -5.489 1.00 76.57 ? 309 SER F OG 1 ATOM 5451 N N . SER C 3 332 ? 0.242 34.050 -8.591 1.00 68.50 ? 310 SER F N 1 ATOM 5452 C CA . SER C 3 332 ? -0.607 33.962 -9.781 1.00 68.02 ? 310 SER F CA 1 ATOM 5453 C C . SER C 3 332 ? -1.835 34.876 -9.674 1.00 68.85 ? 310 SER F C 1 ATOM 5454 O O . SER C 3 332 ? -2.286 35.410 -10.688 1.00 67.42 ? 310 SER F O 1 ATOM 5455 C CB . SER C 3 332 ? -1.042 32.519 -10.015 1.00 74.52 ? 310 SER F CB 1 ATOM 5456 O OG . SER C 3 332 ? 0.079 31.684 -10.253 1.00 86.22 ? 310 SER F OG 1 ATOM 5457 N N . ASP C 3 333 ? -2.365 35.054 -8.446 1.00 64.24 ? 311 ASP F N 1 ATOM 5458 C CA . ASP C 3 333 ? -3.525 35.902 -8.158 1.00 61.91 ? 311 ASP F CA 1 ATOM 5459 C C . ASP C 3 333 ? -3.100 37.340 -7.808 1.00 62.54 ? 311 ASP F C 1 ATOM 5460 O O . ASP C 3 333 ? -1.904 37.644 -7.806 1.00 62.03 ? 311 ASP F O 1 ATOM 5461 C CB . ASP C 3 333 ? -4.383 35.280 -7.036 1.00 64.84 ? 311 ASP F CB 1 ATOM 5462 C CG . ASP C 3 333 ? -3.733 35.271 -5.664 1.00 75.94 ? 311 ASP F CG 1 ATOM 5463 O OD1 . ASP C 3 333 ? -2.645 34.668 -5.523 1.00 77.96 ? 311 ASP F OD1 1 ATOM 5464 O OD2 . ASP C 3 333 ? -4.327 35.841 -4.724 1.00 81.14 ? 311 ASP F OD2 1 ATOM 5465 N N . PHE C 3 334 ? -4.080 38.216 -7.512 1.00 56.91 ? 312 PHE F N 1 ATOM 5466 C CA . PHE C 3 334 ? -3.833 39.612 -7.156 1.00 54.59 ? 312 PHE F CA 1 ATOM 5467 C C . PHE C 3 334 ? -3.392 39.743 -5.688 1.00 57.64 ? 312 PHE F C 1 ATOM 5468 O O . PHE C 3 334 ? -4.193 40.082 -4.812 1.00 56.99 ? 312 PHE F O 1 ATOM 5469 C CB . PHE C 3 334 ? -5.047 40.500 -7.506 1.00 55.45 ? 312 PHE F CB 1 ATOM 5470 C CG . PHE C 3 334 ? -5.401 40.496 -8.976 1.00 56.89 ? 312 PHE F CG 1 ATOM 5471 C CD1 . PHE C 3 334 ? -4.722 41.310 -9.874 1.00 59.01 ? 312 PHE F CD1 1 ATOM 5472 C CD2 . PHE C 3 334 ? -6.407 39.671 -9.463 1.00 60.10 ? 312 PHE F CD2 1 ATOM 5473 C CE1 . PHE C 3 334 ? -5.035 41.289 -11.236 1.00 59.98 ? 312 PHE F CE1 1 ATOM 5474 C CE2 . PHE C 3 334 ? -6.727 39.659 -10.824 1.00 62.96 ? 312 PHE F CE2 1 ATOM 5475 C CZ . PHE C 3 334 ? -6.041 40.471 -11.700 1.00 60.03 ? 312 PHE F CZ 1 ATOM 5476 N N . GLY C 3 335 ? -2.115 39.444 -5.448 1.00 54.09 ? 313 GLY F N 1 ATOM 5477 C CA . GLY C 3 335 ? -1.495 39.491 -4.128 1.00 53.78 ? 313 GLY F CA 1 ATOM 5478 C C . GLY C 3 335 ? -0.923 40.840 -3.735 1.00 55.59 ? 313 GLY F C 1 ATOM 5479 O O . GLY C 3 335 ? -0.434 40.999 -2.614 1.00 55.24 ? 313 GLY F O 1 ATOM 5480 N N . GLY C 3 336 ? -0.988 41.804 -4.652 1.00 50.62 ? 314 GLY F N 1 ATOM 5481 C CA . GLY C 3 336 ? -0.489 43.158 -4.440 1.00 49.29 ? 314 GLY F CA 1 ATOM 5482 C C . GLY C 3 336 ? -1.582 44.189 -4.244 1.00 51.84 ? 314 GLY F C 1 ATOM 5483 O O . GLY C 3 336 ? -2.633 44.116 -4.887 1.00 51.27 ? 314 GLY F O 1 ATOM 5484 N N . VAL C 3 337 ? -1.334 45.157 -3.343 1.00 47.77 ? 315 VAL F N 1 ATOM 5485 C CA . VAL C 3 337 ? -2.247 46.259 -3.007 1.00 47.23 ? 315 VAL F CA 1 ATOM 5486 C C . VAL C 3 337 ? -1.483 47.578 -3.200 1.00 50.51 ? 315 VAL F C 1 ATOM 5487 O O . VAL C 3 337 ? -0.372 47.712 -2.690 1.00 50.16 ? 315 VAL F O 1 ATOM 5488 C CB . VAL C 3 337 ? -2.822 46.119 -1.561 1.00 51.67 ? 315 VAL F CB 1 ATOM 5489 C CG1 . VAL C 3 337 ? -3.634 47.347 -1.149 1.00 51.86 ? 315 VAL F CG1 1 ATOM 5490 C CG2 . VAL C 3 337 ? -3.663 44.852 -1.414 1.00 52.10 ? 315 VAL F CG2 1 ATOM 5491 N N . ALA C 3 338 ? -2.069 48.539 -3.938 1.00 46.80 ? 316 ALA F N 1 ATOM 5492 C CA . ALA C 3 338 ? -1.441 49.840 -4.176 1.00 46.62 ? 316 ALA F CA 1 ATOM 5493 C C . ALA C 3 338 ? -2.413 51.000 -3.955 1.00 50.85 ? 316 ALA F C 1 ATOM 5494 O O . ALA C 3 338 ? -3.543 50.967 -4.450 1.00 50.59 ? 316 ALA F O 1 ATOM 5495 C CB . ALA C 3 338 ? -0.848 49.897 -5.578 1.00 47.07 ? 316 ALA F CB 1 ATOM 5496 N N . ILE C 3 339 ? -1.969 52.017 -3.194 1.00 47.90 ? 317 ILE F N 1 ATOM 5497 C CA . ILE C 3 339 ? -2.750 53.220 -2.896 1.00 48.93 ? 317 ILE F CA 1 ATOM 5498 C C . ILE C 3 339 ? -2.164 54.393 -3.686 1.00 53.00 ? 317 ILE F C 1 ATOM 5499 O O . ILE C 3 339 ? -1.005 54.762 -3.480 1.00 52.58 ? 317 ILE F O 1 ATOM 5500 C CB . ILE C 3 339 ? -2.863 53.499 -1.364 1.00 53.01 ? 317 ILE F CB 1 ATOM 5501 C CG1 . ILE C 3 339 ? -3.585 52.337 -0.637 1.00 53.21 ? 317 ILE F CG1 1 ATOM 5502 C CG2 . ILE C 3 339 ? -3.567 54.843 -1.090 1.00 55.69 ? 317 ILE F CG2 1 ATOM 5503 C CD1 . ILE C 3 339 ? -3.273 52.201 0.862 1.00 61.07 ? 317 ILE F CD1 1 ATOM 5504 N N . ILE C 3 340 ? -2.966 54.957 -4.602 1.00 50.01 ? 318 ILE F N 1 ATOM 5505 C CA . ILE C 3 340 ? -2.555 56.074 -5.451 1.00 50.62 ? 318 ILE F CA 1 ATOM 5506 C C . ILE C 3 340 ? -3.306 57.357 -5.072 1.00 56.51 ? 318 ILE F C 1 ATOM 5507 O O . ILE C 3 340 ? -4.528 57.431 -5.223 1.00 56.91 ? 318 ILE F O 1 ATOM 5508 C CB . ILE C 3 340 ? -2.652 55.723 -6.971 1.00 52.94 ? 318 ILE F CB 1 ATOM 5509 C CG1 . ILE C 3 340 ? -1.775 54.495 -7.325 1.00 51.73 ? 318 ILE F CG1 1 ATOM 5510 C CG2 . ILE C 3 340 ? -2.291 56.931 -7.854 1.00 54.89 ? 318 ILE F CG2 1 ATOM 5511 C CD1 . ILE C 3 340 ? -2.310 53.612 -8.461 1.00 58.02 ? 318 ILE F CD1 1 ATOM 5512 N N . LYS C 3 341 ? -2.561 58.358 -4.572 1.00 54.27 ? 319 LYS F N 1 ATOM 5513 C CA . LYS C 3 341 ? -3.097 59.669 -4.198 1.00 56.75 ? 319 LYS F CA 1 ATOM 5514 C C . LYS C 3 341 ? -3.081 60.565 -5.433 1.00 61.59 ? 319 LYS F C 1 ATOM 5515 O O . LYS C 3 341 ? -2.137 60.493 -6.224 1.00 60.13 ? 319 LYS F O 1 ATOM 5516 C CB . LYS C 3 341 ? -2.290 60.287 -3.047 1.00 60.47 ? 319 LYS F CB 1 ATOM 5517 C CG . LYS C 3 341 ? -2.605 59.658 -1.695 1.00 75.78 ? 319 LYS F CG 1 ATOM 5518 C CD . LYS C 3 341 ? -1.714 60.195 -0.585 1.00 87.86 ? 319 LYS F CD 1 ATOM 5519 C CE . LYS C 3 341 ? -2.021 59.564 0.752 1.00 99.66 ? 319 LYS F CE 1 ATOM 5520 N NZ . LYS C 3 341 ? -3.217 60.169 1.398 1.00 111.94 ? 319 LYS F NZ 1 ATOM 5521 N N . TYR C 3 342 ? -4.135 61.378 -5.623 1.00 60.39 ? 320 TYR F N 1 ATOM 5522 C CA . TYR C 3 342 ? -4.262 62.226 -6.809 1.00 61.59 ? 320 TYR F CA 1 ATOM 5523 C C . TYR C 3 342 ? -4.894 63.602 -6.563 1.00 69.11 ? 320 TYR F C 1 ATOM 5524 O O . TYR C 3 342 ? -5.500 63.839 -5.516 1.00 70.42 ? 320 TYR F O 1 ATOM 5525 C CB . TYR C 3 342 ? -5.040 61.468 -7.911 1.00 61.40 ? 320 TYR F CB 1 ATOM 5526 C CG . TYR C 3 342 ? -6.478 61.143 -7.554 1.00 64.03 ? 320 TYR F CG 1 ATOM 5527 C CD1 . TYR C 3 342 ? -7.512 62.017 -7.878 1.00 68.92 ? 320 TYR F CD1 1 ATOM 5528 C CD2 . TYR C 3 342 ? -6.808 59.948 -6.922 1.00 63.06 ? 320 TYR F CD2 1 ATOM 5529 C CE1 . TYR C 3 342 ? -8.835 61.727 -7.549 1.00 70.96 ? 320 TYR F CE1 1 ATOM 5530 C CE2 . TYR C 3 342 ? -8.130 59.641 -6.597 1.00 65.12 ? 320 TYR F CE2 1 ATOM 5531 C CZ . TYR C 3 342 ? -9.141 60.536 -6.910 1.00 75.56 ? 320 TYR F CZ 1 ATOM 5532 O OH . TYR C 3 342 ? -10.446 60.243 -6.594 1.00 78.17 ? 320 TYR F OH 1 ATOM 5533 N N . ALA C 3 343 ? -4.772 64.488 -7.568 1.00 67.12 ? 321 ALA F N 1 ATOM 5534 C CA . ALA C 3 343 ? -5.360 65.824 -7.608 1.00 70.94 ? 321 ALA F CA 1 ATOM 5535 C C . ALA C 3 343 ? -6.019 65.973 -8.987 1.00 74.89 ? 321 ALA F C 1 ATOM 5536 O O . ALA C 3 343 ? -5.325 66.131 -9.996 1.00 73.75 ? 321 ALA F O 1 ATOM 5537 C CB . ALA C 3 343 ? -4.291 66.889 -7.390 1.00 73.73 ? 321 ALA F CB 1 ATOM 5538 N N . ALA C 3 344 ? -7.357 65.837 -9.029 1.00 72.32 ? 322 ALA F N 1 ATOM 5539 C CA . ALA C 3 344 ? -8.152 65.895 -10.258 1.00 72.61 ? 322 ALA F CA 1 ATOM 5540 C C . ALA C 3 344 ? -8.814 67.252 -10.489 1.00 80.91 ? 322 ALA F C 1 ATOM 5541 O O . ALA C 3 344 ? -9.267 67.890 -9.536 1.00 83.67 ? 322 ALA F O 1 ATOM 5542 C CB . ALA C 3 344 ? -9.201 64.796 -10.251 1.00 71.76 ? 322 ALA F CB 1 ATOM 5543 N N . SER C 3 345 ? -8.880 67.678 -11.765 1.00 77.89 ? 323 SER F N 1 ATOM 5544 C CA . SER C 3 345 ? -9.487 68.947 -12.177 1.00 82.31 ? 323 SER F CA 1 ATOM 5545 C C . SER C 3 345 ? -11.015 68.918 -12.083 1.00 88.11 ? 323 SER F C 1 ATOM 5546 O O . SER C 3 345 ? -11.623 69.935 -11.746 1.00 92.45 ? 323 SER F O 1 ATOM 5547 C CB . SER C 3 345 ? -9.054 69.316 -13.592 1.00 85.82 ? 323 SER F CB 1 ATOM 5548 O OG . SER C 3 345 ? -9.408 68.310 -14.527 1.00 91.26 ? 323 SER F OG 1 ATOM 5549 N N . LYS C 3 346 ? -11.628 67.757 -12.390 1.00 81.40 ? 324 LYS F N 1 ATOM 5550 C CA . LYS C 3 346 ? -13.081 67.553 -12.356 1.00 83.14 ? 324 LYS F CA 1 ATOM 5551 C C . LYS C 3 346 ? -13.473 66.104 -12.022 1.00 83.33 ? 324 LYS F C 1 ATOM 5552 O O . LYS C 3 346 ? -12.614 65.219 -11.997 1.00 78.58 ? 324 LYS F O 1 ATOM 5553 C CB . LYS C 3 346 ? -13.749 68.037 -13.667 1.00 87.61 ? 324 LYS F CB 1 ATOM 5554 C CG . LYS C 3 346 ? -13.234 67.378 -14.948 1.00 95.49 ? 324 LYS F CG 1 ATOM 5555 C CD . LYS C 3 346 ? -13.882 67.983 -16.183 1.00 106.25 ? 324 LYS F CD 1 ATOM 5556 C CE . LYS C 3 346 ? -13.240 67.495 -17.457 1.00 111.54 ? 324 LYS F CE 1 ATOM 5557 N NZ . LYS C 3 346 ? -13.882 68.088 -18.657 1.00 122.04 ? 324 LYS F NZ 1 ATOM 5558 N N . LYS C 3 347 ? -14.771 65.877 -11.752 1.00 82.06 ? 325 LYS F N 1 ATOM 5559 C CA . LYS C 3 347 ? -15.334 64.563 -11.444 1.00 79.43 ? 325 LYS F CA 1 ATOM 5560 C C . LYS C 3 347 ? -15.605 63.812 -12.755 1.00 81.26 ? 325 LYS F C 1 ATOM 5561 O O . LYS C 3 347 ? -16.032 64.423 -13.738 1.00 82.85 ? 325 LYS F O 1 ATOM 5562 C CB . LYS C 3 347 ? -16.631 64.727 -10.632 1.00 85.85 ? 325 LYS F CB 1 ATOM 5563 C CG . LYS C 3 347 ? -17.129 63.450 -9.969 1.00 95.91 ? 325 LYS F CG 1 ATOM 5564 C CD . LYS C 3 347 ? -18.424 63.684 -9.211 1.00 109.18 ? 325 LYS F CD 1 ATOM 5565 C CE . LYS C 3 347 ? -19.034 62.395 -8.716 1.00 116.58 ? 325 LYS F CE 1 ATOM 5566 N NZ . LYS C 3 347 ? -19.852 61.733 -9.766 1.00 124.13 ? 325 LYS F NZ 1 ATOM 5567 N N . GLY C 3 348 ? -15.345 62.505 -12.752 1.00 74.03 ? 326 GLY F N 1 ATOM 5568 C CA . GLY C 3 348 ? -15.550 61.640 -13.911 1.00 71.58 ? 326 GLY F CA 1 ATOM 5569 C C . GLY C 3 348 ? -14.901 60.276 -13.794 1.00 71.22 ? 326 GLY F C 1 ATOM 5570 O O . GLY C 3 348 ? -14.228 59.989 -12.803 1.00 69.34 ? 326 GLY F O 1 ATOM 5571 N N . LYS C 3 349 ? -15.115 59.414 -14.802 1.00 66.02 ? 327 LYS F N 1 ATOM 5572 C CA . LYS C 3 349 ? -14.542 58.067 -14.829 1.00 62.18 ? 327 LYS F CA 1 ATOM 5573 C C . LYS C 3 349 ? -13.162 58.059 -15.478 1.00 63.65 ? 327 LYS F C 1 ATOM 5574 O O . LYS C 3 349 ? -12.972 58.668 -16.534 1.00 63.69 ? 327 LYS F O 1 ATOM 5575 C CB . LYS C 3 349 ? -15.481 57.074 -15.537 1.00 64.34 ? 327 LYS F CB 1 ATOM 5576 C CG . LYS C 3 349 ? -16.576 56.507 -14.636 1.00 80.26 ? 327 LYS F CG 1 ATOM 5577 C CD . LYS C 3 349 ? -17.909 57.227 -14.815 1.00 94.44 ? 327 LYS F CD 1 ATOM 5578 C CE . LYS C 3 349 ? -18.879 56.440 -15.660 1.00 105.97 ? 327 LYS F CE 1 ATOM 5579 N NZ . LYS C 3 349 ? -20.124 57.208 -15.917 1.00 119.41 ? 327 LYS F NZ 1 ATOM 5580 N N . CYS C 3 350 ? -12.202 57.369 -14.838 1.00 57.97 ? 328 CYS F N 1 ATOM 5581 C CA . CYS C 3 350 ? -10.831 57.222 -15.328 1.00 55.68 ? 328 CYS F CA 1 ATOM 5582 C C . CYS C 3 350 ? -10.457 55.749 -15.469 1.00 56.33 ? 328 CYS F C 1 ATOM 5583 O O . CYS C 3 350 ? -10.767 54.943 -14.588 1.00 55.43 ? 328 CYS F O 1 ATOM 5584 C CB . CYS C 3 350 ? -9.840 57.968 -14.437 1.00 56.46 ? 328 CYS F CB 1 ATOM 5585 S SG . CYS C 3 350 ? -9.699 59.743 -14.789 1.00 63.41 ? 328 CYS F SG 1 ATOM 5586 N N . ALA C 3 351 ? -9.788 55.403 -16.579 1.00 51.11 ? 329 ALA F N 1 ATOM 5587 C CA . ALA C 3 351 ? -9.341 54.039 -16.855 1.00 48.74 ? 329 ALA F CA 1 ATOM 5588 C C . ALA C 3 351 ? -8.019 53.757 -16.148 1.00 50.72 ? 329 ALA F C 1 ATOM 5589 O O . ALA C 3 351 ? -7.147 54.626 -16.115 1.00 50.51 ? 329 ALA F O 1 ATOM 5590 C CB . ALA C 3 351 ? -9.189 53.832 -18.352 1.00 49.08 ? 329 ALA F CB 1 ATOM 5591 N N . VAL C 3 352 ? -7.879 52.551 -15.570 1.00 45.81 ? 330 VAL F N 1 ATOM 5592 C CA . VAL C 3 352 ? -6.671 52.125 -14.855 1.00 44.48 ? 330 VAL F CA 1 ATOM 5593 C C . VAL C 3 352 ? -5.974 51.029 -15.667 1.00 47.09 ? 330 VAL F C 1 ATOM 5594 O O . VAL C 3 352 ? -6.604 50.023 -16.005 1.00 46.43 ? 330 VAL F O 1 ATOM 5595 C CB . VAL C 3 352 ? -6.964 51.675 -13.393 1.00 48.31 ? 330 VAL F CB 1 ATOM 5596 C CG1 . VAL C 3 352 ? -5.675 51.361 -12.635 1.00 47.30 ? 330 VAL F CG1 1 ATOM 5597 C CG2 . VAL C 3 352 ? -7.778 52.722 -12.640 1.00 49.55 ? 330 VAL F CG2 1 ATOM 5598 N N . HIS C 3 353 ? -4.681 51.232 -15.985 1.00 43.22 ? 331 HIS F N 1 ATOM 5599 C CA . HIS C 3 353 ? -3.889 50.273 -16.755 1.00 42.63 ? 331 HIS F CA 1 ATOM 5600 C C . HIS C 3 353 ? -2.413 50.296 -16.373 1.00 46.71 ? 331 HIS F C 1 ATOM 5601 O O . HIS C 3 353 ? -1.842 51.369 -16.167 1.00 46.69 ? 331 HIS F O 1 ATOM 5602 C CB . HIS C 3 353 ? -4.056 50.506 -18.265 1.00 43.65 ? 331 HIS F CB 1 ATOM 5603 C CG . HIS C 3 353 ? -3.610 49.348 -19.102 1.00 46.99 ? 331 HIS F CG 1 ATOM 5604 N ND1 . HIS C 3 353 ? -2.411 49.374 -19.790 1.00 49.24 ? 331 HIS F ND1 1 ATOM 5605 C CD2 . HIS C 3 353 ? -4.218 48.160 -19.328 1.00 48.59 ? 331 HIS F CD2 1 ATOM 5606 C CE1 . HIS C 3 353 ? -2.331 48.210 -20.415 1.00 48.92 ? 331 HIS F CE1 1 ATOM 5607 N NE2 . HIS C 3 353 ? -3.394 47.446 -20.165 1.00 48.88 ? 331 HIS F NE2 1 ATOM 5608 N N . SER C 3 354 ? -1.799 49.105 -16.295 1.00 43.40 ? 332 SER F N 1 ATOM 5609 C CA . SER C 3 354 ? -0.382 48.949 -15.981 1.00 43.84 ? 332 SER F CA 1 ATOM 5610 C C . SER C 3 354 ? 0.429 49.099 -17.264 1.00 49.12 ? 332 SER F C 1 ATOM 5611 O O . SER C 3 354 ? 0.153 48.419 -18.257 1.00 48.79 ? 332 SER F O 1 ATOM 5612 C CB . SER C 3 354 ? -0.120 47.594 -15.332 1.00 47.42 ? 332 SER F CB 1 ATOM 5613 O OG . SER C 3 354 ? 1.230 47.460 -14.918 1.00 56.87 ? 332 SER F OG 1 ATOM 5614 N N . MET C 3 355 ? 1.412 50.013 -17.246 1.00 46.98 ? 333 MET F N 1 ATOM 5615 C CA . MET C 3 355 ? 2.287 50.293 -18.388 1.00 48.32 ? 333 MET F CA 1 ATOM 5616 C C . MET C 3 355 ? 3.467 49.314 -18.470 1.00 53.70 ? 333 MET F C 1 ATOM 5617 O O . MET C 3 355 ? 4.210 49.318 -19.455 1.00 54.69 ? 333 MET F O 1 ATOM 5618 C CB . MET C 3 355 ? 2.750 51.761 -18.381 1.00 51.40 ? 333 MET F CB 1 ATOM 5619 C CG . MET C 3 355 ? 1.619 52.758 -18.616 1.00 54.69 ? 333 MET F CG 1 ATOM 5620 S SD . MET C 3 355 ? 0.881 52.680 -20.273 1.00 59.18 ? 333 MET F SD 1 ATOM 5621 C CE . MET C 3 355 ? 2.083 53.623 -21.206 1.00 57.79 ? 333 MET F CE 1 ATOM 5622 N N . THR C 3 356 ? 3.610 48.458 -17.443 1.00 50.34 ? 334 THR F N 1 ATOM 5623 C CA . THR C 3 356 ? 4.634 47.420 -17.343 1.00 51.87 ? 334 THR F CA 1 ATOM 5624 C C . THR C 3 356 ? 3.938 46.068 -17.547 1.00 55.94 ? 334 THR F C 1 ATOM 5625 O O . THR C 3 356 ? 2.968 45.765 -16.849 1.00 54.16 ? 334 THR F O 1 ATOM 5626 C CB . THR C 3 356 ? 5.382 47.536 -16.000 1.00 60.48 ? 334 THR F CB 1 ATOM 5627 O OG1 . THR C 3 356 ? 5.774 48.896 -15.796 1.00 60.31 ? 334 THR F OG1 1 ATOM 5628 C CG2 . THR C 3 356 ? 6.610 46.632 -15.928 1.00 61.36 ? 334 THR F CG2 1 ATOM 5629 N N . ASN C 3 357 ? 4.420 45.276 -18.520 1.00 54.55 ? 335 ASN F N 1 ATOM 5630 C CA . ASN C 3 357 ? 3.862 43.968 -18.884 1.00 55.12 ? 335 ASN F CA 1 ATOM 5631 C C . ASN C 3 357 ? 3.990 42.891 -17.799 1.00 59.68 ? 335 ASN F C 1 ATOM 5632 O O . ASN C 3 357 ? 3.241 41.911 -17.821 1.00 59.36 ? 335 ASN F O 1 ATOM 5633 C CB . ASN C 3 357 ? 4.450 43.483 -20.214 1.00 58.81 ? 335 ASN F CB 1 ATOM 5634 C CG . ASN C 3 357 ? 4.149 44.390 -21.383 1.00 83.08 ? 335 ASN F CG 1 ATOM 5635 O OD1 . ASN C 3 357 ? 3.002 44.784 -21.622 1.00 76.14 ? 335 ASN F OD1 1 ATOM 5636 N ND2 . ASN C 3 357 ? 5.174 44.730 -22.149 1.00 77.00 ? 335 ASN F ND2 1 ATOM 5637 N N . ALA C 3 358 ? 4.924 43.080 -16.853 1.00 56.92 ? 336 ALA F N 1 ATOM 5638 C CA . ALA C 3 358 ? 5.180 42.159 -15.746 1.00 57.54 ? 336 ALA F CA 1 ATOM 5639 C C . ALA C 3 358 ? 4.152 42.280 -14.607 1.00 59.17 ? 336 ALA F C 1 ATOM 5640 O O . ALA C 3 358 ? 4.077 41.389 -13.757 1.00 59.25 ? 336 ALA F O 1 ATOM 5641 C CB . ALA C 3 358 ? 6.583 42.381 -15.214 1.00 59.92 ? 336 ALA F CB 1 ATOM 5642 N N . VAL C 3 359 ? 3.367 43.381 -14.592 1.00 53.56 ? 337 VAL F N 1 ATOM 5643 C CA . VAL C 3 359 ? 2.340 43.670 -13.579 1.00 51.54 ? 337 VAL F CA 1 ATOM 5644 C C . VAL C 3 359 ? 0.964 43.840 -14.257 1.00 54.08 ? 337 VAL F C 1 ATOM 5645 O O . VAL C 3 359 ? 0.875 44.479 -15.305 1.00 53.43 ? 337 VAL F O 1 ATOM 5646 C CB . VAL C 3 359 ? 2.729 44.906 -12.707 1.00 54.58 ? 337 VAL F CB 1 ATOM 5647 C CG1 . VAL C 3 359 ? 1.653 45.239 -11.674 1.00 52.97 ? 337 VAL F CG1 1 ATOM 5648 C CG2 . VAL C 3 359 ? 4.077 44.701 -12.017 1.00 55.69 ? 337 VAL F CG2 1 ATOM 5649 N N . THR C 3 360 ? -0.098 43.260 -13.660 1.00 50.05 ? 338 THR F N 1 ATOM 5650 C CA . THR C 3 360 ? -1.472 43.351 -14.170 1.00 49.11 ? 338 THR F CA 1 ATOM 5651 C C . THR C 3 360 ? -2.406 43.849 -13.060 1.00 51.70 ? 338 THR F C 1 ATOM 5652 O O . THR C 3 360 ? -2.358 43.328 -11.947 1.00 51.42 ? 338 THR F O 1 ATOM 5653 C CB . THR C 3 360 ? -1.931 42.008 -14.772 1.00 58.58 ? 338 THR F CB 1 ATOM 5654 O OG1 . THR C 3 360 ? -0.853 41.404 -15.489 1.00 60.05 ? 338 THR F OG1 1 ATOM 5655 C CG2 . THR C 3 360 ? -3.136 42.162 -15.694 1.00 56.74 ? 338 THR F CG2 1 ATOM 5656 N N . ILE C 3 361 ? -3.252 44.851 -13.368 1.00 47.37 ? 339 ILE F N 1 ATOM 5657 C CA . ILE C 3 361 ? -4.199 45.454 -12.417 1.00 46.67 ? 339 ILE F CA 1 ATOM 5658 C C . ILE C 3 361 ? -5.605 44.842 -12.570 1.00 51.00 ? 339 ILE F C 1 ATOM 5659 O O . ILE C 3 361 ? -6.090 44.688 -13.693 1.00 50.75 ? 339 ILE F O 1 ATOM 5660 C CB . ILE C 3 361 ? -4.220 47.015 -12.527 1.00 49.31 ? 339 ILE F CB 1 ATOM 5661 C CG1 . ILE C 3 361 ? -2.816 47.669 -12.711 1.00 49.60 ? 339 ILE F CG1 1 ATOM 5662 C CG2 . ILE C 3 361 ? -5.063 47.689 -11.432 1.00 50.09 ? 339 ILE F CG2 1 ATOM 5663 C CD1 . ILE C 3 361 ? -1.720 47.469 -11.670 1.00 56.75 ? 339 ILE F CD1 1 ATOM 5664 N N . ARG C 3 362 ? -6.251 44.513 -11.431 1.00 47.97 ? 340 ARG F N 1 ATOM 5665 C CA . ARG C 3 362 ? -7.591 43.920 -11.353 1.00 48.62 ? 340 ARG F CA 1 ATOM 5666 C C . ARG C 3 362 ? -8.701 44.869 -11.843 1.00 52.75 ? 340 ARG F C 1 ATOM 5667 O O . ARG C 3 362 ? -9.588 44.428 -12.576 1.00 52.93 ? 340 ARG F O 1 ATOM 5668 C CB . ARG C 3 362 ? -7.879 43.443 -9.919 1.00 49.61 ? 340 ARG F CB 1 ATOM 5669 C CG . ARG C 3 362 ? -9.053 42.477 -9.810 1.00 61.67 ? 340 ARG F CG 1 ATOM 5670 C CD . ARG C 3 362 ? -9.684 42.526 -8.435 1.00 73.63 ? 340 ARG F CD 1 ATOM 5671 N NE . ARG C 3 362 ? -9.757 41.194 -7.835 1.00 85.28 ? 340 ARG F NE 1 ATOM 5672 C CZ . ARG C 3 362 ? -9.871 40.958 -6.531 1.00 101.61 ? 340 ARG F CZ 1 ATOM 5673 N NH1 . ARG C 3 362 ? -9.914 41.965 -5.667 1.00 89.06 ? 340 ARG F NH1 1 ATOM 5674 N NH2 . ARG C 3 362 ? -9.930 39.712 -6.080 1.00 90.17 ? 340 ARG F NH2 1 ATOM 5675 N N . GLU C 3 363 ? -8.654 46.155 -11.432 1.00 49.21 ? 341 GLU F N 1 ATOM 5676 C CA . GLU C 3 363 ? -9.639 47.187 -11.787 1.00 49.75 ? 341 GLU F CA 1 ATOM 5677 C C . GLU C 3 363 ? -9.377 47.794 -13.164 1.00 53.32 ? 341 GLU F C 1 ATOM 5678 O O . GLU C 3 363 ? -8.235 48.136 -13.477 1.00 52.04 ? 341 GLU F O 1 ATOM 5679 C CB . GLU C 3 363 ? -9.657 48.314 -10.738 1.00 51.55 ? 341 GLU F CB 1 ATOM 5680 C CG . GLU C 3 363 ? -10.032 47.875 -9.334 1.00 62.50 ? 341 GLU F CG 1 ATOM 5681 C CD . GLU C 3 363 ? -8.914 47.443 -8.402 1.00 80.71 ? 341 GLU F CD 1 ATOM 5682 O OE1 . GLU C 3 363 ? -7.886 46.894 -8.867 1.00 72.51 ? 341 GLU F OE1 1 ATOM 5683 O OE2 . GLU C 3 363 ? -9.133 47.557 -7.175 1.00 75.10 ? 341 GLU F OE2 1 ATOM 5684 N N . ALA C 3 364 ? -10.442 47.965 -13.966 1.00 50.89 ? 342 ALA F N 1 ATOM 5685 C CA . ALA C 3 364 ? -10.372 48.556 -15.307 1.00 50.65 ? 342 ALA F CA 1 ATOM 5686 C C . ALA C 3 364 ? -10.780 50.034 -15.301 1.00 55.59 ? 342 ALA F C 1 ATOM 5687 O O . ALA C 3 364 ? -10.257 50.816 -16.098 1.00 54.97 ? 342 ALA F O 1 ATOM 5688 C CB . ALA C 3 364 ? -11.252 47.774 -16.269 1.00 51.93 ? 342 ALA F CB 1 ATOM 5689 N N . GLU C 3 365 ? -11.722 50.408 -14.412 1.00 53.60 ? 343 GLU F N 1 ATOM 5690 C CA . GLU C 3 365 ? -12.223 51.778 -14.279 1.00 55.08 ? 343 GLU F CA 1 ATOM 5691 C C . GLU C 3 365 ? -12.518 52.169 -12.829 1.00 60.08 ? 343 GLU F C 1 ATOM 5692 O O . GLU C 3 365 ? -13.002 51.341 -12.054 1.00 59.90 ? 343 GLU F O 1 ATOM 5693 C CB . GLU C 3 365 ? -13.438 52.045 -15.203 1.00 58.11 ? 343 GLU F CB 1 ATOM 5694 C CG . GLU C 3 365 ? -14.687 51.213 -14.939 1.00 70.49 ? 343 GLU F CG 1 ATOM 5695 C CD . GLU C 3 365 ? -15.991 51.867 -15.359 1.00 95.29 ? 343 GLU F CD 1 ATOM 5696 O OE1 . GLU C 3 365 ? -16.215 52.033 -16.580 1.00 91.67 ? 343 GLU F OE1 1 ATOM 5697 O OE2 . GLU C 3 365 ? -16.801 52.198 -14.462 1.00 91.78 ? 343 GLU F OE2 1 ATOM 5698 N N . ILE C 3 366 ? -12.213 53.431 -12.470 1.00 57.65 ? 344 ILE F N 1 ATOM 5699 C CA . ILE C 3 366 ? -12.455 53.998 -11.135 1.00 59.03 ? 344 ILE F CA 1 ATOM 5700 C C . ILE C 3 366 ? -13.112 55.384 -11.234 1.00 65.71 ? 344 ILE F C 1 ATOM 5701 O O . ILE C 3 366 ? -12.872 56.115 -12.200 1.00 65.47 ? 344 ILE F O 1 ATOM 5702 C CB . ILE C 3 366 ? -11.194 54.008 -10.206 1.00 60.75 ? 344 ILE F CB 1 ATOM 5703 C CG1 . ILE C 3 366 ? -10.064 54.915 -10.732 1.00 60.64 ? 344 ILE F CG1 1 ATOM 5704 C CG2 . ILE C 3 366 ? -10.690 52.602 -9.856 1.00 59.41 ? 344 ILE F CG2 1 ATOM 5705 C CD1 . ILE C 3 366 ? -9.952 56.196 -9.998 1.00 70.23 ? 344 ILE F CD1 1 ATOM 5706 N N . GLU C 3 367 ? -13.913 55.751 -10.220 1.00 64.74 ? 345 GLU F N 1 ATOM 5707 C CA . GLU C 3 367 ? -14.580 57.051 -10.166 1.00 67.94 ? 345 GLU F CA 1 ATOM 5708 C C . GLU C 3 367 ? -13.658 58.082 -9.508 1.00 72.22 ? 345 GLU F C 1 ATOM 5709 O O . GLU C 3 367 ? -13.313 57.936 -8.332 1.00 71.54 ? 345 GLU F O 1 ATOM 5710 C CB . GLU C 3 367 ? -15.927 56.953 -9.420 1.00 72.38 ? 345 GLU F CB 1 ATOM 5711 C CG . GLU C 3 367 ? -17.152 57.104 -10.308 1.00 85.48 ? 345 GLU F CG 1 ATOM 5712 C CD . GLU C 3 367 ? -17.479 58.520 -10.739 1.00 109.33 ? 345 GLU F CD 1 ATOM 5713 O OE1 . GLU C 3 367 ? -18.105 59.257 -9.943 1.00 107.75 ? 345 GLU F OE1 1 ATOM 5714 O OE2 . GLU C 3 367 ? -17.117 58.891 -11.878 1.00 102.53 ? 345 GLU F OE2 1 ATOM 5715 N N . VAL C 3 368 ? -13.232 59.102 -10.281 1.00 69.51 ? 346 VAL F N 1 ATOM 5716 C CA . VAL C 3 368 ? -12.367 60.178 -9.780 1.00 70.25 ? 346 VAL F CA 1 ATOM 5717 C C . VAL C 3 368 ? -13.196 61.340 -9.210 1.00 78.46 ? 346 VAL F C 1 ATOM 5718 O O . VAL C 3 368 ? -14.277 61.628 -9.730 1.00 80.51 ? 346 VAL F O 1 ATOM 5719 C CB . VAL C 3 368 ? -11.234 60.641 -10.748 1.00 72.77 ? 346 VAL F CB 1 ATOM 5720 C CG1 . VAL C 3 368 ? -10.283 59.508 -11.093 1.00 68.66 ? 346 VAL F CG1 1 ATOM 5721 C CG2 . VAL C 3 368 ? -11.757 61.328 -12.001 1.00 74.33 ? 346 VAL F CG2 1 ATOM 5722 N N . GLU C 3 369 ? -12.704 61.987 -8.134 1.00 76.27 ? 347 GLU F N 1 ATOM 5723 C CA . GLU C 3 369 ? -13.412 63.093 -7.479 1.00 80.74 ? 347 GLU F CA 1 ATOM 5724 C C . GLU C 3 369 ? -12.661 64.429 -7.532 1.00 86.62 ? 347 GLU F C 1 ATOM 5725 O O . GLU C 3 369 ? -13.111 65.348 -8.219 1.00 89.21 ? 347 GLU F O 1 ATOM 5726 C CB . GLU C 3 369 ? -13.822 62.722 -6.043 1.00 83.12 ? 347 GLU F CB 1 ATOM 5727 C CG . GLU C 3 369 ? -15.003 61.772 -5.973 1.00 93.63 ? 347 GLU F CG 1 ATOM 5728 C CD . GLU C 3 369 ? -16.159 62.290 -5.144 1.00 117.87 ? 347 GLU F CD 1 ATOM 5729 O OE1 . GLU C 3 369 ? -16.260 61.900 -3.958 1.00 112.80 ? 347 GLU F OE1 1 ATOM 5730 O OE2 . GLU C 3 369 ? -16.967 63.084 -5.677 1.00 114.70 ? 347 GLU F OE2 1 ATOM 5731 N N . GLY C 3 370 ? -11.539 64.518 -6.815 1.00 81.81 ? 348 GLY F N 1 ATOM 5732 C CA . GLY C 3 370 ? -10.710 65.717 -6.744 1.00 83.61 ? 348 GLY F CA 1 ATOM 5733 C C . GLY C 3 370 ? -9.386 65.473 -6.051 1.00 85.03 ? 348 GLY F C 1 ATOM 5734 O O . GLY C 3 370 ? -8.477 64.892 -6.647 1.00 81.13 ? 348 GLY F O 1 ATOM 5735 N N . ASN C 3 371 ? -9.267 65.922 -4.784 1.00 83.74 ? 349 ASN F N 1 ATOM 5736 C CA . ASN C 3 371 ? -8.064 65.745 -3.962 1.00 81.75 ? 349 ASN F CA 1 ATOM 5737 C C . ASN C 3 371 ? -8.214 64.508 -3.052 1.00 83.09 ? 349 ASN F C 1 ATOM 5738 O O . ASN C 3 371 ? -8.000 64.585 -1.838 1.00 83.50 ? 349 ASN F O 1 ATOM 5739 C CB . ASN C 3 371 ? -7.763 67.018 -3.153 1.00 86.84 ? 349 ASN F CB 1 ATOM 5740 C CG . ASN C 3 371 ? -7.352 68.202 -3.991 1.00 113.55 ? 349 ASN F CG 1 ATOM 5741 O OD1 . ASN C 3 371 ? -8.182 68.872 -4.615 1.00 111.56 ? 349 ASN F OD1 1 ATOM 5742 N ND2 . ASN C 3 371 ? -6.063 68.508 -3.997 1.00 104.60 ? 349 ASN F ND2 1 ATOM 5743 N N . SER C 3 372 ? -8.581 63.364 -3.659 1.00 76.76 ? 350 SER F N 1 ATOM 5744 C CA . SER C 3 372 ? -8.801 62.086 -2.975 1.00 74.25 ? 350 SER F CA 1 ATOM 5745 C C . SER C 3 372 ? -7.723 61.041 -3.333 1.00 73.61 ? 350 SER F C 1 ATOM 5746 O O . SER C 3 372 ? -6.715 61.385 -3.957 1.00 72.14 ? 350 SER F O 1 ATOM 5747 C CB . SER C 3 372 ? -10.196 61.553 -3.298 1.00 78.82 ? 350 SER F CB 1 ATOM 5748 O OG . SER C 3 372 ? -11.208 62.502 -3.006 1.00 92.54 ? 350 SER F OG 1 ATOM 5749 N N . GLN C 3 373 ? -7.932 59.774 -2.916 1.00 67.99 ? 351 GLN F N 1 ATOM 5750 C CA . GLN C 3 373 ? -7.028 58.648 -3.176 1.00 64.28 ? 351 GLN F CA 1 ATOM 5751 C C . GLN C 3 373 ? -7.779 57.410 -3.682 1.00 66.49 ? 351 GLN F C 1 ATOM 5752 O O . GLN C 3 373 ? -8.939 57.202 -3.319 1.00 67.51 ? 351 GLN F O 1 ATOM 5753 C CB . GLN C 3 373 ? -6.167 58.309 -1.939 1.00 64.78 ? 351 GLN F CB 1 ATOM 5754 C CG . GLN C 3 373 ? -6.953 58.021 -0.656 1.00 81.39 ? 351 GLN F CG 1 ATOM 5755 C CD . GLN C 3 373 ? -6.180 57.158 0.308 1.00 99.34 ? 351 GLN F CD 1 ATOM 5756 O OE1 . GLN C 3 373 ? -6.424 55.953 0.428 1.00 93.46 ? 351 GLN F OE1 1 ATOM 5757 N NE2 . GLN C 3 373 ? -5.243 57.754 1.030 1.00 92.04 ? 351 GLN F NE2 1 ATOM 5758 N N . LEU C 3 374 ? -7.108 56.592 -4.513 1.00 60.36 ? 352 LEU F N 1 ATOM 5759 C CA . LEU C 3 374 ? -7.665 55.357 -5.075 1.00 58.68 ? 352 LEU F CA 1 ATOM 5760 C C . LEU C 3 374 ? -6.876 54.114 -4.633 1.00 60.13 ? 352 LEU F C 1 ATOM 5761 O O . LEU C 3 374 ? -5.666 54.202 -4.413 1.00 58.79 ? 352 LEU F O 1 ATOM 5762 C CB . LEU C 3 374 ? -7.775 55.438 -6.617 1.00 58.22 ? 352 LEU F CB 1 ATOM 5763 C CG . LEU C 3 374 ? -6.472 55.580 -7.417 1.00 61.55 ? 352 LEU F CG 1 ATOM 5764 C CD1 . LEU C 3 374 ? -6.100 54.277 -8.089 1.00 59.66 ? 352 LEU F CD1 1 ATOM 5765 C CD2 . LEU C 3 374 ? -6.586 56.664 -8.463 1.00 65.29 ? 352 LEU F CD2 1 ATOM 5766 N N . GLN C 3 375 ? -7.562 52.964 -4.510 1.00 56.03 ? 353 GLN F N 1 ATOM 5767 C CA . GLN C 3 375 ? -6.935 51.697 -4.130 1.00 54.18 ? 353 GLN F CA 1 ATOM 5768 C C . GLN C 3 375 ? -7.104 50.669 -5.250 1.00 56.53 ? 353 GLN F C 1 ATOM 5769 O O . GLN C 3 375 ? -8.223 50.440 -5.717 1.00 56.73 ? 353 GLN F O 1 ATOM 5770 C CB . GLN C 3 375 ? -7.494 51.170 -2.797 1.00 56.42 ? 353 GLN F CB 1 ATOM 5771 C CG . GLN C 3 375 ? -6.595 50.126 -2.136 1.00 72.39 ? 353 GLN F CG 1 ATOM 5772 C CD . GLN C 3 375 ? -7.184 49.569 -0.865 1.00 94.04 ? 353 GLN F CD 1 ATOM 5773 O OE1 . GLN C 3 375 ? -8.203 48.869 -0.869 1.00 90.56 ? 353 GLN F OE1 1 ATOM 5774 N NE2 . GLN C 3 375 ? -6.525 49.834 0.251 1.00 86.93 ? 353 GLN F NE2 1 ATOM 5775 N N . ILE C 3 376 ? -5.984 50.069 -5.689 1.00 51.47 ? 354 ILE F N 1 ATOM 5776 C CA . ILE C 3 376 ? -5.959 49.063 -6.758 1.00 50.40 ? 354 ILE F CA 1 ATOM 5777 C C . ILE C 3 376 ? -5.332 47.739 -6.318 1.00 53.36 ? 354 ILE F C 1 ATOM 5778 O O . ILE C 3 376 ? -4.481 47.720 -5.426 1.00 52.69 ? 354 ILE F O 1 ATOM 5779 C CB . ILE C 3 376 ? -5.334 49.590 -8.086 1.00 53.01 ? 354 ILE F CB 1 ATOM 5780 C CG1 . ILE C 3 376 ? -3.908 50.157 -7.882 1.00 53.13 ? 354 ILE F CG1 1 ATOM 5781 C CG2 . ILE C 3 376 ? -6.260 50.586 -8.790 1.00 54.49 ? 354 ILE F CG2 1 ATOM 5782 C CD1 . ILE C 3 376 ? -2.901 49.751 -8.945 1.00 59.81 ? 354 ILE F CD1 1 ATOM 5783 N N . SER C 3 377 ? -5.757 46.637 -6.958 1.00 49.74 ? 355 SER F N 1 ATOM 5784 C CA . SER C 3 377 ? -5.240 45.291 -6.720 1.00 49.47 ? 355 SER F CA 1 ATOM 5785 C C . SER C 3 377 ? -4.408 44.877 -7.931 1.00 52.39 ? 355 SER F C 1 ATOM 5786 O O . SER C 3 377 ? -4.867 45.025 -9.068 1.00 51.87 ? 355 SER F O 1 ATOM 5787 C CB . SER C 3 377 ? -6.380 44.304 -6.489 1.00 54.05 ? 355 SER F CB 1 ATOM 5788 O OG . SER C 3 377 ? -7.106 44.626 -5.314 1.00 63.86 ? 355 SER F OG 1 ATOM 5789 N N . PHE C 3 378 ? -3.178 44.392 -7.693 1.00 48.51 ? 356 PHE F N 1 ATOM 5790 C CA . PHE C 3 378 ? -2.279 43.988 -8.773 1.00 48.31 ? 356 PHE F CA 1 ATOM 5791 C C . PHE C 3 378 ? -1.651 42.603 -8.610 1.00 53.14 ? 356 PHE F C 1 ATOM 5792 O O . PHE C 3 378 ? -1.501 42.116 -7.489 1.00 52.97 ? 356 PHE F O 1 ATOM 5793 C CB . PHE C 3 378 ? -1.220 45.070 -9.056 1.00 49.64 ? 356 PHE F CB 1 ATOM 5794 C CG . PHE C 3 378 ? -0.171 45.280 -7.991 1.00 51.23 ? 356 PHE F CG 1 ATOM 5795 C CD1 . PHE C 3 378 ? -0.390 46.164 -6.941 1.00 53.76 ? 356 PHE F CD1 1 ATOM 5796 C CD2 . PHE C 3 378 ? 1.057 44.634 -8.065 1.00 54.21 ? 356 PHE F CD2 1 ATOM 5797 C CE1 . PHE C 3 378 ? 0.589 46.371 -5.965 1.00 54.91 ? 356 PHE F CE1 1 ATOM 5798 C CE2 . PHE C 3 378 ? 2.035 44.842 -7.091 1.00 57.36 ? 356 PHE F CE2 1 ATOM 5799 C CZ . PHE C 3 378 ? 1.793 45.706 -6.045 1.00 54.78 ? 356 PHE F CZ 1 ATOM 5800 N N . SER C 3 379 ? -1.277 41.980 -9.744 1.00 50.61 ? 357 SER F N 1 ATOM 5801 C CA . SER C 3 379 ? -0.641 40.665 -9.795 1.00 52.15 ? 357 SER F CA 1 ATOM 5802 C C . SER C 3 379 ? 0.718 40.758 -10.487 1.00 57.24 ? 357 SER F C 1 ATOM 5803 O O . SER C 3 379 ? 0.826 41.361 -11.558 1.00 56.40 ? 357 SER F O 1 ATOM 5804 C CB . SER C 3 379 ? -1.534 39.663 -10.520 1.00 56.48 ? 357 SER F CB 1 ATOM 5805 O OG . SER C 3 379 ? -1.034 38.342 -10.398 1.00 67.05 ? 357 SER F OG 1 ATOM 5806 N N . THR C 3 380 ? 1.754 40.171 -9.859 1.00 55.61 ? 358 THR F N 1 ATOM 5807 C CA . THR C 3 380 ? 3.134 40.137 -10.361 1.00 57.10 ? 358 THR F CA 1 ATOM 5808 C C . THR C 3 380 ? 3.879 38.877 -9.899 1.00 63.78 ? 358 THR F C 1 ATOM 5809 O O . THR C 3 380 ? 3.468 38.240 -8.929 1.00 63.57 ? 358 THR F O 1 ATOM 5810 C CB . THR C 3 380 ? 3.890 41.452 -10.045 1.00 64.36 ? 358 THR F CB 1 ATOM 5811 O OG1 . THR C 3 380 ? 5.133 41.464 -10.751 1.00 65.93 ? 358 THR F OG1 1 ATOM 5812 C CG2 . THR C 3 380 ? 4.130 41.667 -8.549 1.00 62.39 ? 358 THR F CG2 1 ATOM 5813 N N . ALA C 3 381 ? 4.969 38.527 -10.600 1.00 62.79 ? 359 ALA F N 1 ATOM 5814 C CA . ALA C 3 381 ? 5.815 37.374 -10.288 1.00 65.82 ? 359 ALA F CA 1 ATOM 5815 C C . ALA C 3 381 ? 7.175 37.828 -9.739 1.00 71.01 ? 359 ALA F C 1 ATOM 5816 O O . ALA C 3 381 ? 7.897 37.025 -9.142 1.00 73.17 ? 359 ALA F O 1 ATOM 5817 C CB . ALA C 3 381 ? 6.010 36.525 -11.533 1.00 69.11 ? 359 ALA F CB 1 ATOM 5818 N N . LEU C 3 382 ? 7.513 39.118 -9.940 1.00 66.03 ? 360 LEU F N 1 ATOM 5819 C CA . LEU C 3 382 ? 8.772 39.728 -9.506 1.00 66.88 ? 360 LEU F CA 1 ATOM 5820 C C . LEU C 3 382 ? 8.783 40.085 -8.025 1.00 69.38 ? 360 LEU F C 1 ATOM 5821 O O . LEU C 3 382 ? 7.782 40.579 -7.499 1.00 66.35 ? 360 LEU F O 1 ATOM 5822 C CB . LEU C 3 382 ? 9.079 40.984 -10.337 1.00 66.07 ? 360 LEU F CB 1 ATOM 5823 C CG . LEU C 3 382 ? 9.657 40.770 -11.733 1.00 73.02 ? 360 LEU F CG 1 ATOM 5824 C CD1 . LEU C 3 382 ? 9.172 41.836 -12.670 1.00 71.27 ? 360 LEU F CD1 1 ATOM 5825 C CD2 . LEU C 3 382 ? 11.185 40.749 -11.713 1.00 78.81 ? 360 LEU F CD2 1 ATOM 5826 N N . ALA C 3 383 ? 9.934 39.855 -7.363 1.00 67.95 ? 361 ALA F N 1 ATOM 5827 C CA . ALA C 3 383 ? 10.155 40.176 -5.951 1.00 67.00 ? 361 ALA F CA 1 ATOM 5828 C C . ALA C 3 383 ? 10.319 41.691 -5.789 1.00 68.62 ? 361 ALA F C 1 ATOM 5829 O O . ALA C 3 383 ? 9.846 42.259 -4.805 1.00 66.25 ? 361 ALA F O 1 ATOM 5830 C CB . ALA C 3 383 ? 11.390 39.453 -5.435 1.00 71.13 ? 361 ALA F CB 1 ATOM 5831 N N . SER C 3 384 ? 10.982 42.336 -6.769 1.00 65.81 ? 362 SER F N 1 ATOM 5832 C CA . SER C 3 384 ? 11.196 43.780 -6.830 1.00 64.31 ? 362 SER F CA 1 ATOM 5833 C C . SER C 3 384 ? 10.398 44.300 -8.030 1.00 66.27 ? 362 SER F C 1 ATOM 5834 O O . SER C 3 384 ? 10.878 44.261 -9.168 1.00 67.29 ? 362 SER F O 1 ATOM 5835 C CB . SER C 3 384 ? 12.683 44.102 -6.963 1.00 70.67 ? 362 SER F CB 1 ATOM 5836 O OG . SER C 3 384 ? 12.913 45.501 -6.974 1.00 78.66 ? 362 SER F OG 1 ATOM 5837 N N . ALA C 3 385 ? 9.149 44.725 -7.772 1.00 59.83 ? 363 ALA F N 1 ATOM 5838 C CA . ALA C 3 385 ? 8.234 45.206 -8.804 1.00 57.99 ? 363 ALA F CA 1 ATOM 5839 C C . ALA C 3 385 ? 8.272 46.724 -9.020 1.00 60.54 ? 363 ALA F C 1 ATOM 5840 O O . ALA C 3 385 ? 7.812 47.499 -8.175 1.00 58.79 ? 363 ALA F O 1 ATOM 5841 C CB . ALA C 3 385 ? 6.815 44.728 -8.521 1.00 56.92 ? 363 ALA F CB 1 ATOM 5842 N N . GLU C 3 386 ? 8.839 47.134 -10.166 1.00 57.89 ? 364 GLU F N 1 ATOM 5843 C CA . GLU C 3 386 ? 8.933 48.524 -10.608 1.00 57.31 ? 364 GLU F CA 1 ATOM 5844 C C . GLU C 3 386 ? 7.915 48.676 -11.733 1.00 59.41 ? 364 GLU F C 1 ATOM 5845 O O . GLU C 3 386 ? 8.109 48.107 -12.812 1.00 59.90 ? 364 GLU F O 1 ATOM 5846 C CB . GLU C 3 386 ? 10.344 48.828 -11.129 1.00 61.29 ? 364 GLU F CB 1 ATOM 5847 C CG . GLU C 3 386 ? 10.970 50.048 -10.489 1.00 72.48 ? 364 GLU F CG 1 ATOM 5848 C CD . GLU C 3 386 ? 11.941 49.695 -9.386 1.00 94.46 ? 364 GLU F CD 1 ATOM 5849 O OE1 . GLU C 3 386 ? 13.161 49.659 -9.665 1.00 91.45 ? 364 GLU F OE1 1 ATOM 5850 O OE2 . GLU C 3 386 ? 11.487 49.438 -8.249 1.00 87.71 ? 364 GLU F OE2 1 ATOM 5851 N N . PHE C 3 387 ? 6.800 49.382 -11.471 1.00 53.74 ? 365 PHE F N 1 ATOM 5852 C CA . PHE C 3 387 ? 5.742 49.534 -12.472 1.00 52.35 ? 365 PHE F CA 1 ATOM 5853 C C . PHE C 3 387 ? 5.081 50.904 -12.541 1.00 55.06 ? 365 PHE F C 1 ATOM 5854 O O . PHE C 3 387 ? 5.027 51.622 -11.542 1.00 54.38 ? 365 PHE F O 1 ATOM 5855 C CB . PHE C 3 387 ? 4.698 48.405 -12.361 1.00 53.03 ? 365 PHE F CB 1 ATOM 5856 C CG . PHE C 3 387 ? 3.889 48.349 -11.085 1.00 53.35 ? 365 PHE F CG 1 ATOM 5857 C CD1 . PHE C 3 387 ? 4.414 47.774 -9.933 1.00 56.71 ? 365 PHE F CD1 1 ATOM 5858 C CD2 . PHE C 3 387 ? 2.576 48.802 -11.056 1.00 54.36 ? 365 PHE F CD2 1 ATOM 5859 C CE1 . PHE C 3 387 ? 3.656 47.699 -8.760 1.00 56.70 ? 365 PHE F CE1 1 ATOM 5860 C CE2 . PHE C 3 387 ? 1.814 48.717 -9.885 1.00 56.48 ? 365 PHE F CE2 1 ATOM 5861 C CZ . PHE C 3 387 ? 2.360 48.167 -8.745 1.00 54.77 ? 365 PHE F CZ 1 ATOM 5862 N N . ARG C 3 388 ? 4.577 51.255 -13.739 1.00 51.22 ? 366 ARG F N 1 ATOM 5863 C CA . ARG C 3 388 ? 3.885 52.513 -14.014 1.00 50.69 ? 366 ARG F CA 1 ATOM 5864 C C . ARG C 3 388 ? 2.386 52.256 -14.175 1.00 52.65 ? 366 ARG F C 1 ATOM 5865 O O . ARG C 3 388 ? 1.993 51.329 -14.887 1.00 51.69 ? 366 ARG F O 1 ATOM 5866 C CB . ARG C 3 388 ? 4.446 53.187 -15.277 1.00 52.58 ? 366 ARG F CB 1 ATOM 5867 C CG . ARG C 3 388 ? 5.879 53.695 -15.144 1.00 65.82 ? 366 ARG F CG 1 ATOM 5868 C CD . ARG C 3 388 ? 6.458 54.096 -16.490 1.00 79.09 ? 366 ARG F CD 1 ATOM 5869 N NE . ARG C 3 388 ? 6.742 52.934 -17.337 1.00 89.65 ? 366 ARG F NE 1 ATOM 5870 C CZ . ARG C 3 388 ? 6.759 52.956 -18.666 1.00 105.43 ? 366 ARG F CZ 1 ATOM 5871 N NH1 . ARG C 3 388 ? 6.503 54.082 -19.323 1.00 93.34 ? 366 ARG F NH1 1 ATOM 5872 N NH2 . ARG C 3 388 ? 7.026 51.852 -19.350 1.00 93.26 ? 366 ARG F NH2 1 ATOM 5873 N N . VAL C 3 389 ? 1.556 53.070 -13.501 1.00 48.55 ? 367 VAL F N 1 ATOM 5874 C CA . VAL C 3 389 ? 0.095 52.964 -13.551 1.00 47.39 ? 367 VAL F CA 1 ATOM 5875 C C . VAL C 3 389 ? -0.470 54.195 -14.261 1.00 51.45 ? 367 VAL F C 1 ATOM 5876 O O . VAL C 3 389 ? -0.208 55.324 -13.837 1.00 51.87 ? 367 VAL F O 1 ATOM 5877 C CB . VAL C 3 389 ? -0.540 52.752 -12.143 1.00 50.78 ? 367 VAL F CB 1 ATOM 5878 C CG1 . VAL C 3 389 ? -2.065 52.684 -12.221 1.00 50.36 ? 367 VAL F CG1 1 ATOM 5879 C CG2 . VAL C 3 389 ? 0.011 51.502 -11.467 1.00 50.02 ? 367 VAL F CG2 1 ATOM 5880 N N . GLN C 3 390 ? -1.235 53.974 -15.342 1.00 47.52 ? 368 GLN F N 1 ATOM 5881 C CA . GLN C 3 390 ? -1.858 55.059 -16.090 1.00 48.12 ? 368 GLN F CA 1 ATOM 5882 C C . GLN C 3 390 ? -3.320 55.215 -15.678 1.00 51.83 ? 368 GLN F C 1 ATOM 5883 O O . GLN C 3 390 ? -4.164 54.393 -16.045 1.00 50.75 ? 368 GLN F O 1 ATOM 5884 C CB . GLN C 3 390 ? -1.707 54.866 -17.613 1.00 49.61 ? 368 GLN F CB 1 ATOM 5885 C CG . GLN C 3 390 ? -2.133 56.090 -18.426 1.00 67.89 ? 368 GLN F CG 1 ATOM 5886 C CD . GLN C 3 390 ? -2.002 55.866 -19.908 1.00 88.84 ? 368 GLN F CD 1 ATOM 5887 O OE1 . GLN C 3 390 ? -2.920 55.377 -20.574 1.00 83.89 ? 368 GLN F OE1 1 ATOM 5888 N NE2 . GLN C 3 390 ? -0.860 56.236 -20.462 1.00 83.09 ? 368 GLN F NE2 1 ATOM 5889 N N . VAL C 3 391 ? -3.600 56.254 -14.879 1.00 49.48 ? 369 VAL F N 1 ATOM 5890 C CA . VAL C 3 391 ? -4.950 56.603 -14.440 1.00 50.17 ? 369 VAL F CA 1 ATOM 5891 C C . VAL C 3 391 ? -5.341 57.763 -15.358 1.00 55.80 ? 369 VAL F C 1 ATOM 5892 O O . VAL C 3 391 ? -4.690 58.811 -15.336 1.00 56.65 ? 369 VAL F O 1 ATOM 5893 C CB . VAL C 3 391 ? -5.051 56.940 -12.925 1.00 54.68 ? 369 VAL F CB 1 ATOM 5894 C CG1 . VAL C 3 391 ? -6.506 57.120 -12.501 1.00 55.74 ? 369 VAL F CG1 1 ATOM 5895 C CG2 . VAL C 3 391 ? -4.385 55.866 -12.068 1.00 52.91 ? 369 VAL F CG2 1 ATOM 5896 N N . CYS C 3 392 ? -6.333 57.523 -16.240 1.00 52.60 ? 370 CYS F N 1 ATOM 5897 C CA . CYS C 3 392 ? -6.800 58.437 -17.289 1.00 54.15 ? 370 CYS F CA 1 ATOM 5898 C C . CYS C 3 392 ? -5.673 58.648 -18.323 1.00 58.21 ? 370 CYS F C 1 ATOM 5899 O O . CYS C 3 392 ? -5.303 57.679 -18.989 1.00 56.08 ? 370 CYS F O 1 ATOM 5900 C CB . CYS C 3 392 ? -7.345 59.752 -16.724 1.00 57.04 ? 370 CYS F CB 1 ATOM 5901 S SG . CYS C 3 392 ? -9.153 59.876 -16.744 1.00 62.71 ? 370 CYS F SG 1 ATOM 5902 N N . SER C 3 393 ? -5.092 59.864 -18.419 1.00 57.10 ? 371 SER F N 1 ATOM 5903 C CA . SER C 3 393 ? -4.011 60.168 -19.363 1.00 57.40 ? 371 SER F CA 1 ATOM 5904 C C . SER C 3 393 ? -2.655 60.482 -18.692 1.00 62.08 ? 371 SER F C 1 ATOM 5905 O O . SER C 3 393 ? -1.700 60.839 -19.388 1.00 62.33 ? 371 SER F O 1 ATOM 5906 C CB . SER C 3 393 ? -4.430 61.290 -20.310 1.00 63.07 ? 371 SER F CB 1 ATOM 5907 O OG . SER C 3 393 ? -5.469 60.869 -21.179 1.00 71.08 ? 371 SER F OG 1 ATOM 5908 N N . THR C 3 394 ? -2.564 60.325 -17.355 1.00 58.74 ? 372 THR F N 1 ATOM 5909 C CA . THR C 3 394 ? -1.338 60.590 -16.594 1.00 59.12 ? 372 THR F CA 1 ATOM 5910 C C . THR C 3 394 ? -0.781 59.301 -15.967 1.00 61.31 ? 372 THR F C 1 ATOM 5911 O O . THR C 3 394 ? -1.549 58.478 -15.465 1.00 59.50 ? 372 THR F O 1 ATOM 5912 C CB . THR C 3 394 ? -1.557 61.728 -15.574 1.00 69.33 ? 372 THR F CB 1 ATOM 5913 O OG1 . THR C 3 394 ? -2.374 62.749 -16.152 1.00 71.06 ? 372 THR F OG1 1 ATOM 5914 C CG2 . THR C 3 394 ? -0.248 62.338 -15.079 1.00 69.17 ? 372 THR F CG2 1 ATOM 5915 N N . GLN C 3 395 ? 0.555 59.136 -16.006 1.00 58.31 ? 373 GLN F N 1 ATOM 5916 C CA . GLN C 3 395 ? 1.259 57.973 -15.461 1.00 56.86 ? 373 GLN F CA 1 ATOM 5917 C C . GLN C 3 395 ? 1.873 58.249 -14.088 1.00 61.58 ? 373 GLN F C 1 ATOM 5918 O O . GLN C 3 395 ? 2.383 59.345 -13.846 1.00 62.85 ? 373 GLN F O 1 ATOM 5919 C CB . GLN C 3 395 ? 2.342 57.487 -16.437 1.00 58.46 ? 373 GLN F CB 1 ATOM 5920 C CG . GLN C 3 395 ? 1.804 56.622 -17.572 1.00 73.71 ? 373 GLN F CG 1 ATOM 5921 C CD . GLN C 3 395 ? 2.846 56.340 -18.626 1.00 94.52 ? 373 GLN F CD 1 ATOM 5922 O OE1 . GLN C 3 395 ? 2.806 56.890 -19.730 1.00 91.50 ? 373 GLN F OE1 1 ATOM 5923 N NE2 . GLN C 3 395 ? 3.795 55.466 -18.318 1.00 86.46 ? 373 GLN F NE2 1 ATOM 5924 N N . VAL C 3 396 ? 1.830 57.241 -13.198 1.00 57.12 ? 374 VAL F N 1 ATOM 5925 C CA . VAL C 3 396 ? 2.388 57.297 -11.843 1.00 57.21 ? 374 VAL F CA 1 ATOM 5926 C C . VAL C 3 396 ? 3.269 56.060 -11.577 1.00 60.57 ? 374 VAL F C 1 ATOM 5927 O O . VAL C 3 396 ? 2.869 54.940 -11.900 1.00 58.82 ? 374 VAL F O 1 ATOM 5928 C CB . VAL C 3 396 ? 1.311 57.573 -10.744 1.00 61.00 ? 374 VAL F CB 1 ATOM 5929 C CG1 . VAL C 3 396 ? 0.273 56.454 -10.650 1.00 59.24 ? 374 VAL F CG1 1 ATOM 5930 C CG2 . VAL C 3 396 ? 1.944 57.855 -9.382 1.00 61.36 ? 374 VAL F CG2 1 ATOM 5931 N N . HIS C 3 397 ? 4.479 56.276 -11.030 1.00 58.64 ? 375 HIS F N 1 ATOM 5932 C CA . HIS C 3 397 ? 5.426 55.202 -10.730 1.00 58.47 ? 375 HIS F CA 1 ATOM 5933 C C . HIS C 3 397 ? 5.136 54.553 -9.377 1.00 61.43 ? 375 HIS F C 1 ATOM 5934 O O . HIS C 3 397 ? 4.964 55.253 -8.377 1.00 61.21 ? 375 HIS F O 1 ATOM 5935 C CB . HIS C 3 397 ? 6.876 55.711 -10.795 1.00 61.18 ? 375 HIS F CB 1 ATOM 5936 C CG . HIS C 3 397 ? 7.900 54.625 -10.671 1.00 65.02 ? 375 HIS F CG 1 ATOM 5937 N ND1 . HIS C 3 397 ? 8.267 53.855 -11.759 1.00 67.25 ? 375 HIS F ND1 1 ATOM 5938 C CD2 . HIS C 3 397 ? 8.593 54.207 -9.586 1.00 67.10 ? 375 HIS F CD2 1 ATOM 5939 C CE1 . HIS C 3 397 ? 9.169 53.001 -11.306 1.00 67.45 ? 375 HIS F CE1 1 ATOM 5940 N NE2 . HIS C 3 397 ? 9.398 53.174 -10.004 1.00 67.67 ? 375 HIS F NE2 1 ATOM 5941 N N . CYS C 3 398 ? 5.087 53.210 -9.360 1.00 57.31 ? 376 CYS F N 1 ATOM 5942 C CA . CYS C 3 398 ? 4.848 52.403 -8.166 1.00 56.50 ? 376 CYS F CA 1 ATOM 5943 C C . CYS C 3 398 ? 6.069 51.537 -7.860 1.00 61.03 ? 376 CYS F C 1 ATOM 5944 O O . CYS C 3 398 ? 6.572 50.836 -8.743 1.00 61.07 ? 376 CYS F O 1 ATOM 5945 C CB . CYS C 3 398 ? 3.589 51.552 -8.317 1.00 55.64 ? 376 CYS F CB 1 ATOM 5946 S SG . CYS C 3 398 ? 2.048 52.499 -8.434 1.00 59.13 ? 376 CYS F SG 1 ATOM 5947 N N . ALA C 3 399 ? 6.545 51.598 -6.606 1.00 57.99 ? 377 ALA F N 1 ATOM 5948 C CA . ALA C 3 399 ? 7.679 50.817 -6.114 1.00 58.88 ? 377 ALA F CA 1 ATOM 5949 C C . ALA C 3 399 ? 7.137 49.754 -5.157 1.00 61.83 ? 377 ALA F C 1 ATOM 5950 O O . ALA C 3 399 ? 6.497 50.093 -4.155 1.00 60.66 ? 377 ALA F O 1 ATOM 5951 C CB . ALA C 3 399 ? 8.676 51.722 -5.404 1.00 60.93 ? 377 ALA F CB 1 ATOM 5952 N N . ALA C 3 400 ? 7.349 48.470 -5.494 1.00 58.65 ? 378 ALA F N 1 ATOM 5953 C CA . ALA C 3 400 ? 6.833 47.361 -4.697 1.00 57.94 ? 378 ALA F CA 1 ATOM 5954 C C . ALA C 3 400 ? 7.856 46.283 -4.376 1.00 63.16 ? 378 ALA F C 1 ATOM 5955 O O . ALA C 3 400 ? 8.574 45.813 -5.263 1.00 64.11 ? 378 ALA F O 1 ATOM 5956 C CB . ALA C 3 400 ? 5.626 46.742 -5.385 1.00 57.71 ? 378 ALA F CB 1 ATOM 5957 N N . GLU C 3 401 ? 7.896 45.882 -3.098 1.00 59.60 ? 379 GLU F N 1 ATOM 5958 C CA . GLU C 3 401 ? 8.742 44.804 -2.601 1.00 61.08 ? 379 GLU F CA 1 ATOM 5959 C C . GLU C 3 401 ? 7.785 43.662 -2.261 1.00 63.99 ? 379 GLU F C 1 ATOM 5960 O O . GLU C 3 401 ? 7.135 43.681 -1.214 1.00 62.67 ? 379 GLU F O 1 ATOM 5961 C CB . GLU C 3 401 ? 9.560 45.252 -1.377 1.00 63.18 ? 379 GLU F CB 1 ATOM 5962 C CG . GLU C 3 401 ? 10.605 44.235 -0.948 1.00 76.64 ? 379 GLU F CG 1 ATOM 5963 C CD . GLU C 3 401 ? 11.235 44.480 0.409 1.00 98.97 ? 379 GLU F CD 1 ATOM 5964 O OE1 . GLU C 3 401 ? 12.484 44.526 0.476 1.00 96.32 ? 379 GLU F OE1 1 ATOM 5965 O OE2 . GLU C 3 401 ? 10.489 44.609 1.406 1.00 91.98 ? 379 GLU F OE2 1 ATOM 5966 N N . CYS C 3 402 ? 7.647 42.711 -3.191 1.00 60.98 ? 380 CYS F N 1 ATOM 5967 C CA . CYS C 3 402 ? 6.736 41.578 -3.053 1.00 60.58 ? 380 CYS F CA 1 ATOM 5968 C C . CYS C 3 402 ? 7.435 40.346 -2.496 1.00 66.01 ? 380 CYS F C 1 ATOM 5969 O O . CYS C 3 402 ? 8.573 40.056 -2.868 1.00 67.65 ? 380 CYS F O 1 ATOM 5970 C CB . CYS C 3 402 ? 6.026 41.295 -4.373 1.00 60.59 ? 380 CYS F CB 1 ATOM 5971 S SG . CYS C 3 402 ? 5.269 42.761 -5.125 1.00 62.17 ? 380 CYS F SG 1 ATOM 5972 N N . HIS C 3 403 ? 6.756 39.643 -1.577 1.00 62.00 ? 381 HIS F N 1 ATOM 5973 C CA . HIS C 3 403 ? 7.287 38.471 -0.881 1.00 63.98 ? 381 HIS F CA 1 ATOM 5974 C C . HIS C 3 403 ? 6.730 37.129 -1.403 1.00 69.28 ? 381 HIS F C 1 ATOM 5975 O O . HIS C 3 403 ? 5.637 37.123 -1.971 1.00 67.46 ? 381 HIS F O 1 ATOM 5976 C CB . HIS C 3 403 ? 7.089 38.632 0.637 1.00 63.99 ? 381 HIS F CB 1 ATOM 5977 C CG . HIS C 3 403 ? 7.702 39.887 1.182 1.00 66.17 ? 381 HIS F CG 1 ATOM 5978 N ND1 . HIS C 3 403 ? 6.920 40.942 1.613 1.00 65.53 ? 381 HIS F ND1 1 ATOM 5979 C CD2 . HIS C 3 403 ? 9.006 40.236 1.293 1.00 69.10 ? 381 HIS F CD2 1 ATOM 5980 C CE1 . HIS C 3 403 ? 7.767 41.881 2.003 1.00 64.81 ? 381 HIS F CE1 1 ATOM 5981 N NE2 . HIS C 3 403 ? 9.033 41.501 1.831 1.00 67.22 ? 381 HIS F NE2 1 ATOM 5982 N N . PRO C 3 404 ? 7.461 35.989 -1.255 1.00 69.08 ? 382 PRO F N 1 ATOM 5983 C CA . PRO C 3 404 ? 6.948 34.711 -1.788 1.00 70.92 ? 382 PRO F CA 1 ATOM 5984 C C . PRO C 3 404 ? 5.738 34.137 -1.043 1.00 74.31 ? 382 PRO F C 1 ATOM 5985 O O . PRO C 3 404 ? 5.635 34.329 0.170 1.00 73.11 ? 382 PRO F O 1 ATOM 5986 C CB . PRO C 3 404 ? 8.161 33.770 -1.704 1.00 76.66 ? 382 PRO F CB 1 ATOM 5987 C CG . PRO C 3 404 ? 9.341 34.648 -1.413 1.00 81.03 ? 382 PRO F CG 1 ATOM 5988 C CD . PRO C 3 404 ? 8.793 35.800 -0.647 1.00 72.96 ? 382 PRO F CD 1 ATOM 5989 N N . PRO C 3 405 ? 4.813 33.425 -1.737 1.00 71.61 ? 383 PRO F N 1 ATOM 5990 C CA . PRO C 3 405 ? 3.653 32.855 -1.031 1.00 71.46 ? 383 PRO F CA 1 ATOM 5991 C C . PRO C 3 405 ? 3.950 31.508 -0.366 1.00 79.17 ? 383 PRO F C 1 ATOM 5992 O O . PRO C 3 405 ? 5.014 30.927 -0.597 1.00 81.43 ? 383 PRO F O 1 ATOM 5993 C CB . PRO C 3 405 ? 2.587 32.746 -2.127 1.00 72.45 ? 383 PRO F CB 1 ATOM 5994 C CG . PRO C 3 405 ? 3.344 32.715 -3.420 1.00 77.82 ? 383 PRO F CG 1 ATOM 5995 C CD . PRO C 3 405 ? 4.779 33.093 -3.176 1.00 74.12 ? 383 PRO F CD 1 ATOM 5996 N N . LYS C 3 406 ? 3.009 31.018 0.467 1.00 76.43 ? 384 LYS F N 1 ATOM 5997 C CA . LYS C 3 406 ? 3.136 29.752 1.197 1.00 79.94 ? 384 LYS F CA 1 ATOM 5998 C C . LYS C 3 406 ? 3.109 28.498 0.310 1.00 88.01 ? 384 LYS F C 1 ATOM 5999 O O . LYS C 3 406 ? 3.723 27.493 0.671 1.00 91.26 ? 384 LYS F O 1 ATOM 6000 C CB . LYS C 3 406 ? 2.110 29.650 2.347 1.00 81.82 ? 384 LYS F CB 1 ATOM 6001 C CG . LYS C 3 406 ? 0.641 29.617 1.916 1.00 94.27 ? 384 LYS F CG 1 ATOM 6002 C CD . LYS C 3 406 ? -0.254 29.071 3.018 1.00 104.93 ? 384 LYS F CD 1 ATOM 6003 C CE . LYS C 3 406 ? -1.700 29.019 2.596 1.00 114.89 ? 384 LYS F CE 1 ATOM 6004 N NZ . LYS C 3 406 ? -2.575 28.520 3.689 1.00 125.07 ? 384 LYS F NZ 1 ATOM 6005 N N . ASP C 3 407 ? 2.396 28.555 -0.833 1.00 84.33 ? 385 ASP F N 1 ATOM 6006 C CA . ASP C 3 407 ? 2.254 27.426 -1.756 1.00 87.79 ? 385 ASP F CA 1 ATOM 6007 C C . ASP C 3 407 ? 3.142 27.543 -2.993 1.00 93.01 ? 385 ASP F C 1 ATOM 6008 O O . ASP C 3 407 ? 3.270 28.627 -3.565 1.00 89.50 ? 385 ASP F O 1 ATOM 6009 C CB . ASP C 3 407 ? 0.783 27.235 -2.164 1.00 88.92 ? 385 ASP F CB 1 ATOM 6010 C CG . ASP C 3 407 ? -0.148 26.949 -1.002 1.00 99.54 ? 385 ASP F CG 1 ATOM 6011 O OD1 . ASP C 3 407 ? -0.918 27.857 -0.623 1.00 96.94 ? 385 ASP F OD1 1 ATOM 6012 O OD2 . ASP C 3 407 ? -0.108 25.817 -0.472 1.00 109.14 ? 385 ASP F OD2 1 ATOM 6013 N N . HIS C 3 408 ? 3.741 26.410 -3.406 1.00 94.55 ? 386 HIS F N 1 ATOM 6014 C CA . HIS C 3 408 ? 4.612 26.303 -4.580 1.00 96.55 ? 386 HIS F CA 1 ATOM 6015 C C . HIS C 3 408 ? 3.828 25.937 -5.846 1.00 101.18 ? 386 HIS F C 1 ATOM 6016 O O . HIS C 3 408 ? 4.278 26.244 -6.951 1.00 100.71 ? 386 HIS F O 1 ATOM 6017 C CB . HIS C 3 408 ? 5.728 25.278 -4.330 1.00 102.62 ? 386 HIS F CB 1 ATOM 6018 C CG . HIS C 3 408 ? 7.032 25.892 -3.928 1.00 106.03 ? 386 HIS F CG 1 ATOM 6019 N ND1 . HIS C 3 408 ? 7.997 26.212 -4.865 1.00 108.94 ? 386 HIS F ND1 1 ATOM 6020 C CD2 . HIS C 3 408 ? 7.491 26.220 -2.698 1.00 106.99 ? 386 HIS F CD2 1 ATOM 6021 C CE1 . HIS C 3 408 ? 9.006 26.724 -4.180 1.00 108.30 ? 386 HIS F CE1 1 ATOM 6022 N NE2 . HIS C 3 408 ? 8.748 26.750 -2.873 1.00 107.42 ? 386 HIS F NE2 1 ATOM 6023 N N . ILE C 3 409 ? 2.670 25.266 -5.683 1.00 98.74 ? 387 ILE F N 1 ATOM 6024 C CA . ILE C 3 409 ? 1.798 24.836 -6.781 1.00 99.47 ? 387 ILE F CA 1 ATOM 6025 C C . ILE C 3 409 ? 0.415 25.488 -6.632 1.00 99.95 ? 387 ILE F C 1 ATOM 6026 O O . ILE C 3 409 ? -0.195 25.412 -5.563 1.00 98.88 ? 387 ILE F O 1 ATOM 6027 C CB . ILE C 3 409 ? 1.729 23.276 -6.889 1.00 108.20 ? 387 ILE F CB 1 ATOM 6028 C CG1 . ILE C 3 409 ? 3.132 22.593 -6.944 1.00 113.24 ? 387 ILE F CG1 1 ATOM 6029 C CG2 . ILE C 3 409 ? 0.804 22.794 -8.017 1.00 109.97 ? 387 ILE F CG2 1 ATOM 6030 C CD1 . ILE C 3 409 ? 4.083 22.945 -8.156 1.00 121.00 ? 387 ILE F CD1 1 ATOM 6031 N N . VAL C 3 410 ? -0.063 26.132 -7.711 1.00 94.68 ? 388 VAL F N 1 ATOM 6032 C CA . VAL C 3 410 ? -1.354 26.824 -7.776 1.00 91.39 ? 388 VAL F CA 1 ATOM 6033 C C . VAL C 3 410 ? -2.395 26.014 -8.588 1.00 98.00 ? 388 VAL F C 1 ATOM 6034 O O . VAL C 3 410 ? -2.020 25.284 -9.508 1.00 100.42 ? 388 VAL F O 1 ATOM 6035 C CB . VAL C 3 410 ? -1.175 28.299 -8.250 1.00 91.03 ? 388 VAL F CB 1 ATOM 6036 C CG1 . VAL C 3 410 ? -0.815 28.397 -9.734 1.00 91.23 ? 388 VAL F CG1 1 ATOM 6037 C CG2 . VAL C 3 410 ? -2.388 29.160 -7.912 1.00 87.49 ? 388 VAL F CG2 1 ATOM 6038 N N . ASN C 3 411 ? -3.688 26.126 -8.223 1.00 94.10 ? 389 ASN F N 1 ATOM 6039 C CA . ASN C 3 411 ? -4.795 25.416 -8.876 1.00 96.19 ? 389 ASN F CA 1 ATOM 6040 C C . ASN C 3 411 ? -5.503 26.221 -9.990 1.00 98.25 ? 389 ASN F C 1 ATOM 6041 O O . ASN C 3 411 ? -6.475 25.731 -10.572 1.00 99.11 ? 389 ASN F O 1 ATOM 6042 C CB . ASN C 3 411 ? -5.793 24.890 -7.834 1.00 98.48 ? 389 ASN F CB 1 ATOM 6043 C CG . ASN C 3 411 ? -6.455 25.969 -7.016 1.00 118.96 ? 389 ASN F CG 1 ATOM 6044 O OD1 . ASN C 3 411 ? -7.489 26.526 -7.398 1.00 111.99 ? 389 ASN F OD1 1 ATOM 6045 N ND2 . ASN C 3 411 ? -5.872 26.287 -5.870 1.00 110.01 ? 389 ASN F ND2 1 ATOM 6046 N N . TYR C 3 412 ? -5.004 27.436 -10.296 1.00 92.11 ? 390 TYR F N 1 ATOM 6047 C CA . TYR C 3 412 ? -5.559 28.321 -11.329 1.00 89.74 ? 390 TYR F CA 1 ATOM 6048 C C . TYR C 3 412 ? -4.461 28.991 -12.182 1.00 93.16 ? 390 TYR F C 1 ATOM 6049 O O . TYR C 3 412 ? -3.454 29.421 -11.616 1.00 91.93 ? 390 TYR F O 1 ATOM 6050 C CB . TYR C 3 412 ? -6.533 29.361 -10.730 1.00 87.83 ? 390 TYR F CB 1 ATOM 6051 C CG . TYR C 3 412 ? -6.034 30.069 -9.487 1.00 87.73 ? 390 TYR F CG 1 ATOM 6052 C CD1 . TYR C 3 412 ? -6.353 29.598 -8.217 1.00 90.84 ? 390 TYR F CD1 1 ATOM 6053 C CD2 . TYR C 3 412 ? -5.290 31.242 -9.580 1.00 85.69 ? 390 TYR F CD2 1 ATOM 6054 C CE1 . TYR C 3 412 ? -5.908 30.251 -7.069 1.00 90.01 ? 390 TYR F CE1 1 ATOM 6055 C CE2 . TYR C 3 412 ? -4.840 31.905 -8.439 1.00 85.04 ? 390 TYR F CE2 1 ATOM 6056 C CZ . TYR C 3 412 ? -5.155 31.408 -7.185 1.00 93.59 ? 390 TYR F CZ 1 ATOM 6057 O OH . TYR C 3 412 ? -4.715 32.055 -6.055 1.00 93.13 ? 390 TYR F OH 1 ATOM 6058 N N . PRO C 3 413 ? -4.637 29.075 -13.534 1.00 90.45 ? 391 PRO F N 1 ATOM 6059 C CA . PRO C 3 413 ? -3.604 29.683 -14.382 1.00 89.69 ? 391 PRO F CA 1 ATOM 6060 C C . PRO C 3 413 ? -3.586 31.218 -14.356 1.00 90.20 ? 391 PRO F C 1 ATOM 6061 O O . PRO C 3 413 ? -4.573 31.849 -13.970 1.00 87.66 ? 391 PRO F O 1 ATOM 6062 C CB . PRO C 3 413 ? -3.903 29.123 -15.776 1.00 93.32 ? 391 PRO F CB 1 ATOM 6063 C CG . PRO C 3 413 ? -5.328 28.677 -15.735 1.00 98.13 ? 391 PRO F CG 1 ATOM 6064 C CD . PRO C 3 413 ? -5.841 28.748 -14.327 1.00 92.73 ? 391 PRO F CD 1 ATOM 6065 N N . ALA C 3 414 ? -2.446 31.809 -14.771 1.00 86.59 ? 392 ALA F N 1 ATOM 6066 C CA . ALA C 3 414 ? -2.223 33.258 -14.820 1.00 83.31 ? 392 ALA F CA 1 ATOM 6067 C C . ALA C 3 414 ? -1.432 33.680 -16.069 1.00 87.71 ? 392 ALA F C 1 ATOM 6068 O O . ALA C 3 414 ? -0.901 32.823 -16.781 1.00 90.07 ? 392 ALA F O 1 ATOM 6069 C CB . ALA C 3 414 ? -1.501 33.714 -13.561 1.00 83.10 ? 392 ALA F CB 1 ATOM 6070 N N . SER C 3 415 ? -1.359 35.004 -16.328 1.00 81.90 ? 393 SER F N 1 ATOM 6071 C CA . SER C 3 415 ? -0.646 35.592 -17.466 1.00 85.01 ? 393 SER F CA 1 ATOM 6072 C C . SER C 3 415 ? 0.873 35.451 -17.327 1.00 98.36 ? 393 SER F C 1 ATOM 6073 O O . SER C 3 415 ? 1.402 35.644 -16.211 1.00 99.17 ? 393 SER F O 1 ATOM 6074 C CB . SER C 3 415 ? -1.025 37.060 -17.634 1.00 85.70 ? 393 SER F CB 1 ATOM 6075 O OG . SER C 3 415 ? -2.413 37.214 -17.877 1.00 93.63 ? 393 SER F OG 1 HETATM 6076 C C1 . NAG D 4 . ? -30.694 4.545 -26.302 1.00 71.36 ? 1001 NAG B C1 1 HETATM 6077 C C2 . NAG D 4 . ? -31.971 5.249 -26.908 1.00 73.08 ? 1001 NAG B C2 1 HETATM 6078 C C3 . NAG D 4 . ? -31.585 6.175 -28.097 1.00 74.55 ? 1001 NAG B C3 1 HETATM 6079 C C4 . NAG D 4 . ? -30.411 7.123 -27.740 1.00 75.12 ? 1001 NAG B C4 1 HETATM 6080 C C5 . NAG D 4 . ? -29.203 6.336 -27.156 1.00 74.32 ? 1001 NAG B C5 1 HETATM 6081 C C6 . NAG D 4 . ? -28.598 6.990 -25.897 1.00 75.57 ? 1001 NAG B C6 1 HETATM 6082 C C7 . NAG D 4 . ? -33.725 3.466 -26.500 1.00 75.59 ? 1001 NAG B C7 1 HETATM 6083 C C8 . NAG D 4 . ? -34.719 2.593 -27.219 1.00 76.40 ? 1001 NAG B C8 1 HETATM 6084 N N2 . NAG D 4 . ? -33.008 4.291 -27.337 1.00 74.09 ? 1001 NAG B N2 1 HETATM 6085 O O3 . NAG D 4 . ? -32.739 6.915 -28.550 1.00 76.64 ? 1001 NAG B O3 1 HETATM 6086 O O4 . NAG D 4 . ? -29.992 7.817 -28.931 1.00 77.52 ? 1001 NAG B O4 1 HETATM 6087 O O5 . NAG D 4 . ? -29.439 4.916 -26.924 1.00 72.66 ? 1001 NAG B O5 1 HETATM 6088 O O6 . NAG D 4 . ? -27.323 6.426 -25.572 1.00 77.64 ? 1001 NAG B O6 1 HETATM 6089 O O7 . NAG D 4 . ? -33.580 3.433 -25.276 1.00 77.61 ? 1001 NAG B O7 1 HETATM 6090 C C1 . NAG E 4 . ? -17.982 40.523 -14.372 1.00 51.19 ? 1001 NAG F C1 1 HETATM 6091 C C2 . NAG E 4 . ? -18.520 41.035 -13.002 1.00 52.93 ? 1001 NAG F C2 1 HETATM 6092 C C3 . NAG E 4 . ? -17.483 40.731 -11.889 1.00 54.40 ? 1001 NAG F C3 1 HETATM 6093 C C4 . NAG E 4 . ? -17.038 39.239 -11.871 1.00 54.98 ? 1001 NAG F C4 1 HETATM 6094 C C5 . NAG E 4 . ? -16.700 38.738 -13.304 1.00 54.18 ? 1001 NAG F C5 1 HETATM 6095 C C6 . NAG E 4 . ? -16.559 37.205 -13.363 1.00 55.41 ? 1001 NAG F C6 1 HETATM 6096 C C7 . NAG E 4 . ? -20.188 42.948 -13.247 1.00 55.43 ? 1001 NAG F C7 1 HETATM 6097 C C8 . NAG E 4 . ? -21.288 41.932 -13.456 1.00 56.22 ? 1001 NAG F C8 1 HETATM 6098 N N2 . NAG E 4 . ? -18.914 42.455 -13.039 1.00 53.91 ? 1001 NAG F N2 1 HETATM 6099 O O3 . NAG E 4 . ? -18.038 41.109 -10.615 1.00 56.50 ? 1001 NAG F O3 1 HETATM 6100 O O4 . NAG E 4 . ? -15.836 39.134 -11.071 1.00 57.44 ? 1001 NAG F O4 1 HETATM 6101 O O5 . NAG E 4 . ? -17.697 39.118 -14.284 1.00 52.50 ? 1001 NAG F O5 1 HETATM 6102 O O6 . NAG E 4 . ? -17.810 36.553 -13.120 1.00 57.45 ? 1001 NAG F O6 1 HETATM 6103 O O7 . NAG E 4 . ? -20.418 44.157 -13.262 1.00 57.44 ? 1001 NAG F O7 1 HETATM 6104 C C1 . NDG F 5 . ? -15.917 38.731 -9.678 1.00 57.82 ? 1002 NDG F C1 1 HETATM 6105 C C2 . NDG F 5 . ? -14.837 37.644 -9.307 1.00 59.59 ? 1002 NDG F C2 1 HETATM 6106 C C3 . NDG F 5 . ? -15.300 36.704 -8.153 1.00 61.02 ? 1002 NDG F C3 1 HETATM 6107 C C4 . NDG F 5 . ? -16.249 37.381 -7.116 1.00 61.60 ? 1002 NDG F C4 1 HETATM 6108 C C5 . NDG F 5 . ? -17.361 38.243 -7.790 1.00 60.82 ? 1002 NDG F C5 1 HETATM 6109 C C6 . NDG F 5 . ? -17.459 39.654 -7.179 1.00 62.05 ? 1002 NDG F C6 1 HETATM 6110 C C7 . NDG F 5 . ? -13.227 37.298 -11.227 1.00 62.11 ? 1002 NDG F C7 1 HETATM 6111 C C8 . NDG F 5 . ? -12.845 36.328 -12.315 1.00 62.90 ? 1002 NDG F C8 1 HETATM 6112 O O . NDG F 5 . ? -17.242 38.367 -9.234 1.00 59.14 ? 1002 NDG F O 1 HETATM 6113 O O3 . NDG F 5 . ? -14.132 36.164 -7.502 1.00 63.13 ? 1002 NDG F O3 1 HETATM 6114 O O4 . NDG F 5 . ? -16.871 36.364 -6.306 1.00 64.01 ? 1002 NDG F O4 1 HETATM 6115 O O6 . NDG F 5 . ? -18.623 40.346 -7.643 1.00 64.13 ? 1002 NDG F O6 1 HETATM 6116 O O7 . NDG F 5 . ? -12.645 38.375 -11.071 1.00 64.11 ? 1002 NDG F O7 1 HETATM 6117 N N2 . NDG F 5 . ? -14.276 36.873 -10.436 1.00 60.57 ? 1002 NDG F N2 1 HETATM 6118 O O . HOH G 6 . ? -36.899 -12.662 -32.417 1.00 42.96 ? 361 HOH B O 1 HETATM 6119 O O . HOH G 6 . ? -51.040 -10.494 -21.293 1.00 31.69 ? 362 HOH B O 1 HETATM 6120 O O . HOH G 6 . ? -7.014 18.451 -4.051 1.00 43.08 ? 363 HOH B O 1 HETATM 6121 O O . HOH G 6 . ? -38.705 -45.959 -26.898 1.00 27.13 ? 364 HOH B O 1 HETATM 6122 O O . HOH G 6 . ? -6.810 12.716 -16.319 1.00 6.29 ? 365 HOH B O 1 HETATM 6123 O O . HOH G 6 . ? -8.993 -3.948 -9.965 1.00 19.66 ? 366 HOH B O 1 HETATM 6124 O O . HOH G 6 . ? -29.222 -22.585 -24.086 1.00 33.94 ? 367 HOH B O 1 HETATM 6125 O O . HOH G 6 . ? -35.040 -2.686 -26.395 1.00 20.86 ? 368 HOH B O 1 HETATM 6126 O O . HOH G 6 . ? 8.692 12.815 -9.476 1.00 43.23 ? 369 HOH B O 1 HETATM 6127 O O . HOH G 6 . ? -36.731 -19.381 -3.219 1.00 40.31 ? 370 HOH B O 1 HETATM 6128 O O . HOH G 6 . ? 2.467 11.197 -24.640 1.00 14.14 ? 390 HOH B O 1 HETATM 6129 O O . HOH G 6 . ? -43.005 -50.024 -40.305 1.00 29.06 ? 425 HOH B O 1 HETATM 6130 O O . HOH G 6 . ? -39.359 -49.279 -32.484 1.00 35.15 ? 507 HOH B O 1 HETATM 6131 O O . HOH G 6 . ? -42.737 -29.942 -24.924 1.00 20.13 ? 530 HOH B O 1 HETATM 6132 O O . HOH G 6 . ? -42.315 -8.194 -11.588 1.00 60.49 ? 532 HOH B O 1 HETATM 6133 O O . HOH G 6 . ? -60.516 -44.288 -24.646 1.00 30.75 ? 534 HOH B O 1 HETATM 6134 O O . HOH G 6 . ? -16.934 17.038 -8.003 1.00 41.78 ? 538 HOH B O 1 HETATM 6135 O O . HOH G 6 . ? -31.733 -25.721 -21.248 1.00 29.80 ? 551 HOH B O 1 HETATM 6136 O O . HOH G 6 . ? -32.013 -34.782 -22.806 1.00 20.92 ? 552 HOH B O 1 HETATM 6137 O O . HOH G 6 . ? -25.222 -30.960 -24.150 1.00 18.55 ? 553 HOH B O 1 HETATM 6138 O O . HOH G 6 . ? -43.878 -14.332 -22.607 1.00 24.23 ? 555 HOH B O 1 HETATM 6139 O O . HOH G 6 . ? -46.804 -22.787 -36.498 1.00 32.88 ? 561 HOH B O 1 HETATM 6140 O O . HOH G 6 . ? -26.144 -7.345 -17.734 1.00 22.79 ? 562 HOH B O 1 HETATM 6141 O O . HOH G 6 . ? -36.968 -17.931 -31.974 1.00 34.36 ? 564 HOH B O 1 HETATM 6142 O O . HOH G 6 . ? -0.494 3.400 -17.096 1.00 40.26 ? 570 HOH B O 1 HETATM 6143 O O . HOH G 6 . ? -40.211 -35.848 -16.847 1.00 41.21 ? 576 HOH B O 1 HETATM 6144 O O . HOH H 6 . ? -10.272 39.104 -35.893 1.00 31.67 ? 452 HOH F O 1 HETATM 6145 O O . HOH H 6 . ? -26.331 -28.509 -34.746 1.00 20.66 ? 453 HOH F O 1 HETATM 6146 O O . HOH H 6 . ? -1.941 36.114 -2.350 1.00 31.43 ? 454 HOH F O 1 HETATM 6147 O O . HOH H 6 . ? -9.952 23.756 -36.562 1.00 30.61 ? 455 HOH F O 1 HETATM 6148 O O . HOH H 6 . ? -11.382 -5.291 -31.430 1.00 31.06 ? 456 HOH F O 1 HETATM 6149 O O . HOH H 6 . ? -6.711 1.419 -34.344 1.00 30.90 ? 457 HOH F O 1 HETATM 6150 O O . HOH H 6 . ? -21.328 14.353 -43.522 1.00 23.15 ? 458 HOH F O 1 HETATM 6151 O O . HOH H 6 . ? -34.233 -16.158 -48.368 1.00 17.61 ? 459 HOH F O 1 HETATM 6152 O O . HOH H 6 . ? -2.725 34.291 -34.821 1.00 25.75 ? 460 HOH F O 1 HETATM 6153 O O . HOH H 6 . ? -19.391 23.117 -25.699 1.00 19.83 ? 461 HOH F O 1 HETATM 6154 O O . HOH H 6 . ? -32.664 -17.922 -30.986 1.00 26.80 ? 462 HOH F O 1 HETATM 6155 O O . HOH H 6 . ? -41.864 -34.966 -42.077 1.00 18.40 ? 463 HOH F O 1 HETATM 6156 O O . HOH H 6 . ? -2.867 64.694 -4.242 1.00 31.32 ? 464 HOH F O 1 HETATM 6157 O O . HOH H 6 . ? -28.231 -17.150 -51.205 1.00 39.12 ? 465 HOH F O 1 HETATM 6158 O O . HOH H 6 . ? -5.974 47.381 -15.836 1.00 27.02 ? 466 HOH F O 1 HETATM 6159 O O . HOH H 6 . ? -34.204 -12.996 -49.310 1.00 32.67 ? 467 HOH F O 1 HETATM 6160 O O . HOH H 6 . ? 12.198 38.794 -9.004 1.00 19.96 ? 468 HOH F O 1 HETATM 6161 O O . HOH H 6 . ? 10.966 36.142 -8.282 1.00 25.29 ? 469 HOH F O 1 HETATM 6162 O O . HOH H 6 . ? -3.198 40.985 -19.524 1.00 13.72 ? 470 HOH F O 1 HETATM 6163 O O . HOH H 6 . ? -28.324 -37.584 -31.811 1.00 26.61 ? 496 HOH F O 1 HETATM 6164 O O . HOH H 6 . ? -23.279 -23.841 -28.182 1.00 24.20 ? 504 HOH F O 1 HETATM 6165 O O . HOH H 6 . ? -21.596 -25.151 -40.836 1.00 18.51 ? 505 HOH F O 1 HETATM 6166 O O . HOH H 6 . ? -25.444 39.735 -34.513 1.00 23.55 ? 506 HOH F O 1 HETATM 6167 O O . HOH H 6 . ? -16.279 60.603 -31.334 1.00 25.47 ? 510 HOH F O 1 HETATM 6168 O O . HOH H 6 . ? -18.860 60.771 -27.912 1.00 30.14 ? 511 HOH F O 1 HETATM 6169 O O . HOH H 6 . ? -10.559 43.284 -38.115 1.00 18.03 ? 512 HOH F O 1 HETATM 6170 O O . HOH H 6 . ? 1.258 31.694 -28.830 1.00 24.41 ? 513 HOH F O 1 HETATM 6171 O O . HOH H 6 . ? -9.762 57.163 -19.050 1.00 51.09 ? 514 HOH F O 1 HETATM 6172 O O . HOH H 6 . ? -14.126 48.938 -18.375 1.00 47.06 ? 515 HOH F O 1 HETATM 6173 O O . HOH H 6 . ? -12.320 51.701 -18.477 1.00 26.25 ? 516 HOH F O 1 HETATM 6174 O O . HOH H 6 . ? -18.043 27.260 -27.091 1.00 18.15 ? 517 HOH F O 1 HETATM 6175 O O . HOH H 6 . ? -32.394 -19.730 -39.611 1.00 7.49 ? 518 HOH F O 1 HETATM 6176 O O . HOH H 6 . ? -32.476 -25.039 -45.259 1.00 20.95 ? 519 HOH F O 1 HETATM 6177 O O . HOH H 6 . ? -20.232 -14.297 -43.640 1.00 24.29 ? 520 HOH F O 1 HETATM 6178 O O . HOH H 6 . ? -24.731 -24.074 -45.573 1.00 29.56 ? 521 HOH F O 1 HETATM 6179 O O . HOH H 6 . ? -41.245 -41.855 -36.233 1.00 36.31 ? 522 HOH F O 1 HETATM 6180 O O . HOH H 6 . ? -28.290 -45.164 -33.834 1.00 22.46 ? 523 HOH F O 1 HETATM 6181 O O . HOH H 6 . ? -0.376 16.183 -31.488 1.00 32.09 ? 524 HOH F O 1 HETATM 6182 O O . HOH H 6 . ? -7.635 6.685 -36.239 1.00 18.15 ? 525 HOH F O 1 HETATM 6183 O O . HOH H 6 . ? -9.048 -2.671 -28.756 1.00 34.48 ? 526 HOH F O 1 HETATM 6184 O O . HOH H 6 . ? -4.661 14.109 -33.744 1.00 20.89 ? 527 HOH F O 1 HETATM 6185 O O . HOH H 6 . ? 7.138 29.697 -1.866 1.00 24.92 ? 529 HOH F O 1 HETATM 6186 O O . HOH H 6 . ? -27.138 -26.627 -26.758 1.00 16.45 ? 536 HOH F O 1 HETATM 6187 O O . HOH H 6 . ? -28.983 -25.471 -28.812 1.00 12.09 ? 537 HOH F O 1 HETATM 6188 O O . HOH H 6 . ? -19.683 28.246 -20.574 1.00 14.54 ? 542 HOH F O 1 HETATM 6189 O O . HOH H 6 . ? -1.892 28.518 -25.279 1.00 16.24 ? 545 HOH F O 1 HETATM 6190 O O . HOH H 6 . ? -20.143 50.657 -34.756 1.00 38.60 ? 546 HOH F O 1 HETATM 6191 O O . HOH H 6 . ? -24.096 36.751 -28.762 1.00 14.25 ? 547 HOH F O 1 HETATM 6192 O O . HOH H 6 . ? -13.042 57.020 -23.861 1.00 17.99 ? 549 HOH F O 1 HETATM 6193 O O . HOH H 6 . ? -31.988 -7.331 -37.024 1.00 29.01 ? 557 HOH F O 1 HETATM 6194 O O . HOH H 6 . ? -23.474 5.500 -28.847 1.00 16.82 ? 559 HOH F O 1 HETATM 6195 O O . HOH H 6 . ? 1.037 36.656 -12.119 1.00 34.46 ? 563 HOH F O 1 HETATM 6196 O O . HOH H 6 . ? -19.641 16.605 -34.408 1.00 14.86 ? 565 HOH F O 1 HETATM 6197 O O . HOH H 6 . ? -15.318 36.049 -36.419 1.00 38.52 ? 567 HOH F O 1 HETATM 6198 O O . HOH H 6 . ? -22.955 42.923 -15.992 1.00 34.71 ? 568 HOH F O 1 HETATM 6199 O O . HOH H 6 . ? -22.519 12.465 -31.765 1.00 31.38 ? 569 HOH F O 1 HETATM 6200 O O . HOH H 6 . ? -21.640 37.874 -39.879 1.00 31.42 ? 571 HOH F O 1 HETATM 6201 O O . HOH H 6 . ? -21.063 -8.313 -31.826 1.00 31.50 ? 572 HOH F O 1 HETATM 6202 O O . HOH H 6 . ? -32.020 -3.225 -33.507 1.00 30.73 ? 573 HOH F O 1 HETATM 6203 O O . HOH H 6 . ? -4.435 17.435 -35.598 1.00 35.13 ? 574 HOH F O 1 HETATM 6204 O O . HOH H 6 . ? -32.418 -24.891 -36.252 1.00 13.06 ? 575 HOH F O 1 HETATM 6205 O O . HOH H 6 . ? -3.659 46.004 -16.324 1.00 30.00 ? 577 HOH F O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . MET A 8 ? 1.3641 1.4211 1.5577 0.0352 -0.0533 0.0163 7 MET A N 2 C CA . MET A 8 ? 1.3637 1.4203 1.5423 0.0366 -0.0563 0.0120 7 MET A CA 3 C C . MET A 8 ? 1.4052 1.4617 1.5791 0.0356 -0.0551 0.0084 7 MET A C 4 O O . MET A 8 ? 1.4005 1.4570 1.5766 0.0364 -0.0503 0.0120 7 MET A O 5 C CB . MET A 8 ? 1.4060 1.4616 1.5717 0.0424 -0.0562 0.0165 7 MET A CB 6 C CG . MET A 8 ? 1.4554 1.5111 1.6248 0.0435 -0.0586 0.0198 7 MET A CG 7 S SD . MET A 8 ? 1.5019 1.5579 1.6759 0.0400 -0.0663 0.0124 7 MET A SD 8 C CE . MET A 8 ? 1.4707 1.5247 1.6276 0.0443 -0.0722 0.0091 7 MET A CE 9 N N . CYS A 9 ? 1.3548 1.4114 1.5244 0.0339 -0.0594 0.0018 8 CYS A N 10 C CA . CYS A 9 ? 1.3483 1.4050 1.5143 0.0328 -0.0592 -0.0022 8 CYS A CA 11 C C . CYS A 9 ? 1.4055 1.4611 1.5593 0.0360 -0.0624 -0.0051 8 CYS A C 12 O O . CYS A 9 ? 1.4053 1.4601 1.5543 0.0386 -0.0661 -0.0051 8 CYS A O 13 C CB . CYS A 9 ? 1.3409 1.3986 1.5145 0.0284 -0.0612 -0.0069 8 CYS A CB 14 S SG . CYS A 9 ? 1.3832 1.4407 1.5676 0.0255 -0.0586 -0.0058 8 CYS A SG 15 N N . LEU A 10 ? 1.3639 1.4192 1.5135 0.0363 -0.0616 -0.0078 9 LEU A N 16 C CA . LEU A 10 ? 1.3704 1.4240 1.5090 0.0399 -0.0651 -0.0117 9 LEU A CA 17 C C . LEU A 10 ? 1.4141 1.4685 1.5577 0.0370 -0.0697 -0.0180 9 LEU A C 18 O O . LEU A 10 ? 1.3994 1.4555 1.5509 0.0331 -0.0677 -0.0188 9 LEU A O 19 C CB . LEU A 10 ? 1.3799 1.4320 1.5093 0.0439 -0.0598 -0.0093 9 LEU A CB 20 C CG . LEU A 10 ? 1.4555 1.5043 1.5680 0.0509 -0.0622 -0.0113 9 LEU A CG 21 C CD1 . LEU A 10 ? 1.4697 1.5170 1.5721 0.0568 -0.0548 -0.0042 9 LEU A CD1 22 C CD2 . LEU A 10 ? 1.4883 1.5360 1.5979 0.0512 -0.0647 -0.0179 9 LEU A CD2 23 N N . LEU A 11 ? 1.3777 1.4306 1.5171 0.0395 -0.0763 -0.0222 10 LEU A N 24 C CA . LEU A 11 ? 1.3718 1.4251 1.5180 0.0377 -0.0814 -0.0278 10 LEU A CA 25 C C . LEU A 11 ? 1.4334 1.4832 1.5698 0.0429 -0.0880 -0.0326 10 LEU A C 26 O O . LEU A 11 ? 1.4340 1.4820 1.5688 0.0453 -0.0946 -0.0342 10 LEU A O 27 C CB . LEU A 11 ? 1.3643 1.4196 1.5237 0.0342 -0.0842 -0.0280 10 LEU A CB 28 C CG . LEU A 11 ? 1.4165 1.4738 1.5889 0.0312 -0.0863 -0.0310 10 LEU A CG 29 C CD1 . LEU A 11 ? 1.4241 1.4799 1.6015 0.0332 -0.0948 -0.0352 10 LEU A CD1 30 C CD2 . LEU A 11 ? 1.4441 1.5023 1.6169 0.0298 -0.0830 -0.0320 10 LEU A CD2 31 N N . ALA A 12 ? 1.3951 1.4434 1.5243 0.0453 -0.0863 -0.0350 11 ALA A N 32 C CA . ALA A 12 ? 1.4076 1.4516 1.5249 0.0514 -0.0921 -0.0407 11 ALA A CA 33 C C . ALA A 12 ? 1.4726 1.5126 1.5720 0.0585 -0.0944 -0.0395 11 ALA A C 34 O O . ALA A 12 ? 1.4777 1.5157 1.5620 0.0636 -0.0887 -0.0369 11 ALA A O 35 C CB . ALA A 12 ? 1.4152 1.4587 1.5441 0.0501 -0.1014 -0.0477 11 ALA A CB 36 N N . ASN A 13 ? 1.4314 1.4705 1.5329 0.0592 -0.1021 -0.0406 12 ASN A N 37 C CA . ASN A 13 ? 1.4453 1.4805 1.5301 0.0661 -0.1057 -0.0392 12 ASN A CA 38 C C . ASN A 13 ? 1.4860 1.5230 1.5796 0.0636 -0.1086 -0.0354 12 ASN A C 39 O O . ASN A 13 ? 1.4932 1.5268 1.5776 0.0687 -0.1160 -0.0363 12 ASN A O 40 C CB . ASN A 13 ? 1.4745 1.5039 1.5480 0.0729 -0.1170 -0.0480 12 ASN A CB 41 C CG . ASN A 13 ? 1.7857 1.8115 1.8415 0.0792 -0.1137 -0.0510 12 ASN A CG 42 O OD1 . ASN A 13 ? 1.7099 1.7369 1.7730 0.0764 -0.1109 -0.0542 12 ASN A OD1 43 N ND2 . ASN A 13 ? 1.7052 1.7261 1.7369 0.0886 -0.1139 -0.0501 12 ASN A ND2 44 N N . THR A 14 ? 1.4233 1.4651 1.5336 0.0564 -0.1030 -0.0312 13 THR A N 45 C CA . THR A 14 ? 1.4152 1.4584 1.5350 0.0541 -0.1053 -0.0280 13 THR A CA 46 C C . THR A 14 ? 1.4583 1.5034 1.5774 0.0534 -0.0976 -0.0198 13 THR A C 47 O O . THR A 14 ? 1.4594 1.5035 1.5758 0.0559 -0.1008 -0.0169 13 THR A O 48 C CB . THR A 14 ? 1.5052 1.5510 1.6458 0.0484 -0.1091 -0.0311 13 THR A CB 49 O OG1 . THR A 14 ? 1.5007 1.5466 1.6490 0.0480 -0.1135 -0.0293 13 THR A OG1 50 C CG2 . THR A 14 ? 1.4718 1.5217 1.6238 0.0423 -0.1008 -0.0290 13 THR A CG2 51 N N . THR A 15 ? 1.4026 1.4504 1.5261 0.0500 -0.0884 -0.0161 14 THR A N 52 C CA . THR A 15 ? 1.3943 1.4440 1.5221 0.0485 -0.0813 -0.0089 14 THR A CA 53 C C . THR A 15 ? 1.4285 1.4803 1.5716 0.0438 -0.0828 -0.0086 14 THR A C 54 O O . THR A 15 ? 1.4259 1.4770 1.5709 0.0450 -0.0888 -0.0093 14 THR A O 55 C CB . THR A 15 ? 1.5104 1.5582 1.6247 0.0549 -0.0781 -0.0025 14 THR A CB 56 O OG1 . THR A 15 ? 1.5168 1.5615 1.6140 0.0608 -0.0786 -0.0046 14 THR A OG1 57 C CG2 . THR A 15 ? 1.4888 1.5386 1.6098 0.0534 -0.0688 0.0051 14 THR A CG2 58 N N . PHE A 16 ? 1.3709 1.4251 1.5249 0.0391 -0.0778 -0.0078 15 PHE A N 59 C CA . PHE A 16 ? 1.3584 1.4143 1.5258 0.0353 -0.0783 -0.0084 15 PHE A CA 60 C C . PHE A 16 ? 1.3967 1.4536 1.5715 0.0328 -0.0726 -0.0054 15 PHE A C 61 O O . PHE A 16 ? 1.3906 1.4475 1.5631 0.0326 -0.0686 -0.0041 15 PHE A O 62 C CB . PHE A 16 ? 1.3750 1.4318 1.5489 0.0324 -0.0804 -0.0136 15 PHE A CB 63 C CG . PHE A 16 ? 1.3898 1.4476 1.5636 0.0302 -0.0764 -0.0152 15 PHE A CG 64 C CD1 . PHE A 16 ? 1.4331 1.4902 1.5993 0.0317 -0.0768 -0.0170 15 PHE A CD1 65 C CD2 . PHE A 16 ? 1.4100 1.4690 1.5909 0.0272 -0.0728 -0.0153 15 PHE A CD2 66 C CE1 . PHE A 16 ? 1.4398 1.4979 1.6072 0.0295 -0.0733 -0.0180 15 PHE A CE1 67 C CE2 . PHE A 16 ? 1.4422 1.5018 1.6226 0.0255 -0.0701 -0.0165 15 PHE A CE2 68 C CZ . PHE A 16 ? 1.4204 1.4798 1.5950 0.0264 -0.0703 -0.0176 15 PHE A CZ 69 N N . PRO A 17 ? 1.3458 1.4032 1.5307 0.0309 -0.0725 -0.0050 16 PRO A N 70 C CA . PRO A 17 ? 1.3375 1.3951 1.5300 0.0290 -0.0686 -0.0037 16 PRO A CA 71 C C . PRO A 17 ? 1.3765 1.4343 1.5700 0.0265 -0.0672 -0.0079 16 PRO A C 72 O O . PRO A 17 ? 1.3678 1.4261 1.5619 0.0255 -0.0685 -0.0115 16 PRO A O 73 C CB . PRO A 17 ? 1.3582 1.4158 1.5601 0.0284 -0.0698 -0.0034 16 PRO A CB 74 C CG . PRO A 17 ? 1.4152 1.4731 1.6168 0.0287 -0.0735 -0.0058 16 PRO A CG 75 C CD . PRO A 17 ? 1.3646 1.4222 1.5557 0.0308 -0.0763 -0.0059 16 PRO A CD 76 N N . CYS A 18 ? 1.3292 1.3866 1.5236 0.0259 -0.0646 -0.0067 17 CYS A N 77 C CA . CYS A 18 ? 1.3215 1.3787 1.5164 0.0239 -0.0639 -0.0100 17 CYS A CA 78 C C . CYS A 18 ? 1.3543 1.4111 1.5521 0.0228 -0.0649 -0.0144 17 CYS A C 79 O O . CYS A 18 ? 1.3465 1.4039 1.5408 0.0222 -0.0648 -0.0170 17 CYS A O 80 C CB . CYS A 18 ? 1.3279 1.3842 1.5280 0.0236 -0.0619 -0.0074 17 CYS A CB 81 S SG . CYS A 18 ? 1.3834 1.4403 1.5786 0.0259 -0.0583 -0.0016 17 CYS A SG 82 N N . SER A 19 ? 1.3016 1.3574 1.5057 0.0231 -0.0654 -0.0148 18 SER A N 83 C CA . SER A 19 ? 1.2945 1.3491 1.5000 0.0233 -0.0656 -0.0189 18 SER A CA 84 C C . SER A 19 ? 1.3298 1.3860 1.5339 0.0239 -0.0649 -0.0195 18 SER A C 85 O O . SER A 19 ? 1.3250 1.3806 1.5286 0.0248 -0.0634 -0.0221 18 SER A O 86 C CB . SER A 19 ? 1.3415 1.3942 1.5550 0.0239 -0.0664 -0.0195 18 SER A CB 87 O OG . SER A 19 ? 1.4534 1.5072 1.6715 0.0243 -0.0665 -0.0160 18 SER A OG 88 N N . GLN A 20 ? 1.2755 1.3332 1.4794 0.0240 -0.0662 -0.0170 19 GLN A N 89 C CA . GLN A 20 ? 1.2673 1.3264 1.4739 0.0244 -0.0668 -0.0173 19 GLN A CA 90 C C . GLN A 20 ? 1.3008 1.3612 1.5040 0.0242 -0.0688 -0.0174 19 GLN A C 91 O O . GLN A 20 ? 1.2974 1.3579 1.5007 0.0251 -0.0723 -0.0164 19 GLN A O 92 C CB . GLN A 20 ? 1.2864 1.3453 1.4994 0.0252 -0.0686 -0.0155 19 GLN A CB 93 C CG . GLN A 20 ? 1.4892 1.5469 1.7085 0.0257 -0.0665 -0.0164 19 GLN A CG 94 C CD . GLN A 20 ? 1.7461 1.8036 1.9724 0.0262 -0.0685 -0.0138 19 GLN A CD 95 O OE1 . GLN A 20 ? 1.6934 1.7519 1.9249 0.0267 -0.0703 -0.0127 19 GLN A OE1 96 N NE2 . GLN A 20 ? 1.6511 1.7075 1.8799 0.0263 -0.0684 -0.0125 19 GLN A NE2 97 N N . PRO A 21 ? 1.2439 1.3049 1.4443 0.0235 -0.0672 -0.0188 20 PRO A N 98 C CA . PRO A 21 ? 1.2362 1.2983 1.4357 0.0235 -0.0696 -0.0194 20 PRO A CA 99 C C . PRO A 21 ? 1.2682 1.3316 1.4774 0.0239 -0.0712 -0.0196 20 PRO A C 100 O O . PRO A 21 ? 1.2610 1.3248 1.4765 0.0242 -0.0681 -0.0188 20 PRO A O 101 C CB . PRO A 21 ? 1.2571 1.3198 1.4531 0.0225 -0.0671 -0.0203 20 PRO A CB 102 C CG . PRO A 21 ? 1.3148 1.3768 1.5109 0.0226 -0.0638 -0.0206 20 PRO A CG 103 C CD . PRO A 21 ? 1.2612 1.3218 1.4593 0.0232 -0.0641 -0.0202 20 PRO A CD 104 N N . PRO A 22 ? 1.2139 1.2773 1.4252 0.0245 -0.0762 -0.0206 21 PRO A N 105 C CA . PRO A 22 ? 1.2058 1.2701 1.4306 0.0248 -0.0788 -0.0205 21 PRO A CA 106 C C . PRO A 22 ? 1.2341 1.3007 1.4689 0.0242 -0.0746 -0.0194 21 PRO A C 107 O O . PRO A 22 ? 1.2278 1.2955 1.4769 0.0246 -0.0745 -0.0179 21 PRO A O 108 C CB . PRO A 22 ? 1.2337 1.2966 1.4570 0.0261 -0.0867 -0.0231 21 PRO A CB 109 C CG . PRO A 22 ? 1.2932 1.3553 1.5032 0.0263 -0.0858 -0.0244 21 PRO A CG 110 C CD . PRO A 22 ? 1.2361 1.2981 1.4384 0.0255 -0.0800 -0.0221 21 PRO A CD 111 N N . CYS A 23 ? 1.1755 1.2428 1.4041 0.0235 -0.0708 -0.0195 22 CYS A N 112 C CA . CYS A 23 ? 1.1644 1.2339 1.4002 0.0235 -0.0661 -0.0174 22 CYS A CA 113 C C . CYS A 23 ? 1.2097 1.2797 1.4471 0.0250 -0.0591 -0.0147 22 CYS A C 114 O O . CYS A 23 ? 1.2030 1.2749 1.4486 0.0262 -0.0544 -0.0115 22 CYS A O 115 C CB . CYS A 23 ? 1.1637 1.2336 1.3918 0.0226 -0.0651 -0.0183 22 CYS A CB 116 S SG . CYS A 23 ? 1.2115 1.2792 1.4226 0.0220 -0.0637 -0.0196 22 CYS A SG 117 N N . THR A 24 ? 1.1659 1.2339 1.3954 0.0256 -0.0581 -0.0156 23 THR A N 118 C CA . THR A 24 ? 1.1653 1.2326 1.3933 0.0279 -0.0520 -0.0145 23 THR A CA 119 C C . THR A 24 ? 1.2099 1.2787 1.4525 0.0298 -0.0481 -0.0111 23 THR A C 120 O O . THR A 24 ? 1.2018 1.2712 1.4561 0.0289 -0.0521 -0.0106 23 THR A O 121 C CB . THR A 24 ? 1.2729 1.3374 1.4930 0.0279 -0.0533 -0.0169 23 THR A CB 122 O OG1 . THR A 24 ? 1.2673 1.3317 1.4924 0.0267 -0.0582 -0.0170 23 THR A OG1 123 C CG2 . THR A 24 ? 1.2570 1.3199 1.4648 0.0271 -0.0546 -0.0193 23 THR A CG2 124 N N . PRO A 25 ? 1.1672 1.2364 1.4095 0.0331 -0.0402 -0.0083 24 PRO A N 125 C CA . PRO A 25 ? 1.1685 1.2363 1.3958 0.0354 -0.0358 -0.0089 24 PRO A CA 126 C C . PRO A 25 ? 1.2113 1.2812 1.4384 0.0351 -0.0346 -0.0064 24 PRO A C 127 O O . PRO A 25 ? 1.2007 1.2735 1.4421 0.0336 -0.0357 -0.0038 24 PRO A O 128 C CB . PRO A 25 ? 1.1985 1.2653 1.4261 0.0404 -0.0278 -0.0067 24 PRO A CB 129 C CG . PRO A 25 ? 1.2523 1.3221 1.5010 0.0405 -0.0253 -0.0019 24 PRO A CG 130 C CD . PRO A 25 ? 1.1882 1.2589 1.4462 0.0355 -0.0346 -0.0039 24 PRO A CD 131 N N . CYS A 26 ? 1.1693 1.2377 1.3814 0.0368 -0.0329 -0.0075 25 CYS A N 132 C CA . CYS A 26 ? 1.1655 1.2356 1.3754 0.0370 -0.0314 -0.0049 25 CYS A CA 133 C C . CYS A 26 ? 1.2072 1.2792 1.4241 0.0322 -0.0377 -0.0061 25 CYS A C 134 O O . CYS A 26 ? 1.1988 1.2737 1.4281 0.0317 -0.0367 -0.0026 25 CYS A O 135 C CB . CYS A 26 ? 1.1719 1.2445 1.3905 0.0411 -0.0229 0.0021 25 CYS A CB 136 S SG . CYS A 26 ? 1.2345 1.3046 1.4343 0.0485 -0.0149 0.0044 25 CYS A SG 137 N N . CYS A 27 ? 1.1616 1.2316 1.3715 0.0293 -0.0440 -0.0108 26 CYS A N 138 C CA . CYS A 27 ? 1.1541 1.2252 1.3676 0.0258 -0.0494 -0.0125 26 CYS A CA 139 C C . CYS A 27 ? 1.1879 1.2606 1.4022 0.0253 -0.0484 -0.0107 26 CYS A C 140 O O . CYS A 27 ? 1.1783 1.2532 1.4039 0.0241 -0.0501 -0.0098 26 CYS A O 141 C CB . CYS A 27 ? 1.1611 1.2296 1.3654 0.0240 -0.0539 -0.0164 26 CYS A CB 142 S SG . CYS A 27 ? 1.2127 1.2799 1.4199 0.0238 -0.0568 -0.0179 26 CYS A SG 143 N N . TYR A 28 ? 1.1378 1.2093 1.3410 0.0266 -0.0465 -0.0104 27 TYR A N 144 C CA . TYR A 28 ? 1.1303 1.2032 1.3330 0.0264 -0.0456 -0.0083 27 TYR A CA 145 C C . TYR A 28 ? 1.1687 1.2447 1.3812 0.0289 -0.0399 -0.0023 27 TYR A C 146 O O . TYR A 28 ? 1.1598 1.2383 1.3809 0.0275 -0.0402 0.0000 27 TYR A O 147 C CB . TYR A 28 ? 1.1503 1.2203 1.3383 0.0277 -0.0464 -0.0099 27 TYR A CB 148 C CG . TYR A 28 ? 1.1716 1.2427 1.3592 0.0271 -0.0467 -0.0078 27 TYR A CG 149 C CD1 . TYR A 28 ? 1.1908 1.2621 1.3810 0.0235 -0.0509 -0.0100 27 TYR A CD1 150 C CD2 . TYR A 28 ? 1.1874 1.2595 1.3722 0.0307 -0.0422 -0.0031 27 TYR A CD2 151 C CE1 . TYR A 28 ? 1.1998 1.2722 1.3912 0.0228 -0.0512 -0.0080 27 TYR A CE1 152 C CE2 . TYR A 28 ? 1.1988 1.2723 1.3843 0.0302 -0.0427 -0.0005 27 TYR A CE2 153 C CZ . TYR A 28 ? 1.2849 1.3585 1.4744 0.0259 -0.0475 -0.0033 27 TYR A CZ 154 O OH . TYR A 28 ? 1.2962 1.3711 1.4877 0.0253 -0.0481 -0.0007 27 TYR A OH 155 N N . GLU A 29 ? 1.1212 1.1972 1.3334 0.0328 -0.0342 0.0009 28 GLU A N 156 C CA . GLU A 29 ? 1.1173 1.1963 1.3399 0.0361 -0.0269 0.0083 28 GLU A CA 157 C C . GLU A 29 ? 1.1458 1.2283 1.3921 0.0336 -0.0280 0.0105 28 GLU A C 158 O O . GLU A 29 ? 1.1385 1.2243 1.3976 0.0342 -0.0250 0.0159 28 GLU A O 159 C CB . GLU A 29 ? 1.1446 1.2222 1.3604 0.0418 -0.0195 0.0111 28 GLU A CB 160 C CG . GLU A 29 ? 1.2911 1.3648 1.4837 0.0459 -0.0184 0.0092 28 GLU A CG 161 C CD . GLU A 29 ? 1.5639 1.6384 1.7492 0.0496 -0.0146 0.0144 28 GLU A CD 162 O OE1 . GLU A 29 ? 1.5088 1.5836 1.6912 0.0560 -0.0058 0.0207 28 GLU A OE1 163 O OE2 . GLU A 29 ? 1.4884 1.5627 1.6703 0.0465 -0.0200 0.0124 28 GLU A OE2 164 N N . LYS A 30 ? 1.0887 1.1703 1.3413 0.0312 -0.0330 0.0063 29 LYS A N 165 C CA . LYS A 30 ? 1.0762 1.1600 1.3508 0.0293 -0.0367 0.0067 29 LYS A CA 166 C C . LYS A 30 ? 1.1087 1.1932 1.3886 0.0261 -0.0431 0.0038 29 LYS A C 167 O O . LYS A 30 ? 1.1005 1.1877 1.3995 0.0259 -0.0429 0.0070 29 LYS A O 168 C CB . LYS A 30 ? 1.1069 1.1888 1.3836 0.0282 -0.0414 0.0026 29 LYS A CB 169 C CG . LYS A 30 ? 1.2967 1.3785 1.5771 0.0314 -0.0350 0.0063 29 LYS A CG 170 C CD . LYS A 30 ? 1.4255 1.5104 1.7325 0.0327 -0.0317 0.0125 29 LYS A CD 171 C CE . LYS A 30 ? 1.5690 1.6548 1.8779 0.0377 -0.0201 0.0195 29 LYS A CE 172 N NZ . LYS A 30 ? 1.6856 1.7690 1.9893 0.0389 -0.0194 0.0172 29 LYS A NZ 173 N N . GLU A 31 ? 1.0556 1.1376 1.3200 0.0239 -0.0482 -0.0021 30 GLU A N 174 C CA . GLU A 31 ? 1.0458 1.1277 1.3121 0.0215 -0.0537 -0.0056 30 GLU A CA 175 C C . GLU A 31 ? 1.0834 1.1634 1.3309 0.0206 -0.0540 -0.0082 30 GLU A C 176 O O . GLU A 31 ? 1.0780 1.1553 1.3144 0.0197 -0.0572 -0.0124 30 GLU A O 177 C CB . GLU A 31 ? 1.0625 1.1429 1.3355 0.0204 -0.0618 -0.0111 30 GLU A CB 178 C CG . GLU A 31 ? 1.1969 1.2782 1.4853 0.0195 -0.0666 -0.0129 30 GLU A CG 179 C CD . GLU A 31 ? 1.4544 1.5389 1.7683 0.0202 -0.0651 -0.0080 30 GLU A CD 180 O OE1 . GLU A 31 ? 1.3882 1.4723 1.7138 0.0209 -0.0677 -0.0081 30 GLU A OE1 181 O OE2 . GLU A 31 ? 1.3717 1.4590 1.6956 0.0202 -0.0615 -0.0037 30 GLU A OE2 182 N N . PRO A 32 ? 1.0316 1.1129 1.2766 0.0209 -0.0505 -0.0048 31 PRO A N 183 C CA . PRO A 32 ? 1.0266 1.1059 1.2564 0.0200 -0.0515 -0.0070 31 PRO A CA 184 C C . PRO A 32 ? 1.0620 1.1400 1.2903 0.0175 -0.0564 -0.0117 31 PRO A C 185 O O . PRO A 32 ? 1.0571 1.1326 1.2741 0.0169 -0.0577 -0.0142 31 PRO A O 186 C CB . PRO A 32 ? 1.0516 1.1326 1.2813 0.0215 -0.0473 -0.0017 31 PRO A CB 187 C CG . PRO A 32 ? 1.1067 1.1914 1.3552 0.0221 -0.0449 0.0028 31 PRO A CG 188 C CD . PRO A 32 ? 1.0503 1.1350 1.3072 0.0225 -0.0455 0.0018 31 PRO A CD 189 N N . GLU A 33 ? 1.0082 1.0876 1.2488 0.0166 -0.0590 -0.0129 32 GLU A N 190 C CA . GLU A 33 ? 1.0015 1.0793 1.2405 0.0154 -0.0632 -0.0177 32 GLU A CA 191 C C . GLU A 33 ? 1.0436 1.1183 1.2729 0.0160 -0.0664 -0.0222 32 GLU A C 192 O O . GLU A 33 ? 1.0389 1.1117 1.2580 0.0157 -0.0663 -0.0238 32 GLU A O 193 C CB . GLU A 33 ? 1.0172 1.0966 1.2725 0.0151 -0.0659 -0.0188 32 GLU A CB 194 C CG . GLU A 33 ? 1.1490 1.2271 1.4025 0.0145 -0.0685 -0.0229 32 GLU A CG 195 C CD . GLU A 33 ? 1.4014 1.4803 1.6715 0.0145 -0.0723 -0.0253 32 GLU A CD 196 O OE1 . GLU A 33 ? 1.3240 1.4062 1.6095 0.0139 -0.0703 -0.0206 32 GLU A OE1 197 O OE2 . GLU A 33 ? 1.3268 1.4028 1.5944 0.0157 -0.0772 -0.0317 32 GLU A OE2 198 N N . GLU A 34 ? 0.9946 1.0690 1.2282 0.0171 -0.0689 -0.0234 33 GLU A N 199 C CA . GLU A 34 ? 0.9928 1.0643 1.2175 0.0183 -0.0723 -0.0269 33 GLU A CA 200 C C . GLU A 34 ? 1.0325 1.1028 1.2452 0.0182 -0.0692 -0.0252 33 GLU A C 201 O O . GLU A 34 ? 1.0295 1.0975 1.2331 0.0192 -0.0707 -0.0270 33 GLU A O 202 C CB . GLU A 34 ? 1.0120 1.0833 1.2468 0.0194 -0.0768 -0.0283 33 GLU A CB 203 C CG . GLU A 34 ? 1.1540 1.2219 1.3815 0.0215 -0.0830 -0.0333 33 GLU A CG 204 C CD . GLU A 34 ? 1.4144 1.4818 1.6527 0.0227 -0.0888 -0.0348 33 GLU A CD 205 O OE1 . GLU A 34 ? 1.3409 1.4085 1.5790 0.0227 -0.0875 -0.0323 33 GLU A OE1 206 O OE2 . GLU A 34 ? 1.3396 1.4059 1.5877 0.0238 -0.0953 -0.0388 33 GLU A OE2 207 N N . THR A 35 ? 0.9801 1.0517 1.1928 0.0177 -0.0651 -0.0218 34 THR A N 208 C CA . THR A 35 ? 0.9758 1.0458 1.1791 0.0179 -0.0631 -0.0210 34 THR A CA 209 C C . THR A 35 ? 1.0171 1.0856 1.2132 0.0170 -0.0629 -0.0216 34 THR A C 210 O O . THR A 35 ? 1.0134 1.0801 1.2040 0.0173 -0.0633 -0.0222 34 THR A O 211 C CB . THR A 35 ? 1.0776 1.1485 1.2818 0.0189 -0.0593 -0.0181 34 THR A CB 212 O OG1 . THR A 35 ? 1.0718 1.1442 1.2854 0.0200 -0.0587 -0.0167 34 THR A OG1 213 C CG2 . THR A 35 ? 1.0637 1.1322 1.2589 0.0196 -0.0585 -0.0186 34 THR A CG2 214 N N . LEU A 36 ? 0.9650 1.0346 1.1635 0.0161 -0.0621 -0.0208 35 LEU A N 215 C CA . LEU A 36 ? 0.9588 1.0273 1.1540 0.0151 -0.0619 -0.0209 35 LEU A CA 216 C C . LEU A 36 ? 1.0017 1.0690 1.1950 0.0156 -0.0626 -0.0228 35 LEU A C 217 O O . LEU A 36 ? 0.9968 1.0625 1.1865 0.0156 -0.0615 -0.0221 35 LEU A O 218 C CB . LEU A 36 ? 0.9576 1.0277 1.1574 0.0142 -0.0611 -0.0193 35 LEU A CB 219 C CG . LEU A 36 ? 1.0189 1.0884 1.2153 0.0142 -0.0606 -0.0173 35 LEU A CG 220 C CD1 . LEU A 36 ? 1.0245 1.0936 1.2166 0.0162 -0.0595 -0.0164 35 LEU A CD1 221 C CD2 . LEU A 36 ? 1.0487 1.1200 1.2499 0.0137 -0.0601 -0.0150 35 LEU A CD2 222 N N . ARG A 37 ? 0.9547 1.0224 1.1506 0.0166 -0.0646 -0.0251 36 ARG A N 223 C CA . ARG A 37 ? 0.9551 1.0208 1.1461 0.0186 -0.0658 -0.0277 36 ARG A CA 224 C C . ARG A 37 ? 1.0034 1.0672 1.1861 0.0204 -0.0655 -0.0270 36 ARG A C 225 O O . ARG A 37 ? 1.0015 1.0635 1.1780 0.0222 -0.0634 -0.0263 36 ARG A O 226 C CB . ARG A 37 ? 0.9609 1.0266 1.1569 0.0199 -0.0700 -0.0314 36 ARG A CB 227 C CG . ARG A 37 ? 1.0909 1.1583 1.2963 0.0187 -0.0702 -0.0323 36 ARG A CG 228 C CD . ARG A 37 ? 1.2252 1.2905 1.4263 0.0205 -0.0700 -0.0352 36 ARG A CD 229 N NE . ARG A 37 ? 1.3427 1.4065 1.5472 0.0229 -0.0752 -0.0407 36 ARG A NE 230 C CZ . ARG A 37 ? 1.5296 1.5911 1.7309 0.0254 -0.0760 -0.0448 36 ARG A CZ 231 N NH1 . ARG A 37 ? 1.3694 1.4304 1.5653 0.0256 -0.0708 -0.0430 36 ARG A NH1 232 N NH2 . ARG A 37 ? 1.3697 1.4291 1.5742 0.0281 -0.0823 -0.0509 36 ARG A NH2 233 N N . MET A 38 ? 0.9563 1.0205 1.1400 0.0203 -0.0669 -0.0264 37 MET A N 234 C CA . MET A 38 ? 0.9559 1.0186 1.1340 0.0217 -0.0669 -0.0252 37 MET A CA 235 C C . MET A 38 ? 0.9976 1.0597 1.1742 0.0209 -0.0633 -0.0222 37 MET A C 236 O O . MET A 38 ? 0.9956 1.0563 1.1678 0.0227 -0.0618 -0.0203 37 MET A O 237 C CB . MET A 38 ? 0.9839 1.0475 1.1667 0.0213 -0.0688 -0.0252 37 MET A CB 238 C CG . MET A 38 ? 1.0338 1.0960 1.2127 0.0226 -0.0691 -0.0238 37 MET A CG 239 S SD . MET A 38 ? 1.0848 1.1481 1.2710 0.0220 -0.0701 -0.0234 37 MET A SD 240 C CE . MET A 38 ? 1.0386 1.1026 1.2266 0.0202 -0.0659 -0.0221 37 MET A CE 241 N N . LEU A 39 ? 0.9455 1.0085 1.1266 0.0186 -0.0623 -0.0215 38 LEU A N 242 C CA . LEU A 39 ? 0.9406 1.0025 1.1231 0.0176 -0.0608 -0.0195 38 LEU A CA 243 C C . LEU A 39 ? 0.9870 1.0482 1.1701 0.0180 -0.0585 -0.0179 38 LEU A C 244 O O . LEU A 39 ? 0.9826 1.0426 1.1677 0.0185 -0.0567 -0.0152 38 LEU A O 245 C CB . LEU A 39 ? 0.9386 1.0008 1.1237 0.0162 -0.0617 -0.0201 38 LEU A CB 246 C CG . LEU A 39 ? 0.9984 1.0605 1.1823 0.0168 -0.0625 -0.0209 38 LEU A CG 247 C CD1 . LEU A 39 ? 1.0007 1.0632 1.1840 0.0168 -0.0625 -0.0212 38 LEU A CD1 248 C CD2 . LEU A 39 ? 1.0307 1.0908 1.2148 0.0173 -0.0631 -0.0208 38 LEU A CD2 249 N N . GLU A 40 ? 0.9407 1.0027 1.1239 0.0179 -0.0581 -0.0191 39 GLU A N 250 C CA . GLU A 40 ? 0.9393 1.0007 1.1235 0.0187 -0.0551 -0.0178 39 GLU A CA 251 C C . GLU A 40 ? 0.9929 1.0527 1.1703 0.0225 -0.0523 -0.0162 39 GLU A C 252 O O . GLU A 40 ? 0.9890 1.0480 1.1682 0.0238 -0.0480 -0.0128 39 GLU A O 253 C CB . GLU A 40 ? 0.9553 1.0178 1.1412 0.0183 -0.0558 -0.0203 39 GLU A CB 254 C CG . GLU A 40 ? 1.0804 1.1441 1.2734 0.0152 -0.0569 -0.0197 39 GLU A CG 255 C CD . GLU A 40 ? 1.3250 1.3905 1.5217 0.0145 -0.0583 -0.0216 39 GLU A CD 256 O OE1 . GLU A 40 ? 1.2570 1.3222 1.4528 0.0161 -0.0583 -0.0240 39 GLU A OE1 257 O OE2 . GLU A 40 ? 1.2342 1.3011 1.4349 0.0127 -0.0595 -0.0205 39 GLU A OE2 258 N N . ASP A 41 ? 0.9530 1.0124 1.1232 0.0247 -0.0545 -0.0182 40 ASP A N 259 C CA . ASP A 41 ? 0.9599 1.0174 1.1206 0.0294 -0.0527 -0.0167 40 ASP A CA 260 C C . ASP A 41 ? 1.0076 1.0648 1.1698 0.0300 -0.0500 -0.0115 40 ASP A C 261 O O . ASP A 41 ? 1.0107 1.0664 1.1659 0.0343 -0.0467 -0.0082 40 ASP A O 262 C CB . ASP A 41 ? 0.9881 1.0447 1.1416 0.0316 -0.0579 -0.0211 40 ASP A CB 263 C CG . ASP A 41 ? 1.1140 1.1703 1.2676 0.0320 -0.0612 -0.0265 40 ASP A CG 264 O OD1 . ASP A 41 ? 1.1219 1.1776 1.2745 0.0332 -0.0582 -0.0268 40 ASP A OD1 265 O OD2 . ASP A 41 ? 1.1873 1.2441 1.3437 0.0314 -0.0668 -0.0301 40 ASP A OD2 266 N N . ASN A 42 ? 0.9546 1.0127 1.1256 0.0262 -0.0514 -0.0108 41 ASN A N 267 C CA . ASN A 42 ? 0.9512 1.0090 1.1270 0.0263 -0.0500 -0.0066 41 ASN A CA 268 C C . ASN A 42 ? 0.9926 1.0502 1.1808 0.0241 -0.0481 -0.0036 41 ASN A C 269 O O . ASN A 42 ? 0.9861 1.0433 1.1816 0.0235 -0.0487 -0.0015 41 ASN A O 270 C CB . ASN A 42 ? 0.9587 1.0169 1.1348 0.0250 -0.0541 -0.0089 41 ASN A CB 271 C CG . ASN A 42 ? 1.2502 1.3080 1.4174 0.0278 -0.0562 -0.0101 41 ASN A CG 272 O OD1 . ASN A 42 ? 1.1828 1.2398 1.3461 0.0308 -0.0549 -0.0066 41 ASN A OD1 273 N ND2 . ASN A 42 ? 1.1460 1.2043 1.3110 0.0271 -0.0599 -0.0147 41 ASN A ND2 274 N N . VAL A 43 ? 0.9448 1.0025 1.1371 0.0232 -0.0465 -0.0035 42 VAL A N 275 C CA . VAL A 43 ? 0.9383 0.9954 1.1445 0.0211 -0.0460 -0.0009 42 VAL A CA 276 C C . VAL A 43 ? 0.9899 1.0465 1.2054 0.0232 -0.0410 0.0060 42 VAL A C 277 O O . VAL A 43 ? 0.9816 1.0374 1.2112 0.0214 -0.0428 0.0077 42 VAL A O 278 C CB . VAL A 43 ? 0.9843 1.0417 1.1949 0.0193 -0.0463 -0.0023 42 VAL A CB 279 C CG1 . VAL A 43 ? 0.9770 1.0348 1.1848 0.0165 -0.0521 -0.0076 42 VAL A CG1 280 C CG2 . VAL A 43 ? 0.9862 1.0440 1.1901 0.0219 -0.0414 -0.0015 42 VAL A CG2 281 N N . MET A 44 ? 0.9541 1.0108 1.1620 0.0276 -0.0348 0.0102 43 MET A N 282 C CA . MET A 44 ? 0.9578 1.0142 1.1733 0.0309 -0.0280 0.0187 43 MET A CA 283 C C . MET A 44 ? 1.0071 1.0635 1.2238 0.0317 -0.0292 0.0211 43 MET A C 284 O O . MET A 44 ? 1.0038 1.0603 1.2328 0.0333 -0.0247 0.0286 43 MET A O 285 C CB . MET A 44 ? 0.9983 1.0542 1.2021 0.0367 -0.0201 0.0225 43 MET A CB 286 C CG . MET A 44 ? 1.0448 1.1006 1.2498 0.0364 -0.0177 0.0209 43 MET A CG 287 S SD . MET A 44 ? 1.0935 1.1496 1.3248 0.0336 -0.0146 0.0266 43 MET A SD 288 C CE . MET A 44 ? 1.0541 1.1099 1.2809 0.0350 -0.0105 0.0247 43 MET A CE 289 N N . ARG A 45 ? 0.9615 1.0180 1.1676 0.0306 -0.0349 0.0154 44 ARG A N 290 C CA . ARG A 45 ? 0.9601 1.0166 1.1667 0.0312 -0.0368 0.0168 44 ARG A CA 291 C C . ARG A 45 ? 1.0043 1.0604 1.2287 0.0277 -0.0403 0.0165 44 ARG A C 292 O O . ARG A 45 ? 0.9924 1.0478 1.2209 0.0242 -0.0452 0.0109 44 ARG A O 293 C CB . ARG A 45 ? 0.9619 1.0185 1.1543 0.0311 -0.0419 0.0107 44 ARG A CB 294 C CG . ARG A 45 ? 1.0973 1.1535 1.2725 0.0351 -0.0408 0.0096 44 ARG A CG 295 C CD . ARG A 45 ? 1.2288 1.2842 1.3967 0.0413 -0.0344 0.0168 44 ARG A CD 296 N NE . ARG A 45 ? 1.3358 1.3913 1.5046 0.0433 -0.0343 0.0215 44 ARG A NE 297 C CZ . ARG A 45 ? 1.5229 1.5774 1.6774 0.0477 -0.0359 0.0219 44 ARG A CZ 298 N NH1 . ARG A 45 ? 1.3701 1.4230 1.5083 0.0508 -0.0385 0.0171 44 ARG A NH1 299 N NH2 . ARG A 45 ? 1.3583 1.4130 1.5156 0.0492 -0.0358 0.0269 44 ARG A NH2 300 N N . PRO A 46 ? 0.9650 1.0211 1.1998 0.0290 -0.0384 0.0223 45 PRO A N 301 C CA . PRO A 46 ? 0.9587 1.0137 1.2121 0.0260 -0.0429 0.0210 45 PRO A CA 302 C C . PRO A 46 ? 1.0046 1.0586 1.2537 0.0234 -0.0505 0.0123 45 PRO A C 303 O O . PRO A 46 ? 0.9964 1.0485 1.2567 0.0212 -0.0556 0.0083 45 PRO A O 304 C CB . PRO A 46 ? 0.9849 1.0405 1.2497 0.0287 -0.0385 0.0298 45 PRO A CB 305 C CG . PRO A 46 ? 1.0476 1.1044 1.2939 0.0328 -0.0340 0.0334 45 PRO A CG 306 C CD . PRO A 46 ? 0.9929 1.0497 1.2236 0.0338 -0.0323 0.0304 45 PRO A CD 307 N N . GLY A 47 ? 0.9625 1.0173 1.1959 0.0241 -0.0513 0.0093 46 GLY A N 308 C CA . GLY A 47 ? 0.9575 1.0116 1.1862 0.0225 -0.0567 0.0022 46 GLY A CA 309 C C . GLY A 47 ? 1.0039 1.0581 1.2224 0.0210 -0.0589 -0.0038 46 GLY A C 310 O O . GLY A 47 ? 0.9965 1.0509 1.2075 0.0208 -0.0611 -0.0079 46 GLY A O 311 N N . TYR A 48 ? 0.9611 1.0152 1.1812 0.0202 -0.0580 -0.0035 47 TYR A N 312 C CA . TYR A 48 ? 0.9571 1.0115 1.1694 0.0189 -0.0598 -0.0080 47 TYR A CA 313 C C . TYR A 48 ? 1.0083 1.0612 1.2202 0.0179 -0.0647 -0.0138 47 TYR A C 314 O O . TYR A 48 ? 1.0013 1.0549 1.2041 0.0179 -0.0653 -0.0169 47 TYR A O 315 C CB . TYR A 48 ? 0.9706 1.0251 1.1873 0.0183 -0.0579 -0.0060 47 TYR A CB 316 C CG . TYR A 48 ? 0.9889 1.0436 1.2004 0.0168 -0.0604 -0.0102 47 TYR A CG 317 C CD1 . TYR A 48 ? 1.0126 1.0691 1.2141 0.0171 -0.0589 -0.0115 47 TYR A CD1 318 C CD2 . TYR A 48 ? 0.9978 1.0507 1.2150 0.0154 -0.0649 -0.0130 47 TYR A CD2 319 C CE1 . TYR A 48 ? 1.0197 1.0767 1.2183 0.0159 -0.0608 -0.0145 47 TYR A CE1 320 C CE2 . TYR A 48 ? 1.0081 1.0612 1.2196 0.0146 -0.0670 -0.0161 47 TYR A CE2 321 C CZ . TYR A 48 ? 1.0978 1.1533 1.3008 0.0147 -0.0644 -0.0162 47 TYR A CZ 322 O OH . TYR A 48 ? 1.1060 1.1621 1.3056 0.0140 -0.0659 -0.0181 47 TYR A OH 323 N N . TYR A 49 ? 0.9702 1.0204 1.1920 0.0176 -0.0682 -0.0151 48 TYR A N 324 C CA . TYR A 49 ? 0.9724 1.0199 1.1917 0.0179 -0.0733 -0.0212 48 TYR A CA 325 C C . TYR A 49 ? 1.0273 1.0747 1.2405 0.0193 -0.0733 -0.0239 48 TYR A C 326 O O . TYR A 49 ? 1.0240 1.0698 1.2297 0.0207 -0.0753 -0.0284 48 TYR A O 327 C CB . TYR A 49 ? 0.9904 1.0342 1.2223 0.0178 -0.0788 -0.0231 48 TYR A CB 328 C CG . TYR A 49 ? 1.0117 1.0552 1.2478 0.0165 -0.0802 -0.0222 48 TYR A CG 329 C CD1 . TYR A 49 ? 1.0385 1.0813 1.2646 0.0167 -0.0829 -0.0259 48 TYR A CD1 330 C CD2 . TYR A 49 ? 1.0192 1.0635 1.2701 0.0154 -0.0781 -0.0168 48 TYR A CD2 331 C CE1 . TYR A 49 ? 1.0476 1.0903 1.2785 0.0155 -0.0845 -0.0248 48 TYR A CE1 332 C CE2 . TYR A 49 ? 1.0299 1.0738 1.2865 0.0143 -0.0791 -0.0156 48 TYR A CE2 333 C CZ . TYR A 49 ? 1.1242 1.1674 1.3709 0.0141 -0.0828 -0.0199 48 TYR A CZ 334 O OH . TYR A 49 ? 1.1353 1.1782 1.3886 0.0129 -0.0841 -0.0186 48 TYR A OH 335 N N . GLN A 50 ? 0.9875 1.0365 1.2033 0.0196 -0.0705 -0.0205 49 GLN A N 336 C CA . GLN A 50 ? 0.9885 1.0377 1.2004 0.0207 -0.0700 -0.0221 49 GLN A CA 337 C C . GLN A 50 ? 1.0407 1.0924 1.2421 0.0209 -0.0677 -0.0223 49 GLN A C 338 O O . GLN A 50 ? 1.0363 1.0878 1.2336 0.0220 -0.0674 -0.0249 49 GLN A O 339 C CB . GLN A 50 ? 1.0055 1.0556 1.2246 0.0210 -0.0684 -0.0176 49 GLN A CB 340 C CG . GLN A 50 ? 1.2104 1.2579 1.4428 0.0213 -0.0711 -0.0182 49 GLN A CG 341 C CD . GLN A 50 ? 1.4613 1.5101 1.7016 0.0218 -0.0691 -0.0131 49 GLN A CD 342 O OE1 . GLN A 50 ? 1.4064 1.4561 1.6428 0.0226 -0.0684 -0.0131 49 GLN A OE1 343 N NE2 . GLN A 50 ? 1.3641 1.4127 1.6174 0.0217 -0.0683 -0.0080 49 GLN A NE2 344 N N . LEU A 51 ? 0.9996 1.0533 1.1980 0.0200 -0.0658 -0.0195 50 LEU A N 345 C CA . LEU A 51 ? 0.9981 1.0541 1.1897 0.0200 -0.0646 -0.0199 50 LEU A CA 346 C C . LEU A 51 ? 1.0551 1.1108 1.2430 0.0198 -0.0651 -0.0226 50 LEU A C 347 O O . LEU A 51 ? 1.0493 1.1062 1.2342 0.0205 -0.0640 -0.0234 50 LEU A O 348 C CB . LEU A 51 ? 0.9980 1.0554 1.1874 0.0200 -0.0632 -0.0170 50 LEU A CB 349 C CG . LEU A 51 ? 1.0563 1.1155 1.2409 0.0201 -0.0632 -0.0181 50 LEU A CG 350 C CD1 . LEU A 51 ? 1.0589 1.1189 1.2436 0.0210 -0.0644 -0.0187 50 LEU A CD1 351 C CD2 . LEU A 51 ? 1.0887 1.1483 1.2700 0.0209 -0.0621 -0.0165 50 LEU A CD2 352 N N . LEU A 52 ? 1.0192 1.0733 1.2086 0.0192 -0.0667 -0.0233 51 LEU A N 353 C CA . LEU A 52 ? 1.0221 1.0755 1.2073 0.0195 -0.0679 -0.0254 51 LEU A CA 354 C C . LEU A 52 ? 1.0855 1.1369 1.2656 0.0221 -0.0686 -0.0286 51 LEU A C 355 O O . LEU A 52 ? 1.0818 1.1339 1.2557 0.0236 -0.0670 -0.0287 51 LEU A O 356 C CB . LEU A 52 ? 1.0236 1.0752 1.2134 0.0185 -0.0708 -0.0256 51 LEU A CB 357 C CG . LEU A 52 ? 1.0860 1.1367 1.2714 0.0189 -0.0729 -0.0271 51 LEU A CG 358 C CD1 . LEU A 52 ? 1.0836 1.1377 1.2680 0.0175 -0.0699 -0.0245 51 LEU A CD1 359 C CD2 . LEU A 52 ? 1.1206 1.1681 1.3124 0.0184 -0.0779 -0.0284 51 LEU A CD2 360 N N . GLN A 53 ? 1.0529 1.1017 1.2360 0.0232 -0.0705 -0.0306 52 GLN A N 361 C CA . GLN A 53 ? 1.0613 1.1072 1.2392 0.0265 -0.0711 -0.0344 52 GLN A CA 362 C C . GLN A 53 ? 1.1175 1.1661 1.2924 0.0277 -0.0661 -0.0327 52 GLN A C 363 O O . GLN A 53 ? 1.1168 1.1648 1.2843 0.0307 -0.0638 -0.0334 52 GLN A O 364 C CB . GLN A 53 ? 1.0813 1.1241 1.2663 0.0270 -0.0744 -0.0369 52 GLN A CB 365 C CG . GLN A 53 ? 1.2928 1.3311 1.4717 0.0312 -0.0765 -0.0426 52 GLN A CG 366 C CD . GLN A 53 ? 1.5498 1.5849 1.7385 0.0315 -0.0805 -0.0456 52 GLN A CD 367 O OE1 . GLN A 53 ? 1.4928 1.5296 1.6893 0.0304 -0.0783 -0.0432 52 GLN A OE1 368 N NE2 . GLN A 53 ? 1.4589 1.4889 1.6483 0.0334 -0.0872 -0.0510 52 GLN A NE2 369 N N . ALA A 54 ? 1.0753 1.1265 1.2564 0.0259 -0.0644 -0.0298 53 ALA A N 370 C CA . ALA A 54 ? 1.0748 1.1284 1.2572 0.0267 -0.0609 -0.0280 53 ALA A CA 371 C C . ALA A 54 ? 1.1295 1.1860 1.3105 0.0266 -0.0583 -0.0257 53 ALA A C 372 O O . ALA A 54 ? 1.1263 1.1838 1.3079 0.0287 -0.0546 -0.0246 53 ALA A O 373 C CB . ALA A 54 ? 1.0799 1.1349 1.2691 0.0250 -0.0616 -0.0258 53 ALA A CB 374 N N . SER A 55 ? 1.0883 1.1462 1.2691 0.0244 -0.0596 -0.0247 54 SER A N 375 C CA . SER A 55 ? 1.0862 1.1469 1.2680 0.0239 -0.0579 -0.0226 54 SER A CA 376 C C . SER A 55 ? 1.1471 1.2074 1.3235 0.0263 -0.0556 -0.0222 54 SER A C 377 O O . SER A 55 ? 1.1405 1.2033 1.3200 0.0272 -0.0523 -0.0194 54 SER A O 378 C CB . SER A 55 ? 1.1265 1.1882 1.3095 0.0214 -0.0600 -0.0222 54 SER A CB 379 O OG . SER A 55 ? 1.2344 1.2962 1.4199 0.0205 -0.0616 -0.0220 54 SER A OG 380 N N . LEU A 56 ? 1.1162 1.1732 1.2853 0.0277 -0.0576 -0.0247 55 LEU A N 381 C CA . LEU A 56 ? 1.1246 1.1804 1.2853 0.0309 -0.0563 -0.0245 55 LEU A CA 382 C C . LEU A 56 ? 1.1915 1.2441 1.3441 0.0361 -0.0541 -0.0264 55 LEU A C 383 O O . LEU A 56 ? 1.1953 1.2452 1.3370 0.0401 -0.0543 -0.0275 55 LEU A O 384 C CB . LEU A 56 ? 1.1268 1.1806 1.2841 0.0298 -0.0611 -0.0261 55 LEU A CB 385 C CG . LEU A 56 ? 1.1784 1.2351 1.3428 0.0257 -0.0620 -0.0240 55 LEU A CG 386 C CD1 . LEU A 56 ? 1.1824 1.2367 1.3460 0.0246 -0.0667 -0.0256 55 LEU A CD1 387 C CD2 . LEU A 56 ? 1.2077 1.2682 1.3744 0.0258 -0.0581 -0.0201 55 LEU A CD2 388 N N . THR A 57 ? 1.1538 1.2066 1.3110 0.0365 -0.0520 -0.0267 56 THR A N 389 C CA . THR A 57 ? 1.1644 1.2143 1.3156 0.0417 -0.0488 -0.0285 56 THR A CA 390 C C . THR A 57 ? 1.2192 1.2726 1.3762 0.0435 -0.0413 -0.0234 56 THR A C 391 O O . THR A 57 ? 1.2035 1.2604 1.3730 0.0399 -0.0409 -0.0207 56 THR A O 392 C CB . THR A 57 ? 1.2683 1.3154 1.4229 0.0409 -0.0526 -0.0328 56 THR A CB 393 O OG1 . THR A 57 ? 1.2661 1.3098 1.4177 0.0399 -0.0594 -0.0370 56 THR A OG1 394 C CG2 . THR A 57 ? 1.2604 1.3043 1.4100 0.0463 -0.0491 -0.0353 56 THR A CG2 395 N N . CYS A 58 ? 1.1934 1.2452 1.3415 0.0498 -0.0354 -0.0220 57 CYS A N 396 C CA . CYS A 58 ? 1.1964 1.2510 1.3504 0.0532 -0.0264 -0.0162 57 CYS A CA 397 C C . CYS A 58 ? 1.2596 1.3107 1.3982 0.0619 -0.0201 -0.0158 57 CYS A C 398 O O . CYS A 58 ? 1.2626 1.3105 1.3857 0.0651 -0.0225 -0.0179 57 CYS A O 399 C CB . CYS A 58 ? 1.1945 1.2544 1.3602 0.0504 -0.0241 -0.0098 57 CYS A CB 400 S SG . CYS A 58 ? 1.2424 1.3067 1.4274 0.0517 -0.0156 -0.0026 57 CYS A SG 401 N N . SER A 59 ? 1.2201 1.2714 1.3627 0.0663 -0.0120 -0.0128 58 SER A N 402 C CA . SER A 59 ? 1.2357 1.2835 1.3631 0.0759 -0.0039 -0.0116 58 SER A CA 403 C C . SER A 59 ? 1.2848 1.3372 1.4212 0.0797 0.0080 -0.0012 58 SER A C 404 O O . SER A 59 ? 1.2681 1.3249 1.4258 0.0763 0.0113 0.0035 58 SER A O 405 C CB . SER A 59 ? 1.2882 1.3316 1.4120 0.0794 -0.0033 -0.0173 58 SER A CB 406 O OG . SER A 59 ? 1.3887 1.4356 1.5332 0.0755 -0.0007 -0.0144 58 SER A OG 407 N N . ASN B 5 ? 0.8895 0.9194 0.9998 0.0632 -0.0514 -0.0468 5 ASN B N 408 C CA . ASN B 5 ? 0.8978 0.9256 0.9927 0.0675 -0.0521 -0.0466 5 ASN B CA 409 C C . ASN B 5 ? 0.9357 0.9638 1.0345 0.0622 -0.0608 -0.0477 5 ASN B C 410 O O . ASN B 5 ? 0.9424 0.9652 1.0301 0.0656 -0.0676 -0.0525 5 ASN B O 411 C CB . ASN B 5 ? 0.9113 0.9438 1.0042 0.0699 -0.0418 -0.0380 5 ASN B CB 412 C CG . ASN B 5 ? 1.2222 1.2518 1.2956 0.0775 -0.0399 -0.0369 5 ASN B CG 413 O OD1 . ASN B 5 ? 1.1720 1.1960 1.2284 0.0862 -0.0382 -0.0406 5 ASN B OD1 414 N ND2 . ASN B 5 ? 1.1127 1.1459 1.1875 0.0750 -0.0398 -0.0316 5 ASN B ND2 415 N N . PHE B 6 ? 0.8700 0.9036 0.9847 0.0544 -0.0607 -0.0434 6 PHE B N 416 C CA . PHE B 6 ? 0.8556 0.8907 0.9776 0.0487 -0.0666 -0.0429 6 PHE B CA 417 C C . PHE B 6 ? 0.8999 0.9333 1.0121 0.0507 -0.0701 -0.0429 6 PHE B C 418 O O . PHE B 6 ? 0.9069 0.9343 1.0103 0.0544 -0.0771 -0.0486 6 PHE B O 419 C CB . PHE B 6 ? 0.8741 0.9072 1.0074 0.0448 -0.0735 -0.0469 6 PHE B CB 420 C CG . PHE B 6 ? 0.8871 0.9214 1.0289 0.0397 -0.0784 -0.0456 6 PHE B CG 421 C CD1 . PHE B 6 ? 0.9149 0.9549 1.0649 0.0349 -0.0747 -0.0400 6 PHE B CD1 422 C CD2 . PHE B 6 ? 0.9215 0.9510 1.0641 0.0403 -0.0869 -0.0502 6 PHE B CD2 423 C CE1 . PHE B 6 ? 0.9209 0.9618 1.0784 0.0309 -0.0780 -0.0386 6 PHE B CE1 424 C CE2 . PHE B 6 ? 0.9509 0.9818 1.1037 0.0358 -0.0905 -0.0482 6 PHE B CE2 425 C CZ . PHE B 6 ? 0.9146 0.9513 1.0743 0.0313 -0.0853 -0.0422 6 PHE B CZ 426 N N . ASN B 7 ? 0.8389 0.8772 0.9542 0.0482 -0.0662 -0.0368 7 ASN B N 427 C CA . ASN B 7 ? 0.8365 0.8742 0.9449 0.0495 -0.0690 -0.0354 7 ASN B CA 428 C C . ASN B 7 ? 0.8582 0.9005 0.9800 0.0426 -0.0697 -0.0317 7 ASN B C 429 O O . ASN B 7 ? 0.8440 0.8917 0.9725 0.0404 -0.0637 -0.0264 7 ASN B O 430 C CB . ASN B 7 ? 0.8550 0.8934 0.9507 0.0558 -0.0620 -0.0309 7 ASN B CB 431 C CG . ASN B 7 ? 1.1491 1.1858 1.2344 0.0588 -0.0651 -0.0294 7 ASN B CG 432 O OD1 . ASN B 7 ? 1.0851 1.1187 1.1702 0.0572 -0.0741 -0.0333 7 ASN B OD1 433 N ND2 . ASN B 7 ? 1.0494 1.0883 1.1270 0.0636 -0.0575 -0.0231 7 ASN B ND2 434 N N . VAL B 8 ? 0.8027 0.8428 0.9298 0.0395 -0.0772 -0.0347 8 VAL B N 435 C CA . VAL B 8 ? 0.7835 0.8272 0.9230 0.0337 -0.0780 -0.0317 8 VAL B CA 436 C C . VAL B 8 ? 0.8188 0.8649 0.9554 0.0342 -0.0764 -0.0274 8 VAL B C 437 O O . VAL B 8 ? 0.8021 0.8523 0.9484 0.0300 -0.0741 -0.0240 8 VAL B O 438 C CB . VAL B 8 ? 0.8319 0.8724 0.9804 0.0310 -0.0855 -0.0352 8 VAL B CB 439 C CG1 . VAL B 8 ? 0.8390 0.8751 0.9832 0.0330 -0.0933 -0.0377 8 VAL B CG1 440 C CG2 . VAL B 8 ? 0.8164 0.8609 0.9791 0.0254 -0.0832 -0.0319 8 VAL B CG2 441 N N . TYR B 9 ? 0.7788 0.8221 0.9013 0.0399 -0.0772 -0.0275 9 TYR B N 442 C CA . TYR B 9 ? 0.7756 0.8206 0.8936 0.0417 -0.0758 -0.0228 9 TYR B CA 443 C C . TYR B 9 ? 0.8050 0.8559 0.9271 0.0416 -0.0663 -0.0159 9 TYR B C 444 O O . TYR B 9 ? 0.7999 0.8534 0.9228 0.0421 -0.0645 -0.0109 9 TYR B O 445 C CB . TYR B 9 ? 0.8103 0.8495 0.9102 0.0489 -0.0807 -0.0252 9 TYR B CB 446 C CG . TYR B 9 ? 0.8383 0.8716 0.9391 0.0481 -0.0923 -0.0319 9 TYR B CG 447 C CD1 . TYR B 9 ? 0.8596 0.8932 0.9691 0.0446 -0.0981 -0.0309 9 TYR B CD1 448 C CD2 . TYR B 9 ? 0.8557 0.8835 0.9523 0.0506 -0.0976 -0.0391 9 TYR B CD2 449 C CE1 . TYR B 9 ? 0.8736 0.9019 0.9884 0.0436 -0.1090 -0.0365 9 TYR B CE1 450 C CE2 . TYR B 9 ? 0.8711 0.8935 0.9732 0.0497 -0.1089 -0.0452 9 TYR B CE2 451 C CZ . TYR B 9 ? 0.9613 0.9840 1.0730 0.0462 -0.1146 -0.0436 9 TYR B CZ 452 O OH . TYR B 9 ? 0.9772 0.9946 1.0978 0.0453 -0.1260 -0.0491 9 TYR B OH 453 N N . LYS B 10 ? 0.7785 0.6373 1.2657 -0.0232 0.0949 -0.1523 10 LYS B N 454 C CA . LYS B 10 ? 0.7699 0.6397 1.3010 -0.0259 0.0947 -0.1620 10 LYS B CA 455 C C . LYS B 10 ? 0.8127 0.6745 1.2841 -0.0330 0.0731 -0.1416 10 LYS B C 456 O O . LYS B 10 ? 0.8028 0.6717 1.2695 -0.0374 0.0882 -0.1468 10 LYS B O 457 C CB . LYS B 10 ? 0.8073 0.6839 1.4431 -0.0206 0.0655 -0.1734 10 LYS B CB 458 C CG . LYS B 10 ? 0.9850 0.8750 1.7033 -0.0159 0.0952 -0.2038 10 LYS B CG 459 C CD . LYS B 10 ? 1.1121 1.0150 1.9462 -0.0125 0.0761 -0.2220 10 LYS B CD 460 C CE . LYS B 10 ? 1.2372 1.1537 2.1676 -0.0089 0.1040 -0.2562 10 LYS B CE 461 N NZ . LYS B 10 ? 1.3482 1.2577 2.3352 0.0005 0.0657 -0.2526 10 LYS B NZ 462 N N . ALA B 11 ? 0.7735 0.6187 1.1969 -0.0363 0.0408 -0.1198 11 ALA B N 463 C CA . ALA B 11 ? 0.7811 0.6144 1.1415 -0.0474 0.0215 -0.1023 11 ALA B CA 464 C C . ALA B 11 ? 0.8112 0.6421 1.0926 -0.0513 0.0505 -0.0971 11 ALA B C 465 O O . ALA B 11 ? 0.8076 0.6377 1.0532 -0.0594 0.0546 -0.0939 11 ALA B O 466 C CB . ALA B 11 ? 0.8192 0.6307 1.1648 -0.0543 -0.0261 -0.0835 11 ALA B CB 467 N N . THR B 12 ? 0.7521 0.5812 1.0114 -0.0459 0.0685 -0.0972 12 THR B N 468 C CA . THR B 12 ? 0.7395 0.5651 0.9346 -0.0483 0.0918 -0.0928 12 THR B CA 469 C C . THR B 12 ? 0.7674 0.6017 0.9645 -0.0453 0.1283 -0.1051 12 THR B C 470 O O . THR B 12 ? 0.7582 0.6009 1.0031 -0.0423 0.1413 -0.1190 12 THR B O 471 C CB . THR B 12 ? 0.8385 0.6545 1.0056 -0.0459 0.0881 -0.0850 12 THR B CB 472 O OG1 . THR B 12 ? 0.8200 0.6408 1.0234 -0.0367 0.1019 -0.0956 12 THR B OG1 473 C CG2 . THR B 12 ? 0.8422 0.6435 0.9963 -0.0532 0.0515 -0.0708 12 THR B CG2 474 N N . ARG B 13 ? 0.7151 0.5447 0.8620 -0.0482 0.1441 -0.1008 13 ARG B N 475 C CA . ARG B 13 ? 0.7057 0.5353 0.8425 -0.0485 0.1730 -0.1081 13 ARG B CA 476 C C . ARG B 13 ? 0.7463 0.5651 0.8337 -0.0488 0.1821 -0.1012 13 ARG B C 477 O O . ARG B 13 ? 0.7393 0.5554 0.8018 -0.0505 0.1696 -0.0930 13 ARG B O 478 C CB . ARG B 13 ? 0.7071 0.5429 0.8543 -0.0535 0.1773 -0.1122 13 ARG B CB 479 C CG . ARG B 13 ? 0.8356 0.6694 0.9509 -0.0593 0.1662 -0.1041 13 ARG B CG 480 C CD . ARG B 13 ? 0.9560 0.7940 1.0773 -0.0638 0.1768 -0.1095 13 ARG B CD 481 N NE . ARG B 13 ? 1.0685 0.9029 1.1569 -0.0695 0.1759 -0.1056 13 ARG B NE 482 C CZ . ARG B 13 ? 1.2561 1.0922 1.3447 -0.0737 0.1850 -0.1097 13 ARG B CZ 483 N NH1 . ARG B 13 ? 1.0992 0.9397 1.2140 -0.0735 0.1953 -0.1162 13 ARG B NH1 484 N NH2 . ARG B 13 ? 1.0946 0.9279 1.1606 -0.0792 0.1856 -0.1095 13 ARG B NH2 485 N N . PRO B 14 ? 0.7033 0.5129 0.7753 -0.0498 0.2029 -0.1048 14 PRO B N 486 C CA . PRO B 14 ? 0.7026 0.4992 0.7338 -0.0503 0.2048 -0.0971 14 PRO B CA 487 C C . PRO B 14 ? 0.7409 0.5382 0.7627 -0.0536 0.2032 -0.0944 14 PRO B C 488 O O . PRO B 14 ? 0.7341 0.5389 0.7739 -0.0566 0.2064 -0.0989 14 PRO B O 489 C CB . PRO B 14 ? 0.7434 0.5243 0.7589 -0.0545 0.2234 -0.1012 14 PRO B CB 490 C CG . PRO B 14 ? 0.8051 0.5920 0.8492 -0.0594 0.2385 -0.1127 14 PRO B CG 491 C CD . PRO B 14 ? 0.7324 0.5396 0.8217 -0.0537 0.2249 -0.1167 14 PRO B CD 492 N N . TYR B 15 ? 0.6897 0.4803 0.6903 -0.0531 0.1984 -0.0890 15 TYR B N 493 C CA . TYR B 15 ? 0.6816 0.4739 0.6826 -0.0564 0.1979 -0.0899 15 TYR B CA 494 C C . TYR B 15 ? 0.7315 0.5094 0.7201 -0.0558 0.1975 -0.0865 15 TYR B C 495 O O . TYR B 15 ? 0.7356 0.5004 0.7092 -0.0535 0.1946 -0.0816 15 TYR B O 496 C CB . TYR B 15 ? 0.6893 0.4935 0.6938 -0.0602 0.1889 -0.0920 15 TYR B CB 497 C CG . TYR B 15 ? 0.7108 0.5132 0.7021 -0.0598 0.1817 -0.0892 15 TYR B CG 498 C CD1 . TYR B 15 ? 0.7367 0.5393 0.7261 -0.0575 0.1735 -0.0851 15 TYR B CD1 499 C CD2 . TYR B 15 ? 0.7205 0.5208 0.7070 -0.0625 0.1835 -0.0924 15 TYR B CD2 500 C CE1 . TYR B 15 ? 0.7477 0.5471 0.7235 -0.0583 0.1673 -0.0822 15 TYR B CE1 501 C CE2 . TYR B 15 ? 0.7330 0.5318 0.7099 -0.0638 0.1796 -0.0917 15 TYR B CE2 502 C CZ . TYR B 15 ? 0.8276 0.6251 0.7953 -0.0620 0.1715 -0.0856 15 TYR B CZ 503 O OH . TYR B 15 ? 0.8446 0.6392 0.8013 -0.0644 0.1678 -0.0846 15 TYR B OH 504 N N . LEU B 16 ? 0.6810 0.4598 0.6796 -0.0585 0.1982 -0.0898 16 LEU B N 505 C CA . LEU B 16 ? 0.6827 0.4484 0.6841 -0.0577 0.1932 -0.0881 16 LEU B CA 506 C C . LEU B 16 ? 0.7105 0.4883 0.7280 -0.0584 0.1913 -0.0964 16 LEU B C 507 O O . LEU B 16 ? 0.6975 0.4894 0.7221 -0.0642 0.1969 -0.1045 16 LEU B O 508 C CB . LEU B 16 ? 0.6929 0.4499 0.7025 -0.0612 0.1962 -0.0885 16 LEU B CB 509 C CG . LEU B 16 ? 0.7744 0.5113 0.7625 -0.0656 0.2005 -0.0812 16 LEU B CG 510 C CD1 . LEU B 16 ? 0.7815 0.5179 0.7801 -0.0708 0.2077 -0.0842 16 LEU B CD1 511 C CD2 . LEU B 16 ? 0.8315 0.5379 0.7981 -0.0672 0.1886 -0.0707 16 LEU B CD2 512 N N . ALA B 17 ? 0.6632 0.4340 0.6854 -0.0550 0.1841 -0.0956 17 ALA B N 513 C CA . ALA B 17 ? 0.6521 0.4334 0.6936 -0.0580 0.1865 -0.1070 17 ALA B CA 514 C C . ALA B 17 ? 0.7000 0.4703 0.7695 -0.0536 0.1772 -0.1093 17 ALA B C 515 O O . ALA B 17 ? 0.7083 0.4586 0.7700 -0.0486 0.1638 -0.0975 17 ALA B O 516 C CB . ALA B 17 ? 0.6579 0.4459 0.6811 -0.0596 0.1869 -0.1060 17 ALA B CB 517 N N . HIS B 18 ? 0.6455 0.4262 0.7487 -0.0578 0.1838 -0.1257 18 HIS B N 518 C CA . HIS B 18 ? 0.6450 0.4184 0.7928 -0.0535 0.1740 -0.1324 18 HIS B CA 519 C C . HIS B 18 ? 0.6993 0.4616 0.8419 -0.0469 0.1589 -0.1234 18 HIS B C 520 O O . HIS B 18 ? 0.6880 0.4580 0.8084 -0.0487 0.1649 -0.1230 18 HIS B O 521 C CB . HIS B 18 ? 0.6488 0.4388 0.8406 -0.0620 0.1910 -0.1581 18 HIS B CB 522 C CG . HIS B 18 ? 0.6927 0.4783 0.9455 -0.0571 0.1812 -0.1691 18 HIS B CG 523 N ND1 . HIS B 18 ? 0.7219 0.4939 1.0167 -0.0505 0.1642 -0.1677 18 HIS B ND1 524 C CD2 . HIS B 18 ? 0.7113 0.5027 0.9923 -0.0581 0.1835 -0.1809 18 HIS B CD2 525 C CE1 . HIS B 18 ? 0.7156 0.4858 1.0679 -0.0467 0.1542 -0.1789 18 HIS B CE1 526 N NE2 . HIS B 18 ? 0.7125 0.4957 1.0602 -0.0510 0.1671 -0.1884 18 HIS B NE2 527 N N . CYS B 19 ? 0.6716 0.4126 0.8341 -0.0406 0.1366 -0.1154 19 CYS B N 528 C CA . CYS B 19 ? 0.6810 0.4059 0.8433 -0.0353 0.1163 -0.1066 19 CYS B CA 529 C C . CYS B 19 ? 0.7313 0.4466 0.9597 -0.0314 0.0970 -0.1148 19 CYS B C 530 O O . CYS B 19 ? 0.7378 0.4393 0.9855 -0.0310 0.0854 -0.1117 19 CYS B O 531 C CB . CYS B 19 ? 0.7094 0.4074 0.8158 -0.0348 0.1018 -0.0839 19 CYS B CB 532 S SG . CYS B 19 ? 0.7829 0.4545 0.8783 -0.0317 0.0738 -0.0715 19 CYS B SG 533 N N . PRO B 20 ? 0.6781 0.4003 0.9485 -0.0290 0.0927 -0.1265 20 PRO B N 534 C CA . PRO B 20 ? 0.6818 0.3964 1.0314 -0.0247 0.0726 -0.1375 20 PRO B CA 535 C C . PRO B 20 ? 0.7593 0.4339 1.1052 -0.0197 0.0289 -0.1148 20 PRO B C 536 O O . PRO B 20 ? 0.7666 0.4279 1.1738 -0.0166 0.0063 -0.1188 20 PRO B O 537 C CB . PRO B 20 ? 0.6905 0.4248 1.0821 -0.0253 0.0836 -0.1574 20 PRO B CB 538 C CG . PRO B 20 ? 0.7437 0.4797 1.0653 -0.0268 0.0912 -0.1442 20 PRO B CG 539 C CD . PRO B 20 ? 0.6856 0.4225 0.9401 -0.0305 0.1054 -0.1315 20 PRO B CD 540 N N . ASP B 21 ? 0.7318 0.3844 1.0060 -0.0210 0.0163 -0.0919 21 ASP B N 541 C CA . ASP B 21 ? 0.7721 0.3790 1.0219 -0.0223 -0.0250 -0.0683 21 ASP B CA 542 C C . ASP B 21 ? 0.8427 0.4268 0.9968 -0.0310 -0.0210 -0.0467 21 ASP B C 543 O O . ASP B 21 ? 0.8368 0.4222 0.9404 -0.0331 -0.0112 -0.0413 21 ASP B O 544 C CB . ASP B 21 ? 0.8052 0.4020 1.0794 -0.0183 -0.0501 -0.0675 21 ASP B CB 545 C CG . ASP B 21 ? 0.9844 0.5291 1.2437 -0.0217 -0.1012 -0.0446 21 ASP B CG 546 O OD1 . ASP B 21 ? 1.0014 0.5370 1.2912 -0.0182 -0.1262 -0.0449 21 ASP B OD1 547 O OD2 . ASP B 21 ? 1.0925 0.6026 1.3073 -0.0299 -0.1173 -0.0259 21 ASP B OD2 548 N N . CYS B 22 ? 0.8214 0.3837 0.9550 -0.0372 -0.0273 -0.0363 22 CYS B N 549 C CA . CYS B 22 ? 0.8487 0.3858 0.8976 -0.0491 -0.0210 -0.0190 22 CYS B CA 550 C C . CYS B 22 ? 0.9625 0.4406 0.9667 -0.0609 -0.0613 0.0045 22 CYS B C 551 O O . CYS B 22 ? 0.9956 0.4434 0.9238 -0.0761 -0.0575 0.0184 22 CYS B O 552 C CB . CYS B 22 ? 0.8428 0.3900 0.8910 -0.0522 -0.0007 -0.0227 22 CYS B CB 553 S SG . CYS B 22 ? 0.8292 0.4362 0.9032 -0.0448 0.0452 -0.0461 22 CYS B SG 554 N N . GLY B 23 ? 0.9347 0.3951 0.9872 -0.0561 -0.0994 0.0072 23 GLY B N 555 C CA . GLY B 23 ? 1.0007 0.4002 1.0202 -0.0678 -0.1483 0.0304 23 GLY B CA 556 C C . GLY B 23 ? 1.0625 0.4457 1.1645 -0.0614 -0.1893 0.0308 23 GLY B C 557 O O . GLY B 23 ? 1.0405 0.4364 1.1847 -0.0577 -0.1809 0.0231 23 GLY B O 558 N N . GLU B 24 ? 1.0477 0.4037 1.1803 -0.0598 -0.2347 0.0381 24 GLU B N 559 C CA . GLU B 24 ? 1.0623 0.3995 1.2886 -0.0527 -0.2826 0.0378 24 GLU B CA 560 C C . GLU B 24 ? 1.0399 0.4363 1.3895 -0.0332 -0.2582 0.0037 24 GLU B C 561 O O . GLU B 24 ? 1.0394 0.4288 1.4757 -0.0273 -0.2844 -0.0028 24 GLU B O 562 C CB . GLU B 24 ? 1.1468 0.4241 1.3424 -0.0673 -0.3222 0.0626 24 GLU B CB 563 C CG . GLU B 24 ? 1.3644 0.5722 1.4371 -0.0927 -0.3516 0.0955 24 GLU B CG 564 C CD . GLU B 24 ? 1.6682 0.8287 1.7406 -0.0983 -0.4110 0.1119 24 GLU B CD 565 O OE1 . GLU B 24 ? 1.5799 0.7568 1.6326 -0.0955 -0.3993 0.1062 24 GLU B OE1 566 O OE2 . GLU B 24 ? 1.6450 0.7489 1.7358 -0.1064 -0.4722 0.1317 24 GLU B OE2 567 N N . GLY B 25 ? 0.9365 0.3871 1.2918 -0.0257 -0.2090 -0.0183 25 GLY B N 568 C CA . GLY B 25 ? 0.8749 0.3805 1.3280 -0.0134 -0.1769 -0.0530 25 GLY B CA 569 C C . GLY B 25 ? 0.8939 0.4261 1.3675 -0.0131 -0.1430 -0.0678 25 GLY B C 570 O O . GLY B 25 ? 0.8513 0.4214 1.4107 -0.0067 -0.1201 -0.0980 25 GLY B O 571 N N . HIS B 26 ? 0.8693 0.3817 1.2643 -0.0220 -0.1369 -0.0489 26 HIS B N 572 C CA . HIS B 26 ? 0.8449 0.3785 1.2512 -0.0228 -0.1073 -0.0602 26 HIS B CA 573 C C . HIS B 26 ? 0.8503 0.4229 1.2014 -0.0252 -0.0549 -0.0695 26 HIS B C 574 O O . HIS B 26 ? 0.8528 0.4160 1.1206 -0.0309 -0.0474 -0.0537 26 HIS B O 575 C CB . HIS B 26 ? 0.9037 0.3901 1.2704 -0.0320 -0.1352 -0.0356 26 HIS B CB 576 C CG . HIS B 26 ? 0.9896 0.4338 1.4172 -0.0308 -0.1920 -0.0255 26 HIS B CG 577 N ND1 . HIS B 26 ? 0.9965 0.4546 1.5343 -0.0219 -0.1996 -0.0460 26 HIS B ND1 578 C CD2 . HIS B 26 ? 1.0733 0.4598 1.4660 -0.0387 -0.2448 0.0024 26 HIS B CD2 579 C CE1 . HIS B 26 ? 1.0386 0.4483 1.6127 -0.0227 -0.2593 -0.0294 26 HIS B CE1 580 N NE2 . HIS B 26 ? 1.0929 0.4563 1.5780 -0.0335 -0.2901 0.0014 26 HIS B NE2 581 N N . SER B 27 ? 0.7660 0.3799 1.1655 -0.0225 -0.0200 -0.0961 27 SER B N 582 C CA . SER B 27 ? 0.7302 0.3792 1.0865 -0.0262 0.0250 -0.1061 27 SER B CA 583 C C . SER B 27 ? 0.7862 0.4252 1.0830 -0.0325 0.0345 -0.0921 27 SER B C 584 O O . SER B 27 ? 0.8005 0.4180 1.1143 -0.0341 0.0179 -0.0859 27 SER B O 585 C CB . SER B 27 ? 0.7421 0.4308 1.1651 -0.0262 0.0560 -0.1395 27 SER B CB 586 O OG . SER B 27 ? 0.8573 0.5451 1.3390 -0.0262 0.0535 -0.1514 27 SER B OG 587 N N . CYS B 28 ? 0.7278 0.3816 0.9602 -0.0363 0.0604 -0.0881 28 CYS B N 588 C CA . CYS B 28 ? 0.7315 0.3803 0.9118 -0.0427 0.0737 -0.0781 28 CYS B CA 589 C C . CYS B 28 ? 0.7403 0.4209 0.8879 -0.0446 0.1065 -0.0859 28 CYS B C 590 O O . CYS B 28 ? 0.7154 0.4152 0.8645 -0.0423 0.1160 -0.0938 28 CYS B O 591 C CB . CYS B 28 ? 0.7813 0.3868 0.9016 -0.0495 0.0520 -0.0527 28 CYS B CB 592 S SG . CYS B 28 ? 0.8353 0.4399 0.8816 -0.0535 0.0650 -0.0432 28 CYS B SG 593 N N . HIS B 29 ? 0.6899 0.3730 0.8089 -0.0497 0.1208 -0.0827 29 HIS B N 594 C CA . HIS B 29 ? 0.6643 0.3717 0.7543 -0.0521 0.1450 -0.0872 29 HIS B CA 595 C C . HIS B 29 ? 0.7250 0.4147 0.7623 -0.0542 0.1420 -0.0718 29 HIS B C 596 O O . HIS B 29 ? 0.7429 0.4126 0.7500 -0.0607 0.1424 -0.0622 29 HIS B O 597 C CB . HIS B 29 ? 0.6682 0.3851 0.7624 -0.0567 0.1590 -0.0926 29 HIS B CB 598 C CG . HIS B 29 ? 0.7012 0.4294 0.8468 -0.0568 0.1618 -0.1086 29 HIS B CG 599 N ND1 . HIS B 29 ? 0.7031 0.4585 0.8700 -0.0596 0.1783 -0.1276 29 HIS B ND1 600 C CD2 . HIS B 29 ? 0.7355 0.4485 0.9145 -0.0567 0.1504 -0.1093 29 HIS B CD2 601 C CE1 . HIS B 29 ? 0.6951 0.4535 0.9097 -0.0612 0.1804 -0.1421 29 HIS B CE1 602 N NE2 . HIS B 29 ? 0.7163 0.4508 0.9443 -0.0579 0.1625 -0.1315 29 HIS B NE2 603 N N . SER B 30 ? 0.6702 0.3644 0.6977 -0.0506 0.1396 -0.0711 30 SER B N 604 C CA . SER B 30 ? 0.6838 0.3610 0.6668 -0.0530 0.1367 -0.0598 30 SER B CA 605 C C . SER B 30 ? 0.7152 0.4081 0.6739 -0.0548 0.1565 -0.0622 30 SER B C 606 O O . SER B 30 ? 0.6830 0.4028 0.6570 -0.0512 0.1659 -0.0708 30 SER B O 607 C CB . SER B 30 ? 0.7317 0.4037 0.7204 -0.0481 0.1220 -0.0581 30 SER B CB 608 O OG . SER B 30 ? 0.8718 0.5253 0.8165 -0.0517 0.1190 -0.0484 30 SER B OG 609 N N . PRO B 31 ? 0.6926 0.3654 0.6135 -0.0623 0.1618 -0.0554 31 PRO B N 610 C CA . PRO B 31 ? 0.6781 0.3662 0.5894 -0.0634 0.1800 -0.0610 31 PRO B CA 611 C C . PRO B 31 ? 0.7170 0.4058 0.6160 -0.0600 0.1776 -0.0603 31 PRO B C 612 O O . PRO B 31 ? 0.7041 0.4043 0.6022 -0.0598 0.1898 -0.0656 31 PRO B O 613 C CB . PRO B 31 ? 0.7337 0.3989 0.6156 -0.0761 0.1914 -0.0587 31 PRO B CB 614 C CG . PRO B 31 ? 0.8296 0.4561 0.6831 -0.0839 0.1734 -0.0463 31 PRO B CG 615 C CD . PRO B 31 ? 0.7566 0.3889 0.6419 -0.0731 0.1516 -0.0438 31 PRO B CD 616 N N . VAL B 32 ? 0.6743 0.3504 0.5700 -0.0570 0.1603 -0.0545 32 VAL B N 617 C CA . VAL B 32 ? 0.6696 0.3431 0.5544 -0.0539 0.1544 -0.0529 32 VAL B CA 618 C C . VAL B 32 ? 0.6881 0.3768 0.6053 -0.0453 0.1426 -0.0558 32 VAL B C 619 O O . VAL B 32 ? 0.6899 0.3697 0.6038 -0.0430 0.1306 -0.0529 32 VAL B O 620 C CB . VAL B 32 ? 0.7642 0.3987 0.6043 -0.0641 0.1458 -0.0438 32 VAL B CB 621 C CG1 . VAL B 32 ? 0.7872 0.3939 0.6254 -0.0668 0.1206 -0.0336 32 VAL B CG1 622 C CG2 . VAL B 32 ? 0.7656 0.3974 0.5891 -0.0631 0.1454 -0.0444 32 VAL B CG2 623 N N . ALA B 33 ? 0.6143 0.3254 0.5626 -0.0428 0.1484 -0.0638 33 ALA B N 624 C CA . ALA B 33 ? 0.5916 0.3179 0.5723 -0.0396 0.1452 -0.0719 33 ALA B CA 625 C C . ALA B 33 ? 0.6225 0.3602 0.5988 -0.0378 0.1476 -0.0742 33 ALA B C 626 O O . ALA B 33 ? 0.6115 0.3570 0.5714 -0.0384 0.1550 -0.0729 33 ALA B O 627 C CB . ALA B 33 ? 0.5862 0.3312 0.5902 -0.0425 0.1563 -0.0821 33 ALA B CB 628 N N . LEU B 34 ? 0.5735 0.3110 0.5694 -0.0358 0.1398 -0.0782 34 LEU B N 629 C CA . LEU B 34 ? 0.5618 0.3077 0.5544 -0.0355 0.1417 -0.0806 34 LEU B CA 630 C C . LEU B 34 ? 0.5939 0.3594 0.5986 -0.0427 0.1553 -0.0921 34 LEU B C 631 O O . LEU B 34 ? 0.5862 0.3586 0.6198 -0.0470 0.1612 -0.1040 34 LEU B O 632 C CB . LEU B 34 ? 0.5699 0.3046 0.5776 -0.0318 0.1272 -0.0802 34 LEU B CB 633 C CG . LEU B 34 ? 0.6532 0.3613 0.6345 -0.0293 0.1107 -0.0673 34 LEU B CG 634 C CD1 . LEU B 34 ? 0.6659 0.3613 0.6694 -0.0265 0.0909 -0.0671 34 LEU B CD1 635 C CD2 . LEU B 34 ? 0.6878 0.3940 0.6322 -0.0297 0.1172 -0.0617 34 LEU B CD2 636 N N . GLU B 35 ? 0.5445 0.3158 0.5265 -0.0462 0.1596 -0.0891 35 GLU B N 637 C CA . GLU B 35 ? 0.5426 0.3241 0.5198 -0.0581 0.1693 -0.0966 35 GLU B CA 638 C C . GLU B 35 ? 0.5897 0.3716 0.5673 -0.0641 0.1716 -0.1018 35 GLU B C 639 O O . GLU B 35 ? 0.5901 0.3775 0.5808 -0.0758 0.1837 -0.1159 35 GLU B O 640 C CB . GLU B 35 ? 0.5639 0.3464 0.5170 -0.0609 0.1668 -0.0886 35 GLU B CB 641 C CG . GLU B 35 ? 0.7031 0.4889 0.6597 -0.0602 0.1691 -0.0882 35 GLU B CG 642 C CD . GLU B 35 ? 0.9870 0.7792 0.9509 -0.0713 0.1787 -0.0990 35 GLU B CD 643 O OE1 . GLU B 35 ? 0.9262 0.7198 0.8832 -0.0848 0.1855 -0.1075 35 GLU B OE1 644 O OE2 . GLU B 35 ? 0.9260 0.7202 0.9001 -0.0687 0.1811 -0.1002 35 GLU B OE2 645 N N . ARG B 36 ? 0.5399 0.3156 0.5041 -0.0579 0.1625 -0.0926 36 ARG B N 646 C CA . ARG B 36 ? 0.5392 0.3136 0.5008 -0.0633 0.1635 -0.0955 36 ARG B CA 647 C C . ARG B 36 ? 0.5759 0.3422 0.5341 -0.0514 0.1515 -0.0865 36 ARG B C 648 O O . ARG B 36 ? 0.5691 0.3304 0.5126 -0.0442 0.1450 -0.0768 36 ARG B O 649 C CB . ARG B 36 ? 0.5576 0.3300 0.4893 -0.0776 0.1658 -0.0926 36 ARG B CB 650 C CG . ARG B 36 ? 0.7063 0.4740 0.6281 -0.0897 0.1701 -0.0967 36 ARG B CG 651 C CD . ARG B 36 ? 0.8526 0.6098 0.7365 -0.1048 0.1646 -0.0882 36 ARG B CD 652 N NE . ARG B 36 ? 0.9861 0.7337 0.8532 -0.1173 0.1661 -0.0886 36 ARG B NE 653 C CZ . ARG B 36 ? 1.1954 0.9271 1.0281 -0.1296 0.1545 -0.0772 36 ARG B CZ 654 N NH1 . ARG B 36 ? 1.0412 0.7661 0.8588 -0.1296 0.1382 -0.0650 36 ARG B NH1 655 N NH2 . ARG B 36 ? 1.0519 0.7727 0.8680 -0.1424 0.1568 -0.0777 36 ARG B NH2 656 N N . ILE B 37 ? 0.5266 0.2916 0.5010 -0.0510 0.1502 -0.0921 37 ILE B N 657 C CA . ILE B 37 ? 0.5218 0.2777 0.4919 -0.0423 0.1385 -0.0852 37 ILE B CA 658 C C . ILE B 37 ? 0.5647 0.3219 0.5276 -0.0502 0.1424 -0.0874 37 ILE B C 659 O O . ILE B 37 ? 0.5629 0.3255 0.5428 -0.0602 0.1523 -0.0995 37 ILE B O 660 C CB . ILE B 37 ? 0.5629 0.3114 0.5590 -0.0349 0.1272 -0.0877 37 ILE B CB 661 C CG1 . ILE B 37 ? 0.5710 0.3134 0.5714 -0.0309 0.1219 -0.0846 37 ILE B CG1 662 C CG2 . ILE B 37 ? 0.5798 0.3148 0.5615 -0.0285 0.1138 -0.0796 37 ILE B CG2 663 C CD1 . ILE B 37 ? 0.6672 0.4026 0.7065 -0.0276 0.1087 -0.0899 37 ILE B CD1 664 N N . ARG B 38 ? 0.5161 0.2672 0.4559 -0.0476 0.1360 -0.0773 38 ARG B N 665 C CA . ARG B 38 ? 0.5177 0.2655 0.4464 -0.0554 0.1360 -0.0761 38 ARG B CA 666 C C . ARG B 38 ? 0.5579 0.2996 0.4928 -0.0467 0.1276 -0.0744 38 ARG B C 667 O O . ARG B 38 ? 0.5492 0.2848 0.4787 -0.0361 0.1195 -0.0685 38 ARG B O 668 C CB . ARG B 38 ? 0.5255 0.2683 0.4305 -0.0595 0.1305 -0.0660 38 ARG B CB 669 C CG . ARG B 38 ? 0.6526 0.3965 0.5440 -0.0744 0.1361 -0.0675 38 ARG B CG 670 C CD . ARG B 38 ? 0.7785 0.5145 0.6530 -0.0770 0.1228 -0.0557 38 ARG B CD 671 N NE . ARG B 38 ? 0.8989 0.6219 0.7593 -0.0832 0.1120 -0.0480 38 ARG B NE 672 C CZ . ARG B 38 ? 1.0845 0.7973 0.9401 -0.0831 0.0940 -0.0367 38 ARG B CZ 673 N NH1 . ARG B 38 ? 0.9192 0.6355 0.7861 -0.0771 0.0864 -0.0335 38 ARG B NH1 674 N NH2 . ARG B 38 ? 0.9272 0.6256 0.7719 -0.0892 0.0822 -0.0292 38 ARG B NH2 675 N N . ASN B 39 ? 0.5157 0.2580 0.4612 -0.0537 0.1314 -0.0814 39 ASN B N 676 C CA . ASN B 39 ? 0.5115 0.2483 0.4661 -0.0471 0.1229 -0.0813 39 ASN B CA 677 C C . ASN B 39 ? 0.5664 0.2998 0.5119 -0.0574 0.1265 -0.0817 39 ASN B C 678 O O . ASN B 39 ? 0.5624 0.2964 0.5270 -0.0597 0.1279 -0.0895 39 ASN B O 679 C CB . ASN B 39 ? 0.5172 0.2566 0.5077 -0.0430 0.1195 -0.0912 39 ASN B CB 680 C CG . ASN B 39 ? 0.8041 0.5547 0.8265 -0.0545 0.1346 -0.1078 39 ASN B CG 681 O OD1 . ASN B 39 ? 0.7435 0.4990 0.7532 -0.0683 0.1507 -0.1126 39 ASN B OD1 682 N ND2 . ASN B 39 ? 0.6975 0.4504 0.7640 -0.0510 0.1293 -0.1187 39 ASN B ND2 683 N N . GLU B 40 ? 0.5300 0.2574 0.4481 -0.0642 0.1253 -0.0727 40 GLU B N 684 C CA . GLU B 40 ? 0.5442 0.2620 0.4457 -0.0768 0.1251 -0.0694 40 GLU B CA 685 C C . GLU B 40 ? 0.5896 0.3001 0.4919 -0.0658 0.1124 -0.0624 40 GLU B C 686 O O . GLU B 40 ? 0.5968 0.2996 0.4934 -0.0740 0.1118 -0.0617 40 GLU B O 687 C CB . GLU B 40 ? 0.5820 0.2902 0.4528 -0.0912 0.1228 -0.0607 40 GLU B CB 688 C CG . GLU B 40 ? 0.7182 0.4317 0.5828 -0.1042 0.1360 -0.0684 40 GLU B CG 689 C CD . GLU B 40 ? 0.9672 0.6821 0.8242 -0.0989 0.1280 -0.0605 40 GLU B CD 690 O OE1 . GLU B 40 ? 0.8679 0.5778 0.7238 -0.0881 0.1120 -0.0490 40 GLU B OE1 691 O OE2 . GLU B 40 ? 0.9027 0.6239 0.7593 -0.1062 0.1389 -0.0680 40 GLU B OE2 692 N N . ALA B 41 ? 0.5329 0.2442 0.4406 -0.0496 0.1045 -0.0588 41 ALA B N 693 C CA . ALA B 41 ? 0.5301 0.2342 0.4392 -0.0400 0.0957 -0.0557 41 ALA B CA 694 C C . ALA B 41 ? 0.5786 0.2816 0.4993 -0.0375 0.0946 -0.0622 41 ALA B C 695 O O . ALA B 41 ? 0.5659 0.2719 0.4978 -0.0332 0.0942 -0.0675 41 ALA B O 696 C CB . ALA B 41 ? 0.5341 0.2378 0.4430 -0.0288 0.0938 -0.0547 41 ALA B CB 697 N N . THR B 42 ? 0.5462 0.2428 0.4664 -0.0410 0.0914 -0.0612 42 THR B N 698 C CA . THR B 42 ? 0.5458 0.2407 0.4800 -0.0395 0.0886 -0.0676 42 THR B CA 699 C C . THR B 42 ? 0.6023 0.2899 0.5347 -0.0278 0.0788 -0.0679 42 THR B C 700 O O . THR B 42 ? 0.6011 0.2857 0.5456 -0.0260 0.0720 -0.0729 42 THR B O 701 C CB . THR B 42 ? 0.6489 0.3378 0.5809 -0.0490 0.0894 -0.0666 42 THR B CB 702 O OG1 . THR B 42 ? 0.6455 0.3248 0.5644 -0.0459 0.0816 -0.0574 42 THR B OG1 703 C CG2 . THR B 42 ? 0.6420 0.3330 0.5695 -0.0674 0.1020 -0.0698 42 THR B CG2 704 N N . ASP B 43 ? 0.5643 0.2469 0.4821 -0.0222 0.0782 -0.0641 43 ASP B N 705 C CA . ASP B 43 ? 0.5742 0.2452 0.4798 -0.0168 0.0737 -0.0665 43 ASP B CA 706 C C . ASP B 43 ? 0.6318 0.2985 0.5298 -0.0163 0.0701 -0.0670 43 ASP B C 707 O O . ASP B 43 ? 0.6481 0.2985 0.5263 -0.0167 0.0642 -0.0680 43 ASP B O 708 C CB . ASP B 43 ? 0.6033 0.2700 0.5022 -0.0142 0.0792 -0.0671 43 ASP B CB 709 C CG . ASP B 43 ? 0.7255 0.3976 0.6227 -0.0132 0.0870 -0.0665 43 ASP B CG 710 O OD1 . ASP B 43 ? 0.7207 0.4029 0.6228 -0.0149 0.0881 -0.0624 43 ASP B OD1 711 O OD2 . ASP B 43 ? 0.8078 0.4740 0.7006 -0.0121 0.0940 -0.0723 43 ASP B OD2 712 N N . GLY B 44 ? 0.5762 0.2542 0.4873 -0.0176 0.0730 -0.0665 44 GLY B N 713 C CA . GLY B 44 ? 0.5781 0.2520 0.4896 -0.0171 0.0673 -0.0664 44 GLY B CA 714 C C . GLY B 44 ? 0.6261 0.3013 0.5234 -0.0169 0.0752 -0.0636 44 GLY B C 715 O O . GLY B 44 ? 0.6242 0.2955 0.5226 -0.0173 0.0703 -0.0626 44 GLY B O 716 N N . THR B 45 ? 0.5798 0.2596 0.4689 -0.0164 0.0858 -0.0628 45 THR B N 717 C CA . THR B 45 ? 0.5773 0.2599 0.4589 -0.0163 0.0947 -0.0621 45 THR B CA 718 C C . THR B 45 ? 0.6159 0.3123 0.5109 -0.0177 0.0979 -0.0608 45 THR B C 719 O O . THR B 45 ? 0.6002 0.3071 0.5078 -0.0207 0.0996 -0.0609 45 THR B O 720 C CB . THR B 45 ? 0.6706 0.3557 0.5551 -0.0148 0.1023 -0.0640 45 THR B CB 721 O OG1 . THR B 45 ? 0.6798 0.3521 0.5549 -0.0150 0.1018 -0.0685 45 THR B OG1 722 C CG2 . THR B 45 ? 0.6496 0.3374 0.5336 -0.0151 0.1125 -0.0665 45 THR B CG2 723 N N . LEU B 46 ? 0.5788 0.2724 0.4676 -0.0180 0.0997 -0.0602 46 LEU B N 724 C CA . LEU B 46 ? 0.5659 0.2715 0.4677 -0.0196 0.1038 -0.0607 46 LEU B CA 725 C C . LEU B 46 ? 0.6134 0.3255 0.5110 -0.0199 0.1130 -0.0596 46 LEU B C 726 O O . LEU B 46 ? 0.6196 0.3233 0.5046 -0.0192 0.1172 -0.0602 46 LEU B O 727 C CB . LEU B 46 ? 0.5751 0.2720 0.4803 -0.0196 0.0959 -0.0606 46 LEU B CB 728 C CG . LEU B 46 ? 0.6414 0.3316 0.5639 -0.0189 0.0817 -0.0627 46 LEU B CG 729 C CD1 . LEU B 46 ? 0.6629 0.3348 0.5834 -0.0192 0.0662 -0.0590 46 LEU B CD1 730 C CD2 . LEU B 46 ? 0.6542 0.3624 0.6120 -0.0211 0.0876 -0.0710 46 LEU B CD2 731 N N . LYS B 47 ? 0.5602 0.2851 0.4675 -0.0233 0.1166 -0.0594 47 LYS B N 732 C CA . LYS B 47 ? 0.5557 0.2868 0.4645 -0.0241 0.1212 -0.0582 47 LYS B CA 733 C C . LYS B 47 ? 0.6070 0.3437 0.5192 -0.0268 0.1257 -0.0602 47 LYS B C 734 O O . LYS B 47 ? 0.5986 0.3420 0.5169 -0.0329 0.1276 -0.0629 47 LYS B O 735 C CB . LYS B 47 ? 0.5860 0.3211 0.4978 -0.0289 0.1165 -0.0546 47 LYS B CB 736 C CG . LYS B 47 ? 0.7303 0.4691 0.6505 -0.0287 0.1150 -0.0529 47 LYS B CG 737 C CD . LYS B 47 ? 0.8421 0.5775 0.7634 -0.0352 0.1022 -0.0463 47 LYS B CD 738 C CE . LYS B 47 ? 0.9550 0.6930 0.8931 -0.0344 0.0954 -0.0447 47 LYS B CE 739 N NZ . LYS B 47 ? 1.0759 0.8043 1.0210 -0.0390 0.0751 -0.0365 47 LYS B NZ 740 N N . ILE B 48 ? 0.5717 0.3034 0.4795 -0.0242 0.1290 -0.0605 48 ILE B N 741 C CA . ILE B 48 ? 0.5696 0.3036 0.4821 -0.0260 0.1317 -0.0619 48 ILE B CA 742 C C . ILE B 48 ? 0.6153 0.3580 0.5312 -0.0278 0.1386 -0.0624 48 ILE B C 743 O O . ILE B 48 ? 0.6139 0.3546 0.5278 -0.0261 0.1425 -0.0626 48 ILE B O 744 C CB . ILE B 48 ? 0.6265 0.3425 0.5273 -0.0249 0.1264 -0.0598 48 ILE B CB 745 C CG1 . ILE B 48 ? 0.6418 0.3469 0.5413 -0.0235 0.1147 -0.0587 48 ILE B CG1 746 C CG2 . ILE B 48 ? 0.6357 0.3509 0.5463 -0.0265 0.1252 -0.0603 48 ILE B CG2 747 C CD1 . ILE B 48 ? 0.7687 0.4477 0.6397 -0.0259 0.1070 -0.0544 48 ILE B CD1 748 N N . GLN B 49 ? 0.5658 0.3180 0.4903 -0.0323 0.1412 -0.0649 49 GLN B N 749 C CA . GLN B 49 ? 0.5610 0.3207 0.4894 -0.0351 0.1456 -0.0655 49 GLN B CA 750 C C . GLN B 49 ? 0.6162 0.3737 0.5484 -0.0347 0.1503 -0.0677 49 GLN B C 751 O O . GLN B 49 ? 0.6126 0.3695 0.5536 -0.0359 0.1494 -0.0709 49 GLN B O 752 C CB . GLN B 49 ? 0.5779 0.3452 0.5054 -0.0444 0.1444 -0.0667 49 GLN B CB 753 C CG . GLN B 49 ? 0.7430 0.5151 0.6736 -0.0474 0.1430 -0.0654 49 GLN B CG 754 C CD . GLN B 49 ? 0.9709 0.7433 0.8901 -0.0610 0.1383 -0.0649 49 GLN B CD 755 O OE1 . GLN B 49 ? 0.9217 0.6882 0.8260 -0.0698 0.1347 -0.0635 49 GLN B OE1 756 N NE2 . GLN B 49 ? 0.8679 0.6440 0.7895 -0.0658 0.1378 -0.0659 49 GLN B NE2 757 N N . VAL B 50 ? 0.5770 0.3325 0.5073 -0.0337 0.1553 -0.0671 50 VAL B N 758 C CA . VAL B 50 ? 0.5807 0.3300 0.5099 -0.0350 0.1595 -0.0675 50 VAL B CA 759 C C . VAL B 50 ? 0.6199 0.3806 0.5602 -0.0378 0.1661 -0.0706 50 VAL B C 760 O O . VAL B 50 ? 0.6086 0.3789 0.5570 -0.0382 0.1652 -0.0715 50 VAL B O 761 C CB . VAL B 50 ? 0.6527 0.3816 0.5609 -0.0358 0.1612 -0.0647 50 VAL B CB 762 C CG1 . VAL B 50 ? 0.6558 0.3862 0.5632 -0.0377 0.1733 -0.0690 50 VAL B CG1 763 C CG2 . VAL B 50 ? 0.6678 0.3793 0.5659 -0.0395 0.1574 -0.0611 50 VAL B CG2 764 N N . SER B 51 ? 0.5784 0.3361 0.5215 -0.0400 0.1697 -0.0717 51 SER B N 765 C CA . SER B 51 ? 0.5711 0.3388 0.5256 -0.0431 0.1758 -0.0752 51 SER B CA 766 C C . SER B 51 ? 0.6280 0.3941 0.5842 -0.0437 0.1844 -0.0769 51 SER B C 767 O O . SER B 51 ? 0.6170 0.3947 0.5900 -0.0453 0.1869 -0.0807 51 SER B O 768 C CB . SER B 51 ? 0.6169 0.3816 0.5778 -0.0454 0.1768 -0.0769 51 SER B CB 769 O OG . SER B 51 ? 0.7237 0.4980 0.6950 -0.0489 0.1828 -0.0808 51 SER B OG 770 N N . LEU B 52 ? 0.6004 0.3510 0.5403 -0.0447 0.1899 -0.0761 52 LEU B N 771 C CA . LEU B 52 ? 0.6090 0.3566 0.5524 -0.0488 0.2044 -0.0828 52 LEU B CA 772 C C . LEU B 52 ? 0.6501 0.4072 0.6128 -0.0449 0.2050 -0.0883 52 LEU B C 773 O O . LEU B 52 ? 0.6337 0.3955 0.5977 -0.0397 0.1924 -0.0839 52 LEU B O 774 C CB . LEU B 52 ? 0.6426 0.3629 0.5519 -0.0584 0.2141 -0.0817 52 LEU B CB 775 C CG . LEU B 52 ? 0.7223 0.4203 0.5985 -0.0602 0.2051 -0.0747 52 LEU B CG 776 C CD1 . LEU B 52 ? 0.7324 0.4276 0.6037 -0.0617 0.2137 -0.0814 52 LEU B CD1 777 C CD2 . LEU B 52 ? 0.7933 0.4585 0.6305 -0.0728 0.2056 -0.0689 52 LEU B CD2 778 N N . GLN B 53 ? 0.6150 0.3740 0.5969 -0.0485 0.2203 -0.0994 53 GLN B N 779 C CA . GLN B 53 ? 0.6084 0.3763 0.6223 -0.0447 0.2212 -0.1080 53 GLN B CA 780 C C . GLN B 53 ? 0.6872 0.4410 0.6924 -0.0528 0.2437 -0.1206 53 GLN B C 781 O O . GLN B 53 ? 0.6984 0.4459 0.7033 -0.0631 0.2652 -0.1313 53 GLN B O 782 C CB . GLN B 53 ? 0.6098 0.3969 0.6746 -0.0414 0.2158 -0.1143 53 GLN B CB 783 C CG . GLN B 53 ? 0.7405 0.5368 0.8072 -0.0372 0.1912 -0.1024 53 GLN B CG 784 C CD . GLN B 53 ? 0.9481 0.7575 1.0560 -0.0372 0.1819 -0.1062 53 GLN B CD 785 O OE1 . GLN B 53 ? 0.8930 0.7079 1.0317 -0.0393 0.1959 -0.1182 53 GLN B OE1 786 N NE2 . GLN B 53 ? 0.8372 0.6494 0.9442 -0.0372 0.1577 -0.0965 53 GLN B NE2 787 N N . ILE B 54 ? 0.6542 0.4012 0.6496 -0.0507 0.2407 -0.1206 54 ILE B N 788 C CA . ILE B 54 ? 0.6829 0.4135 0.6635 -0.0610 0.2625 -0.1338 54 ILE B CA 789 C C . ILE B 54 ? 0.7318 0.4773 0.7720 -0.0581 0.2730 -0.1529 54 ILE B C 790 O O . ILE B 54 ? 0.7007 0.4619 0.7798 -0.0456 0.2527 -0.1491 54 ILE B O 791 C CB . ILE B 54 ? 0.7358 0.4472 0.6695 -0.0620 0.2531 -0.1240 54 ILE B CB 792 C CG1 . ILE B 54 ? 0.7411 0.4416 0.6356 -0.0611 0.2353 -0.1055 54 ILE B CG1 793 C CG2 . ILE B 54 ? 0.7873 0.4735 0.6875 -0.0787 0.2767 -0.1369 54 ILE B CG2 794 C CD1 . ILE B 54 ? 0.8104 0.5179 0.7062 -0.0498 0.2125 -0.0939 54 ILE B CD1 795 N N . GLY B 55 ? 0.7225 0.4597 0.7691 -0.0721 0.3045 -0.1741 55 GLY B N 796 C CA . GLY B 55 ? 0.7230 0.4733 0.8359 -0.0719 0.3206 -0.1987 55 GLY B CA 797 C C . GLY B 55 ? 0.7617 0.5344 0.9461 -0.0677 0.3229 -0.2108 55 GLY B C 798 O O . GLY B 55 ? 0.7525 0.5394 1.0101 -0.0644 0.3293 -0.2311 55 GLY B O 799 N N . ILE B 56 ? 0.7136 0.4898 0.8836 -0.0677 0.3159 -0.1992 56 ILE B N 800 C CA . ILE B 56 ? 0.6990 0.4953 0.9322 -0.0643 0.3144 -0.2082 56 ILE B CA 801 C C . ILE B 56 ? 0.7741 0.5610 0.9767 -0.0795 0.3398 -0.2131 56 ILE B C 802 O O . ILE B 56 ? 0.7799 0.5491 0.9129 -0.0846 0.3364 -0.1957 56 ILE B O 803 C CB . ILE B 56 ? 0.7075 0.5186 0.9598 -0.0481 0.2722 -0.1869 56 ILE B CB 804 C CG1 . ILE B 56 ? 0.7028 0.5182 0.9829 -0.0364 0.2457 -0.1812 56 ILE B CG1 805 C CG2 . ILE B 56 ? 0.7045 0.5329 1.0161 -0.0460 0.2658 -0.1939 56 ILE B CG2 806 C CD1 . ILE B 56 ? 0.8007 0.6047 1.0178 -0.0326 0.2275 -0.1588 56 ILE B CD1 807 N N . LYS B 57 ? 0.7416 0.5388 1.0008 -0.0873 0.3644 -0.2378 57 LYS B N 808 C CA . LYS B 57 ? 0.7621 0.5508 1.0009 -0.1036 0.3908 -0.2454 57 LYS B CA 809 C C . LYS B 57 ? 0.7873 0.5944 1.0557 -0.0928 0.3673 -0.2338 57 LYS B C 810 O O . LYS B 57 ? 0.7510 0.5763 1.0612 -0.0757 0.3338 -0.2244 57 LYS B O 811 C CB . LYS B 57 ? 0.8204 0.6108 1.1086 -0.1208 0.4349 -0.2825 57 LYS B CB 812 C CG . LYS B 57 ? 1.0481 0.8107 1.2836 -0.1421 0.4692 -0.2968 57 LYS B CG 813 C CD . LYS B 57 ? 1.2023 0.9706 1.5020 -0.1595 0.5156 -0.3398 57 LYS B CD 814 C CE . LYS B 57 ? 1.3786 1.1325 1.6569 -0.1865 0.5560 -0.3567 57 LYS B CE 815 N NZ . LYS B 57 ? 1.5170 1.2816 1.8743 -0.2032 0.6034 -0.4033 57 LYS B NZ 816 N N . THR B 58 ? 0.7640 0.5632 1.0077 -0.1051 0.3841 -0.2346 58 THR B N 817 C CA . THR B 58 ? 0.7425 0.5567 1.0096 -0.0979 0.3662 -0.2258 58 THR B CA 818 C C . THR B 58 ? 0.7782 0.6208 1.1452 -0.0893 0.3581 -0.2429 58 THR B C 819 O O . THR B 58 ? 0.7495 0.6058 1.1397 -0.0784 0.3277 -0.2309 58 THR B O 820 C CB . THR B 58 ? 0.8698 0.6664 1.0900 -0.1147 0.3882 -0.2246 58 THR B CB 821 O OG1 . THR B 58 ? 0.9048 0.6916 1.1361 -0.1356 0.4315 -0.2515 58 THR B OG1 822 C CG2 . THR B 58 ? 0.8651 0.6339 0.9952 -0.1187 0.3787 -0.2005 58 THR B CG2 823 N N . ASP B 59 ? 0.7522 0.6015 1.1801 -0.0955 0.3842 -0.2721 59 ASP B N 824 C CA . ASP B 59 ? 0.7364 0.6115 1.2755 -0.0876 0.3764 -0.2929 59 ASP B CA 825 C C . ASP B 59 ? 0.7693 0.6544 1.3529 -0.0690 0.3366 -0.2845 59 ASP B C 826 O O . ASP B 59 ? 0.7543 0.6569 1.4365 -0.0617 0.3240 -0.3011 59 ASP B O 827 C CB . ASP B 59 ? 0.7855 0.6632 1.3791 -0.1050 0.4268 -0.3329 59 ASP B CB 828 C CG . ASP B 59 ? 0.9427 0.8023 1.4997 -0.1178 0.4591 -0.3466 59 ASP B CG 829 O OD1 . ASP B 59 ? 0.9453 0.8163 1.5731 -0.1125 0.4616 -0.3669 59 ASP B OD1 830 O OD2 . ASP B 59 ? 1.0489 0.8807 1.5063 -0.1337 0.4787 -0.3361 59 ASP B OD2 831 N N . ASP B 60 ? 0.7260 0.5980 1.2385 -0.0623 0.3149 -0.2584 60 ASP B N 832 C CA . ASP B 60 ? 0.7125 0.5861 1.2391 -0.0478 0.2766 -0.2440 60 ASP B CA 833 C C . ASP B 60 ? 0.7721 0.6442 1.3325 -0.0471 0.2904 -0.2617 60 ASP B C 834 O O . ASP B 60 ? 0.7593 0.6277 1.3141 -0.0370 0.2618 -0.2473 60 ASP B O 835 C CB . ASP B 60 ? 0.7214 0.6074 1.3063 -0.0366 0.2304 -0.2339 60 ASP B CB 836 C CG . ASP B 60 ? 0.8529 0.7395 1.4028 -0.0388 0.2165 -0.2176 60 ASP B CG 837 O OD1 . ASP B 60 ? 0.8596 0.7346 1.3251 -0.0407 0.2135 -0.1968 60 ASP B OD1 838 O OD2 . ASP B 60 ? 0.9282 0.8270 1.5403 -0.0386 0.2070 -0.2269 60 ASP B OD2 839 N N . SER B 61 ? 0.7500 0.6228 1.3411 -0.0602 0.3363 -0.2938 61 SER B N 840 C CA . SER B 61 ? 0.7622 0.6331 1.3885 -0.0632 0.3576 -0.3172 61 SER B CA 841 C C . SER B 61 ? 0.8249 0.6746 1.3596 -0.0656 0.3596 -0.3006 61 SER B C 842 O O . SER B 61 ? 0.8297 0.6618 1.2706 -0.0742 0.3676 -0.2834 61 SER B O 843 C CB . SER B 61 ? 0.8350 0.7076 1.5012 -0.0831 0.4136 -0.3578 61 SER B CB 844 O OG . SER B 61 ? 0.9777 0.8275 1.5455 -0.1041 0.4490 -0.3553 61 SER B OG 845 N N . HIS B 62 ? 0.7832 0.6339 1.3509 -0.0579 0.3497 -0.3060 62 HIS B N 846 C CA . HIS B 62 ? 0.7920 0.6243 1.2851 -0.0592 0.3496 -0.2928 62 HIS B CA 847 C C . HIS B 62 ? 0.8766 0.6916 1.3341 -0.0814 0.4011 -0.3185 62 HIS B C 848 O O . HIS B 62 ? 0.8846 0.7067 1.4117 -0.0896 0.4318 -0.3541 62 HIS B O 849 C CB . HIS B 62 ? 0.7864 0.6246 1.3262 -0.0425 0.3149 -0.2860 62 HIS B CB 850 C CG . HIS B 62 ? 0.8062 0.6489 1.3428 -0.0270 0.2624 -0.2538 62 HIS B CG 851 N ND1 . HIS B 62 ? 0.8233 0.6539 1.2863 -0.0220 0.2379 -0.2244 62 HIS B ND1 852 C CD2 . HIS B 62 ? 0.8154 0.6707 1.4106 -0.0191 0.2321 -0.2486 62 HIS B CD2 853 C CE1 . HIS B 62 ? 0.8025 0.6372 1.2766 -0.0135 0.1972 -0.2035 62 HIS B CE1 854 N NE2 . HIS B 62 ? 0.8032 0.6511 1.3525 -0.0117 0.1900 -0.2156 62 HIS B NE2 855 N N . ASP B 63 ? 0.8527 0.6426 1.2025 -0.0934 0.4101 -0.3015 63 ASP B N 856 C CA . ASP B 63 ? 0.8982 0.6609 1.1862 -0.1195 0.4531 -0.3188 63 ASP B CA 857 C C . ASP B 63 ? 0.9537 0.6910 1.1412 -0.1202 0.4346 -0.2901 63 ASP B C 858 O O . ASP B 63 ? 0.9449 0.6716 1.0709 -0.1194 0.4171 -0.2638 63 ASP B O 859 C CB . ASP B 63 ? 0.9521 0.7037 1.2141 -0.1422 0.4877 -0.3312 63 ASP B CB 860 C CG . ASP B 63 ? 1.1380 0.8615 1.3587 -0.1762 0.5413 -0.3610 63 ASP B CG 861 O OD1 . ASP B 63 ? 1.1745 0.8701 1.3207 -0.1878 0.5453 -0.3550 63 ASP B OD1 862 O OD2 . ASP B 63 ? 1.2348 0.9613 1.4920 -0.1941 0.5798 -0.3903 63 ASP B OD2 863 N N . TRP B 64 ? 0.9205 0.6485 1.0984 -0.1215 0.4379 -0.2967 64 TRP B N 864 C CA . TRP B 64 ? 0.9281 0.6330 1.0224 -0.1217 0.4192 -0.2727 64 TRP B CA 865 C C . TRP B 64 ? 1.0262 0.6930 1.0163 -0.1463 0.4335 -0.2637 64 TRP B C 866 O O . TRP B 64 ? 1.0207 0.6718 0.9488 -0.1418 0.4060 -0.2361 64 TRP B O 867 C CB . TRP B 64 ? 0.9166 0.6199 1.0300 -0.1193 0.4221 -0.2854 64 TRP B CB 868 C CG . TRP B 64 ? 0.9797 0.6647 1.0861 -0.1464 0.4705 -0.3212 64 TRP B CG 869 C CD1 . TRP B 64 ? 1.0231 0.7236 1.2128 -0.1534 0.5045 -0.3596 64 TRP B CD1 870 C CD2 . TRP B 64 ? 1.0348 0.6805 1.0469 -0.1727 0.4905 -0.3239 64 TRP B CD2 871 N NE1 . TRP B 64 ? 1.0749 0.7487 1.2255 -0.1842 0.5500 -0.3887 64 TRP B NE1 872 C CE2 . TRP B 64 ? 1.1274 0.7650 1.1630 -0.1976 0.5410 -0.3661 64 TRP B CE2 873 C CE3 . TRP B 64 ? 1.0739 0.6881 0.9854 -0.1792 0.4694 -0.2958 64 TRP B CE3 874 C CZ2 . TRP B 64 ? 1.1890 0.7849 1.1391 -0.2316 0.5720 -0.3799 64 TRP B CZ2 875 C CZ3 . TRP B 64 ? 1.1607 0.7333 0.9916 -0.2106 0.4943 -0.3069 64 TRP B CZ3 876 C CH2 . TRP B 64 ? 1.2155 0.7777 1.0598 -0.2378 0.5455 -0.3480 64 TRP B CH2 877 N N . THR B 65 ? 1.0282 0.6781 1.0013 -0.1736 0.4748 -0.2870 65 THR B N 878 C CA . THR B 65 ? 1.0856 0.6915 0.9551 -0.2026 0.4879 -0.2785 65 THR B CA 879 C C . THR B 65 ? 1.1192 0.7253 0.9684 -0.1974 0.4686 -0.2548 65 THR B C 880 O O . THR B 65 ? 1.1591 0.7272 0.9240 -0.2178 0.4680 -0.2407 65 THR B O 881 C CB . THR B 65 ? 1.2510 0.8324 1.1008 -0.2401 0.5437 -0.3149 65 THR B CB 882 O OG1 . THR B 65 ? 1.2281 0.8362 1.1560 -0.2403 0.5697 -0.3390 65 THR B OG1 883 C CG2 . THR B 65 ? 1.2556 0.8306 1.1147 -0.2499 0.5661 -0.3404 65 THR B CG2 884 N N . LYS B 66 ? 1.0166 0.6622 0.9418 -0.1717 0.4505 -0.2500 66 LYS B N 885 C CA . LYS B 66 ? 0.9968 0.6475 0.9148 -0.1654 0.4337 -0.2310 66 LYS B CA 886 C C . LYS B 66 ? 0.9990 0.6666 0.9223 -0.1379 0.3873 -0.2007 66 LYS B C 887 O O . LYS B 66 ? 0.9629 0.6463 0.9136 -0.1203 0.3675 -0.1959 66 LYS B O 888 C CB . LYS B 66 ? 1.0127 0.6891 1.0042 -0.1657 0.4555 -0.2526 66 LYS B CB 889 C CG . LYS B 66 ? 1.2458 0.9039 1.2313 -0.1977 0.5078 -0.2858 66 LYS B CG 890 C CD . LYS B 66 ? 1.4255 1.0409 1.3168 -0.2272 0.5228 -0.2768 66 LYS B CD 891 C CE . LYS B 66 ? 1.6265 1.2132 1.4888 -0.2663 0.5772 -0.3096 66 LYS B CE 892 N NZ . LYS B 66 ? 1.7833 1.3405 1.5900 -0.2832 0.5882 -0.3165 66 LYS B NZ 893 N N . LEU B 67 ? 0.9544 0.6166 0.8510 -0.1367 0.3725 -0.1822 67 LEU B N 894 C CA . LEU B 67 ? 0.9146 0.5892 0.8116 -0.1165 0.3352 -0.1570 67 LEU B CA 895 C C . LEU B 67 ? 0.9478 0.6355 0.8673 -0.1139 0.3337 -0.1539 67 LEU B C 896 O O . LEU B 67 ? 0.9743 0.6447 0.8709 -0.1317 0.3546 -0.1602 67 LEU B O 897 C CB . LEU B 67 ? 0.9440 0.5851 0.7679 -0.1233 0.3180 -0.1372 67 LEU B CB 898 C CG . LEU B 67 ? 0.9719 0.6218 0.7958 -0.1054 0.2828 -0.1150 67 LEU B CG 899 C CD1 . LEU B 67 ? 0.9935 0.6203 0.7742 -0.1068 0.2657 -0.1036 67 LEU B CD1 900 C CD2 . LEU B 67 ? 1.0085 0.6498 0.8175 -0.1086 0.2748 -0.1037 67 LEU B CD2 901 N N . ARG B 68 ? 0.8602 0.5750 0.8180 -0.0943 0.3091 -0.1440 68 ARG B N 902 C CA . ARG B 68 ? 0.8378 0.5685 0.8221 -0.0899 0.3038 -0.1413 68 ARG B CA 903 C C . ARG B 68 ? 0.8782 0.6062 0.8361 -0.0819 0.2781 -0.1205 68 ARG B C 904 O O . ARG B 68 ? 0.8509 0.5887 0.8140 -0.0700 0.2577 -0.1118 68 ARG B O 905 C CB . ARG B 68 ? 0.8016 0.5640 0.8563 -0.0767 0.2956 -0.1503 68 ARG B CB 906 C CG . ARG B 68 ? 0.8909 0.6724 0.9841 -0.0724 0.2886 -0.1510 68 ARG B CG 907 C CD . ARG B 68 ? 0.9762 0.7799 1.1416 -0.0651 0.2839 -0.1646 68 ARG B CD 908 N NE . ARG B 68 ? 1.0423 0.8598 1.2290 -0.0523 0.2496 -0.1521 68 ARG B NE 909 C CZ . ARG B 68 ? 1.2016 1.0353 1.4497 -0.0469 0.2342 -0.1582 68 ARG B CZ 910 N NH1 . ARG B 68 ? 1.0443 0.8875 1.3493 -0.0506 0.2514 -0.1786 68 ARG B NH1 911 N NH2 . ARG B 68 ? 1.0165 0.8545 1.2698 -0.0400 0.2007 -0.1444 68 ARG B NH2 912 N N . TYR B 69 ? 0.8546 0.5684 0.7878 -0.0899 0.2802 -0.1144 69 TYR B N 913 C CA . TYR B 69 ? 0.8438 0.5545 0.7623 -0.0838 0.2587 -0.0989 69 TYR B CA 914 C C . TYR B 69 ? 0.8858 0.6064 0.8243 -0.0848 0.2613 -0.1003 69 TYR B C 915 O O . TYR B 69 ? 0.8925 0.6107 0.8383 -0.0947 0.2810 -0.1102 69 TYR B O 916 C CB . TYR B 69 ? 0.8966 0.5710 0.7611 -0.0934 0.2519 -0.0873 69 TYR B CB 917 C CG . TYR B 69 ? 0.9649 0.6091 0.7943 -0.1129 0.2665 -0.0875 69 TYR B CG 918 C CD1 . TYR B 69 ? 1.0001 0.6310 0.8198 -0.1160 0.2560 -0.0775 69 TYR B CD1 919 C CD2 . TYR B 69 ? 1.0122 0.6390 0.8183 -0.1306 0.2925 -0.0993 69 TYR B CD2 920 C CE1 . TYR B 69 ? 1.0581 0.6568 0.8410 -0.1364 0.2679 -0.0761 69 TYR B CE1 921 C CE2 . TYR B 69 ? 1.0732 0.6680 0.8396 -0.1535 0.3089 -0.1003 69 TYR B CE2 922 C CZ . TYR B 69 ? 1.1795 0.7591 0.9321 -0.1564 0.2950 -0.0871 69 TYR B CZ 923 O OH . TYR B 69 ? 1.2490 0.7925 0.9576 -0.1813 0.3094 -0.0863 69 TYR B OH 924 N N . MET B 70 ? 0.8265 0.5570 0.7743 -0.0765 0.2439 -0.0926 70 MET B N 925 C CA . MET B 70 ? 0.8181 0.5572 0.7838 -0.0778 0.2453 -0.0942 70 MET B CA 926 C C . MET B 70 ? 0.9061 0.6164 0.8416 -0.0883 0.2477 -0.0875 70 MET B C 927 O O . MET B 70 ? 0.9081 0.6018 0.8255 -0.0869 0.2320 -0.0773 70 MET B O 928 C CB . MET B 70 ? 0.8183 0.5775 0.8045 -0.0686 0.2293 -0.0922 70 MET B CB 929 C CG . MET B 70 ? 0.8568 0.6254 0.8617 -0.0708 0.2309 -0.0957 70 MET B CG 930 S SD . MET B 70 ? 0.9054 0.6902 0.9426 -0.0744 0.2434 -0.1070 70 MET B SD 931 C CE . MET B 70 ? 0.8404 0.6483 0.9016 -0.0678 0.2260 -0.1086 70 MET B CE 932 N N . ASP B 71 ? 0.8915 0.5938 0.8245 -0.0999 0.2659 -0.0937 71 ASP B N 933 C CA . ASP B 71 ? 0.9311 0.6008 0.8308 -0.1140 0.2685 -0.0866 71 ASP B CA 934 C C . ASP B 71 ? 0.9721 0.6535 0.8986 -0.1125 0.2681 -0.0884 71 ASP B C 935 O O . ASP B 71 ? 0.9669 0.6577 0.9110 -0.1188 0.2864 -0.0988 71 ASP B O 936 C CB . ASP B 71 ? 0.9989 0.6439 0.8659 -0.1341 0.2934 -0.0932 71 ASP B CB 937 C CG . ASP B 71 ? 1.1828 0.7822 0.9974 -0.1545 0.2935 -0.0826 71 ASP B CG 938 O OD1 . ASP B 71 ? 1.2166 0.7853 0.9930 -0.1574 0.2718 -0.0670 71 ASP B OD1 939 O OD2 . ASP B 71 ? 1.2777 0.8690 1.0890 -0.1691 0.3139 -0.0897 71 ASP B OD2 940 N N . ASN B 72 ? 0.9214 0.6034 0.8569 -0.1045 0.2483 -0.0806 72 ASN B N 941 C CA . ASN B 72 ? 0.9101 0.6009 0.8711 -0.1031 0.2457 -0.0826 72 ASN B CA 942 C C . ASN B 72 ? 0.9392 0.6587 0.9332 -0.1026 0.2606 -0.0957 72 ASN B C 943 O O . ASN B 72 ? 0.9506 0.6621 0.9441 -0.1130 0.2749 -0.0994 72 ASN B O 944 C CB . ASN B 72 ? 0.9703 0.6231 0.9042 -0.1158 0.2417 -0.0726 72 ASN B CB 945 C CG . ASN B 72 ? 1.3253 0.9424 1.2263 -0.1189 0.2207 -0.0577 72 ASN B CG 946 O OD1 . ASN B 72 ? 1.3082 0.8840 1.1657 -0.1354 0.2185 -0.0474 72 ASN B OD1 947 N ND2 . ASN B 72 ? 1.2071 0.8356 1.1266 -0.1056 0.2034 -0.0561 72 ASN B ND2 948 N N . HIS B 73 ? 0.8639 0.6136 0.8852 -0.0924 0.2555 -0.1021 73 HIS B N 949 C CA . HIS B 73 ? 0.8422 0.6187 0.8979 -0.0908 0.2597 -0.1127 73 HIS B CA 950 C C . HIS B 73 ? 0.8827 0.6702 0.9550 -0.0905 0.2680 -0.1204 73 HIS B C 951 O O . HIS B 73 ? 0.8588 0.6676 0.9597 -0.0853 0.2588 -0.1252 73 HIS B O 952 C CB . HIS B 73 ? 0.8566 0.6353 0.9290 -0.0967 0.2664 -0.1177 73 HIS B CB 953 C CG . HIS B 73 ? 0.8795 0.6815 0.9784 -0.0933 0.2569 -0.1239 73 HIS B CG 954 N ND1 . HIS B 73 ? 0.8912 0.7128 1.0168 -0.0922 0.2537 -0.1310 73 HIS B ND1 955 C CD2 . HIS B 73 ? 0.8964 0.7014 0.9981 -0.0931 0.2495 -0.1247 73 HIS B CD2 956 C CE1 . HIS B 73 ? 0.8758 0.7084 1.0098 -0.0933 0.2429 -0.1338 73 HIS B CE1 957 N NE2 . HIS B 73 ? 0.8823 0.7066 1.0021 -0.0945 0.2431 -0.1319 73 HIS B NE2 958 N N . MET B 74 ? 0.8573 0.6280 0.9127 -0.0980 0.2843 -0.1223 74 MET B N 959 C CA . MET B 74 ? 0.8520 0.6330 0.9320 -0.0987 0.2962 -0.1341 74 MET B CA 960 C C . MET B 74 ? 0.9029 0.6692 0.9544 -0.0995 0.2995 -0.1314 74 MET B C 961 O O . MET B 74 ? 0.9239 0.6620 0.9287 -0.1078 0.3031 -0.1231 74 MET B O 962 C CB . MET B 74 ? 0.9011 0.6798 1.0005 -0.1115 0.3219 -0.1483 74 MET B CB 963 C CG . MET B 74 ? 0.9288 0.7314 1.0777 -0.1082 0.3176 -0.1564 74 MET B CG 964 S SD . MET B 74 ? 0.9585 0.7914 1.1747 -0.0979 0.3057 -0.1686 74 MET B SD 965 C CE . MET B 74 ? 0.8932 0.7378 1.1044 -0.0872 0.2696 -0.1546 74 MET B CE 966 N N . PRO B 75 ? 0.8371 0.6188 0.9157 -0.0923 0.2963 -0.1379 75 PRO B N 967 C CA . PRO B 75 ? 0.8453 0.6130 0.8974 -0.0936 0.3006 -0.1367 75 PRO B CA 968 C C . PRO B 75 ? 0.9214 0.6675 0.9536 -0.1115 0.3312 -0.1484 75 PRO B C 969 O O . PRO B 75 ? 0.9214 0.6738 0.9841 -0.1202 0.3524 -0.1642 75 PRO B O 970 C CB . PRO B 75 ? 0.8434 0.6341 0.9392 -0.0818 0.2885 -0.1422 75 PRO B CB 971 C CG . PRO B 75 ? 0.8764 0.6882 1.0081 -0.0747 0.2703 -0.1408 75 PRO B CG 972 C CD . PRO B 75 ? 0.8300 0.6392 0.9645 -0.0833 0.2847 -0.1456 75 PRO B CD 973 N N . ALA B 76 ? 0.9008 0.6193 0.8801 -0.1194 0.3340 -0.1417 76 ALA B N 974 C CA . ALA B 76 ? 0.9455 0.6344 0.8875 -0.1422 0.3632 -0.1519 76 ALA B CA 975 C C . ALA B 76 ? 1.0006 0.6801 0.9244 -0.1442 0.3674 -0.1561 76 ALA B C 976 O O . ALA B 76 ? 0.9694 0.6577 0.8943 -0.1282 0.3431 -0.1448 76 ALA B O 977 C CB . ALA B 76 ? 0.9970 0.6468 0.8737 -0.1585 0.3610 -0.1370 76 ALA B CB 978 N N . ASP B 77 ? 0.9945 0.6552 0.9013 -0.1660 0.4008 -0.1744 77 ASP B N 979 C CA . ASP B 77 ? 1.0102 0.6588 0.8977 -0.1724 0.4110 -0.1828 77 ASP B CA 980 C C . ASP B 77 ? 1.1041 0.7050 0.8995 -0.1901 0.4042 -0.1664 77 ASP B C 981 O O . ASP B 77 ? 1.1439 0.7105 0.8852 -0.2108 0.4098 -0.1589 77 ASP B O 982 C CB . ASP B 77 ? 1.0568 0.7095 0.9783 -0.1896 0.4540 -0.2160 77 ASP B CB 983 C CG . ASP B 77 ? 1.1319 0.8306 1.1559 -0.1698 0.4538 -0.2338 77 ASP B CG 984 O OD1 . ASP B 77 ? 1.1261 0.8426 1.1986 -0.1698 0.4635 -0.2446 77 ASP B OD1 985 O OD2 . ASP B 77 ? 1.1843 0.8986 1.2413 -0.1557 0.4429 -0.2374 77 ASP B OD2 986 N N . ALA B 78 ? 1.0528 0.6490 0.8311 -0.1832 0.3898 -0.1605 78 ALA B N 987 C CA . ALA B 78 ? 1.0975 0.6488 0.7944 -0.1983 0.3775 -0.1451 78 ALA B CA 988 C C . ALA B 78 ? 1.1536 0.7004 0.8430 -0.2037 0.3908 -0.1590 78 ALA B C 989 O O . ALA B 78 ? 1.1066 0.6900 0.8626 -0.1880 0.3994 -0.1752 78 ALA B O 990 C CB . ALA B 78 ? 1.0784 0.6315 0.7690 -0.1781 0.3337 -0.1179 78 ALA B CB 991 N N . GLU B 79 ? 1.1679 0.6671 0.7763 -0.2271 0.3904 -0.1527 79 GLU B N 992 C CA . GLU B 79 ? 1.1864 0.6753 0.7775 -0.2364 0.4043 -0.1665 79 GLU B CA 993 C C . GLU B 79 ? 1.1848 0.6906 0.7939 -0.2100 0.3695 -0.1517 79 GLU B C 994 O O . GLU B 79 ? 1.1644 0.6644 0.7579 -0.1975 0.3326 -0.1265 79 GLU B O 995 C CB . GLU B 79 ? 1.3001 0.7253 0.7882 -0.2779 0.4194 -0.1672 79 GLU B CB 996 C CG . GLU B 79 ? 1.4877 0.8926 0.9534 -0.3119 0.4664 -0.1905 79 GLU B CG 997 C CD . GLU B 79 ? 1.7404 1.1784 1.2756 -0.3143 0.5137 -0.2302 79 GLU B CD 998 O OE1 . GLU B 79 ? 1.6916 1.1323 1.2345 -0.3161 0.5259 -0.2462 79 GLU B OE1 999 O OE2 . GLU B 79 ? 1.6541 1.1148 1.2408 -0.3151 0.5383 -0.2466 79 GLU B OE2 1000 N N . ARG B 80 ? 1.1178 0.6437 0.7638 -0.2029 0.3826 -0.1695 80 ARG B N 1001 C CA . ARG B 80 ? 1.0773 0.6184 0.7413 -0.1809 0.3553 -0.1593 80 ARG B CA 1002 C C . ARG B 80 ? 1.1742 0.6694 0.7561 -0.1970 0.3380 -0.1449 80 ARG B C 1003 O O . ARG B 80 ? 1.1436 0.6428 0.7262 -0.1796 0.3033 -0.1257 80 ARG B O 1004 C CB . ARG B 80 ? 1.0527 0.6244 0.7820 -0.1715 0.3753 -0.1839 80 ARG B CB 1005 C CG . ARG B 80 ? 1.1704 0.7458 0.9029 -0.1592 0.3575 -0.1796 80 ARG B CG 1006 C CD . ARG B 80 ? 1.2361 0.8381 1.0012 -0.1295 0.3184 -0.1571 80 ARG B CD 1007 N NE . ARG B 80 ? 1.3355 0.9367 1.0972 -0.1210 0.3029 -0.1529 80 ARG B NE 1008 C CZ . ARG B 80 ? 1.5404 1.1144 1.2462 -0.1262 0.2830 -0.1375 80 ARG B CZ 1009 N NH1 . ARG B 80 ? 1.4162 0.9587 1.0646 -0.1401 0.2730 -0.1236 80 ARG B NH1 1010 N NH2 . ARG B 80 ? 1.3641 0.9404 1.0741 -0.1180 0.2706 -0.1358 80 ARG B NH2 1011 N N . ALA B 81 ? 1.2050 0.6544 0.7156 -0.2326 0.3621 -0.1548 81 ALA B N 1012 C CA . ALA B 81 ? 1.2685 0.6643 0.6893 -0.2552 0.3453 -0.1417 81 ALA B CA 1013 C C . ALA B 81 ? 1.3209 0.6924 0.7059 -0.2506 0.2992 -0.1084 81 ALA B C 1014 O O . ALA B 81 ? 1.3386 0.6832 0.6844 -0.2523 0.2676 -0.0921 81 ALA B O 1015 C CB . ALA B 81 ? 1.3688 0.7161 0.7142 -0.3002 0.3835 -0.1600 81 ALA B CB 1016 N N . GLY B 82 ? 1.2546 0.6368 0.6609 -0.2442 0.2950 -0.1003 82 GLY B N 1017 C CA . GLY B 82 ? 1.2553 0.6189 0.6448 -0.2383 0.2538 -0.0724 82 GLY B CA 1018 C C . GLY B 82 ? 1.2285 0.6309 0.6821 -0.2019 0.2199 -0.0597 82 GLY B C 1019 O O . GLY B 82 ? 1.2292 0.6145 0.6748 -0.1968 0.1829 -0.0390 82 GLY B O 1020 N N . LEU B 83 ? 1.1172 0.5699 0.6370 -0.1781 0.2320 -0.0730 83 LEU B N 1021 C CA . LEU B 83 ? 1.0488 0.5382 0.6261 -0.1477 0.2063 -0.0644 83 LEU B CA 1022 C C . LEU B 83 ? 1.1119 0.5804 0.6640 -0.1469 0.1788 -0.0539 83 LEU B C 1023 O O . LEU B 83 ? 1.1391 0.5897 0.6577 -0.1596 0.1893 -0.0618 83 LEU B O 1024 C CB . LEU B 83 ? 0.9890 0.5290 0.6336 -0.1283 0.2256 -0.0803 83 LEU B CB 1025 C CG . LEU B 83 ? 0.9881 0.5641 0.6857 -0.1018 0.2043 -0.0736 83 LEU B CG 1026 C CD1 . LEU B 83 ? 0.9554 0.5531 0.6879 -0.0902 0.1960 -0.0674 83 LEU B CD1 1027 C CD2 . LEU B 83 ? 0.9856 0.5923 0.7257 -0.0907 0.2179 -0.0871 83 LEU B CD2 1028 N N . PHE B 84 ? 1.0458 0.5166 0.6181 -0.1330 0.1445 -0.0381 84 PHE B N 1029 C CA . PHE B 84 ? 1.0557 0.5089 0.6166 -0.1303 0.1139 -0.0280 84 PHE B CA 1030 C C . PHE B 84 ? 1.0428 0.5330 0.6705 -0.1042 0.0952 -0.0250 84 PHE B C 1031 O O . PHE B 84 ? 1.0020 0.5162 0.6710 -0.0928 0.0949 -0.0245 84 PHE B O 1032 C CB . PHE B 84 ? 1.1503 0.5446 0.6496 -0.1517 0.0844 -0.0110 84 PHE B CB 1033 C CG . PHE B 84 ? 1.1688 0.5551 0.6864 -0.1480 0.0610 0.0023 84 PHE B CG 1034 C CD1 . PHE B 84 ? 1.1868 0.5779 0.7491 -0.1322 0.0244 0.0123 84 PHE B CD1 1035 C CD2 . PHE B 84 ? 1.2196 0.5919 0.7134 -0.1618 0.0759 0.0031 84 PHE B CD2 1036 C CE1 . PHE B 84 ? 1.1995 0.5831 0.7875 -0.1289 0.0030 0.0219 84 PHE B CE1 1037 C CE2 . PHE B 84 ? 1.2569 0.6200 0.7697 -0.1587 0.0531 0.0152 84 PHE B CE2 1038 C CZ . PHE B 84 ? 1.2108 0.5797 0.7723 -0.1418 0.0164 0.0242 84 PHE B CZ 1039 N N . VAL B 85 ? 0.9899 0.4831 0.6263 -0.0972 0.0817 -0.0247 85 VAL B N 1040 C CA . VAL B 85 ? 0.9389 0.4622 0.6335 -0.0770 0.0661 -0.0243 85 VAL B CA 1041 C C . VAL B 85 ? 1.0180 0.5102 0.6994 -0.0808 0.0311 -0.0143 85 VAL B C 1042 O O . VAL B 85 ? 1.0551 0.5176 0.6877 -0.0940 0.0272 -0.0124 85 VAL B O 1043 C CB . VAL B 85 ? 0.9419 0.5045 0.6698 -0.0642 0.0864 -0.0360 85 VAL B CB 1044 C CG1 . VAL B 85 ? 0.8982 0.4880 0.6792 -0.0487 0.0741 -0.0367 85 VAL B CG1 1045 C CG2 . VAL B 85 ? 0.9157 0.5031 0.6567 -0.0623 0.1151 -0.0450 85 VAL B CG2 1046 N N . ARG B 86 ? 0.9565 0.4538 0.6840 -0.0708 0.0055 -0.0095 86 ARG B N 1047 C CA . ARG B 86 ? 0.9819 0.4516 0.7139 -0.0724 -0.0329 -0.0009 86 ARG B CA 1048 C C . ARG B 86 ? 0.9858 0.4843 0.7989 -0.0553 -0.0471 -0.0067 86 ARG B C 1049 O O . ARG B 86 ? 0.9447 0.4712 0.8025 -0.0467 -0.0348 -0.0135 86 ARG B O 1050 C CB . ARG B 86 ? 1.0559 0.4687 0.7367 -0.0912 -0.0635 0.0156 86 ARG B CB 1051 C CG . ARG B 86 ? 1.1856 0.5950 0.8867 -0.0909 -0.0701 0.0209 86 ARG B CG 1052 C CD . ARG B 86 ? 1.3785 0.7253 1.0315 -0.1104 -0.1094 0.0402 86 ARG B CD 1053 N NE . ARG B 86 ? 1.4916 0.8194 1.1857 -0.1050 -0.1580 0.0483 86 ARG B NE 1054 C CZ . ARG B 86 ? 1.7153 1.0010 1.3695 -0.1173 -0.1905 0.0589 86 ARG B CZ 1055 N NH1 . ARG B 86 ? 1.5956 0.8522 1.1612 -0.1379 -0.1766 0.0618 86 ARG B NH1 1056 N NH2 . ARG B 86 ? 1.5559 0.8273 1.2615 -0.1105 -0.2371 0.0650 86 ARG B NH2 1057 N N . THR B 87 ? 0.9482 0.4387 0.7811 -0.0523 -0.0712 -0.0062 87 THR B N 1058 C CA . THR B 87 ? 0.9132 0.4270 0.8279 -0.0390 -0.0849 -0.0151 87 THR B CA 1059 C C . THR B 87 ? 1.0066 0.4796 0.9356 -0.0436 -0.1344 -0.0035 87 THR B C 1060 O O . THR B 87 ? 1.0171 0.4752 0.9598 -0.0456 -0.1500 0.0025 87 THR B O 1061 C CB . THR B 87 ? 0.9780 0.5210 0.9161 -0.0314 -0.0695 -0.0268 87 THR B CB 1062 O OG1 . THR B 87 ? 1.0007 0.5162 0.8871 -0.0394 -0.0815 -0.0192 87 THR B OG1 1063 C CG2 . THR B 87 ? 0.9157 0.4984 0.8553 -0.0266 -0.0274 -0.0374 87 THR B CG2 1064 N N . SER B 88 ? 0.9874 0.4385 0.9106 -0.0465 -0.1620 0.0009 88 SER B N 1065 C CA . SER B 88 ? 1.0380 0.4424 0.9681 -0.0533 -0.2169 0.0146 88 SER B CA 1066 C C . SER B 88 ? 1.1561 0.5033 0.9771 -0.0762 -0.2321 0.0342 88 SER B C 1067 O O . SER B 88 ? 1.2136 0.5082 1.0097 -0.0893 -0.2776 0.0516 88 SER B O 1068 C CB . SER B 88 ? 1.0737 0.4854 1.0596 -0.0454 -0.2390 0.0072 88 SER B CB 1069 O OG . SER B 88 ? 1.1850 0.5970 1.1187 -0.0500 -0.2232 0.0063 88 SER B OG 1070 N N . ALA B 89 ? 1.1050 0.4609 0.8620 -0.0830 -0.1931 0.0299 89 ALA B N 1071 C CA . ALA B 89 ? 1.1662 0.4762 0.8177 -0.1075 -0.1900 0.0402 89 ALA B CA 1072 C C . ALA B 89 ? 1.1796 0.5209 0.8018 -0.1077 -0.1332 0.0280 89 ALA B C 1073 O O . ALA B 89 ? 1.1038 0.4990 0.7850 -0.0883 -0.1046 0.0143 89 ALA B O 1074 C CB . ALA B 89 ? 1.2085 0.4951 0.8291 -0.1154 -0.2085 0.0419 89 ALA B CB 1075 N N . PRO B 90 ? 1.1865 0.4944 0.7222 -0.1309 -0.1158 0.0311 90 PRO B N 1076 C CA . PRO B 90 ? 1.1502 0.4906 0.6757 -0.1296 -0.0634 0.0166 90 PRO B CA 1077 C C . PRO B 90 ? 1.1471 0.5299 0.7031 -0.1153 -0.0355 0.0008 90 PRO B C 1078 O O . PRO B 90 ? 1.1550 0.5274 0.7022 -0.1169 -0.0488 0.0003 90 PRO B O 1079 C CB . PRO B 90 ? 1.2512 0.5399 0.6791 -0.1618 -0.0533 0.0202 90 PRO B CB 1080 C CG . PRO B 90 ? 1.3799 0.6085 0.7667 -0.1795 -0.1026 0.0413 90 PRO B CG 1081 C CD . PRO B 90 ? 1.3022 0.5389 0.7463 -0.1621 -0.1423 0.0464 90 PRO B CD 1082 N N . CYS B 91 ? 1.0477 0.4760 0.6403 -0.1022 0.0001 -0.0112 91 CYS B N 1083 C CA . CYS B 91 ? 0.9970 0.4650 0.6219 -0.0891 0.0255 -0.0247 91 CYS B CA 1084 C C . CYS B 91 ? 1.0704 0.5317 0.6536 -0.1022 0.0584 -0.0361 91 CYS B C 1085 O O . CYS B 91 ? 1.1043 0.5410 0.6428 -0.1198 0.0709 -0.0366 91 CYS B O 1086 C CB . CYS B 91 ? 0.9334 0.4498 0.6239 -0.0693 0.0389 -0.0300 91 CYS B CB 1087 S SG . CYS B 91 ? 0.9535 0.4841 0.7065 -0.0552 0.0099 -0.0251 91 CYS B SG 1088 N N . THR B 92 ? 1.0048 0.4885 0.6081 -0.0943 0.0738 -0.0471 92 THR B N 1089 C CA . THR B 92 ? 1.0163 0.5008 0.6012 -0.1036 0.1067 -0.0627 92 THR B CA 1090 C C . THR B 92 ? 1.0115 0.5408 0.6535 -0.0873 0.1292 -0.0715 92 THR B C 1091 O O . THR B 92 ? 0.9624 0.5217 0.6508 -0.0701 0.1243 -0.0713 92 THR B O 1092 C CB . THR B 92 ? 1.1334 0.6057 0.7011 -0.1085 0.1056 -0.0694 92 THR B CB 1093 O OG1 . THR B 92 ? 1.0901 0.5813 0.6982 -0.0909 0.0827 -0.0626 92 THR B OG1 1094 C CG2 . THR B 92 ? 1.1928 0.6102 0.6821 -0.1357 0.0953 -0.0663 92 THR B CG2 1095 N N . ILE B 93 ? 0.9741 0.5050 0.6112 -0.0946 0.1514 -0.0782 93 ILE B N 1096 C CA . ILE B 93 ? 0.9251 0.4941 0.6156 -0.0814 0.1690 -0.0860 93 ILE B CA 1097 C C . ILE B 93 ? 0.9667 0.5484 0.6813 -0.0800 0.1897 -0.1031 93 ILE B C 1098 O O . ILE B 93 ? 1.0022 0.5638 0.6891 -0.0969 0.2111 -0.1175 93 ILE B O 1099 C CB . ILE B 93 ? 0.9731 0.5403 0.6575 -0.0888 0.1828 -0.0873 93 ILE B CB 1100 C CG1 . ILE B 93 ? 0.9868 0.5396 0.6530 -0.0896 0.1590 -0.0701 93 ILE B CG1 1101 C CG2 . ILE B 93 ? 0.9361 0.5418 0.6793 -0.0750 0.1960 -0.0948 93 ILE B CG2 1102 C CD1 . ILE B 93 ? 1.1175 0.6459 0.7470 -0.1069 0.1687 -0.0689 93 ILE B CD1 1103 N N . THR B 94 ? 0.8760 0.4878 0.6414 -0.0621 0.1829 -0.1023 94 THR B N 1104 C CA . THR B 94 ? 0.8618 0.4864 0.6620 -0.0577 0.1952 -0.1163 94 THR B CA 1105 C C . THR B 94 ? 0.8828 0.5316 0.7358 -0.0515 0.2092 -0.1265 94 THR B C 1106 O O . THR B 94 ? 0.8831 0.5367 0.7675 -0.0523 0.2244 -0.1435 94 THR B O 1107 C CB . THR B 94 ? 0.9445 0.5770 0.7603 -0.0463 0.1759 -0.1088 94 THR B CB 1108 O OG1 . THR B 94 ? 0.9052 0.5545 0.7381 -0.0352 0.1573 -0.0938 94 THR B OG1 1109 C CG2 . THR B 94 ? 0.9616 0.5676 0.7333 -0.0552 0.1675 -0.1068 94 THR B CG2 1110 N N . GLY B 95 ? 0.8116 0.4746 0.6783 -0.0457 0.2029 -0.1176 95 GLY B N 1111 C CA . GLY B 95 ? 0.7864 0.4707 0.7032 -0.0401 0.2102 -0.1249 95 GLY B CA 1112 C C . GLY B 95 ? 0.8168 0.5091 0.7316 -0.0390 0.2065 -0.1160 95 GLY B C 1113 O O . GLY B 95 ? 0.8023 0.4934 0.6955 -0.0360 0.1905 -0.1009 95 GLY B O 1114 N N . THR B 96 ? 0.7689 0.4698 0.7117 -0.0420 0.2225 -0.1276 96 THR B N 1115 C CA . THR B 96 ? 0.7535 0.4627 0.6994 -0.0419 0.2216 -0.1220 96 THR B CA 1116 C C . THR B 96 ? 0.7768 0.5069 0.7835 -0.0365 0.2247 -0.1317 96 THR B C 1117 O O . THR B 96 ? 0.7820 0.5141 0.8224 -0.0405 0.2433 -0.1512 96 THR B O 1118 C CB . THR B 96 ? 0.8913 0.5792 0.7923 -0.0575 0.2396 -0.1255 96 THR B CB 1119 O OG1 . THR B 96 ? 0.9242 0.5988 0.8206 -0.0713 0.2668 -0.1457 96 THR B OG1 1120 C CG2 . THR B 96 ? 0.8890 0.5556 0.7355 -0.0614 0.2246 -0.1096 96 THR B CG2 1121 N N . MET B 97 ? 0.7036 0.4480 0.7265 -0.0291 0.2063 -0.1198 97 MET B N 1122 C CA . MET B 97 ? 0.6847 0.4461 0.7624 -0.0245 0.2004 -0.1248 97 MET B CA 1123 C C . MET B 97 ? 0.7116 0.4802 0.7787 -0.0228 0.1840 -0.1100 97 MET B C 1124 O O . MET B 97 ? 0.6988 0.4666 0.7463 -0.0202 0.1651 -0.0958 97 MET B O 1125 C CB . MET B 97 ? 0.7076 0.4754 0.8336 -0.0168 0.1839 -0.1271 97 MET B CB 1126 C CG . MET B 97 ? 0.7475 0.5287 0.9421 -0.0131 0.1762 -0.1360 97 MET B CG 1127 S SD . MET B 97 ? 0.8122 0.5996 1.0509 -0.0202 0.2131 -0.1658 97 MET B SD 1128 C CE . MET B 97 ? 0.7868 0.5666 1.0437 -0.0226 0.2327 -0.1861 97 MET B CE 1129 N N . GLY B 98 ? 0.6615 0.4361 0.7413 -0.0263 0.1942 -0.1158 98 GLY B N 1130 C CA . GLY B 98 ? 0.6451 0.4263 0.7173 -0.0265 0.1829 -0.1056 98 GLY B CA 1131 C C . GLY B 98 ? 0.6854 0.4581 0.7070 -0.0290 0.1813 -0.0941 98 GLY B C 1132 O O . GLY B 98 ? 0.6911 0.4510 0.6828 -0.0334 0.1948 -0.0957 98 GLY B O 1133 N N . HIS B 99 ? 0.6283 0.4052 0.6409 -0.0281 0.1638 -0.0832 99 HIS B N 1134 C CA . HIS B 99 ? 0.6223 0.3942 0.6015 -0.0303 0.1620 -0.0759 99 HIS B CA 1135 C C . HIS B 99 ? 0.6715 0.4343 0.6307 -0.0284 0.1585 -0.0722 99 HIS B C 1136 O O . HIS B 99 ? 0.6661 0.4246 0.6071 -0.0297 0.1567 -0.0686 99 HIS B O 1137 C CB . HIS B 99 ? 0.6256 0.4047 0.6038 -0.0344 0.1499 -0.0706 99 HIS B CB 1138 C CG . HIS B 99 ? 0.6658 0.4524 0.6576 -0.0376 0.1522 -0.0735 99 HIS B CG 1139 N ND1 . HIS B 99 ? 0.6870 0.4728 0.6720 -0.0389 0.1648 -0.0766 99 HIS B ND1 1140 C CD2 . HIS B 99 ? 0.6888 0.4811 0.6995 -0.0405 0.1404 -0.0729 99 HIS B CD2 1141 C CE1 . HIS B 99 ? 0.6771 0.4709 0.6782 -0.0419 0.1635 -0.0790 99 HIS B CE1 1142 N NE2 . HIS B 99 ? 0.6831 0.4809 0.7001 -0.0431 0.1482 -0.0770 99 HIS B NE2 1143 N N . PHE B 100 ? 0.6286 0.3885 0.5972 -0.0253 0.1571 -0.0747 100 PHE B N 1144 C CA . PHE B 100 ? 0.6280 0.3798 0.5805 -0.0236 0.1523 -0.0715 100 PHE B CA 1145 C C . PHE B 100 ? 0.6898 0.4278 0.6266 -0.0244 0.1628 -0.0768 100 PHE B C 1146 O O . PHE B 100 ? 0.6930 0.4285 0.6405 -0.0264 0.1758 -0.0866 100 PHE B O 1147 C CB . PHE B 100 ? 0.6476 0.4028 0.6145 -0.0219 0.1377 -0.0674 100 PHE B CB 1148 C CG . PHE B 100 ? 0.6648 0.4245 0.6267 -0.0275 0.1258 -0.0602 100 PHE B CG 1149 C CD1 . PHE B 100 ? 0.7052 0.4622 0.6454 -0.0326 0.1233 -0.0563 100 PHE B CD1 1150 C CD2 . PHE B 100 ? 0.6922 0.4571 0.6711 -0.0303 0.1182 -0.0592 100 PHE B CD2 1151 C CE1 . PHE B 100 ? 0.7226 0.4804 0.6519 -0.0430 0.1174 -0.0529 100 PHE B CE1 1152 C CE2 . PHE B 100 ? 0.7351 0.4989 0.6991 -0.0401 0.1078 -0.0530 100 PHE B CE2 1153 C CZ . PHE B 100 ? 0.7160 0.4755 0.6523 -0.0478 0.1093 -0.0506 100 PHE B CZ 1154 N N . ILE B 101 ? 0.6526 0.3800 0.5647 -0.0248 0.1573 -0.0717 101 ILE B N 1155 C CA . ILE B 101 ? 0.6725 0.3806 0.5590 -0.0284 0.1613 -0.0739 101 ILE B CA 1156 C C . ILE B 101 ? 0.7186 0.4247 0.6027 -0.0247 0.1498 -0.0704 101 ILE B C 1157 O O . ILE B 101 ? 0.7007 0.4136 0.5900 -0.0222 0.1393 -0.0647 101 ILE B O 1158 C CB . ILE B 101 ? 0.7309 0.4213 0.5879 -0.0346 0.1597 -0.0694 101 ILE B CB 1159 C CG1 . ILE B 101 ? 0.7400 0.4315 0.5981 -0.0393 0.1708 -0.0719 101 ILE B CG1 1160 C CG2 . ILE B 101 ? 0.7752 0.4377 0.5952 -0.0429 0.1597 -0.0698 101 ILE B CG2 1161 C CD1 . ILE B 101 ? 0.8314 0.5164 0.6809 -0.0408 0.1617 -0.0644 101 ILE B CD1 1162 N N . LEU B 102 ? 0.6897 0.3855 0.5664 -0.0262 0.1545 -0.0760 102 LEU B N 1163 C CA . LEU B 102 ? 0.6883 0.3792 0.5606 -0.0237 0.1447 -0.0737 102 LEU B CA 1164 C C . LEU B 102 ? 0.7673 0.4337 0.6027 -0.0308 0.1424 -0.0730 102 LEU B C 1165 O O . LEU B 102 ? 0.7883 0.4381 0.6003 -0.0401 0.1549 -0.0795 102 LEU B O 1166 C CB . LEU B 102 ? 0.6875 0.3828 0.5813 -0.0209 0.1491 -0.0811 102 LEU B CB 1167 C CG . LEU B 102 ? 0.7273 0.4397 0.6576 -0.0153 0.1425 -0.0791 102 LEU B CG 1168 C CD1 . LEU B 102 ? 0.7310 0.4423 0.6841 -0.0121 0.1399 -0.0843 102 LEU B CD1 1169 C CD2 . LEU B 102 ? 0.7465 0.4661 0.6734 -0.0148 0.1286 -0.0677 102 LEU B CD2 1170 N N . ALA B 103 ? 0.7260 0.3872 0.5557 -0.0289 0.1260 -0.0659 103 ALA B N 1171 C CA . ALA B 103 ? 0.7585 0.3921 0.5547 -0.0362 0.1153 -0.0625 103 ALA B CA 1172 C C . ALA B 103 ? 0.8122 0.4419 0.6133 -0.0329 0.0985 -0.0596 103 ALA B C 1173 O O . ALA B 103 ? 0.7785 0.4274 0.6107 -0.0255 0.0934 -0.0585 103 ALA B O 1174 C CB . ALA B 103 ? 0.7788 0.4017 0.5650 -0.0401 0.1068 -0.0558 103 ALA B CB 1175 N N . ARG B 104 ? 0.8095 0.4119 0.5770 -0.0411 0.0909 -0.0593 104 ARG B N 1176 C CA . ARG B 104 ? 0.8174 0.4103 0.5860 -0.0398 0.0718 -0.0566 104 ARG B CA 1177 C C . ARG B 104 ? 0.8981 0.4657 0.6508 -0.0457 0.0477 -0.0477 104 ARG B C 1178 O O . ARG B 104 ? 0.9367 0.4722 0.6423 -0.0594 0.0440 -0.0442 104 ARG B O 1179 C CB . ARG B 104 ? 0.8511 0.4279 0.5925 -0.0466 0.0776 -0.0629 104 ARG B CB 1180 C CG . ARG B 104 ? 0.9626 0.5634 0.7326 -0.0388 0.0943 -0.0711 104 ARG B CG 1181 C CD . ARG B 104 ? 1.1118 0.6993 0.8674 -0.0431 0.0954 -0.0779 104 ARG B CD 1182 N NE . ARG B 104 ? 1.2231 0.8078 0.9870 -0.0393 0.0745 -0.0727 104 ARG B NE 1183 C CZ . ARG B 104 ? 1.3730 0.9784 1.1728 -0.0298 0.0722 -0.0725 104 ARG B CZ 1184 N NH1 . ARG B 104 ? 1.1847 0.8118 1.0110 -0.0236 0.0852 -0.0747 104 ARG B NH1 1185 N NH2 . ARG B 104 ? 1.2076 0.8097 1.0169 -0.0282 0.0554 -0.0700 104 ARG B NH2 1186 N N . CYS B 105 ? 0.8358 0.4163 0.6299 -0.0374 0.0319 -0.0451 105 CYS B N 1187 C CA . CYS B 105 ? 0.8561 0.4167 0.6562 -0.0399 0.0048 -0.0377 105 CYS B CA 1188 C C . CYS B 105 ? 0.9098 0.4589 0.7312 -0.0383 -0.0236 -0.0362 105 CYS B C 1189 O O . CYS B 105 ? 0.8752 0.4480 0.7338 -0.0304 -0.0182 -0.0436 105 CYS B O 1190 C CB . CYS B 105 ? 0.8318 0.4157 0.6741 -0.0328 0.0101 -0.0396 105 CYS B CB 1191 S SG . CYS B 105 ? 0.8816 0.4692 0.6976 -0.0370 0.0335 -0.0386 105 CYS B SG 1192 N N . PRO B 106 ? 0.9059 0.4177 0.7092 -0.0464 -0.0567 -0.0265 106 PRO B N 1193 C CA . PRO B 106 ? 0.9121 0.4138 0.7491 -0.0437 -0.0889 -0.0256 106 PRO B CA 1194 C C . PRO B 106 ? 0.9213 0.4501 0.8412 -0.0317 -0.0957 -0.0329 106 PRO B C 1195 O O . PRO B 106 ? 0.8890 0.4390 0.8289 -0.0276 -0.0771 -0.0368 106 PRO B O 1196 C CB . PRO B 106 ? 1.0032 0.4500 0.7867 -0.0594 -0.1250 -0.0109 106 PRO B CB 1197 C CG . PRO B 106 ? 1.0759 0.5102 0.8242 -0.0672 -0.1152 -0.0045 106 PRO B CG 1198 C CD . PRO B 106 ? 0.9726 0.4469 0.7255 -0.0601 -0.0689 -0.0152 106 PRO B CD 1199 N N . LYS B 107 ? 0.8763 0.4047 0.8480 -0.0273 -0.1206 -0.0373 107 LYS B N 1200 C CA . LYS B 107 ? 0.8435 0.3969 0.9053 -0.0181 -0.1256 -0.0498 107 LYS B CA 1201 C C . LYS B 107 ? 0.9030 0.4452 0.9858 -0.0181 -0.1413 -0.0452 107 LYS B C 1202 O O . LYS B 107 ? 0.9471 0.4473 0.9945 -0.0257 -0.1754 -0.0291 107 LYS B O 1203 C CB . LYS B 107 ? 0.8875 0.4319 0.9998 -0.0159 -0.1577 -0.0542 107 LYS B CB 1204 C CG . LYS B 107 ? 1.0295 0.6074 1.1806 -0.0112 -0.1336 -0.0707 107 LYS B CG 1205 C CD . LYS B 107 ? 1.1699 0.7345 1.3636 -0.0103 -0.1675 -0.0740 107 LYS B CD 1206 C CE . LYS B 107 ? 1.2783 0.8597 1.5809 -0.0042 -0.1808 -0.0913 107 LYS B CE 1207 N NZ . LYS B 107 ? 1.4105 0.9661 1.7400 -0.0034 -0.2195 -0.0829 107 LYS B NZ 1208 N N . GLY B 108 ? 0.8174 0.3938 0.9524 -0.0120 -0.1165 -0.0589 108 GLY B N 1209 C CA . GLY B 108 ? 0.8182 0.3894 0.9819 -0.0111 -0.1266 -0.0577 108 GLY B CA 1210 C C . GLY B 108 ? 0.8217 0.4322 1.0659 -0.0053 -0.1022 -0.0801 108 GLY B C 1211 O O . GLY B 108 ? 0.7844 0.4265 1.0549 -0.0044 -0.0728 -0.0967 108 GLY B O 1212 N N . GLU B 109 ? 0.7801 0.3856 1.0609 -0.0038 -0.1134 -0.0811 109 GLU B N 1213 C CA . GLU B 109 ? 0.7439 0.3829 1.1031 -0.0008 -0.0901 -0.1047 109 GLU B CA 1214 C C . GLU B 109 ? 0.7786 0.4255 1.1074 -0.0031 -0.0667 -0.1023 109 GLU B C 1215 O O . GLU B 109 ? 0.7463 0.4219 1.1231 -0.0038 -0.0393 -0.1225 109 GLU B O 1216 C CB . GLU B 109 ? 0.7728 0.4039 1.2329 0.0042 -0.1249 -0.1157 109 GLU B CB 1217 C CG . GLU B 109 ? 0.9126 0.5447 1.4258 0.0068 -0.1429 -0.1254 109 GLU B CG 1218 C CD . GLU B 109 ? 1.1486 0.8209 1.6939 0.0043 -0.0993 -0.1510 109 GLU B CD 1219 O OE1 . GLU B 109 ? 1.0540 0.7572 1.6422 0.0008 -0.0621 -0.1744 109 GLU B OE1 1220 O OE2 . GLU B 109 ? 1.0846 0.7546 1.6100 0.0036 -0.1026 -0.1482 109 GLU B OE2 1221 N N . THR B 110 ? 0.7571 0.3779 1.0050 -0.0066 -0.0752 -0.0795 110 THR B N 1222 C CA . THR B 110 ? 0.7488 0.3736 0.9603 -0.0095 -0.0552 -0.0748 110 THR B CA 1223 C C . THR B 110 ? 0.8018 0.4202 0.9225 -0.0145 -0.0380 -0.0610 110 THR B C 1224 O O . THR B 110 ? 0.8142 0.4156 0.8961 -0.0168 -0.0489 -0.0520 110 THR B O 1225 C CB . THR B 110 ? 0.8854 0.4785 1.1062 -0.0107 -0.0877 -0.0629 110 THR B CB 1226 O OG1 . THR B 110 ? 0.9334 0.4807 1.1078 -0.0161 -0.1270 -0.0415 110 THR B OG1 1227 C CG2 . THR B 110 ? 0.8564 0.4605 1.1803 -0.0048 -0.1002 -0.0804 110 THR B CG2 1228 N N . LEU B 111 ? 0.7431 0.3752 0.8358 -0.0166 -0.0112 -0.0612 111 LEU B N 1229 C CA . LEU B 111 ? 0.7456 0.3737 0.7667 -0.0211 0.0062 -0.0516 111 LEU B CA 1230 C C . LEU B 111 ? 0.8080 0.4242 0.8010 -0.0258 0.0100 -0.0439 111 LEU B C 1231 O O . LEU B 111 ? 0.7812 0.4169 0.8050 -0.0238 0.0234 -0.0522 111 LEU B O 1232 C CB . LEU B 111 ? 0.7118 0.3734 0.7313 -0.0195 0.0381 -0.0620 111 LEU B CB 1233 C CG . LEU B 111 ? 0.7769 0.4340 0.7389 -0.0222 0.0501 -0.0546 111 LEU B CG 1234 C CD1 . LEU B 111 ? 0.7633 0.4362 0.7307 -0.0202 0.0592 -0.0605 111 LEU B CD1 1235 C CD2 . LEU B 111 ? 0.7971 0.4655 0.7384 -0.0243 0.0716 -0.0544 111 LEU B CD2 1236 N N . THR B 112 ? 0.8054 0.3875 0.7383 -0.0345 -0.0006 -0.0295 112 THR B N 1237 C CA . THR B 112 ? 0.8263 0.3905 0.7240 -0.0427 0.0032 -0.0215 112 THR B CA 1238 C C . THR B 112 ? 0.8819 0.4476 0.7246 -0.0495 0.0303 -0.0212 112 THR B C 1239 O O . THR B 112 ? 0.8944 0.4467 0.7006 -0.0546 0.0308 -0.0190 112 THR B O 1240 C CB . THR B 112 ? 0.9816 0.4963 0.8570 -0.0525 -0.0342 -0.0059 112 THR B CB 1241 O OG1 . THR B 112 ? 0.9674 0.4837 0.9109 -0.0441 -0.0615 -0.0088 112 THR B OG1 1242 C CG2 . THR B 112 ? 0.9943 0.4856 0.8316 -0.0639 -0.0313 0.0030 112 THR B CG2 1243 N N . VAL B 113 ? 0.8249 0.4074 0.6680 -0.0499 0.0529 -0.0255 113 VAL B N 1244 C CA . VAL B 113 ? 0.8276 0.4139 0.6342 -0.0562 0.0793 -0.0284 113 VAL B CA 1245 C C . VAL B 113 ? 0.9097 0.4768 0.6933 -0.0666 0.0830 -0.0236 113 VAL B C 1246 O O . VAL B 113 ? 0.8866 0.4662 0.7026 -0.0618 0.0818 -0.0248 113 VAL B O 1247 C CB . VAL B 113 ? 0.8292 0.4575 0.6655 -0.0464 0.1026 -0.0398 113 VAL B CB 1248 C CG1 . VAL B 113 ? 0.8292 0.4622 0.6450 -0.0519 0.1266 -0.0445 113 VAL B CG1 1249 C CG2 . VAL B 113 ? 0.8115 0.4513 0.6589 -0.0401 0.0995 -0.0430 113 VAL B CG2 1250 N N . GLY B 114 ? 0.9182 0.4528 0.6447 -0.0831 0.0886 -0.0193 114 GLY B N 1251 C CA . GLY B 114 ? 0.9542 0.4638 0.6485 -0.0980 0.0942 -0.0147 114 GLY B CA 1252 C C . GLY B 114 ? 1.0365 0.5365 0.6877 -0.1139 0.1249 -0.0227 114 GLY B C 1253 O O . GLY B 114 ? 1.0237 0.5349 0.6705 -0.1132 0.1409 -0.0322 114 GLY B O 1254 N N . PHE B 115 ? 1.0315 0.5101 0.6547 -0.1293 0.1346 -0.0206 115 PHE B N 1255 C CA . PHE B 115 ? 1.0636 0.5304 0.6492 -0.1488 0.1682 -0.0316 115 PHE B CA 1256 C C . PHE B 115 ? 1.1764 0.6005 0.7132 -0.1724 0.1676 -0.0230 115 PHE B C 1257 O O . PHE B 115 ? 1.1755 0.5865 0.7202 -0.1690 0.1404 -0.0086 115 PHE B O 1258 C CB . PHE B 115 ? 1.0300 0.5476 0.6712 -0.1348 0.1981 -0.0493 115 PHE B CB 1259 C CG . PHE B 115 ? 1.0235 0.5612 0.6995 -0.1284 0.2026 -0.0499 115 PHE B CG 1260 C CD1 . PHE B 115 ? 1.0806 0.6150 0.7482 -0.1424 0.2301 -0.0598 115 PHE B CD1 1261 C CD2 . PHE B 115 ? 1.0103 0.5700 0.7291 -0.1101 0.1817 -0.0430 115 PHE B CD2 1262 C CE1 . PHE B 115 ? 1.0685 0.6210 0.7685 -0.1367 0.2332 -0.0604 115 PHE B CE1 1263 C CE2 . PHE B 115 ? 1.0243 0.6014 0.7733 -0.1058 0.1867 -0.0449 115 PHE B CE2 1264 C CZ . PHE B 115 ? 1.0170 0.5902 0.7556 -0.1183 0.2108 -0.0525 115 PHE B CZ 1265 N N . THR B 116 ? 1.1833 0.5854 0.6733 -0.1975 0.1992 -0.0337 116 THR B N 1266 C CA . THR B 116 ? 1.2468 0.6051 0.6813 -0.2259 0.2068 -0.0285 116 THR B CA 1267 C C . THR B 116 ? 1.2706 0.6621 0.7419 -0.2256 0.2472 -0.0482 116 THR B C 1268 O O . THR B 116 ? 1.2466 0.6643 0.7407 -0.2248 0.2797 -0.0697 116 THR B O 1269 C CB . THR B 116 ? 1.4432 0.7387 0.7820 -0.2625 0.2099 -0.0255 116 THR B CB 1270 O OG1 . THR B 116 ? 1.4577 0.7242 0.7722 -0.2598 0.1651 -0.0055 116 THR B OG1 1271 C CG2 . THR B 116 ? 1.5102 0.7522 0.7781 -0.2988 0.2199 -0.0202 116 THR B CG2 1272 N N . ASP B 117 ? 1.2260 0.6169 0.7099 -0.2256 0.2432 -0.0416 117 ASP B N 1273 C CA . ASP B 117 ? 1.1984 0.6198 0.7212 -0.2251 0.2770 -0.0589 117 ASP B CA 1274 C C . ASP B 117 ? 1.3188 0.7025 0.7836 -0.2625 0.3134 -0.0709 117 ASP B C 1275 O O . ASP B 117 ? 1.3788 0.7195 0.7746 -0.2892 0.3213 -0.0720 117 ASP B O 1276 C CB . ASP B 117 ? 1.1787 0.6235 0.7505 -0.2060 0.2588 -0.0498 117 ASP B CB 1277 C CG . ASP B 117 ? 1.3594 0.7576 0.8892 -0.2208 0.2340 -0.0294 117 ASP B CG 1278 O OD1 . ASP B 117 ? 1.4331 0.7877 0.9025 -0.2520 0.2493 -0.0285 117 ASP B OD1 1279 O OD2 . ASP B 117 ? 1.4074 0.8141 0.9709 -0.2023 0.2016 -0.0164 117 ASP B OD2 1280 N N . SER B 118 ? 1.2661 0.6649 0.7582 -0.2666 0.3373 -0.0816 118 SER B N 1281 C CA . SER B 118 ? 1.3285 0.6962 0.7758 -0.3030 0.3772 -0.0967 118 SER B CA 1282 C C . SER B 118 ? 1.4677 0.7620 0.8174 -0.3368 0.3602 -0.0747 118 SER B C 1283 O O . SER B 118 ? 1.5443 0.7886 0.8141 -0.3745 0.3803 -0.0800 118 SER B O 1284 C CB . SER B 118 ? 1.3331 0.7406 0.8468 -0.2946 0.4020 -0.1130 118 SER B CB 1285 O OG . SER B 118 ? 1.3662 0.8362 0.9696 -0.2639 0.4086 -0.1294 118 SER B OG 1286 N N . ARG B 119 ? 1.4133 0.6982 0.7690 -0.3251 0.3218 -0.0504 119 ARG B N 1287 C CA . ARG B 119 ? 1.4935 0.7082 0.7689 -0.3528 0.2937 -0.0249 119 ARG B CA 1288 C C . ARG B 119 ? 1.5768 0.7505 0.8051 -0.3540 0.2459 -0.0005 119 ARG B C 1289 O O . ARG B 119 ? 1.6118 0.7420 0.8103 -0.3603 0.2032 0.0257 119 ARG B O 1290 C CB . ARG B 119 ? 1.4680 0.6940 0.7860 -0.3382 0.2742 -0.0129 119 ARG B CB 1291 C CG . ARG B 119 ? 1.5873 0.8386 0.9366 -0.3447 0.3164 -0.0329 119 ARG B CG 1292 C CD . ARG B 119 ? 1.6934 0.9483 1.0757 -0.3333 0.2942 -0.0193 119 ARG B CD 1293 N NE . ARG B 119 ? 1.7024 1.0169 1.1756 -0.2897 0.2721 -0.0191 119 ARG B NE 1294 C CZ . ARG B 119 ? 1.8463 1.1737 1.3634 -0.2739 0.2515 -0.0106 119 ARG B CZ 1295 N NH1 . ARG B 119 ? 1.7395 1.0255 1.2224 -0.2952 0.2467 0.0004 119 ARG B NH1 1296 N NH2 . ARG B 119 ? 1.5935 0.9728 1.1865 -0.2391 0.2367 -0.0140 119 ARG B NH2 1297 N N . LYS B 120 ? 1.5173 0.7048 0.7452 -0.3475 0.2510 -0.0096 120 LYS B N 1298 C CA . LYS B 120 ? 1.5452 0.6992 0.7333 -0.3484 0.2106 0.0086 120 LYS B CA 1299 C C . LYS B 120 ? 1.5483 0.7135 0.7878 -0.3167 0.1543 0.0310 120 LYS B C 1300 O O . LYS B 120 ? 1.5825 0.7097 0.7860 -0.3219 0.1153 0.0485 120 LYS B O 1301 C CB . LYS B 120 ? 1.7044 0.7698 0.7669 -0.3994 0.2055 0.0208 120 LYS B CB 1302 C CG . LYS B 120 ? 1.9327 0.9819 0.9396 -0.4369 0.2662 -0.0060 120 LYS B CG 1303 C CD . LYS B 120 ? 2.0442 1.1125 1.0513 -0.4362 0.2915 -0.0273 120 LYS B CD 1304 C CE . LYS B 120 ? 2.2038 1.2774 1.1960 -0.4641 0.3594 -0.0630 120 LYS B CE 1305 N NZ . LYS B 120 ? 2.4480 1.4369 1.3122 -0.5248 0.3771 -0.0619 120 LYS B NZ 1306 N N . ILE B 121 ? 1.4246 0.6408 0.7496 -0.2856 0.1508 0.0283 121 ILE B N 1307 C CA . ILE B 121 ? 1.3762 0.6090 0.7626 -0.2565 0.1061 0.0425 121 ILE B CA 1308 C C . ILE B 121 ? 1.3531 0.6347 0.7944 -0.2273 0.1036 0.0328 121 ILE B C 1309 O O . ILE B 121 ? 1.2779 0.6173 0.7736 -0.2077 0.1335 0.0139 121 ILE B O 1310 C CB . ILE B 121 ? 1.3682 0.6332 0.8177 -0.2404 0.1103 0.0394 121 ILE B CB 1311 C CG1 . ILE B 121 ? 1.4435 0.6591 0.8374 -0.2710 0.1153 0.0485 121 ILE B CG1 1312 C CG2 . ILE B 121 ? 1.3260 0.6157 0.8516 -0.2105 0.0730 0.0465 121 ILE B CG2 1313 C CD1 . ILE B 121 ? 1.6284 0.7637 0.9583 -0.2954 0.0656 0.0783 121 ILE B CD1 1314 N N . SER B 122 ? 1.3309 0.5863 0.7571 -0.2260 0.0661 0.0464 122 SER B N 1315 C CA . SER B 122 ? 1.2711 0.5664 0.7437 -0.2015 0.0620 0.0385 122 SER B CA 1316 C C . SER B 122 ? 1.2332 0.5818 0.8016 -0.1679 0.0515 0.0334 122 SER B C 1317 O O . SER B 122 ? 1.2330 0.5677 0.8307 -0.1622 0.0180 0.0447 122 SER B O 1318 C CB . SER B 122 ? 1.3735 0.6218 0.8003 -0.2128 0.0249 0.0537 122 SER B CB 1319 O OG . SER B 122 ? 1.5278 0.7356 0.9569 -0.2158 -0.0249 0.0750 122 SER B OG 1320 N N . HIS B 123 ? 1.1151 0.5217 0.7319 -0.1483 0.0802 0.0153 123 HIS B N 1321 C CA . HIS B 123 ? 1.0391 0.4958 0.7367 -0.1215 0.0773 0.0070 123 HIS B CA 1322 C C . HIS B 123 ? 1.0470 0.5255 0.7689 -0.1071 0.0703 0.0024 123 HIS B C 1323 O O . HIS B 123 ? 1.0356 0.5245 0.7369 -0.1089 0.0902 -0.0049 123 HIS B O 1324 C CB . HIS B 123 ? 1.0018 0.5029 0.7308 -0.1138 0.1125 -0.0085 123 HIS B CB 1325 C CG . HIS B 123 ? 1.0690 0.5544 0.7818 -0.1267 0.1229 -0.0065 123 HIS B CG 1326 N ND1 . HIS B 123 ? 1.0892 0.5699 0.8317 -0.1227 0.1053 -0.0007 123 HIS B ND1 1327 C CD2 . HIS B 123 ? 1.1172 0.5923 0.7927 -0.1437 0.1510 -0.0120 123 HIS B CD2 1328 C CE1 . HIS B 123 ? 1.1075 0.5735 0.8246 -0.1374 0.1213 -0.0003 123 HIS B CE1 1329 N NE2 . HIS B 123 ? 1.1297 0.5921 0.8065 -0.1509 0.1500 -0.0077 123 HIS B NE2 1330 N N . SER B 124 ? 0.9780 0.4629 0.7480 -0.0938 0.0431 0.0049 124 SER B N 1331 C CA . SER B 124 ? 0.9442 0.4492 0.7429 -0.0811 0.0356 -0.0003 124 SER B CA 1332 C C . SER B 124 ? 0.9308 0.4758 0.8070 -0.0632 0.0352 -0.0121 124 SER B C 1333 O O . SER B 124 ? 0.9202 0.4670 0.8306 -0.0609 0.0290 -0.0135 124 SER B O 1334 C CB . SER B 124 ? 1.0394 0.5000 0.8107 -0.0892 -0.0007 0.0137 124 SER B CB 1335 O OG . SER B 124 ? 1.1733 0.6076 0.9710 -0.0898 -0.0362 0.0238 124 SER B OG 1336 N N . CYS B 125 ? 0.8448 0.4199 0.7470 -0.0529 0.0436 -0.0221 125 CYS B N 1337 C CA . CYS B 125 ? 0.7964 0.4069 0.7645 -0.0411 0.0484 -0.0365 125 CYS B CA 1338 C C . CYS B 125 ? 0.8351 0.4485 0.8282 -0.0353 0.0342 -0.0399 125 CYS B C 1339 O O . CYS B 125 ? 0.8240 0.4430 0.7911 -0.0351 0.0425 -0.0397 125 CYS B O 1340 C CB . CYS B 125 ? 0.7609 0.4093 0.7346 -0.0383 0.0809 -0.0484 125 CYS B CB 1341 S SG . CYS B 125 ? 0.7705 0.4558 0.8104 -0.0323 0.0924 -0.0682 125 CYS B SG 1342 N N . THR B 126 ? 0.7914 0.4006 0.8409 -0.0307 0.0122 -0.0441 126 THR B N 1343 C CA . THR B 126 ? 0.7838 0.3956 0.8713 -0.0254 -0.0035 -0.0498 126 THR B CA 1344 C C . THR B 126 ? 0.7886 0.4404 0.9429 -0.0198 0.0175 -0.0733 126 THR B C 1345 O O . THR B 126 ? 0.7721 0.4352 0.9736 -0.0189 0.0229 -0.0849 126 THR B O 1346 C CB . THR B 126 ? 0.9273 0.4989 1.0318 -0.0268 -0.0484 -0.0378 126 THR B CB 1347 O OG1 . THR B 126 ? 0.9691 0.4986 0.9949 -0.0383 -0.0634 -0.0163 126 THR B OG1 1348 C CG2 . THR B 126 ? 0.9081 0.4800 1.0553 -0.0214 -0.0686 -0.0433 126 THR B CG2 1349 N N . HIS B 127 ? 0.7254 0.3959 0.8806 -0.0185 0.0307 -0.0813 127 HIS B N 1350 C CA . HIS B 127 ? 0.6940 0.3974 0.8991 -0.0188 0.0539 -0.1042 127 HIS B CA 1351 C C . HIS B 127 ? 0.7436 0.4462 0.9883 -0.0158 0.0401 -0.1113 127 HIS B C 1352 O O . HIS B 127 ? 0.7513 0.4371 0.9587 -0.0143 0.0247 -0.0975 127 HIS B O 1353 C CB . HIS B 127 ? 0.6854 0.4099 0.8462 -0.0239 0.0851 -0.1066 127 HIS B CB 1354 C CG . HIS B 127 ? 0.7183 0.4566 0.8718 -0.0287 0.1060 -0.1120 127 HIS B CG 1355 N ND1 . HIS B 127 ? 0.7264 0.4883 0.8939 -0.0372 0.1325 -0.1297 127 HIS B ND1 1356 C CD2 . HIS B 127 ? 0.7475 0.4765 0.8779 -0.0285 0.1037 -0.1022 127 HIS B CD2 1357 C CE1 . HIS B 127 ? 0.7168 0.4833 0.8704 -0.0408 0.1430 -0.1295 127 HIS B CE1 1358 N NE2 . HIS B 127 ? 0.7308 0.4798 0.8652 -0.0346 0.1270 -0.1136 127 HIS B NE2 1359 N N . PRO B 128 ? 0.6883 0.4092 1.0103 -0.0163 0.0476 -0.1350 128 PRO B N 1360 C CA . PRO B 128 ? 0.6872 0.4094 1.0528 -0.0141 0.0363 -0.1441 128 PRO B CA 1361 C C . PRO B 128 ? 0.7243 0.4624 1.0506 -0.0196 0.0615 -0.1472 128 PRO B C 1362 O O . PRO B 128 ? 0.7054 0.4657 1.0272 -0.0289 0.0954 -0.1618 128 PRO B O 1363 C CB . PRO B 128 ? 0.7006 0.4396 1.1668 -0.0151 0.0428 -0.1729 128 PRO B CB 1364 C CG . PRO B 128 ? 0.7457 0.5008 1.2072 -0.0218 0.0723 -0.1836 128 PRO B CG 1365 C CD . PRO B 128 ? 0.6945 0.4362 1.0693 -0.0209 0.0698 -0.1577 128 PRO B CD 1366 N N . PHE B 129 ? 0.6910 0.4134 0.9814 -0.0159 0.0434 -0.1318 129 PHE B N 1367 C CA . PHE B 129 ? 0.6806 0.4130 0.9328 -0.0200 0.0614 -0.1315 129 PHE B CA 1368 C C . PHE B 129 ? 0.7384 0.4591 1.0052 -0.0159 0.0390 -0.1287 129 PHE B C 1369 O O . PHE B 129 ? 0.7538 0.4479 0.9902 -0.0112 0.0097 -0.1103 129 PHE B O 1370 C CB . PHE B 129 ? 0.7053 0.4318 0.8764 -0.0209 0.0697 -0.1130 129 PHE B CB 1371 C CG . PHE B 129 ? 0.7198 0.4528 0.8530 -0.0243 0.0832 -0.1103 129 PHE B CG 1372 C CD1 . PHE B 129 ? 0.7486 0.5008 0.8791 -0.0339 0.1106 -0.1216 129 PHE B CD1 1373 C CD2 . PHE B 129 ? 0.7587 0.4747 0.8554 -0.0201 0.0676 -0.0963 129 PHE B CD2 1374 C CE1 . PHE B 129 ? 0.7605 0.5141 0.8562 -0.0380 0.1185 -0.1170 129 PHE B CE1 1375 C CE2 . PHE B 129 ? 0.7900 0.5114 0.8580 -0.0225 0.0787 -0.0944 129 PHE B CE2 1376 C CZ . PHE B 129 ? 0.7547 0.4944 0.8239 -0.0308 0.1023 -0.1037 129 PHE B CZ 1377 N N . HIS B 130 ? 0.6841 0.4227 0.9934 -0.0203 0.0541 -0.1477 130 HIS B N 1378 C CA . HIS B 130 ? 0.6894 0.4206 1.0198 -0.0172 0.0357 -0.1481 130 HIS B CA 1379 C C . HIS B 130 ? 0.7429 0.4668 0.9992 -0.0179 0.0392 -0.1320 130 HIS B C 1380 O O . HIS B 130 ? 0.7263 0.4654 0.9587 -0.0254 0.0672 -0.1373 130 HIS B O 1381 C CB . HIS B 130 ? 0.6881 0.4418 1.0960 -0.0237 0.0548 -0.1776 130 HIS B CB 1382 C CG . HIS B 130 ? 0.7365 0.4852 1.1713 -0.0211 0.0381 -0.1802 130 HIS B CG 1383 N ND1 . HIS B 130 ? 0.7725 0.5047 1.2616 -0.0121 -0.0021 -0.1785 130 HIS B ND1 1384 C CD2 . HIS B 130 ? 0.7548 0.5107 1.1687 -0.0271 0.0543 -0.1836 130 HIS B CD2 1385 C CE1 . HIS B 130 ? 0.7674 0.4994 1.2681 -0.0125 -0.0080 -0.1819 130 HIS B CE1 1386 N NE2 . HIS B 130 ? 0.7603 0.5070 1.2171 -0.0212 0.0267 -0.1854 130 HIS B NE2 1387 N N . HIS B 131 ? 0.7205 0.4177 0.9388 -0.0123 0.0098 -0.1126 131 HIS B N 1388 C CA . HIS B 131 ? 0.7243 0.4121 0.8785 -0.0130 0.0117 -0.0995 131 HIS B CA 1389 C C . HIS B 131 ? 0.7864 0.4591 0.9524 -0.0108 -0.0131 -0.0976 131 HIS B C 1390 O O . HIS B 131 ? 0.8069 0.4537 0.9778 -0.0087 -0.0473 -0.0890 131 HIS B O 1391 C CB . HIS B 131 ? 0.7489 0.4184 0.8356 -0.0131 0.0085 -0.0816 131 HIS B CB 1392 C CG . HIS B 131 ? 0.7979 0.4602 0.8282 -0.0145 0.0151 -0.0729 131 HIS B CG 1393 N ND1 . HIS B 131 ? 0.8004 0.4822 0.8162 -0.0162 0.0410 -0.0765 131 HIS B ND1 1394 C CD2 . HIS B 131 ? 0.8479 0.4833 0.8355 -0.0162 -0.0019 -0.0621 131 HIS B CD2 1395 C CE1 . HIS B 131 ? 0.8046 0.4739 0.7793 -0.0163 0.0391 -0.0690 131 HIS B CE1 1396 N NE2 . HIS B 131 ? 0.8378 0.4799 0.7924 -0.0171 0.0164 -0.0616 131 HIS B NE2 1397 N N . ASP B 132 ? 0.7290 0.4159 0.8996 -0.0132 0.0027 -0.1056 132 ASP B N 1398 C CA . ASP B 132 ? 0.7362 0.4139 0.9178 -0.0121 -0.0143 -0.1062 132 ASP B CA 1399 C C . ASP B 132 ? 0.7680 0.4594 0.9191 -0.0164 0.0125 -0.1081 132 ASP B C 1400 O O . ASP B 132 ? 0.7490 0.4601 0.9351 -0.0221 0.0329 -0.1233 132 ASP B O 1401 C CB . ASP B 132 ? 0.7559 0.4426 1.0262 -0.0110 -0.0259 -0.1242 132 ASP B CB 1402 C CG . ASP B 132 ? 0.8962 0.5675 1.1890 -0.0086 -0.0558 -0.1235 132 ASP B CG 1403 O OD1 . ASP B 132 ? 0.9155 0.5703 1.1502 -0.0091 -0.0636 -0.1102 132 ASP B OD1 1404 O OD2 . ASP B 132 ? 0.9704 0.6465 1.3437 -0.0067 -0.0710 -0.1381 132 ASP B OD2 1405 N N . PRO B 133 ? 0.7284 0.4083 0.8146 -0.0160 0.0149 -0.0941 133 PRO B N 1406 C CA . PRO B 133 ? 0.7148 0.4049 0.7766 -0.0196 0.0361 -0.0944 133 PRO B CA 1407 C C . PRO B 133 ? 0.7617 0.4523 0.8440 -0.0212 0.0321 -0.1009 133 PRO B C 1408 O O . PRO B 133 ? 0.7710 0.4456 0.8591 -0.0177 0.0080 -0.0984 133 PRO B O 1409 C CB . PRO B 133 ? 0.7478 0.4236 0.7510 -0.0175 0.0353 -0.0810 133 PRO B CB 1410 C CG . PRO B 133 ? 0.8292 0.4807 0.8178 -0.0157 0.0109 -0.0740 133 PRO B CG 1411 C CD . PRO B 133 ? 0.7700 0.4251 0.8053 -0.0144 -0.0005 -0.0791 133 PRO B CD 1412 N N . PRO B 134 ? 0.7051 0.4106 0.7961 -0.0288 0.0541 -0.1088 134 PRO B N 1413 C CA . PRO B 134 ? 0.7034 0.4093 0.8153 -0.0319 0.0523 -0.1158 134 PRO B CA 1414 C C . PRO B 134 ? 0.7526 0.4422 0.8264 -0.0272 0.0394 -0.1047 134 PRO B C 1415 O O . PRO B 134 ? 0.7489 0.4312 0.7779 -0.0248 0.0421 -0.0938 134 PRO B O 1416 C CB . PRO B 134 ? 0.7214 0.4411 0.8351 -0.0456 0.0811 -0.1244 134 PRO B CB 1417 C CG . PRO B 134 ? 0.7768 0.4972 0.8497 -0.0476 0.0920 -0.1147 134 PRO B CG 1418 C CD . PRO B 134 ? 0.7167 0.4352 0.7942 -0.0379 0.0798 -0.1111 134 PRO B CD 1419 N N . VAL B 135 ? 0.7101 0.3942 0.8072 -0.0265 0.0261 -0.1098 135 VAL B N 1420 C CA . VAL B 135 ? 0.7192 0.3869 0.7857 -0.0238 0.0136 -0.1026 135 VAL B CA 1421 C C . VAL B 135 ? 0.7566 0.4284 0.7990 -0.0281 0.0321 -0.1000 135 VAL B C 1422 O O . VAL B 135 ? 0.7424 0.4261 0.8037 -0.0363 0.0484 -0.1068 135 VAL B O 1423 C CB . VAL B 135 ? 0.7813 0.4396 0.8819 -0.0222 -0.0108 -0.1085 135 VAL B CB 1424 C CG1 . VAL B 135 ? 0.7671 0.4431 0.9248 -0.0278 0.0007 -0.1243 135 VAL B CG1 1425 C CG2 . VAL B 135 ? 0.8000 0.4368 0.8607 -0.0211 -0.0253 -0.1012 135 VAL B CG2 1426 N N . ILE B 136 ? 0.7187 0.3781 0.7197 -0.0245 0.0296 -0.0911 136 ILE B N 1427 C CA . ILE B 136 ? 0.7143 0.3733 0.6975 -0.0269 0.0405 -0.0876 136 ILE B CA 1428 C C . ILE B 136 ? 0.7679 0.4168 0.7552 -0.0266 0.0305 -0.0908 136 ILE B C 1429 O O . ILE B 136 ? 0.7787 0.4124 0.7494 -0.0232 0.0168 -0.0904 136 ILE B O 1430 C CB . ILE B 136 ? 0.7565 0.4109 0.7075 -0.0232 0.0460 -0.0802 136 ILE B CB 1431 C CG1 . ILE B 136 ? 0.7509 0.4174 0.7015 -0.0259 0.0579 -0.0768 136 ILE B CG1 1432 C CG2 . ILE B 136 ? 0.7725 0.4196 0.7122 -0.0226 0.0483 -0.0781 136 ILE B CG2 1433 C CD1 . ILE B 136 ? 0.8507 0.5237 0.8058 -0.0361 0.0688 -0.0751 136 ILE B CD1 1434 N N . GLY B 137 ? 0.7153 0.3702 0.7220 -0.0329 0.0377 -0.0947 137 GLY B N 1435 C CA . GLY B 137 ? 0.7187 0.3662 0.7352 -0.0338 0.0299 -0.0988 137 GLY B CA 1436 C C . GLY B 137 ? 0.7594 0.4116 0.8174 -0.0357 0.0210 -0.1094 137 GLY B C 1437 O O . GLY B 137 ? 0.7437 0.4097 0.8331 -0.0409 0.0307 -0.1169 137 GLY B O 1438 N N . ARG B 138 ? 0.7240 0.3639 0.7860 -0.0325 0.0023 -0.1118 138 ARG B N 1439 C CA . ARG B 138 ? 0.7221 0.3639 0.8310 -0.0334 -0.0127 -0.1221 138 ARG B CA 1440 C C . ARG B 138 ? 0.7894 0.4116 0.8905 -0.0283 -0.0445 -0.1190 138 ARG B C 1441 O O . ARG B 138 ? 0.7913 0.4093 0.9306 -0.0284 -0.0653 -0.1259 138 ARG B O 1442 C CB . ARG B 138 ? 0.7235 0.3662 0.8508 -0.0386 -0.0083 -0.1287 138 ARG B CB 1443 C CG . ARG B 138 ? 0.8271 0.4851 0.9721 -0.0499 0.0196 -0.1347 138 ARG B CG 1444 C CD . ARG B 138 ? 0.9333 0.5864 1.0799 -0.0567 0.0250 -0.1370 138 ARG B CD 1445 N NE . ARG B 138 ? 1.0259 0.6772 1.2127 -0.0549 0.0080 -0.1476 138 ARG B NE 1446 C CZ . ARG B 138 ? 1.1892 0.8531 1.4336 -0.0625 0.0145 -0.1640 138 ARG B CZ 1447 N NH1 . ARG B 138 ? 1.0168 0.6950 1.2808 -0.0749 0.0417 -0.1733 138 ARG B NH1 1448 N NH2 . ARG B 138 ? 1.0226 0.6837 1.3071 -0.0597 -0.0055 -0.1731 138 ARG B NH2 1449 N N . GLU B 139 ? 0.7596 0.3671 0.8112 -0.0260 -0.0494 -0.1090 139 GLU B N 1450 C CA . GLU B 139 ? 0.7901 0.3705 0.8164 -0.0268 -0.0792 -0.1038 139 GLU B CA 1451 C C . GLU B 139 ? 0.8446 0.4196 0.8485 -0.0261 -0.0811 -0.0963 139 GLU B C 1452 O O . GLU B 139 ? 0.8282 0.4098 0.8019 -0.0254 -0.0587 -0.0926 139 GLU B O 1453 C CB . GLU B 139 ? 0.8362 0.3929 0.8092 -0.0312 -0.0830 -0.1014 139 GLU B CB 1454 C CG . GLU B 139 ? 0.9759 0.5282 0.9691 -0.0330 -0.0939 -0.1079 139 GLU B CG 1455 C CD . GLU B 139 ? 1.2591 0.7912 1.2036 -0.0381 -0.0912 -0.1087 139 GLU B CD 1456 O OE1 . GLU B 139 ? 1.2289 0.7312 1.1227 -0.0459 -0.1056 -0.1055 139 GLU B OE1 1457 O OE2 . GLU B 139 ? 1.1668 0.7102 1.1229 -0.0365 -0.0745 -0.1135 139 GLU B OE2 1458 N N . LYS B 140 ? 0.8206 0.3823 0.8434 -0.0265 -0.1104 -0.0941 140 LYS B N 1459 C CA . LYS B 140 ? 0.8296 0.3815 0.8334 -0.0270 -0.1175 -0.0861 140 LYS B CA 1460 C C . LYS B 140 ? 0.9345 0.4469 0.8619 -0.0367 -0.1335 -0.0757 140 LYS B C 1461 O O . LYS B 140 ? 0.9694 0.4497 0.8845 -0.0434 -0.1704 -0.0696 140 LYS B O 1462 C CB . LYS B 140 ? 0.8577 0.4125 0.9259 -0.0237 -0.1428 -0.0892 140 LYS B CB 1463 C CG . LYS B 140 ? 0.9791 0.5729 1.1181 -0.0185 -0.1176 -0.1032 140 LYS B CG 1464 C CD . LYS B 140 ? 1.0977 0.6947 1.3103 -0.0155 -0.1407 -0.1105 140 LYS B CD 1465 C CE . LYS B 140 ? 1.1891 0.8236 1.4700 -0.0147 -0.1093 -0.1292 140 LYS B CE 1466 N NZ . LYS B 140 ? 1.2993 0.9390 1.6644 -0.0117 -0.1290 -0.1409 140 LYS B NZ 1467 N N . PHE B 141 ? 0.8985 0.4108 0.7751 -0.0397 -0.1058 -0.0749 141 PHE B N 1468 C CA . PHE B 141 ? 0.9483 0.4249 0.7493 -0.0529 -0.1089 -0.0703 141 PHE B CA 1469 C C . PHE B 141 ? 1.0203 0.4880 0.7890 -0.0572 -0.1026 -0.0635 141 PHE B C 1470 O O . PHE B 141 ? 0.9752 0.4704 0.7795 -0.0476 -0.0889 -0.0633 141 PHE B O 1471 C CB . PHE B 141 ? 0.9689 0.4491 0.7435 -0.0552 -0.0815 -0.0787 141 PHE B CB 1472 C CG . PHE B 141 ? 0.9435 0.4569 0.7382 -0.0459 -0.0461 -0.0829 141 PHE B CG 1473 C CD1 . PHE B 141 ? 0.9382 0.4830 0.7850 -0.0353 -0.0357 -0.0859 141 PHE B CD1 1474 C CD2 . PHE B 141 ? 0.9782 0.4879 0.7382 -0.0502 -0.0242 -0.0844 141 PHE B CD2 1475 C CE1 . PHE B 141 ? 0.9181 0.4863 0.7773 -0.0296 -0.0095 -0.0872 141 PHE B CE1 1476 C CE2 . PHE B 141 ? 0.9760 0.5138 0.7596 -0.0417 0.0024 -0.0876 141 PHE B CE2 1477 C CZ . PHE B 141 ? 0.9124 0.4773 0.7429 -0.0317 0.0071 -0.0874 141 PHE B CZ 1478 N N . HIS B 142 ? 1.0459 0.4725 0.7436 -0.0745 -0.1115 -0.0589 142 HIS B N 1479 C CA . HIS B 142 ? 1.0715 0.4819 0.7286 -0.0832 -0.1061 -0.0525 142 HIS B CA 1480 C C . HIS B 142 ? 1.1255 0.5430 0.7478 -0.0883 -0.0645 -0.0616 142 HIS B C 1481 O O . HIS B 142 ? 1.0898 0.5300 0.7289 -0.0811 -0.0442 -0.0617 142 HIS B O 1482 C CB . HIS B 142 ? 1.1582 0.5126 0.7554 -0.1038 -0.1438 -0.0410 142 HIS B CB 1483 C CG . HIS B 142 ? 1.2067 0.5526 0.8498 -0.0980 -0.1902 -0.0315 142 HIS B CG 1484 N ND1 . HIS B 142 ? 1.2359 0.5766 0.9052 -0.0961 -0.2156 -0.0336 142 HIS B ND1 1485 C CD2 . HIS B 142 ? 1.2284 0.5703 0.9020 -0.0939 -0.2151 -0.0218 142 HIS B CD2 1486 C CE1 . HIS B 142 ? 1.2312 0.5660 0.9507 -0.0905 -0.2552 -0.0262 142 HIS B CE1 1487 N NE2 . HIS B 142 ? 1.2315 0.5665 0.9567 -0.0889 -0.2567 -0.0191 142 HIS B NE2 1488 N N . SER B 143 ? 1.1211 0.5192 0.7000 -0.1012 -0.0519 -0.0710 143 SER B N 1489 C CA . SER B 143 ? 1.1244 0.5271 0.6791 -0.1078 -0.0118 -0.0845 143 SER B CA 1490 C C . SER B 143 ? 1.1296 0.5685 0.7341 -0.0927 0.0119 -0.0963 143 SER B C 1491 O O . SER B 143 ? 1.1173 0.5592 0.7408 -0.0880 0.0003 -0.0979 143 SER B O 1492 C CB . SER B 143 ? 1.2484 0.6019 0.7207 -0.1368 -0.0083 -0.0913 143 SER B CB 1493 O OG . SER B 143 ? 1.3830 0.7194 0.8420 -0.1430 -0.0224 -0.0956 143 SER B OG 1494 N N . ARG B 144 ? 1.0600 0.5236 0.6865 -0.0862 0.0427 -0.1042 144 ARG B N 1495 C CA . ARG B 144 ? 1.0182 0.5122 0.6937 -0.0728 0.0613 -0.1134 144 ARG B CA 1496 C C . ARG B 144 ? 1.1005 0.5789 0.7581 -0.0836 0.0774 -0.1309 144 ARG B C 1497 O O . ARG B 144 ? 1.1371 0.5931 0.7533 -0.1013 0.0967 -0.1435 144 ARG B O 1498 C CB . ARG B 144 ? 0.9839 0.5075 0.6963 -0.0618 0.0810 -0.1142 144 ARG B CB 1499 C CG . ARG B 144 ? 1.1490 0.6621 0.8343 -0.0738 0.1048 -0.1241 144 ARG B CG 1500 C CD . ARG B 144 ? 1.2478 0.7911 0.9824 -0.0622 0.1246 -0.1296 144 ARG B CD 1501 N NE . ARG B 144 ? 1.3534 0.9092 1.1284 -0.0554 0.1343 -0.1411 144 ARG B NE 1502 C CZ . ARG B 144 ? 1.5639 1.1126 1.3433 -0.0639 0.1582 -0.1623 144 ARG B CZ 1503 N NH1 . ARG B 144 ? 1.4464 0.9748 1.1861 -0.0823 0.1790 -0.1756 144 ARG B NH1 1504 N NH2 . ARG B 144 ? 1.3858 0.9460 1.2112 -0.0559 0.1626 -0.1718 144 ARG B NH2 1505 N N . PRO B 145 ? 1.0424 0.5304 0.7299 -0.0754 0.0720 -0.1338 145 PRO B N 1506 C CA . PRO B 145 ? 1.0707 0.5441 0.7460 -0.0857 0.0882 -0.1525 145 PRO B CA 1507 C C . PRO B 145 ? 1.0978 0.5932 0.8202 -0.0781 0.1163 -0.1675 145 PRO B C 1508 O O . PRO B 145 ? 1.0460 0.5699 0.8163 -0.0618 0.1158 -0.1595 145 PRO B O 1509 C CB . PRO B 145 ? 1.0857 0.5588 0.7754 -0.0799 0.0662 -0.1475 145 PRO B CB 1510 C CG . PRO B 145 ? 1.0903 0.5913 0.8246 -0.0620 0.0495 -0.1305 145 PRO B CG 1511 C CD . PRO B 145 ? 1.0190 0.5299 0.7524 -0.0591 0.0536 -0.1224 145 PRO B CD 1512 N N . GLN B 146 ? 1.0925 0.5725 0.8030 -0.0916 0.1397 -0.1906 146 GLN B N 1513 C CA . GLN B 146 ? 1.0746 0.5729 0.8410 -0.0854 0.1653 -0.2094 146 GLN B CA 1514 C C . GLN B 146 ? 1.0896 0.6063 0.9125 -0.0680 0.1522 -0.2050 146 GLN B C 1515 O O . GLN B 146 ? 1.0467 0.5870 0.9278 -0.0529 0.1522 -0.2018 146 GLN B O 1516 C CB . GLN B 146 ? 1.1463 0.6210 0.8864 -0.1081 0.1978 -0.2400 146 GLN B CB 1517 C CG . GLN B 146 ? 1.3815 0.8444 1.0866 -0.1253 0.2219 -0.2501 146 GLN B CG 1518 C CD . GLN B 146 ? 1.6875 1.1296 1.3761 -0.1503 0.2619 -0.2859 146 GLN B CD 1519 O OE1 . GLN B 146 ? 1.6177 1.0771 1.3731 -0.1444 0.2845 -0.3095 146 GLN B OE1 1520 N NE2 . GLN B 146 ? 1.6590 1.0613 1.2593 -0.1809 0.2716 -0.2920 146 GLN B NE2 1521 N N . HIS B 147 ? 1.0630 0.5658 0.8661 -0.0716 0.1380 -0.2032 147 HIS B N 1522 C CA . HIS B 147 ? 1.0348 0.5499 0.8826 -0.0584 0.1246 -0.1984 147 HIS B CA 1523 C C . HIS B 147 ? 1.0617 0.5796 0.8978 -0.0522 0.0955 -0.1758 147 HIS B C 1524 O O . HIS B 147 ? 1.0790 0.5803 0.8683 -0.0614 0.0834 -0.1700 147 HIS B O 1525 C CB . HIS B 147 ? 1.0784 0.5774 0.9270 -0.0680 0.1373 -0.2211 147 HIS B CB 1526 C CG . HIS B 147 ? 1.1421 0.6395 1.0129 -0.0758 0.1703 -0.2490 147 HIS B CG 1527 N ND1 . HIS B 147 ? 1.2199 0.6913 1.0383 -0.0999 0.1946 -0.2713 147 HIS B ND1 1528 C CD2 . HIS B 147 ? 1.1398 0.6569 1.0816 -0.0643 0.1817 -0.2587 147 HIS B CD2 1529 C CE1 . HIS B 147 ? 1.2161 0.6954 1.0802 -0.1022 0.2249 -0.2971 147 HIS B CE1 1530 N NE2 . HIS B 147 ? 1.1711 0.6787 1.1151 -0.0795 0.2161 -0.2902 147 HIS B NE2 1531 N N . GLY B 148 ? 0.9798 0.5167 0.8602 -0.0385 0.0841 -0.1641 148 GLY B N 1532 C CA . GLY B 148 ? 0.9585 0.5018 0.8405 -0.0336 0.0624 -0.1469 148 GLY B CA 1533 C C . GLY B 148 ? 0.9726 0.5339 0.8979 -0.0235 0.0565 -0.1354 148 GLY B C 1534 O O . GLY B 148 ? 0.9609 0.5269 0.9177 -0.0190 0.0635 -0.1390 148 GLY B O 1535 N N . LYS B 149 ? 0.9107 0.4794 0.8391 -0.0220 0.0431 -0.1224 149 LYS B N 1536 C CA . LYS B 149 ? 0.8857 0.4656 0.8420 -0.0188 0.0383 -0.1108 149 LYS B CA 1537 C C . LYS B 149 ? 0.9170 0.5083 0.8794 -0.0160 0.0428 -0.1020 149 LYS B C 1538 O O . LYS B 149 ? 0.9059 0.5028 0.8521 -0.0163 0.0454 -0.0999 149 LYS B O 1539 C CB . LYS B 149 ? 0.9105 0.4943 0.8683 -0.0222 0.0285 -0.1049 149 LYS B CB 1540 C CG . LYS B 149 ? 1.0785 0.6663 1.0566 -0.0253 0.0266 -0.0962 149 LYS B CG 1541 C CD . LYS B 149 ? 1.1964 0.7916 1.1801 -0.0313 0.0241 -0.0943 149 LYS B CD 1542 C CE . LYS B 149 ? 1.3412 0.9356 1.3362 -0.0402 0.0263 -0.0876 149 LYS B CE 1543 N NZ . LYS B 149 ? 1.4575 1.0604 1.4644 -0.0486 0.0299 -0.0913 149 LYS B NZ 1544 N N . GLU B 150 ? 0.8698 0.4614 0.8560 -0.0142 0.0407 -0.0965 150 GLU B N 1545 C CA . GLU B 150 ? 0.8579 0.4565 0.8514 -0.0129 0.0403 -0.0872 150 GLU B CA 1546 C C . GLU B 150 ? 0.8977 0.5006 0.8805 -0.0201 0.0349 -0.0730 150 GLU B C 1547 O O . GLU B 150 ? 0.8996 0.4946 0.8868 -0.0267 0.0275 -0.0654 150 GLU B O 1548 C CB . GLU B 150 ? 0.8820 0.4744 0.9094 -0.0092 0.0348 -0.0875 150 GLU B CB 1549 C CG . GLU B 150 ? 1.0277 0.6208 1.0735 -0.0036 0.0473 -0.1055 150 GLU B CG 1550 C CD . GLU B 150 ? 1.3098 0.9013 1.4032 0.0014 0.0410 -0.1070 150 GLU B CD 1551 O OE1 . GLU B 150 ? 1.2540 0.8355 1.3771 0.0025 0.0282 -0.1047 150 GLU B OE1 1552 O OE2 . GLU B 150 ? 1.2348 0.8342 1.3401 0.0042 0.0472 -0.1107 150 GLU B OE2 1553 N N . LEU B 151 ? 0.8423 0.4555 0.8098 -0.0212 0.0404 -0.0710 151 LEU B N 1554 C CA . LEU B 151 ? 0.8354 0.4536 0.7937 -0.0305 0.0410 -0.0625 151 LEU B CA 1555 C C . LEU B 151 ? 0.8759 0.4990 0.8280 -0.0323 0.0422 -0.0548 151 LEU B C 1556 O O . LEU B 151 ? 0.8611 0.4899 0.8148 -0.0244 0.0458 -0.0586 151 LEU B O 1557 C CB . LEU B 151 ? 0.8294 0.4558 0.7841 -0.0320 0.0454 -0.0694 151 LEU B CB 1558 C CG . LEU B 151 ? 0.8959 0.5180 0.8601 -0.0354 0.0421 -0.0747 151 LEU B CG 1559 C CD1 . LEU B 151 ? 0.8923 0.5212 0.8631 -0.0342 0.0408 -0.0827 151 LEU B CD1 1560 C CD2 . LEU B 151 ? 0.9386 0.5569 0.9052 -0.0489 0.0447 -0.0694 151 LEU B CD2 1561 N N . PRO B 152 ? 0.8411 0.4593 0.7826 -0.0452 0.0398 -0.0445 152 PRO B N 1562 C CA . PRO B 152 ? 0.8390 0.4589 0.7712 -0.0488 0.0385 -0.0368 152 PRO B CA 1563 C C . PRO B 152 ? 0.8683 0.5042 0.7938 -0.0471 0.0508 -0.0428 152 PRO B C 1564 O O . PRO B 152 ? 0.8582 0.5007 0.7819 -0.0525 0.0596 -0.0491 152 PRO B O 1565 C CB . PRO B 152 ? 0.8879 0.4913 0.7997 -0.0687 0.0322 -0.0247 152 PRO B CB 1566 C CG . PRO B 152 ? 0.9564 0.5489 0.8717 -0.0735 0.0295 -0.0255 152 PRO B CG 1567 C CD . PRO B 152 ? 0.8780 0.4854 0.8105 -0.0605 0.0388 -0.0400 152 PRO B CD 1568 N N . CYS B 153 ? 0.8142 0.4561 0.7422 -0.0396 0.0508 -0.0422 153 CYS B N 1569 C CA . CYS B 153 ? 0.7973 0.4523 0.7200 -0.0373 0.0604 -0.0465 153 CYS B CA 1570 C C . CYS B 153 ? 0.8392 0.4961 0.7609 -0.0365 0.0578 -0.0408 153 CYS B C 1571 O O . CYS B 153 ? 0.8426 0.4919 0.7759 -0.0339 0.0473 -0.0359 153 CYS B O 1572 C CB . CYS B 153 ? 0.7929 0.4525 0.7199 -0.0265 0.0645 -0.0563 153 CYS B CB 1573 S SG . CYS B 153 ? 0.8453 0.5010 0.7792 -0.0161 0.0655 -0.0616 153 CYS B SG 1574 N N . SER B 154 ? 0.7807 0.4476 0.6946 -0.0386 0.0658 -0.0423 154 SER B N 1575 C CA . SER B 154 ? 0.7741 0.4437 0.6876 -0.0383 0.0637 -0.0377 154 SER B CA 1576 C C . SER B 154 ? 0.8036 0.4837 0.7233 -0.0276 0.0723 -0.0451 154 SER B C 1577 O O . SER B 154 ? 0.7903 0.4741 0.7061 -0.0247 0.0789 -0.0515 154 SER B O 1578 C CB . SER B 154 ? 0.8274 0.4958 0.7212 -0.0541 0.0658 -0.0326 154 SER B CB 1579 O OG . SER B 154 ? 0.9260 0.6043 0.8171 -0.0580 0.0800 -0.0414 154 SER B OG 1580 N N . THR B 155 ? 0.7569 0.4391 0.6875 -0.0233 0.0704 -0.0442 155 THR B N 1581 C CA . THR B 155 ? 0.7444 0.4339 0.6788 -0.0165 0.0805 -0.0514 155 THR B CA 1582 C C . THR B 155 ? 0.7892 0.4836 0.7349 -0.0170 0.0777 -0.0483 155 THR B C 1583 O O . THR B 155 ? 0.7916 0.4807 0.7449 -0.0215 0.0637 -0.0401 155 THR B O 1584 C CB . THR B 155 ? 0.8484 0.5329 0.7915 -0.0098 0.0867 -0.0617 155 THR B CB 1585 O OG1 . THR B 155 ? 0.8438 0.5291 0.7734 -0.0090 0.0986 -0.0684 155 THR B OG1 1586 C CG2 . THR B 155 ? 0.8333 0.5165 0.8093 -0.0057 0.0833 -0.0658 155 THR B CG2 1587 N N . TYR B 156 ? 0.7389 0.4404 0.6845 -0.0138 0.0886 -0.0540 156 TYR B N 1588 C CA . TYR B 156 ? 0.7339 0.4413 0.6951 -0.0134 0.0874 -0.0535 156 TYR B CA 1589 C C . TYR B 156 ? 0.7962 0.5036 0.7877 -0.0068 0.0937 -0.0649 156 TYR B C 1590 O O . TYR B 156 ? 0.7932 0.4987 0.7761 -0.0057 0.1096 -0.0755 156 TYR B O 1591 C CB . TYR B 156 ? 0.7364 0.4512 0.6820 -0.0153 0.0976 -0.0546 156 TYR B CB 1592 C CG . TYR B 156 ? 0.7491 0.4654 0.6738 -0.0227 0.0962 -0.0491 156 TYR B CG 1593 C CD1 . TYR B 156 ? 0.7790 0.4950 0.6973 -0.0322 0.0888 -0.0422 156 TYR B CD1 1594 C CD2 . TYR B 156 ? 0.7530 0.4688 0.6662 -0.0222 0.1022 -0.0526 156 TYR B CD2 1595 C CE1 . TYR B 156 ? 0.7881 0.5052 0.6892 -0.0425 0.0938 -0.0423 156 TYR B CE1 1596 C CE2 . TYR B 156 ? 0.7608 0.4801 0.6680 -0.0293 0.1039 -0.0525 156 TYR B CE2 1597 C CZ . TYR B 156 ? 0.8534 0.5743 0.7546 -0.0401 0.1028 -0.0490 156 TYR B CZ 1598 O OH . TYR B 156 ? 0.8619 0.5859 0.7588 -0.0505 0.1102 -0.0536 156 TYR B OH 1599 N N . VAL B 157 ? 0.7668 0.4731 0.7942 -0.0047 0.0803 -0.0638 157 VAL B N 1600 C CA . VAL B 157 ? 0.7731 0.4809 0.8460 0.0012 0.0865 -0.0787 157 VAL B CA 1601 C C . VAL B 157 ? 0.8333 0.5499 0.9200 0.0016 0.1068 -0.0928 157 VAL B C 1602 O O . VAL B 157 ? 0.8212 0.5442 0.9026 -0.0001 0.1049 -0.0873 157 VAL B O 1603 C CB . VAL B 157 ? 0.8303 0.5327 0.9501 0.0040 0.0618 -0.0742 157 VAL B CB 1604 C CG1 . VAL B 157 ? 0.8364 0.5264 0.9463 0.0030 0.0492 -0.0667 157 VAL B CG1 1605 C CG2 . VAL B 157 ? 0.8322 0.5328 0.9542 -0.0005 0.0387 -0.0591 157 VAL B CG2 1606 N N . GLN B 158 ? 0.8096 0.5249 0.9120 0.0015 0.1283 -0.1124 158 GLN B N 1607 C CA . GLN B 158 ? 0.8178 0.5375 0.9299 -0.0026 0.1536 -0.1297 158 GLN B CA 1608 C C . GLN B 158 ? 0.8730 0.6047 1.0496 0.0013 0.1500 -0.1381 158 GLN B C 1609 O O . GLN B 158 ? 0.8719 0.6089 1.0585 -0.0032 0.1714 -0.1521 158 GLN B O 1610 C CB . GLN B 158 ? 0.8559 0.5658 0.9606 -0.0093 0.1801 -0.1508 158 GLN B CB 1611 C CG . GLN B 158 ? 1.0730 0.7677 1.1056 -0.0180 0.1890 -0.1455 158 GLN B CG 1612 C CD . GLN B 158 ? 1.3637 1.0445 1.3773 -0.0320 0.2202 -0.1677 158 GLN B CD 1613 O OE1 . GLN B 158 ? 1.3306 1.0000 1.3386 -0.0373 0.2298 -0.1800 158 GLN B OE1 1614 N NE2 . GLN B 158 ? 1.2789 0.9579 1.2797 -0.0410 0.2383 -0.1746 158 GLN B NE2 1615 N N . SER B 159 ? 0.8339 0.5671 1.0540 0.0079 0.1211 -0.1292 159 SER B N 1616 C CA . SER B 159 ? 0.8343 0.5755 1.1247 0.0124 0.1073 -0.1348 159 SER B CA 1617 C C . SER B 159 ? 0.8855 0.6347 1.1673 0.0101 0.1043 -0.1277 159 SER B C 1618 O O . SER B 159 ? 0.8763 0.6221 1.1042 0.0066 0.0931 -0.1079 159 SER B O 1619 C CB . SER B 159 ? 0.8868 0.6192 1.2117 0.0172 0.0683 -0.1206 159 SER B CB 1620 O OG . SER B 159 ? 1.0043 0.7267 1.2715 0.0124 0.0447 -0.0934 159 SER B OG 1621 N N . THR B 160 ? 0.8485 0.6087 1.1880 0.0110 0.1167 -0.1467 160 THR B N 1622 C CA . THR B 160 ? 0.8427 0.6119 1.1876 0.0091 0.1157 -0.1444 160 THR B CA 1623 C C . THR B 160 ? 0.8935 0.6587 1.2578 0.0115 0.0715 -0.1236 160 THR B C 1624 O O . THR B 160 ? 0.8843 0.6496 1.2109 0.0071 0.0629 -0.1092 160 THR B O 1625 C CB . THR B 160 ? 0.9621 0.7436 1.3710 0.0077 0.1446 -0.1748 160 THR B CB 1626 O OG1 . THR B 160 ? 0.9739 0.7516 1.3455 -0.0009 0.1860 -0.1922 160 THR B OG1 1627 C CG2 . THR B 160 ? 0.9425 0.7342 1.3656 0.0059 0.1435 -0.1742 160 THR B CG2 1628 N N . ALA B 161 ? 0.8603 0.6185 1.2817 0.0167 0.0426 -0.1222 161 ALA B N 1629 C CA . ALA B 161 ? 0.8724 0.6179 1.3178 0.0163 -0.0068 -0.1022 161 ALA B CA 1630 C C . ALA B 161 ? 0.9285 0.6628 1.2982 0.0060 -0.0263 -0.0754 161 ALA B C 1631 O O . ALA B 161 ? 0.9231 0.6514 1.2191 0.0003 -0.0163 -0.0642 161 ALA B O 1632 C CB . ALA B 161 ? 0.8961 0.6262 1.3726 0.0198 -0.0339 -0.0966 161 ALA B CB 1633 N N . ALA B 162 ? 0.8930 0.6242 1.2852 0.0025 -0.0533 -0.0677 162 ALA B N 1634 C CA . ALA B 162 ? 0.9035 0.6227 1.2287 -0.0106 -0.0711 -0.0459 162 ALA B CA 1635 C C . ALA B 162 ? 0.9844 0.6719 1.2865 -0.0222 -0.1198 -0.0205 162 ALA B C 1636 O O . ALA B 162 ? 1.0038 0.6770 1.3427 -0.0262 -0.1605 -0.0115 162 ALA B O 1637 C CB . ALA B 162 ? 0.9080 0.6389 1.2606 -0.0111 -0.0712 -0.0522 162 ALA B CB 1638 N N . THR B 163 ? 0.9440 0.6178 1.1847 -0.0295 -0.1167 -0.0089 163 THR B N 1639 C CA . THR B 163 ? 0.9811 0.6201 1.1811 -0.0456 -0.1563 0.0155 163 THR B CA 1640 C C . THR B 163 ? 1.0255 0.6571 1.1316 -0.0607 -0.1356 0.0244 163 THR B C 1641 O O . THR B 163 ? 0.9870 0.6413 1.0729 -0.0543 -0.0947 0.0113 163 THR B O 1642 C CB . THR B 163 ? 1.0995 0.7261 1.3519 -0.0376 -0.1790 0.0165 163 THR B CB 1643 O OG1 . THR B 163 ? 1.0635 0.7125 1.3334 -0.0230 -0.1393 -0.0030 163 THR B OG1 1644 C CG2 . THR B 163 ? 1.0947 0.7162 1.4416 -0.0293 -0.2170 0.0136 163 THR B CG2 1645 N N . THR B 164 ? 1.0211 0.6180 1.0722 -0.0825 -0.1651 0.0457 164 THR B N 1646 C CA . THR B 164 ? 1.0331 0.6170 0.9998 -0.1022 -0.1491 0.0532 164 THR B CA 1647 C C . THR B 164 ? 1.0595 0.6581 0.9780 -0.1113 -0.1170 0.0456 164 THR B C 1648 O O . THR B 164 ? 1.0903 0.6689 0.9645 -0.1334 -0.1320 0.0555 164 THR B O 1649 C CB . THR B 164 ? 1.1243 0.7104 1.0899 -0.0951 -0.1339 0.0497 164 THR B CB 1650 O OG1 . THR B 164 ? 1.1317 0.7032 1.1493 -0.0870 -0.1663 0.0558 164 THR B OG1 1651 C CG2 . THR B 164 ? 1.1387 0.7037 1.0252 -0.1196 -0.1262 0.0590 164 THR B CG2 1652 N N . GLU B 165 ? 0.9618 0.5913 0.8876 -0.0965 -0.0753 0.0283 165 GLU B N 1653 C CA . GLU B 165 ? 0.9405 0.5850 0.8314 -0.1025 -0.0444 0.0192 165 GLU B CA 1654 C C . GLU B 165 ? 0.9708 0.6258 0.8781 -0.1009 -0.0461 0.0155 165 GLU B C 1655 O O . GLU B 165 ? 0.9520 0.6157 0.9147 -0.0862 -0.0584 0.0126 165 GLU B O 1656 C CB . GLU B 165 ? 0.9171 0.5861 0.8165 -0.0872 -0.0082 0.0044 165 GLU B CB 1657 C CG . GLU B 165 ? 1.0584 0.7173 0.9291 -0.0945 -0.0019 0.0067 165 GLU B CG 1658 C CD . GLU B 165 ? 1.2667 0.9452 1.1447 -0.0815 0.0277 -0.0064 165 GLU B CD 1659 O OE1 . GLU B 165 ? 1.1623 0.8604 1.0587 -0.0690 0.0452 -0.0167 165 GLU B OE1 1660 O OE2 . GLU B 165 ? 1.1878 0.8595 1.0521 -0.0852 0.0310 -0.0056 165 GLU B OE2 1661 N N . GLU B 166 ? 0.9284 0.5827 0.7915 -0.1170 -0.0323 0.0134 166 GLU B N 1662 C CA . GLU B 166 ? 0.9189 0.5811 0.7898 -0.1186 -0.0331 0.0099 166 GLU B CA 1663 C C . GLU B 166 ? 0.9412 0.6176 0.7834 -0.1252 0.0000 -0.0020 166 GLU B C 1664 O O . GLU B 166 ? 0.9409 0.6157 0.7504 -0.1347 0.0200 -0.0068 166 GLU B O 1665 C CB . GLU B 166 ? 0.9887 0.6199 0.8377 -0.1397 -0.0735 0.0259 166 GLU B CB 1666 C CG . GLU B 166 ? 1.1801 0.7780 0.9502 -0.1734 -0.0801 0.0360 166 GLU B CG 1667 C CD . GLU B 166 ? 1.5036 1.0628 1.2360 -0.2005 -0.1217 0.0533 166 GLU B CD 1668 O OE1 . GLU B 166 ? 1.4395 0.9876 1.2136 -0.1923 -0.1618 0.0649 166 GLU B OE1 1669 O OE2 . GLU B 166 ? 1.4706 1.0078 1.1318 -0.2321 -0.1152 0.0546 166 GLU B OE2 1670 N N . ILE B 167 ? 0.8709 0.5608 0.7316 -0.1205 0.0049 -0.0081 167 ILE B N 1671 C CA . ILE B 167 ? 0.8517 0.5541 0.6943 -0.1263 0.0319 -0.0197 167 ILE B CA 1672 C C . ILE B 167 ? 0.9133 0.6065 0.7415 -0.1416 0.0174 -0.0169 167 ILE B C 1673 O O . ILE B 167 ? 0.9144 0.6012 0.7679 -0.1381 -0.0109 -0.0087 167 ILE B O 1674 C CB . ILE B 167 ? 0.8430 0.5731 0.7224 -0.1034 0.0594 -0.0326 167 ILE B CB 1675 C CG1 . ILE B 167 ? 0.8279 0.5702 0.7564 -0.0863 0.0528 -0.0342 167 ILE B CG1 1676 C CG2 . ILE B 167 ? 0.8339 0.5691 0.7151 -0.0937 0.0746 -0.0362 167 ILE B CG2 1677 C CD1 . ILE B 167 ? 0.8813 0.6434 0.8317 -0.0726 0.0788 -0.0459 167 ILE B CD1 1678 N N . GLU B 168 ? 0.8760 0.5684 0.6688 -0.1589 0.0365 -0.0254 168 GLU B N 1679 C CA . GLU B 168 ? 0.8976 0.5806 0.6705 -0.1761 0.0267 -0.0251 168 GLU B CA 1680 C C . GLU B 168 ? 0.9009 0.6105 0.7187 -0.1570 0.0402 -0.0350 168 GLU B C 1681 O O . GLU B 168 ? 0.8580 0.5888 0.6970 -0.1419 0.0682 -0.0462 168 GLU B O 1682 C CB . GLU B 168 ? 0.9534 0.6207 0.6658 -0.2077 0.0442 -0.0330 168 GLU B CB 1683 C CG . GLU B 168 ? 1.1424 0.7713 0.7940 -0.2382 0.0232 -0.0205 168 GLU B CG 1684 C CD . GLU B 168 ? 1.4338 1.0404 1.0166 -0.2776 0.0416 -0.0303 168 GLU B CD 1685 O OE1 . GLU B 168 ? 1.3271 0.9512 0.9154 -0.2806 0.0734 -0.0498 168 GLU B OE1 1686 O OE2 . GLU B 168 ? 1.4127 0.9821 0.9357 -0.3077 0.0251 -0.0195 168 GLU B OE2 1687 N N . VAL B 169 ? 0.8646 0.5703 0.6976 -0.1586 0.0176 -0.0300 169 VAL B N 1688 C CA . VAL B 169 ? 0.8292 0.5571 0.7041 -0.1438 0.0281 -0.0389 169 VAL B CA 1689 C C . VAL B 169 ? 0.9060 0.6232 0.7575 -0.1638 0.0170 -0.0394 169 VAL B C 1690 O O . VAL B 169 ? 0.9500 0.6390 0.7616 -0.1869 -0.0105 -0.0287 169 VAL B O 1691 C CB . VAL B 169 ? 0.8500 0.5919 0.7897 -0.1196 0.0175 -0.0378 169 VAL B CB 1692 C CG1 . VAL B 169 ? 0.8139 0.5692 0.7741 -0.1005 0.0386 -0.0425 169 VAL B CG1 1693 C CG2 . VAL B 169 ? 0.8777 0.6006 0.8329 -0.1245 -0.0250 -0.0247 169 VAL B CG2 1694 N N . HIS B 170 ? 0.8885 0.6728 1.4487 -0.1860 0.2770 -0.0048 170 HIS B N 1695 C CA . HIS B 170 ? 0.8671 0.6668 1.3819 -0.1686 0.2603 0.0304 170 HIS B CA 1696 C C . HIS B 170 ? 0.8800 0.7103 1.3571 -0.1616 0.2395 0.0122 170 HIS B C 1697 O O . HIS B 170 ? 0.8614 0.7065 1.3426 -0.1712 0.2369 -0.0257 170 HIS B O 1698 C CB . HIS B 170 ? 0.8722 0.6863 1.3619 -0.1733 0.2581 0.0542 170 HIS B CB 1699 C CG . HIS B 170 ? 0.8936 0.7359 1.3682 -0.1900 0.2528 0.0256 170 HIS B CG 1700 N ND1 . HIS B 170 ? 0.8819 0.7560 1.3244 -0.1892 0.2350 0.0011 170 HIS B ND1 1701 C CD2 . HIS B 170 ? 0.9248 0.7703 1.4115 -0.2061 0.2629 0.0221 170 HIS B CD2 1702 C CE1 . HIS B 170 ? 0.8648 0.7606 1.3027 -0.2036 0.2347 -0.0169 170 HIS B CE1 1703 N NE2 . HIS B 170 ? 0.8932 0.7740 1.3566 -0.2145 0.2509 -0.0065 170 HIS B NE2 1704 N N . MET B 171 ? 0.8228 0.6656 1.2642 -0.1458 0.2252 0.0391 171 MET B N 1705 C CA . MET B 171 ? 0.7900 0.6599 1.1954 -0.1391 0.2063 0.0271 171 MET B CA 1706 C C . MET B 171 ? 0.8098 0.7090 1.1875 -0.1507 0.1961 0.0061 171 MET B C 1707 O O . MET B 171 ? 0.8047 0.7092 1.1748 -0.1574 0.1982 0.0153 171 MET B O 1708 C CB . MET B 171 ? 0.8150 0.6928 1.1921 -0.1220 0.1953 0.0605 171 MET B CB 1709 C CG . MET B 171 ? 0.8842 0.7420 1.2855 -0.1071 0.2017 0.0792 171 MET B CG 1710 S SD . MET B 171 ? 0.9330 0.8102 1.3017 -0.0876 0.1884 0.1170 171 MET B SD 1711 C CE . MET B 171 ? 0.9248 0.7749 1.3359 -0.0710 0.2015 0.1402 171 MET B CE 1712 N N . PRO B 172 ? 0.7449 0.6652 1.1096 -0.1529 0.1861 -0.0213 172 PRO B N 1713 C CA . PRO B 172 ? 0.7213 0.6711 1.0622 -0.1616 0.1769 -0.0382 172 PRO B CA 1714 C C . PRO B 172 ? 0.7522 0.7171 1.0529 -0.1539 0.1633 -0.0177 172 PRO B C 1715 O O . PRO B 172 ? 0.7448 0.7049 1.0310 -0.1419 0.1574 0.0029 172 PRO B O 1716 C CB . PRO B 172 ? 0.7308 0.6998 1.0703 -0.1633 0.1709 -0.0675 172 PRO B CB 1717 C CG . PRO B 172 ? 0.8036 0.7513 1.1729 -0.1587 0.1799 -0.0719 172 PRO B CG 1718 C CD . PRO B 172 ? 0.7607 0.6825 1.1321 -0.1468 0.1832 -0.0365 172 PRO B CD 1719 N N . PRO B 173 ? 0.6961 0.6819 0.9804 -0.1603 0.1583 -0.0246 173 PRO B N 1720 C CA . PRO B 173 ? 0.6792 0.6782 0.9290 -0.1529 0.1468 -0.0085 173 PRO B CA 1721 C C . PRO B 173 ? 0.7093 0.7218 0.9351 -0.1453 0.1331 -0.0137 173 PRO B C 1722 O O . PRO B 173 ? 0.7005 0.7167 0.9341 -0.1465 0.1321 -0.0302 173 PRO B O 1723 C CB . PRO B 173 ? 0.6964 0.7135 0.9435 -0.1620 0.1475 -0.0185 173 PRO B CB 1724 C CG . PRO B 173 ? 0.7532 0.7800 1.0212 -0.1723 0.1518 -0.0470 173 PRO B CG 1725 C CD . PRO B 173 ? 0.7156 0.7166 1.0138 -0.1743 0.1633 -0.0487 173 PRO B CD 1726 N N . ASP B 174 ? 0.6550 0.6761 0.8532 -0.1386 0.1236 -0.0011 174 ASP B N 1727 C CA . ASP B 174 ? 0.6375 0.6693 0.8142 -0.1326 0.1120 -0.0042 174 ASP B CA 1728 C C . ASP B 174 ? 0.6734 0.7243 0.8476 -0.1373 0.1083 -0.0231 174 ASP B C 1729 O O . ASP B 174 ? 0.6660 0.7282 0.8394 -0.1411 0.1091 -0.0273 174 ASP B O 1730 C CB . ASP B 174 ? 0.6569 0.6931 0.8100 -0.1263 0.1052 0.0101 174 ASP B CB 1731 C CG . ASP B 174 ? 0.8030 0.8315 0.9547 -0.1213 0.1077 0.0300 174 ASP B CG 1732 O OD1 . ASP B 174 ? 0.8105 0.8479 0.9469 -0.1191 0.1050 0.0387 174 ASP B OD1 1733 O OD2 . ASP B 174 ? 0.8893 0.9058 1.0562 -0.1189 0.1127 0.0368 174 ASP B OD2 1734 N N . THR B 175 ? 0.6236 0.6821 0.7981 -0.1367 0.1048 -0.0339 175 THR B N 1735 C CA . THR B 175 ? 0.6136 0.6971 0.7856 -0.1401 0.1011 -0.0499 175 THR B CA 1736 C C . THR B 175 ? 0.6501 0.7444 0.7982 -0.1333 0.0911 -0.0415 175 THR B C 1737 O O . THR B 175 ? 0.6406 0.7307 0.7785 -0.1286 0.0866 -0.0354 175 THR B O 1738 C CB . THR B 175 ? 0.7249 0.8163 0.9111 -0.1438 0.1039 -0.0668 175 THR B CB 1739 O OG1 . THR B 175 ? 0.7352 0.8087 0.9476 -0.1487 0.1148 -0.0727 175 THR B OG1 1740 C CG2 . THR B 175 ? 0.7069 0.8327 0.8937 -0.1490 0.1016 -0.0854 175 THR B CG2 1741 N N . PRO B 176 ? 0.6022 0.7101 0.7437 -0.1324 0.0885 -0.0412 176 PRO B N 1742 C CA . PRO B 176 ? 0.5945 0.7087 0.7181 -0.1247 0.0808 -0.0323 176 PRO B CA 1743 C C . PRO B 176 ? 0.6401 0.7735 0.7591 -0.1231 0.0763 -0.0360 176 PRO B C 1744 O O . PRO B 176 ? 0.6336 0.7900 0.7613 -0.1279 0.0777 -0.0494 176 PRO B O 1745 C CB . PRO B 176 ? 0.6161 0.7424 0.7395 -0.1236 0.0807 -0.0328 176 PRO B CB 1746 C CG . PRO B 176 ? 0.6744 0.8129 0.8149 -0.1326 0.0869 -0.0466 176 PRO B CG 1747 C CD . PRO B 176 ? 0.6235 0.7419 0.7761 -0.1382 0.0933 -0.0488 176 PRO B CD 1748 N N . ASP B 177 ? 0.5969 0.7230 0.7032 -0.1175 0.0717 -0.0248 177 ASP B N 1749 C CA . ASP B 177 ? 0.5950 0.7388 0.6955 -0.1156 0.0682 -0.0233 177 ASP B CA 1750 C C . ASP B 177 ? 0.6518 0.7864 0.7407 -0.1085 0.0644 -0.0076 177 ASP B C 1751 O O . ASP B 177 ? 0.6472 0.7592 0.7320 -0.1081 0.0645 -0.0016 177 ASP B O 1752 C CB . ASP B 177 ? 0.6167 0.7583 0.7215 -0.1200 0.0702 -0.0297 177 ASP B CB 1753 C CG . ASP B 177 ? 0.7309 0.8969 0.8305 -0.1198 0.0678 -0.0300 177 ASP B CG 1754 O OD1 . ASP B 177 ? 0.7377 0.9314 0.8335 -0.1177 0.0652 -0.0289 177 ASP B OD1 1755 O OD2 . ASP B 177 ? 0.7998 0.9611 0.8995 -0.1215 0.0686 -0.0308 177 ASP B OD2 1756 N N . ARG B 178 ? 0.6163 0.7696 0.7022 -0.1027 0.0618 -0.0013 178 ARG B N 1757 C CA . ARG B 178 ? 0.6239 0.7669 0.7039 -0.0950 0.0600 0.0145 178 ARG B CA 1758 C C . ARG B 178 ? 0.6801 0.8247 0.7548 -0.0953 0.0594 0.0243 178 ARG B C 1759 O O . ARG B 178 ? 0.6832 0.8103 0.7561 -0.0914 0.0601 0.0369 178 ARG B O 1760 C CB . ARG B 178 ? 0.6366 0.7976 0.7187 -0.0863 0.0583 0.0207 178 ARG B CB 1761 C CG . ARG B 178 ? 0.7836 0.9347 0.8705 -0.0847 0.0598 0.0147 178 ARG B CG 1762 C CD . ARG B 178 ? 0.9411 1.0984 1.0312 -0.0730 0.0587 0.0247 178 ARG B CD 1763 N NE . ARG B 178 ? 1.0678 1.2145 1.1624 -0.0716 0.0610 0.0181 178 ARG B NE 1764 C CZ . ARG B 178 ? 1.2679 1.3870 1.3626 -0.0699 0.0635 0.0190 178 ARG B CZ 1765 N NH1 . ARG B 178 ? 1.1162 1.2131 1.2081 -0.0701 0.0642 0.0255 178 ARG B NH1 1766 N NH2 . ARG B 178 ? 1.1105 1.2274 1.2088 -0.0689 0.0658 0.0118 178 ARG B NH2 1767 N N . THR B 179 ? 0.6358 0.8010 0.7100 -0.1007 0.0594 0.0171 179 THR B N 1768 C CA . THR B 179 ? 0.6400 0.8127 0.7092 -0.1023 0.0595 0.0251 179 THR B CA 1769 C C . THR B 179 ? 0.6936 0.8369 0.7625 -0.1067 0.0613 0.0257 179 THR B C 1770 O O . THR B 179 ? 0.6939 0.8374 0.7596 -0.1083 0.0622 0.0347 179 THR B O 1771 C CB . THR B 179 ? 0.7350 0.9458 0.8046 -0.1067 0.0593 0.0141 179 THR B CB 1772 O OG1 . THR B 179 ? 0.7208 0.9253 0.7986 -0.1135 0.0617 -0.0056 179 THR B OG1 1773 C CG2 . THR B 179 ? 0.7171 0.9670 0.7862 -0.1025 0.0569 0.0141 179 THR B CG2 1774 N N . LEU B 180 ? 0.6489 0.7703 0.7214 -0.1088 0.0621 0.0171 180 LEU B N 1775 C CA . LEU B 180 ? 0.6482 0.7478 0.7207 -0.1120 0.0629 0.0167 180 LEU B CA 1776 C C . LEU B 180 ? 0.7101 0.7909 0.7804 -0.1104 0.0634 0.0268 180 LEU B C 1777 O O . LEU B 180 ? 0.7075 0.7776 0.7779 -0.1145 0.0643 0.0274 180 LEU B O 1778 C CB . LEU B 180 ? 0.6435 0.7310 0.7203 -0.1130 0.0637 0.0082 180 LEU B CB 1779 C CG . LEU B 180 ? 0.6986 0.7954 0.7836 -0.1155 0.0657 -0.0028 180 LEU B CG 1780 C CD1 . LEU B 180 ? 0.6996 0.7847 0.7899 -0.1152 0.0677 -0.0056 180 LEU B CD1 1781 C CD2 . LEU B 180 ? 0.7304 0.8279 0.8192 -0.1179 0.0666 -0.0060 180 LEU B CD2 1782 N N . MET B 181 ? 0.6760 0.7538 0.7470 -0.1045 0.0635 0.0332 181 MET B N 1783 C CA . MET B 181 ? 0.6878 0.7453 0.7617 -0.1020 0.0657 0.0407 181 MET B CA 1784 C C . MET B 181 ? 0.7526 0.8142 0.8284 -0.0982 0.0676 0.0572 181 MET B C 1785 O O . MET B 181 ? 0.7475 0.8317 0.8212 -0.0928 0.0659 0.0646 181 MET B O 1786 C CB . MET B 181 ? 0.7190 0.7680 0.7961 -0.0965 0.0660 0.0366 181 MET B CB 1787 C CG . MET B 181 ? 0.7560 0.8025 0.8310 -0.1001 0.0652 0.0241 181 MET B CG 1788 S SD . MET B 181 ? 0.8102 0.8565 0.8881 -0.0943 0.0661 0.0192 181 MET B SD 1789 C CE . MET B 181 ? 0.7616 0.8333 0.8404 -0.0911 0.0641 0.0205 181 MET B CE 1790 N N . SER B 182 ? 0.7241 0.7660 0.8050 -0.1014 0.0716 0.0634 182 SER B N 1791 C CA . SER B 182 ? 0.7411 0.7802 0.8271 -0.0987 0.0757 0.0827 182 SER B CA 1792 C C . SER B 182 ? 0.8087 0.8145 0.9079 -0.0995 0.0820 0.0841 182 SER B C 1793 O O . SER B 182 ? 0.7985 0.7899 0.9002 -0.1043 0.0822 0.0673 182 SER B O 1794 C CB . SER B 182 ? 0.7870 0.8412 0.8683 -0.1062 0.0765 0.0884 182 SER B CB 1795 O OG . SER B 182 ? 0.8969 0.9393 0.9795 -0.1165 0.0776 0.0761 182 SER B OG 1796 N N . GLN B 183 ? 0.7882 0.7838 0.8977 -0.0947 0.0877 0.1039 183 GLN B N 1797 C CA . GLN B 183 ? 0.8078 0.7687 0.9355 -0.0956 0.0959 0.1042 183 GLN B CA 1798 C C . GLN B 183 ? 0.8715 0.8190 1.0070 -0.1080 0.1026 0.1084 183 GLN B C 1799 O O . GLN B 183 ? 0.8761 0.8329 1.0112 -0.1080 0.1054 0.1296 183 GLN B O 1800 C CB . GLN B 183 ? 0.8450 0.7961 0.9859 -0.0807 0.1000 0.1225 183 GLN B CB 1801 C CG . GLN B 183 ? 1.0117 0.9754 1.1483 -0.0696 0.0943 0.1143 183 GLN B CG 1802 C CD . GLN B 183 ? 1.2632 1.2016 1.4193 -0.0599 0.1003 0.1127 183 GLN B CD 1803 O OE1 . GLN B 183 ? 1.2114 1.1222 1.3804 -0.0664 0.1063 0.0971 183 GLN B OE1 1804 N NE2 . GLN B 183 ? 1.1695 1.1211 1.3291 -0.0441 0.0985 0.1259 183 GLN B NE2 1805 N N . GLN B 184 ? 0.8293 0.7598 0.9717 -0.1192 0.1053 0.0876 184 GLN B N 1806 C CA . GLN B 184 ? 0.8404 0.7600 0.9927 -0.1331 0.1121 0.0870 184 GLN B CA 1807 C C . GLN B 184 ? 0.9212 0.8045 1.0999 -0.1348 0.1240 0.0887 184 GLN B C 1808 O O . GLN B 184 ? 0.9221 0.7901 1.1122 -0.1419 0.1273 0.0651 184 GLN B O 1809 C CB . GLN B 184 ? 0.8384 0.7714 0.9822 -0.1453 0.1073 0.0634 184 GLN B CB 1810 C CG . GLN B 184 ? 1.0296 0.9753 1.1717 -0.1567 0.1091 0.0690 184 GLN B CG 1811 C CD . GLN B 184 ? 1.2472 1.2093 1.3833 -0.1667 0.1043 0.0474 184 GLN B CD 1812 O OE1 . GLN B 184 ? 1.1971 1.1512 1.3419 -0.1741 0.1060 0.0281 184 GLN B OE1 1813 N NE2 . GLN B 184 ? 1.1196 1.1080 1.2426 -0.1671 0.0987 0.0499 184 GLN B NE2 1814 N N . SER B 185 ? 0.8983 0.7706 1.0880 -0.1270 0.1310 0.1177 185 SER B N 1815 C CA . SER B 185 ? 0.9311 0.7664 1.1501 -0.1240 0.1443 0.1301 185 SER B CA 1816 C C . SER B 185 ? 0.9814 0.8029 1.2104 -0.1074 0.1447 0.1287 185 SER B C 1817 O O . SER B 185 ? 1.0049 0.8077 1.2525 -0.0954 0.1526 0.1526 185 SER B O 1818 C CB . SER B 185 ? 0.9954 0.8042 1.2366 -0.1424 0.1550 0.1117 185 SER B CB 1819 O OG . SER B 185 ? 1.1197 0.9325 1.3628 -0.1542 0.1604 0.1276 185 SER B OG 1820 N N . GLY B 186 ? 0.9080 0.7415 1.1250 -0.1059 0.1364 0.1029 186 GLY B N 1821 C CA . GLY B 186 ? 0.9050 0.7325 1.1286 -0.0914 0.1355 0.0966 186 GLY B CA 1822 C C . GLY B 186 ? 0.9226 0.7642 1.1331 -0.0962 0.1282 0.0646 186 GLY B C 1823 O O . GLY B 186 ? 0.9221 0.7554 1.1425 -0.0892 0.1302 0.0504 186 GLY B O 1824 N N . ASN B 187 ? 0.8480 0.7126 1.0373 -0.1074 0.1203 0.0542 187 ASN B N 1825 C CA . ASN B 187 ? 0.8192 0.7015 0.9941 -0.1126 0.1132 0.0287 187 ASN B CA 1826 C C . ASN B 187 ? 0.8299 0.7430 0.9796 -0.1087 0.1020 0.0358 187 ASN B C 1827 O O . ASN B 187 ? 0.8233 0.7454 0.9680 -0.1007 0.0999 0.0566 187 ASN B O 1828 C CB . ASN B 187 ? 0.8310 0.7120 1.0097 -0.1299 0.1157 0.0082 187 ASN B CB 1829 C CG . ASN B 187 ? 1.1399 0.9908 1.3472 -0.1372 0.1284 -0.0012 187 ASN B CG 1830 O OD1 . ASN B 187 ? 1.0768 0.9133 1.3000 -0.1336 0.1340 -0.0165 187 ASN B OD1 1831 N ND2 . ASN B 187 ? 1.0498 0.8908 1.2667 -0.1482 0.1342 0.0064 187 ASN B ND2 1832 N N . VAL B 188 ? 0.7582 0.6891 0.8940 -0.1140 0.0957 0.0187 188 VAL B N 1833 C CA . VAL B 188 ? 0.7276 0.6833 0.8444 -0.1113 0.0872 0.0230 188 VAL B CA 1834 C C . VAL B 188 ? 0.7531 0.7217 0.8609 -0.1215 0.0838 0.0192 188 VAL B C 1835 O O . VAL B 188 ? 0.7451 0.7163 0.8531 -0.1293 0.0836 0.0042 188 VAL B O 1836 C CB . VAL B 188 ? 0.7650 0.7317 0.8749 -0.1055 0.0834 0.0127 188 VAL B CB 1837 C CG1 . VAL B 188 ? 0.7415 0.7300 0.8367 -0.1048 0.0767 0.0160 188 VAL B CG1 1838 C CG2 . VAL B 188 ? 0.7732 0.7322 0.8927 -0.0938 0.0862 0.0177 188 VAL B CG2 1839 N N . LYS B 189 ? 0.6938 0.6751 0.7945 -0.1207 0.0811 0.0321 189 LYS B N 1840 C CA . LYS B 189 ? 0.6761 0.6720 0.7700 -0.1282 0.0782 0.0294 189 LYS B CA 1841 C C . LYS B 189 ? 0.6979 0.7131 0.7809 -0.1236 0.0724 0.0288 189 LYS B C 1842 O O . LYS B 189 ? 0.6895 0.7137 0.7697 -0.1177 0.0714 0.0376 189 LYS B O 1843 C CB . LYS B 189 ? 0.7166 0.7126 0.8146 -0.1331 0.0821 0.0421 189 LYS B CB 1844 C CG . LYS B 189 ? 0.8758 0.8813 0.9733 -0.1437 0.0817 0.0343 189 LYS B CG 1845 C CD . LYS B 189 ? 0.9766 1.0058 1.0651 -0.1429 0.0777 0.0376 189 LYS B CD 1846 C CE . LYS B 189 ? 1.0981 1.1394 1.1870 -0.1503 0.0760 0.0270 189 LYS B CE 1847 N NZ . LYS B 189 ? 1.2241 1.2661 1.3203 -0.1604 0.0812 0.0309 189 LYS B NZ 1848 N N . ILE B 190 ? 0.6367 0.6601 0.7157 -0.1262 0.0693 0.0185 190 ILE B N 1849 C CA . ILE B 190 ? 0.6171 0.6541 0.6908 -0.1227 0.0658 0.0170 190 ILE B CA 1850 C C . ILE B 190 ? 0.6540 0.7034 0.7277 -0.1266 0.0648 0.0161 190 ILE B C 1851 O O . ILE B 190 ? 0.6477 0.6998 0.7228 -0.1305 0.0641 0.0112 190 ILE B O 1852 C CB . ILE B 190 ? 0.6513 0.6880 0.7229 -0.1202 0.0644 0.0101 190 ILE B CB 1853 C CG1 . ILE B 190 ? 0.6628 0.6903 0.7356 -0.1162 0.0661 0.0090 190 ILE B CG1 1854 C CG2 . ILE B 190 ? 0.6497 0.6961 0.7204 -0.1174 0.0630 0.0100 190 ILE B CG2 1855 C CD1 . ILE B 190 ? 0.7572 0.7833 0.8296 -0.1179 0.0667 -0.0003 190 ILE B CD1 1856 N N . THR B 191 ? 0.6040 0.6654 0.6771 -0.1255 0.0648 0.0199 191 THR B N 1857 C CA . THR B 191 ? 0.5958 0.6719 0.6706 -0.1284 0.0647 0.0172 191 THR B CA 1858 C C . THR B 191 ? 0.6342 0.7167 0.7124 -0.1247 0.0637 0.0099 191 THR B C 1859 O O . THR B 191 ? 0.6252 0.7132 0.7043 -0.1222 0.0641 0.0076 191 THR B O 1860 C CB . THR B 191 ? 0.7006 0.7900 0.7740 -0.1305 0.0666 0.0242 191 THR B CB 1861 O OG1 . THR B 191 ? 0.7095 0.7869 0.7830 -0.1327 0.0692 0.0345 191 THR B OG1 1862 C CG2 . THR B 191 ? 0.6795 0.7856 0.7556 -0.1348 0.0675 0.0203 191 THR B CG2 1863 N N . VAL B 192 ? 0.5881 0.6711 0.6703 -0.1245 0.0629 0.0064 192 VAL B N 1864 C CA . VAL B 192 ? 0.5813 0.6659 0.6709 -0.1200 0.0634 0.0025 192 VAL B CA 1865 C C . VAL B 192 ? 0.6259 0.7225 0.7241 -0.1195 0.0660 -0.0046 192 VAL B C 1866 O O . VAL B 192 ? 0.6191 0.7132 0.7254 -0.1169 0.0684 -0.0095 192 VAL B O 1867 C CB . VAL B 192 ? 0.6323 0.7171 0.7240 -0.1177 0.0618 0.0048 192 VAL B CB 1868 C CG1 . VAL B 192 ? 0.6292 0.7248 0.7319 -0.1143 0.0626 0.0027 192 VAL B CG1 1869 C CG2 . VAL B 192 ? 0.6319 0.7085 0.7220 -0.1139 0.0617 0.0086 192 VAL B CG2 1870 N N . ASN B 193 ? 0.5824 0.6934 0.6803 -0.1229 0.0664 -0.0064 193 ASN B N 1871 C CA . ASN B 193 ? 0.5781 0.7072 0.6840 -0.1233 0.0693 -0.0161 193 ASN B CA 1872 C C . ASN B 193 ? 0.6218 0.7493 0.7443 -0.1182 0.0721 -0.0243 193 ASN B C 1873 O O . ASN B 193 ? 0.6162 0.7503 0.7498 -0.1177 0.0760 -0.0360 193 ASN B O 1874 C CB . ASN B 193 ? 0.5957 0.7366 0.6980 -0.1252 0.0704 -0.0200 193 ASN B CB 1875 C CG . ASN B 193 ? 0.9207 1.0719 1.0105 -0.1286 0.0691 -0.0099 193 ASN B CG 1876 O OD1 . ASN B 193 ? 0.8623 1.0236 0.9472 -0.1282 0.0688 -0.0082 193 ASN B OD1 1877 N ND2 . ASN B 193 ? 0.8234 0.9752 0.9096 -0.1320 0.0691 -0.0026 193 ASN B ND2 1878 N N . GLY B 194 ? 0.5774 0.6982 0.7035 -0.1142 0.0706 -0.0184 194 GLY B N 1879 C CA . GLY B 194 ? 0.5779 0.6960 0.7216 -0.1066 0.0734 -0.0206 194 GLY B CA 1880 C C . GLY B 194 ? 0.6298 0.7303 0.7831 -0.1026 0.0769 -0.0194 194 GLY B C 1881 O O . GLY B 194 ? 0.6303 0.7265 0.8037 -0.0976 0.0824 -0.0249 194 GLY B O 1882 N N . GLN B 195 ? 0.5845 0.6741 0.7257 -0.1049 0.0748 -0.0125 195 GLN B N 1883 C CA . GLN B 195 ? 0.5863 0.6606 0.7345 -0.1030 0.0784 -0.0100 195 GLN B CA 1884 C C . GLN B 195 ? 0.6394 0.7066 0.7768 -0.1005 0.0752 0.0045 195 GLN B C 1885 O O . GLN B 195 ? 0.6294 0.7035 0.7530 -0.1020 0.0700 0.0086 195 GLN B O 1886 C CB . GLN B 195 ? 0.5996 0.6756 0.7443 -0.1094 0.0799 -0.0195 195 GLN B CB 1887 C CG . GLN B 195 ? 0.7756 0.8653 0.9319 -0.1128 0.0839 -0.0368 195 GLN B CG 1888 C CD . GLN B 195 ? 1.0063 1.1083 1.1551 -0.1188 0.0832 -0.0446 195 GLN B CD 1889 O OE1 . GLN B 195 ? 0.9401 1.0518 1.0715 -0.1205 0.0781 -0.0387 195 GLN B OE1 1890 N NE2 . GLN B 195 ? 0.9121 1.0154 1.0759 -0.1219 0.0888 -0.0579 195 GLN B NE2 1891 N N . THR B 196 ? 0.6062 0.6617 0.7512 -0.0978 0.0793 0.0110 196 THR B N 1892 C CA . THR B 196 ? 0.6082 0.6622 0.7427 -0.0957 0.0771 0.0242 196 THR B CA 1893 C C . THR B 196 ? 0.6552 0.7049 0.7797 -0.1017 0.0771 0.0199 196 THR B C 1894 O O . THR B 196 ? 0.6534 0.6957 0.7878 -0.1040 0.0823 0.0157 196 THR B O 1895 C CB . THR B 196 ? 0.7296 0.7775 0.8789 -0.0880 0.0822 0.0382 196 THR B CB 1896 O OG1 . THR B 196 ? 0.7345 0.7875 0.8966 -0.0810 0.0826 0.0405 196 THR B OG1 1897 C CG2 . THR B 196 ? 0.7158 0.7716 0.8527 -0.0852 0.0796 0.0534 196 THR B CG2 1898 N N . VAL B 197 ? 0.6069 0.6622 0.7145 -0.1044 0.0718 0.0192 197 VAL B N 1899 C CA . VAL B 197 ? 0.6020 0.6551 0.7009 -0.1080 0.0712 0.0153 197 VAL B CA 1900 C C . VAL B 197 ? 0.6580 0.7126 0.7479 -0.1070 0.0704 0.0215 197 VAL B C 1901 O O . VAL B 197 ? 0.6525 0.7147 0.7350 -0.1061 0.0672 0.0243 197 VAL B O 1902 C CB . VAL B 197 ? 0.6456 0.7025 0.7367 -0.1112 0.0677 0.0092 197 VAL B CB 1903 C CG1 . VAL B 197 ? 0.6426 0.6979 0.7273 -0.1122 0.0672 0.0076 197 VAL B CG1 1904 C CG2 . VAL B 197 ? 0.6403 0.7031 0.7390 -0.1126 0.0689 0.0026 197 VAL B CG2 1905 N N . ARG B 198 ? 0.6212 0.6730 0.7123 -0.1081 0.0736 0.0216 198 ARG B N 1906 C CA . ARG B 198 ? 0.6248 0.6817 0.7077 -0.1076 0.0739 0.0254 198 ARG B CA 1907 C C . ARG B 198 ? 0.6761 0.7328 0.7519 -0.1091 0.0717 0.0168 198 ARG B C 1908 O O . ARG B 198 ? 0.6659 0.7204 0.7460 -0.1101 0.0728 0.0122 198 ARG B O 1909 C CB . ARG B 198 ? 0.6340 0.6892 0.7250 -0.1079 0.0801 0.0321 198 ARG B CB 1910 C CG . ARG B 198 ? 0.7712 0.8380 0.8538 -0.1065 0.0811 0.0407 198 ARG B CG 1911 C CD . ARG B 198 ? 0.9004 0.9659 0.9918 -0.1080 0.0887 0.0494 198 ARG B CD 1912 N NE . ARG B 198 ? 1.0202 1.0764 1.1268 -0.1059 0.0940 0.0615 198 ARG B NE 1913 C CZ . ARG B 198 ? 1.2152 1.2787 1.3222 -0.1005 0.0954 0.0792 198 ARG B CZ 1914 N NH1 . ARG B 198 ? 1.0565 1.1417 1.1471 -0.0979 0.0912 0.0847 198 ARG B NH1 1915 N NH2 . ARG B 198 ? 1.0619 1.1133 1.1872 -0.0971 0.1016 0.0911 198 ARG B NH2 1916 N N . TYR B 199 ? 0.6421 0.7031 0.7092 -0.1090 0.0692 0.0139 199 TYR B N 1917 C CA . TYR B 199 ? 0.6444 0.7017 0.7090 -0.1089 0.0684 0.0065 199 TYR B CA 1918 C C . TYR B 199 ? 0.7062 0.7707 0.7664 -0.1083 0.0699 0.0017 199 TYR B C 1919 O O . TYR B 199 ? 0.7042 0.7807 0.7593 -0.1092 0.0699 0.0023 199 TYR B O 1920 C CB . TYR B 199 ? 0.6611 0.7123 0.7254 -0.1105 0.0659 0.0036 199 TYR B CB 1921 C CG . TYR B 199 ? 0.6896 0.7468 0.7503 -0.1134 0.0646 -0.0003 199 TYR B CG 1922 C CD1 . TYR B 199 ? 0.7126 0.7789 0.7727 -0.1142 0.0626 0.0038 199 TYR B CD1 1923 C CD2 . TYR B 199 ? 0.7079 0.7639 0.7683 -0.1153 0.0656 -0.0097 199 TYR B CD2 1924 C CE1 . TYR B 199 ? 0.7274 0.8068 0.7847 -0.1171 0.0608 -0.0011 199 TYR B CE1 1925 C CE2 . TYR B 199 ? 0.7252 0.7920 0.7842 -0.1198 0.0647 -0.0175 199 TYR B CE2 1926 C CZ . TYR B 199 ? 0.8173 0.8980 0.8737 -0.1210 0.0618 -0.0129 199 TYR B CZ 1927 O OH . TYR B 199 ? 0.8382 0.9363 0.8935 -0.1257 0.0603 -0.0217 199 TYR B OH 1928 N N . LYS B 200 ? 0.6712 0.7318 0.7340 -0.1060 0.0712 -0.0035 200 LYS B N 1929 C CA . LYS B 200 ? 0.6787 0.7462 0.7404 -0.1045 0.0736 -0.0114 200 LYS B CA 1930 C C . LYS B 200 ? 0.7426 0.7986 0.8110 -0.1007 0.0743 -0.0176 200 LYS B C 1931 O O . LYS B 200 ? 0.7342 0.7854 0.8074 -0.0969 0.0738 -0.0128 200 LYS B O 1932 C CB . LYS B 200 ? 0.7089 0.7875 0.7709 -0.1038 0.0767 -0.0084 200 LYS B CB 1933 C CG . LYS B 200 ? 0.8952 0.9899 0.9532 -0.1038 0.0797 -0.0150 200 LYS B CG 1934 C CD . LYS B 200 ? 1.0204 1.1278 1.0786 -0.1049 0.0837 -0.0083 200 LYS B CD 1935 C CE . LYS B 200 ? 1.1628 1.2910 1.2170 -0.1048 0.0873 -0.0152 200 LYS B CE 1936 N NZ . LYS B 200 ? 1.2879 1.4341 1.3321 -0.1073 0.0871 -0.0133 200 LYS B NZ 1937 N N . CYS B 201 ? 0.7175 0.7710 0.7882 -0.1016 0.0760 -0.0284 201 CYS B N 1938 C CA . CYS B 201 ? 0.7302 0.7685 0.8120 -0.0974 0.0788 -0.0340 201 CYS B CA 1939 C C . CYS B 201 ? 0.8032 0.8479 0.8906 -0.0946 0.0833 -0.0482 201 CYS B C 1940 O O . CYS B 201 ? 0.7989 0.8608 0.8803 -0.0991 0.0842 -0.0582 201 CYS B O 1941 C CB . CYS B 201 ? 0.7404 0.7645 0.8267 -0.1022 0.0791 -0.0362 201 CYS B CB 1942 S SG . CYS B 201 ? 0.7806 0.7964 0.8643 -0.1034 0.0754 -0.0197 201 CYS B SG 1943 N N . ASN B 202 ? 0.7799 0.8141 0.8798 -0.0863 0.0864 -0.0492 202 ASN B N 1944 C CA . ASN B 202 ? 0.7948 0.8339 0.9043 -0.0819 0.0917 -0.0646 202 ASN B CA 1945 C C . ASN B 202 ? 0.8755 0.8980 0.9987 -0.0844 0.0970 -0.0798 202 ASN B C 1946 O O . ASN B 202 ? 0.8856 0.8942 1.0271 -0.0769 0.1027 -0.0865 202 ASN B O 1947 C CB . ASN B 202 ? 0.8082 0.8470 0.9273 -0.0701 0.0928 -0.0581 202 ASN B CB 1948 C CG . ASN B 202 ? 1.1170 1.1761 1.2383 -0.0665 0.0963 -0.0700 202 ASN B CG 1949 O OD1 . ASN B 202 ? 1.0591 1.1287 1.1803 -0.0706 0.1001 -0.0874 202 ASN B OD1 1950 N ND2 . ASN B 202 ? 1.0099 1.0800 1.1337 -0.0594 0.0953 -0.0620 202 ASN B ND2 1951 N N . CYS B 203 ? 0.8420 0.8668 0.9590 -0.0950 0.0956 -0.0857 203 CYS B N 1952 C CA . CYS B 203 ? 0.8618 0.8746 0.9922 -0.1016 0.1008 -0.1029 203 CYS B CA 1953 C C . CYS B 203 ? 0.9210 0.9622 1.0408 -0.1126 0.0994 -0.1199 203 CYS B C 1954 O O . CYS B 203 ? 0.9004 0.9659 1.0016 -0.1142 0.0938 -0.1114 203 CYS B O 1955 C CB . CYS B 203 ? 0.8690 0.8562 1.0060 -0.1040 0.1006 -0.0896 203 CYS B CB 1956 S SG . CYS B 203 ? 0.9261 0.8857 1.0777 -0.0902 0.1032 -0.0684 203 CYS B SG 1957 N N . GLY B 204 ? 0.9037 0.9432 1.0374 -0.1201 0.1052 -0.1434 204 GLY B N 1958 C CA . GLY B 204 ? 0.9075 0.9804 1.0335 -0.1311 0.1042 -0.1632 204 GLY B CA 1959 C C . GLY B 204 ? 0.9559 1.0362 1.0722 -0.1395 0.0983 -0.1547 204 GLY B C 1960 O O . GLY B 204 ? 0.9423 0.9994 1.0582 -0.1376 0.0956 -0.1345 204 GLY B O 1961 N N . GLY B 205 ? 0.9218 1.0391 1.0306 -0.1483 0.0964 -0.1709 205 GLY B N 1962 C CA . GLY B 205 ? 0.9161 1.0497 1.0167 -0.1558 0.0906 -0.1658 205 GLY B CA 1963 C C . GLY B 205 ? 0.9526 1.1022 1.0321 -0.1494 0.0822 -0.1385 205 GLY B C 1964 O O . GLY B 205 ? 0.9439 1.1296 1.0093 -0.1475 0.0793 -0.1371 205 GLY B O 1965 N N . SER B 206 ? 0.9032 1.0268 0.9819 -0.1460 0.0792 -0.1168 206 SER B N 1966 C CA . SER B 206 ? 0.8866 1.0182 0.9508 -0.1400 0.0729 -0.0922 206 SER B CA 1967 C C . SER B 206 ? 0.9298 1.0335 0.9943 -0.1314 0.0735 -0.0747 206 SER B C 1968 O O . SER B 206 ? 0.9255 1.0003 0.9996 -0.1305 0.0756 -0.0715 206 SER B O 1969 C CB . SER B 206 ? 0.9275 1.0623 0.9917 -0.1442 0.0688 -0.0856 206 SER B CB 1970 O OG . SER B 206 ? 1.0276 1.1711 1.0814 -0.1377 0.0638 -0.0642 206 SER B OG 1971 N N . ASN B 207 ? 0.8812 0.9969 0.9360 -0.1255 0.0722 -0.0631 207 ASN B N 1972 C CA . ASN B 207 ? 0.8717 0.9689 0.9273 -0.1188 0.0729 -0.0495 207 ASN B CA 1973 C C . ASN B 207 ? 0.9109 1.0199 0.9580 -0.1155 0.0710 -0.0324 207 ASN B C 1974 O O . ASN B 207 ? 0.9007 1.0013 0.9493 -0.1118 0.0725 -0.0246 207 ASN B O 1975 C CB . ASN B 207 ? 0.8921 0.9831 0.9542 -0.1153 0.0776 -0.0596 207 ASN B CB 1976 C CG . ASN B 207 ? 1.1965 1.3157 1.2537 -0.1164 0.0800 -0.0720 207 ASN B CG 1977 O OD1 . ASN B 207 ? 1.1231 1.2617 1.1710 -0.1147 0.0797 -0.0627 207 ASN B OD1 1978 N ND2 . ASN B 207 ? 1.1059 1.2289 1.1711 -0.1199 0.0837 -0.0940 207 ASN B ND2 1979 N N . GLU B 208 ? 0.8658 0.9953 0.9063 -0.1169 0.0683 -0.0263 208 GLU B N 1980 C CA . GLU B 208 ? 0.8585 0.9951 0.8954 -0.1130 0.0681 -0.0076 208 GLU B CA 1981 C C . GLU B 208 ? 0.8991 1.0332 0.9380 -0.1120 0.0647 0.0029 208 GLU B C 1982 O O . GLU B 208 ? 0.8922 1.0195 0.9343 -0.1151 0.0623 -0.0046 208 GLU B O 1983 C CB . GLU B 208 ? 0.8841 1.0521 0.9123 -0.1122 0.0699 -0.0038 208 GLU B CB 1984 C CG . GLU B 208 ? 1.0288 1.2314 1.0497 -0.1142 0.0669 -0.0088 208 GLU B CG 1985 C CD . GLU B 208 ? 1.2969 1.5376 1.3078 -0.1127 0.0687 -0.0022 208 GLU B CD 1986 O OE1 . GLU B 208 ? 1.2262 1.4674 1.2361 -0.1083 0.0714 0.0195 208 GLU B OE1 1987 O OE2 . GLU B 208 ? 1.2248 1.4969 1.2298 -0.1164 0.0683 -0.0190 208 GLU B OE2 1988 N N . GLY B 209 ? 0.8513 0.9893 0.8911 -0.1078 0.0656 0.0202 209 GLY B N 1989 C CA . GLY B 209 ? 0.8448 0.9824 0.8895 -0.1047 0.0633 0.0307 209 GLY B CA 1990 C C . GLY B 209 ? 0.8804 0.9923 0.9359 -0.1032 0.0653 0.0361 209 GLY B C 1991 O O . GLY B 209 ? 0.8687 0.9626 0.9273 -0.1055 0.0670 0.0293 209 GLY B O 1992 N N . LEU B 210 ? 0.8344 0.9491 0.8967 -0.0984 0.0652 0.0480 210 LEU B N 1993 C CA . LEU B 210 ? 0.8267 0.9237 0.9026 -0.0959 0.0676 0.0526 210 LEU B CA 1994 C C . LEU B 210 ? 0.8636 0.9687 0.9399 -0.0956 0.0627 0.0477 210 LEU B C 1995 O O . LEU B 210 ? 0.8625 0.9889 0.9370 -0.0916 0.0598 0.0546 210 LEU B O 1996 C CB . LEU B 210 ? 0.8388 0.9388 0.9238 -0.0891 0.0723 0.0721 210 LEU B CB 1997 C CG . LEU B 210 ? 0.9022 0.9847 1.0069 -0.0849 0.0771 0.0781 210 LEU B CG 1998 C CD1 . LEU B 210 ? 0.9074 0.9701 1.0231 -0.0885 0.0848 0.0772 210 LEU B CD1 1999 C CD2 . LEU B 210 ? 0.9472 1.0412 1.0605 -0.0747 0.0786 0.0987 210 LEU B CD2 2000 N N . THR B 211 ? 0.8063 0.8992 0.8840 -0.1002 0.0617 0.0360 211 THR B N 2001 C CA . THR B 211 ? 0.7975 0.8985 0.8758 -0.1022 0.0580 0.0301 211 THR B CA 2002 C C . THR B 211 ? 0.8363 0.9310 0.9267 -0.0999 0.0595 0.0302 211 THR B C 2003 O O . THR B 211 ? 0.8277 0.9078 0.9240 -0.1007 0.0629 0.0273 211 THR B O 2004 C CB . THR B 211 ? 0.8933 0.9922 0.9638 -0.1102 0.0563 0.0177 211 THR B CB 2005 O OG1 . THR B 211 ? 0.8861 0.9966 0.9580 -0.1138 0.0536 0.0126 211 THR B OG1 2006 C CG2 . THR B 211 ? 0.8704 0.9499 0.9418 -0.1130 0.0586 0.0134 211 THR B CG2 2007 N N . THR B 212 ? 0.7896 0.8994 0.8844 -0.0972 0.0570 0.0317 212 THR B N 2008 C CA . THR B 212 ? 0.7829 0.8919 0.8905 -0.0944 0.0586 0.0297 212 THR B CA 2009 C C . THR B 212 ? 0.8200 0.9356 0.9235 -0.1023 0.0563 0.0192 212 THR B C 2010 O O . THR B 212 ? 0.8120 0.9309 0.9240 -0.1019 0.0576 0.0150 212 THR B O 2011 C CB . THR B 212 ? 0.8935 1.0161 1.0127 -0.0837 0.0585 0.0411 212 THR B CB 2012 O OG1 . THR B 212 ? 0.8990 1.0242 1.0158 -0.0780 0.0592 0.0549 212 THR B OG1 2013 C CG2 . THR B 212 ? 0.8790 0.9916 1.0179 -0.0777 0.0637 0.0404 212 THR B CG2 2014 N N . THR B 213 ? 0.7724 0.8901 0.8648 -0.1098 0.0540 0.0144 213 THR B N 2015 C CA . THR B 213 ? 0.7676 0.8885 0.8577 -0.1190 0.0535 0.0063 213 THR B CA 2016 C C . THR B 213 ? 0.8145 0.9177 0.8976 -0.1252 0.0554 0.0031 213 THR B C 2017 O O . THR B 213 ? 0.8097 0.9035 0.8883 -0.1228 0.0558 0.0048 213 THR B O 2018 C CB . THR B 213 ? 0.8715 1.0151 0.9613 -0.1224 0.0502 0.0024 213 THR B CB 2019 O OG1 . THR B 213 ? 0.8709 1.0207 0.9539 -0.1218 0.0485 0.0022 213 THR B OG1 2020 C CG2 . THR B 213 ? 0.8503 1.0160 0.9494 -0.1155 0.0482 0.0062 213 THR B CG2 2021 N N . ASP B 214 ? 0.7711 0.8709 0.8548 -0.1327 0.0571 -0.0001 214 ASP B N 2022 C CA . ASP B 214 ? 0.7730 0.8559 0.8536 -0.1371 0.0598 0.0001 214 ASP B CA 2023 C C . ASP B 214 ? 0.8246 0.9032 0.9040 -0.1409 0.0601 -0.0063 214 ASP B C 2024 O O . ASP B 214 ? 0.8225 0.9151 0.9043 -0.1459 0.0589 -0.0135 214 ASP B O 2025 C CB . ASP B 214 ? 0.8009 0.8836 0.8847 -0.1438 0.0628 0.0021 214 ASP B CB 2026 C CG . ASP B 214 ? 0.9259 1.0139 1.0094 -0.1408 0.0638 0.0071 214 ASP B CG 2027 O OD1 . ASP B 214 ? 0.9265 1.0195 1.0109 -0.1342 0.0623 0.0057 214 ASP B OD1 2028 O OD2 . ASP B 214 ? 1.0051 1.0943 1.0890 -0.1454 0.0668 0.0120 214 ASP B OD2 2029 N N . LYS B 215 ? 0.7810 0.8443 0.8579 -0.1386 0.0617 -0.0057 215 LYS B N 2030 C CA . LYS B 215 ? 0.7860 0.8449 0.8637 -0.1415 0.0632 -0.0146 215 LYS B CA 2031 C C . LYS B 215 ? 0.8404 0.8772 0.9239 -0.1433 0.0682 -0.0139 215 LYS B C 2032 O O . LYS B 215 ? 0.8326 0.8601 0.9152 -0.1383 0.0690 -0.0036 215 LYS B O 2033 C CB . LYS B 215 ? 0.8146 0.8804 0.8859 -0.1351 0.0611 -0.0152 215 LYS B CB 2034 C CG . LYS B 215 ? 1.0083 1.0969 1.0774 -0.1377 0.0589 -0.0237 215 LYS B CG 2035 C CD . LYS B 215 ? 1.1365 1.2439 1.2019 -0.1315 0.0550 -0.0145 215 LYS B CD 2036 C CE . LYS B 215 ? 1.2886 1.4268 1.3520 -0.1333 0.0520 -0.0202 215 LYS B CE 2037 N NZ . LYS B 215 ? 1.4051 1.5611 1.4658 -0.1239 0.0490 -0.0064 215 LYS B NZ 2038 N N . VAL B 216 ? 0.8068 0.8375 0.8981 -0.1500 0.0720 -0.0254 216 VAL B N 2039 C CA . VAL B 216 ? 0.8187 0.8251 0.9207 -0.1509 0.0785 -0.0249 216 VAL B CA 2040 C C . VAL B 216 ? 0.8729 0.8748 0.9792 -0.1495 0.0810 -0.0389 216 VAL B C 2041 O O . VAL B 216 ? 0.8675 0.8864 0.9729 -0.1548 0.0800 -0.0548 216 VAL B O 2042 C CB . VAL B 216 ? 0.8821 0.8784 0.9968 -0.1613 0.0844 -0.0245 216 VAL B CB 2043 C CG1 . VAL B 216 ? 0.8888 0.8947 1.0122 -0.1735 0.0866 -0.0449 216 VAL B CG1 2044 C CG2 . VAL B 216 ? 0.8977 0.8661 1.0245 -0.1587 0.0918 -0.0140 216 VAL B CG2 2045 N N . ILE B 217 ? 0.8338 0.8180 0.9445 -0.1416 0.0841 -0.0331 217 ILE B N 2046 C CA . ILE B 217 ? 0.8396 0.8189 0.9565 -0.1385 0.0875 -0.0464 217 ILE B CA 2047 C C . ILE B 217 ? 0.9098 0.8601 1.0475 -0.1387 0.0966 -0.0470 217 ILE B C 2048 O O . ILE B 217 ? 0.9079 0.8432 1.0497 -0.1296 0.0983 -0.0298 217 ILE B O 2049 C CB . ILE B 217 ? 0.8666 0.8541 0.9729 -0.1274 0.0837 -0.0402 217 ILE B CB 2050 C CG1 . ILE B 217 ? 0.8516 0.8607 0.9414 -0.1263 0.0765 -0.0328 217 ILE B CG1 2051 C CG2 . ILE B 217 ? 0.8841 0.8741 0.9956 -0.1251 0.0871 -0.0565 217 ILE B CG2 2052 C CD1 . ILE B 217 ? 0.9391 0.9724 1.0213 -0.1322 0.0732 -0.0429 217 ILE B CD1 2053 N N . ASN B 218 ? 0.8825 0.8268 1.0354 -0.1491 0.1030 -0.0666 218 ASN B N 2054 C CA . ASN B 218 ? 0.9073 0.8202 1.0860 -0.1509 0.1142 -0.0697 218 ASN B CA 2055 C C . ASN B 218 ? 0.9660 0.8674 1.1555 -0.1406 0.1187 -0.0777 218 ASN B C 2056 O O . ASN B 218 ? 0.9500 0.8724 1.1304 -0.1389 0.1152 -0.0934 218 ASN B O 2057 C CB . ASN B 218 ? 0.9338 0.8454 1.1285 -0.1678 0.1207 -0.0916 218 ASN B CB 2058 C CG . ASN B 218 ? 1.2262 1.1426 1.4175 -0.1776 0.1192 -0.0809 218 ASN B CG 2059 O OD1 . ASN B 218 ? 1.1357 1.0811 1.3086 -0.1805 0.1104 -0.0810 218 ASN B OD1 2060 N ND2 . ASN B 218 ? 1.1454 1.0340 1.3561 -0.1823 0.1285 -0.0702 218 ASN B ND2 2061 N N . ASN B 219 ? 0.9446 0.8145 1.1546 -0.1329 0.1270 -0.0651 219 ASN B N 2062 C CA . ASN B 219 ? 0.9577 0.8126 1.1839 -0.1204 0.1328 -0.0690 219 ASN B CA 2063 C C . ASN B 219 ? 0.9819 0.8590 1.1882 -0.1072 0.1239 -0.0614 219 ASN B C 2064 O O . ASN B 219 ? 0.9758 0.8637 1.1832 -0.1037 0.1246 -0.0796 219 ASN B O 2065 C CB . ASN B 219 ? 0.9951 0.8425 1.2438 -0.1284 0.1424 -0.1035 219 ASN B CB 2066 C CG . ASN B 219 ? 1.3385 1.1580 1.6149 -0.1413 0.1542 -0.1116 219 ASN B CG 2067 O OD1 . ASN B 219 ? 1.2971 1.0826 1.5948 -0.1359 0.1628 -0.0918 219 ASN B OD1 2068 N ND2 . ASN B 219 ? 1.2396 1.0750 1.5179 -0.1588 0.1555 -0.1404 219 ASN B ND2 2069 N N . CYS B 220 ? 0.9186 0.8052 1.1077 -0.1011 0.1163 -0.0359 220 CYS B N 2070 C CA . CYS B 220 ? 0.8940 0.8024 1.0658 -0.0908 0.1083 -0.0274 220 CYS B CA 2071 C C . CYS B 220 ? 0.9312 0.8386 1.1009 -0.0803 0.1058 0.0014 220 CYS B C 2072 O O . CYS B 220 ? 0.9288 0.8294 1.0985 -0.0844 0.1064 0.0162 220 CYS B O 2073 C CB . CYS B 220 ? 0.8740 0.8098 1.0222 -0.0990 0.0999 -0.0345 220 CYS B CB 2074 S SG . CYS B 220 ? 0.9063 0.8677 1.0408 -0.0917 0.0947 -0.0391 220 CYS B SG 2075 N N . LYS B 221 ? 0.8760 0.7950 1.0441 -0.0672 0.1030 0.0085 221 LYS B N 2076 C CA . LYS B 221 ? 0.8687 0.7973 1.0338 -0.0562 0.0996 0.0337 221 LYS B CA 2077 C C . LYS B 221 ? 0.8819 0.8402 1.0240 -0.0602 0.0903 0.0359 221 LYS B C 2078 O O . LYS B 221 ? 0.8596 0.8298 0.9915 -0.0657 0.0871 0.0203 221 LYS B O 2079 C CB . LYS B 221 ? 0.9127 0.8414 1.0926 -0.0392 0.1023 0.0393 221 LYS B CB 2080 C CG . LYS B 221 ? 1.1059 1.0367 1.2932 -0.0259 0.1027 0.0690 221 LYS B CG 2081 C CD . LYS B 221 ? 1.2457 1.1766 1.4517 -0.0070 0.1060 0.0752 221 LYS B CD 2082 C CE . LYS B 221 ? 1.3949 1.3318 1.6095 0.0083 0.1066 0.1082 221 LYS B CE 2083 N NZ . LYS B 221 ? 1.5408 1.4411 1.7763 0.0092 0.1170 0.1234 221 LYS B NZ 2084 N N . VAL B 222 ? 0.8298 0.8011 0.9653 -0.0576 0.0868 0.0550 222 VAL B N 2085 C CA . VAL B 222 ? 0.8026 0.8018 0.9207 -0.0617 0.0794 0.0553 222 VAL B CA 2086 C C . VAL B 222 ? 0.8324 0.8535 0.9469 -0.0562 0.0757 0.0483 222 VAL B C 2087 O O . VAL B 222 ? 0.8088 0.8448 0.9125 -0.0633 0.0719 0.0393 222 VAL B O 2088 C CB . VAL B 222 ? 0.8540 0.8668 0.9673 -0.0611 0.0776 0.0744 222 VAL B CB 2089 C CG1 . VAL B 222 ? 0.8620 0.8922 0.9809 -0.0465 0.0769 0.0931 222 VAL B CG1 2090 C CG2 . VAL B 222 ? 0.8308 0.8655 0.9291 -0.0703 0.0722 0.0675 222 VAL B CG2 2091 N N . ASP B 223 ? 0.7957 0.8174 0.9218 -0.0437 0.0778 0.0521 223 ASP B N 2092 C CA . ASP B 223 ? 0.7816 0.8256 0.9075 -0.0380 0.0754 0.0453 223 ASP B CA 2093 C C . ASP B 223 ? 0.8136 0.8519 0.9374 -0.0448 0.0772 0.0250 223 ASP B C 2094 O O . ASP B 223 ? 0.7957 0.8540 0.9151 -0.0461 0.0752 0.0177 223 ASP B O 2095 C CB . ASP B 223 ? 0.8222 0.8705 0.9637 -0.0207 0.0774 0.0568 223 ASP B CB 2096 C CG . ASP B 223 ? 0.9694 1.0315 1.1125 -0.0119 0.0754 0.0810 223 ASP B CG 2097 O OD1 . ASP B 223 ? 0.9706 1.0687 1.1098 -0.0063 0.0703 0.0865 223 ASP B OD1 2098 O OD2 . ASP B 223 ? 1.0629 1.1030 1.2118 -0.0111 0.0794 0.0943 223 ASP B OD2 2099 N N . GLN B 224 ? 0.7723 0.7869 0.8998 -0.0499 0.0816 0.0159 224 GLN B N 2100 C CA . GLN B 224 ? 0.7632 0.7773 0.8878 -0.0564 0.0836 -0.0029 224 GLN B CA 2101 C C . GLN B 224 ? 0.7880 0.8108 0.8965 -0.0690 0.0800 -0.0074 224 GLN B C 2102 O O . GLN B 224 ? 0.7787 0.8084 0.8824 -0.0739 0.0811 -0.0192 224 GLN B O 2103 C CB . GLN B 224 ? 0.7992 0.7901 0.9364 -0.0573 0.0901 -0.0137 224 GLN B CB 2104 C CG . GLN B 224 ? 1.0173 0.9987 1.1750 -0.0442 0.0960 -0.0153 224 GLN B CG 2105 C CD . GLN B 224 ? 1.2892 1.2471 1.4626 -0.0475 0.1040 -0.0310 224 GLN B CD 2106 O OE1 . GLN B 224 ? 1.2484 1.1821 1.4334 -0.0488 0.1081 -0.0244 224 GLN B OE1 2107 N NE2 . GLN B 224 ? 1.1971 1.1638 1.3722 -0.0503 0.1071 -0.0535 224 GLN B NE2 2108 N N . CYS B 225 ? 0.7312 0.7558 0.8325 -0.0732 0.0763 0.0025 225 CYS B N 2109 C CA . CYS B 225 ? 0.7133 0.7441 0.8034 -0.0830 0.0737 0.0001 225 CYS B CA 2110 C C . CYS B 225 ? 0.7327 0.7809 0.8182 -0.0842 0.0708 0.0038 225 CYS B C 2111 O O . CYS B 225 ? 0.7256 0.7846 0.8146 -0.0788 0.0695 0.0096 225 CYS B O 2112 C CB . CYS B 225 ? 0.7224 0.7414 0.8107 -0.0889 0.0732 0.0033 225 CYS B CB 2113 S SG . CYS B 225 ? 0.7894 0.7905 0.8852 -0.0927 0.0778 -0.0075 225 CYS B SG 2114 N N . HIS B 226 ? 0.6690 0.7216 0.7488 -0.0913 0.0705 0.0004 226 HIS B N 2115 C CA . HIS B 226 ? 0.6519 0.7165 0.7316 -0.0947 0.0700 0.0010 226 HIS B CA 2116 C C . HIS B 226 ? 0.6871 0.7469 0.7636 -0.1008 0.0693 0.0024 226 HIS B C 2117 O O . HIS B 226 ? 0.6822 0.7370 0.7549 -0.1031 0.0698 0.0019 226 HIS B O 2118 C CB . HIS B 226 ? 0.6589 0.7329 0.7405 -0.0957 0.0730 -0.0033 226 HIS B CB 2119 C CG . HIS B 226 ? 0.6947 0.7780 0.7809 -0.1011 0.0748 -0.0042 226 HIS B CG 2120 N ND1 . HIS B 226 ? 0.7158 0.7939 0.8021 -0.1067 0.0773 -0.0019 226 HIS B ND1 2121 C CD2 . HIS B 226 ? 0.7124 0.8106 0.8057 -0.1017 0.0751 -0.0077 226 HIS B CD2 2122 C CE1 . HIS B 226 ? 0.7057 0.7906 0.8012 -0.1112 0.0803 -0.0049 226 HIS B CE1 2123 N NE2 . HIS B 226 ? 0.7074 0.8065 0.8070 -0.1094 0.0789 -0.0102 226 HIS B NE2 2124 N N . ALA B 227 ? 0.6335 0.6989 0.7125 -0.1029 0.0683 0.0033 227 ALA B N 2125 C CA . ALA B 227 ? 0.6256 0.6877 0.7051 -0.1071 0.0683 0.0036 227 ALA B CA 2126 C C . ALA B 227 ? 0.6634 0.7333 0.7516 -0.1107 0.0709 -0.0011 227 ALA B C 2127 O O . ALA B 227 ? 0.6554 0.7387 0.7478 -0.1110 0.0711 -0.0059 227 ALA B O 2128 C CB . ALA B 227 ? 0.6359 0.6970 0.7127 -0.1071 0.0659 0.0064 227 ALA B CB 2129 N N . ALA B 228 ? 0.6167 0.6797 0.7097 -0.1131 0.0736 -0.0001 228 ALA B N 2130 C CA . ALA B 228 ? 0.6133 0.6780 0.7201 -0.1170 0.0785 -0.0055 228 ALA B CA 2131 C C . ALA B 228 ? 0.6602 0.7167 0.7738 -0.1169 0.0802 -0.0034 228 ALA B C 2132 O O . ALA B 228 ? 0.6558 0.7058 0.7644 -0.1138 0.0791 0.0057 228 ALA B O 2133 C CB . ALA B 228 ? 0.6269 0.6897 0.7399 -0.1192 0.0836 -0.0041 228 ALA B CB 2134 N N . VAL B 229 ? 0.6153 0.6759 0.7416 -0.1198 0.0832 -0.0132 229 VAL B N 2135 C CA . VAL B 229 ? 0.6155 0.6695 0.7533 -0.1186 0.0861 -0.0137 229 VAL B CA 2136 C C . VAL B 229 ? 0.6742 0.7142 0.8295 -0.1189 0.0942 -0.0097 229 VAL B C 2137 O O . VAL B 229 ? 0.6730 0.7130 0.8417 -0.1245 0.1001 -0.0184 229 VAL B O 2138 C CB . VAL B 229 ? 0.6618 0.7291 0.8071 -0.1215 0.0867 -0.0287 229 VAL B CB 2139 C CG1 . VAL B 229 ? 0.6646 0.7250 0.8255 -0.1192 0.0909 -0.0312 229 VAL B CG1 2140 C CG2 . VAL B 229 ? 0.6522 0.7342 0.7805 -0.1208 0.0799 -0.0276 229 VAL B CG2 2141 N N . THR B 230 ? 0.6366 0.6670 0.7936 -0.1131 0.0949 0.0043 230 THR B N 2142 C CA . THR B 230 ? 0.6487 0.6652 0.8238 -0.1112 0.1033 0.0145 230 THR B CA 2143 C C . THR B 230 ? 0.7075 0.7149 0.9083 -0.1102 0.1103 0.0063 230 THR B C 2144 O O . THR B 230 ? 0.6966 0.7107 0.8962 -0.1073 0.1066 -0.0001 230 THR B O 2145 C CB . THR B 230 ? 0.7509 0.7680 0.9155 -0.1038 0.1007 0.0358 230 THR B CB 2146 O OG1 . THR B 230 ? 0.7429 0.7643 0.9068 -0.0972 0.0966 0.0393 230 THR B OG1 2147 C CG2 . THR B 230 ? 0.7243 0.7530 0.8651 -0.1052 0.0943 0.0390 230 THR B CG2 2148 N N . ASN B 231 ? 0.6801 0.6723 0.9063 -0.1132 0.1215 0.0054 231 ASN B N 2149 C CA . ASN B 231 ? 0.6908 0.6706 0.9482 -0.1124 0.1309 -0.0047 231 ASN B CA 2150 C C . ASN B 231 ? 0.7588 0.7147 1.0421 -0.1087 0.1429 0.0127 231 ASN B C 2151 O O . ASN B 231 ? 0.7638 0.7090 1.0631 -0.1168 0.1523 0.0100 231 ASN B O 2152 C CB . ASN B 231 ? 0.7062 0.6949 0.9765 -0.1232 0.1348 -0.0351 231 ASN B CB 2153 C CG . ASN B 231 ? 1.0143 1.0216 1.2665 -0.1319 0.1295 -0.0449 231 ASN B CG 2154 O OD1 . ASN B 231 ? 0.9576 0.9607 1.2146 -0.1378 0.1342 -0.0430 231 ASN B OD1 2155 N ND2 . ASN B 231 ? 0.8977 0.9275 1.1301 -0.1323 0.1201 -0.0545 231 ASN B ND2 2156 N N . HIS B 232 ? 0.7213 0.6712 1.0093 -0.0960 0.1427 0.0324 232 HIS B N 2157 C CA . HIS B 232 ? 0.7427 0.6722 1.0548 -0.0883 0.1534 0.0566 232 HIS B CA 2158 C C . HIS B 232 ? 0.8021 0.7131 1.1521 -0.0817 0.1638 0.0506 232 HIS B C 2159 O O . HIS B 232 ? 0.8216 0.7121 1.1980 -0.0735 0.1745 0.0719 232 HIS B O 2160 C CB . HIS B 232 ? 0.7525 0.6956 1.0420 -0.0767 0.1453 0.0873 232 HIS B CB 2161 C CG . HIS B 232 ? 0.7838 0.7434 1.0418 -0.0824 0.1380 0.0936 232 HIS B CG 2162 N ND1 . HIS B 232 ? 0.7884 0.7721 1.0145 -0.0799 0.1245 0.0944 232 HIS B ND1 2163 C CD2 . HIS B 232 ? 0.8111 0.7667 1.0683 -0.0906 0.1436 0.0979 232 HIS B CD2 2164 C CE1 . HIS B 232 ? 0.7762 0.7687 0.9838 -0.0858 0.1225 0.0981 232 HIS B CE1 2165 N NE2 . HIS B 232 ? 0.7929 0.7707 1.0172 -0.0920 0.1333 0.1007 232 HIS B NE2 2166 N N . LYS B 233 ? 0.7542 0.5882 0.9742 -0.1110 0.0246 -0.1035 233 LYS B N 2167 C CA . LYS B 233 ? 0.7389 0.5805 1.0260 -0.0976 0.0142 -0.1069 233 LYS B CA 2168 C C . LYS B 233 ? 0.7709 0.6110 1.0477 -0.0882 0.0250 -0.1034 233 LYS B C 2169 O O . LYS B 233 ? 0.7642 0.6060 1.0917 -0.0799 0.0104 -0.1050 233 LYS B O 2170 C CB . LYS B 233 ? 0.7462 0.6093 1.0994 -0.0879 0.0390 -0.1245 233 LYS B CB 2171 C CG . LYS B 233 ? 0.9326 0.7991 1.3203 -0.0948 0.0209 -0.1295 233 LYS B CG 2172 C CD . LYS B 233 ? 1.0346 0.9221 1.4858 -0.0870 0.0516 -0.1489 233 LYS B CD 2173 C CE . LYS B 233 ? 1.1812 1.0735 1.6688 -0.0936 0.0357 -0.1550 233 LYS B CE 2174 N NZ . LYS B 233 ? 1.2761 1.1878 1.8215 -0.0887 0.0706 -0.1754 233 LYS B NZ 2175 N N . LYS B 234 ? 0.7151 0.5521 0.9333 -0.0895 0.0496 -0.1001 234 LYS B N 2176 C CA . LYS B 234 ? 0.7004 0.5355 0.9054 -0.0812 0.0611 -0.0972 234 LYS B CA 2177 C C . LYS B 234 ? 0.7636 0.5817 0.9054 -0.0910 0.0498 -0.0845 234 LYS B C 2178 O O . LYS B 234 ? 0.7797 0.5869 0.8785 -0.1065 0.0411 -0.0801 234 LYS B O 2179 C CB . LYS B 234 ? 0.7071 0.5530 0.9098 -0.0725 0.1023 -0.1067 234 LYS B CB 2180 C CG . LYS B 234 ? 0.8608 0.7200 1.1225 -0.0655 0.1204 -0.1215 234 LYS B CG 2181 C CD . LYS B 234 ? 0.9698 0.8320 1.2713 -0.0569 0.1239 -0.1280 234 LYS B CD 2182 C CE . LYS B 234 ? 1.0912 0.9663 1.4586 -0.0544 0.1427 -0.1473 234 LYS B CE 2183 N NZ . LYS B 234 ? 1.2014 1.0802 1.6182 -0.0479 0.1466 -0.1582 234 LYS B NZ 2184 N N . TRP B 235 ? 0.7115 0.5263 0.8484 -0.0838 0.0521 -0.0806 235 TRP B N 2185 C CA . TRP B 235 ? 0.7226 0.5225 0.8053 -0.0920 0.0465 -0.0706 235 TRP B CA 2186 C C . TRP B 235 ? 0.7410 0.5480 0.8038 -0.0840 0.0794 -0.0753 235 TRP B C 2187 O O . TRP B 235 ? 0.7129 0.5310 0.8038 -0.0714 0.0995 -0.0828 235 TRP B O 2188 C CB . TRP B 235 ? 0.7238 0.5110 0.8194 -0.0910 0.0168 -0.0608 235 TRP B CB 2189 C CG . TRP B 235 ? 0.7801 0.5426 0.8457 -0.1103 -0.0224 -0.0473 235 TRP B CG 2190 C CD1 . TRP B 235 ? 0.8459 0.5954 0.8649 -0.1308 -0.0297 -0.0444 235 TRP B CD1 2191 C CD2 . TRP B 235 ? 0.8059 0.5484 0.8801 -0.1140 -0.0610 -0.0344 235 TRP B CD2 2192 N NE1 . TRP B 235 ? 0.8879 0.6076 0.8792 -0.1495 -0.0712 -0.0296 235 TRP B NE1 2193 C CE2 . TRP B 235 ? 0.9060 0.6201 0.9316 -0.1390 -0.0932 -0.0219 235 TRP B CE2 2194 C CE3 . TRP B 235 ? 0.8129 0.5564 0.9321 -0.1001 -0.0725 -0.0327 235 TRP B CE3 2195 C CZ2 . TRP B 235 ? 0.9425 0.6256 0.9587 -0.1512 -0.1402 -0.0048 235 TRP B CZ2 2196 C CZ3 . TRP B 235 ? 0.8704 0.5871 0.9893 -0.1093 -0.1179 -0.0173 235 TRP B CZ3 2197 C CH2 . TRP B 235 ? 0.9316 0.6169 0.9983 -0.1348 -0.1533 -0.0021 235 TRP B CH2 2198 N N . GLN B 236 ? 0.7031 0.5012 0.7175 -0.0936 0.0844 -0.0718 236 GLN B N 2199 C CA . GLN B 236 ? 0.6820 0.4841 0.6799 -0.0877 0.1096 -0.0758 236 GLN B CA 2200 C C . GLN B 236 ? 0.7403 0.5302 0.7000 -0.0975 0.1045 -0.0705 236 GLN B C 2201 O O . GLN B 236 ? 0.7648 0.5416 0.6947 -0.1155 0.0903 -0.0668 236 GLN B O 2202 C CB . GLN B 236 ? 0.6931 0.5014 0.6840 -0.0913 0.1290 -0.0842 236 GLN B CB 2203 C CG . GLN B 236 ? 0.8733 0.6859 0.8674 -0.0809 0.1509 -0.0884 236 GLN B CG 2204 C CD . GLN B 236 ? 1.1070 0.9239 1.1049 -0.0836 0.1649 -0.0960 236 GLN B CD 2205 O OE1 . GLN B 236 ? 1.0587 0.8741 1.0428 -0.0916 0.1723 -0.1017 236 GLN B OE1 2206 N NE2 . GLN B 236 ? 0.9926 0.8145 1.0132 -0.0781 0.1704 -0.0982 236 GLN B NE2 2207 N N . TYR B 237 ? 0.6764 0.4676 0.6333 -0.0885 0.1162 -0.0707 237 TYR B N 2208 C CA . TYR B 237 ? 0.6844 0.4655 0.6098 -0.0976 0.1151 -0.0679 237 TYR B CA 2209 C C . TYR B 237 ? 0.7405 0.5179 0.6370 -0.1156 0.1268 -0.0758 237 TYR B C 2210 O O . TYR B 237 ? 0.7218 0.5088 0.6303 -0.1132 0.1432 -0.0852 237 TYR B O 2211 C CB . TYR B 237 ? 0.6805 0.4654 0.6136 -0.0839 0.1272 -0.0689 237 TYR B CB 2212 C CG . TYR B 237 ? 0.7133 0.4914 0.6211 -0.0927 0.1323 -0.0702 237 TYR B CG 2213 C CD1 . TYR B 237 ? 0.7608 0.5256 0.6460 -0.1032 0.1180 -0.0628 237 TYR B CD1 2214 C CD2 . TYR B 237 ? 0.7127 0.4961 0.6236 -0.0916 0.1506 -0.0797 237 TYR B CD2 2215 C CE1 . TYR B 237 ? 0.7834 0.5415 0.6457 -0.1138 0.1260 -0.0659 237 TYR B CE1 2216 C CE2 . TYR B 237 ? 0.7331 0.5121 0.6305 -0.1004 0.1575 -0.0845 237 TYR B CE2 2217 C CZ . TYR B 237 ? 0.8508 0.6178 0.7221 -0.1121 0.1474 -0.0782 237 TYR B CZ 2218 O OH . TYR B 237 ? 0.8765 0.6387 0.7347 -0.1231 0.1574 -0.0848 237 TYR B OH 2219 N N . ASN B 238 ? 0.7228 0.4841 0.5813 -0.1361 0.1190 -0.0732 238 ASN B N 2220 C CA . ASN B 238 ? 0.7423 0.4967 0.5685 -0.1596 0.1343 -0.0846 238 ASN B CA 2221 C C . ASN B 238 ? 0.7608 0.5263 0.6029 -0.1531 0.1601 -0.0975 238 ASN B C 2222 O O . ASN B 238 ? 0.7684 0.5268 0.5934 -0.1627 0.1666 -0.1005 238 ASN B O 2223 C CB . ASN B 238 ? 0.8057 0.5336 0.5796 -0.1871 0.1188 -0.0773 238 ASN B CB 2224 C CG . ASN B 238 ? 1.1447 0.8595 0.8751 -0.2193 0.1360 -0.0910 238 ASN B CG 2225 O OD1 . ASN B 238 ? 1.0625 0.7895 0.8061 -0.2217 0.1584 -0.1075 238 ASN B OD1 2226 N ND2 . ASN B 238 ? 1.0993 0.7858 0.7746 -0.2475 0.1261 -0.0852 238 ASN B ND2 2227 N N . SER B 239 ? 0.6789 0.4602 0.5571 -0.1368 0.1721 -0.1045 239 SER B N 2228 C CA . SER B 239 ? 0.6515 0.4419 0.5572 -0.1267 0.1888 -0.1147 239 SER B CA 2229 C C . SER B 239 ? 0.7026 0.4957 0.6135 -0.1430 0.2104 -0.1352 239 SER B C 2230 O O . SER B 239 ? 0.7030 0.4983 0.6143 -0.1512 0.2161 -0.1425 239 SER B O 2231 C CB . SER B 239 ? 0.6676 0.4663 0.6050 -0.1047 0.1867 -0.1101 239 SER B CB 2232 O OG . SER B 239 ? 0.7648 0.5675 0.7298 -0.0971 0.1970 -0.1189 239 SER B OG 2233 N N . PRO B 240 ? 0.6538 0.4482 0.5769 -0.1471 0.2240 -0.1472 240 PRO B N 2234 C CA . PRO B 240 ? 0.6594 0.4586 0.6021 -0.1625 0.2485 -0.1723 240 PRO B CA 2235 C C . PRO B 240 ? 0.6755 0.4863 0.6721 -0.1452 0.2521 -0.1800 240 PRO B C 2236 O O . PRO B 240 ? 0.6747 0.4910 0.7003 -0.1553 0.2711 -0.2023 240 PRO B O 2237 C CB . PRO B 240 ? 0.6909 0.4880 0.6371 -0.1715 0.2604 -0.1829 240 PRO B CB 2238 C CG . PRO B 240 ? 0.7263 0.5226 0.6761 -0.1497 0.2405 -0.1634 240 PRO B CG 2239 C CD . PRO B 240 ? 0.6642 0.4565 0.5906 -0.1385 0.2189 -0.1411 240 PRO B CD 2240 N N . LEU B 241 ? 0.6050 0.4166 0.6142 -0.1217 0.2341 -0.1623 241 LEU B N 2241 C CA . LEU B 241 ? 0.5838 0.3985 0.6341 -0.1061 0.2307 -0.1632 241 LEU B CA 2242 C C . LEU B 241 ? 0.6329 0.4488 0.6772 -0.1059 0.2292 -0.1593 241 LEU B C 2243 O O . LEU B 241 ? 0.6178 0.4332 0.6910 -0.0961 0.2265 -0.1595 241 LEU B O 2244 C CB . LEU B 241 ? 0.5706 0.3785 0.6272 -0.0863 0.2130 -0.1464 241 LEU B CB 2245 C CG . LEU B 241 ? 0.6286 0.4344 0.6933 -0.0837 0.2104 -0.1478 241 LEU B CG 2246 C CD1 . LEU B 241 ? 0.6247 0.4208 0.6732 -0.0689 0.1926 -0.1282 241 LEU B CD1 2247 C CD2 . LEU B 241 ? 0.6565 0.4650 0.7759 -0.0827 0.2152 -0.1652 241 LEU B CD2 2248 N N . VAL B 242 ? 0.6044 0.4194 0.6115 -0.1175 0.2280 -0.1549 242 VAL B N 2249 C CA . VAL B 242 ? 0.6045 0.4210 0.6049 -0.1194 0.2252 -0.1517 242 VAL B CA 2250 C C . VAL B 242 ? 0.6828 0.4975 0.6588 -0.1449 0.2359 -0.1655 242 VAL B C 2251 O O . VAL B 242 ? 0.6981 0.5051 0.6410 -0.1602 0.2360 -0.1659 242 VAL B O 2252 C CB . VAL B 242 ? 0.6487 0.4627 0.6316 -0.1094 0.2079 -0.1322 242 VAL B CB 2253 C CG1 . VAL B 242 ? 0.6461 0.4631 0.6332 -0.1097 0.2052 -0.1306 242 VAL B CG1 2254 C CG2 . VAL B 242 ? 0.6301 0.4413 0.6251 -0.0907 0.2012 -0.1211 242 VAL B CG2 2255 N N . PRO B 243 ? 0.6490 0.4671 0.6355 -0.1528 0.2452 -0.1773 243 PRO B N 2256 C CA . PRO B 243 ? 0.6831 0.4950 0.6376 -0.1816 0.2565 -0.1917 243 PRO B CA 2257 C C . PRO B 243 ? 0.7638 0.5636 0.6687 -0.1937 0.2368 -0.1766 243 PRO B C 2258 O O . PRO B 243 ? 0.7420 0.5436 0.6518 -0.1774 0.2167 -0.1584 243 PRO B O 2259 C CB . PRO B 243 ? 0.7007 0.5198 0.6860 -0.1836 0.2700 -0.2078 243 PRO B CB 2260 C CG . PRO B 243 ? 0.7247 0.5499 0.7409 -0.1574 0.2567 -0.1929 243 PRO B CG 2261 C CD . PRO B 243 ? 0.6498 0.4741 0.6731 -0.1391 0.2461 -0.1784 243 PRO B CD 2262 N N . ARG B 244 ? 0.7709 0.5555 0.6288 -0.2246 0.2422 -0.1852 244 ARG B N 2263 C CA . ARG B 244 ? 0.8086 0.5739 0.6143 -0.2420 0.2182 -0.1706 244 ARG B CA 2264 C C . ARG B 244 ? 0.8755 0.6420 0.6842 -0.2449 0.2095 -0.1706 244 ARG B C 2265 O O . ARG B 244 ? 0.8598 0.6375 0.6953 -0.2445 0.2297 -0.1876 244 ARG B O 2266 C CB . ARG B 244 ? 0.8650 0.6068 0.6102 -0.2803 0.2284 -0.1810 244 ARG B CB 2267 C CG . ARG B 244 ? 1.0192 0.7339 0.7076 -0.2959 0.1965 -0.1591 244 ARG B CG 2268 C CD . ARG B 244 ? 1.1822 0.8664 0.7988 -0.3404 0.2079 -0.1696 244 ARG B CD 2269 N NE . ARG B 244 ? 1.2566 0.9445 0.8781 -0.3441 0.2347 -0.1826 244 ARG B NE 2270 C CZ . ARG B 244 ? 1.4683 1.1332 1.0362 -0.3831 0.2562 -0.1981 244 ARG B CZ 2271 N NH1 . ARG B 244 ? 1.2913 0.9635 0.8761 -0.3834 0.2811 -0.2114 244 ARG B NH1 2272 N NH2 . ARG B 244 ? 1.3611 0.9936 0.8563 -0.4247 0.2534 -0.2015 244 ARG B NH2 2273 N N . ASN B 245 ? 0.8587 0.6133 0.6461 -0.2475 0.1779 -0.1522 245 ASN B N 2274 C CA . ASN B 245 ? 0.8693 0.6237 0.6609 -0.2514 0.1656 -0.1516 245 ASN B CA 2275 C C . ASN B 245 ? 0.9882 0.7215 0.7252 -0.2904 0.1741 -0.1662 245 ASN B C 2276 O O . ASN B 245 ? 1.0348 0.7407 0.7114 -0.3185 0.1636 -0.1618 245 ASN B O 2277 C CB . ASN B 245 ? 0.8788 0.6272 0.6765 -0.2417 0.1270 -0.1295 245 ASN B CB 2278 C CG . ASN B 245 ? 1.1514 0.9078 0.9779 -0.2356 0.1157 -0.1293 245 ASN B CG 2279 O OD1 . ASN B 245 ? 1.1103 0.8530 0.9073 -0.2590 0.1087 -0.1345 245 ASN B OD1 2280 N ND2 . ASN B 245 ? 1.0044 0.7813 0.8871 -0.2064 0.1143 -0.1241 245 ASN B ND2 2281 N N . ALA B 246 ? 0.9488 0.6924 0.7043 -0.2944 0.1949 -0.1847 246 ALA B N 2282 C CA . ALA B 246 ? 1.0050 0.7309 0.7141 -0.3322 0.2105 -0.2045 246 ALA B CA 2283 C C . ALA B 246 ? 1.1227 0.8196 0.7745 -0.3593 0.1777 -0.1926 246 ALA B C 2284 O O . ALA B 246 ? 1.1847 0.8517 0.7667 -0.4000 0.1822 -0.2014 246 ALA B O 2285 C CB . ALA B 246 ? 0.9882 0.7349 0.7442 -0.3251 0.2398 -0.2274 246 ALA B CB 2286 N N . GLU B 247 ? 1.0662 0.7694 0.7477 -0.3391 0.1447 -0.1738 247 GLU B N 2287 C CA . GLU B 247 ? 1.1161 0.7939 0.7615 -0.3587 0.1048 -0.1603 247 GLU B CA 2288 C C . GLU B 247 ? 1.1998 0.8532 0.8172 -0.3624 0.0619 -0.1340 247 GLU B C 2289 O O . GLU B 247 ? 1.2081 0.8519 0.8368 -0.3591 0.0201 -0.1172 247 GLU B O 2290 C CB . GLU B 247 ? 1.0940 0.7945 0.8014 -0.3342 0.0941 -0.1581 247 GLU B CB 2291 C CG . GLU B 247 ? 1.2576 0.9555 0.9524 -0.3543 0.1080 -0.1766 247 GLU B CG 2292 C CD . GLU B 247 ? 1.5183 1.2294 1.2190 -0.3600 0.1577 -0.2045 247 GLU B CD 2293 O OE1 . GLU B 247 ? 1.4006 1.1419 1.1666 -0.3301 0.1789 -0.2115 247 GLU B OE1 2294 O OE2 . GLU B 247 ? 1.5011 1.1897 1.1420 -0.3965 0.1749 -0.2203 247 GLU B OE2 2295 N N . LEU B 248 ? 1.1720 0.8144 0.7573 -0.3703 0.0714 -0.1319 248 LEU B N 2296 C CA . LEU B 248 ? 1.1974 0.8161 0.7558 -0.3740 0.0370 -0.1090 248 LEU B CA 2297 C C . LEU B 248 ? 1.2917 0.8893 0.7845 -0.4042 0.0634 -0.1190 248 LEU B C 2298 O O . LEU B 248 ? 1.2547 0.8751 0.7685 -0.3977 0.1089 -0.1408 248 LEU B O 2299 C CB . LEU B 248 ? 1.1223 0.7747 0.7606 -0.3272 0.0348 -0.0993 248 LEU B CB 2300 C CG . LEU B 248 ? 1.1757 0.8224 0.8118 -0.3175 0.0249 -0.0854 248 LEU B CG 2301 C CD1 . LEU B 248 ? 1.1298 0.7963 0.8373 -0.2813 0.0014 -0.0716 248 LEU B CD1 2302 C CD2 . LEU B 248 ? 1.1739 0.8393 0.8169 -0.3091 0.0691 -0.1005 248 LEU B CD2 2303 N N . GLY B 249 ? 1.3241 0.8765 0.7411 -0.4383 0.0342 -0.1040 249 GLY B N 2304 C CA . GLY B 249 ? 1.3739 0.8999 0.7205 -0.4727 0.0575 -0.1126 249 GLY B CA 2305 C C . GLY B 249 ? 1.3810 0.9220 0.7589 -0.4477 0.0635 -0.1048 249 GLY B C 2306 O O . GLY B 249 ? 1.2962 0.8804 0.7502 -0.4083 0.0873 -0.1131 249 GLY B O 2307 N N . ASP B 250 ? 1.3946 0.8968 0.7110 -0.4719 0.0396 -0.0877 250 ASP B N 2308 C CA . ASP B 250 ? 1.3594 0.8711 0.6994 -0.4514 0.0416 -0.0788 250 ASP B CA 2309 C C . ASP B 250 ? 1.3762 0.8889 0.7606 -0.4207 -0.0103 -0.0492 250 ASP B C 2310 O O . ASP B 250 ? 1.3914 0.8827 0.7561 -0.4242 -0.0332 -0.0319 250 ASP B O 2311 C CB . ASP B 250 ? 1.4606 0.9308 0.7116 -0.4967 0.0536 -0.0815 250 ASP B CB 2312 C CG . ASP B 250 ? 1.5551 1.0500 0.8352 -0.4831 0.0951 -0.0967 250 ASP B CG 2313 O OD1 . ASP B 250 ? 1.4882 1.0170 0.8421 -0.4382 0.0904 -0.0888 250 ASP B OD1 2314 O OD2 . ASP B 250 ? 1.6783 1.1564 0.9066 -0.5196 0.1321 -0.1175 250 ASP B OD2 2315 N N . ARG B 251 ? 1.2827 0.8209 0.7327 -0.3913 -0.0268 -0.0460 251 ARG B N 2316 C CA . ARG B 251 ? 1.2512 0.7953 0.7597 -0.3617 -0.0708 -0.0247 251 ARG B CA 2317 C C . ARG B 251 ? 1.2221 0.8031 0.7988 -0.3211 -0.0513 -0.0267 251 ARG B C 2318 O O . ARG B 251 ? 1.1542 0.7740 0.7796 -0.2961 -0.0144 -0.0432 251 ARG B O 2319 C CB . ARG B 251 ? 1.2348 0.7928 0.7912 -0.3483 -0.0905 -0.0246 251 ARG B CB 2320 C CG . ARG B 251 ? 1.4424 0.9589 0.9318 -0.3889 -0.1205 -0.0189 251 ARG B CG 2321 C CD . ARG B 251 ? 1.5405 1.0699 1.0850 -0.3742 -0.1463 -0.0172 251 ARG B CD 2322 N NE . ARG B 251 ? 1.6228 1.1518 1.2318 -0.3510 -0.1952 0.0019 251 ARG B NE 2323 C CZ . ARG B 251 ? 1.8589 1.3445 1.4439 -0.3714 -0.2564 0.0239 251 ARG B CZ 2324 N NH1 . ARG B 251 ? 1.7881 1.2219 1.2719 -0.4189 -0.2774 0.0320 251 ARG B NH1 2325 N NH2 . ARG B 251 ? 1.6671 1.1576 1.3294 -0.3465 -0.2979 0.0370 251 ARG B NH2 2326 N N . LYS B 252 ? 1.1882 0.7533 0.7637 -0.3173 -0.0771 -0.0097 252 LYS B N 2327 C CA . LYS B 252 ? 1.1226 0.7170 0.7556 -0.2825 -0.0622 -0.0107 252 LYS B CA 2328 C C . LYS B 252 ? 1.1661 0.7533 0.8431 -0.2649 -0.1053 0.0081 252 LYS B C 2329 O O . LYS B 252 ? 1.2174 0.7681 0.8691 -0.2843 -0.1522 0.0259 252 LYS B O 2330 C CB . LYS B 252 ? 1.1515 0.7476 0.7505 -0.2904 -0.0248 -0.0207 252 LYS B CB 2331 C CG . LYS B 252 ? 1.4128 0.9654 0.9195 -0.3357 -0.0272 -0.0174 252 LYS B CG 2332 C CD . LYS B 252 ? 1.5260 1.0899 1.0196 -0.3392 0.0175 -0.0338 252 LYS B CD 2333 C CE . LYS B 252 ? 1.7500 1.2721 1.1523 -0.3878 0.0255 -0.0364 252 LYS B CE 2334 N NZ . LYS B 252 ? 1.9195 1.4015 1.2802 -0.4031 -0.0145 -0.0112 252 LYS B NZ 2335 N N . GLY B 253 ? 1.0580 0.6786 0.8032 -0.2294 -0.0897 0.0029 253 GLY B N 2336 C CA . GLY B 253 ? 1.0393 0.6620 0.8430 -0.2077 -0.1188 0.0134 253 GLY B CA 2337 C C . GLY B 253 ? 1.0592 0.6914 0.8682 -0.1941 -0.0983 0.0119 253 GLY B C 2338 O O . GLY B 253 ? 1.0393 0.6814 0.8173 -0.1974 -0.0607 0.0014 253 GLY B O 2339 N N . LYS B 254 ? 1.0082 0.6371 0.8615 -0.1789 -0.1235 0.0209 254 LYS B N 2340 C CA . LYS B 254 ? 0.9809 0.6178 0.8425 -0.1655 -0.1070 0.0196 254 LYS B CA 2341 C C . LYS B 254 ? 0.9928 0.6480 0.9376 -0.1364 -0.1154 0.0165 254 LYS B C 2342 O O . LYS B 254 ? 1.0005 0.6477 0.9921 -0.1327 -0.1514 0.0225 254 LYS B O 2343 C CB . LYS B 254 ? 1.0652 0.6649 0.8596 -0.1914 -0.1240 0.0342 254 LYS B CB 2344 C CG . LYS B 254 ? 1.2981 0.8568 1.0831 -0.2080 -0.1820 0.0561 254 LYS B CG 2345 C CD . LYS B 254 ? 1.4788 0.9976 1.1897 -0.2362 -0.1947 0.0705 254 LYS B CD 2346 C CE . LYS B 254 ? 1.6804 1.1531 1.3830 -0.2526 -0.2581 0.0952 254 LYS B CE 2347 N NZ . LYS B 254 ? 1.8631 1.2916 1.4846 -0.2842 -0.2701 0.1105 254 LYS B NZ 2348 N N . ILE B 255 ? 0.9057 0.5848 0.8719 -0.1169 -0.0816 0.0052 255 ILE B N 2349 C CA . ILE B 255 ? 0.8705 0.5674 0.9101 -0.0921 -0.0795 -0.0027 255 ILE B CA 2350 C C . ILE B 255 ? 0.9082 0.6036 0.9385 -0.0855 -0.0680 -0.0021 255 ILE B C 2351 O O . ILE B 255 ? 0.8976 0.5939 0.8782 -0.0917 -0.0439 -0.0034 255 ILE B O 2352 C CB . ILE B 255 ? 0.8679 0.5965 0.9532 -0.0748 -0.0476 -0.0214 255 ILE B CB 2353 C CG1 . ILE B 255 ? 0.8466 0.5904 0.8954 -0.0717 -0.0047 -0.0305 255 ILE B CG1 2354 C CG2 . ILE B 255 ? 0.8868 0.6171 0.9908 -0.0805 -0.0619 -0.0225 255 ILE B CG2 2355 C CD1 . ILE B 255 ? 0.9049 0.6719 0.9944 -0.0541 0.0262 -0.0467 255 ILE B CD1 2356 N N . HIS B 256 ? 0.8621 0.5555 0.9457 -0.0733 -0.0855 -0.0019 256 HIS B N 2357 C CA . HIS B 256 ? 0.8506 0.5430 0.9316 -0.0662 -0.0755 -0.0026 256 HIS B CA 2358 C C . HIS B 256 ? 0.8559 0.5754 0.9480 -0.0507 -0.0308 -0.0206 256 HIS B C 2359 O O . HIS B 256 ? 0.8278 0.5658 0.9552 -0.0416 -0.0137 -0.0338 256 HIS B O 2360 C CB . HIS B 256 ? 0.8727 0.5541 1.0133 -0.0583 -0.1076 0.0010 256 HIS B CB 2361 C CG . HIS B 256 ? 0.9666 0.6108 1.0766 -0.0766 -0.1537 0.0237 256 HIS B CG 2362 N ND1 . HIS B 256 ? 1.0152 0.6383 1.0459 -0.0953 -0.1522 0.0364 256 HIS B ND1 2363 C CD2 . HIS B 256 ? 1.0212 0.6432 1.1718 -0.0801 -0.2028 0.0352 256 HIS B CD2 2364 C CE1 . HIS B 256 ? 1.0596 0.6457 1.0746 -0.1123 -0.1989 0.0565 256 HIS B CE1 2365 N NE2 . HIS B 256 ? 1.0703 0.6531 1.1562 -0.1032 -0.2339 0.0579 256 HIS B NE2 2366 N N . ILE B 257 ? 0.8065 0.5250 0.8645 -0.0502 -0.0131 -0.0205 257 ILE B N 2367 C CA . ILE B 257 ? 0.7741 0.5106 0.8310 -0.0392 0.0235 -0.0342 257 ILE B CA 2368 C C . ILE B 257 ? 0.8155 0.5528 0.8960 -0.0284 0.0305 -0.0407 257 ILE B C 2369 O O . ILE B 257 ? 0.8248 0.5480 0.9037 -0.0311 0.0106 -0.0319 257 ILE B O 2370 C CB . ILE B 257 ? 0.8092 0.5471 0.8105 -0.0475 0.0428 -0.0329 257 ILE B CB 2371 C CG1 . ILE B 257 ? 0.8336 0.5552 0.7932 -0.0598 0.0339 -0.0228 257 ILE B CG1 2372 C CG2 . ILE B 257 ? 0.8210 0.5632 0.8099 -0.0556 0.0449 -0.0333 257 ILE B CG2 2373 C CD1 . ILE B 257 ? 0.9096 0.6364 0.8370 -0.0622 0.0580 -0.0281 257 ILE B CD1 2374 N N . PRO B 258 ? 0.7546 0.5049 0.8516 -0.0188 0.0586 -0.0561 258 PRO B N 2375 C CA . PRO B 258 ? 0.7505 0.4992 0.8646 -0.0117 0.0671 -0.0642 258 PRO B CA 2376 C C . PRO B 258 ? 0.8004 0.5420 0.8668 -0.0142 0.0732 -0.0580 258 PRO B C 2377 O O . PRO B 258 ? 0.7945 0.5348 0.8195 -0.0210 0.0754 -0.0505 258 PRO B O 2378 C CB . PRO B 258 ? 0.7633 0.5230 0.8994 -0.0071 0.0966 -0.0833 258 PRO B CB 2379 C CG . PRO B 258 ? 0.8135 0.5781 0.9169 -0.0117 0.1080 -0.0807 258 PRO B CG 2380 C CD . PRO B 258 ? 0.7617 0.5243 0.8575 -0.0172 0.0834 -0.0667 258 PRO B CD 2381 N N . PHE B 259 ? 0.7583 0.4958 0.8367 -0.0092 0.0770 -0.0637 259 PHE B N 2382 C CA . PHE B 259 ? 0.7564 0.4873 0.8003 -0.0101 0.0822 -0.0605 259 PHE B CA 2383 C C . PHE B 259 ? 0.8134 0.5345 0.8249 -0.0187 0.0649 -0.0450 259 PHE B C 2384 O O . PHE B 259 ? 0.8040 0.5257 0.7805 -0.0231 0.0745 -0.0431 259 PHE B O 2385 C CB . PHE B 259 ? 0.7730 0.5067 0.7869 -0.0100 0.1061 -0.0677 259 PHE B CB 2386 C CG . PHE B 259 ? 0.7928 0.5314 0.8205 -0.0088 0.1260 -0.0813 259 PHE B CG 2387 C CD1 . PHE B 259 ? 0.8388 0.5763 0.8967 -0.0067 0.1384 -0.0968 259 PHE B CD1 2388 C CD2 . PHE B 259 ? 0.8166 0.5592 0.8264 -0.0120 0.1352 -0.0806 259 PHE B CD2 2389 C CE1 . PHE B 259 ? 0.8572 0.5965 0.9234 -0.0103 0.1617 -0.1121 259 PHE B CE1 2390 C CE2 . PHE B 259 ? 0.8585 0.6020 0.8755 -0.0141 0.1550 -0.0930 259 PHE B CE2 2391 C CZ . PHE B 259 ? 0.8445 0.5856 0.8871 -0.0145 0.1695 -0.1090 259 PHE B CZ 2392 N N . PRO B 260 ? 0.7861 0.4954 0.8088 -0.0232 0.0394 -0.0347 260 PRO B N 2393 C CA . PRO B 260 ? 0.8005 0.4956 0.7825 -0.0369 0.0271 -0.0212 260 PRO B CA 2394 C C . PRO B 260 ? 0.8404 0.5305 0.8091 -0.0360 0.0330 -0.0220 260 PRO B C 2395 O O . PRO B 260 ? 0.8249 0.5180 0.8193 -0.0250 0.0383 -0.0302 260 PRO B O 2396 C CB . PRO B 260 ? 0.8509 0.5282 0.8459 -0.0446 -0.0061 -0.0083 260 PRO B CB 2397 C CG . PRO B 260 ? 0.8977 0.5846 0.9524 -0.0318 -0.0117 -0.0168 260 PRO B CG 2398 C CD . PRO B 260 ? 0.8148 0.5197 0.8888 -0.0184 0.0191 -0.0352 260 PRO B CD 2399 N N . LEU B 261 ? 0.8037 0.4857 0.7330 -0.0493 0.0343 -0.0157 261 LEU B N 2400 C CA . LEU B 261 ? 0.8001 0.4774 0.7174 -0.0504 0.0397 -0.0169 261 LEU B CA 2401 C C . LEU B 261 ? 0.8697 0.5279 0.7939 -0.0544 0.0171 -0.0070 261 LEU B C 2402 O O . LEU B 261 ? 0.8925 0.5332 0.8059 -0.0669 -0.0047 0.0056 261 LEU B O 2403 C CB . LEU B 261 ? 0.8059 0.4830 0.6879 -0.0648 0.0526 -0.0179 261 LEU B CB 2404 C CG . LEU B 261 ? 0.8603 0.5372 0.7371 -0.0652 0.0622 -0.0230 261 LEU B CG 2405 C CD1 . LEU B 261 ? 0.8358 0.5277 0.7292 -0.0499 0.0762 -0.0342 261 LEU B CD1 2406 C CD2 . LEU B 261 ? 0.9058 0.5774 0.7543 -0.0854 0.0720 -0.0245 261 LEU B CD2 2407 N N . ALA B 262 ? 0.8169 0.4753 0.7574 -0.0451 0.0202 -0.0121 262 ALA B N 2408 C CA . ALA B 262 ? 0.8330 0.4737 0.7861 -0.0468 0.0000 -0.0045 262 ALA B CA 2409 C C . ALA B 262 ? 0.8718 0.5134 0.8222 -0.0428 0.0111 -0.0108 262 ALA B C 2410 O O . ALA B 262 ? 0.8435 0.4999 0.7968 -0.0334 0.0308 -0.0232 262 ALA B O 2411 C CB . ALA B 262 ? 0.8402 0.4814 0.8461 -0.0342 -0.0140 -0.0078 262 ALA B CB 2412 N N . ASN B 263 ? 0.8503 0.4727 0.7929 -0.0515 -0.0041 -0.0015 263 ASN B N 2413 C CA . ASN B 263 ? 0.8429 0.4646 0.7850 -0.0487 0.0040 -0.0070 263 ASN B CA 2414 C C . ASN B 263 ? 0.8763 0.5024 0.8609 -0.0319 0.0036 -0.0174 263 ASN B C 2415 O O . ASN B 263 ? 0.8791 0.4973 0.8985 -0.0275 -0.0139 -0.0148 263 ASN B O 2416 C CB . ASN B 263 ? 0.8877 0.4863 0.8023 -0.0669 -0.0084 0.0055 263 ASN B CB 2417 C CG . ASN B 263 ? 1.2463 0.8189 1.1434 -0.0837 -0.0350 0.0236 263 ASN B CG 2418 O OD1 . ASN B 263 ? 1.1919 0.7521 1.1196 -0.0781 -0.0605 0.0310 263 ASN B OD1 2419 N ND2 . ASN B 263 ? 1.1822 0.7436 1.0305 -0.1066 -0.0302 0.0300 263 ASN B ND2 2420 N N . VAL B 264 ? 0.8149 0.4518 0.7985 -0.0242 0.0224 -0.0304 264 VAL B N 2421 C CA . VAL B 264 ? 0.8063 0.4457 0.8195 -0.0126 0.0290 -0.0444 264 VAL B CA 2422 C C . VAL B 264 ? 0.8575 0.4927 0.8568 -0.0137 0.0342 -0.0483 264 VAL B C 2423 O O . VAL B 264 ? 0.8581 0.4877 0.8347 -0.0231 0.0300 -0.0395 264 VAL B O 2424 C CB . VAL B 264 ? 0.8421 0.4949 0.8631 -0.0049 0.0477 -0.0590 264 VAL B CB 2425 C CG1 . VAL B 264 ? 0.8381 0.4955 0.8879 -0.0022 0.0421 -0.0586 264 VAL B CG1 2426 C CG2 . VAL B 264 ? 0.8307 0.4911 0.8147 -0.0077 0.0612 -0.0599 264 VAL B CG2 2427 N N . THR B 265 ? 0.8136 0.4501 0.8258 -0.0065 0.0448 -0.0632 265 THR B N 2428 C CA . THR B 265 ? 0.8157 0.4471 0.8155 -0.0074 0.0483 -0.0683 265 THR B CA 2429 C C . THR B 265 ? 0.8623 0.4975 0.8395 -0.0063 0.0632 -0.0795 265 THR B C 2430 O O . THR B 265 ? 0.8599 0.4969 0.8402 -0.0040 0.0747 -0.0900 265 THR B O 2431 C CB . THR B 265 ? 0.9323 0.5537 0.9627 -0.0041 0.0421 -0.0742 265 THR B CB 2432 O OG1 . THR B 265 ? 0.9393 0.5551 1.0013 -0.0033 0.0257 -0.0659 265 THR B OG1 2433 C CG2 . THR B 265 ? 0.9216 0.5346 0.9400 -0.0084 0.0365 -0.0706 265 THR B CG2 2434 N N . CYS B 266 ? 0.8176 0.4515 0.7729 -0.0098 0.0617 -0.0774 266 CYS B N 2435 C CA . CYS B 266 ? 0.8205 0.4515 0.7519 -0.0108 0.0671 -0.0844 266 CYS B CA 2436 C C . CYS B 266 ? 0.8801 0.4991 0.8063 -0.0123 0.0644 -0.0921 266 CYS B C 2437 O O . CYS B 266 ? 0.8718 0.4900 0.8070 -0.0133 0.0565 -0.0882 266 CYS B O 2438 C CB . CYS B 266 ? 0.8155 0.4536 0.7359 -0.0135 0.0634 -0.0774 266 CYS B CB 2439 S SG . CYS B 266 ? 0.8536 0.5026 0.7699 -0.0130 0.0696 -0.0729 266 CYS B SG 2440 N N . ARG B 267 ? 0.8532 0.4607 0.7620 -0.0149 0.0722 -0.1039 267 ARG B N 2441 C CA . ARG B 267 ? 0.8699 0.4622 0.7666 -0.0191 0.0703 -0.1130 267 ARG B CA 2442 C C . ARG B 267 ? 0.9212 0.5052 0.7926 -0.0234 0.0567 -0.1083 267 ARG B C 2443 O O . ARG B 267 ? 0.9247 0.5034 0.7722 -0.0270 0.0546 -0.1058 267 ARG B O 2444 C CB . ARG B 267 ? 0.9023 0.4810 0.7848 -0.0254 0.0870 -0.1304 267 ARG B CB 2445 C CG . ARG B 267 ? 1.0277 0.6147 0.9507 -0.0208 0.1002 -0.1401 267 ARG B CG 2446 C CD . ARG B 267 ? 1.1533 0.7380 1.1082 -0.0174 0.0965 -0.1456 267 ARG B CD 2447 N NE . ARG B 267 ? 1.2651 0.8529 1.2637 -0.0147 0.1094 -0.1608 267 ARG B NE 2448 C CZ . ARG B 267 ? 1.4509 1.0368 1.4909 -0.0106 0.1061 -0.1676 267 ARG B CZ 2449 N NH1 . ARG B 267 ? 1.2906 0.8709 1.3270 -0.0098 0.0919 -0.1596 267 ARG B NH1 2450 N NH2 . ARG B 267 ? 1.2931 0.8824 1.3841 -0.0076 0.1167 -0.1836 267 ARG B NH2 2451 N N . VAL B 268 ? 0.8713 0.4535 0.7528 -0.0232 0.0454 -0.1070 268 VAL B N 2452 C CA . VAL B 268 ? 0.8753 0.4502 0.7474 -0.0264 0.0284 -0.1041 268 VAL B CA 2453 C C . VAL B 268 ? 0.9480 0.5029 0.8043 -0.0322 0.0198 -0.1120 268 VAL B C 2454 O O . VAL B 268 ? 0.9391 0.4947 0.8100 -0.0309 0.0253 -0.1175 268 VAL B O 2455 C CB . VAL B 268 ? 0.8983 0.4908 0.8023 -0.0230 0.0218 -0.0969 268 VAL B CB 2456 C CG1 . VAL B 268 ? 0.8769 0.4838 0.7863 -0.0209 0.0283 -0.0906 268 VAL B CG1 2457 C CG2 . VAL B 268 ? 0.8842 0.4843 0.8129 -0.0222 0.0260 -0.0964 268 VAL B CG2 2458 N N . PRO B 269 ? 0.7168 0.9704 0.8616 -0.2265 -0.0450 -0.1032 269 PRO B N 2459 C CA . PRO B 269 ? 0.7152 0.9889 0.8253 -0.2199 -0.0428 -0.0960 269 PRO B CA 2460 C C . PRO B 269 ? 0.7515 0.9724 0.8389 -0.1943 -0.0568 -0.0901 269 PRO B C 2461 O O . PRO B 269 ? 0.7436 0.9107 0.8365 -0.1888 -0.0657 -0.0786 269 PRO B O 2462 C CB . PRO B 269 ? 0.7717 1.0597 0.8724 -0.2537 -0.0304 -0.0571 269 PRO B CB 2463 C CG . PRO B 269 ? 0.8454 1.0813 0.9665 -0.2711 -0.0354 -0.0336 269 PRO B CG 2464 C CD . PRO B 269 ? 0.7662 0.9934 0.9218 -0.2571 -0.0423 -0.0657 269 PRO B CD 2465 N N . LYS B 270 ? 0.7017 0.9429 0.7656 -0.1788 -0.0598 -0.0994 270 LYS B N 2466 C CA . LYS B 270 ? 0.6892 0.8886 0.7334 -0.1574 -0.0723 -0.0951 270 LYS B CA 2467 C C . LYS B 270 ? 0.7574 0.9552 0.7793 -0.1660 -0.0689 -0.0662 270 LYS B C 2468 O O . LYS B 270 ? 0.7616 1.0094 0.7732 -0.1723 -0.0615 -0.0661 270 LYS B O 2469 C CB . LYS B 270 ? 0.7041 0.9192 0.7410 -0.1314 -0.0838 -0.1287 270 LYS B CB 2470 C CG . LYS B 270 ? 0.8535 1.0506 0.9038 -0.1158 -0.0922 -0.1555 270 LYS B CG 2471 C CD . LYS B 270 ? 0.9664 1.1702 1.0045 -0.0905 -0.1085 -0.1868 270 LYS B CD 2472 C CE . LYS B 270 ? 1.0941 1.2726 1.1385 -0.0731 -0.1187 -0.2110 270 LYS B CE 2473 N NZ . LYS B 270 ? 1.2089 1.3848 1.2375 -0.0485 -0.1395 -0.2402 270 LYS B NZ 2474 N N . ALA B 271 ? 0.7206 0.8657 0.7350 -0.1644 -0.0752 -0.0442 271 ALA B N 2475 C CA . ALA B 271 ? 0.7372 0.8708 0.7288 -0.1683 -0.0753 -0.0191 271 ALA B CA 2476 C C . ALA B 271 ? 0.7789 0.9365 0.7545 -0.1493 -0.0798 -0.0327 271 ALA B C 2477 O O . ALA B 271 ? 0.7532 0.9059 0.7339 -0.1305 -0.0893 -0.0558 271 ALA B O 2478 C CB . ALA B 271 ? 0.7482 0.8232 0.7384 -0.1640 -0.0857 -0.0039 271 ALA B CB 2479 N N . ARG B 272 ? 0.7556 0.9388 0.7119 -0.1535 -0.0750 -0.0187 272 ARG B N 2480 C CA . ARG B 272 ? 0.7471 0.9585 0.6913 -0.1332 -0.0816 -0.0332 272 ARG B CA 2481 C C . ARG B 272 ? 0.7830 0.9499 0.7260 -0.1137 -0.0961 -0.0387 272 ARG B C 2482 O O . ARG B 272 ? 0.7814 0.9032 0.7206 -0.1173 -0.0981 -0.0213 272 ARG B O 2483 C CB . ARG B 272 ? 0.7768 1.0280 0.6993 -0.1396 -0.0733 -0.0163 272 ARG B CB 2484 C CG . ARG B 272 ? 0.9349 1.1438 0.8371 -0.1489 -0.0722 0.0173 272 ARG B CG 2485 C CD . ARG B 272 ? 1.0928 1.3379 0.9734 -0.1681 -0.0590 0.0428 272 ARG B CD 2486 N NE . ARG B 272 ? 1.1988 1.5012 1.0628 -0.1511 -0.0583 0.0330 272 ARG B NE 2487 C CZ . ARG B 272 ? 1.4029 1.7539 1.2446 -0.1630 -0.0461 0.0516 272 ARG B CZ 2488 N NH1 . ARG B 272 ? 1.2756 1.6198 1.1084 -0.1965 -0.0332 0.0845 272 ARG B NH1 2489 N NH2 . ARG B 272 ? 1.2304 1.6387 1.0592 -0.1416 -0.0481 0.0379 272 ARG B NH2 2490 N N . ASN B 273 ? 0.7271 0.9079 0.6753 -0.0938 -0.1082 -0.0648 273 ASN B N 2491 C CA . ASN B 273 ? 0.7156 0.8597 0.6665 -0.0783 -0.1224 -0.0715 273 ASN B CA 2492 C C . ASN B 273 ? 0.7788 0.9108 0.7175 -0.0736 -0.1242 -0.0572 273 ASN B C 2493 O O . ASN B 273 ? 0.7831 0.9511 0.7111 -0.0666 -0.1238 -0.0583 273 ASN B O 2494 C CB . ASN B 273 ? 0.7151 0.8768 0.6735 -0.0596 -0.1390 -0.1012 273 ASN B CB 2495 C CG . ASN B 273 ? 0.9940 1.1551 0.9618 -0.0595 -0.1424 -0.1191 273 ASN B CG 2496 O OD1 . ASN B 273 ? 0.9180 1.0422 0.8904 -0.0664 -0.1391 -0.1122 273 ASN B OD1 2497 N ND2 . ASN B 273 ? 0.8895 1.0941 0.8597 -0.0480 -0.1515 -0.1460 273 ASN B ND2 2498 N N . PRO B 274 ? 0.7379 0.8246 0.6776 -0.0757 -0.1264 -0.0458 274 PRO B N 2499 C CA . PRO B 274 ? 0.7482 0.8233 0.6764 -0.0691 -0.1297 -0.0368 274 PRO B CA 2500 C C . PRO B 274 ? 0.7964 0.8826 0.7305 -0.0497 -0.1426 -0.0550 274 PRO B C 2501 O O . PRO B 274 ? 0.7780 0.8638 0.7270 -0.0435 -0.1523 -0.0718 274 PRO B O 2502 C CB . PRO B 274 ? 0.7675 0.7989 0.6995 -0.0755 -0.1308 -0.0269 274 PRO B CB 2503 C CG . PRO B 274 ? 0.8049 0.8263 0.7534 -0.0783 -0.1318 -0.0362 274 PRO B CG 2504 C CD . PRO B 274 ? 0.7469 0.7972 0.6977 -0.0817 -0.1270 -0.0437 274 PRO B CD 2505 N N . THR B 275 ? 0.7702 0.8632 0.6926 -0.0391 -0.1453 -0.0521 275 THR B N 2506 C CA . THR B 275 ? 0.7654 0.8694 0.6970 -0.0184 -0.1595 -0.0709 275 THR B CA 2507 C C . THR B 275 ? 0.8076 0.8738 0.7565 -0.0201 -0.1667 -0.0753 275 THR B C 2508 O O . THR B 275 ? 0.8061 0.8475 0.7495 -0.0254 -0.1630 -0.0651 275 THR B O 2509 C CB . THR B 275 ? 0.8884 1.0114 0.8007 -0.0047 -0.1596 -0.0670 275 THR B CB 2510 O OG1 . THR B 275 ? 0.9007 1.0590 0.7928 -0.0106 -0.1483 -0.0550 275 THR B OG1 2511 C CG2 . THR B 275 ? 0.8667 1.0111 0.7924 0.0211 -0.1762 -0.0912 275 THR B CG2 2512 N N . VAL B 276 ? 0.7569 0.8198 0.7258 -0.0169 -0.1783 -0.0903 276 VAL B N 2513 C CA . VAL B 276 ? 0.7496 0.7815 0.7354 -0.0235 -0.1840 -0.0917 276 VAL B CA 2514 C C . VAL B 276 ? 0.8013 0.8335 0.8047 -0.0110 -0.1987 -0.1064 276 VAL B C 2515 O O . VAL B 276 ? 0.7986 0.8495 0.8119 0.0049 -0.2140 -0.1233 276 VAL B O 2516 C CB . VAL B 276 ? 0.7959 0.8115 0.7887 -0.0342 -0.1861 -0.0916 276 VAL B CB 2517 C CG1 . VAL B 276 ? 0.7980 0.8247 0.8000 -0.0224 -0.2047 -0.1106 276 VAL B CG1 2518 C CG2 . VAL B 276 ? 0.7916 0.7782 0.7943 -0.0471 -0.1850 -0.0841 276 VAL B CG2 2519 N N . THR B 277 ? 0.7572 0.7730 0.7669 -0.0168 -0.1957 -0.1029 277 THR B N 2520 C CA . THR B 277 ? 0.7563 0.7718 0.7875 -0.0088 -0.2077 -0.1174 277 THR B CA 2521 C C . THR B 277 ? 0.8016 0.7969 0.8497 -0.0285 -0.2058 -0.1123 277 THR B C 2522 O O . THR B 277 ? 0.7914 0.7789 0.8293 -0.0416 -0.1927 -0.0994 277 THR B O 2523 C CB . THR B 277 ? 0.8684 0.8950 0.8893 0.0068 -0.2062 -0.1231 277 THR B CB 2524 O OG1 . THR B 277 ? 0.8756 0.8904 0.8754 -0.0024 -0.1929 -0.1084 277 THR B OG1 2525 C CG2 . THR B 277 ? 0.8559 0.9095 0.8635 0.0290 -0.2114 -0.1306 277 THR B CG2 2526 N N . TYR B 278 ? 0.7635 0.7527 0.8383 -0.0309 -0.2202 -0.1220 278 TYR B N 2527 C CA . TYR B 278 ? 0.7652 0.7393 0.8565 -0.0536 -0.2184 -0.1142 278 TYR B CA 2528 C C . TYR B 278 ? 0.8131 0.7969 0.9284 -0.0562 -0.2204 -0.1254 278 TYR B C 2529 O O . TYR B 278 ? 0.8069 0.8025 0.9340 -0.0372 -0.2309 -0.1439 278 TYR B O 2530 C CB . TYR B 278 ? 0.7950 0.7474 0.8975 -0.0625 -0.2340 -0.1114 278 TYR B CB 2531 C CG . TYR B 278 ? 0.8182 0.7646 0.9002 -0.0561 -0.2363 -0.1082 278 TYR B CG 2532 C CD1 . TYR B 278 ? 0.8488 0.8008 0.9351 -0.0372 -0.2567 -0.1249 278 TYR B CD1 2533 C CD2 . TYR B 278 ? 0.8237 0.7637 0.8846 -0.0669 -0.2201 -0.0925 278 TYR B CD2 2534 C CE1 . TYR B 278 ? 0.8602 0.8139 0.9293 -0.0307 -0.2596 -0.1268 278 TYR B CE1 2535 C CE2 . TYR B 278 ? 0.8363 0.7736 0.8814 -0.0608 -0.2224 -0.0934 278 TYR B CE2 2536 C CZ . TYR B 278 ? 0.9355 0.8810 0.9843 -0.0435 -0.2415 -0.1110 278 TYR B CZ 2537 O OH . TYR B 278 ? 0.9478 0.8979 0.9824 -0.0367 -0.2443 -0.1166 278 TYR B OH 2538 N N . GLY B 279 ? 0.7708 0.7543 0.8935 -0.0787 -0.2105 -0.1158 279 GLY B N 2539 C CA . GLY B 279 ? 0.7696 0.7695 0.9177 -0.0873 -0.2096 -0.1265 279 GLY B CA 2540 C C . GLY B 279 ? 0.8290 0.8266 0.9919 -0.1190 -0.2045 -0.1114 279 GLY B C 2541 O O . GLY B 279 ? 0.8331 0.8108 0.9831 -0.1317 -0.2032 -0.0920 279 GLY B O 2542 N N . LYS B 280 ? 0.7869 0.8074 0.9758 -0.1322 -0.2015 -0.1206 280 LYS B N 2543 C CA . LYS B 280 ? 0.8004 0.8287 1.0049 -0.1665 -0.1943 -0.1050 280 LYS B CA 2544 C C . LYS B 280 ? 0.8418 0.8836 1.0194 -0.1771 -0.1756 -0.0872 280 LYS B C 2545 O O . LYS B 280 ? 0.8221 0.8961 0.9931 -0.1695 -0.1652 -0.0983 280 LYS B O 2546 C CB . LYS B 280 ? 0.8359 0.8974 1.0768 -0.1771 -0.1936 -0.1236 280 LYS B CB 2547 C CG . LYS B 280 ? 1.0595 1.1261 1.3257 -0.2171 -0.1909 -0.1063 280 LYS B CG 2548 C CD . LYS B 280 ? 1.1923 1.3073 1.4550 -0.2390 -0.1685 -0.1000 280 LYS B CD 2549 C CE . LYS B 280 ? 1.3248 1.4910 1.6190 -0.2413 -0.1640 -0.1288 280 LYS B CE 2550 N NZ . LYS B 280 ? 1.4637 1.6342 1.8018 -0.2720 -0.1699 -0.1271 280 LYS B NZ 2551 N N . ASN B 281 ? 0.8095 0.8254 0.9710 -0.1906 -0.1749 -0.0625 281 ASN B N 2552 C CA . ASN B 281 ? 0.8035 0.8280 0.9394 -0.1980 -0.1601 -0.0448 281 ASN B CA 2553 C C . ASN B 281 ? 0.8195 0.8522 0.9322 -0.1724 -0.1541 -0.0538 281 ASN B C 2554 O O . ASN B 281 ? 0.8066 0.8622 0.9071 -0.1739 -0.1429 -0.0491 281 ASN B O 2555 C CB . ASN B 281 ? 0.8299 0.8944 0.9767 -0.2253 -0.1461 -0.0359 281 ASN B CB 2556 C CG . ASN B 281 ? 1.1917 1.2396 1.3529 -0.2577 -0.1505 -0.0150 281 ASN B CG 2557 O OD1 . ASN B 281 ? 1.1519 1.1638 1.2946 -0.2671 -0.1550 0.0081 281 ASN B OD1 2558 N ND2 . ASN B 281 ? 1.1063 1.1789 1.3005 -0.2764 -0.1505 -0.0229 281 ASN B ND2 2559 N N . GLN B 282 ? 0.7607 0.7760 0.8680 -0.1492 -0.1633 -0.0663 282 GLN B N 2560 C CA . GLN B 282 ? 0.7399 0.7565 0.8258 -0.1282 -0.1600 -0.0719 282 GLN B CA 2561 C C . GLN B 282 ? 0.7806 0.7722 0.8542 -0.1111 -0.1683 -0.0734 282 GLN B C 2562 O O . GLN B 282 ? 0.7812 0.7627 0.8667 -0.1066 -0.1799 -0.0804 282 GLN B O 2563 C CB . GLN B 282 ? 0.7476 0.7914 0.8374 -0.1169 -0.1590 -0.0909 282 GLN B CB 2564 C CG . GLN B 282 ? 0.9529 0.9997 1.0594 -0.1063 -0.1686 -0.1104 282 GLN B CG 2565 C CD . GLN B 282 ? 1.2035 1.2657 1.3027 -0.0871 -0.1715 -0.1304 282 GLN B CD 2566 O OE1 . GLN B 282 ? 1.1439 1.2295 1.2406 -0.0882 -0.1679 -0.1372 282 GLN B OE1 2567 N NE2 . GLN B 282 ? 1.1141 1.1652 1.2088 -0.0667 -0.1808 -0.1424 282 GLN B NE2 2568 N N . VAL B 283 ? 0.7252 0.7116 0.7774 -0.1013 -0.1634 -0.0685 283 VAL B N 2569 C CA . VAL B 283 ? 0.7197 0.6931 0.7584 -0.0877 -0.1675 -0.0689 283 VAL B CA 2570 C C . VAL B 283 ? 0.7596 0.7384 0.7830 -0.0742 -0.1649 -0.0724 283 VAL B C 2571 O O . VAL B 283 ? 0.7503 0.7333 0.7676 -0.0755 -0.1604 -0.0700 283 VAL B O 2572 C CB . VAL B 283 ? 0.7717 0.7298 0.8003 -0.0925 -0.1662 -0.0582 283 VAL B CB 2573 C CG1 . VAL B 283 ? 0.7629 0.7233 0.7800 -0.0953 -0.1558 -0.0495 283 VAL B CG1 2574 C CG2 . VAL B 283 ? 0.7704 0.7247 0.7915 -0.0802 -0.1729 -0.0638 283 VAL B CG2 2575 N N . ILE B 284 ? 0.7169 0.6963 0.7337 -0.0605 -0.1703 -0.0784 284 ILE B N 2576 C CA . ILE B 284 ? 0.7189 0.6982 0.7162 -0.0489 -0.1697 -0.0779 284 ILE B CA 2577 C C . ILE B 284 ? 0.7673 0.7456 0.7483 -0.0465 -0.1665 -0.0684 284 ILE B C 2578 O O . ILE B 284 ? 0.7625 0.7507 0.7470 -0.0404 -0.1706 -0.0738 284 ILE B O 2579 C CB . ILE B 284 ? 0.7650 0.7519 0.7643 -0.0336 -0.1779 -0.0933 284 ILE B CB 2580 C CG1 . ILE B 284 ? 0.7661 0.7618 0.7858 -0.0381 -0.1802 -0.1064 284 ILE B CG1 2581 C CG2 . ILE B 284 ? 0.7895 0.7694 0.7615 -0.0214 -0.1796 -0.0898 284 ILE B CG2 2582 C CD1 . ILE B 284 ? 0.8627 0.8671 0.9102 -0.0399 -0.1863 -0.1182 284 ILE B CD1 2583 N N . MET B 285 ? 0.7242 0.6940 0.6900 -0.0512 -0.1609 -0.0561 285 MET B N 2584 C CA . MET B 285 ? 0.7265 0.6997 0.6788 -0.0539 -0.1555 -0.0456 285 MET B CA 2585 C C . MET B 285 ? 0.7913 0.7575 0.7209 -0.0512 -0.1557 -0.0349 285 MET B C 2586 O O . MET B 285 ? 0.7946 0.7420 0.7186 -0.0525 -0.1600 -0.0307 285 MET B O 2587 C CB . MET B 285 ? 0.7476 0.7145 0.7056 -0.0657 -0.1493 -0.0388 285 MET B CB 2588 C CG . MET B 285 ? 0.7814 0.7509 0.7536 -0.0682 -0.1503 -0.0462 285 MET B CG 2589 S SD . MET B 285 ? 0.8273 0.7877 0.8034 -0.0770 -0.1445 -0.0408 285 MET B SD 2590 C CE . MET B 285 ? 0.7803 0.7342 0.7677 -0.0802 -0.1480 -0.0445 285 MET B CE 2591 N N . LEU B 286 ? 0.7554 0.7381 0.6707 -0.0469 -0.1532 -0.0305 286 LEU B N 2592 C CA . LEU B 286 ? 0.7809 0.7574 0.6691 -0.0470 -0.1527 -0.0150 286 LEU B CA 2593 C C . LEU B 286 ? 0.8291 0.8101 0.7127 -0.0649 -0.1427 0.0020 286 LEU B C 2594 O O . LEU B 286 ? 0.8211 0.8343 0.7046 -0.0672 -0.1351 0.0015 286 LEU B O 2595 C CB . LEU B 286 ? 0.7944 0.7947 0.6689 -0.0303 -0.1551 -0.0207 286 LEU B CB 2596 C CG . LEU B 286 ? 0.8912 0.8764 0.7345 -0.0213 -0.1608 -0.0107 286 LEU B CG 2597 C CD1 . LEU B 286 ? 0.8943 0.8533 0.7408 -0.0091 -0.1736 -0.0249 286 LEU B CD1 2598 C CD2 . LEU B 286 ? 0.9358 0.9552 0.7649 -0.0043 -0.1605 -0.0152 286 LEU B CD2 2599 N N . LEU B 287 ? 0.7870 0.7397 0.6714 -0.0765 -0.1448 0.0131 287 LEU B N 2600 C CA . LEU B 287 ? 0.7888 0.7416 0.6762 -0.0949 -0.1373 0.0272 287 LEU B CA 2601 C C . LEU B 287 ? 0.8739 0.8224 0.7361 -0.1068 -0.1350 0.0513 287 LEU B C 2602 O O . LEU B 287 ? 0.8986 0.8152 0.7410 -0.1044 -0.1462 0.0625 287 LEU B O 2603 C CB . LEU B 287 ? 0.7792 0.7057 0.6843 -0.0999 -0.1434 0.0255 287 LEU B CB 2604 C CG . LEU B 287 ? 0.8038 0.7340 0.7301 -0.0909 -0.1451 0.0064 287 LEU B CG 2605 C CD1 . LEU B 287 ? 0.8031 0.7118 0.7404 -0.0901 -0.1548 0.0046 287 LEU B CD1 2606 C CD2 . LEU B 287 ? 0.8126 0.7655 0.7529 -0.0941 -0.1353 -0.0019 287 LEU B CD2 2607 N N . TYR B 288 ? 0.8314 0.8133 0.6936 -0.1204 -0.1214 0.0590 288 TYR B N 2608 C CA . TYR B 288 ? 0.8693 0.8575 0.7090 -0.1382 -0.1150 0.0855 288 TYR B CA 2609 C C . TYR B 288 ? 0.9108 0.9055 0.7688 -0.1632 -0.1061 0.0948 288 TYR B C 2610 O O . TYR B 288 ? 0.8964 0.9398 0.7615 -0.1717 -0.0919 0.0902 288 TYR B O 2611 C CB . TYR B 288 ? 0.8937 0.9327 0.7150 -0.1306 -0.1056 0.0845 288 TYR B CB 2612 C CG . TYR B 288 ? 0.9331 0.9605 0.7307 -0.1083 -0.1157 0.0821 288 TYR B CG 2613 C CD1 . TYR B 288 ? 0.9258 0.9601 0.7374 -0.0834 -0.1231 0.0544 288 TYR B CD1 2614 C CD2 . TYR B 288 ? 0.9942 1.0029 0.7552 -0.1121 -0.1190 0.1074 288 TYR B CD2 2615 C CE1 . TYR B 288 ? 0.9495 0.9762 0.7438 -0.0615 -0.1330 0.0482 288 TYR B CE1 2616 C CE2 . TYR B 288 ? 1.0209 1.0193 0.7588 -0.0878 -0.1295 0.1017 288 TYR B CE2 2617 C CZ . TYR B 288 ? 1.0794 1.0891 0.8363 -0.0617 -0.1361 0.0701 288 TYR B CZ 2618 O OH . TYR B 288 ? 1.1077 1.1096 0.8461 -0.0365 -0.1472 0.0606 288 TYR B OH 2619 N N . PRO B 289 ? 0.8704 0.8204 0.7396 -0.1732 -0.1165 0.1034 289 PRO B N 2620 C CA . PRO B 289 ? 0.8663 0.8228 0.7586 -0.1954 -0.1098 0.1089 289 PRO B CA 2621 C C . PRO B 289 ? 0.9543 0.9115 0.8315 -0.2250 -0.1039 0.1415 289 PRO B C 2622 O O . PRO B 289 ? 0.9935 0.9149 0.8424 -0.2296 -0.1146 0.1653 289 PRO B O 2623 C CB . PRO B 289 ? 0.8780 0.7896 0.7919 -0.1885 -0.1270 0.1004 289 PRO B CB 2624 C CG . PRO B 289 ? 0.9517 0.8253 0.8444 -0.1725 -0.1448 0.1030 289 PRO B CG 2625 C CD . PRO B 289 ? 0.9005 0.7969 0.7652 -0.1623 -0.1374 0.1040 289 PRO B CD 2626 N N . ASP B 290 ? 0.8985 0.8967 0.7937 -0.2459 -0.0878 0.1421 290 ASP B N 2627 C CA . ASP B 290 ? 0.9405 0.9500 0.8275 -0.2809 -0.0784 0.1737 290 ASP B CA 2628 C C . ASP B 290 ? 0.9965 0.9568 0.9087 -0.3005 -0.0918 0.1858 290 ASP B C 2629 O O . ASP B 290 ? 1.0441 0.9901 0.9491 -0.3321 -0.0918 0.2183 290 ASP B O 2630 C CB . ASP B 290 ? 0.9494 1.0396 0.8475 -0.2934 -0.0543 0.1630 290 ASP B CB 2631 C CG . ASP B 290 ? 1.0571 1.2019 0.9373 -0.2698 -0.0459 0.1440 290 ASP B CG 2632 O OD1 . ASP B 290 ? 1.0186 1.1980 0.9198 -0.2523 -0.0431 0.1094 290 ASP B OD1 2633 O OD2 . ASP B 290 ? 1.1637 1.3148 1.0087 -0.2671 -0.0448 0.1626 290 ASP B OD2 2634 N N . HIS B 291 ? 0.9030 0.8385 0.8451 -0.2814 -0.1046 0.1599 291 HIS B N 2635 C CA . HIS B 291 ? 0.9040 0.7971 0.8777 -0.2894 -0.1219 0.1605 291 HIS B CA 2636 C C . HIS B 291 ? 0.8980 0.7634 0.8863 -0.2552 -0.1399 0.1322 291 HIS B C 2637 O O . HIS B 291 ? 0.8546 0.7418 0.8331 -0.2321 -0.1330 0.1127 291 HIS B O 2638 C CB . HIS B 291 ? 0.9020 0.8350 0.9125 -0.3099 -0.1065 0.1515 291 HIS B CB 2639 C CG . HIS B 291 ? 0.8906 0.8804 0.9133 -0.2923 -0.0891 0.1170 291 HIS B CG 2640 N ND1 . HIS B 291 ? 0.9096 0.9628 0.9194 -0.3009 -0.0670 0.1148 291 HIS B ND1 2641 C CD2 . HIS B 291 ? 0.8658 0.8560 0.9102 -0.2657 -0.0939 0.0840 291 HIS B CD2 2642 C CE1 . HIS B 291 ? 0.8547 0.9395 0.8793 -0.2788 -0.0622 0.0790 291 HIS B CE1 2643 N NE2 . HIS B 291 ? 0.8334 0.8795 0.8771 -0.2584 -0.0770 0.0616 291 HIS B NE2 2644 N N . PRO B 292 ? 0.8516 0.6734 0.8639 -0.2509 -0.1639 0.1285 292 PRO B N 2645 C CA . PRO B 292 ? 0.8065 0.6157 0.8313 -0.2177 -0.1791 0.1006 292 PRO B CA 2646 C C . PRO B 292 ? 0.7841 0.6376 0.8243 -0.2015 -0.1612 0.0719 292 PRO B C 2647 O O . PRO B 292 ? 0.7651 0.6441 0.8300 -0.2104 -0.1498 0.0626 292 PRO B O 2648 C CB . PRO B 292 ? 0.8486 0.6189 0.9043 -0.2183 -0.2063 0.0991 292 PRO B CB 2649 C CG . PRO B 292 ? 0.9683 0.7075 1.0139 -0.2503 -0.2139 0.1334 292 PRO B CG 2650 C CD . PRO B 292 ? 0.9157 0.7007 0.9466 -0.2751 -0.1806 0.1485 292 PRO B CD 2651 N N . THR B 293 ? 0.7009 0.5627 0.7251 -0.1788 -0.1594 0.0582 293 THR B N 2652 C CA . THR B 293 ? 0.6490 0.5442 0.6799 -0.1636 -0.1458 0.0347 293 THR B CA 2653 C C . THR B 293 ? 0.6579 0.5426 0.6943 -0.1383 -0.1581 0.0173 293 THR B C 2654 O O . THR B 293 ? 0.6585 0.5276 0.6790 -0.1292 -0.1685 0.0203 293 THR B O 2655 C CB . THR B 293 ? 0.7470 0.6718 0.7530 -0.1661 -0.1292 0.0376 293 THR B CB 2656 O OG1 . THR B 293 ? 0.7677 0.7107 0.7679 -0.1900 -0.1179 0.0546 293 THR B OG1 2657 C CG2 . THR B 293 ? 0.6941 0.6484 0.7058 -0.1524 -0.1194 0.0141 293 THR B CG2 2658 N N . LEU B 294 ? 0.5770 0.4746 0.6348 -0.1266 -0.1565 -0.0020 294 LEU B N 2659 C CA . LEU B 294 ? 0.5480 0.4455 0.6110 -0.1041 -0.1653 -0.0176 294 LEU B CA 2660 C C . LEU B 294 ? 0.5744 0.4873 0.6177 -0.0969 -0.1544 -0.0222 294 LEU B C 2661 O O . LEU B 294 ? 0.5600 0.4893 0.5985 -0.1000 -0.1414 -0.0269 294 LEU B O 2662 C CB . LEU B 294 ? 0.5313 0.4372 0.6215 -0.0932 -0.1680 -0.0350 294 LEU B CB 2663 C CG . LEU B 294 ? 0.5725 0.4825 0.6723 -0.0690 -0.1804 -0.0502 294 LEU B CG 2664 C CD1 . LEU B 294 ? 0.5885 0.4827 0.6917 -0.0620 -0.2028 -0.0480 294 LEU B CD1 2665 C CD2 . LEU B 294 ? 0.5904 0.5099 0.7160 -0.0567 -0.1829 -0.0676 294 LEU B CD2 2666 N N . LEU B 295 ? 0.5235 0.4317 0.5571 -0.0875 -0.1624 -0.0227 295 LEU B N 2667 C CA . LEU B 295 ? 0.5040 0.4245 0.5240 -0.0824 -0.1552 -0.0265 295 LEU B CA 2668 C C . LEU B 295 ? 0.5284 0.4595 0.5569 -0.0682 -0.1602 -0.0380 295 LEU B C 2669 O O . LEU B 295 ? 0.5256 0.4564 0.5607 -0.0594 -0.1737 -0.0425 295 LEU B O 2670 C CB . LEU B 295 ? 0.5189 0.4321 0.5213 -0.0851 -0.1586 -0.0186 295 LEU B CB 2671 C CG . LEU B 295 ? 0.5693 0.4944 0.5625 -0.0809 -0.1537 -0.0235 295 LEU B CG 2672 C CD1 . LEU B 295 ? 0.5686 0.5030 0.5545 -0.0864 -0.1428 -0.0223 295 LEU B CD1 2673 C CD2 . LEU B 295 ? 0.6135 0.5321 0.5965 -0.0766 -0.1631 -0.0234 295 LEU B CD2 2674 N N . SER B 296 ? 0.4661 0.4080 0.4934 -0.0652 -0.1512 -0.0434 296 SER B N 2675 C CA . SER B 296 ? 0.4516 0.4079 0.4824 -0.0538 -0.1529 -0.0505 296 SER B CA 2676 C C . SER B 296 ? 0.4908 0.4524 0.5079 -0.0586 -0.1448 -0.0470 296 SER B C 2677 O O . SER B 296 ? 0.4879 0.4402 0.4963 -0.0659 -0.1395 -0.0442 296 SER B O 2678 C CB . SER B 296 ? 0.4926 0.4519 0.5353 -0.0435 -0.1538 -0.0596 296 SER B CB 2679 O OG . SER B 296 ? 0.6073 0.5602 0.6433 -0.0472 -0.1452 -0.0615 296 SER B OG 2680 N N . TYR B 297 ? 0.4399 0.4193 0.4564 -0.0548 -0.1456 -0.0479 297 TYR B N 2681 C CA . TYR B 297 ? 0.4400 0.4241 0.4462 -0.0633 -0.1391 -0.0416 297 TYR B CA 2682 C C . TYR B 297 ? 0.4852 0.4940 0.4904 -0.0592 -0.1371 -0.0409 297 TYR B C 2683 O O . TYR B 297 ? 0.4714 0.5043 0.4861 -0.0474 -0.1424 -0.0490 297 TYR B O 2684 C CB . TYR B 297 ? 0.4573 0.4414 0.4621 -0.0727 -0.1394 -0.0391 297 TYR B CB 2685 C CG . TYR B 297 ? 0.4761 0.4761 0.4879 -0.0673 -0.1466 -0.0461 297 TYR B CG 2686 C CD1 . TYR B 297 ? 0.4998 0.5300 0.5160 -0.0675 -0.1468 -0.0509 297 TYR B CD1 2687 C CD2 . TYR B 297 ? 0.4888 0.4743 0.5015 -0.0628 -0.1547 -0.0485 297 TYR B CD2 2688 C CE1 . TYR B 297 ? 0.5094 0.5570 0.5318 -0.0592 -0.1573 -0.0633 297 TYR B CE1 2689 C CE2 . TYR B 297 ? 0.5041 0.4974 0.5199 -0.0552 -0.1668 -0.0570 297 TYR B CE2 2690 C CZ . TYR B 297 ? 0.5946 0.6197 0.6156 -0.0515 -0.1691 -0.0671 297 TYR B CZ 2691 O OH . TYR B 297 ? 0.6125 0.6482 0.6363 -0.0409 -0.1845 -0.0813 297 TYR B OH 2692 N N . ARG B 298 ? 0.4535 0.4568 0.4462 -0.0685 -0.1314 -0.0312 298 ARG B N 2693 C CA . ARG B 298 ? 0.4611 0.4877 0.4467 -0.0692 -0.1270 -0.0245 298 ARG B CA 2694 C C . ARG B 298 ? 0.5361 0.5520 0.5102 -0.0892 -0.1228 -0.0089 298 ARG B C 2695 O O . ARG B 298 ? 0.5390 0.5206 0.5077 -0.0962 -0.1266 -0.0058 298 ARG B O 2696 C CB . ARG B 298 ? 0.4629 0.4864 0.4414 -0.0531 -0.1281 -0.0277 298 ARG B CB 2697 C CG . ARG B 298 ? 0.5885 0.5714 0.5548 -0.0523 -0.1305 -0.0276 298 ARG B CG 2698 C CD . ARG B 298 ? 0.7062 0.6857 0.6583 -0.0380 -0.1315 -0.0288 298 ARG B CD 2699 N NE . ARG B 298 ? 0.8135 0.7545 0.7525 -0.0355 -0.1371 -0.0332 298 ARG B NE 2700 C CZ . ARG B 298 ? 1.0051 0.9341 0.9315 -0.0188 -0.1412 -0.0411 298 ARG B CZ 2701 N NH1 . ARG B 298 ? 0.8428 0.7960 0.7686 -0.0024 -0.1393 -0.0438 298 ARG B NH1 2702 N NH2 . ARG B 298 ? 0.8583 0.7546 0.7732 -0.0153 -0.1492 -0.0499 298 ARG B NH2 2703 N N . ASN B 299 ? 0.5087 0.5569 0.4801 -0.0985 -0.1166 0.0002 299 ASN B N 2704 C CA . ASN B 299 ? 0.5364 0.5758 0.4984 -0.1218 -0.1130 0.0188 299 ASN B CA 2705 C C . ASN B 299 ? 0.6158 0.6275 0.5530 -0.1201 -0.1147 0.0321 299 ASN B C 2706 O O . ASN B 299 ? 0.6056 0.6320 0.5349 -0.1024 -0.1132 0.0279 299 ASN B O 2707 C CB . ASN B 299 ? 0.5569 0.6500 0.5266 -0.1352 -0.1040 0.0236 299 ASN B CB 2708 C CG . ASN B 299 ? 0.8571 0.9820 0.8491 -0.1321 -0.1051 0.0053 299 ASN B CG 2709 O OD1 . ASN B 299 ? 0.7925 0.8938 0.7939 -0.1350 -0.1101 -0.0012 299 ASN B OD1 2710 N ND2 . ASN B 299 ? 0.7461 0.9280 0.7457 -0.1238 -0.1024 -0.0054 299 ASN B ND2 2711 N N . MET B 300 ? 0.6059 0.5755 0.5310 -0.1359 -0.1212 0.0459 300 MET B N 2712 C CA . MET B 300 ? 0.6409 0.5735 0.5375 -0.1342 -0.1280 0.0582 300 MET B CA 2713 C C . MET B 300 ? 0.7292 0.6749 0.6076 -0.1550 -0.1213 0.0857 300 MET B C 2714 O O . MET B 300 ? 0.7689 0.6704 0.6246 -0.1675 -0.1310 0.1042 300 MET B O 2715 C CB . MET B 300 ? 0.6869 0.5621 0.5779 -0.1346 -0.1455 0.0538 300 MET B CB 2716 C CG . MET B 300 ? 0.7037 0.5708 0.6028 -0.1112 -0.1506 0.0284 300 MET B CG 2717 S SD . MET B 300 ? 0.7763 0.5908 0.6684 -0.1067 -0.1732 0.0167 300 MET B SD 2718 C CE . MET B 300 ? 0.7167 0.5420 0.6360 -0.1207 -0.1744 0.0141 300 MET B CE 2719 N N . GLY B 301 ? 0.6718 0.6798 0.5593 -0.1578 -0.1066 0.0876 301 GLY B N 2720 C CA . GLY B 301 ? 0.7044 0.7452 0.5768 -0.1782 -0.0958 0.1129 301 GLY B CA 2721 C C . GLY B 301 ? 0.7439 0.8414 0.6077 -0.1576 -0.0861 0.1081 301 GLY B C 2722 O O . GLY B 301 ? 0.7143 0.8072 0.5779 -0.1260 -0.0916 0.0883 301 GLY B O 2723 N N . GLU B 302 ? 0.7202 0.8766 0.5793 -0.1753 -0.0724 0.1250 302 GLU B N 2724 C CA . GLU B 302 ? 0.7129 0.9391 0.5641 -0.1563 -0.0632 0.1209 302 GLU B CA 2725 C C . GLU B 302 ? 0.7031 0.9783 0.5856 -0.1257 -0.0666 0.0837 302 GLU B C 2726 O O . GLU B 302 ? 0.6827 0.9827 0.5621 -0.0935 -0.0703 0.0687 302 GLU B O 2727 C CB . GLU B 302 ? 0.7643 1.0524 0.6072 -0.1876 -0.0468 0.1467 302 GLU B CB 2728 C CG . GLU B 302 ? 0.9209 1.2725 0.7409 -0.1711 -0.0379 0.1532 302 GLU B CG 2729 C CD . GLU B 302 ? 1.2394 1.6579 1.0471 -0.2055 -0.0195 0.1826 302 GLU B CD 2730 O OE1 . GLU B 302 ? 1.1639 1.6368 1.0003 -0.2276 -0.0107 0.1761 302 GLU B OE1 2731 O OE2 . GLU B 302 ? 1.2238 1.6441 0.9925 -0.2099 -0.0137 0.2115 302 GLU B OE2 2732 N N . GLU B 303 ? 0.6316 0.9176 0.5440 -0.1343 -0.0682 0.0680 303 GLU B N 2733 C CA . GLU B 303 ? 0.5846 0.9050 0.5250 -0.1082 -0.0762 0.0340 303 GLU B CA 2734 C C . GLU B 303 ? 0.6113 0.8644 0.5630 -0.0998 -0.0881 0.0212 303 GLU B C 2735 O O . GLU B 303 ? 0.6011 0.8329 0.5642 -0.1175 -0.0887 0.0215 303 GLU B O 2736 C CB . GLU B 303 ? 0.5909 0.9815 0.5528 -0.1210 -0.0708 0.0230 303 GLU B CB 2737 C CG . GLU B 303 ? 0.7354 1.2192 0.6951 -0.1132 -0.0635 0.0188 303 GLU B CG 2738 C CD . GLU B 303 ? 0.9840 1.5078 0.9562 -0.0700 -0.0779 -0.0133 303 GLU B CD 2739 O OE1 . GLU B 303 ? 0.8905 1.4314 0.8880 -0.0548 -0.0916 -0.0432 303 GLU B OE1 2740 O OE2 . GLU B 303 ? 0.9283 1.4644 0.8849 -0.0499 -0.0782 -0.0095 303 GLU B OE2 2741 N N . PRO B 304 ? 0.5564 0.7778 0.5053 -0.0738 -0.0973 0.0101 304 PRO B N 2742 C CA . PRO B 304 ? 0.5380 0.7030 0.4966 -0.0692 -0.1064 0.0001 304 PRO B CA 2743 C C . PRO B 304 ? 0.5621 0.7421 0.5460 -0.0619 -0.1140 -0.0208 304 PRO B C 2744 O O . PRO B 304 ? 0.5503 0.6936 0.5395 -0.0707 -0.1169 -0.0216 304 PRO B O 2745 C CB . PRO B 304 ? 0.5581 0.6976 0.5088 -0.0451 -0.1125 -0.0071 304 PRO B CB 2746 C CG . PRO B 304 ? 0.6149 0.8089 0.5633 -0.0260 -0.1115 -0.0124 304 PRO B CG 2747 C CD . PRO B 304 ? 0.5782 0.8179 0.5166 -0.0473 -0.0996 0.0050 304 PRO B CD 2748 N N . ASN B 305 ? 0.5087 0.7433 0.5065 -0.0438 -0.1198 -0.0386 305 ASN B N 2749 C CA . ASN B 305 ? 0.4885 0.7386 0.5075 -0.0325 -0.1330 -0.0610 305 ASN B CA 2750 C C . ASN B 305 ? 0.5309 0.7235 0.5560 -0.0259 -0.1431 -0.0662 305 ASN B C 2751 O O . ASN B 305 ? 0.5244 0.6903 0.5514 -0.0374 -0.1443 -0.0650 305 ASN B O 2752 C CB . ASN B 305 ? 0.5057 0.7839 0.5304 -0.0511 -0.1285 -0.0625 305 ASN B CB 2753 C CG . ASN B 305 ? 0.8054 1.1093 0.8478 -0.0355 -0.1452 -0.0895 305 ASN B CG 2754 O OD1 . ASN B 305 ? 0.7349 1.0767 0.7876 -0.0110 -0.1594 -0.1098 305 ASN B OD1 2755 N ND2 . ASN B 305 ? 0.7068 0.9908 0.7525 -0.0469 -0.1468 -0.0925 305 ASN B ND2 2756 N N . TYR B 306 ? 0.4854 0.6619 0.5134 -0.0079 -0.1495 -0.0715 306 TYR B N 2757 C CA . TYR B 306 ? 0.4786 0.6076 0.5139 -0.0040 -0.1572 -0.0751 306 TYR B CA 2758 C C . TYR B 306 ? 0.5298 0.6572 0.5813 0.0031 -0.1739 -0.0888 306 TYR B C 2759 O O . TYR B 306 ? 0.5197 0.6807 0.5850 0.0219 -0.1892 -0.1062 306 TYR B O 2760 C CB . TYR B 306 ? 0.4892 0.6088 0.5285 0.0140 -0.1606 -0.0811 306 TYR B CB 2761 C CG . TYR B 306 ? 0.5027 0.5819 0.5540 0.0151 -0.1677 -0.0857 306 TYR B CG 2762 C CD1 . TYR B 306 ? 0.5315 0.5731 0.5719 -0.0004 -0.1582 -0.0755 306 TYR B CD1 2763 C CD2 . TYR B 306 ? 0.5052 0.5867 0.5801 0.0307 -0.1858 -0.1009 306 TYR B CD2 2764 C CE1 . TYR B 306 ? 0.5379 0.5526 0.5895 -0.0024 -0.1622 -0.0791 306 TYR B CE1 2765 C CE2 . TYR B 306 ? 0.5174 0.5631 0.6041 0.0261 -0.1912 -0.1014 306 TYR B CE2 2766 C CZ . TYR B 306 ? 0.6101 0.6262 0.6847 0.0085 -0.1773 -0.0899 306 TYR B CZ 2767 O OH . TYR B 306 ? 0.6187 0.6094 0.7052 0.0014 -0.1801 -0.0900 306 TYR B OH 2768 N N . GLN B 307 ? 0.4976 0.5854 0.5456 -0.0103 -0.1734 -0.0818 307 GLN B N 2769 C CA . GLN B 307 ? 0.5032 0.5758 0.5591 -0.0065 -0.1898 -0.0896 307 GLN B CA 2770 C C . GLN B 307 ? 0.5659 0.5927 0.6212 -0.0145 -0.1894 -0.0802 307 GLN B C 2771 O O . GLN B 307 ? 0.5584 0.5678 0.6029 -0.0279 -0.1742 -0.0683 307 GLN B O 2772 C CB . GLN B 307 ? 0.5252 0.6053 0.5731 -0.0161 -0.1888 -0.0901 307 GLN B CB 2773 C CG . GLN B 307 ? 0.7438 0.8781 0.7946 -0.0126 -0.1875 -0.1008 307 GLN B CG 2774 C CD . GLN B 307 ? 1.0267 1.1971 1.0918 0.0110 -0.2097 -0.1245 307 GLN B CD 2775 O OE1 . GLN B 307 ? 0.9742 1.1835 1.0469 0.0243 -0.2111 -0.1323 307 GLN B OE1 2776 N NE2 . GLN B 307 ? 0.9469 1.1069 1.0146 0.0193 -0.2301 -0.1386 307 GLN B NE2 2777 N N . GLU B 308 ? 0.5400 0.5495 0.6075 -0.0067 -0.2080 -0.0863 308 GLU B N 2778 C CA . GLU B 308 ? 0.5528 0.5246 0.6217 -0.0177 -0.2078 -0.0757 308 GLU B CA 2779 C C . GLU B 308 ? 0.6317 0.5772 0.7006 -0.0191 -0.2277 -0.0739 308 GLU B C 2780 O O . GLU B 308 ? 0.6330 0.5858 0.7104 -0.0034 -0.2506 -0.0880 308 GLU B O 2781 C CB . GLU B 308 ? 0.5652 0.5351 0.6520 -0.0111 -0.2081 -0.0807 308 GLU B CB 2782 C CG . GLU B 308 ? 0.7023 0.6842 0.8137 0.0111 -0.2317 -0.0983 308 GLU B CG 2783 C CD . GLU B 308 ? 0.9830 0.9563 1.1178 0.0173 -0.2361 -0.1049 308 GLU B CD 2784 O OE1 . GLU B 308 ? 0.9209 0.9201 1.0711 0.0399 -0.2436 -0.1217 308 GLU B OE1 2785 O OE2 . GLU B 308 ? 0.9290 0.8740 1.0681 0.0003 -0.2325 -0.0947 308 GLU B OE2 2786 N N . GLU B 309 ? 0.6092 0.5253 0.6665 -0.0369 -0.2207 -0.0571 309 GLU B N 2787 C CA . GLU B 309 ? 0.6409 0.5241 0.6907 -0.0424 -0.2378 -0.0485 309 GLU B CA 2788 C C . GLU B 309 ? 0.7115 0.5714 0.7557 -0.0638 -0.2268 -0.0282 309 GLU B C 2789 O O . GLU B 309 ? 0.6931 0.5651 0.7281 -0.0746 -0.2039 -0.0212 309 GLU B O 2790 C CB . GLU B 309 ? 0.6680 0.5507 0.6966 -0.0389 -0.2429 -0.0507 309 GLU B CB 2791 C CG . GLU B 309 ? 0.7956 0.6903 0.8071 -0.0490 -0.2189 -0.0432 309 GLU B CG 2792 C CD . GLU B 309 ? 1.0932 0.9901 1.0888 -0.0431 -0.2250 -0.0497 309 GLU B CD 2793 O OE1 . GLU B 309 ? 1.0756 0.9456 1.0583 -0.0396 -0.2433 -0.0479 309 GLU B OE1 2794 O OE2 . GLU B 309 ? 1.0078 0.9316 1.0038 -0.0422 -0.2129 -0.0571 309 GLU B OE2 2795 N N . TRP B 310 ? 0.7034 0.5322 0.7541 -0.0703 -0.2450 -0.0195 310 TRP B N 2796 C CA . TRP B 310 ? 0.7268 0.5376 0.7728 -0.0946 -0.2353 0.0024 310 TRP B CA 2797 C C . TRP B 310 ? 0.8175 0.6101 0.8298 -0.1043 -0.2345 0.0202 310 TRP B C 2798 O O . TRP B 310 ? 0.8414 0.6050 0.8419 -0.0974 -0.2585 0.0217 310 TRP B O 2799 C CB . TRP B 310 ? 0.7353 0.5191 0.8059 -0.1007 -0.2563 0.0064 310 TRP B CB 2800 C CG . TRP B 310 ? 0.7204 0.5247 0.8248 -0.0961 -0.2506 -0.0080 310 TRP B CG 2801 C CD1 . TRP B 310 ? 0.7385 0.5537 0.8690 -0.0720 -0.2672 -0.0313 310 TRP B CD1 2802 C CD2 . TRP B 310 ? 0.7100 0.5298 0.8258 -0.1135 -0.2285 -0.0033 310 TRP B CD2 2803 N NE1 . TRP B 310 ? 0.7130 0.5450 0.8695 -0.0722 -0.2568 -0.0407 310 TRP B NE1 2804 C CE2 . TRP B 310 ? 0.7363 0.5710 0.8849 -0.0979 -0.2333 -0.0251 310 TRP B CE2 2805 C CE3 . TRP B 310 ? 0.7358 0.5645 0.8374 -0.1389 -0.2057 0.0142 310 TRP B CE3 2806 C CZ2 . TRP B 310 ? 0.7145 0.5682 0.8817 -0.1064 -0.2166 -0.0315 310 TRP B CZ2 2807 C CZ3 . TRP B 310 ? 0.7409 0.5940 0.8623 -0.1486 -0.1892 0.0074 310 TRP B CZ3 2808 C CH2 . TRP B 310 ? 0.7266 0.5895 0.8804 -0.1324 -0.1950 -0.0160 310 TRP B CH2 2809 N N . VAL B 311 ? 0.7769 0.5886 0.7731 -0.1165 -0.2093 0.0303 311 VAL B N 2810 C CA . VAL B 311 ? 0.8048 0.6078 0.7684 -0.1228 -0.2056 0.0458 311 VAL B CA 2811 C C . VAL B 311 ? 0.9088 0.6930 0.8632 -0.1475 -0.2045 0.0730 311 VAL B C 2812 O O . VAL B 311 ? 0.8965 0.7034 0.8628 -0.1642 -0.1866 0.0789 311 VAL B O 2813 C CB . VAL B 311 ? 0.8253 0.6631 0.7779 -0.1185 -0.1836 0.0390 311 VAL B CB 2814 C CG1 . VAL B 311 ? 0.8486 0.6799 0.7693 -0.1182 -0.1835 0.0502 311 VAL B CG1 2815 C CG2 . VAL B 311 ? 0.7860 0.6409 0.7509 -0.1003 -0.1841 0.0163 311 VAL B CG2 2816 N N . MET B 312 ? 0.9227 0.6655 0.8558 -0.1504 -0.2255 0.0887 312 MET B N 2817 C CA . MET B 312 ? 0.9783 0.6951 0.8982 -0.1770 -0.2284 0.1202 312 MET B CA 2818 C C . MET B 312 ? 1.0560 0.7829 0.9365 -0.1865 -0.2130 0.1413 312 MET B C 2819 O O . MET B 312 ? 1.0689 0.8159 0.9447 -0.2115 -0.1945 0.1624 312 MET B O 2820 C CB . MET B 312 ? 1.0573 0.7148 0.9769 -0.1756 -0.2661 0.1272 312 MET B CB 2821 C CG . MET B 312 ? 1.0878 0.7399 1.0515 -0.1702 -0.2821 0.1099 312 MET B CG 2822 S SD . MET B 312 ? 1.1892 0.7785 1.1567 -0.1539 -0.3358 0.1029 312 MET B SD 2823 C CE . MET B 312 ? 1.0990 0.7177 1.0656 -0.1133 -0.3427 0.0629 312 MET B CE 2824 N N . HIS B 313 ? 1.0160 0.7347 0.8693 -0.1655 -0.2208 0.1333 313 HIS B N 2825 C CA . HIS B 313 ? 1.0392 0.7676 0.8535 -0.1665 -0.2102 0.1488 313 HIS B CA 2826 C C . HIS B 313 ? 1.0392 0.8061 0.8527 -0.1424 -0.1979 0.1230 313 HIS B C 2827 O O . HIS B 313 ? 0.9840 0.7719 0.8265 -0.1313 -0.1936 0.0983 313 HIS B O 2828 C CB . HIS B 313 ? 1.1160 0.7863 0.8923 -0.1639 -0.2375 0.1670 313 HIS B CB 2829 C CG . HIS B 313 ? 1.1956 0.8104 0.9830 -0.1714 -0.2682 0.1742 313 HIS B CG 2830 N ND1 . HIS B 313 ? 1.2103 0.7972 1.0082 -0.1462 -0.2983 0.1477 313 HIS B ND1 2831 C CD2 . HIS B 313 ? 1.2622 0.8487 1.0543 -0.2009 -0.2746 0.2029 313 HIS B CD2 2832 C CE1 . HIS B 313 ? 1.2426 0.7833 1.0512 -0.1576 -0.3251 0.1591 313 HIS B CE1 2833 N NE2 . HIS B 313 ? 1.2802 0.8155 1.0869 -0.1918 -0.3121 0.1935 313 HIS B NE2 2834 N N . LYS B 314 ? 1.0144 0.7897 0.7947 -0.1344 -0.1935 0.1297 314 LYS B N 2835 C CA . LYS B 314 ? 0.9766 0.7855 0.7556 -0.1114 -0.1853 0.1067 314 LYS B CA 2836 C C . LYS B 314 ? 0.9975 0.7904 0.7903 -0.0889 -0.2022 0.0782 314 LYS B C 2837 O O . LYS B 314 ? 1.0243 0.7771 0.8003 -0.0791 -0.2254 0.0771 314 LYS B O 2838 C CB . LYS B 314 ? 1.0477 0.8608 0.7859 -0.1040 -0.1840 0.1199 314 LYS B CB 2839 C CG . LYS B 314 ? 1.2641 1.1088 0.9867 -0.1259 -0.1646 0.1472 314 LYS B CG 2840 C CD . LYS B 314 ? 1.4475 1.2877 1.1224 -0.1193 -0.1674 0.1664 314 LYS B CD 2841 C CE . LYS B 314 ? 1.6082 1.4890 1.2661 -0.1433 -0.1468 0.1953 314 LYS B CE 2842 N NZ . LYS B 314 ? 1.7726 1.6513 1.3792 -0.1357 -0.1493 0.2164 314 LYS B NZ 2843 N N . LYS B 315 ? 0.8976 0.7228 0.7207 -0.0817 -0.1919 0.0552 315 LYS B N 2844 C CA . LYS B 315 ? 0.8678 0.6907 0.7079 -0.0649 -0.2033 0.0290 315 LYS B CA 2845 C C . LYS B 315 ? 0.8686 0.7297 0.7287 -0.0572 -0.1897 0.0095 315 LYS B C 2846 O O . LYS B 315 ? 0.8392 0.7244 0.7145 -0.0666 -0.1743 0.0114 315 LYS B O 2847 C CB . LYS B 315 ? 0.8911 0.6997 0.7538 -0.0702 -0.2132 0.0253 315 LYS B CB 2848 C CG . LYS B 315 ? 1.0603 0.8686 0.9353 -0.0526 -0.2296 -0.0004 315 LYS B CG 2849 C CD . LYS B 315 ? 1.1863 0.9816 1.0800 -0.0532 -0.2449 -0.0046 315 LYS B CD 2850 C CE . LYS B 315 ? 1.2876 1.1114 1.2111 -0.0600 -0.2292 -0.0090 315 LYS B CE 2851 N NZ . LYS B 315 ? 1.4158 1.2248 1.3566 -0.0606 -0.2446 -0.0093 315 LYS B NZ 2852 N N . GLU B 316 ? 0.8143 0.6794 0.6757 -0.0402 -0.1979 -0.0108 316 GLU B N 2853 C CA . GLU B 316 ? 0.7753 0.6707 0.6584 -0.0345 -0.1894 -0.0292 316 GLU B CA 2854 C C . GLU B 316 ? 0.7910 0.6934 0.6993 -0.0366 -0.1917 -0.0428 316 GLU B C 2855 O O . GLU B 316 ? 0.7952 0.6872 0.7019 -0.0290 -0.2062 -0.0528 316 GLU B O 2856 C CB . GLU B 316 ? 0.8027 0.7031 0.6758 -0.0159 -0.1965 -0.0444 316 GLU B CB 2857 C CG . GLU B 316 ? 0.9157 0.8456 0.8132 -0.0118 -0.1894 -0.0607 316 GLU B CG 2858 C CD . GLU B 316 ? 1.2002 1.1371 1.0970 0.0078 -0.1985 -0.0816 316 GLU B CD 2859 O OE1 . GLU B 316 ? 1.1356 1.0703 1.0398 0.0141 -0.2078 -0.0990 316 GLU B OE1 2860 O OE2 . GLU B 316 ? 1.1381 1.0879 1.0294 0.0187 -0.1973 -0.0838 316 GLU B OE2 2861 N N . VAL B 317 ? 0.7125 0.6341 0.6417 -0.0457 -0.1793 -0.0437 317 VAL B N 2862 C CA . VAL B 317 ? 0.6862 0.6197 0.6362 -0.0492 -0.1787 -0.0528 317 VAL B CA 2863 C C . VAL B 317 ? 0.7058 0.6613 0.6735 -0.0508 -0.1729 -0.0644 317 VAL B C 2864 O O . VAL B 317 ? 0.6934 0.6532 0.6653 -0.0546 -0.1663 -0.0612 317 VAL B O 2865 C CB . VAL B 317 ? 0.7281 0.6585 0.6858 -0.0588 -0.1733 -0.0427 317 VAL B CB 2866 C CG1 . VAL B 317 ? 0.7458 0.6543 0.6952 -0.0571 -0.1853 -0.0361 317 VAL B CG1 2867 C CG2 . VAL B 317 ? 0.7195 0.6532 0.6774 -0.0673 -0.1610 -0.0329 317 VAL B CG2 2868 N N . VAL B 318 ? 0.6485 0.6198 0.6276 -0.0480 -0.1776 -0.0790 318 VAL B N 2869 C CA . VAL B 318 ? 0.6300 0.6237 0.6288 -0.0543 -0.1725 -0.0884 318 VAL B CA 2870 C C . VAL B 318 ? 0.6587 0.6691 0.6699 -0.0660 -0.1657 -0.0843 318 VAL B C 2871 O O . VAL B 318 ? 0.6519 0.6780 0.6651 -0.0619 -0.1704 -0.0922 318 VAL B O 2872 C CB . VAL B 318 ? 0.6844 0.6929 0.6889 -0.0443 -0.1810 -0.1100 318 VAL B CB 2873 C CG1 . VAL B 318 ? 0.6723 0.7044 0.7022 -0.0553 -0.1752 -0.1179 318 VAL B CG1 2874 C CG2 . VAL B 318 ? 0.6984 0.6884 0.6850 -0.0285 -0.1891 -0.1137 318 VAL B CG2 2875 N N . LEU B 319 ? 0.6026 0.6100 0.6199 -0.0781 -0.1571 -0.0730 319 LEU B N 2876 C CA . LEU B 319 ? 0.5912 0.6108 0.6147 -0.0890 -0.1501 -0.0654 319 LEU B CA 2877 C C . LEU B 319 ? 0.6324 0.6650 0.6701 -0.1044 -0.1457 -0.0636 319 LEU B C 2878 O O . LEU B 319 ? 0.6318 0.6494 0.6745 -0.1081 -0.1484 -0.0623 319 LEU B O 2879 C CB . LEU B 319 ? 0.5915 0.5903 0.6058 -0.0902 -0.1465 -0.0524 319 LEU B CB 2880 C CG . LEU B 319 ? 0.6506 0.6388 0.6558 -0.0807 -0.1492 -0.0507 319 LEU B CG 2881 C CD1 . LEU B 319 ? 0.6514 0.6272 0.6530 -0.0832 -0.1445 -0.0422 319 LEU B CD1 2882 C CD2 . LEU B 319 ? 0.6800 0.6859 0.6892 -0.0734 -0.1551 -0.0588 319 LEU B CD2 2883 N N . THR B 320 ? 0.5804 0.6433 0.6257 -0.1138 -0.1402 -0.0633 320 THR B N 2884 C CA . THR B 320 ? 0.5839 0.6619 0.6426 -0.1344 -0.1346 -0.0570 320 THR B CA 2885 C C . THR B 320 ? 0.6320 0.6858 0.6812 -0.1459 -0.1313 -0.0360 320 THR B C 2886 O O . THR B 320 ? 0.6239 0.6791 0.6605 -0.1413 -0.1274 -0.0289 320 THR B O 2887 C CB . THR B 320 ? 0.6903 0.8207 0.7598 -0.1407 -0.1293 -0.0663 320 THR B CB 2888 O OG1 . THR B 320 ? 0.6807 0.8280 0.7557 -0.1251 -0.1372 -0.0905 320 THR B OG1 2889 C CG2 . THR B 320 ? 0.6868 0.8382 0.7726 -0.1674 -0.1219 -0.0580 320 THR B CG2 2890 N N . VAL B 321 ? 0.5936 0.6235 0.6494 -0.1584 -0.1361 -0.0285 321 VAL B N 2891 C CA . VAL B 321 ? 0.6063 0.6051 0.6511 -0.1682 -0.1390 -0.0107 321 VAL B CA 2892 C C . VAL B 321 ? 0.6706 0.6834 0.7209 -0.1950 -0.1334 0.0060 321 VAL B C 2893 O O . VAL B 321 ? 0.6772 0.6903 0.7468 -0.2111 -0.1377 0.0062 321 VAL B O 2894 C CB . VAL B 321 ? 0.6623 0.6219 0.7084 -0.1619 -0.1541 -0.0144 321 VAL B CB 2895 C CG1 . VAL B 321 ? 0.6849 0.6089 0.7166 -0.1683 -0.1623 -0.0002 321 VAL B CG1 2896 C CG2 . VAL B 321 ? 0.6388 0.5952 0.6781 -0.1388 -0.1564 -0.0283 321 VAL B CG2 2897 N N . PRO B 322 ? 0.6309 0.6579 0.6652 -0.2005 -0.1240 0.0202 322 PRO B N 2898 C CA . PRO B 322 ? 0.6567 0.7007 0.6921 -0.2290 -0.1169 0.0405 322 PRO B CA 2899 C C . PRO B 322 ? 0.7418 0.7314 0.7664 -0.2446 -0.1290 0.0617 322 PRO B C 2900 O O . PRO B 322 ? 0.7371 0.6819 0.7497 -0.2286 -0.1422 0.0576 322 PRO B O 2901 C CB . PRO B 322 ? 0.6737 0.7563 0.6928 -0.2226 -0.1043 0.0454 322 PRO B CB 2902 C CG . PRO B 322 ? 0.7111 0.7680 0.7155 -0.1941 -0.1099 0.0357 322 PRO B CG 2903 C CD . PRO B 322 ? 0.6361 0.6660 0.6517 -0.1812 -0.1201 0.0187 322 PRO B CD 2904 N N . THR B 323 ? 0.7337 0.7285 0.7619 -0.2765 -0.1260 0.0838 323 THR B N 2905 C CA . THR B 323 ? 0.7815 0.7196 0.7985 -0.2961 -0.1414 0.1077 323 THR B CA 2906 C C . THR B 323 ? 0.8422 0.7397 0.8218 -0.2813 -0.1485 0.1182 323 THR B C 2907 O O . THR B 323 ? 0.8650 0.7023 0.8344 -0.2793 -0.1707 0.1222 323 THR B O 2908 C CB . THR B 323 ? 0.9355 0.8938 0.9608 -0.3373 -0.1334 0.1342 323 THR B CB 2909 O OG1 . THR B 323 ? 0.9326 0.9495 0.9428 -0.3428 -0.1103 0.1446 323 THR B OG1 2910 C CG2 . THR B 323 ? 0.9124 0.8958 0.9800 -0.3538 -0.1338 0.1214 323 THR B CG2 2911 N N . GLU B 324 ? 0.7776 0.7097 0.7386 -0.2676 -0.1324 0.1184 324 GLU B N 2912 C CA . GLU B 324 ? 0.7846 0.6880 0.7121 -0.2488 -0.1368 0.1231 324 GLU B CA 2913 C C . GLU B 324 ? 0.7971 0.6695 0.7247 -0.2176 -0.1497 0.0973 324 GLU B C 2914 O O . GLU B 324 ? 0.8103 0.6423 0.7139 -0.2042 -0.1617 0.0976 324 GLU B O 2915 C CB . GLU B 324 ? 0.7901 0.7483 0.7043 -0.2406 -0.1171 0.1267 324 GLU B CB 2916 C CG . GLU B 324 ? 0.8734 0.8946 0.8123 -0.2269 -0.1041 0.1030 324 GLU B CG 2917 C CD . GLU B 324 ? 1.1485 1.2341 1.1042 -0.2498 -0.0891 0.1087 324 GLU B CD 2918 O OE1 . GLU B 324 ? 1.1023 1.1812 1.0735 -0.2777 -0.0907 0.1185 324 GLU B OE1 2919 O OE2 . GLU B 324 ? 1.0618 1.2087 1.0183 -0.2384 -0.0776 0.0999 324 GLU B OE2 2920 N N . GLY B 325 ? 0.7057 0.5996 0.6585 -0.2067 -0.1473 0.0750 325 GLY B N 2921 C CA . GLY B 325 ? 0.6735 0.5492 0.6288 -0.1815 -0.1565 0.0523 325 GLY B CA 2922 C C . GLY B 325 ? 0.6738 0.5854 0.6345 -0.1616 -0.1439 0.0361 325 GLY B C 2923 O O . GLY B 325 ? 0.6613 0.6073 0.6186 -0.1601 -0.1314 0.0400 325 GLY B O 2924 N N . LEU B 326 ? 0.5997 0.5047 0.5689 -0.1461 -0.1492 0.0179 326 LEU B N 2925 C CA . LEU B 326 ? 0.5606 0.4895 0.5352 -0.1293 -0.1415 0.0043 326 LEU B CA 2926 C C . LEU B 326 ? 0.5938 0.5016 0.5613 -0.1130 -0.1480 -0.0073 326 LEU B C 2927 O O . LEU B 326 ? 0.5948 0.4827 0.5628 -0.1113 -0.1589 -0.0139 326 LEU B O 2928 C CB . LEU B 326 ? 0.5425 0.4933 0.5353 -0.1304 -0.1391 -0.0048 326 LEU B CB 2929 C CG . LEU B 326 ? 0.5782 0.5500 0.5753 -0.1161 -0.1344 -0.0158 326 LEU B CG 2930 C CD1 . LEU B 326 ? 0.5752 0.5830 0.5759 -0.1159 -0.1277 -0.0155 326 LEU B CD1 2931 C CD2 . LEU B 326 ? 0.6005 0.5751 0.6071 -0.1128 -0.1379 -0.0256 326 LEU B CD2 2932 N N . GLU B 327 ? 0.5303 0.4475 0.4936 -0.1003 -0.1425 -0.0123 327 GLU B N 2933 C CA . GLU B 327 ? 0.5162 0.4223 0.4766 -0.0865 -0.1461 -0.0250 327 GLU B CA 2934 C C . GLU B 327 ? 0.5354 0.4608 0.5092 -0.0810 -0.1404 -0.0323 327 GLU B C 2935 O O . GLU B 327 ? 0.5207 0.4648 0.5012 -0.0779 -0.1358 -0.0311 327 GLU B O 2936 C CB . GLU B 327 ? 0.5427 0.4411 0.4903 -0.0761 -0.1465 -0.0263 327 GLU B CB 2937 C CG . GLU B 327 ? 0.6668 0.5517 0.6111 -0.0632 -0.1527 -0.0429 327 GLU B CG 2938 C CD . GLU B 327 ? 0.9168 0.8022 0.8555 -0.0478 -0.1517 -0.0506 327 GLU B CD 2939 O OE1 . GLU B 327 ? 0.8296 0.7374 0.7816 -0.0415 -0.1446 -0.0527 327 GLU B OE1 2940 O OE2 . GLU B 327 ? 0.8536 0.7160 0.7755 -0.0393 -0.1612 -0.0575 327 GLU B OE2 2941 N N . VAL B 328 ? 0.4815 0.4039 0.4585 -0.0796 -0.1429 -0.0397 328 VAL B N 2942 C CA . VAL B 328 ? 0.4635 0.3981 0.4489 -0.0779 -0.1389 -0.0420 328 VAL B CA 2943 C C . VAL B 328 ? 0.5066 0.4415 0.4931 -0.0733 -0.1381 -0.0508 328 VAL B C 2944 O O . VAL B 328 ? 0.5064 0.4393 0.4879 -0.0718 -0.1421 -0.0588 328 VAL B O 2945 C CB . VAL B 328 ? 0.5119 0.4509 0.4988 -0.0827 -0.1402 -0.0400 328 VAL B CB 2946 C CG1 . VAL B 328 ? 0.5051 0.4506 0.4947 -0.0817 -0.1380 -0.0382 328 VAL B CG1 2947 C CG2 . VAL B 328 ? 0.5128 0.4548 0.5027 -0.0885 -0.1414 -0.0355 328 VAL B CG2 2948 N N . THR B 329 ? 0.4547 0.3952 0.4503 -0.0709 -0.1350 -0.0515 329 THR B N 2949 C CA . THR B 329 ? 0.4507 0.3961 0.4527 -0.0703 -0.1328 -0.0594 329 THR B CA 2950 C C . THR B 329 ? 0.5014 0.4521 0.5090 -0.0792 -0.1303 -0.0511 329 THR B C 2951 O O . THR B 329 ? 0.4977 0.4429 0.5116 -0.0792 -0.1337 -0.0446 329 THR B O 2952 C CB . THR B 329 ? 0.5468 0.4907 0.5573 -0.0601 -0.1339 -0.0686 329 THR B CB 2953 O OG1 . THR B 329 ? 0.5515 0.4867 0.5498 -0.0522 -0.1371 -0.0714 329 THR B OG1 2954 C CG2 . THR B 329 ? 0.5253 0.4775 0.5453 -0.0598 -0.1317 -0.0817 329 THR B CG2 2955 N N . TRP B 330 ? 0.4609 0.4234 0.4641 -0.0859 -0.1265 -0.0518 330 TRP B N 2956 C CA . TRP B 330 ? 0.4682 0.4363 0.4703 -0.0970 -0.1230 -0.0401 330 TRP B CA 2957 C C . TRP B 330 ? 0.5194 0.5026 0.5322 -0.1055 -0.1171 -0.0440 330 TRP B C 2958 O O . TRP B 330 ? 0.5147 0.5226 0.5248 -0.1073 -0.1124 -0.0538 330 TRP B O 2959 C CB . TRP B 330 ? 0.4580 0.4366 0.4453 -0.0979 -0.1224 -0.0364 330 TRP B CB 2960 C CG . TRP B 330 ? 0.4869 0.4764 0.4660 -0.1085 -0.1176 -0.0235 330 TRP B CG 2961 C CD1 . TRP B 330 ? 0.5304 0.5506 0.5023 -0.1122 -0.1118 -0.0257 330 TRP B CD1 2962 C CD2 . TRP B 330 ? 0.5028 0.4736 0.4766 -0.1158 -0.1204 -0.0060 330 TRP B CD2 2963 N NE1 . TRP B 330 ? 0.5457 0.5688 0.5064 -0.1237 -0.1076 -0.0069 330 TRP B NE1 2964 C CE2 . TRP B 330 ? 0.5729 0.5605 0.5335 -0.1263 -0.1142 0.0061 330 TRP B CE2 2965 C CE3 . TRP B 330 ? 0.5224 0.4654 0.5005 -0.1132 -0.1300 -0.0007 330 TRP B CE3 2966 C CZ2 . TRP B 330 ? 0.5934 0.5619 0.5413 -0.1361 -0.1176 0.0269 330 TRP B CZ2 2967 C CZ3 . TRP B 330 ? 0.5675 0.4917 0.5358 -0.1202 -0.1367 0.0153 330 TRP B CZ3 2968 C CH2 . TRP B 330 ? 0.6008 0.5332 0.5525 -0.1324 -0.1305 0.0308 330 TRP B CH2 2969 N N . GLY B 331 ? 0.4781 0.4496 0.5061 -0.1096 -0.1195 -0.0396 331 GLY B N 2970 C CA . GLY B 331 ? 0.4811 0.4651 0.5264 -0.1201 -0.1148 -0.0433 331 GLY B CA 2971 C C . GLY B 331 ? 0.5167 0.5166 0.5716 -0.1100 -0.1125 -0.0676 331 GLY B C 2972 O O . GLY B 331 ? 0.4979 0.4857 0.5519 -0.0931 -0.1183 -0.0786 331 GLY B O 2973 N N . ASN B 332 ? 0.4806 0.5108 0.5427 -0.1201 -0.1044 -0.0768 332 ASN B N 2974 C CA . ASN B 332 ? 0.4697 0.5192 0.5406 -0.1094 -0.1040 -0.1054 332 ASN B CA 2975 C C . ASN B 332 ? 0.5179 0.5785 0.5687 -0.0954 -0.1083 -0.1218 332 ASN B C 2976 O O . ASN B 332 ? 0.5092 0.5831 0.5628 -0.0835 -0.1122 -0.1485 332 ASN B O 2977 C CB . ASN B 332 ? 0.4848 0.5680 0.5768 -0.1264 -0.0949 -0.1128 332 ASN B CB 2978 C CG . ASN B 332 ? 0.7730 0.8393 0.8915 -0.1381 -0.0962 -0.1019 332 ASN B CG 2979 O OD1 . ASN B 332 ? 0.6891 0.7306 0.8212 -0.1227 -0.1057 -0.1096 332 ASN B OD1 2980 N ND2 . ASN B 332 ? 0.6914 0.7725 0.8185 -0.1654 -0.0882 -0.0840 332 ASN B ND2 2981 N N . ASN B 333 ? 0.4805 0.5331 0.5124 -0.0949 -0.1108 -0.1083 333 ASN B N 2982 C CA . ASN B 333 ? 0.4799 0.5367 0.4957 -0.0816 -0.1200 -0.1222 333 ASN B CA 2983 C C . ASN B 333 ? 0.5310 0.5534 0.5403 -0.0655 -0.1310 -0.1295 333 ASN B C 2984 O O . ASN B 333 ? 0.5202 0.5187 0.5337 -0.0647 -0.1297 -0.1176 333 ASN B O 2985 C CB . ASN B 333 ? 0.4953 0.5520 0.4980 -0.0853 -0.1207 -0.1057 333 ASN B CB 2986 C CG . ASN B 333 ? 0.8044 0.8977 0.8056 -0.0986 -0.1110 -0.0974 333 ASN B CG 2987 O OD1 . ASN B 333 ? 0.7458 0.8810 0.7463 -0.0968 -0.1106 -0.1143 333 ASN B OD1 2988 N ND2 . ASN B 333 ? 0.7081 0.7882 0.7063 -0.1110 -0.1047 -0.0719 333 ASN B ND2 2989 N N . GLU B 334 ? 0.4999 0.5211 0.4978 -0.0520 -0.1440 -0.1489 334 GLU B N 2990 C CA . GLU B 334 ? 0.5090 0.4937 0.4943 -0.0386 -0.1567 -0.1526 334 GLU B CA 2991 C C . GLU B 334 ? 0.5630 0.5233 0.5411 -0.0449 -0.1568 -0.1274 334 GLU B C 2992 O O . GLU B 334 ? 0.5568 0.5281 0.5354 -0.0524 -0.1550 -0.1183 334 GLU B O 2993 C CB . GLU B 334 ? 0.5421 0.5262 0.5150 -0.0237 -0.1760 -0.1787 334 GLU B CB 2994 C CG . GLU B 334 ? 0.6891 0.6974 0.6679 -0.0131 -0.1791 -0.2106 334 GLU B CG 2995 C CD . GLU B 334 ? 0.9785 0.9676 0.9595 -0.0039 -0.1772 -0.2175 334 GLU B CD 2996 O OE1 . GLU B 334 ? 0.9433 0.8932 0.9061 0.0084 -0.1895 -0.2162 334 GLU B OE1 2997 O OE2 . GLU B 334 ? 0.8972 0.9113 0.8985 -0.0088 -0.1644 -0.2243 334 GLU B OE2 2998 N N . PRO B 335 ? 0.5235 0.4566 0.4957 -0.0419 -0.1580 -0.1170 335 PRO B N 2999 C CA . PRO B 335 ? 0.5223 0.4423 0.4911 -0.0502 -0.1563 -0.0952 335 PRO B CA 3000 C C . PRO B 335 ? 0.5848 0.4945 0.5457 -0.0527 -0.1678 -0.0935 335 PRO B C 3001 O O . PRO B 335 ? 0.5969 0.4913 0.5476 -0.0448 -0.1834 -0.1058 335 PRO B O 3002 C CB . PRO B 335 ? 0.5505 0.4534 0.5129 -0.0449 -0.1561 -0.0886 335 PRO B CB 3003 C CG . PRO B 335 ? 0.6166 0.5107 0.5710 -0.0306 -0.1641 -0.1080 335 PRO B CG 3004 C CD . PRO B 335 ? 0.5474 0.4670 0.5160 -0.0299 -0.1604 -0.1255 335 PRO B CD 3005 N N . TYR B 336 ? 0.5353 0.4522 0.5021 -0.0617 -0.1633 -0.0808 336 TYR B N 3006 C CA . TYR B 336 ? 0.5436 0.4527 0.5094 -0.0638 -0.1746 -0.0796 336 TYR B CA 3007 C C . TYR B 336 ? 0.6020 0.4879 0.5639 -0.0717 -0.1766 -0.0644 336 TYR B C 3008 O O . TYR B 336 ? 0.5881 0.4800 0.5525 -0.0773 -0.1644 -0.0523 336 TYR B O 3009 C CB . TYR B 336 ? 0.5495 0.4792 0.5236 -0.0677 -0.1687 -0.0752 336 TYR B CB 3010 C CG . TYR B 336 ? 0.5652 0.5226 0.5411 -0.0662 -0.1598 -0.0800 336 TYR B CG 3011 C CD1 . TYR B 336 ? 0.5932 0.5712 0.5677 -0.0587 -0.1657 -0.0977 336 TYR B CD1 3012 C CD2 . TYR B 336 ? 0.5680 0.5334 0.5463 -0.0730 -0.1478 -0.0671 336 TYR B CD2 3013 C CE1 . TYR B 336 ? 0.5978 0.6084 0.5738 -0.0617 -0.1554 -0.0992 336 TYR B CE1 3014 C CE2 . TYR B 336 ? 0.5787 0.5660 0.5562 -0.0760 -0.1401 -0.0663 336 TYR B CE2 3015 C CZ . TYR B 336 ? 0.6729 0.6854 0.6495 -0.0721 -0.1419 -0.0808 336 TYR B CZ 3016 O OH . TYR B 336 ? 0.6866 0.7272 0.6622 -0.0792 -0.1321 -0.0772 336 TYR B OH 3017 N N . LYS B 337 ? 0.5785 0.4403 0.5349 -0.0726 -0.1936 -0.0653 337 LYS B N 3018 C CA . LYS B 337 ? 0.5938 0.4343 0.5459 -0.0853 -0.1956 -0.0474 337 LYS B CA 3019 C C . LYS B 337 ? 0.6458 0.4838 0.6116 -0.0948 -0.2038 -0.0434 337 LYS B C 3020 O O . LYS B 337 ? 0.6478 0.4800 0.6190 -0.0871 -0.2214 -0.0573 337 LYS B O 3021 C CB . LYS B 337 ? 0.6582 0.4638 0.5905 -0.0820 -0.2104 -0.0468 337 LYS B CB 3022 C CG . LYS B 337 ? 0.8377 0.6461 0.7572 -0.0742 -0.1995 -0.0461 337 LYS B CG 3023 C CD . LYS B 337 ? 1.0102 0.7804 0.9051 -0.0670 -0.2169 -0.0479 337 LYS B CD 3024 C CE . LYS B 337 ? 1.1512 0.9263 1.0341 -0.0551 -0.2070 -0.0502 337 LYS B CE 3025 N NZ . LYS B 337 ? 1.3186 1.0531 1.1726 -0.0448 -0.2259 -0.0537 337 LYS B NZ 3026 N N . TYR B 338 ? 0.5967 0.4447 0.5705 -0.1094 -0.1923 -0.0282 338 TYR B N 3027 C CA . TYR B 338 ? 0.5984 0.4486 0.5899 -0.1196 -0.1979 -0.0260 338 TYR B CA 3028 C C . TYR B 338 ? 0.6699 0.5069 0.6619 -0.1413 -0.1981 -0.0064 338 TYR B C 3029 O O . TYR B 338 ? 0.6648 0.5133 0.6472 -0.1491 -0.1834 0.0069 338 TYR B O 3030 C CB . TYR B 338 ? 0.5857 0.4694 0.5900 -0.1168 -0.1838 -0.0308 338 TYR B CB 3031 C CG . TYR B 338 ? 0.5901 0.4878 0.5917 -0.1000 -0.1822 -0.0445 338 TYR B CG 3032 C CD1 . TYR B 338 ? 0.6159 0.5168 0.6242 -0.0893 -0.1951 -0.0585 338 TYR B CD1 3033 C CD2 . TYR B 338 ? 0.5840 0.4950 0.5777 -0.0953 -0.1686 -0.0432 338 TYR B CD2 3034 C CE1 . TYR B 338 ? 0.6129 0.5341 0.6163 -0.0764 -0.1914 -0.0682 338 TYR B CE1 3035 C CE2 . TYR B 338 ? 0.5841 0.5083 0.5751 -0.0852 -0.1660 -0.0514 338 TYR B CE2 3036 C CZ . TYR B 338 ? 0.6831 0.6145 0.6772 -0.0769 -0.1758 -0.0626 338 TYR B CZ 3037 O OH . TYR B 338 ? 0.6929 0.6443 0.6819 -0.0693 -0.1713 -0.0681 338 TYR B OH 3038 N N . TRP B 339 ? 0.6474 0.4634 0.6522 -0.1511 -0.2159 -0.0050 339 TRP B N 3039 C CA . TRP B 339 ? 0.6768 0.4781 0.6857 -0.1773 -0.2185 0.0159 339 TRP B CA 3040 C C . TRP B 339 ? 0.7287 0.5380 0.7695 -0.1874 -0.2260 0.0104 339 TRP B C 3041 O O . TRP B 339 ? 0.7161 0.5184 0.7704 -0.1714 -0.2436 -0.0090 339 TRP B O 3042 C CB . TRP B 339 ? 0.7062 0.4553 0.6964 -0.1816 -0.2418 0.0257 339 TRP B CB 3043 C CG . TRP B 339 ? 0.7281 0.4669 0.6860 -0.1773 -0.2340 0.0361 339 TRP B CG 3044 C CD1 . TRP B 339 ? 0.7838 0.5284 0.7257 -0.1944 -0.2190 0.0607 339 TRP B CD1 3045 C CD2 . TRP B 339 ? 0.7221 0.4450 0.6602 -0.1529 -0.2430 0.0201 339 TRP B CD2 3046 N NE1 . TRP B 339 ? 0.7839 0.5151 0.6967 -0.1793 -0.2184 0.0606 339 TRP B NE1 3047 C CE2 . TRP B 339 ? 0.7874 0.5038 0.6985 -0.1544 -0.2331 0.0349 339 TRP B CE2 3048 C CE3 . TRP B 339 ? 0.7220 0.4427 0.6634 -0.1291 -0.2580 -0.0074 339 TRP B CE3 3049 C CZ2 . TRP B 339 ? 0.7786 0.4816 0.6681 -0.1321 -0.2387 0.0213 339 TRP B CZ2 3050 C CZ3 . TRP B 339 ? 0.7411 0.4526 0.6615 -0.1101 -0.2623 -0.0205 339 TRP B CZ3 3051 C CH2 . TRP B 339 ? 0.7643 0.4649 0.6600 -0.1112 -0.2531 -0.0071 339 TRP B CH2 3052 N N . PRO B 340 ? 0.6968 0.5252 0.7518 -0.2125 -0.2141 0.0246 340 PRO B N 3053 C CA . PRO B 340 ? 0.6967 0.5337 0.7864 -0.2214 -0.2224 0.0156 340 PRO B CA 3054 C C . PRO B 340 ? 0.7922 0.5819 0.8944 -0.2355 -0.2517 0.0230 340 PRO B C 3055 O O . PRO B 340 ? 0.8268 0.5812 0.9095 -0.2519 -0.2594 0.0456 340 PRO B O 3056 C CB . PRO B 340 ? 0.7130 0.5944 0.8133 -0.2439 -0.1984 0.0256 340 PRO B CB 3057 C CG . PRO B 340 ? 0.7660 0.6620 0.8361 -0.2455 -0.1796 0.0409 340 PRO B CG 3058 C CD . PRO B 340 ? 0.7261 0.5765 0.7685 -0.2328 -0.1931 0.0465 340 PRO B CD 3059 N N . GLN B 341 ? 0.7472 0.5342 0.8814 -0.2273 -0.2709 0.0033 341 GLN B N 3060 C CA . GLN B 341 ? 0.7889 0.5305 0.9432 -0.2376 -0.3051 0.0051 341 GLN B CA 3061 C C . GLN B 341 ? 0.8755 0.6161 1.0508 -0.2793 -0.3001 0.0289 341 GLN B C 3062 O O . GLN B 341 ? 0.8475 0.6357 1.0431 -0.2906 -0.2772 0.0256 341 GLN B O 3063 C CB . GLN B 341 ? 0.7881 0.5347 0.9728 -0.2097 -0.3288 -0.0282 341 GLN B CB 3064 C CG . GLN B 341 ? 0.9439 0.6834 1.1094 -0.1728 -0.3448 -0.0497 341 GLN B CG 3065 C CD . GLN B 341 ? 1.2084 0.8962 1.3759 -0.1661 -0.3883 -0.0557 341 GLN B CD 3066 O OE1 . GLN B 341 ? 1.1919 0.8336 1.3432 -0.1870 -0.4001 -0.0329 341 GLN B OE1 3067 N NE2 . GLN B 341 ? 1.0930 0.7884 1.2776 -0.1340 -0.4154 -0.0878 341 GLN B NE2 3068 N N . LEU B 342 ? 0.8926 0.5794 1.0619 -0.3027 -0.3227 0.0526 342 LEU B N 3069 C CA . LEU B 342 ? 0.9742 0.6521 1.1602 -0.3488 -0.3209 0.0821 342 LEU B CA 3070 C C . LEU B 342 ? 1.1153 0.8039 1.3574 -0.3577 -0.3352 0.0651 342 LEU B C 3071 O O . LEU B 342 ? 1.1333 0.8623 1.3990 -0.3882 -0.3131 0.0747 342 LEU B O 3072 C CB . LEU B 342 ? 1.0475 0.6522 1.2087 -0.3680 -0.3490 0.1116 342 LEU B CB 3073 C CG . LEU B 342 ? 1.1239 0.7176 1.2301 -0.3706 -0.3326 0.1370 342 LEU B CG 3074 C CD1 . LEU B 342 ? 1.1189 0.6759 1.1949 -0.3302 -0.3548 0.1169 342 LEU B CD1 3075 C CD2 . LEU B 342 ? 1.2355 0.7851 1.3247 -0.4144 -0.3408 0.1816 342 LEU B CD2 3076 N N . GLY C 21 ? 0.6355 0.6046 0.8403 -0.0718 -0.1834 0.1124 -1 GLY F N 3077 C CA . GLY C 21 ? 0.6290 0.5964 0.8657 -0.0575 -0.1733 0.1078 -1 GLY F CA 3078 C C . GLY C 21 ? 0.6611 0.6346 0.8908 -0.0492 -0.1514 0.0908 -1 GLY F C 3079 O O . GLY C 21 ? 0.6455 0.6264 0.9011 -0.0397 -0.1419 0.0865 -1 GLY F O 3080 N N . GLY C 22 ? 0.6158 0.5863 0.8112 -0.0539 -0.1439 0.0821 0 GLY F N 3081 C CA . GLY C 22 ? 0.6009 0.5761 0.7855 -0.0489 -0.1258 0.0680 0 GLY F CA 3082 C C . GLY C 22 ? 0.6448 0.6202 0.7931 -0.0566 -0.1227 0.0627 0 GLY F C 3083 O O . GLY C 22 ? 0.6498 0.6197 0.7805 -0.0657 -0.1322 0.0684 0 GLY F O 3084 N N . TYR C 23 ? 0.5858 0.5674 0.7242 -0.0538 -0.1094 0.0525 1 TYR F N 3085 C CA . TYR C 23 ? 0.5768 0.5613 0.6876 -0.0594 -0.1049 0.0476 1 TYR F CA 3086 C C . TYR C 23 ? 0.6075 0.6035 0.7120 -0.0591 -0.1000 0.0438 1 TYR F C 3087 O O . TYR C 23 ? 0.5941 0.5954 0.7106 -0.0531 -0.0934 0.0398 1 TYR F O 3088 C CB . TYR C 23 ? 0.5930 0.5723 0.6972 -0.0580 -0.0954 0.0405 1 TYR F CB 3089 C CG . TYR C 23 ? 0.6106 0.5952 0.6920 -0.0634 -0.0912 0.0367 1 TYR F CG 3090 C CD1 . TYR C 23 ? 0.6261 0.6189 0.7040 -0.0614 -0.0823 0.0308 1 TYR F CD1 3091 C CD2 . TYR C 23 ? 0.6271 0.6086 0.6923 -0.0712 -0.0963 0.0399 1 TYR F CD2 3092 C CE1 . TYR C 23 ? 0.6338 0.6328 0.6963 -0.0660 -0.0796 0.0291 1 TYR F CE1 3093 C CE2 . TYR C 23 ? 0.6343 0.6227 0.6837 -0.0758 -0.0918 0.0370 1 TYR F CE2 3094 C CZ . TYR C 23 ? 0.7178 0.7154 0.7679 -0.0727 -0.0839 0.0321 1 TYR F CZ 3095 O OH . TYR C 23 ? 0.7251 0.7309 0.7650 -0.0768 -0.0806 0.0311 1 TYR F OH 3096 N N . GLU C 24 ? 0.5593 0.5581 0.6449 -0.0661 -0.1024 0.0448 2 GLU F N 3097 C CA . GLU C 24 ? 0.5459 0.5532 0.6247 -0.0662 -0.0973 0.0412 2 GLU F CA 3098 C C . GLU C 24 ? 0.5791 0.5918 0.6485 -0.0653 -0.0880 0.0350 2 GLU F C 3099 O O . GLU C 24 ? 0.5761 0.5877 0.6334 -0.0703 -0.0876 0.0349 2 GLU F O 3100 C CB . GLU C 24 ? 0.5721 0.5774 0.6370 -0.0750 -0.1035 0.0451 2 GLU F CB 3101 C CG . GLU C 24 ? 0.7062 0.7173 0.7655 -0.0750 -0.0978 0.0412 2 GLU F CG 3102 C CD . GLU C 24 ? 0.9876 0.9936 1.0286 -0.0856 -0.1009 0.0430 2 GLU F CD 3103 O OE1 . GLU C 24 ? 0.9102 0.9176 0.9384 -0.0884 -0.0926 0.0378 2 GLU F OE1 3104 O OE2 . GLU C 24 ? 0.9316 0.9316 0.9714 -0.0921 -0.1116 0.0500 2 GLU F OE2 3105 N N . HIS C 25 ? 0.5210 0.5397 0.5968 -0.0599 -0.0812 0.0308 3 HIS F N 3106 C CA . HIS C 25 ? 0.5104 0.5349 0.5802 -0.0595 -0.0745 0.0269 3 HIS F CA 3107 C C . HIS C 25 ? 0.5457 0.5769 0.6129 -0.0593 -0.0718 0.0259 3 HIS F C 3108 O O . HIS C 25 ? 0.5365 0.5690 0.6093 -0.0565 -0.0715 0.0255 3 HIS F O 3109 C CB . HIS C 25 ? 0.5181 0.5420 0.5942 -0.0560 -0.0694 0.0235 3 HIS F CB 3110 C CG . HIS C 25 ? 0.5580 0.5873 0.6274 -0.0578 -0.0650 0.0217 3 HIS F CG 3111 N ND1 . HIS C 25 ? 0.5849 0.6133 0.6458 -0.0623 -0.0652 0.0224 3 HIS F ND1 3112 C CD2 . HIS C 25 ? 0.5741 0.6092 0.6450 -0.0564 -0.0620 0.0206 3 HIS F CD2 3113 C CE1 . HIS C 25 ? 0.5741 0.6088 0.6330 -0.0638 -0.0630 0.0225 3 HIS F CE1 3114 N NE2 . HIS C 25 ? 0.5724 0.6108 0.6370 -0.0603 -0.0612 0.0216 3 HIS F NE2 3115 N N . VAL C 26 ? 0.4965 0.5315 0.5563 -0.0624 -0.0691 0.0255 4 VAL F N 3116 C CA . VAL C 26 ? 0.4879 0.5278 0.5471 -0.0618 -0.0646 0.0239 4 VAL F CA 3117 C C . VAL C 26 ? 0.5233 0.5716 0.5883 -0.0593 -0.0603 0.0236 4 VAL F C 3118 O O . VAL C 26 ? 0.5193 0.5710 0.5832 -0.0619 -0.0602 0.0249 4 VAL F O 3119 C CB . VAL C 26 ? 0.5465 0.5832 0.5953 -0.0682 -0.0634 0.0236 4 VAL F CB 3120 C CG1 . VAL C 26 ? 0.5447 0.5840 0.5941 -0.0672 -0.0558 0.0204 4 VAL F CG1 3121 C CG2 . VAL C 26 ? 0.5538 0.5812 0.5952 -0.0732 -0.0705 0.0261 4 VAL F CG2 3122 N N . THR C 27 ? 0.4698 0.5211 0.5411 -0.0553 -0.0581 0.0229 5 THR F N 3123 C CA . THR C 27 ? 0.4618 0.5207 0.5404 -0.0536 -0.0563 0.0246 5 THR F CA 3124 C C . THR C 27 ? 0.5064 0.5672 0.5919 -0.0499 -0.0528 0.0240 5 THR F C 3125 O O . THR C 27 ? 0.5017 0.5567 0.5835 -0.0491 -0.0517 0.0215 5 THR F O 3126 C CB . THR C 27 ? 0.5612 0.6195 0.6389 -0.0547 -0.0591 0.0258 5 THR F CB 3127 O OG1 . THR C 27 ? 0.5516 0.6168 0.6347 -0.0556 -0.0598 0.0295 5 THR F OG1 3128 C CG2 . THR C 27 ? 0.5410 0.5940 0.6184 -0.0527 -0.0592 0.0234 5 THR F CG2 3129 N N . VAL C 28 ? 0.4607 0.5288 0.5567 -0.0482 -0.0517 0.0271 6 VAL F N 3130 C CA . VAL C 28 ? 0.4579 0.5269 0.5637 -0.0440 -0.0482 0.0273 6 VAL F CA 3131 C C . VAL C 28 ? 0.5016 0.5750 0.6154 -0.0433 -0.0531 0.0327 6 VAL F C 3132 O O . VAL C 28 ? 0.4977 0.5782 0.6167 -0.0460 -0.0568 0.0379 6 VAL F O 3133 C CB . VAL C 28 ? 0.5115 0.5844 0.6270 -0.0426 -0.0406 0.0261 6 VAL F CB 3134 C CG1 . VAL C 28 ? 0.5110 0.5834 0.6403 -0.0372 -0.0361 0.0264 6 VAL F CG1 3135 C CG2 . VAL C 28 ? 0.5169 0.5827 0.6192 -0.0463 -0.0357 0.0204 6 VAL F CG2 3136 N N . ILE C 29 ? 0.4537 0.5222 0.5667 -0.0414 -0.0539 0.0323 7 ILE F N 3137 C CA . ILE C 29 ? 0.4503 0.5207 0.5678 -0.0426 -0.0593 0.0378 7 ILE F CA 3138 C C . ILE C 29 ? 0.5000 0.5695 0.6308 -0.0376 -0.0575 0.0400 7 ILE F C 3139 O O . ILE C 29 ? 0.4965 0.5598 0.6258 -0.0342 -0.0514 0.0346 7 ILE F O 3140 C CB . ILE C 29 ? 0.4896 0.5544 0.5938 -0.0467 -0.0621 0.0361 7 ILE F CB 3141 C CG1 . ILE C 29 ? 0.4932 0.5513 0.5926 -0.0441 -0.0590 0.0309 7 ILE F CG1 3142 C CG2 . ILE C 29 ? 0.4994 0.5639 0.5938 -0.0515 -0.0629 0.0344 7 ILE F CG2 3143 C CD1 . ILE C 29 ? 0.5797 0.6343 0.6734 -0.0472 -0.0610 0.0310 7 ILE F CD1 3144 N N . PRO C 30 ? 0.4568 0.5308 0.6002 -0.0379 -0.0631 0.0481 8 PRO F N 3145 C CA . PRO C 30 ? 0.4576 0.5289 0.6161 -0.0323 -0.0615 0.0505 8 PRO F CA 3146 C C . PRO C 30 ? 0.5055 0.5661 0.6518 -0.0326 -0.0614 0.0469 8 PRO F C 3147 O O . PRO C 30 ? 0.4988 0.5571 0.6298 -0.0382 -0.0655 0.0462 8 PRO F O 3148 C CB . PRO C 30 ? 0.4825 0.5613 0.6569 -0.0345 -0.0710 0.0625 8 PRO F CB 3149 C CG . PRO C 30 ? 0.5368 0.6232 0.7045 -0.0415 -0.0759 0.0656 8 PRO F CG 3150 C CD . PRO C 30 ? 0.4777 0.5578 0.6214 -0.0446 -0.0721 0.0564 8 PRO F CD 3151 N N . ASN C 31 ? 0.4636 0.5170 0.6166 -0.0273 -0.0557 0.0441 9 ASN F N 3152 C CA . ASN C 31 ? 0.4639 0.5067 0.6056 -0.0282 -0.0556 0.0410 9 ASN F CA 3153 C C . ASN C 31 ? 0.5114 0.5530 0.6571 -0.0307 -0.0646 0.0494 9 ASN F C 3154 O O . ASN C 31 ? 0.5137 0.5495 0.6711 -0.0270 -0.0648 0.0527 9 ASN F O 3155 C CB . ASN C 31 ? 0.4847 0.5174 0.6283 -0.0236 -0.0459 0.0346 9 ASN F CB 3156 C CG . ASN C 31 ? 0.7908 0.8116 0.9200 -0.0258 -0.0456 0.0309 9 ASN F CG 3157 O OD1 . ASN C 31 ? 0.7211 0.7426 0.8369 -0.0308 -0.0507 0.0307 9 ASN F OD1 3158 N ND2 . ASN C 31 ? 0.7009 0.7103 0.8333 -0.0227 -0.0385 0.0275 9 ASN F ND2 3159 N N . THR C 32 ? 0.4615 0.5073 0.5966 -0.0382 -0.0719 0.0529 10 THR F N 3160 C CA . THR C 32 ? 0.4641 0.5080 0.5966 -0.0447 -0.0814 0.0611 10 THR F CA 3161 C C . THR C 32 ? 0.5084 0.5494 0.6188 -0.0530 -0.0817 0.0567 10 THR F C 3162 O O . THR C 32 ? 0.4986 0.5434 0.5999 -0.0565 -0.0797 0.0530 10 THR F O 3163 C CB . THR C 32 ? 0.5667 0.6188 0.7117 -0.0479 -0.0900 0.0720 10 THR F CB 3164 O OG1 . THR C 32 ? 0.5588 0.6161 0.7290 -0.0389 -0.0869 0.0746 10 THR F OG1 3165 C CG2 . THR C 32 ? 0.5592 0.6076 0.7024 -0.0561 -0.1018 0.0828 10 THR F CG2 3166 N N . VAL C 33 ? 0.4691 0.5026 0.5720 -0.0561 -0.0834 0.0569 11 VAL F N 3167 C CA . VAL C 33 ? 0.4683 0.4990 0.5532 -0.0641 -0.0820 0.0524 11 VAL F CA 3168 C C . VAL C 33 ? 0.5243 0.5546 0.5979 -0.0763 -0.0887 0.0583 11 VAL F C 3169 O O . VAL C 33 ? 0.5269 0.5558 0.6055 -0.0798 -0.0979 0.0684 11 VAL F O 3170 C CB . VAL C 33 ? 0.5215 0.5445 0.6031 -0.0629 -0.0803 0.0499 11 VAL F CB 3171 C CG1 . VAL C 33 ? 0.5250 0.5458 0.5910 -0.0727 -0.0800 0.0477 11 VAL F CG1 3172 C CG2 . VAL C 33 ? 0.5118 0.5340 0.5969 -0.0551 -0.0730 0.0426 11 VAL F CG2 3173 N N . GLY C 34 ? 0.4804 0.5110 0.5394 -0.0835 -0.0838 0.0522 12 GLY F N 3174 C CA . GLY C 34 ? 0.4917 0.5190 0.5338 -0.0979 -0.0870 0.0550 12 GLY F CA 3175 C C . GLY C 34 ? 0.5421 0.5722 0.5818 -0.1029 -0.0910 0.0594 12 GLY F C 3176 O O . GLY C 34 ? 0.5524 0.5779 0.5768 -0.1172 -0.0966 0.0646 12 GLY F O 3177 N N . VAL C 35 ? 0.4847 0.5216 0.5374 -0.0932 -0.0886 0.0576 13 VAL F N 3178 C CA . VAL C 35 ? 0.4839 0.5244 0.5355 -0.0975 -0.0923 0.0617 13 VAL F CA 3179 C C . VAL C 35 ? 0.5230 0.5643 0.5695 -0.0950 -0.0825 0.0515 13 VAL F C 3180 O O . VAL C 35 ? 0.5044 0.5499 0.5630 -0.0834 -0.0778 0.0470 13 VAL F O 3181 C CB . VAL C 35 ? 0.5275 0.5760 0.6013 -0.0901 -0.0998 0.0712 13 VAL F CB 3182 C CG1 . VAL C 35 ? 0.5298 0.5831 0.6020 -0.0970 -0.1050 0.0769 13 VAL F CG1 3183 C CG2 . VAL C 35 ? 0.5324 0.5792 0.6162 -0.0910 -0.1094 0.0818 13 VAL F CG2 3184 N N . PRO C 36 ? 0.4880 0.5235 0.5160 -0.1063 -0.0792 0.0478 14 PRO F N 3185 C CA . PRO C 36 ? 0.4798 0.5143 0.5056 -0.1031 -0.0698 0.0385 14 PRO F CA 3186 C C . PRO C 36 ? 0.5194 0.5590 0.5512 -0.1006 -0.0737 0.0423 14 PRO F C 3187 O O . PRO C 36 ? 0.5239 0.5640 0.5499 -0.1097 -0.0816 0.0503 14 PRO F O 3188 C CB . PRO C 36 ? 0.5213 0.5453 0.5250 -0.1172 -0.0633 0.0328 14 PRO F CB 3189 C CG . PRO C 36 ? 0.5932 0.6128 0.5845 -0.1292 -0.0700 0.0394 14 PRO F CG 3190 C CD . PRO C 36 ? 0.5289 0.5563 0.5356 -0.1239 -0.0831 0.0516 14 PRO F CD 3191 N N . TYR C 37 ? 0.4596 0.5033 0.5028 -0.0895 -0.0690 0.0375 15 TYR F N 3192 C CA . TYR C 37 ? 0.4517 0.5004 0.5006 -0.0869 -0.0713 0.0400 15 TYR F CA 3193 C C . TYR C 37 ? 0.4973 0.5401 0.5377 -0.0882 -0.0646 0.0324 15 TYR F C 3194 O O . TYR C 37 ? 0.4886 0.5276 0.5308 -0.0834 -0.0575 0.0250 15 TYR F O 3195 C CB . TYR C 37 ? 0.4539 0.5107 0.5214 -0.0747 -0.0718 0.0413 15 TYR F CB 3196 C CG . TYR C 37 ? 0.4773 0.5385 0.5568 -0.0718 -0.0769 0.0482 15 TYR F CG 3197 C CD1 . TYR C 37 ? 0.5070 0.5743 0.5949 -0.0753 -0.0849 0.0583 15 TYR F CD1 3198 C CD2 . TYR C 37 ? 0.4833 0.5423 0.5678 -0.0655 -0.0741 0.0454 15 TYR F CD2 3199 C CE1 . TYR C 37 ? 0.5180 0.5886 0.6213 -0.0715 -0.0896 0.0653 15 TYR F CE1 3200 C CE2 . TYR C 37 ? 0.4961 0.5567 0.5921 -0.0625 -0.0782 0.0513 15 TYR F CE2 3201 C CZ . TYR C 37 ? 0.5988 0.6649 0.7055 -0.0649 -0.0857 0.0613 15 TYR F CZ 3202 O OH . TYR C 37 ? 0.6175 0.6845 0.7397 -0.0609 -0.0896 0.0679 15 TYR F OH 3203 N N . LYS C 38 ? 0.4567 0.4985 0.4896 -0.0950 -0.0673 0.0352 16 LYS F N 3204 C CA . LYS C 38 ? 0.4587 0.4925 0.4826 -0.0972 -0.0615 0.0288 16 LYS F CA 3205 C C . LYS C 38 ? 0.4929 0.5328 0.5278 -0.0893 -0.0628 0.0296 16 LYS F C 3206 O O . LYS C 38 ? 0.4839 0.5329 0.5256 -0.0892 -0.0690 0.0366 16 LYS F O 3207 C CB . LYS C 38 ? 0.5103 0.5358 0.5135 -0.1126 -0.0632 0.0306 16 LYS F CB 3208 C CG . LYS C 38 ? 0.7017 0.7174 0.6879 -0.1241 -0.0601 0.0282 16 LYS F CG 3209 C CD . LYS C 38 ? 0.8347 0.8355 0.8083 -0.1280 -0.0467 0.0163 16 LYS F CD 3210 C CE . LYS C 38 ? 0.9801 0.9742 0.9455 -0.1335 -0.0392 0.0108 16 LYS F CE 3211 N NZ . LYS C 38 ? 1.1156 1.1056 1.0605 -0.1504 -0.0461 0.0174 16 LYS F NZ 3212 N N . THR C 39 ? 0.4424 0.4774 0.4802 -0.0833 -0.0571 0.0230 17 THR F N 3213 C CA . THR C 39 ? 0.4306 0.4686 0.4752 -0.0777 -0.0585 0.0235 17 THR F CA 3214 C C . THR C 39 ? 0.4832 0.5103 0.5198 -0.0807 -0.0550 0.0191 17 THR F C 3215 O O . THR C 39 ? 0.4839 0.5017 0.5194 -0.0800 -0.0486 0.0130 17 THR F O 3216 C CB . THR C 39 ? 0.5208 0.5642 0.5786 -0.0680 -0.0584 0.0229 17 THR F CB 3217 O OG1 . THR C 39 ? 0.5146 0.5610 0.5754 -0.0658 -0.0604 0.0245 17 THR F OG1 3218 C CG2 . THR C 39 ? 0.5009 0.5387 0.5631 -0.0636 -0.0540 0.0176 17 THR F CG2 3219 N N . LEU C 40 ? 0.4384 0.4664 0.4706 -0.0841 -0.0585 0.0222 18 LEU F N 3220 C CA . LEU C 40 ? 0.4454 0.4615 0.4689 -0.0876 -0.0561 0.0188 18 LEU F CA 3221 C C . LEU C 40 ? 0.4885 0.5041 0.5214 -0.0802 -0.0571 0.0182 18 LEU F C 3222 O O . LEU C 40 ? 0.4750 0.4992 0.5116 -0.0788 -0.0616 0.0223 18 LEU F O 3223 C CB . LEU C 40 ? 0.4554 0.4710 0.4656 -0.0983 -0.0602 0.0230 18 LEU F CB 3224 C CG . LEU C 40 ? 0.5298 0.5303 0.5270 -0.1041 -0.0577 0.0195 18 LEU F CG 3225 C CD1 . LEU C 40 ? 0.5499 0.5333 0.5350 -0.1094 -0.0490 0.0119 18 LEU F CD1 3226 C CD2 . LEU C 40 ? 0.5656 0.5695 0.5522 -0.1143 -0.0639 0.0257 18 LEU F CD2 3227 N N . VAL C 41 ? 0.4510 0.4562 0.4885 -0.0763 -0.0528 0.0134 19 VAL F N 3228 C CA . VAL C 41 ? 0.4469 0.4492 0.4937 -0.0707 -0.0556 0.0143 19 VAL F CA 3229 C C . VAL C 41 ? 0.5113 0.5015 0.5494 -0.0754 -0.0559 0.0137 19 VAL F C 3230 O O . VAL C 41 ? 0.5194 0.4965 0.5540 -0.0774 -0.0495 0.0087 19 VAL F O 3231 C CB . VAL C 41 ? 0.4937 0.4933 0.5564 -0.0633 -0.0526 0.0116 19 VAL F CB 3232 C CG1 . VAL C 41 ? 0.4913 0.4880 0.5641 -0.0593 -0.0586 0.0152 19 VAL F CG1 3233 C CG2 . VAL C 41 ? 0.4798 0.4902 0.5485 -0.0601 -0.0522 0.0120 19 VAL F CG2 3234 N N . ASN C 42 ? 0.4672 0.4606 0.5004 -0.0782 -0.0622 0.0183 20 ASN F N 3235 C CA . ASN C 42 ? 0.4782 0.4602 0.5016 -0.0837 -0.0638 0.0188 20 ASN F CA 3236 C C . ASN C 42 ? 0.5280 0.5058 0.5571 -0.0811 -0.0699 0.0222 20 ASN F C 3237 O O . ASN C 42 ? 0.5190 0.5047 0.5446 -0.0838 -0.0752 0.0265 20 ASN F O 3238 C CB . ASN C 42 ? 0.4910 0.4792 0.5004 -0.0928 -0.0663 0.0219 20 ASN F CB 3239 C CG . ASN C 42 ? 0.7911 0.7663 0.7869 -0.1005 -0.0676 0.0221 20 ASN F CG 3240 O OD1 . ASN C 42 ? 0.7298 0.6899 0.7168 -0.1044 -0.0626 0.0176 20 ASN F OD1 3241 N ND2 . ASN C 42 ? 0.6898 0.6691 0.6820 -0.1041 -0.0733 0.0267 20 ASN F ND2 3242 N N . ARG C 43 ? 0.4897 0.4547 0.5289 -0.0765 -0.0688 0.0206 21 ARG F N 3243 C CA . ARG C 43 ? 0.4902 0.4485 0.5367 -0.0749 -0.0765 0.0255 21 ARG F CA 3244 C C . ARG C 43 ? 0.5547 0.4985 0.5887 -0.0813 -0.0780 0.0260 21 ARG F C 3245 O O . ARG C 43 ? 0.5604 0.4917 0.5921 -0.0819 -0.0707 0.0207 21 ARG F O 3246 C CB . ARG C 43 ? 0.4905 0.4433 0.5597 -0.0662 -0.0753 0.0251 21 ARG F CB 3247 C CG . ARG C 43 ? 0.6150 0.5641 0.6950 -0.0650 -0.0865 0.0332 21 ARG F CG 3248 C CD . ARG C 43 ? 0.7337 0.6775 0.8414 -0.0564 -0.0857 0.0340 21 ARG F CD 3249 N NE . ARG C 43 ? 0.8377 0.7775 0.9571 -0.0568 -0.0993 0.0442 21 ARG F NE 3250 C CZ . ARG C 43 ? 1.0262 0.9613 1.1742 -0.0500 -0.1025 0.0486 21 ARG F CZ 3251 N NH1 . ARG C 43 ? 0.8699 0.8038 1.0387 -0.0416 -0.0907 0.0421 21 ARG F NH1 3252 N NH2 . ARG C 43 ? 0.8729 0.8043 1.0299 -0.0524 -0.1176 0.0600 21 ARG F NH2 3253 N N . PRO C 44 ? 0.5141 0.4585 0.5378 -0.0877 -0.0861 0.0316 22 PRO F N 3254 C CA . PRO C 44 ? 0.5273 0.4576 0.5374 -0.0949 -0.0880 0.0323 22 PRO F CA 3255 C C . PRO C 44 ? 0.5903 0.4995 0.6106 -0.0909 -0.0874 0.0314 22 PRO F C 3256 O O . PRO C 44 ? 0.5863 0.4921 0.6244 -0.0849 -0.0929 0.0356 22 PRO F O 3257 C CB . PRO C 44 ? 0.5498 0.4857 0.5497 -0.1022 -0.0970 0.0388 22 PRO F CB 3258 C CG . PRO C 44 ? 0.5954 0.5419 0.6056 -0.0980 -0.1006 0.0417 22 PRO F CG 3259 C CD . PRO C 44 ? 0.5251 0.4813 0.5465 -0.0901 -0.0929 0.0367 22 PRO F CD 3260 N N . GLY C 45 ? 0.5586 0.4535 0.5686 -0.0946 -0.0805 0.0261 23 GLY F N 3261 C CA . GLY C 45 ? 0.5747 0.4466 0.5939 -0.0910 -0.0763 0.0231 23 GLY F CA 3262 C C . GLY C 45 ? 0.6212 0.4894 0.6591 -0.0819 -0.0643 0.0156 23 GLY F C 3263 O O . GLY C 45 ? 0.6315 0.4813 0.6836 -0.0769 -0.0585 0.0124 23 GLY F O 3264 N N . TYR C 46 ? 0.5595 0.4448 0.5987 -0.0800 -0.0597 0.0127 24 TYR F N 3265 C CA . TYR C 46 ? 0.5547 0.4399 0.6096 -0.0730 -0.0478 0.0055 24 TYR F CA 3266 C C . TYR C 46 ? 0.6009 0.4916 0.6359 -0.0800 -0.0394 -0.0009 24 TYR F C 3267 O O . TYR C 46 ? 0.5843 0.4886 0.6036 -0.0864 -0.0457 0.0030 24 TYR F O 3268 C CB . TYR C 46 ? 0.5507 0.4516 0.6307 -0.0634 -0.0533 0.0105 24 TYR F CB 3269 C CG . TYR C 46 ? 0.5771 0.4718 0.6800 -0.0573 -0.0627 0.0182 24 TYR F CG 3270 C CD1 . TYR C 46 ? 0.6105 0.4963 0.7434 -0.0480 -0.0566 0.0164 24 TYR F CD1 3271 C CD2 . TYR C 46 ? 0.5844 0.4827 0.6805 -0.0615 -0.0778 0.0280 24 TYR F CD2 3272 C CE1 . TYR C 46 ? 0.6265 0.5073 0.7843 -0.0427 -0.0676 0.0259 24 TYR F CE1 3273 C CE2 . TYR C 46 ? 0.6029 0.4946 0.7184 -0.0581 -0.0889 0.0370 24 TYR F CE2 3274 C CZ . TYR C 46 ? 0.7061 0.5894 0.8537 -0.0484 -0.0849 0.0368 24 TYR F CZ 3275 O OH . TYR C 46 ? 0.7277 0.6052 0.8980 -0.0453 -0.0979 0.0479 24 TYR F OH 3276 N N . SER C 47 ? 0.5702 0.4500 0.6071 -0.0797 -0.0249 -0.0104 25 SER F N 3277 C CA . SER C 47 ? 0.5726 0.4537 0.5891 -0.0886 -0.0164 -0.0165 25 SER F CA 3278 C C . SER C 47 ? 0.5974 0.5025 0.6167 -0.0868 -0.0221 -0.0122 25 SER F C 3279 O O . SER C 47 ? 0.5780 0.4942 0.6201 -0.0766 -0.0244 -0.0098 25 SER F O 3280 C CB . SER C 47 ? 0.6389 0.5027 0.6597 -0.0882 0.0017 -0.0282 25 SER F CB 3281 O OG . SER C 47 ? 0.7690 0.6284 0.7625 -0.1012 0.0095 -0.0341 25 SER F OG 3282 N N . PRO C 48 ? 0.5497 0.4625 0.5473 -0.0970 -0.0251 -0.0103 26 PRO F N 3283 C CA . PRO C 48 ? 0.5260 0.4601 0.5282 -0.0948 -0.0305 -0.0058 26 PRO F CA 3284 C C . PRO C 48 ? 0.5728 0.5094 0.5865 -0.0899 -0.0219 -0.0111 26 PRO F C 3285 O O . PRO C 48 ? 0.5841 0.5061 0.5940 -0.0930 -0.0095 -0.0196 26 PRO F O 3286 C CB . PRO C 48 ? 0.5530 0.4907 0.5317 -0.1079 -0.0345 -0.0025 26 PRO F CB 3287 C CG . PRO C 48 ? 0.6260 0.5496 0.5893 -0.1158 -0.0357 -0.0025 26 PRO F CG 3288 C CD . PRO C 48 ? 0.5863 0.4890 0.5557 -0.1115 -0.0250 -0.0109 26 PRO F CD 3289 N N . MET C 49 ? 0.5107 0.4649 0.5378 -0.0830 -0.0276 -0.0065 27 MET F N 3290 C CA . MET C 49 ? 0.5032 0.4628 0.5424 -0.0783 -0.0215 -0.0100 27 MET F CA 3291 C C . MET C 49 ? 0.5420 0.5157 0.5733 -0.0819 -0.0267 -0.0058 27 MET F C 3292 O O . MET C 49 ? 0.5226 0.5085 0.5558 -0.0798 -0.0364 0.0012 27 MET F O 3293 C CB . MET C 49 ? 0.5206 0.4864 0.5866 -0.0661 -0.0246 -0.0075 27 MET F CB 3294 C CG . MET C 49 ? 0.5644 0.5342 0.6466 -0.0611 -0.0170 -0.0115 27 MET F CG 3295 S SD . MET C 49 ? 0.6025 0.5833 0.7149 -0.0493 -0.0251 -0.0050 27 MET F SD 3296 C CE . MET C 49 ? 0.5746 0.5407 0.7066 -0.0442 -0.0212 -0.0065 27 MET F CE 3297 N N . VAL C 50 ? 0.5076 0.4786 0.5303 -0.0879 -0.0197 -0.0101 28 VAL F N 3298 C CA . VAL C 50 ? 0.4978 0.4803 0.5141 -0.0919 -0.0252 -0.0054 28 VAL F CA 3299 C C . VAL C 50 ? 0.5391 0.5287 0.5702 -0.0850 -0.0220 -0.0071 28 VAL F C 3300 O O . VAL C 50 ? 0.5439 0.5261 0.5778 -0.0858 -0.0111 -0.0144 28 VAL F O 3301 C CB . VAL C 50 ? 0.5663 0.5408 0.5569 -0.1076 -0.0239 -0.0057 28 VAL F CB 3302 C CG1 . VAL C 50 ? 0.5560 0.5427 0.5438 -0.1112 -0.0321 0.0016 28 VAL F CG1 3303 C CG2 . VAL C 50 ? 0.5748 0.5429 0.5506 -0.1156 -0.0282 -0.0030 28 VAL F CG2 3304 N N . LEU C 51 ? 0.4799 0.4834 0.5207 -0.0788 -0.0306 -0.0008 29 LEU F N 3305 C CA . LEU C 51 ? 0.4688 0.4796 0.5219 -0.0732 -0.0295 -0.0011 29 LEU F CA 3306 C C . LEU C 51 ? 0.5157 0.5331 0.5606 -0.0779 -0.0344 0.0034 29 LEU F C 3307 O O . LEU C 51 ? 0.5036 0.5272 0.5459 -0.0785 -0.0425 0.0098 29 LEU F O 3308 C CB . LEU C 51 ? 0.4547 0.4731 0.5256 -0.0628 -0.0350 0.0022 29 LEU F CB 3309 C CG . LEU C 51 ? 0.5179 0.5308 0.6024 -0.0574 -0.0329 0.0002 29 LEU F CG 3310 C CD1 . LEU C 51 ? 0.5095 0.5288 0.6041 -0.0514 -0.0419 0.0061 29 LEU F CD1 3311 C CD2 . LEU C 51 ? 0.5554 0.5654 0.6541 -0.0548 -0.0234 -0.0053 29 LEU F CD2 3312 N N . GLU C 52 ? 0.4795 0.4955 0.5220 -0.0814 -0.0293 0.0003 30 GLU F N 3313 C CA . GLU C 52 ? 0.4779 0.4984 0.5134 -0.0862 -0.0346 0.0052 30 GLU F CA 3314 C C . GLU C 52 ? 0.5123 0.5414 0.5632 -0.0771 -0.0371 0.0069 30 GLU F C 3315 O O . GLU C 52 ? 0.5046 0.5336 0.5653 -0.0732 -0.0311 0.0023 30 GLU F O 3316 C CB . GLU C 52 ? 0.5149 0.5265 0.5334 -0.0989 -0.0279 0.0011 30 GLU F CB 3317 C CG . GLU C 52 ? 0.6592 0.6735 0.6682 -0.1063 -0.0356 0.0080 30 GLU F CG 3318 C CD . GLU C 52 ? 0.9751 0.9794 0.9641 -0.1211 -0.0295 0.0042 30 GLU F CD 3319 O OE1 . GLU C 52 ? 0.9485 0.9428 0.9168 -0.1345 -0.0284 0.0037 30 GLU F OE1 3320 O OE2 . GLU C 52 ? 0.9204 0.9261 0.9122 -0.1211 -0.0260 0.0021 30 GLU F OE2 3321 N N . MET C 53 ? 0.4594 0.4953 0.5135 -0.0739 -0.0455 0.0136 31 MET F N 3322 C CA . MET C 53 ? 0.4460 0.4873 0.5110 -0.0667 -0.0479 0.0152 31 MET F CA 3323 C C . MET C 53 ? 0.4910 0.5336 0.5520 -0.0702 -0.0524 0.0200 31 MET F C 3324 O O . MET C 53 ? 0.4879 0.5316 0.5451 -0.0738 -0.0579 0.0257 31 MET F O 3325 C CB . MET C 53 ? 0.4667 0.5123 0.5401 -0.0593 -0.0517 0.0175 31 MET F CB 3326 C CG . MET C 53 ? 0.5133 0.5569 0.5908 -0.0564 -0.0497 0.0146 31 MET F CG 3327 S SD . MET C 53 ? 0.5602 0.6069 0.6428 -0.0511 -0.0542 0.0174 31 MET F SD 3328 C CE . MET C 53 ? 0.5188 0.5695 0.5970 -0.0536 -0.0570 0.0217 31 MET F CE 3329 N N . GLU C 54 ? 0.4433 0.4858 0.5067 -0.0693 -0.0509 0.0186 32 GLU F N 3330 C CA . GLU C 54 ? 0.4429 0.4848 0.5028 -0.0726 -0.0555 0.0233 32 GLU F CA 3331 C C . GLU C 54 ? 0.4760 0.5192 0.5438 -0.0665 -0.0559 0.0231 32 GLU F C 3332 O O . GLU C 54 ? 0.4690 0.5128 0.5403 -0.0654 -0.0515 0.0186 32 GLU F O 3333 C CB . GLU C 54 ? 0.4755 0.5121 0.5216 -0.0841 -0.0527 0.0218 32 GLU F CB 3334 C CG . GLU C 54 ? 0.6298 0.6639 0.6689 -0.0907 -0.0603 0.0292 32 GLU F CG 3335 C CD . GLU C 54 ? 0.9301 0.9584 0.9551 -0.1022 -0.0571 0.0271 32 GLU F CD 3336 O OE1 . GLU C 54 ? 0.8785 0.9020 0.8911 -0.1113 -0.0500 0.0217 32 GLU F OE1 3337 O OE2 . GLU C 54 ? 0.8783 0.9055 0.9034 -0.1031 -0.0609 0.0305 32 GLU F OE2 3338 N N . LEU C 55 ? 0.4228 0.4659 0.4947 -0.0630 -0.0609 0.0280 33 LEU F N 3339 C CA . LEU C 55 ? 0.4139 0.4550 0.4898 -0.0588 -0.0611 0.0276 33 LEU F CA 3340 C C . LEU C 55 ? 0.4631 0.5007 0.5325 -0.0649 -0.0621 0.0287 33 LEU F C 3341 O O . LEU C 55 ? 0.4646 0.4996 0.5293 -0.0700 -0.0666 0.0338 33 LEU F O 3342 C CB . LEU C 55 ? 0.4127 0.4525 0.4957 -0.0530 -0.0635 0.0311 33 LEU F CB 3343 C CG . LEU C 55 ? 0.4656 0.5071 0.5534 -0.0474 -0.0606 0.0283 33 LEU F CG 3344 C CD1 . LEU C 55 ? 0.4687 0.5098 0.5652 -0.0430 -0.0605 0.0314 33 LEU F CD1 3345 C CD2 . LEU C 55 ? 0.4958 0.5341 0.5809 -0.0464 -0.0582 0.0242 33 LEU F CD2 3346 N N . LEU C 56 ? 0.4151 0.4531 0.4843 -0.0658 -0.0586 0.0246 34 LEU F N 3347 C CA . LEU C 56 ? 0.4191 0.4544 0.4819 -0.0725 -0.0583 0.0248 34 LEU F CA 3348 C C . LEU C 56 ? 0.4697 0.4994 0.5323 -0.0706 -0.0627 0.0283 34 LEU F C 3349 O O . LEU C 56 ? 0.4739 0.4986 0.5298 -0.0763 -0.0661 0.0318 34 LEU F O 3350 C CB . LEU C 56 ? 0.4178 0.4578 0.4844 -0.0746 -0.0518 0.0193 34 LEU F CB 3351 C CG . LEU C 56 ? 0.4776 0.5208 0.5460 -0.0765 -0.0449 0.0146 34 LEU F CG 3352 C CD1 . LEU C 56 ? 0.4766 0.5259 0.5581 -0.0748 -0.0386 0.0101 34 LEU F CD1 3353 C CD2 . LEU C 56 ? 0.5199 0.5586 0.5740 -0.0873 -0.0423 0.0139 34 LEU F CD2 3354 N N . SER C 57 ? 0.4195 0.4480 0.4876 -0.0639 -0.0625 0.0271 35 SER F N 3355 C CA . SER C 57 ? 0.4221 0.4421 0.4888 -0.0619 -0.0645 0.0287 35 SER F CA 3356 C C . SER C 57 ? 0.4663 0.4839 0.5363 -0.0560 -0.0623 0.0264 35 SER F C 3357 O O . SER C 57 ? 0.4553 0.4778 0.5268 -0.0552 -0.0606 0.0237 35 SER F O 3358 C CB . SER C 57 ? 0.4727 0.4904 0.5339 -0.0673 -0.0646 0.0279 35 SER F CB 3359 O OG . SER C 57 ? 0.5817 0.6052 0.6461 -0.0676 -0.0624 0.0246 35 SER F OG 3360 N N . VAL C 58 ? 0.4273 0.4359 0.4983 -0.0525 -0.0618 0.0275 36 VAL F N 3361 C CA . VAL C 58 ? 0.4265 0.4292 0.4975 -0.0488 -0.0574 0.0241 36 VAL F CA 3362 C C . VAL C 58 ? 0.4812 0.4699 0.5452 -0.0505 -0.0560 0.0230 36 VAL F C 3363 O O . VAL C 58 ? 0.4824 0.4641 0.5505 -0.0485 -0.0567 0.0258 36 VAL F O 3364 C CB . VAL C 58 ? 0.4749 0.4797 0.5564 -0.0428 -0.0547 0.0250 36 VAL F CB 3365 C CG1 . VAL C 58 ? 0.4792 0.4767 0.5584 -0.0408 -0.0477 0.0200 36 VAL F CG1 3366 C CG2 . VAL C 58 ? 0.4614 0.4785 0.5471 -0.0427 -0.0568 0.0264 36 VAL F CG2 3367 N N . THR C 59 ? 0.4367 0.4206 0.4900 -0.0551 -0.0550 0.0197 37 THR F N 3368 C CA . THR C 59 ? 0.4458 0.4149 0.4880 -0.0593 -0.0538 0.0182 37 THR F CA 3369 C C . THR C 59 ? 0.5025 0.4579 0.5362 -0.0599 -0.0467 0.0129 37 THR F C 3370 O O . THR C 59 ? 0.4963 0.4545 0.5249 -0.0626 -0.0457 0.0108 37 THR F O 3371 C CB . THR C 59 ? 0.5349 0.5082 0.5699 -0.0672 -0.0591 0.0196 37 THR F CB 3372 O OG1 . THR C 59 ? 0.5172 0.5014 0.5594 -0.0673 -0.0627 0.0230 37 THR F OG1 3373 C CG2 . THR C 59 ? 0.5311 0.4891 0.5521 -0.0737 -0.0592 0.0187 37 THR F CG2 3374 N N . LEU C 60 ? 0.4707 0.4098 0.5022 -0.0583 -0.0412 0.0108 38 LEU F N 3375 C CA . LEU C 60 ? 0.4858 0.4074 0.5071 -0.0601 -0.0312 0.0040 38 LEU F CA 3376 C C . LEU C 60 ? 0.5492 0.4524 0.5522 -0.0683 -0.0310 0.0021 38 LEU F C 3377 O O . LEU C 60 ? 0.5542 0.4461 0.5606 -0.0655 -0.0292 0.0026 38 LEU F O 3378 C CB . LEU C 60 ? 0.4912 0.4076 0.5295 -0.0503 -0.0222 0.0022 38 LEU F CB 3379 C CG . LEU C 60 ? 0.5355 0.4681 0.5916 -0.0432 -0.0211 0.0038 38 LEU F CG 3380 C CD1 . LEU C 60 ? 0.5391 0.4711 0.6195 -0.0332 -0.0172 0.0066 38 LEU F CD1 3381 C CD2 . LEU C 60 ? 0.5730 0.5035 0.6194 -0.0468 -0.0132 -0.0027 38 LEU F CD2 3382 N N . GLU C 61 ? 0.5075 0.4078 0.4913 -0.0794 -0.0342 0.0010 39 GLU F N 3383 C CA . GLU C 61 ? 0.5237 0.4072 0.4871 -0.0900 -0.0355 0.0000 39 GLU F CA 3384 C C . GLU C 61 ? 0.5983 0.4575 0.5399 -0.0978 -0.0247 -0.0082 39 GLU F C 3385 O O . GLU C 61 ? 0.5983 0.4577 0.5265 -0.1063 -0.0253 -0.0096 39 GLU F O 3386 C CB . GLU C 61 ? 0.5323 0.4291 0.4905 -0.0991 -0.0475 0.0059 39 GLU F CB 3387 C CG . GLU C 61 ? 0.6833 0.5688 0.6260 -0.1095 -0.0520 0.0076 39 GLU F CG 3388 C CD . GLU C 61 ? 0.9333 0.8300 0.8706 -0.1207 -0.0628 0.0134 39 GLU F CD 3389 O OE1 . GLU C 61 ? 0.8738 0.7559 0.7890 -0.1341 -0.0646 0.0130 39 GLU F OE1 3390 O OE2 . GLU C 61 ? 0.8365 0.7562 0.7925 -0.1168 -0.0693 0.0186 39 GLU F OE2 3391 N N . PRO C 62 ? 0.7071 0.3403 0.6234 -0.0347 -0.0024 0.0399 40 PRO F N 3392 C CA . PRO C 62 ? 0.7260 0.3426 0.6062 -0.0405 -0.0075 0.0506 40 PRO F CA 3393 C C . PRO C 62 ? 0.7769 0.3888 0.6542 -0.0129 -0.0369 0.0671 40 PRO F C 3394 O O . PRO C 62 ? 0.7321 0.3795 0.6532 0.0089 -0.0528 0.0657 40 PRO F O 3395 C CB . PRO C 62 ? 0.6898 0.3693 0.6000 -0.0587 0.0005 0.0368 40 PRO F CB 3396 C CG . PRO C 62 ? 0.6850 0.4193 0.6485 -0.0495 -0.0060 0.0275 40 PRO F CG 3397 C CD . PRO C 62 ? 0.6532 0.3586 0.6178 -0.0411 -0.0020 0.0260 40 PRO F CD 3398 N N . THR C 63 ? 0.7851 0.3535 0.6092 -0.0166 -0.0433 0.0809 41 THR F N 3399 C CA . THR C 63 ? 0.7961 0.3595 0.6108 0.0064 -0.0741 0.0963 41 THR F CA 3400 C C . THR C 63 ? 0.7762 0.4077 0.6267 0.0034 -0.0792 0.0887 41 THR F C 3401 O O . THR C 63 ? 0.7582 0.4043 0.5994 -0.0205 -0.0617 0.0808 41 THR F O 3402 C CB . THR C 63 ? 0.9946 0.4775 0.7280 0.0013 -0.0806 0.1149 41 THR F CB 3403 O OG1 . THR C 63 ? 1.0561 0.4711 0.7561 0.0020 -0.0714 0.1207 41 THR F OG1 3404 C CG2 . THR C 63 ? 1.0024 0.4769 0.7237 0.0274 -0.1189 0.1318 41 THR F CG2 3405 N N . LEU C 64 ? 0.6889 0.3623 0.5843 0.0270 -0.1009 0.0885 42 LEU F N 3406 C CA . LEU C 64 ? 0.6248 0.3585 0.5549 0.0257 -0.1056 0.0812 42 LEU F CA 3407 C C . LEU C 64 ? 0.6907 0.4205 0.5999 0.0345 -0.1289 0.0913 42 LEU F C 3408 O O . LEU C 64 ? 0.7261 0.4284 0.6212 0.0543 -0.1530 0.1027 42 LEU F O 3409 C CB . LEU C 64 ? 0.5651 0.3513 0.5579 0.0387 -0.1084 0.0699 42 LEU F CB 3410 C CG . LEU C 64 ? 0.5999 0.3989 0.6162 0.0288 -0.0881 0.0579 42 LEU F CG 3411 C CD1 . LEU C 64 ? 0.5604 0.4000 0.6262 0.0409 -0.0925 0.0480 42 LEU F CD1 3412 C CD2 . LEU C 64 ? 0.6033 0.4239 0.6187 0.0049 -0.0703 0.0497 42 LEU F CD2 3413 N N . SER C 65 ? 0.6166 0.3763 0.5276 0.0204 -0.1231 0.0857 43 SER F N 3414 C CA . SER C 65 ? 0.6255 0.3901 0.5190 0.0229 -0.1412 0.0909 43 SER F CA 3415 C C . SER C 65 ? 0.6004 0.4272 0.5439 0.0214 -0.1369 0.0778 43 SER F C 3416 O O . SER C 65 ? 0.5702 0.4141 0.5213 0.0044 -0.1161 0.0686 43 SER F O 3417 C CB . SER C 65 ? 0.7307 0.4504 0.5574 -0.0003 -0.1311 0.0964 43 SER F CB 3418 O OG . SER C 65 ? 0.9312 0.5827 0.7010 0.0002 -0.1363 0.1109 43 SER F OG 3419 N N . LEU C 66 ? 0.5247 0.3846 0.5062 0.0398 -0.1555 0.0752 44 LEU F N 3420 C CA . LEU C 66 ? 0.4635 0.3748 0.4877 0.0382 -0.1514 0.0632 44 LEU F CA 3421 C C . LEU C 66 ? 0.5144 0.4313 0.5176 0.0255 -0.1514 0.0617 44 LEU F C 3422 O O . LEU C 66 ? 0.5420 0.4484 0.5211 0.0292 -0.1708 0.0672 44 LEU F O 3423 C CB . LEU C 66 ? 0.4413 0.3838 0.5105 0.0573 -0.1671 0.0572 44 LEU F CB 3424 C CG . LEU C 66 ? 0.4501 0.4394 0.5586 0.0536 -0.1612 0.0440 44 LEU F CG 3425 C CD1 . LEU C 66 ? 0.4157 0.4177 0.5451 0.0459 -0.1405 0.0374 44 LEU F CD1 3426 C CD2 . LEU C 66 ? 0.4737 0.4909 0.6195 0.0686 -0.1779 0.0356 44 LEU F CD2 3427 N N . ASP C 67 ? 0.4408 0.3732 0.4534 0.0107 -0.1304 0.0534 45 ASP F N 3428 C CA . ASP C 67 ? 0.4410 0.3796 0.4404 -0.0028 -0.1241 0.0481 45 ASP F CA 3429 C C . ASP C 67 ? 0.4541 0.4299 0.4877 0.0038 -0.1321 0.0406 45 ASP F C 3430 O O . ASP C 67 ? 0.4660 0.4446 0.4849 0.0013 -0.1436 0.0394 45 ASP F O 3431 C CB . ASP C 67 ? 0.4502 0.3912 0.4557 -0.0183 -0.0981 0.0396 45 ASP F CB 3432 C CG . ASP C 67 ? 0.6210 0.5247 0.5836 -0.0353 -0.0840 0.0408 45 ASP F CG 3433 O OD1 . ASP C 67 ? 0.6820 0.5482 0.5957 -0.0375 -0.0948 0.0511 45 ASP F OD1 3434 O OD2 . ASP C 67 ? 0.6796 0.5902 0.6566 -0.0473 -0.0623 0.0305 45 ASP F OD2 3435 N N . TYR C 68 ? 0.3670 0.3686 0.4416 0.0098 -0.1257 0.0349 46 TYR F N 3436 C CA . TYR C 68 ? 0.3362 0.3678 0.4410 0.0126 -0.1277 0.0264 46 TYR F CA 3437 C C . TYR C 68 ? 0.3583 0.4041 0.4939 0.0179 -0.1215 0.0233 46 TYR F C 3438 O O . TYR C 68 ? 0.3492 0.3852 0.4845 0.0182 -0.1150 0.0269 46 TYR F O 3439 C CB . TYR C 68 ? 0.3439 0.3810 0.4464 0.0003 -0.1151 0.0195 46 TYR F CB 3440 C CG . TYR C 68 ? 0.3485 0.3818 0.4597 -0.0047 -0.0977 0.0181 46 TYR F CG 3441 C CD1 . TYR C 68 ? 0.3906 0.4074 0.4836 -0.0139 -0.0868 0.0177 46 TYR F CD1 3442 C CD2 . TYR C 68 ? 0.3321 0.3777 0.4693 -0.0011 -0.0926 0.0156 46 TYR F CD2 3443 C CE1 . TYR C 68 ? 0.3854 0.4065 0.4977 -0.0168 -0.0726 0.0126 46 TYR F CE1 3444 C CE2 . TYR C 68 ? 0.3347 0.3790 0.4838 -0.0024 -0.0828 0.0145 46 TYR F CE2 3445 C CZ . TYR C 68 ? 0.4365 0.4728 0.5789 -0.0090 -0.0734 0.0118 46 TYR F CZ 3446 O OH . TYR C 68 ? 0.4389 0.4815 0.6040 -0.0086 -0.0654 0.0072 46 TYR F OH 3447 N N . ILE C 69 ? 0.3010 0.3683 0.4591 0.0183 -0.1216 0.0148 47 ILE F N 3448 C CA . ILE C 69 ? 0.2802 0.3565 0.4582 0.0177 -0.1132 0.0101 47 ILE F CA 3449 C C . ILE C 69 ? 0.3239 0.4025 0.5022 0.0084 -0.1028 0.0061 47 ILE F C 3450 O O . ILE C 69 ? 0.3244 0.4065 0.4980 0.0035 -0.1025 0.0020 47 ILE F O 3451 C CB . ILE C 69 ? 0.3166 0.4099 0.5194 0.0237 -0.1180 0.0009 47 ILE F CB 3452 C CG1 . ILE C 69 ? 0.3235 0.4402 0.5421 0.0217 -0.1235 -0.0110 47 ILE F CG1 3453 C CG2 . ILE C 69 ? 0.3383 0.4227 0.5432 0.0363 -0.1280 0.0055 47 ILE F CG2 3454 C CD1 . ILE C 69 ? 0.4050 0.5343 0.6384 0.0102 -0.1088 -0.0241 47 ILE F CD1 3455 N N . THR C 70 ? 0.2746 0.3470 0.4542 0.0055 -0.0953 0.0076 48 THR F N 3456 C CA . THR C 70 ? 0.2748 0.3399 0.4502 -0.0011 -0.0875 0.0062 48 THR F CA 3457 C C . THR C 70 ? 0.3312 0.3927 0.5054 -0.0074 -0.0818 0.0023 48 THR F C 3458 O O . THR C 70 ? 0.3254 0.3888 0.5021 -0.0065 -0.0824 0.0020 48 THR F O 3459 C CB . THR C 70 ? 0.3671 0.4203 0.5383 0.0011 -0.0862 0.0130 48 THR F CB 3460 O OG1 . THR C 70 ? 0.3674 0.4099 0.5355 -0.0025 -0.0801 0.0109 48 THR F OG1 3461 C CG2 . THR C 70 ? 0.3464 0.3944 0.5177 0.0041 -0.0897 0.0194 48 THR F CG2 3462 N N . CYS C 71 ? 0.3017 0.3541 0.4681 -0.0164 -0.0735 -0.0022 49 CYS F N 3463 C CA . CYS C 71 ? 0.3182 0.3594 0.4734 -0.0284 -0.0637 -0.0078 49 CYS F CA 3464 C C . CYS C 71 ? 0.3858 0.4003 0.5200 -0.0367 -0.0559 -0.0060 49 CYS F C 3465 O O . CYS C 71 ? 0.3793 0.3864 0.5136 -0.0303 -0.0590 -0.0005 49 CYS F O 3466 C CB . CYS C 71 ? 0.3189 0.3850 0.4951 -0.0344 -0.0576 -0.0250 49 CYS F CB 3467 S SG . CYS C 71 ? 0.3612 0.4531 0.5576 -0.0341 -0.0608 -0.0364 49 CYS F SG 3468 N N . GLU C 72 ? 0.3663 0.3619 0.4804 -0.0523 -0.0436 -0.0118 50 GLU F N 3469 C CA . GLU C 72 ? 0.3994 0.3591 0.4853 -0.0627 -0.0341 -0.0100 50 GLU F CA 3470 C C . GLU C 72 ? 0.4354 0.4112 0.5372 -0.0702 -0.0237 -0.0251 50 GLU F C 3471 O O . GLU C 72 ? 0.4114 0.4221 0.5384 -0.0759 -0.0196 -0.0414 50 GLU F O 3472 C CB . GLU C 72 ? 0.4585 0.3879 0.5093 -0.0823 -0.0213 -0.0130 50 GLU F CB 3473 C CG . GLU C 72 ? 0.6600 0.5332 0.6650 -0.0897 -0.0175 -0.0020 50 GLU F CG 3474 C CD . GLU C 72 ? 1.0103 0.8422 0.9658 -0.1129 -0.0046 -0.0030 50 GLU F CD 3475 O OE1 . GLU C 72 ? 0.9495 0.7833 0.8946 -0.1156 -0.0093 -0.0003 50 GLU F OE1 3476 O OE2 . GLU C 72 ? 0.9995 0.7917 0.9208 -0.1306 0.0118 -0.0067 50 GLU F OE2 3477 N N . TYR C 73 ? 0.4038 0.3562 0.4943 -0.0693 -0.0207 -0.0209 51 TYR F N 3478 C CA . TYR C 73 ? 0.3999 0.3641 0.5005 -0.0795 -0.0097 -0.0362 51 TYR F CA 3479 C C . TYR C 73 ? 0.4886 0.4281 0.5661 -0.1039 0.0121 -0.0492 51 TYR F C 3480 O O . TYR C 73 ? 0.5188 0.4196 0.5629 -0.1117 0.0182 -0.0418 51 TYR F O 3481 C CB . TYR C 73 ? 0.4152 0.3660 0.5167 -0.0693 -0.0123 -0.0297 51 TYR F CB 3482 C CG . TYR C 73 ? 0.4743 0.3719 0.5490 -0.0659 -0.0085 -0.0174 51 TYR F CG 3483 C CD1 . TYR C 73 ? 0.5424 0.4019 0.5904 -0.0824 0.0094 -0.0236 51 TYR F CD1 3484 C CD2 . TYR C 73 ? 0.4824 0.3672 0.5607 -0.0456 -0.0236 -0.0008 51 TYR F CD2 3485 C CE1 . TYR C 73 ? 0.5989 0.4012 0.6188 -0.0765 0.0101 -0.0100 51 TYR F CE1 3486 C CE2 . TYR C 73 ? 0.5356 0.3720 0.5945 -0.0380 -0.0253 0.0109 51 TYR F CE2 3487 C CZ . TYR C 73 ? 0.6760 0.4676 0.7033 -0.0522 -0.0094 0.0078 51 TYR F CZ 3488 O OH . TYR C 73 ? 0.7407 0.4763 0.7450 -0.0422 -0.0136 0.0214 51 TYR F OH 3489 N N . LYS C 74 ? 0.3247 0.4045 0.5112 0.0426 -0.1145 -0.0587 52 LYS F N 3490 C CA . LYS C 74 ? 0.3151 0.4070 0.4811 0.0475 -0.1081 -0.0653 52 LYS F CA 3491 C C . LYS C 74 ? 0.3719 0.4528 0.5091 0.0370 -0.0876 -0.0544 52 LYS F C 3492 O O . LYS C 74 ? 0.3816 0.4439 0.5042 0.0268 -0.0864 -0.0453 52 LYS F O 3493 C CB . LYS C 74 ? 0.3476 0.4445 0.5150 0.0510 -0.1251 -0.0752 52 LYS F CB 3494 C CG . LYS C 74 ? 0.5169 0.6307 0.6712 0.0557 -0.1174 -0.0849 52 LYS F CG 3495 C CD . LYS C 74 ? 0.6471 0.7614 0.8023 0.0548 -0.1302 -0.0944 52 LYS F CD 3496 C CE . LYS C 74 ? 0.7877 0.9209 0.9361 0.0577 -0.1199 -0.1054 52 LYS F CE 3497 N NZ . LYS C 74 ? 0.9083 1.0350 1.0324 0.0505 -0.0973 -0.0945 52 LYS F NZ 3498 N N . THR C 75 ? 0.3216 0.4114 0.4489 0.0402 -0.0736 -0.0558 53 THR F N 3499 C CA . THR C 75 ? 0.3250 0.4070 0.4286 0.0323 -0.0565 -0.0479 53 THR F CA 3500 C C . THR C 75 ? 0.3759 0.4623 0.4639 0.0329 -0.0563 -0.0518 53 THR F C 3501 O O . THR C 75 ? 0.3617 0.4614 0.4477 0.0392 -0.0535 -0.0584 53 THR F O 3502 C CB . THR C 75 ? 0.4118 0.4978 0.5165 0.0348 -0.0446 -0.0479 53 THR F CB 3503 O OG1 . THR C 75 ? 0.3973 0.4821 0.5262 0.0358 -0.0473 -0.0489 53 THR F OG1 3504 C CG2 . THR C 75 ? 0.3957 0.4739 0.4808 0.0266 -0.0290 -0.0408 53 THR F CG2 3505 N N . VAL C 76 ? 0.3478 0.4213 0.4249 0.0266 -0.0601 -0.0485 54 VAL F N 3506 C CA . VAL C 76 ? 0.3471 0.4235 0.4161 0.0271 -0.0615 -0.0548 54 VAL F CA 3507 C C . VAL C 76 ? 0.4020 0.4763 0.4538 0.0234 -0.0452 -0.0493 54 VAL F C 3508 O O . VAL C 76 ? 0.4071 0.4663 0.4444 0.0177 -0.0394 -0.0408 54 VAL F O 3509 C CB . VAL C 76 ? 0.4098 0.4707 0.4769 0.0248 -0.0779 -0.0574 54 VAL F CB 3510 C CG1 . VAL C 76 ? 0.4074 0.4712 0.4716 0.0258 -0.0793 -0.0667 54 VAL F CG1 3511 C CG2 . VAL C 76 ? 0.4059 0.4711 0.4943 0.0296 -0.0976 -0.0652 54 VAL F CG2 3512 N N . ILE C 77 ? 0.3549 0.4437 0.4074 0.0266 -0.0378 -0.0543 55 ILE F N 3513 C CA . ILE C 77 ? 0.3554 0.4424 0.3949 0.0235 -0.0246 -0.0497 55 ILE F CA 3514 C C . ILE C 77 ? 0.4046 0.4989 0.4467 0.0228 -0.0230 -0.0571 55 ILE F C 3515 O O . ILE C 77 ? 0.3961 0.5051 0.4438 0.0252 -0.0196 -0.0635 55 ILE F O 3516 C CB . ILE C 77 ? 0.3928 0.4840 0.4282 0.0260 -0.0159 -0.0463 55 ILE F CB 3517 C CG1 . ILE C 77 ? 0.3983 0.4859 0.4414 0.0280 -0.0188 -0.0439 55 ILE F CG1 3518 C CG2 . ILE C 77 ? 0.4053 0.4906 0.4285 0.0222 -0.0060 -0.0408 55 ILE F CG2 3519 C CD1 . ILE C 77 ? 0.4943 0.5901 0.5448 0.0366 -0.0226 -0.0492 55 ILE F CD1 3520 N N . PRO C 78 ? 0.3677 0.4518 0.4063 0.0197 -0.0247 -0.0574 56 PRO F N 3521 C CA . PRO C 78 ? 0.3646 0.4566 0.4131 0.0188 -0.0227 -0.0666 56 PRO F CA 3522 C C . PRO C 78 ? 0.4135 0.5093 0.4564 0.0156 -0.0078 -0.0611 56 PRO F C 3523 O O . PRO C 78 ? 0.4087 0.5001 0.4391 0.0153 -0.0018 -0.0515 56 PRO F O 3524 C CB . PRO C 78 ? 0.3962 0.4713 0.4429 0.0189 -0.0338 -0.0696 56 PRO F CB 3525 C CG . PRO C 78 ? 0.4607 0.5186 0.4868 0.0176 -0.0325 -0.0569 56 PRO F CG 3526 C CD . PRO C 78 ? 0.3983 0.4627 0.4235 0.0174 -0.0281 -0.0505 56 PRO F CD 3527 N N . SER C 79 ? 0.3700 0.4730 0.4248 0.0129 -0.0029 -0.0683 57 SER F N 3528 C CA . SER C 79 ? 0.3699 0.4739 0.4215 0.0082 0.0103 -0.0625 57 SER F CA 3529 C C . SER C 79 ? 0.4180 0.5062 0.4594 0.0082 0.0085 -0.0538 57 SER F C 3530 O O . SER C 79 ? 0.4139 0.4925 0.4570 0.0107 -0.0009 -0.0571 57 SER F O 3531 C CB . SER C 79 ? 0.4158 0.5303 0.4888 0.0041 0.0157 -0.0735 57 SER F CB 3532 O OG . SER C 79 ? 0.5249 0.6575 0.6068 0.0034 0.0208 -0.0830 57 SER F OG 3533 N N . PRO C 80 ? 0.3747 0.4587 0.4038 0.0066 0.0153 -0.0438 58 PRO F N 3534 C CA . PRO C 80 ? 0.3725 0.4450 0.3950 0.0076 0.0124 -0.0387 58 PRO F CA 3535 C C . PRO C 80 ? 0.4207 0.4900 0.4555 0.0064 0.0113 -0.0420 58 PRO F C 3536 O O . PRO C 80 ? 0.4164 0.4917 0.4634 0.0018 0.0179 -0.0438 58 PRO F O 3537 C CB . PRO C 80 ? 0.3980 0.4677 0.4088 0.0069 0.0169 -0.0308 58 PRO F CB 3538 C CG . PRO C 80 ? 0.4607 0.5362 0.4694 0.0039 0.0241 -0.0299 58 PRO F CG 3539 C CD . PRO C 80 ? 0.3996 0.4868 0.4183 0.0048 0.0236 -0.0384 58 PRO F CD 3540 N N . TYR C 81 ? 0.3774 0.4370 0.4092 0.0106 0.0034 -0.0436 59 TYR F N 3541 C CA . TYR C 81 ? 0.3766 0.4314 0.4216 0.0124 -0.0012 -0.0487 59 TYR F CA 3542 C C . TYR C 81 ? 0.4231 0.4760 0.4686 0.0110 0.0014 -0.0424 59 TYR F C 3543 O O . TYR C 81 ? 0.4178 0.4652 0.4520 0.0150 -0.0026 -0.0401 59 TYR F O 3544 C CB . TYR C 81 ? 0.3994 0.4414 0.4372 0.0197 -0.0135 -0.0547 59 TYR F CB 3545 C CG . TYR C 81 ? 0.4266 0.4618 0.4788 0.0248 -0.0218 -0.0622 59 TYR F CG 3546 C CD1 . TYR C 81 ? 0.4486 0.4891 0.5300 0.0234 -0.0229 -0.0719 59 TYR F CD1 3547 C CD2 . TYR C 81 ? 0.4454 0.4700 0.4846 0.0316 -0.0285 -0.0618 59 TYR F CD2 3548 C CE1 . TYR C 81 ? 0.4626 0.4965 0.5630 0.0291 -0.0321 -0.0807 59 TYR F CE1 3549 C CE2 . TYR C 81 ? 0.4626 0.4803 0.5166 0.0387 -0.0389 -0.0703 59 TYR F CE2 3550 C CZ . TYR C 81 ? 0.5510 0.5727 0.6372 0.0376 -0.0415 -0.0797 59 TYR F CZ 3551 O OH . TYR C 81 ? 0.5666 0.5815 0.6735 0.0455 -0.0532 -0.0900 59 TYR F OH 3552 N N . VAL C 82 ? 0.3806 0.4377 0.4393 0.0047 0.0083 -0.0402 60 VAL F N 3553 C CA . VAL C 82 ? 0.3829 0.4350 0.4439 0.0022 0.0086 -0.0336 60 VAL F CA 3554 C C . VAL C 82 ? 0.4351 0.4840 0.5192 0.0052 0.0010 -0.0404 60 VAL F C 3555 O O . VAL C 82 ? 0.4306 0.4834 0.5377 0.0006 0.0052 -0.0450 60 VAL F O 3556 C CB . VAL C 82 ? 0.4405 0.4931 0.4975 -0.0072 0.0198 -0.0251 60 VAL F CB 3557 C CG1 . VAL C 82 ? 0.4484 0.4899 0.5049 -0.0099 0.0162 -0.0173 60 VAL F CG1 3558 C CG2 . VAL C 82 ? 0.4392 0.4937 0.4737 -0.0071 0.0244 -0.0210 60 VAL F CG2 3559 N N . LYS C 83 ? 0.3957 0.4386 0.4759 0.0136 -0.0102 -0.0432 61 LYS F N 3560 C CA . LYS C 83 ? 0.3975 0.4359 0.4987 0.0199 -0.0209 -0.0512 61 LYS F CA 3561 C C . LYS C 83 ? 0.4610 0.4970 0.5758 0.0163 -0.0231 -0.0456 61 LYS F C 3562 O O . LYS C 83 ? 0.4554 0.4887 0.5594 0.0200 -0.0295 -0.0429 61 LYS F O 3563 C CB . LYS C 83 ? 0.4295 0.4614 0.5159 0.0321 -0.0326 -0.0581 61 LYS F CB 3564 C CG . LYS C 83 ? 0.5942 0.6186 0.6970 0.0419 -0.0457 -0.0709 61 LYS F CG 3565 C CD . LYS C 83 ? 0.7105 0.7346 0.8467 0.0441 -0.0536 -0.0756 61 LYS F CD 3566 C CE . LYS C 83 ? 0.8469 0.8638 1.0053 0.0533 -0.0660 -0.0909 61 LYS F CE 3567 N NZ . LYS C 83 ? 0.9632 0.9834 1.1661 0.0506 -0.0686 -0.0956 61 LYS F NZ 3568 N N . CYS C 84 ? 0.4325 0.4693 0.5728 0.0084 -0.0180 -0.0446 62 CYS F N 3569 C CA . CYS C 84 ? 0.4445 0.4753 0.5997 0.0029 -0.0205 -0.0377 62 CYS F CA 3570 C C . CYS C 84 ? 0.4952 0.5226 0.6733 0.0141 -0.0384 -0.0473 62 CYS F C 3571 O O . CYS C 84 ? 0.4854 0.5144 0.6828 0.0216 -0.0444 -0.0598 62 CYS F O 3572 C CB . CYS C 84 ? 0.4609 0.4930 0.6348 -0.0114 -0.0057 -0.0326 62 CYS F CB 3573 S SG . CYS C 84 ? 0.5205 0.5563 0.6638 -0.0231 0.0150 -0.0222 62 CYS F SG 3574 N N . CYS C 85 ? 0.4600 0.4819 0.6361 0.0169 -0.0494 -0.0434 63 CYS F N 3575 C CA . CYS C 85 ? 0.4593 0.4790 0.6562 0.0290 -0.0689 -0.0530 63 CYS F CA 3576 C C . CYS C 85 ? 0.5029 0.5258 0.6878 0.0455 -0.0786 -0.0666 63 CYS F C 3577 O O . CYS C 85 ? 0.4988 0.5197 0.7023 0.0580 -0.0945 -0.0780 63 CYS F O 3578 C CB . CYS C 85 ? 0.4686 0.4851 0.7086 0.0256 -0.0730 -0.0554 63 CYS F CB 3579 S SG . CYS C 85 ? 0.5351 0.5430 0.7836 0.0039 -0.0598 -0.0369 63 CYS F SG 3580 N N . GLY C 86 ? 0.4570 0.4829 0.6092 0.0456 -0.0694 -0.0650 64 GLY F N 3581 C CA . GLY C 86 ? 0.4571 0.4818 0.5884 0.0582 -0.0750 -0.0745 64 GLY F CA 3582 C C . GLY C 86 ? 0.5040 0.5323 0.6001 0.0560 -0.0649 -0.0698 64 GLY F C 3583 O O . GLY C 86 ? 0.4914 0.5235 0.5804 0.0458 -0.0546 -0.0604 64 GLY F O 3584 N N . THR C 87 ? 0.4716 0.4968 0.5448 0.0657 -0.0681 -0.0767 65 THR F N 3585 C CA . THR C 87 ? 0.4745 0.5025 0.5162 0.0634 -0.0576 -0.0735 65 THR F CA 3586 C C . THR C 87 ? 0.5355 0.5542 0.5558 0.0625 -0.0523 -0.0719 65 THR F C 3587 O O . THR C 87 ? 0.5442 0.5504 0.5558 0.0720 -0.0618 -0.0789 65 THR F O 3588 C CB . THR C 87 ? 0.5806 0.6126 0.6101 0.0729 -0.0626 -0.0821 65 THR F CB 3589 O OG1 . THR C 87 ? 0.5723 0.6117 0.6271 0.0750 -0.0725 -0.0858 65 THR F OG1 3590 C CG2 . THR C 87 ? 0.5642 0.6026 0.5689 0.0678 -0.0485 -0.0797 65 THR F CG2 3591 N N . ALA C 88 ? 0.4884 0.5109 0.5002 0.0523 -0.0399 -0.0634 66 ALA F N 3592 C CA . ALA C 88 ? 0.4950 0.5090 0.4883 0.0503 -0.0363 -0.0611 66 ALA F CA 3593 C C . ALA C 88 ? 0.5663 0.5743 0.5268 0.0524 -0.0317 -0.0603 66 ALA F C 3594 O O . ALA C 88 ? 0.5595 0.5769 0.5164 0.0519 -0.0258 -0.0609 66 ALA F O 3595 C CB . ALA C 88 ? 0.4906 0.5127 0.4905 0.0396 -0.0262 -0.0535 66 ALA F CB 3596 N N . GLU C 89 ? 0.5468 0.5380 0.4837 0.0543 -0.0346 -0.0598 67 GLU F N 3597 C CA . GLU C 89 ? 0.5726 0.5533 0.4731 0.0543 -0.0282 -0.0569 67 GLU F CA 3598 C C . GLU C 89 ? 0.6299 0.6022 0.5151 0.0458 -0.0221 -0.0485 67 GLU F C 3599 O O . GLU C 89 ? 0.6260 0.5868 0.5136 0.0465 -0.0319 -0.0491 67 GLU F O 3600 C CB . GLU C 89 ? 0.6222 0.5830 0.4968 0.0669 -0.0398 -0.0641 67 GLU F CB 3601 C CG . GLU C 89 ? 0.7800 0.7219 0.6601 0.0760 -0.0592 -0.0712 67 GLU F CG 3602 C CD . GLU C 89 ? 1.1090 1.0315 0.9684 0.0918 -0.0742 -0.0811 67 GLU F CD 3603 O OE1 . GLU C 89 ? 1.1012 1.0003 0.9148 0.0953 -0.0751 -0.0788 67 GLU F OE1 3604 O OE2 . GLU C 89 ? 1.0402 0.9690 0.9281 0.1010 -0.0857 -0.0910 67 GLU F OE2 3605 N N . CYS C 90 ? 0.5921 0.5711 0.4659 0.0377 -0.0068 -0.0423 68 CYS F N 3606 C CA . CYS C 90 ? 0.5979 0.5699 0.4606 0.0288 -0.0004 -0.0338 68 CYS F CA 3607 C C . CYS C 90 ? 0.6859 0.6279 0.5078 0.0300 -0.0049 -0.0298 68 CYS F C 3608 O O . CYS C 90 ? 0.7084 0.6405 0.5013 0.0329 -0.0003 -0.0305 68 CYS F O 3609 C CB . CYS C 90 ? 0.5924 0.5823 0.4645 0.0199 0.0169 -0.0305 68 CYS F CB 3610 S SG . CYS C 90 ? 0.6025 0.6153 0.5146 0.0166 0.0178 -0.0312 68 CYS F SG 3611 N N . LYS C 91 ? 0.6468 0.5731 0.4650 0.0281 -0.0151 -0.0263 69 LYS F N 3612 C CA . LYS C 91 ? 0.6860 0.5772 0.4642 0.0287 -0.0243 -0.0215 69 LYS F CA 3613 C C . LYS C 91 ? 0.7393 0.6263 0.5082 0.0157 -0.0130 -0.0095 69 LYS F C 3614 O O . LYS C 91 ? 0.7050 0.6098 0.5052 0.0105 -0.0112 -0.0085 69 LYS F O 3615 C CB . LYS C 91 ? 0.7210 0.5960 0.5073 0.0368 -0.0486 -0.0294 69 LYS F CB 3616 C CG . LYS C 91 ? 0.9874 0.8188 0.7290 0.0420 -0.0657 -0.0282 69 LYS F CG 3617 C CD . LYS C 91 ? 1.1299 0.9482 0.8889 0.0510 -0.0922 -0.0408 69 LYS F CD 3618 C CE . LYS C 91 ? 1.3428 1.1122 1.0558 0.0579 -0.1142 -0.0414 69 LYS F CE 3619 N NZ . LYS C 91 ? 1.4660 1.2237 1.2026 0.0677 -0.1424 -0.0581 69 LYS F NZ 3620 N N . ASP C 92 ? 0.7347 0.5974 0.4603 0.0107 -0.0051 -0.0007 70 ASP F N 3621 C CA . ASP C 92 ? 0.7461 0.6010 0.4619 -0.0032 0.0067 0.0118 70 ASP F CA 3622 C C . ASP C 92 ? 0.7961 0.6248 0.5060 -0.0037 -0.0147 0.0158 70 ASP F C 3623 O O . ASP C 92 ? 0.8338 0.6244 0.5042 0.0010 -0.0310 0.0177 70 ASP F O 3624 C CB . ASP C 92 ? 0.8205 0.6571 0.4899 -0.0103 0.0250 0.0203 70 ASP F CB 3625 C CG . ASP C 92 ? 0.9768 0.8109 0.6441 -0.0273 0.0431 0.0329 70 ASP F CG 3626 O OD1 . ASP C 92 ? 1.0321 0.8291 0.6625 -0.0335 0.0372 0.0449 70 ASP F OD1 3627 O OD2 . ASP C 92 ? 1.0225 0.8898 0.7264 -0.0342 0.0618 0.0301 70 ASP F OD2 3628 N N . LYS C 93 ? 0.7075 0.5560 0.4572 -0.0077 -0.0172 0.0151 71 LYS F N 3629 C CA . LYS C 93 ? 0.7062 0.5372 0.4607 -0.0074 -0.0390 0.0156 71 LYS F CA 3630 C C . LYS C 93 ? 0.7645 0.5844 0.5137 -0.0206 -0.0323 0.0291 71 LYS F C 3631 O O . LYS C 93 ? 0.7380 0.5830 0.5110 -0.0286 -0.0124 0.0325 71 LYS F O 3632 C CB . LYS C 93 ? 0.6871 0.5483 0.4906 -0.0010 -0.0490 0.0030 71 LYS F CB 3633 C CG . LYS C 93 ? 0.8474 0.7131 0.6593 0.0110 -0.0603 -0.0107 71 LYS F CG 3634 C CD . LYS C 93 ? 0.9222 0.8170 0.7800 0.0146 -0.0664 -0.0222 71 LYS F CD 3635 C CE . LYS C 93 ? 1.0366 0.9374 0.9082 0.0240 -0.0742 -0.0356 71 LYS F CE 3636 N NZ . LYS C 93 ? 1.1120 1.0406 1.0256 0.0254 -0.0765 -0.0464 71 LYS F NZ 3637 N N . ASN C 94 ? 0.7556 0.5361 0.4756 -0.0226 -0.0512 0.0356 72 ASN F N 3638 C CA . ASN C 94 ? 0.7753 0.5386 0.4890 -0.0358 -0.0489 0.0497 72 ASN F CA 3639 C C . ASN C 94 ? 0.7772 0.5633 0.5420 -0.0344 -0.0623 0.0431 72 ASN F C 3640 O O . ASN C 94 ? 0.7850 0.5505 0.5502 -0.0313 -0.0893 0.0405 72 ASN F O 3641 C CB . ASN C 94 ? 0.8525 0.5585 0.5085 -0.0385 -0.0658 0.0605 72 ASN F CB 3642 C CG . ASN C 94 ? 1.1789 0.8611 0.8204 -0.0551 -0.0597 0.0788 72 ASN F CG 3643 O OD1 . ASN C 94 ? 1.1110 0.8060 0.7546 -0.0683 -0.0297 0.0889 72 ASN F OD1 3644 N ND2 . ASN C 94 ? 1.1058 0.7515 0.7341 -0.0551 -0.0890 0.0824 72 ASN F ND2 3645 N N . LEU C 95 ? 0.6804 0.5088 0.4881 -0.0351 -0.0453 0.0382 73 LEU F N 3646 C CA . LEU C 95 ? 0.6356 0.4905 0.4917 -0.0320 -0.0545 0.0306 73 LEU F CA 3647 C C . LEU C 95 ? 0.6651 0.5402 0.5473 -0.0411 -0.0335 0.0365 73 LEU F C 3648 O O . LEU C 95 ? 0.6628 0.5460 0.5370 -0.0466 -0.0094 0.0401 73 LEU F O 3649 C CB . LEU C 95 ? 0.5919 0.4785 0.4760 -0.0197 -0.0587 0.0143 73 LEU F CB 3650 C CG . LEU C 95 ? 0.6564 0.5308 0.5340 -0.0098 -0.0825 0.0029 73 LEU F CG 3651 C CD1 . LEU C 95 ? 0.6289 0.5280 0.5203 -0.0018 -0.0758 -0.0085 73 LEU F CD1 3652 C CD2 . LEU C 95 ? 0.6764 0.5533 0.5807 -0.0059 -0.1064 -0.0060 73 LEU F CD2 3653 N N . PRO C 96 ? 0.6040 0.4882 0.5206 -0.0419 -0.0433 0.0353 74 PRO F N 3654 C CA . PRO C 96 ? 0.5887 0.4910 0.5353 -0.0492 -0.0252 0.0385 74 PRO F CA 3655 C C . PRO C 96 ? 0.5945 0.5337 0.5685 -0.0420 -0.0111 0.0270 74 PRO F C 3656 O O . PRO C 96 ? 0.5573 0.5150 0.5470 -0.0302 -0.0222 0.0157 74 PRO F O 3657 C CB . PRO C 96 ? 0.6042 0.5055 0.5818 -0.0479 -0.0458 0.0373 74 PRO F CB 3658 C CG . PRO C 96 ? 0.6795 0.5559 0.6358 -0.0432 -0.0737 0.0362 74 PRO F CG 3659 C CD . PRO C 96 ? 0.6168 0.4962 0.5503 -0.0351 -0.0727 0.0286 74 PRO F CD 3660 N N . ASP C 97 ? 0.5556 0.5035 0.5333 -0.0496 0.0136 0.0293 75 ASP F N 3661 C CA . ASP C 97 ? 0.5233 0.5007 0.5241 -0.0440 0.0267 0.0183 75 ASP F CA 3662 C C . ASP C 97 ? 0.5625 0.5469 0.5459 -0.0344 0.0234 0.0118 75 ASP F C 3663 O O . ASP C 97 ? 0.5272 0.5331 0.5312 -0.0256 0.0217 0.0019 75 ASP F O 3664 C CB . ASP C 97 ? 0.5140 0.5132 0.5615 -0.0370 0.0194 0.0087 75 ASP F CB 3665 C CG . ASP C 97 ? 0.6364 0.6435 0.7154 -0.0448 0.0343 0.0074 75 ASP F CG 3666 O OD1 . ASP C 97 ? 0.6293 0.6431 0.7434 -0.0412 0.0239 0.0032 75 ASP F OD1 3667 O OD2 . ASP C 97 ? 0.7235 0.7319 0.7953 -0.0537 0.0560 0.0084 75 ASP F OD2 3668 N N . TYR C 98 ? 0.5475 0.5110 0.4921 -0.0359 0.0213 0.0174 76 TYR F N 3669 C CA . TYR C 98 ? 0.5373 0.5049 0.4682 -0.0271 0.0170 0.0112 76 TYR F CA 3670 C C . TYR C 98 ? 0.5812 0.5677 0.5184 -0.0261 0.0337 0.0055 76 TYR F C 3671 O O . TYR C 98 ? 0.5947 0.5789 0.5215 -0.0336 0.0507 0.0083 76 TYR F O 3672 C CB . TYR C 98 ? 0.5856 0.5236 0.4759 -0.0268 0.0077 0.0162 76 TYR F CB 3673 C CG . TYR C 98 ? 0.5953 0.5383 0.4799 -0.0167 0.0007 0.0077 76 TYR F CG 3674 C CD1 . TYR C 98 ? 0.5969 0.5494 0.5011 -0.0086 -0.0151 -0.0010 76 TYR F CD1 3675 C CD2 . TYR C 98 ? 0.6169 0.5572 0.4803 -0.0153 0.0106 0.0070 76 TYR F CD2 3676 C CE1 . TYR C 98 ? 0.5966 0.5547 0.5014 -0.0010 -0.0195 -0.0091 76 TYR F CE1 3677 C CE2 . TYR C 98 ? 0.6160 0.5614 0.4801 -0.0059 0.0031 -0.0013 76 TYR F CE2 3678 C CZ . TYR C 98 ? 0.6900 0.6436 0.5758 0.0005 -0.0113 -0.0087 76 TYR F CZ 3679 O OH . TYR C 98 ? 0.6973 0.6558 0.5882 0.0082 -0.0171 -0.0168 76 TYR F OH 3680 N N . SER C 99 ? 0.5156 0.5205 0.4705 -0.0174 0.0287 -0.0032 77 SER F N 3681 C CA . SER C 99 ? 0.5036 0.5248 0.4672 -0.0147 0.0387 -0.0101 77 SER F CA 3682 C C . SER C 99 ? 0.5549 0.5773 0.5098 -0.0072 0.0308 -0.0138 77 SER F C 3683 O O . SER C 99 ? 0.5376 0.5612 0.4985 -0.0024 0.0191 -0.0154 77 SER F O 3684 C CB . SER C 99 ? 0.5237 0.5632 0.5204 -0.0120 0.0394 -0.0168 77 SER F CB 3685 O OG . SER C 99 ? 0.6393 0.6787 0.6518 -0.0183 0.0453 -0.0150 77 SER F OG 3686 N N . CYS C 100 ? 0.5285 0.5514 0.4714 -0.0063 0.0375 -0.0163 78 CYS F N 3687 C CA . CYS C 100 ? 0.5245 0.5483 0.4630 0.0007 0.0302 -0.0204 78 CYS F CA 3688 C C . CYS C 100 ? 0.5636 0.6004 0.5106 0.0025 0.0371 -0.0271 78 CYS F C 3689 O O . CYS C 100 ? 0.5717 0.6110 0.5134 -0.0012 0.0484 -0.0292 78 CYS F O 3690 C CB . CYS C 100 ? 0.5563 0.5598 0.4670 0.0029 0.0235 -0.0180 78 CYS F CB 3691 S SG . CYS C 100 ? 0.5987 0.6023 0.5139 0.0123 0.0108 -0.0247 78 CYS F SG 3692 N N . LYS C 101 ? 0.4993 0.5442 0.4600 0.0076 0.0301 -0.0311 79 LYS F N 3693 C CA . LYS C 101 ? 0.4888 0.5437 0.4599 0.0104 0.0312 -0.0383 79 LYS F CA 3694 C C . LYS C 101 ? 0.5236 0.5775 0.4988 0.0155 0.0209 -0.0392 79 LYS F C 3695 O O . LYS C 101 ? 0.5080 0.5607 0.4891 0.0155 0.0160 -0.0357 79 LYS F O 3696 C CB . LYS C 101 ? 0.5112 0.5765 0.5029 0.0091 0.0339 -0.0428 79 LYS F CB 3697 C CG . LYS C 101 ? 0.7194 0.7947 0.7223 0.0100 0.0378 -0.0538 79 LYS F CG 3698 C CD . LYS C 101 ? 0.8549 0.9384 0.8802 0.0085 0.0413 -0.0611 79 LYS F CD 3699 C CE . LYS C 101 ? 1.0178 1.1065 1.0460 0.0012 0.0571 -0.0636 79 LYS F CE 3700 N NZ . LYS C 101 ? 1.1331 1.2313 1.1914 0.0004 0.0598 -0.0742 79 LYS F NZ 3701 N N . VAL C 102 ? 0.4822 0.5372 0.4557 0.0196 0.0181 -0.0447 80 VAL F N 3702 C CA . VAL C 102 ? 0.4724 0.5261 0.4543 0.0241 0.0078 -0.0461 80 VAL F CA 3703 C C . VAL C 102 ? 0.5106 0.5717 0.5080 0.0251 0.0040 -0.0514 80 VAL F C 3704 O O . VAL C 102 ? 0.5090 0.5775 0.5096 0.0270 0.0057 -0.0601 80 VAL F O 3705 C CB . VAL C 102 ? 0.5332 0.5801 0.5048 0.0302 0.0023 -0.0497 80 VAL F CB 3706 C CG1 . VAL C 102 ? 0.5240 0.5711 0.5121 0.0348 -0.0091 -0.0526 80 VAL F CG1 3707 C CG2 . VAL C 102 ? 0.5415 0.5753 0.4969 0.0304 0.0012 -0.0457 80 VAL F CG2 3708 N N . PHE C 103 ? 0.4575 0.5155 0.4634 0.0237 -0.0015 -0.0471 81 PHE F N 3709 C CA . PHE C 103 ? 0.4533 0.5109 0.4696 0.0249 -0.0092 -0.0508 81 PHE F CA 3710 C C . PHE C 103 ? 0.4997 0.5523 0.5236 0.0272 -0.0201 -0.0507 81 PHE F C 3711 O O . PHE C 103 ? 0.4947 0.5413 0.5188 0.0248 -0.0205 -0.0433 81 PHE F O 3712 C CB . PHE C 103 ? 0.4761 0.5282 0.4903 0.0221 -0.0090 -0.0454 81 PHE F CB 3713 C CG . PHE C 103 ? 0.4927 0.5499 0.5051 0.0209 -0.0007 -0.0465 81 PHE F CG 3714 C CD1 . PHE C 103 ? 0.5320 0.5953 0.5543 0.0224 0.0004 -0.0562 81 PHE F CD1 3715 C CD2 . PHE C 103 ? 0.5189 0.5757 0.5242 0.0183 0.0052 -0.0395 81 PHE F CD2 3716 C CE1 . PHE C 103 ? 0.5414 0.6093 0.5671 0.0206 0.0082 -0.0573 81 PHE F CE1 3717 C CE2 . PHE C 103 ? 0.5527 0.6133 0.5595 0.0174 0.0106 -0.0404 81 PHE F CE2 3718 C CZ . PHE C 103 ? 0.5283 0.5940 0.5457 0.0183 0.0125 -0.0484 81 PHE F CZ 3719 N N . THR C 104 ? 0.4530 0.5093 0.4870 0.0318 -0.0291 -0.0605 82 THR F N 3720 C CA . THR C 104 ? 0.4506 0.5025 0.4963 0.0352 -0.0429 -0.0624 82 THR F CA 3721 C C . THR C 104 ? 0.5006 0.5400 0.5514 0.0327 -0.0546 -0.0588 82 THR F C 3722 O O . THR C 104 ? 0.4980 0.5340 0.5447 0.0318 -0.0555 -0.0607 82 THR F O 3723 C CB . THR C 104 ? 0.5454 0.6086 0.5991 0.0430 -0.0487 -0.0769 82 THR F CB 3724 O OG1 . THR C 104 ? 0.5414 0.6137 0.6001 0.0439 -0.0478 -0.0882 82 THR F OG1 3725 C CG2 . THR C 104 ? 0.5270 0.5950 0.5685 0.0464 -0.0399 -0.0784 82 THR F CG2 3726 N N . GLY C 105 ? 0.4590 0.4891 0.5186 0.0319 -0.0647 -0.0540 83 GLY F N 3727 C CA . GLY C 105 ? 0.4702 0.4823 0.5307 0.0283 -0.0773 -0.0479 83 GLY F CA 3728 C C . GLY C 105 ? 0.5266 0.5243 0.5675 0.0201 -0.0686 -0.0338 83 GLY F C 3729 O O . GLY C 105 ? 0.5392 0.5197 0.5695 0.0189 -0.0780 -0.0311 83 GLY F O 3730 N N . VAL C 106 ? 0.4718 0.4750 0.5066 0.0153 -0.0521 -0.0262 84 VAL F N 3731 C CA . VAL C 106 ? 0.4784 0.4723 0.4948 0.0080 -0.0413 -0.0146 84 VAL F CA 3732 C C . VAL C 106 ? 0.5409 0.5224 0.5585 -0.0011 -0.0384 -0.0026 84 VAL F C 3733 O O . VAL C 106 ? 0.5288 0.5160 0.5670 -0.0021 -0.0387 -0.0038 84 VAL F O 3734 C CB . VAL C 106 ? 0.5128 0.5206 0.5229 0.0080 -0.0261 -0.0155 84 VAL F CB 3735 C CG1 . VAL C 106 ? 0.5021 0.5165 0.5080 0.0141 -0.0274 -0.0239 84 VAL F CG1 3736 C CG2 . VAL C 106 ? 0.4956 0.5164 0.5197 0.0087 -0.0201 -0.0188 84 VAL F CG2 3737 N N . TYR C 107 ? 0.5197 0.4830 0.5148 -0.0077 -0.0354 0.0084 85 TYR F N 3738 C CA . TYR C 107 ? 0.5400 0.4893 0.5315 -0.0194 -0.0284 0.0216 85 TYR F CA 3739 C C . TYR C 107 ? 0.6025 0.5489 0.5682 -0.0259 -0.0107 0.0297 85 TYR F C 3740 O O . TYR C 107 ? 0.6270 0.5504 0.5621 -0.0286 -0.0133 0.0385 85 TYR F O 3741 C CB . TYR C 107 ? 0.5832 0.5053 0.5681 -0.0219 -0.0462 0.0284 85 TYR F CB 3742 C CG . TYR C 107 ? 0.6290 0.5369 0.6189 -0.0351 -0.0401 0.0420 85 TYR F CG 3743 C CD1 . TYR C 107 ? 0.6395 0.5579 0.6665 -0.0363 -0.0426 0.0384 85 TYR F CD1 3744 C CD2 . TYR C 107 ? 0.6790 0.5610 0.6363 -0.0464 -0.0322 0.0581 85 TYR F CD2 3745 C CE1 . TYR C 107 ? 0.6718 0.5775 0.7099 -0.0495 -0.0365 0.0502 85 TYR F CE1 3746 C CE2 . TYR C 107 ? 0.7165 0.5846 0.6788 -0.0612 -0.0237 0.0717 85 TYR F CE2 3747 C CZ . TYR C 107 ? 0.7924 0.6734 0.7986 -0.0632 -0.0256 0.0675 85 TYR F CZ 3748 O OH . TYR C 107 ? 0.8307 0.6985 0.8481 -0.0787 -0.0165 0.0802 85 TYR F OH 3749 N N . PRO C 108 ? 0.5408 0.5091 0.5168 -0.0270 0.0052 0.0253 86 PRO F N 3750 C CA . PRO C 108 ? 0.5516 0.5212 0.5054 -0.0313 0.0208 0.0296 86 PRO F CA 3751 C C . PRO C 108 ? 0.6343 0.5942 0.5792 -0.0455 0.0366 0.0411 86 PRO F C 3752 O O . PRO C 108 ? 0.6280 0.5915 0.5985 -0.0533 0.0417 0.0424 86 PRO F O 3753 C CB . PRO C 108 ? 0.5416 0.5381 0.5142 -0.0266 0.0280 0.0181 86 PRO F CB 3754 C CG . PRO C 108 ? 0.5785 0.5842 0.5827 -0.0252 0.0228 0.0117 86 PRO F CG 3755 C CD . PRO C 108 ? 0.5295 0.5203 0.5355 -0.0228 0.0070 0.0144 86 PRO F CD 3756 N N . PHE C 109 ? 0.6232 0.5706 0.5319 -0.0485 0.0448 0.0485 87 PHE F N 3757 C CA . PHE C 109 ? 0.6605 0.5968 0.5506 -0.0630 0.0639 0.0604 87 PHE F CA 3758 C C . PHE C 109 ? 0.7095 0.6685 0.5970 -0.0649 0.0844 0.0539 87 PHE F C 3759 O O . PHE C 109 ? 0.6927 0.6598 0.5673 -0.0540 0.0802 0.0467 87 PHE F O 3760 C CB . PHE C 109 ? 0.7331 0.6306 0.5740 -0.0649 0.0564 0.0749 87 PHE F CB 3761 C CG . PHE C 109 ? 0.7750 0.6438 0.6154 -0.0700 0.0408 0.0853 87 PHE F CG 3762 C CD1 . PHE C 109 ? 0.8469 0.7013 0.6874 -0.0872 0.0534 0.0992 87 PHE F CD1 3763 C CD2 . PHE C 109 ? 0.7944 0.6500 0.6355 -0.0581 0.0132 0.0803 87 PHE F CD2 3764 C CE1 . PHE C 109 ? 0.8815 0.7071 0.7228 -0.0919 0.0361 0.1092 87 PHE F CE1 3765 C CE2 . PHE C 109 ? 0.8522 0.6813 0.6947 -0.0618 -0.0046 0.0879 87 PHE F CE2 3766 C CZ . PHE C 109 ? 0.8601 0.6730 0.7019 -0.0784 0.0057 0.1031 87 PHE F CZ 3767 N N . MET C 110 ? 0.6794 0.6496 0.5831 -0.0788 0.1060 0.0550 88 MET F N 3768 C CA . MET C 110 ? 0.6801 0.6737 0.5853 -0.0828 0.1276 0.0469 88 MET F CA 3769 C C . MET C 110 ? 0.7834 0.7591 0.6527 -0.0983 0.1495 0.0612 88 MET F C 3770 O O . MET C 110 ? 0.8151 0.7562 0.6538 -0.1038 0.1438 0.0783 88 MET F O 3771 C CB . MET C 110 ? 0.6757 0.7010 0.6359 -0.0855 0.1349 0.0308 88 MET F CB 3772 C CG . MET C 110 ? 0.6808 0.7277 0.6602 -0.0703 0.1213 0.0143 88 MET F CG 3773 S SD . MET C 110 ? 0.7009 0.7779 0.7397 -0.0710 0.1242 -0.0066 88 MET F SD 3774 C CE . MET C 110 ? 0.6738 0.7748 0.7141 -0.0791 0.1492 -0.0174 88 MET F CE 3775 N N . TRP C 111 ? 0.7489 0.7466 0.6197 -0.1052 0.1738 0.0537 89 TRP F N 3776 C CA . TRP C 111 ? 0.8024 0.7883 0.6376 -0.1210 0.2007 0.0650 89 TRP F CA 3777 C C . TRP C 111 ? 0.8826 0.8468 0.7219 -0.1411 0.2130 0.0817 89 TRP F C 3778 O O . TRP C 111 ? 0.9344 0.8647 0.7223 -0.1511 0.2215 0.1011 89 TRP F O 3779 C CB . TRP C 111 ? 0.7810 0.8048 0.6332 -0.1243 0.2248 0.0474 89 TRP F CB 3780 C CG . TRP C 111 ? 0.8453 0.8678 0.6811 -0.1454 0.2599 0.0546 89 TRP F CG 3781 C CD1 . TRP C 111 ? 0.9404 0.9439 0.7137 -0.1504 0.2762 0.0663 89 TRP F CD1 3782 C CD2 . TRP C 111 ? 0.8461 0.8851 0.7279 -0.1650 0.2838 0.0508 89 TRP F CD2 3783 N NE1 . TRP C 111 ? 0.9745 0.9818 0.7489 -0.1737 0.3116 0.0714 89 TRP F NE1 3784 C CE2 . TRP C 111 ? 0.9574 0.9879 0.8020 -0.1835 0.3173 0.0613 89 TRP F CE2 3785 C CE3 . TRP C 111 ? 0.8212 0.8800 0.7724 -0.1683 0.2798 0.0385 89 TRP F CE3 3786 C CZ2 . TRP C 111 ? 0.9683 1.0124 0.8478 -0.2070 0.3493 0.0598 89 TRP F CZ2 3787 C CZ3 . TRP C 111 ? 0.8571 0.9284 0.8453 -0.1893 0.3079 0.0355 89 TRP F CZ3 3788 C CH2 . TRP C 111 ? 0.9243 0.9897 0.8793 -0.2093 0.3435 0.0460 89 TRP F CH2 3789 N N . GLY C 112 ? 0.8061 0.7870 0.7044 -0.1466 0.2127 0.0741 90 GLY F N 3790 C CA . GLY C 112 ? 0.8309 0.7946 0.7445 -0.1655 0.2233 0.0878 90 GLY F CA 3791 C C . GLY C 112 ? 0.8653 0.8050 0.7906 -0.1599 0.1943 0.0965 90 GLY F C 3792 O O . GLY C 112 ? 0.8536 0.7948 0.8226 -0.1692 0.1954 0.0970 90 GLY F O 3793 N N . GLY C 113 ? 0.8180 0.7367 0.7074 -0.1445 0.1680 0.1014 91 GLY F N 3794 C CA . GLY C 113 ? 0.8034 0.7010 0.7011 -0.1368 0.1380 0.1066 91 GLY F CA 3795 C C . GLY C 113 ? 0.7881 0.7094 0.7193 -0.1171 0.1157 0.0881 91 GLY F C 3796 O O . GLY C 113 ? 0.7536 0.6991 0.6867 -0.1070 0.1185 0.0746 91 GLY F O 3797 N N . ALA C 114 ? 0.7263 0.6398 0.6832 -0.1117 0.0932 0.0875 92 ALA F N 3798 C CA . ALA C 114 ? 0.6741 0.6062 0.6593 -0.0939 0.0722 0.0714 92 ALA F CA 3799 C C . ALA C 114 ? 0.6825 0.6490 0.7137 -0.0914 0.0814 0.0540 92 ALA F C 3800 O O . ALA C 114 ? 0.6811 0.6552 0.7459 -0.1023 0.0942 0.0523 92 ALA F O 3801 C CB . ALA C 114 ? 0.6820 0.5972 0.6824 -0.0899 0.0475 0.0742 92 ALA F CB 3802 N N . TYR C 115 ? 0.6033 0.5883 0.6368 -0.0770 0.0737 0.0404 93 TYR F N 3803 C CA . TYR C 115 ? 0.5665 0.5789 0.6368 -0.0717 0.0767 0.0227 93 TYR F CA 3804 C C . TYR C 115 ? 0.5893 0.6039 0.6980 -0.0649 0.0603 0.0144 93 TYR F C 3805 O O . TYR C 115 ? 0.5685 0.5981 0.7148 -0.0649 0.0639 0.0017 93 TYR F O 3806 C CB . TYR C 115 ? 0.5608 0.5860 0.6148 -0.0595 0.0722 0.0138 93 TYR F CB 3807 C CG . TYR C 115 ? 0.5547 0.6018 0.6398 -0.0524 0.0701 -0.0040 93 TYR F CG 3808 C CD1 . TYR C 115 ? 0.5790 0.6435 0.6871 -0.0592 0.0854 -0.0142 93 TYR F CD1 3809 C CD2 . TYR C 115 ? 0.5419 0.5909 0.6312 -0.0389 0.0524 -0.0117 93 TYR F CD2 3810 C CE1 . TYR C 115 ? 0.5657 0.6461 0.7019 -0.0515 0.0790 -0.0323 93 TYR F CE1 3811 C CE2 . TYR C 115 ? 0.5346 0.5968 0.6455 -0.0321 0.0478 -0.0269 93 TYR F CE2 3812 C CZ . TYR C 115 ? 0.6321 0.7087 0.7668 -0.0377 0.0591 -0.0376 93 TYR F CZ 3813 O OH . TYR C 115 ? 0.6339 0.7195 0.7896 -0.0299 0.0504 -0.0543 93 TYR F OH 3814 N N . CYS C 116 ? 0.5437 0.5433 0.6441 -0.0579 0.0408 0.0194 94 CYS F N 3815 C CA . CYS C 116 ? 0.5239 0.5247 0.6561 -0.0490 0.0227 0.0110 94 CYS F CA 3816 C C . CYS C 116 ? 0.5934 0.5775 0.7426 -0.0572 0.0167 0.0203 94 CYS F C 3817 O O . CYS C 116 ? 0.6156 0.5794 0.7387 -0.0660 0.0178 0.0357 94 CYS F O 3818 C CB . CYS C 116 ? 0.5097 0.5113 0.6268 -0.0336 0.0046 0.0050 94 CYS F CB 3819 S SG . CYS C 116 ? 0.5358 0.5546 0.6384 -0.0242 0.0092 -0.0057 94 CYS F SG 3820 N N . PHE C 117 ? 0.5394 0.5294 0.7320 -0.0531 0.0076 0.0105 95 PHE F N 3821 C CA . PHE C 117 ? 0.5529 0.5288 0.7720 -0.0591 -0.0016 0.0168 95 PHE F CA 3822 C C . PHE C 117 ? 0.6023 0.5646 0.8091 -0.0489 -0.0275 0.0192 95 PHE F C 3823 O O . PHE C 117 ? 0.6209 0.5625 0.8260 -0.0570 -0.0352 0.0316 95 PHE F O 3824 C CB . PHE C 117 ? 0.5606 0.5489 0.8353 -0.0552 -0.0050 0.0017 95 PHE F CB 3825 C CG . PHE C 117 ? 0.5871 0.5643 0.8977 -0.0540 -0.0234 0.0024 95 PHE F CG 3826 C CD1 . PHE C 117 ? 0.6538 0.6164 0.9805 -0.0726 -0.0142 0.0167 95 PHE F CD1 3827 C CD2 . PHE C 117 ? 0.5959 0.5767 0.9240 -0.0344 -0.0500 -0.0115 95 PHE F CD2 3828 C CE1 . PHE C 117 ? 0.6717 0.6231 1.0355 -0.0714 -0.0335 0.0173 95 PHE F CE1 3829 C CE2 . PHE C 117 ? 0.6370 0.6088 1.0016 -0.0315 -0.0697 -0.0127 95 PHE F CE2 3830 C CZ . PHE C 117 ? 0.6377 0.5948 1.0222 -0.0500 -0.0624 0.0017 95 PHE F CZ 3831 N N . CYS C 118 ? 0.5354 0.5090 0.7349 -0.0316 -0.0411 0.0062 96 CYS F N 3832 C CA . CYS C 118 ? 0.5305 0.4982 0.7224 -0.0199 -0.0647 0.0024 96 CYS F CA 3833 C C . CYS C 118 ? 0.5948 0.5493 0.7453 -0.0229 -0.0656 0.0119 96 CYS F C 3834 O O . CYS C 118 ? 0.5918 0.5486 0.7144 -0.0273 -0.0493 0.0164 96 CYS F O 3835 C CB . CYS C 118 ? 0.5085 0.4939 0.7078 -0.0017 -0.0749 -0.0158 96 CYS F CB 3836 S SG . CYS C 118 ? 0.5460 0.5404 0.7936 0.0075 -0.0836 -0.0306 96 CYS F SG 3837 N N . ASP C 119 ? 0.5630 0.5034 0.7122 -0.0190 -0.0875 0.0124 97 ASP F N 3838 C CA . ASP C 119 ? 0.5779 0.5019 0.6925 -0.0196 -0.0948 0.0179 97 ASP F CA 3839 C C . ASP C 119 ? 0.5983 0.5388 0.7009 -0.0061 -0.0987 0.0032 97 ASP F C 3840 O O . ASP C 119 ? 0.5996 0.5352 0.6727 -0.0076 -0.0918 0.0065 97 ASP F O 3841 C CB . ASP C 119 ? 0.6271 0.5265 0.7479 -0.0210 -0.1200 0.0224 97 ASP F CB 3842 C CG . ASP C 119 ? 0.7976 0.6738 0.9240 -0.0377 -0.1151 0.0408 97 ASP F CG 3843 O OD1 . ASP C 119 ? 0.8382 0.6939 0.9302 -0.0508 -0.1009 0.0573 97 ASP F OD1 3844 O OD2 . ASP C 119 ? 0.8685 0.7460 1.0332 -0.0375 -0.1257 0.0384 97 ASP F OD2 3845 N N . ALA C 120 ? 0.5265 0.4858 0.6513 0.0069 -0.1093 -0.0132 98 ALA F N 3846 C CA . ALA C 120 ? 0.5047 0.4800 0.6197 0.0180 -0.1110 -0.0273 98 ALA F CA 3847 C C . ALA C 120 ? 0.5227 0.5207 0.6422 0.0260 -0.1004 -0.0379 98 ALA F C 3848 O O . ALA C 120 ? 0.5094 0.5180 0.6134 0.0301 -0.0933 -0.0443 98 ALA F O 3849 C CB . ALA C 120 ? 0.5172 0.4907 0.6440 0.0270 -0.1359 -0.0398 98 ALA F CB 3850 N N . GLU C 121 ? 0.4648 0.4677 0.6054 0.0287 -0.1009 -0.0403 99 GLU F N 3851 C CA . GLU C 121 ? 0.4441 0.4617 0.5863 0.0382 -0.0960 -0.0510 99 GLU F CA 3852 C C . GLU C 121 ? 0.4761 0.4974 0.6029 0.0329 -0.0759 -0.0461 99 GLU F C 3853 O O . GLU C 121 ? 0.4650 0.4909 0.5973 0.0390 -0.0746 -0.0529 99 GLU F O 3854 C CB . GLU C 121 ? 0.4604 0.4789 0.6333 0.0468 -0.1104 -0.0594 99 GLU F CB 3855 C CG . GLU C 121 ? 0.5999 0.6200 0.7890 0.0567 -0.1332 -0.0697 99 GLU F CG 3856 C CD . GLU C 121 ? 0.8877 0.8930 1.0950 0.0492 -0.1469 -0.0614 99 GLU F CD 3857 O OE1 . GLU C 121 ? 0.8292 0.8233 1.0504 0.0386 -0.1416 -0.0496 99 GLU F OE1 3858 O OE2 . GLU C 121 ? 0.8259 0.8301 1.0347 0.0536 -0.1634 -0.0677 99 GLU F OE2 3859 N N . ASN C 122 ? 0.4276 0.4451 0.5348 0.0232 -0.0632 -0.0360 100 ASN F N 3860 C CA . ASN C 122 ? 0.4169 0.4387 0.5117 0.0182 -0.0462 -0.0321 100 ASN F CA 3861 C C . ASN C 122 ? 0.4518 0.4803 0.5237 0.0215 -0.0404 -0.0351 100 ASN F C 3862 O O . ASN C 122 ? 0.4482 0.4758 0.5115 0.0228 -0.0446 -0.0362 100 ASN F O 3863 C CB . ASN C 122 ? 0.4331 0.4466 0.5229 0.0052 -0.0353 -0.0194 100 ASN F CB 3864 C CG . ASN C 122 ? 0.6991 0.7024 0.8092 -0.0017 -0.0395 -0.0132 100 ASN F CG 3865 O OD1 . ASN C 122 ? 0.6163 0.6232 0.7531 -0.0017 -0.0396 -0.0175 100 ASN F OD1 3866 N ND2 . ASN C 122 ? 0.6057 0.5935 0.7042 -0.0077 -0.0442 -0.0034 100 ASN F ND2 3867 N N . THR C 123 ? 0.3969 0.4310 0.4616 0.0227 -0.0319 -0.0375 101 THR F N 3868 C CA . THR C 123 ? 0.3883 0.4274 0.4333 0.0244 -0.0254 -0.0391 101 THR F CA 3869 C C . THR C 123 ? 0.4268 0.4675 0.4636 0.0188 -0.0144 -0.0341 101 THR F C 3870 O O . THR C 123 ? 0.4185 0.4591 0.4650 0.0162 -0.0119 -0.0340 101 THR F O 3871 C CB . THR C 123 ? 0.4897 0.5314 0.5284 0.0331 -0.0289 -0.0479 101 THR F CB 3872 O OG1 . THR C 123 ? 0.4839 0.5212 0.5290 0.0363 -0.0321 -0.0509 101 THR F OG1 3873 C CG2 . THR C 123 ? 0.4736 0.5183 0.5178 0.0402 -0.0388 -0.0559 101 THR F CG2 3874 N N . GLN C 124 ? 0.3787 0.4221 0.4016 0.0175 -0.0089 -0.0323 102 GLN F N 3875 C CA . GLN C 124 ? 0.3715 0.4177 0.3877 0.0141 -0.0010 -0.0294 102 GLN F CA 3876 C C . GLN C 124 ? 0.4145 0.4628 0.4207 0.0169 0.0008 -0.0325 102 GLN F C 3877 O O . GLN C 124 ? 0.4074 0.4576 0.4085 0.0184 0.0018 -0.0343 102 GLN F O 3878 C CB . GLN C 124 ? 0.3915 0.4363 0.4007 0.0103 0.0028 -0.0239 102 GLN F CB 3879 C CG . GLN C 124 ? 0.5747 0.6243 0.5802 0.0078 0.0097 -0.0225 102 GLN F CG 3880 C CD . GLN C 124 ? 0.8337 0.8814 0.8281 0.0078 0.0115 -0.0193 102 GLN F CD 3881 O OE1 . GLN C 124 ? 0.7781 0.8291 0.7697 0.0110 0.0110 -0.0219 102 GLN F OE1 3882 N NE2 . GLN C 124 ? 0.7470 0.7876 0.7339 0.0042 0.0136 -0.0137 102 GLN F NE2 3883 N N . LEU C 125 ? 0.3708 0.4177 0.3756 0.0172 0.0008 -0.0340 103 LEU F N 3884 C CA . LEU C 125 ? 0.3721 0.4157 0.3640 0.0184 0.0014 -0.0348 103 LEU F CA 3885 C C . LEU C 125 ? 0.4140 0.4622 0.4063 0.0150 0.0051 -0.0321 103 LEU F C 3886 O O . LEU C 125 ? 0.4031 0.4539 0.4027 0.0139 0.0038 -0.0336 103 LEU F O 3887 C CB . LEU C 125 ? 0.3820 0.4155 0.3696 0.0224 -0.0061 -0.0392 103 LEU F CB 3888 C CG . LEU C 125 ? 0.4557 0.4781 0.4226 0.0232 -0.0074 -0.0383 103 LEU F CG 3889 C CD1 . LEU C 125 ? 0.4770 0.4852 0.4283 0.0297 -0.0144 -0.0422 103 LEU F CD1 3890 C CD2 . LEU C 125 ? 0.4871 0.5059 0.4567 0.0218 -0.0125 -0.0393 103 LEU F CD2 3891 N N . SER C 126 ? 0.3719 0.4226 0.3600 0.0140 0.0093 -0.0302 104 SER F N 3892 C CA . SER C 126 ? 0.3663 0.4211 0.3573 0.0127 0.0107 -0.0289 104 SER F CA 3893 C C . SER C 126 ? 0.4257 0.4745 0.4098 0.0113 0.0098 -0.0278 104 SER F C 3894 O O . SER C 126 ? 0.4300 0.4738 0.4051 0.0098 0.0139 -0.0267 104 SER F O 3895 C CB . SER C 126 ? 0.4077 0.4669 0.4033 0.0133 0.0134 -0.0293 104 SER F CB 3896 O OG . SER C 126 ? 0.5198 0.5795 0.5167 0.0144 0.0119 -0.0286 104 SER F OG 3897 N N . GLU C 127 ? 0.3829 0.4311 0.3702 0.0114 0.0042 -0.0286 105 GLU F N 3898 C CA . GLU C 127 ? 0.3918 0.4302 0.3719 0.0095 0.0003 -0.0265 105 GLU F CA 3899 C C . GLU C 127 ? 0.4323 0.4768 0.4246 0.0096 -0.0037 -0.0272 105 GLU F C 3900 O O . GLU C 127 ? 0.4163 0.4722 0.4201 0.0126 -0.0061 -0.0316 105 GLU F O 3901 C CB . GLU C 127 ? 0.4268 0.4486 0.3923 0.0106 -0.0080 -0.0275 105 GLU F CB 3902 C CG . GLU C 127 ? 0.5664 0.5879 0.5419 0.0137 -0.0198 -0.0351 105 GLU F CG 3903 C CD . GLU C 127 ? 0.8758 0.8772 0.8379 0.0170 -0.0313 -0.0389 105 GLU F CD 3904 O OE1 . GLU C 127 ? 0.8560 0.8371 0.7973 0.0160 -0.0375 -0.0347 105 GLU F OE1 3905 O OE2 . GLU C 127 ? 0.8083 0.8124 0.7812 0.0207 -0.0352 -0.0468 105 GLU F OE2 3906 N N . ALA C 128 ? 0.3962 0.4334 0.3861 0.0062 -0.0033 -0.0229 106 ALA F N 3907 C CA . ALA C 128 ? 0.3878 0.4295 0.3929 0.0067 -0.0089 -0.0236 106 ALA F CA 3908 C C . ALA C 128 ? 0.4537 0.4793 0.4519 0.0009 -0.0115 -0.0172 106 ALA F C 3909 O O . ALA C 128 ? 0.4659 0.4801 0.4477 -0.0050 -0.0022 -0.0111 106 ALA F O 3910 C CB . ALA C 128 ? 0.3846 0.4392 0.4051 0.0090 -0.0023 -0.0258 106 ALA F CB 3911 N N . HIS C 129 ? 0.4076 0.4319 0.4178 0.0022 -0.0243 -0.0188 107 HIS F N 3912 C CA . HIS C 129 ? 0.4236 0.4303 0.4302 -0.0041 -0.0298 -0.0117 107 HIS F CA 3913 C C . HIS C 129 ? 0.4548 0.4712 0.4899 -0.0005 -0.0412 -0.0160 107 HIS F C 3914 O O . HIS C 129 ? 0.4258 0.4602 0.4772 0.0082 -0.0482 -0.0258 107 HIS F O 3915 C CB . HIS C 129 ? 0.4593 0.4403 0.4396 -0.0062 -0.0415 -0.0085 107 HIS F CB 3916 C CG . HIS C 129 ? 0.4972 0.4776 0.4882 0.0000 -0.0636 -0.0178 107 HIS F CG 3917 N ND1 . HIS C 129 ? 0.5066 0.4968 0.5013 0.0068 -0.0689 -0.0289 107 HIS F ND1 3918 C CD2 . HIS C 129 ? 0.5272 0.4983 0.5281 0.0001 -0.0818 -0.0189 107 HIS F CD2 3919 C CE1 . HIS C 129 ? 0.4989 0.4881 0.5070 0.0109 -0.0890 -0.0383 107 HIS F CE1 3920 N NE2 . HIS C 129 ? 0.5152 0.4926 0.5269 0.0077 -0.0990 -0.0328 107 HIS F NE2 3921 N N . VAL C 130 ? 0.4255 0.4297 0.4665 -0.0073 -0.0425 -0.0087 108 VAL F N 3922 C CA . VAL C 130 ? 0.4128 0.4245 0.4848 -0.0036 -0.0552 -0.0127 108 VAL F CA 3923 C C . VAL C 130 ? 0.4811 0.4731 0.5494 -0.0056 -0.0767 -0.0103 108 VAL F C 3924 O O . VAL C 130 ? 0.5072 0.4717 0.5486 -0.0149 -0.0765 0.0006 108 VAL F O 3925 C CB . VAL C 130 ? 0.4604 0.4768 0.5544 -0.0086 -0.0422 -0.0093 108 VAL F CB 3926 C CG1 . VAL C 130 ? 0.4505 0.4722 0.5801 -0.0041 -0.0579 -0.0137 108 VAL F CG1 3927 C CG2 . VAL C 130 ? 0.4383 0.4739 0.5398 -0.0034 -0.0278 -0.0163 108 VAL F CG2 3928 N N . GLU C 131 ? 0.4214 0.4265 0.5146 0.0041 -0.0966 -0.0217 109 GLU F N 3929 C CA . GLU C 131 ? 0.4324 0.4233 0.5309 0.0052 -0.1228 -0.0245 109 GLU F CA 3930 C C . GLU C 131 ? 0.4577 0.4670 0.5965 0.0140 -0.1380 -0.0342 109 GLU F C 3931 O O . GLU C 131 ? 0.4304 0.4622 0.5880 0.0205 -0.1281 -0.0395 109 GLU F O 3932 C CB . GLU C 131 ? 0.4474 0.4410 0.5353 0.0119 -0.1347 -0.0366 109 GLU F CB 3933 C CG . GLU C 131 ? 0.6305 0.5904 0.6953 0.0073 -0.1528 -0.0331 109 GLU F CG 3934 C CD . GLU C 131 ? 0.9051 0.8701 0.9687 0.0151 -0.1661 -0.0496 109 GLU F CD 3935 O OE1 . GLU C 131 ? 0.8418 0.8217 0.9326 0.0234 -0.1864 -0.0663 109 GLU F OE1 3936 O OE2 . GLU C 131 ? 0.8390 0.7947 0.8780 0.0135 -0.1564 -0.0478 109 GLU F OE2 3937 N N . LYS C 132 ? 0.4209 0.4191 0.5729 0.0156 -0.1647 -0.0378 110 LYS F N 3938 C CA . LYS C 132 ? 0.4007 0.4165 0.5933 0.0259 -0.1837 -0.0492 110 LYS F CA 3939 C C . LYS C 132 ? 0.4235 0.4725 0.6295 0.0415 -0.1891 -0.0700 110 LYS F C 3940 O O . LYS C 132 ? 0.4180 0.4703 0.6088 0.0432 -0.1908 -0.0779 110 LYS F O 3941 C CB . LYS C 132 ? 0.4511 0.4445 0.6537 0.0234 -0.2140 -0.0486 110 LYS F CB 3942 C CG . LYS C 132 ? 0.6095 0.5755 0.8149 0.0098 -0.2119 -0.0295 110 LYS F CG 3943 C CD . LYS C 132 ? 0.7268 0.6718 0.9493 0.0091 -0.2464 -0.0300 110 LYS F CD 3944 C CE . LYS C 132 ? 0.8618 0.7733 1.0497 0.0042 -0.2650 -0.0274 110 LYS F CE 3945 N NZ . LYS C 132 ? 0.9938 0.8752 1.1930 0.0001 -0.2978 -0.0230 110 LYS F NZ 3946 N N . SER C 133 ? 0.3804 0.4742 0.5733 -0.1040 -0.0010 -0.0982 111 SER F N 3947 C CA . SER C 133 ? 0.4056 0.4846 0.5871 -0.1253 0.0218 -0.1117 111 SER F CA 3948 C C . SER C 133 ? 0.4344 0.5585 0.6609 -0.1242 0.0218 -0.1313 111 SER F C 3949 O O . SER C 133 ? 0.4001 0.5536 0.6566 -0.1020 0.0006 -0.1261 111 SER F O 3950 C CB . SER C 133 ? 0.4794 0.5049 0.6131 -0.1259 0.0251 -0.0904 111 SER F CB 3951 O OG . SER C 133 ? 0.6315 0.6337 0.7413 -0.1508 0.0485 -0.1026 111 SER F OG 3952 N N . GLU C 134 ? 0.4116 0.5373 0.6420 -0.1487 0.0473 -0.1549 112 GLU F N 3953 C CA . GLU C 134 ? 0.3976 0.5656 0.6768 -0.1508 0.0541 -0.1801 112 GLU F CA 3954 C C . GLU C 134 ? 0.4350 0.5915 0.7088 -0.1351 0.0455 -0.1647 112 GLU F C 3955 O O . GLU C 134 ? 0.4102 0.6036 0.7318 -0.1236 0.0405 -0.1783 112 GLU F O 3956 C CB . GLU C 134 ? 0.4533 0.6141 0.7268 -0.1870 0.0910 -0.2095 112 GLU F CB 3957 C CG . GLU C 134 ? 0.6106 0.7798 0.8871 -0.2088 0.1055 -0.2291 112 GLU F CG 3958 C CD . GLU C 134 ? 0.9156 1.0186 1.1215 -0.2246 0.1174 -0.2111 112 GLU F CD 3959 O OE1 . GLU C 134 ? 0.8669 0.9203 1.0241 -0.2118 0.1060 -0.1784 112 GLU F OE1 3960 O OE2 . GLU C 134 ? 0.8582 0.9594 1.0603 -0.2495 0.1377 -0.2311 112 GLU F OE2 3961 N N . SER C 135 ? 0.4061 0.5111 0.6233 -0.1341 0.0426 -0.1373 113 SER F N 3962 C CA . SER C 135 ? 0.4004 0.4868 0.6002 -0.1235 0.0347 -0.1206 113 SER F CA 3963 C C . SER C 135 ? 0.4084 0.5167 0.6342 -0.0926 0.0069 -0.1049 113 SER F C 3964 O O . SER C 135 ? 0.3984 0.5029 0.6245 -0.0846 0.0027 -0.0989 113 SER F O 3965 C CB . SER C 135 ? 0.4814 0.5092 0.6145 -0.1318 0.0355 -0.0970 113 SER F CB 3966 O OG . SER C 135 ? 0.5879 0.6024 0.7079 -0.1181 0.0192 -0.0773 113 SER F OG 3967 N N . CYS C 136 ? 0.3425 0.4679 0.5830 -0.0786 -0.0101 -0.0986 114 CYS F N 3968 C CA . CYS C 136 ? 0.3137 0.4509 0.5671 -0.0534 -0.0348 -0.0829 114 CYS F CA 3969 C C . CYS C 136 ? 0.3418 0.5046 0.6327 -0.0378 -0.0442 -0.0896 114 CYS F C 3970 O O . CYS C 136 ? 0.3287 0.4828 0.6134 -0.0213 -0.0591 -0.0730 114 CYS F O 3971 C CB . CYS C 136 ? 0.3112 0.4596 0.5677 -0.0480 -0.0471 -0.0797 114 CYS F CB 3972 S SG . CYS C 136 ? 0.3775 0.4852 0.5886 -0.0565 -0.0407 -0.0640 114 CYS F SG 3973 N N . LYS C 137 ? 0.2936 0.4855 0.6244 -0.0436 -0.0336 -0.1154 115 LYS F N 3974 C CA . LYS C 137 ? 0.2807 0.4961 0.6552 -0.0272 -0.0406 -0.1257 115 LYS F CA 3975 C C . LYS C 137 ? 0.3337 0.5245 0.6920 -0.0335 -0.0249 -0.1244 115 LYS F C 3976 O O . LYS C 137 ? 0.3252 0.5183 0.7028 -0.0170 -0.0326 -0.1228 115 LYS F O 3977 C CB . LYS C 137 ? 0.3125 0.5745 0.7466 -0.0306 -0.0345 -0.1588 115 LYS F CB 3978 C CG . LYS C 137 ? 0.4973 0.7918 0.9565 -0.0196 -0.0580 -0.1619 115 LYS F CG 3979 C CD . LYS C 137 ? 0.6317 0.9787 1.1543 -0.0267 -0.0512 -0.1988 115 LYS F CD 3980 C CE . LYS C 137 ? 0.7875 1.1365 1.2952 -0.0582 -0.0273 -0.2148 115 LYS F CE 3981 N NZ . LYS C 137 ? 0.9091 1.3155 1.4844 -0.0674 -0.0197 -0.2549 115 LYS F NZ 3982 N N . THR C 138 ? 0.3042 0.4670 0.6220 -0.0584 -0.0033 -0.1250 116 THR F N 3983 C CA . THR C 138 ? 0.3187 0.4541 0.6090 -0.0712 0.0125 -0.1247 116 THR F CA 3984 C C . THR C 138 ? 0.3672 0.4655 0.6046 -0.0686 0.0003 -0.0949 116 THR F C 3985 O O . THR C 138 ? 0.3624 0.4514 0.5944 -0.0618 -0.0039 -0.0876 116 THR F O 3986 C CB . THR C 138 ? 0.4472 0.5734 0.7235 -0.1034 0.0439 -0.1474 116 THR F CB 3987 O OG1 . THR C 138 ? 0.4318 0.6018 0.7703 -0.1049 0.0556 -0.1798 116 THR F OG1 3988 C CG2 . THR C 138 ? 0.4583 0.5529 0.6982 -0.1218 0.0619 -0.1494 116 THR F CG2 3989 N N . GLU C 139 ? 0.3241 0.4022 0.5263 -0.0742 -0.0046 -0.0801 117 GLU F N 3990 C CA . GLU C 139 ? 0.3253 0.3733 0.4862 -0.0704 -0.0179 -0.0548 117 GLU F CA 3991 C C . GLU C 139 ? 0.3388 0.3970 0.5114 -0.0500 -0.0380 -0.0398 117 GLU F C 3992 O O . GLU C 139 ? 0.3334 0.3921 0.5044 -0.0509 -0.0390 -0.0389 117 GLU F O 3993 C CB . GLU C 139 ? 0.3821 0.3923 0.4928 -0.0905 -0.0091 -0.0492 117 GLU F CB 3994 C CG . GLU C 139 ? 0.5577 0.5431 0.6349 -0.1142 0.0085 -0.0578 117 GLU F CG 3995 C CD . GLU C 139 ? 0.8309 0.8029 0.8868 -0.1122 -0.0011 -0.0466 117 GLU F CD 3996 O OE1 . GLU C 139 ? 0.7605 0.7275 0.8082 -0.0970 -0.0230 -0.0262 117 GLU F OE1 3997 O OE2 . GLU C 139 ? 0.7754 0.7429 0.8240 -0.1281 0.0152 -0.0608 117 GLU F OE2 3998 N N . PHE C 140 ? 0.2716 0.3347 0.4529 -0.0348 -0.0508 -0.0300 118 PHE F N 3999 C CA . PHE C 140 ? 0.2481 0.3170 0.4357 -0.0193 -0.0661 -0.0178 118 PHE F CA 4000 C C . PHE C 140 ? 0.2885 0.3493 0.4689 -0.0113 -0.0746 -0.0059 118 PHE F C 4001 O O . PHE C 140 ? 0.2868 0.3438 0.4667 -0.0137 -0.0705 -0.0090 118 PHE F O 4002 C CB . PHE C 140 ? 0.2570 0.3509 0.4752 -0.0091 -0.0722 -0.0264 118 PHE F CB 4003 C CG . PHE C 140 ? 0.2725 0.3774 0.5152 0.0021 -0.0762 -0.0324 118 PHE F CG 4004 C CD1 . PHE C 140 ? 0.3086 0.4077 0.5497 0.0165 -0.0898 -0.0211 118 PHE F CD1 4005 C CD2 . PHE C 140 ? 0.3032 0.4207 0.5702 -0.0026 -0.0646 -0.0508 118 PHE F CD2 4006 C CE1 . PHE C 140 ? 0.3259 0.4265 0.5864 0.0288 -0.0944 -0.0251 118 PHE F CE1 4007 C CE2 . PHE C 140 ? 0.3395 0.4649 0.6346 0.0108 -0.0683 -0.0574 118 PHE F CE2 4008 C CZ . PHE C 140 ? 0.3167 0.4314 0.6072 0.0277 -0.0846 -0.0431 118 PHE F CZ 4009 N N . ALA C 141 ? 0.2374 0.2959 0.4136 -0.0041 -0.0835 0.0048 119 ALA F N 4010 C CA . ALA C 141 ? 0.2328 0.2864 0.4052 0.0009 -0.0890 0.0129 119 ALA F CA 4011 C C . ALA C 141 ? 0.2774 0.3348 0.4559 0.0097 -0.0942 0.0149 119 ALA F C 4012 O O . ALA C 141 ? 0.2687 0.3314 0.4488 0.0110 -0.0964 0.0140 119 ALA F O 4013 C CB . ALA C 141 ? 0.2445 0.2918 0.4079 -0.0008 -0.0929 0.0203 119 ALA F CB 4014 N N . SER C 142 ? 0.2406 0.2905 0.4169 0.0137 -0.0956 0.0174 120 SER F N 4015 C CA . SER C 142 ? 0.2487 0.2909 0.4185 0.0204 -0.1017 0.0216 120 SER F CA 4016 C C . SER C 142 ? 0.3050 0.3344 0.4590 0.0154 -0.0982 0.0270 120 SER F C 4017 O O . SER C 142 ? 0.2991 0.3241 0.4520 0.0104 -0.0928 0.0266 120 SER F O 4018 C CB . SER C 142 ? 0.3072 0.3419 0.4827 0.0296 -0.1060 0.0201 120 SER F CB 4019 O OG . SER C 142 ? 0.4124 0.4649 0.6119 0.0339 -0.1074 0.0102 120 SER F OG 4020 N N . ALA C 143 ? 0.2733 0.2978 0.4152 0.0139 -0.0996 0.0294 121 ALA F N 4021 C CA . ALA C 143 ? 0.2853 0.2977 0.4126 0.0054 -0.0916 0.0303 121 ALA F CA 4022 C C . ALA C 143 ? 0.3725 0.3558 0.4701 0.0052 -0.0939 0.0362 121 ALA F C 4023 O O . ALA C 143 ? 0.3853 0.3590 0.4661 0.0094 -0.1040 0.0405 121 ALA F O 4024 C CB . ALA C 143 ? 0.2915 0.3110 0.4195 0.0003 -0.0873 0.0267 121 ALA F CB 4025 N N . TYR C 144 ? 0.3480 0.3146 0.4365 -0.0001 -0.0860 0.0366 122 TYR F N 4026 C CA . TYR C 144 ? 0.3919 0.3195 0.4453 -0.0014 -0.0863 0.0436 122 TYR F CA 4027 C C . TYR C 144 ? 0.4783 0.3848 0.5058 -0.0202 -0.0691 0.0405 122 TYR F C 4028 O O . TYR C 144 ? 0.4508 0.3786 0.5002 -0.0304 -0.0561 0.0301 122 TYR F O 4029 C CB . TYR C 144 ? 0.4110 0.3268 0.4703 0.0057 -0.0870 0.0447 122 TYR F CB 4030 C CG . TYR C 144 ? 0.4174 0.3461 0.5000 0.0232 -0.1008 0.0451 122 TYR F CG 4031 C CD1 . TYR C 144 ? 0.4701 0.3815 0.5423 0.0378 -0.1175 0.0522 122 TYR F CD1 4032 C CD2 . TYR C 144 ? 0.3933 0.3491 0.5075 0.0242 -0.0968 0.0368 122 TYR F CD2 4033 C CE1 . TYR C 144 ? 0.4687 0.3979 0.5732 0.0542 -0.1288 0.0477 122 TYR F CE1 4034 C CE2 . TYR C 144 ? 0.3968 0.3646 0.5349 0.0366 -0.1039 0.0323 122 TYR F CE2 4035 C CZ . TYR C 144 ? 0.5104 0.4687 0.6493 0.0522 -0.1191 0.0362 122 TYR F CZ 4036 O OH . TYR C 144 ? 0.5099 0.4872 0.6833 0.0646 -0.1250 0.0272 122 TYR F OH 4037 N N . ARG C 145 ? 0.4966 0.3590 0.4765 -0.0251 -0.0697 0.0486 123 ARG F N 4038 C CA . ARG C 145 ? 0.5407 0.3710 0.4840 -0.0474 -0.0496 0.0449 123 ARG F CA 4039 C C . ARG C 145 ? 0.6348 0.4257 0.5547 -0.0487 -0.0452 0.0500 123 ARG F C 4040 O O . ARG C 145 ? 0.6719 0.4231 0.5595 -0.0368 -0.0600 0.0641 123 ARG F O 4041 C CB . ARG C 145 ? 0.5978 0.3949 0.4898 -0.0567 -0.0517 0.0511 123 ARG F CB 4042 C CG . ARG C 145 ? 0.7245 0.5536 0.6349 -0.0658 -0.0432 0.0396 123 ARG F CG 4043 C CD . ARG C 145 ? 0.9378 0.7282 0.7895 -0.0860 -0.0343 0.0402 123 ARG F CD 4044 N NE . ARG C 145 ? 1.0437 0.8599 0.9175 -0.1034 -0.0107 0.0210 123 ARG F NE 4045 C CZ . ARG C 145 ? 1.2324 1.0533 1.0957 -0.1100 -0.0095 0.0164 123 ARG F CZ 4046 N NH1 . ARG C 145 ? 1.0901 0.8935 0.9177 -0.1024 -0.0327 0.0300 123 ARG F NH1 4047 N NH2 . ARG C 145 ? 1.0556 0.8993 0.9463 -0.1245 0.0149 -0.0037 123 ARG F NH2 4048 N N . ALA C 146 ? 0.5830 0.3869 0.5235 -0.0614 -0.0269 0.0377 124 ALA F N 4049 C CA . ALA C 146 ? 0.6174 0.3860 0.5390 -0.0665 -0.0179 0.0386 124 ALA F CA 4050 C C . ALA C 146 ? 0.7391 0.4591 0.6094 -0.0933 0.0053 0.0352 124 ALA F C 4051 O O . ALA C 146 ? 0.7272 0.4678 0.6075 -0.1145 0.0249 0.0195 124 ALA F O 4052 C CB . ALA C 146 ? 0.5813 0.3912 0.5503 -0.0688 -0.0114 0.0253 124 ALA F CB 4053 N N . HIS C 147 ? 0.7700 0.4229 0.5852 -0.0926 0.0040 0.0487 125 HIS F N 4054 C CA . HIS C 147 ? 0.8456 0.4388 0.5991 -0.1214 0.0284 0.0466 125 HIS F CA 4055 C C . HIS C 147 ? 0.9395 0.4877 0.6715 -0.1299 0.0434 0.0454 125 HIS F C 4056 O O . HIS C 147 ? 0.8888 0.4790 0.6703 -0.1318 0.0515 0.0308 125 HIS F O 4057 C CB . HIS C 147 ? 0.9220 0.4627 0.6067 -0.1267 0.0213 0.0613 125 HIS F CB 4058 C CG . HIS C 147 ? 0.9571 0.5020 0.6422 -0.0957 -0.0158 0.0801 125 HIS F CG 4059 N ND1 . HIS C 147 ? 0.9178 0.5230 0.6464 -0.0861 -0.0279 0.0752 125 HIS F ND1 4060 C CD2 . HIS C 147 ? 1.0312 0.5262 0.6789 -0.0738 -0.0427 0.1018 125 HIS F CD2 4061 C CE1 . HIS C 147 ? 0.9227 0.5175 0.6408 -0.0612 -0.0601 0.0920 125 HIS F CE1 4062 N NE2 . HIS C 147 ? 0.9937 0.5256 0.6669 -0.0513 -0.0720 0.1083 125 HIS F NE2 4063 N N . THR C 148 ? 0.9880 0.4494 0.6447 -0.1360 0.0468 0.0602 126 THR F N 4064 C CA . THR C 148 ? 1.0368 0.4450 0.6673 -0.1448 0.0634 0.0592 126 THR F CA 4065 C C . THR C 148 ? 1.0403 0.4710 0.7202 -0.1156 0.0471 0.0616 126 THR F C 4066 O O . THR C 148 ? 1.0003 0.4562 0.7092 -0.0837 0.0172 0.0730 126 THR F O 4067 C CB . THR C 148 ? 1.2736 0.5742 0.8052 -0.1560 0.0684 0.0774 126 THR F CB 4068 O OG1 . THR C 148 ? 1.3292 0.5780 0.8351 -0.1725 0.0933 0.0714 126 THR F OG1 4069 C CG2 . THR C 148 ? 1.2993 0.5571 0.7998 -0.1197 0.0280 0.1070 126 THR F CG2 4070 N N . ALA C 149 ? 0.6548 0.4711 0.5713 -0.1028 0.0303 -0.0410 127 ALA F N 4071 C CA . ALA C 149 ? 0.6187 0.4585 0.5535 -0.0955 0.0127 -0.0298 127 ALA F CA 4072 C C . ALA C 149 ? 0.6403 0.5023 0.5775 -0.0978 0.0002 -0.0232 127 ALA F C 4073 O O . ALA C 149 ? 0.6312 0.5000 0.5731 -0.0959 0.0049 -0.0253 127 ALA F O 4074 C CB . ALA C 149 ? 0.6099 0.4602 0.5781 -0.0780 0.0146 -0.0270 127 ALA F CB 4075 N N . SER C 150 ? 0.5780 0.4512 0.5136 -0.1019 -0.0152 -0.0151 128 SER F N 4076 C CA . SER C 150 ? 0.5527 0.4465 0.4947 -0.1032 -0.0274 -0.0081 128 SER F CA 4077 C C . SER C 150 ? 0.5651 0.4811 0.5359 -0.0890 -0.0324 -0.0030 128 SER F C 4078 O O . SER C 150 ? 0.5518 0.4719 0.5309 -0.0853 -0.0368 0.0004 128 SER F O 4079 C CB . SER C 150 ? 0.6044 0.4981 0.5319 -0.1163 -0.0401 -0.0020 128 SER F CB 4080 O OG . SER C 150 ? 0.7180 0.6131 0.6505 -0.1147 -0.0449 0.0012 128 SER F OG 4081 N N . ALA C 151 ? 0.5024 0.4309 0.4859 -0.0825 -0.0310 -0.0027 129 ALA F N 4082 C CA . ALA C 151 ? 0.4724 0.4198 0.4794 -0.0713 -0.0350 0.0017 129 ALA F CA 4083 C C . ALA C 151 ? 0.5001 0.4634 0.5123 -0.0732 -0.0462 0.0076 129 ALA F C 4084 O O . ALA C 151 ? 0.4972 0.4617 0.5018 -0.0797 -0.0502 0.0089 129 ALA F O 4085 C CB . ALA C 151 ? 0.4762 0.4283 0.4946 -0.0641 -0.0275 -0.0009 129 ALA F CB 4086 N N . SER C 152 ? 0.4382 0.4128 0.4638 -0.0681 -0.0509 0.0114 130 SER F N 4087 C CA . SER C 152 ? 0.4208 0.4105 0.4558 -0.0685 -0.0586 0.0159 130 SER F CA 4088 C C . SER C 152 ? 0.4537 0.4546 0.5035 -0.0609 -0.0582 0.0172 130 SER F C 4089 O O . SER C 152 ? 0.4480 0.4454 0.4999 -0.0577 -0.0558 0.0171 130 SER F O 4090 C CB . SER C 152 ? 0.4715 0.4607 0.5024 -0.0755 -0.0644 0.0189 130 SER F CB 4091 O OG . SER C 152 ? 0.5938 0.5779 0.6232 -0.0748 -0.0627 0.0184 130 SER F OG 4092 N N . ALA C 153 ? 0.3982 0.4113 0.4575 -0.0592 -0.0608 0.0189 131 ALA F N 4093 C CA . ALA C 153 ? 0.3843 0.4060 0.4533 -0.0547 -0.0599 0.0196 131 ALA F CA 4094 C C . ALA C 153 ? 0.4231 0.4549 0.5006 -0.0560 -0.0618 0.0206 131 ALA F C 4095 O O . ALA C 153 ? 0.4167 0.4523 0.4989 -0.0575 -0.0643 0.0216 131 ALA F O 4096 C CB . ALA C 153 ? 0.3898 0.4137 0.4618 -0.0505 -0.0575 0.0189 131 ALA F CB 4097 N N . LYS C 154 ? 0.3757 0.4110 0.4558 -0.0561 -0.0602 0.0206 132 LYS F N 4098 C CA . LYS C 154 ? 0.3695 0.4127 0.4572 -0.0579 -0.0582 0.0197 132 LYS F CA 4099 C C . LYS C 154 ? 0.4168 0.4618 0.5046 -0.0562 -0.0556 0.0186 132 LYS F C 4100 O O . LYS C 154 ? 0.4128 0.4548 0.4945 -0.0572 -0.0561 0.0199 132 LYS F O 4101 C CB . LYS C 154 ? 0.4062 0.4492 0.4911 -0.0628 -0.0574 0.0199 132 LYS F CB 4102 C CG . LYS C 154 ? 0.5842 0.6355 0.6787 -0.0658 -0.0530 0.0178 132 LYS F CG 4103 C CD . LYS C 154 ? 0.7186 0.7690 0.8077 -0.0723 -0.0516 0.0178 132 LYS F CD 4104 C CE . LYS C 154 ? 0.8612 0.9200 0.9609 -0.0760 -0.0446 0.0146 132 LYS F CE 4105 N NZ . LYS C 154 ? 0.9890 1.0469 1.0815 -0.0840 -0.0429 0.0145 132 LYS F NZ 4106 N N . LEU C 155 ? 0.3717 0.4209 0.4668 -0.0543 -0.0540 0.0171 133 LEU F N 4107 C CA . LEU C 155 ? 0.3700 0.4194 0.4633 -0.0538 -0.0516 0.0158 133 LEU F CA 4108 C C . LEU C 155 ? 0.4262 0.4779 0.5251 -0.0560 -0.0454 0.0120 133 LEU F C 4109 O O . LEU C 155 ? 0.4200 0.4753 0.5317 -0.0540 -0.0438 0.0110 133 LEU F O 4110 C CB . LEU C 155 ? 0.3672 0.4159 0.4614 -0.0500 -0.0541 0.0168 133 LEU F CB 4111 C CG . LEU C 155 ? 0.4272 0.4758 0.5184 -0.0499 -0.0530 0.0165 133 LEU F CG 4112 C CD1 . LEU C 155 ? 0.4311 0.4787 0.5165 -0.0505 -0.0550 0.0193 133 LEU F CD1 4113 C CD2 . LEU C 155 ? 0.4555 0.5040 0.5496 -0.0473 -0.0547 0.0168 133 LEU F CD2 4114 N N . ARG C 156 ? 0.3907 0.4396 0.4803 -0.0609 -0.0419 0.0103 134 ARG F N 4115 C CA . ARG C 156 ? 0.3958 0.4434 0.4862 -0.0649 -0.0333 0.0050 134 ARG F CA 4116 C C . ARG C 156 ? 0.4486 0.4931 0.5375 -0.0634 -0.0326 0.0039 134 ARG F C 4117 O O . ARG C 156 ? 0.4445 0.4870 0.5232 -0.0649 -0.0373 0.0071 134 ARG F O 4118 C CB . ARG C 156 ? 0.4102 0.4534 0.4854 -0.0749 -0.0300 0.0037 134 ARG F CB 4119 C CG . ARG C 156 ? 0.5450 0.5836 0.6163 -0.0816 -0.0184 -0.0035 134 ARG F CG 4120 C CD . ARG C 156 ? 0.6860 0.7175 0.7356 -0.0950 -0.0163 -0.0042 134 ARG F CD 4121 N NE . ARG C 156 ? 0.8073 0.8346 0.8419 -0.0993 -0.0253 0.0019 134 ARG F NE 4122 C CZ . ARG C 156 ? 0.9999 1.0213 1.0242 -0.1044 -0.0235 0.0005 134 ARG F CZ 4123 N NH1 . ARG C 156 ? 0.8511 0.8679 0.8773 -0.1051 -0.0119 -0.0079 134 ARG F NH1 4124 N NH2 . ARG C 156 ? 0.8352 0.8550 0.8489 -0.1088 -0.0333 0.0078 134 ARG F NH2 4125 N N . VAL C 157 ? 0.4085 0.4529 0.5098 -0.0602 -0.0270 0.0002 135 VAL F N 4126 C CA . VAL C 157 ? 0.4103 0.4501 0.5105 -0.0589 -0.0259 -0.0011 135 VAL F CA 4127 C C . VAL C 157 ? 0.4765 0.5096 0.5774 -0.0629 -0.0137 -0.0086 135 VAL F C 4128 O O . VAL C 157 ? 0.4701 0.5054 0.5878 -0.0605 -0.0063 -0.0123 135 VAL F O 4129 C CB . VAL C 157 ? 0.4507 0.4933 0.5646 -0.0512 -0.0321 0.0025 135 VAL F CB 4130 C CG1 . VAL C 157 ? 0.4519 0.4888 0.5616 -0.0510 -0.0323 0.0019 135 VAL F CG1 4131 C CG2 . VAL C 157 ? 0.4400 0.4870 0.5512 -0.0490 -0.0414 0.0081 135 VAL F CG2 4132 N N . LEU C 158 ? 0.4500 0.4745 0.5333 -0.0698 -0.0109 -0.0109 136 LEU F N 4133 C CA . LEU C 158 ? 0.4668 0.4809 0.5460 -0.0754 0.0023 -0.0194 136 LEU F CA 4134 C C . LEU C 158 ? 0.5169 0.5279 0.6109 -0.0676 0.0030 -0.0202 136 LEU F C 4135 O O . LEU C 158 ? 0.5127 0.5190 0.5963 -0.0688 -0.0021 -0.0179 136 LEU F O 4136 C CB . LEU C 158 ? 0.4842 0.4886 0.5344 -0.0887 0.0030 -0.0203 136 LEU F CB 4137 C CG . LEU C 158 ? 0.5688 0.5601 0.6057 -0.1000 0.0186 -0.0302 136 LEU F CG 4138 C CD1 . LEU C 158 ? 0.5850 0.5737 0.5995 -0.1137 0.0184 -0.0294 136 LEU F CD1 4139 C CD2 . LEU C 158 ? 0.6148 0.5926 0.6374 -0.1058 0.0228 -0.0338 136 LEU F CD2 4140 N N . TYR C 159 ? 0.4722 0.4871 0.5927 -0.0597 0.0076 -0.0218 137 TYR F N 4141 C CA . TYR C 159 ? 0.4693 0.4821 0.6096 -0.0515 0.0064 -0.0206 137 TYR F CA 4142 C C . TYR C 159 ? 0.5333 0.5377 0.6900 -0.0504 0.0228 -0.0293 137 TYR F C 4143 O O . TYR C 159 ? 0.5284 0.5385 0.7042 -0.0483 0.0311 -0.0324 137 TYR F O 4144 C CB . TYR C 159 ? 0.4689 0.4938 0.6298 -0.0433 -0.0055 -0.0120 137 TYR F CB 4145 C CG . TYR C 159 ? 0.4915 0.5146 0.6714 -0.0363 -0.0113 -0.0075 137 TYR F CG 4146 C CD1 . TYR C 159 ? 0.5149 0.5341 0.6822 -0.0367 -0.0211 -0.0029 137 TYR F CD1 4147 C CD2 . TYR C 159 ? 0.5029 0.5293 0.7154 -0.0299 -0.0083 -0.0065 137 TYR F CD2 4148 C CE1 . TYR C 159 ? 0.5269 0.5432 0.7094 -0.0320 -0.0279 0.0023 137 TYR F CE1 4149 C CE2 . TYR C 159 ? 0.5151 0.5393 0.7466 -0.0242 -0.0161 -0.0003 137 TYR F CE2 4150 C CZ . TYR C 159 ? 0.6095 0.6278 0.8239 -0.0259 -0.0262 0.0041 137 TYR F CZ 4151 O OH . TYR C 159 ? 0.6252 0.6399 0.8560 -0.0219 -0.0350 0.0111 137 TYR F OH 4152 N N . GLN C 160 ? 0.5035 0.4938 0.6533 -0.0520 0.0283 -0.0336 138 GLN F N 4153 C CA . GLN C 160 ? 0.5201 0.4977 0.6835 -0.0512 0.0458 -0.0433 138 GLN F CA 4154 C C . GLN C 160 ? 0.5885 0.5601 0.7412 -0.0606 0.0644 -0.0545 138 GLN F C 4155 O O . GLN C 160 ? 0.5907 0.5612 0.7681 -0.0571 0.0799 -0.0616 138 GLN F O 4156 C CB . GLN C 160 ? 0.5302 0.5136 0.7364 -0.0381 0.0449 -0.0395 138 GLN F CB 4157 C CG . GLN C 160 ? 0.6921 0.6761 0.9048 -0.0318 0.0280 -0.0293 138 GLN F CG 4158 C CD . GLN C 160 ? 0.9119 0.9015 1.1671 -0.0207 0.0243 -0.0232 138 GLN F CD 4159 O OE1 . GLN C 160 ? 0.8442 0.8483 1.1229 -0.0165 0.0207 -0.0183 138 GLN F OE1 4160 N NE2 . GLN C 160 ? 0.8083 0.7863 1.0746 -0.0165 0.0233 -0.0218 138 GLN F NE2 4161 N N . GLY C 161 ? 0.5533 0.5213 0.6702 -0.0733 0.0625 -0.0554 139 GLY F N 4162 C CA . GLY C 161 ? 0.5719 0.5322 0.6692 -0.0865 0.0774 -0.0647 139 GLY F CA 4163 C C . GLY C 161 ? 0.6137 0.5880 0.7236 -0.0857 0.0792 -0.0641 139 GLY F C 4164 O O . GLY C 161 ? 0.6270 0.5952 0.7229 -0.0971 0.0930 -0.0723 139 GLY F O 4165 N N . ASN C 162 ? 0.5451 0.5370 0.6788 -0.0740 0.0652 -0.0543 140 ASN F N 4166 C CA . ASN C 162 ? 0.5322 0.5384 0.6795 -0.0725 0.0643 -0.0519 140 ASN F CA 4167 C C . ASN C 162 ? 0.5592 0.5765 0.6972 -0.0707 0.0440 -0.0405 140 ASN F C 4168 O O . ASN C 162 ? 0.5418 0.5609 0.6797 -0.0648 0.0307 -0.0333 140 ASN F O 4169 C CB . ASN C 162 ? 0.5373 0.5534 0.7287 -0.0605 0.0697 -0.0519 140 ASN F CB 4170 C CG . ASN C 162 ? 0.8584 0.8647 1.0660 -0.0612 0.0930 -0.0642 140 ASN F CG 4171 O OD1 . ASN C 162 ? 0.8028 0.8086 1.0105 -0.0682 0.1092 -0.0727 140 ASN F OD1 4172 N ND2 . ASN C 162 ? 0.7632 0.7604 0.9850 -0.0542 0.0961 -0.0657 140 ASN F ND2 4173 N N . ASN C 163 ? 0.5125 0.5361 0.6426 -0.0763 0.0428 -0.0393 141 ASN F N 4174 C CA . ASN C 163 ? 0.4937 0.5257 0.6159 -0.0749 0.0260 -0.0296 141 ASN F CA 4175 C C . ASN C 163 ? 0.5285 0.5740 0.6786 -0.0649 0.0189 -0.0237 141 ASN F C 4176 O O . ASN C 163 ? 0.5247 0.5770 0.6929 -0.0647 0.0264 -0.0261 141 ASN F O 4177 C CB . ASN C 163 ? 0.5075 0.5372 0.6056 -0.0869 0.0265 -0.0300 141 ASN F CB 4178 C CG . ASN C 163 ? 0.8033 0.8219 0.8698 -0.0977 0.0232 -0.0294 141 ASN F CG 4179 O OD1 . ASN C 163 ? 0.7269 0.7445 0.7873 -0.0945 0.0127 -0.0238 141 ASN F OD1 4180 N ND2 . ASN C 163 ? 0.7210 0.7312 0.7665 -0.1120 0.0318 -0.0344 141 ASN F ND2 4181 N N . ILE C 164 ? 0.4722 0.5212 0.6252 -0.0581 0.0047 -0.0157 142 ILE F N 4182 C CA . ILE C 164 ? 0.4574 0.5168 0.6311 -0.0513 -0.0047 -0.0086 142 ILE F CA 4183 C C . ILE C 164 ? 0.5014 0.5631 0.6591 -0.0531 -0.0166 -0.0025 142 ILE F C 4184 O O . ILE C 164 ? 0.4961 0.5522 0.6333 -0.0551 -0.0212 -0.0013 142 ILE F O 4185 C CB . ILE C 164 ? 0.4918 0.5518 0.6853 -0.0433 -0.0101 -0.0046 142 ILE F CB 4186 C CG1 . ILE C 164 ? 0.4949 0.5477 0.6699 -0.0428 -0.0180 -0.0021 142 ILE F CG1 4187 C CG2 . ILE C 164 ? 0.5101 0.5685 0.7279 -0.0400 0.0029 -0.0103 142 ILE F CG2 4188 C CD1 . ILE C 164 ? 0.5751 0.6293 0.7622 -0.0374 -0.0292 0.0052 142 ILE F CD1 4189 N N . THR C 165 ? 0.4561 0.5255 0.6240 -0.0527 -0.0209 0.0013 143 THR F N 4190 C CA . THR C 165 ? 0.4508 0.5201 0.6043 -0.0547 -0.0305 0.0062 143 THR F CA 4191 C C . THR C 165 ? 0.4933 0.5651 0.6545 -0.0510 -0.0415 0.0130 143 THR F C 4192 O O . THR C 165 ? 0.4862 0.5647 0.6685 -0.0493 -0.0437 0.0163 143 THR F O 4193 C CB . THR C 165 ? 0.5642 0.6367 0.7151 -0.0605 -0.0271 0.0051 143 THR F CB 4194 O OG1 . THR C 165 ? 0.5744 0.6424 0.7143 -0.0664 -0.0169 -0.0012 143 THR F OG1 4195 C CG2 . THR C 165 ? 0.5495 0.6187 0.6841 -0.0628 -0.0360 0.0095 143 THR F CG2 4196 N N . VAL C 166 ? 0.4482 0.5142 0.5926 -0.0507 -0.0483 0.0154 144 VAL F N 4197 C CA . VAL C 166 ? 0.4446 0.5094 0.5886 -0.0501 -0.0578 0.0209 144 VAL F CA 4198 C C . VAL C 166 ? 0.4965 0.5568 0.6243 -0.0535 -0.0617 0.0224 144 VAL F C 4199 O O . VAL C 166 ? 0.4914 0.5465 0.6052 -0.0534 -0.0597 0.0203 144 VAL F O 4200 C CB . VAL C 166 ? 0.4932 0.5535 0.6328 -0.0474 -0.0602 0.0214 144 VAL F CB 4201 C CG1 . VAL C 166 ? 0.4937 0.5510 0.6287 -0.0496 -0.0694 0.0267 144 VAL F CG1 4202 C CG2 . VAL C 166 ? 0.4909 0.5532 0.6466 -0.0441 -0.0560 0.0198 144 VAL F CG2 4203 N N . THR C 167 ? 0.4562 0.5179 0.5874 -0.0570 -0.0675 0.0265 145 THR F N 4204 C CA . THR C 167 ? 0.4601 0.5149 0.5753 -0.0614 -0.0707 0.0275 145 THR F CA 4205 C C . THR C 167 ? 0.5154 0.5642 0.6227 -0.0648 -0.0779 0.0312 145 THR F C 4206 O O . THR C 167 ? 0.5132 0.5660 0.6306 -0.0682 -0.0848 0.0367 145 THR F O 4207 C CB . THR C 167 ? 0.5668 0.6259 0.6868 -0.0656 -0.0709 0.0288 145 THR F CB 4208 O OG1 . THR C 167 ? 0.5593 0.6229 0.6843 -0.0641 -0.0631 0.0248 145 THR F OG1 4209 C CG2 . THR C 167 ? 0.5579 0.6071 0.6594 -0.0705 -0.0734 0.0292 145 THR F CG2 4210 N N . ALA C 168 ? 0.4758 0.5148 0.5660 -0.0648 -0.0761 0.0286 146 ALA F N 4211 C CA . ALA C 168 ? 0.4832 0.5137 0.5607 -0.0700 -0.0804 0.0304 146 ALA F CA 4212 C C . ALA C 168 ? 0.5393 0.5571 0.5973 -0.0721 -0.0755 0.0261 146 ALA F C 4213 O O . ALA C 168 ? 0.5292 0.5459 0.5871 -0.0668 -0.0692 0.0225 146 ALA F O 4214 C CB . ALA C 168 ? 0.4887 0.5214 0.5705 -0.0672 -0.0811 0.0308 146 ALA F CB 4215 N N . TYR C 169 ? 0.5096 0.5166 0.5514 -0.0807 -0.0782 0.0269 147 TYR F N 4216 C CA . TYR C 169 ? 0.5211 0.5132 0.5441 -0.0837 -0.0710 0.0215 147 TYR F CA 4217 C C . TYR C 169 ? 0.5652 0.5573 0.5885 -0.0785 -0.0644 0.0177 147 TYR F C 4218 O O . TYR C 169 ? 0.5586 0.5541 0.5827 -0.0804 -0.0680 0.0199 147 TYR F O 4219 C CB . TYR C 169 ? 0.5589 0.5376 0.5608 -0.0974 -0.0751 0.0229 147 TYR F CB 4220 C CG . TYR C 169 ? 0.5890 0.5642 0.5862 -0.1041 -0.0800 0.0259 147 TYR F CG 4221 C CD1 . TYR C 169 ? 0.6239 0.5872 0.6102 -0.1045 -0.0730 0.0209 147 TYR F CD1 4222 C CD2 . TYR C 169 ? 0.5977 0.5811 0.6025 -0.1105 -0.0920 0.0343 147 TYR F CD2 4223 C CE1 . TYR C 169 ? 0.6428 0.6021 0.6229 -0.1118 -0.0778 0.0237 147 TYR F CE1 4224 C CE2 . TYR C 169 ? 0.6169 0.5986 0.6183 -0.1177 -0.0971 0.0377 147 TYR F CE2 4225 C CZ . TYR C 169 ? 0.7205 0.6896 0.7076 -0.1189 -0.0899 0.0321 147 TYR F CZ 4226 O OH . TYR C 169 ? 0.7416 0.7081 0.7235 -0.1270 -0.0951 0.0356 147 TYR F OH 4227 N N . ALA C 170 ? 0.5201 0.5090 0.5451 -0.0722 -0.0554 0.0130 148 ALA F N 4228 C CA . ALA C 170 ? 0.5136 0.5045 0.5430 -0.0669 -0.0485 0.0099 148 ALA F CA 4229 C C . ALA C 170 ? 0.5821 0.5598 0.5949 -0.0738 -0.0412 0.0050 148 ALA F C 4230 O O . ALA C 170 ? 0.5826 0.5557 0.5978 -0.0700 -0.0307 0.0001 148 ALA F O 4231 C CB . ALA C 170 ? 0.5148 0.5092 0.5573 -0.0579 -0.0436 0.0090 148 ALA F CB 4232 N N . ASN C 171 ? 0.5502 0.5220 0.5473 -0.0848 -0.0467 0.0068 149 ASN F N 4233 C CA . ASN C 171 ? 0.5715 0.5286 0.5468 -0.0957 -0.0406 0.0023 149 ASN F CA 4234 C C . ASN C 171 ? 0.6228 0.5843 0.5954 -0.0993 -0.0433 0.0041 149 ASN F C 4235 O O . ASN C 171 ? 0.6368 0.5873 0.5922 -0.1080 -0.0359 -0.0007 149 ASN F O 4236 C CB . ASN C 171 ? 0.6016 0.5441 0.5542 -0.1100 -0.0456 0.0035 149 ASN F CB 4237 C CG . ASN C 171 ? 0.8761 0.8262 0.8314 -0.1156 -0.0623 0.0134 149 ASN F CG 4238 O OD1 . ASN C 171 ? 0.7865 0.7510 0.7591 -0.1098 -0.0699 0.0189 149 ASN F OD1 4239 N ND2 . ASN C 171 ? 0.7863 0.7261 0.7257 -0.1275 -0.0682 0.0161 149 ASN F ND2 4240 N N . GLY C 172 ? 0.5612 0.5369 0.5497 -0.0936 -0.0530 0.0103 150 GLY F N 4241 C CA . GLY C 172 ? 0.5578 0.5376 0.5457 -0.0964 -0.0575 0.0133 150 GLY F CA 4242 C C . GLY C 172 ? 0.6231 0.5962 0.5967 -0.1098 -0.0694 0.0197 150 GLY F C 4243 O O . GLY C 172 ? 0.6216 0.5941 0.5900 -0.1151 -0.0738 0.0225 150 GLY F O 4244 N N . ASP C 173 ? 0.5916 0.5593 0.5589 -0.1164 -0.0761 0.0232 151 ASP F N 4245 C CA . ASP C 173 ? 0.6067 0.5684 0.5623 -0.1307 -0.0902 0.0318 151 ASP F CA 4246 C C . ASP C 173 ? 0.6447 0.6148 0.6170 -0.1284 -0.1012 0.0394 151 ASP F C 4247 O O . ASP C 173 ? 0.6578 0.6201 0.6173 -0.1409 -0.1091 0.0442 151 ASP F O 4248 C CB . ASP C 173 ? 0.6638 0.6048 0.5843 -0.1489 -0.0863 0.0281 151 ASP F CB 4249 C CG . ASP C 173 ? 0.8183 0.7512 0.7216 -0.1673 -0.1021 0.0381 151 ASP F CG 4250 O OD1 . ASP C 173 ? 0.8236 0.7604 0.7311 -0.1686 -0.1092 0.0434 151 ASP F OD1 4251 O OD2 . ASP C 173 ? 0.9153 0.8371 0.8006 -0.1814 -0.1085 0.0416 151 ASP F OD2 4252 N N . HIS C 174 ? 0.5721 0.5580 0.5726 -0.1135 -0.1010 0.0402 152 HIS F N 4253 C CA . HIS C 174 ? 0.5570 0.5535 0.5784 -0.1096 -0.1084 0.0462 152 HIS F CA 4254 C C . HIS C 174 ? 0.5819 0.5929 0.6315 -0.0974 -0.1096 0.0483 152 HIS F C 4255 O O . HIS C 174 ? 0.5610 0.5783 0.6202 -0.0864 -0.1002 0.0422 152 HIS F O 4256 C CB . HIS C 174 ? 0.5628 0.5586 0.5827 -0.1059 -0.1006 0.0407 152 HIS F CB 4257 C CG . HIS C 174 ? 0.5988 0.6041 0.6357 -0.1055 -0.1079 0.0467 152 HIS F CG 4258 N ND1 . HIS C 174 ? 0.6004 0.6198 0.6623 -0.0939 -0.1048 0.0460 152 HIS F ND1 4259 C CD2 . HIS C 174 ? 0.6339 0.6362 0.6655 -0.1168 -0.1175 0.0534 152 HIS F CD2 4260 C CE1 . HIS C 174 ? 0.5932 0.6188 0.6663 -0.0974 -0.1115 0.0518 152 HIS F CE1 4261 N NE2 . HIS C 174 ? 0.6166 0.6331 0.6732 -0.1109 -0.1201 0.0571 152 HIS F NE2 4262 N N . ALA C 175 ? 0.5376 0.5522 0.5994 -0.1006 -0.1213 0.0574 153 ALA F N 4263 C CA . ALA C 175 ? 0.5188 0.5439 0.6075 -0.0901 -0.1221 0.0595 153 ALA F CA 4264 C C . ALA C 175 ? 0.5532 0.5906 0.6698 -0.0837 -0.1229 0.0622 153 ALA F C 4265 O O . ALA C 175 ? 0.5548 0.5949 0.6789 -0.0902 -0.1325 0.0701 153 ALA F O 4266 C CB . ALA C 175 ? 0.5379 0.5597 0.6294 -0.0961 -0.1340 0.0683 153 ALA F CB 4267 N N . VAL C 176 ? 0.4920 0.5365 0.6226 -0.0724 -0.1123 0.0555 154 VAL F N 4268 C CA . VAL C 176 ? 0.4789 0.5347 0.6354 -0.0662 -0.1090 0.0556 154 VAL F CA 4269 C C . VAL C 176 ? 0.5167 0.5768 0.6951 -0.0576 -0.1049 0.0544 154 VAL F C 4270 O O . VAL C 176 ? 0.5081 0.5642 0.6771 -0.0534 -0.0971 0.0477 154 VAL F O 4271 C CB . VAL C 176 ? 0.5233 0.5806 0.6714 -0.0637 -0.0986 0.0478 154 VAL F CB 4272 C CG1 . VAL C 176 ? 0.5131 0.5815 0.6861 -0.0584 -0.0929 0.0464 154 VAL F CG1 4273 C CG2 . VAL C 176 ? 0.5305 0.5818 0.6594 -0.0723 -0.1027 0.0493 154 VAL F CG2 4274 N N . THR C 177 ? 0.4695 0.5369 0.6781 -0.0556 -0.1104 0.0615 155 THR F N 4275 C CA . THR C 177 ? 0.4624 0.5319 0.6954 -0.0475 -0.1059 0.0606 155 THR F CA 4276 C C . THR C 177 ? 0.4987 0.5772 0.7557 -0.0407 -0.0932 0.0547 155 THR F C 4277 O O . THR C 177 ? 0.4931 0.5815 0.7718 -0.0414 -0.0957 0.0595 155 THR F O 4278 C CB . THR C 177 ? 0.5784 0.6472 0.8300 -0.0498 -0.1204 0.0728 155 THR F CB 4279 O OG1 . THR C 177 ? 0.5883 0.6472 0.8110 -0.0592 -0.1309 0.0771 155 THR F OG1 4280 C CG2 . THR C 177 ? 0.5621 0.6288 0.8362 -0.0413 -0.1157 0.0716 155 THR F CG2 4281 N N . VAL C 178 ? 0.4468 0.5214 0.6980 -0.0357 -0.0795 0.0444 156 VAL F N 4282 C CA . VAL C 178 ? 0.4401 0.5194 0.7075 -0.0312 -0.0644 0.0364 156 VAL F CA 4283 C C . VAL C 178 ? 0.4886 0.5613 0.7675 -0.0256 -0.0562 0.0318 156 VAL F C 4284 O O . VAL C 178 ? 0.4830 0.5460 0.7394 -0.0264 -0.0554 0.0283 156 VAL F O 4285 C CB . VAL C 178 ? 0.4861 0.5641 0.7279 -0.0345 -0.0552 0.0278 156 VAL F CB 4286 C CG1 . VAL C 178 ? 0.4859 0.5667 0.7401 -0.0328 -0.0391 0.0192 156 VAL F CG1 4287 C CG2 . VAL C 178 ? 0.4814 0.5635 0.7120 -0.0399 -0.0629 0.0321 156 VAL F CG2 4288 N N . LYS C 179 ? 0.4469 0.5244 0.7622 -0.0202 -0.0498 0.0320 157 LYS F N 4289 C CA . LYS C 179 ? 0.4513 0.5209 0.7832 -0.0143 -0.0403 0.0274 157 LYS F CA 4290 C C . LYS C 179 ? 0.5004 0.5607 0.8265 -0.0137 -0.0527 0.0342 157 LYS F C 4291 O O . LYS C 179 ? 0.5003 0.5487 0.8140 -0.0127 -0.0462 0.0281 157 LYS F O 4292 C CB . LYS C 179 ? 0.4889 0.5502 0.8018 -0.0156 -0.0211 0.0128 157 LYS F CB 4293 C CG . LYS C 179 ? 0.6779 0.7420 1.0187 -0.0124 -0.0025 0.0047 157 LYS F CG 4294 C CD . LYS C 179 ? 0.8007 0.8750 1.1378 -0.0171 0.0037 0.0013 157 LYS F CD 4295 C CE . LYS C 179 ? 0.9443 1.0213 1.3082 -0.0153 0.0244 -0.0078 157 LYS F CE 4296 N NZ . LYS C 179 ? 1.0548 1.1416 1.4133 -0.0214 0.0300 -0.0108 157 LYS F NZ 4297 N N . ASP C 180 ? 0.4539 0.5187 0.7865 -0.0163 -0.0713 0.0474 158 ASP F N 4298 C CA . ASP C 180 ? 0.4561 0.5130 0.7820 -0.0187 -0.0864 0.0565 158 ASP F CA 4299 C C . ASP C 180 ? 0.4996 0.5476 0.7816 -0.0249 -0.0892 0.0530 158 ASP F C 4300 O O . ASP C 180 ? 0.5009 0.5420 0.7733 -0.0287 -0.1008 0.0597 158 ASP F O 4301 C CB . ASP C 180 ? 0.4888 0.5391 0.8452 -0.0117 -0.0851 0.0590 158 ASP F CB 4302 C CG . ASP C 180 ? 0.6266 0.6751 0.9973 -0.0143 -0.1059 0.0750 158 ASP F CG 4303 O OD1 . ASP C 180 ? 0.6422 0.6785 1.0058 -0.0145 -0.1102 0.0769 158 ASP F OD1 4304 O OD2 . ASP C 180 ? 0.7014 0.7603 1.0899 -0.0175 -0.1187 0.0865 158 ASP F OD2 4305 N N . ALA C 181 ? 0.4446 0.4933 0.7017 -0.0267 -0.0791 0.0434 159 ALA F N 4306 C CA . ALA C 181 ? 0.4385 0.4813 0.6597 -0.0317 -0.0802 0.0401 159 ALA F CA 4307 C C . ALA C 181 ? 0.4781 0.5250 0.6830 -0.0379 -0.0886 0.0444 159 ALA F C 4308 O O . ALA C 181 ? 0.4672 0.5207 0.6738 -0.0382 -0.0851 0.0424 159 ALA F O 4309 C CB . ALA C 181 ? 0.4453 0.4858 0.6515 -0.0307 -0.0658 0.0290 159 ALA F CB 4310 N N . LYS C 182 ? 0.4358 0.4772 0.6239 -0.0441 -0.0991 0.0499 160 LYS F N 4311 C CA . LYS C 182 ? 0.4340 0.4753 0.6031 -0.0518 -0.1058 0.0530 160 LYS F CA 4312 C C . LYS C 182 ? 0.4751 0.5143 0.6186 -0.0527 -0.0971 0.0448 160 LYS F C 4313 O O . LYS C 182 ? 0.4682 0.5032 0.5997 -0.0525 -0.0938 0.0414 160 LYS F O 4314 C CB . LYS C 182 ? 0.4783 0.5128 0.6393 -0.0603 -0.1198 0.0623 160 LYS F CB 4315 C CG . LYS C 182 ? 0.6671 0.6991 0.8092 -0.0709 -0.1272 0.0664 160 LYS F CG 4316 C CD . LYS C 182 ? 0.8121 0.8353 0.9422 -0.0824 -0.1412 0.0757 160 LYS F CD 4317 C CE . LYS C 182 ? 0.9568 0.9707 1.0560 -0.0885 -0.1371 0.0705 160 LYS F CE 4318 N NZ . LYS C 182 ? 1.0942 1.0982 1.1798 -0.1016 -0.1507 0.0797 160 LYS F NZ 4319 N N . PHE C 183 ? 0.4278 0.4703 0.5651 -0.0539 -0.0941 0.0424 161 PHE F N 4320 C CA . PHE C 183 ? 0.4213 0.4623 0.5398 -0.0539 -0.0865 0.0358 161 PHE F CA 4321 C C . PHE C 183 ? 0.4766 0.5119 0.5761 -0.0611 -0.0897 0.0369 161 PHE F C 4322 O O . PHE C 183 ? 0.4756 0.5105 0.5756 -0.0658 -0.0952 0.0408 161 PHE F O 4323 C CB . PHE C 183 ? 0.4364 0.4829 0.5616 -0.0497 -0.0788 0.0313 161 PHE F CB 4324 C CG . PHE C 183 ? 0.4519 0.5008 0.5874 -0.0447 -0.0714 0.0271 161 PHE F CG 4325 C CD1 . PHE C 183 ? 0.4896 0.5369 0.6136 -0.0439 -0.0650 0.0222 161 PHE F CD1 4326 C CD2 . PHE C 183 ? 0.4793 0.5315 0.6365 -0.0417 -0.0703 0.0281 161 PHE F CD2 4327 C CE1 . PHE C 183 ? 0.5016 0.5486 0.6303 -0.0422 -0.0580 0.0181 161 PHE F CE1 4328 C CE2 . PHE C 183 ? 0.5154 0.5667 0.6793 -0.0386 -0.0609 0.0225 161 PHE F CE2 4329 C CZ . PHE C 183 ? 0.4918 0.5395 0.6386 -0.0398 -0.0549 0.0173 161 PHE F CZ 4330 N N . ILE C 184 ? 0.4372 0.4678 0.5203 -0.0627 -0.0853 0.0332 162 ILE F N 4331 C CA . ILE C 184 ? 0.4470 0.4701 0.5109 -0.0694 -0.0839 0.0316 162 ILE F CA 4332 C C . ILE C 184 ? 0.4928 0.5173 0.5534 -0.0643 -0.0737 0.0253 162 ILE F C 4333 O O . ILE C 184 ? 0.4825 0.5098 0.5443 -0.0609 -0.0695 0.0232 162 ILE F O 4334 C CB . ILE C 184 ? 0.5004 0.5156 0.5494 -0.0782 -0.0882 0.0339 162 ILE F CB 4335 C CG1 . ILE C 184 ? 0.5141 0.5271 0.5672 -0.0850 -0.1014 0.0429 162 ILE F CG1 4336 C CG2 . ILE C 184 ? 0.5242 0.5300 0.5516 -0.0854 -0.0818 0.0293 162 ILE F CG2 4337 C CD1 . ILE C 184 ? 0.6224 0.6291 0.6663 -0.0925 -0.1082 0.0472 162 ILE F CD1 4338 N N . VAL C 185 ? 0.4533 0.4760 0.5117 -0.0640 -0.0708 0.0234 163 VAL F N 4339 C CA . VAL C 185 ? 0.4485 0.4718 0.5073 -0.0590 -0.0629 0.0192 163 VAL F CA 4340 C C . VAL C 185 ? 0.5138 0.5272 0.5590 -0.0630 -0.0567 0.0155 163 VAL F C 4341 O O . VAL C 185 ? 0.5227 0.5270 0.5553 -0.0705 -0.0583 0.0154 163 VAL F O 4342 C CB . VAL C 185 ? 0.4923 0.5190 0.5587 -0.0560 -0.0633 0.0197 163 VAL F CB 4343 C CG1 . VAL C 185 ? 0.4904 0.5149 0.5562 -0.0526 -0.0574 0.0172 163 VAL F CG1 4344 C CG2 . VAL C 185 ? 0.4794 0.5149 0.5590 -0.0523 -0.0651 0.0212 163 VAL F CG2 4345 N N . GLY C 186 ? 0.4685 0.4836 0.5172 -0.0588 -0.0493 0.0126 164 GLY F N 4346 C CA . GLY C 186 ? 0.4793 0.4857 0.5204 -0.0609 -0.0399 0.0077 164 GLY F CA 4347 C C . GLY C 186 ? 0.5403 0.5417 0.5692 -0.0680 -0.0366 0.0055 164 GLY F C 4348 O O . GLY C 186 ? 0.5301 0.5366 0.5589 -0.0699 -0.0426 0.0086 164 GLY F O 4349 N N . PRO C 187 ? 0.5144 0.5046 0.5320 -0.0730 -0.0262 -0.0005 165 PRO F N 4350 C CA . PRO C 187 ? 0.5220 0.5024 0.5387 -0.0714 -0.0170 -0.0054 165 PRO F CA 4351 C C . PRO C 187 ? 0.5596 0.5480 0.5996 -0.0596 -0.0103 -0.0059 165 PRO F C 4352 O O . PRO C 187 ? 0.5461 0.5453 0.5994 -0.0553 -0.0083 -0.0046 165 PRO F O 4353 C CB . PRO C 187 ? 0.5702 0.5348 0.5654 -0.0827 -0.0067 -0.0123 165 PRO F CB 4354 C CG . PRO C 187 ? 0.6244 0.5959 0.6190 -0.0856 -0.0062 -0.0118 165 PRO F CG 4355 C CD . PRO C 187 ? 0.5485 0.5326 0.5511 -0.0823 -0.0216 -0.0034 165 PRO F CD 4356 N N . MET C 188 ? 0.5153 0.4980 0.5606 -0.0553 -0.0081 -0.0066 166 MET F N 4357 C CA . MET C 188 ? 0.5043 0.4925 0.5730 -0.0449 -0.0041 -0.0050 166 MET F CA 4358 C C . MET C 188 ? 0.5532 0.5410 0.6340 -0.0419 0.0099 -0.0096 166 MET F C 4359 O O . MET C 188 ? 0.5690 0.5431 0.6363 -0.0480 0.0216 -0.0175 166 MET F O 4360 C CB . MET C 188 ? 0.5427 0.5199 0.6102 -0.0433 -0.0036 -0.0056 166 MET F CB 4361 C CG . MET C 188 ? 0.5829 0.5618 0.6414 -0.0464 -0.0160 -0.0011 166 MET F CG 4362 S SD . MET C 188 ? 0.6155 0.6116 0.6924 -0.0394 -0.0268 0.0073 166 MET F SD 4363 C CE . MET C 188 ? 0.5808 0.5691 0.6687 -0.0341 -0.0246 0.0089 166 MET F CE 4364 N N . SER C 189 ? 0.4881 0.4907 0.5942 -0.0338 0.0088 -0.0046 167 SER F N 4365 C CA . SER C 189 ? 0.4872 0.4939 0.6130 -0.0296 0.0215 -0.0072 167 SER F CA 4366 C C . SER C 189 ? 0.5409 0.5352 0.6790 -0.0245 0.0341 -0.0118 167 SER F C 4367 O O . SER C 189 ? 0.5514 0.5398 0.6954 -0.0247 0.0506 -0.0193 167 SER F O 4368 C CB . SER C 189 ? 0.5155 0.5421 0.6667 -0.0232 0.0140 0.0018 167 SER F CB 4369 O OG . SER C 189 ? 0.6399 0.6737 0.8131 -0.0197 0.0254 0.0004 167 SER F OG 4370 N N . SER C 190 ? 0.4865 0.4756 0.6281 -0.0205 0.0273 -0.0079 168 SER F N 4371 C CA . SER C 190 ? 0.4952 0.4702 0.6482 -0.0154 0.0372 -0.0112 168 SER F CA 4372 C C . SER C 190 ? 0.5490 0.5035 0.6721 -0.0230 0.0379 -0.0171 168 SER F C 4373 O O . SER C 190 ? 0.5362 0.4925 0.6435 -0.0272 0.0242 -0.0127 168 SER F O 4374 C CB . SER C 190 ? 0.5263 0.5105 0.7085 -0.0057 0.0277 -0.0004 168 SER F CB 4375 O OG . SER C 190 ? 0.6454 0.6162 0.8449 0.0007 0.0378 -0.0027 168 SER F OG 4376 N N . ALA C 191 ? 0.5199 0.4544 0.6353 -0.0257 0.0549 -0.0273 169 ALA F N 4377 C CA . ALA C 191 ? 0.5326 0.4441 0.6182 -0.0347 0.0577 -0.0337 169 ALA F CA 4378 C C . ALA C 191 ? 0.5756 0.4748 0.6752 -0.0274 0.0601 -0.0326 169 ALA F C 4379 O O . ALA C 191 ? 0.5931 0.4698 0.6711 -0.0340 0.0659 -0.0390 169 ALA F O 4380 C CB . ALA C 191 ? 0.5700 0.4634 0.6326 -0.0453 0.0757 -0.0464 169 ALA F CB 4381 N N . TRP C 192 ? 0.5024 0.4155 0.6370 -0.0150 0.0540 -0.0235 170 TRP F N 4382 C CA . TRP C 192 ? 0.4999 0.4039 0.6538 -0.0070 0.0533 -0.0194 170 TRP F CA 4383 C C . TRP C 192 ? 0.5337 0.4303 0.6658 -0.0126 0.0393 -0.0152 170 TRP F C 4384 O O . TRP C 192 ? 0.5086 0.4186 0.6278 -0.0175 0.0245 -0.0095 170 TRP F O 4385 C CB . TRP C 192 ? 0.4665 0.3901 0.6622 0.0050 0.0461 -0.0077 170 TRP F CB 4386 C CG . TRP C 192 ? 0.4871 0.4015 0.7073 0.0134 0.0442 -0.0015 170 TRP F CG 4387 C CD1 . TRP C 192 ? 0.5427 0.4452 0.7911 0.0223 0.0595 -0.0050 170 TRP F CD1 4388 C CD2 . TRP C 192 ? 0.4780 0.3929 0.6964 0.0130 0.0262 0.0092 170 TRP F CD2 4389 N NE1 . TRP C 192 ? 0.5406 0.4359 0.8062 0.0280 0.0506 0.0040 170 TRP F NE1 4390 C CE2 . TRP C 192 ? 0.5432 0.4457 0.7889 0.0216 0.0299 0.0128 170 TRP F CE2 4391 C CE3 . TRP C 192 ? 0.4776 0.4016 0.6748 0.0057 0.0084 0.0157 170 TRP F CE3 4392 C CZ2 . TRP C 192 ? 0.5344 0.4330 0.7838 0.0219 0.0144 0.0237 170 TRP F CZ2 4393 C CZ3 . TRP C 192 ? 0.4967 0.4172 0.6969 0.0056 -0.0049 0.0251 170 TRP F CZ3 4394 C CH2 . TRP C 192 ? 0.5205 0.4283 0.7452 0.0131 -0.0028 0.0296 170 TRP F CH2 4395 N N . THR C 193 ? 0.5021 0.3769 0.6319 -0.0119 0.0451 -0.0183 171 THR F N 4396 C CA . THR C 193 ? 0.4984 0.3634 0.6094 -0.0174 0.0339 -0.0147 171 THR F CA 4397 C C . THR C 193 ? 0.5467 0.3994 0.6804 -0.0089 0.0344 -0.0102 171 THR F C 4398 O O . THR C 193 ? 0.5596 0.3983 0.7109 -0.0023 0.0505 -0.0161 171 THR F O 4399 C CB . THR C 193 ? 0.6258 0.4703 0.6975 -0.0309 0.0401 -0.0247 171 THR F CB 4400 O OG1 . THR C 193 ? 0.6580 0.4800 0.7270 -0.0314 0.0614 -0.0366 171 THR F OG1 4401 C CG2 . THR C 193 ? 0.5949 0.4518 0.6433 -0.0410 0.0330 -0.0251 171 THR F CG2 4402 N N . PRO C 194 ? 0.4908 0.4092 0.5651 -0.1861 0.0670 -0.0835 172 PRO F N 4403 C CA . PRO C 194 ? 0.4344 0.4190 0.5566 -0.1758 0.0434 -0.0871 172 PRO F CA 4404 C C . PRO C 194 ? 0.4523 0.4449 0.5829 -0.1523 0.0283 -0.0715 172 PRO F C 4405 O O . PRO C 194 ? 0.4111 0.4511 0.5795 -0.1436 0.0113 -0.0744 172 PRO F O 4406 C CB . PRO C 194 ? 0.4444 0.4383 0.5679 -0.1700 0.0288 -0.0843 172 PRO F CB 4407 C CG . PRO C 194 ? 0.5293 0.4646 0.6142 -0.1629 0.0393 -0.0722 172 PRO F CG 4408 C CD . PRO C 194 ? 0.5201 0.4066 0.5736 -0.1762 0.0639 -0.0741 172 PRO F CD 4409 N N . PHE C 195 ? 0.4281 0.3723 0.5223 -0.1417 0.0330 -0.0551 173 PHE F N 4410 C CA . PHE C 195 ? 0.4071 0.3524 0.5015 -0.1223 0.0205 -0.0408 173 PHE F CA 4411 C C . PHE C 195 ? 0.4738 0.4170 0.5649 -0.1347 0.0351 -0.0482 173 PHE F C 4412 O O . PHE C 195 ? 0.5142 0.4217 0.5746 -0.1554 0.0580 -0.0552 173 PHE F O 4413 C CB . PHE C 195 ? 0.4492 0.3469 0.5078 -0.1048 0.0144 -0.0210 173 PHE F CB 4414 C CG . PHE C 195 ? 0.4620 0.3550 0.5234 -0.0941 0.0063 -0.0170 173 PHE F CG 4415 C CD1 . PHE C 195 ? 0.4603 0.3897 0.5487 -0.0812 -0.0109 -0.0149 173 PHE F CD1 4416 C CD2 . PHE C 195 ? 0.5304 0.3770 0.5643 -0.0979 0.0181 -0.0161 173 PHE F CD2 4417 C CE1 . PHE C 195 ? 0.4715 0.3948 0.5604 -0.0756 -0.0136 -0.0147 173 PHE F CE1 4418 C CE2 . PHE C 195 ? 0.5629 0.4055 0.6035 -0.0890 0.0144 -0.0162 173 PHE F CE2 4419 C CZ . PHE C 195 ? 0.4972 0.3798 0.5656 -0.0793 -0.0002 -0.0166 173 PHE F CZ 4420 N N . ASP C 196 ? 0.3994 0.3757 0.5185 -0.1237 0.0245 -0.0478 174 ASP F N 4421 C CA . ASP C 196 ? 0.4100 0.3867 0.5293 -0.1347 0.0397 -0.0568 174 ASP F CA 4422 C C . ASP C 196 ? 0.4854 0.4151 0.5559 -0.1263 0.0376 -0.0379 174 ASP F C 4423 O O . ASP C 196 ? 0.4873 0.3885 0.5315 -0.1114 0.0240 -0.0201 174 ASP F O 4424 C CB . ASP C 196 ? 0.3905 0.4256 0.5687 -0.1260 0.0296 -0.0679 174 ASP F CB 4425 C CG . ASP C 196 ? 0.5034 0.5883 0.7336 -0.1353 0.0294 -0.0897 174 ASP F CG 4426 O OD1 . ASP C 196 ? 0.5355 0.6162 0.7625 -0.1598 0.0508 -0.1071 174 ASP F OD1 4427 O OD2 . ASP C 196 ? 0.5483 0.6757 0.8220 -0.1190 0.0074 -0.0903 174 ASP F OD2 4428 N N . ASN C 197 ? 0.4603 0.3831 0.5200 -0.1367 0.0506 -0.0437 175 ASN F N 4429 C CA . ASN C 197 ? 0.4902 0.3698 0.4993 -0.1324 0.0468 -0.0275 175 ASN F CA 4430 C C . ASN C 197 ? 0.4965 0.3958 0.5218 -0.1046 0.0195 -0.0123 175 ASN F C 4431 O O . ASN C 197 ? 0.5133 0.3794 0.5012 -0.0935 0.0060 0.0051 175 ASN F O 4432 C CB . ASN C 197 ? 0.5396 0.4097 0.5331 -0.1552 0.0708 -0.0415 175 ASN F CB 4433 C CG . ASN C 197 ? 0.9219 0.7587 0.8837 -0.1877 0.1022 -0.0562 175 ASN F CG 4434 O OD1 . ASN C 197 ? 0.8357 0.7057 0.8390 -0.2011 0.1170 -0.0776 175 ASN F OD1 4435 N ND2 . ASN C 197 ? 0.9014 0.6696 0.7859 -0.2027 0.1123 -0.0454 175 ASN F ND2 4436 N N . LYS C 198 ? 0.3976 0.3492 0.4784 -0.0936 0.0105 -0.0197 176 LYS F N 4437 C CA . LYS C 198 ? 0.3595 0.3305 0.4576 -0.0713 -0.0113 -0.0088 176 LYS F CA 4438 C C . LYS C 198 ? 0.3728 0.3696 0.5011 -0.0586 -0.0263 -0.0063 176 LYS F C 4439 O O . LYS C 198 ? 0.3522 0.3786 0.5139 -0.0631 -0.0246 -0.0178 176 LYS F O 4440 C CB . LYS C 198 ? 0.3733 0.3712 0.4999 -0.0706 -0.0078 -0.0183 176 LYS F CB 4441 C CG . LYS C 198 ? 0.5878 0.5577 0.6766 -0.0800 0.0018 -0.0170 176 LYS F CG 4442 C CD . LYS C 198 ? 0.6961 0.6918 0.8156 -0.0769 0.0050 -0.0266 176 LYS F CD 4443 C CE . LYS C 198 ? 0.8825 0.8495 0.9591 -0.0882 0.0135 -0.0257 176 LYS F CE 4444 N NZ . LYS C 198 ? 0.9866 0.9756 1.0929 -0.0858 0.0190 -0.0365 176 LYS F NZ 4445 N N . ILE C 199 ? 0.3201 0.3058 0.4361 -0.0442 -0.0409 0.0070 177 ILE F N 4446 C CA . ILE C 199 ? 0.2923 0.2953 0.4273 -0.0358 -0.0520 0.0087 177 ILE F CA 4447 C C . ILE C 199 ? 0.3137 0.3266 0.4562 -0.0207 -0.0663 0.0163 177 ILE F C 4448 O O . ILE C 199 ? 0.3148 0.3161 0.4437 -0.0144 -0.0699 0.0223 177 ILE F O 4449 C CB . ILE C 199 ? 0.3523 0.3323 0.4702 -0.0398 -0.0476 0.0096 177 ILE F CB 4450 C CG1 . ILE C 199 ? 0.3848 0.3268 0.4724 -0.0309 -0.0504 0.0206 177 ILE F CG1 4451 C CG2 . ILE C 199 ? 0.3807 0.3577 0.4970 -0.0589 -0.0318 -0.0021 177 ILE F CG2 4452 C CD1 . ILE C 199 ? 0.4702 0.4029 0.5603 -0.0224 -0.0544 0.0223 177 ILE F CD1 4453 N N . VAL C 200 ? 0.2463 0.2786 0.4064 -0.0173 -0.0741 0.0152 178 VAL F N 4454 C CA . VAL C 200 ? 0.2282 0.2669 0.3924 -0.0081 -0.0834 0.0198 178 VAL F CA 4455 C C . VAL C 200 ? 0.2749 0.3092 0.4346 -0.0091 -0.0843 0.0190 178 VAL F C 4456 O O . VAL C 200 ? 0.2730 0.3112 0.4331 -0.0173 -0.0835 0.0151 178 VAL F O 4457 C CB . VAL C 200 ? 0.2639 0.3201 0.4445 -0.0054 -0.0898 0.0193 178 VAL F CB 4458 C CG1 . VAL C 200 ? 0.2564 0.3116 0.4330 -0.0010 -0.0963 0.0233 178 VAL F CG1 4459 C CG2 . VAL C 200 ? 0.2609 0.3191 0.4477 -0.0042 -0.0850 0.0173 178 VAL F CG2 4460 N N . VAL C 201 ? 0.2286 0.2567 0.3862 -0.0023 -0.0852 0.0201 179 VAL F N 4461 C CA . VAL C 201 ? 0.2310 0.2548 0.3887 -0.0042 -0.0814 0.0152 179 VAL F CA 4462 C C . VAL C 201 ? 0.2739 0.3070 0.4360 -0.0049 -0.0824 0.0121 179 VAL F C 4463 O O . VAL C 201 ? 0.2594 0.2984 0.4295 0.0019 -0.0849 0.0121 179 VAL F O 4464 C CB . VAL C 201 ? 0.2947 0.3012 0.4525 0.0036 -0.0781 0.0141 179 VAL F CB 4465 C CG1 . VAL C 201 ? 0.2995 0.3023 0.4640 0.0011 -0.0700 0.0047 179 VAL F CG1 4466 C CG2 . VAL C 201 ? 0.3108 0.2973 0.4535 0.0007 -0.0743 0.0179 179 VAL F CG2 4467 N N . TYR C 202 ? 0.2414 0.2732 0.3938 -0.0159 -0.0795 0.0085 180 TYR F N 4468 C CA . TYR C 202 ? 0.2462 0.2775 0.3919 -0.0228 -0.0760 0.0042 180 TYR F CA 4469 C C . TYR C 202 ? 0.3180 0.3412 0.4565 -0.0345 -0.0639 -0.0067 180 TYR F C 4470 O O . TYR C 202 ? 0.3268 0.3429 0.4467 -0.0459 -0.0644 -0.0067 180 TYR F O 4471 C CB . TYR C 202 ? 0.2669 0.2948 0.3953 -0.0279 -0.0852 0.0120 180 TYR F CB 4472 C CG . TYR C 202 ? 0.3084 0.3236 0.4154 -0.0401 -0.0794 0.0086 180 TYR F CG 4473 C CD1 . TYR C 202 ? 0.3302 0.3467 0.4435 -0.0398 -0.0720 0.0037 180 TYR F CD1 4474 C CD2 . TYR C 202 ? 0.3469 0.3465 0.4229 -0.0554 -0.0804 0.0088 180 TYR F CD2 4475 C CE1 . TYR C 202 ? 0.3655 0.3660 0.4551 -0.0557 -0.0619 -0.0019 180 TYR F CE1 4476 C CE2 . TYR C 202 ? 0.3898 0.3690 0.4352 -0.0711 -0.0722 0.0054 180 TYR F CE2 4477 C CZ . TYR C 202 ? 0.4808 0.4595 0.5333 -0.0719 -0.0612 -0.0004 180 TYR F CZ 4478 O OH . TYR C 202 ? 0.5304 0.4850 0.5489 -0.0917 -0.0488 -0.0060 180 TYR F OH 4479 N N . LYS C 203 ? 0.2787 0.3052 0.4350 -0.0321 -0.0528 -0.0185 181 LYS F N 4480 C CA . LYS C 203 ? 0.2957 0.3161 0.4545 -0.0424 -0.0361 -0.0342 181 LYS F CA 4481 C C . LYS C 203 ? 0.3564 0.3655 0.5120 -0.0430 -0.0331 -0.0350 181 LYS F C 4482 O O . LYS C 203 ? 0.3458 0.3526 0.5197 -0.0275 -0.0360 -0.0327 181 LYS F O 4483 C CB . LYS C 203 ? 0.3519 0.3622 0.4812 -0.0652 -0.0259 -0.0410 181 LYS F CB 4484 C CG . LYS C 203 ? 0.5351 0.5529 0.6787 -0.0705 -0.0120 -0.0555 181 LYS F CG 4485 C CD . LYS C 203 ? 0.6598 0.6757 0.7870 -0.0725 -0.0200 -0.0458 181 LYS F CD 4486 C CE . LYS C 203 ? 0.8254 0.8290 0.9315 -0.0955 -0.0014 -0.0590 181 LYS F CE 4487 N NZ . LYS C 203 ? 0.9286 0.9564 1.0774 -0.0929 0.0124 -0.0790 181 LYS F NZ 4488 N N . GLY C 204 ? 0.3336 0.3323 0.4612 -0.0619 -0.0285 -0.0374 182 GLY F N 4489 C CA . GLY C 204 ? 0.3454 0.3333 0.4660 -0.0681 -0.0232 -0.0409 182 GLY F CA 4490 C C . GLY C 204 ? 0.3909 0.3826 0.4973 -0.0708 -0.0380 -0.0294 182 GLY F C 4491 O O . GLY C 204 ? 0.3994 0.3843 0.4965 -0.0814 -0.0333 -0.0343 182 GLY F O 4492 N N . ASP C 205 ? 0.3306 0.3347 0.4392 -0.0621 -0.0543 -0.0168 183 ASP F N 4493 C CA . ASP C 205 ? 0.3237 0.3381 0.4300 -0.0628 -0.0684 -0.0092 183 ASP F CA 4494 C C . ASP C 205 ? 0.3506 0.3717 0.4770 -0.0474 -0.0723 -0.0024 183 ASP F C 4495 O O . ASP C 205 ? 0.3318 0.3546 0.4676 -0.0353 -0.0743 0.0025 183 ASP F O 4496 C CB . ASP C 205 ? 0.3560 0.3759 0.4458 -0.0677 -0.0846 -0.0022 183 ASP F CB 4497 C CG . ASP C 205 ? 0.5296 0.5372 0.5859 -0.0879 -0.0838 -0.0074 183 ASP F CG 4498 O OD1 . ASP C 205 ? 0.5517 0.5625 0.5987 -0.1001 -0.0873 -0.0123 183 ASP F OD1 4499 O OD2 . ASP C 205 ? 0.6275 0.6211 0.6636 -0.0944 -0.0789 -0.0079 183 ASP F OD2 4500 N N . VAL C 206 ? 0.3090 0.3329 0.4391 -0.0515 -0.0715 -0.0041 184 VAL F N 4501 C CA . VAL C 206 ? 0.2967 0.3220 0.4379 -0.0438 -0.0709 -0.0003 184 VAL F CA 4502 C C . VAL C 206 ? 0.3375 0.3864 0.4916 -0.0479 -0.0807 -0.0017 184 VAL F C 4503 O O . VAL C 206 ? 0.3398 0.4003 0.4939 -0.0593 -0.0854 -0.0081 184 VAL F O 4504 C CB . VAL C 206 ? 0.3636 0.3654 0.4970 -0.0470 -0.0567 -0.0040 184 VAL F CB 4505 C CG1 . VAL C 206 ? 0.3628 0.3572 0.4955 -0.0429 -0.0543 0.0005 184 VAL F CG1 4506 C CG2 . VAL C 206 ? 0.3725 0.3525 0.5017 -0.0390 -0.0500 -0.0043 184 VAL F CG2 4507 N N . TYR C 207 ? 0.2820 0.3394 0.4495 -0.0387 -0.0843 0.0024 185 TYR F N 4508 C CA . TYR C 207 ? 0.2730 0.3553 0.4637 -0.0388 -0.0925 -0.0017 185 TYR F CA 4509 C C . TYR C 207 ? 0.3281 0.4109 0.5295 -0.0408 -0.0799 -0.0070 185 TYR F C 4510 O O . TYR C 207 ? 0.3247 0.3894 0.5135 -0.0354 -0.0731 -0.0013 185 TYR F O 4511 C CB . TYR C 207 ? 0.2771 0.3670 0.4748 -0.0268 -0.1076 0.0061 185 TYR F CB 4512 C CG . TYR C 207 ? 0.3079 0.3925 0.4873 -0.0291 -0.1202 0.0112 185 TYR F CG 4513 C CD1 . TYR C 207 ? 0.3448 0.4435 0.5292 -0.0313 -0.1387 0.0104 185 TYR F CD1 4514 C CD2 . TYR C 207 ? 0.3213 0.3860 0.4773 -0.0301 -0.1143 0.0155 185 TYR F CD2 4515 C CE1 . TYR C 207 ? 0.3768 0.4622 0.5317 -0.0365 -0.1511 0.0166 185 TYR F CE1 4516 C CE2 . TYR C 207 ? 0.3523 0.4065 0.4839 -0.0374 -0.1214 0.0181 185 TYR F CE2 4517 C CZ . TYR C 207 ? 0.4628 0.5236 0.5881 -0.0416 -0.1399 0.0200 185 TYR F CZ 4518 O OH . TYR C 207 ? 0.5052 0.5478 0.5944 -0.0519 -0.1476 0.0240 185 TYR F OH 4519 N N . ASN C 208 ? 0.2907 0.3947 0.5145 -0.0505 -0.0766 -0.0199 186 ASN F N 4520 C CA . ASN C 208 ? 0.2955 0.4011 0.5301 -0.0576 -0.0603 -0.0295 186 ASN F CA 4521 C C . ASN C 208 ? 0.3378 0.4642 0.6018 -0.0454 -0.0682 -0.0304 186 ASN F C 4522 O O . ASN C 208 ? 0.3234 0.4809 0.6228 -0.0405 -0.0818 -0.0373 186 ASN F O 4523 C CB . ASN C 208 ? 0.3081 0.4319 0.5607 -0.0760 -0.0500 -0.0481 186 ASN F CB 4524 C CG . ASN C 208 ? 0.5677 0.6587 0.7866 -0.0929 -0.0304 -0.0509 186 ASN F CG 4525 O OD1 . ASN C 208 ? 0.4980 0.5486 0.6800 -0.0898 -0.0229 -0.0389 186 ASN F OD1 4526 N ND2 . ASN C 208 ? 0.4632 0.5698 0.6950 -0.1112 -0.0221 -0.0678 186 ASN F ND2 4527 N N . MET C 209 ? 0.3028 0.4105 0.5515 -0.0390 -0.0625 -0.0229 187 MET F N 4528 C CA . MET C 209 ? 0.2943 0.4148 0.5666 -0.0281 -0.0668 -0.0239 187 MET F CA 4529 C C . MET C 209 ? 0.3579 0.4631 0.6182 -0.0345 -0.0482 -0.0281 187 MET F C 4530 O O . MET C 209 ? 0.3663 0.4424 0.5875 -0.0371 -0.0438 -0.0185 187 MET F O 4531 C CB . MET C 209 ? 0.3162 0.4293 0.5781 -0.0133 -0.0840 -0.0090 187 MET F CB 4532 C CG . MET C 209 ? 0.3598 0.4844 0.6487 -0.0008 -0.0920 -0.0099 187 MET F CG 4533 S SD . MET C 209 ? 0.4152 0.5162 0.6796 0.0069 -0.0915 0.0015 187 MET F SD 4534 C CE . MET C 209 ? 0.3752 0.4657 0.6177 0.0113 -0.1084 0.0146 187 MET F CE 4535 N N . ASP C 210 ? 0.3163 0.4411 0.6113 -0.0364 -0.0389 -0.0433 188 ASP F N 4536 C CA . ASP C 210 ? 0.3316 0.4426 0.6155 -0.0459 -0.0185 -0.0510 188 ASP F CA 4537 C C . ASP C 210 ? 0.3740 0.4778 0.6536 -0.0318 -0.0276 -0.0411 188 ASP F C 4538 O O . ASP C 210 ? 0.3653 0.4840 0.6792 -0.0252 -0.0249 -0.0506 188 ASP F O 4539 C CB . ASP C 210 ? 0.3604 0.4985 0.6904 -0.0562 -0.0003 -0.0769 188 ASP F CB 4540 C CG . ASP C 210 ? 0.5217 0.6425 0.8356 -0.0731 0.0273 -0.0895 188 ASP F CG 4541 O OD1 . ASP C 210 ? 0.5615 0.6465 0.8202 -0.0906 0.0406 -0.0846 188 ASP F OD1 4542 O OD2 . ASP C 210 ? 0.5957 0.7356 0.9502 -0.0696 0.0360 -0.1051 188 ASP F OD2 4543 N N . TYR C 211 ? 0.3298 0.4118 0.5713 -0.0268 -0.0382 -0.0237 189 TYR F N 4544 C CA . TYR C 211 ? 0.3213 0.3958 0.5540 -0.0169 -0.0462 -0.0151 189 TYR F CA 4545 C C . TYR C 211 ? 0.3896 0.4543 0.6130 -0.0252 -0.0306 -0.0234 189 TYR F C 4546 O O . TYR C 211 ? 0.4063 0.4574 0.6070 -0.0409 -0.0155 -0.0297 189 TYR F O 4547 C CB . TYR C 211 ? 0.3331 0.3924 0.5336 -0.0127 -0.0583 -0.0002 189 TYR F CB 4548 C CG . TYR C 211 ? 0.3747 0.4113 0.5380 -0.0215 -0.0538 0.0039 189 TYR F CG 4549 C CD1 . TYR C 211 ? 0.4189 0.4382 0.5535 -0.0267 -0.0507 0.0055 189 TYR F CD1 4550 C CD2 . TYR C 211 ? 0.3911 0.4192 0.5438 -0.0241 -0.0549 0.0073 189 TYR F CD2 4551 C CE1 . TYR C 211 ? 0.4585 0.4502 0.5527 -0.0327 -0.0518 0.0122 189 TYR F CE1 4552 C CE2 . TYR C 211 ? 0.4323 0.4308 0.5473 -0.0294 -0.0529 0.0133 189 TYR F CE2 4553 C CZ . TYR C 211 ? 0.5486 0.5278 0.6333 -0.0326 -0.0533 0.0170 189 TYR F CZ 4554 O OH . TYR C 211 ? 0.6035 0.5473 0.6453 -0.0360 -0.0562 0.0255 189 TYR F OH 4555 N N . PRO C 212 ? 0.3457 0.4117 0.5803 -0.0178 -0.0322 -0.0242 190 PRO F N 4556 C CA . PRO C 212 ? 0.3645 0.4195 0.5866 -0.0289 -0.0152 -0.0342 190 PRO F CA 4557 C C . PRO C 212 ? 0.4367 0.4697 0.6062 -0.0389 -0.0178 -0.0255 190 PRO F C 4558 O O . PRO C 212 ? 0.4215 0.4525 0.5774 -0.0304 -0.0351 -0.0123 190 PRO F O 4559 C CB . PRO C 212 ? 0.3788 0.4371 0.6240 -0.0173 -0.0182 -0.0356 190 PRO F CB 4560 C CG . PRO C 212 ? 0.4172 0.4775 0.6628 -0.0034 -0.0394 -0.0203 190 PRO F CG 4561 C CD . PRO C 212 ? 0.3513 0.4223 0.6029 -0.0020 -0.0473 -0.0165 190 PRO F CD 4562 N N . PRO C 213 ? 0.4281 0.4436 0.5668 -0.0571 -0.0021 -0.0335 191 PRO F N 4563 C CA . PRO C 213 ? 0.4536 0.4457 0.5383 -0.0647 -0.0115 -0.0231 191 PRO F CA 4564 C C . PRO C 213 ? 0.4940 0.4911 0.5751 -0.0587 -0.0234 -0.0196 191 PRO F C 4565 O O . PRO C 213 ? 0.4686 0.4792 0.5817 -0.0525 -0.0186 -0.0263 191 PRO F O 4566 C CB . PRO C 213 ? 0.5219 0.4903 0.5705 -0.0891 0.0102 -0.0343 191 PRO F CB 4567 C CG . PRO C 213 ? 0.5678 0.5534 0.6605 -0.0936 0.0338 -0.0550 191 PRO F CG 4568 C CD . PRO C 213 ? 0.4674 0.4824 0.6177 -0.0729 0.0247 -0.0537 191 PRO F CD 4569 N N . PHE C 214 ? 0.4702 0.4559 0.5139 -0.0599 -0.0401 -0.0099 192 PHE F N 4570 C CA . PHE C 214 ? 0.4641 0.4595 0.5062 -0.0571 -0.0520 -0.0099 192 PHE F CA 4571 C C . PHE C 214 ? 0.5261 0.5168 0.5601 -0.0729 -0.0343 -0.0244 192 PHE F C 4572 O O . PHE C 214 ? 0.5570 0.5279 0.5579 -0.0909 -0.0214 -0.0306 192 PHE F O 4573 C CB . PHE C 214 ? 0.5120 0.4998 0.5206 -0.0547 -0.0761 0.0007 192 PHE F CB 4574 C CG . PHE C 214 ? 0.5212 0.5311 0.5444 -0.0483 -0.0915 -0.0014 192 PHE F CG 4575 C CD1 . PHE C 214 ? 0.5326 0.5619 0.5865 -0.0321 -0.1043 0.0029 192 PHE F CD1 4576 C CD2 . PHE C 214 ? 0.5725 0.5844 0.5786 -0.0617 -0.0906 -0.0108 192 PHE F CD2 4577 C CE1 . PHE C 214 ? 0.5354 0.5878 0.6066 -0.0296 -0.1147 -0.0035 192 PHE F CE1 4578 C CE2 . PHE C 214 ? 0.5982 0.6342 0.6212 -0.0587 -0.1029 -0.0165 192 PHE F CE2 4579 C CZ . PHE C 214 ? 0.5433 0.6004 0.6006 -0.0428 -0.1143 -0.0134 192 PHE F CZ 4580 N N . GLY C 215 ? 0.4593 0.4638 0.5207 -0.0683 -0.0312 -0.0306 193 GLY F N 4581 C CA . GLY C 215 ? 0.4726 0.4715 0.5323 -0.0819 -0.0123 -0.0460 193 GLY F CA 4582 C C . GLY C 215 ? 0.5141 0.5100 0.6054 -0.0817 0.0118 -0.0578 193 GLY F C 4583 O O . GLY C 215 ? 0.5318 0.5183 0.6197 -0.0958 0.0330 -0.0737 193 GLY F O 4584 N N . ALA C 216 ? 0.4427 0.4484 0.5680 -0.0658 0.0084 -0.0519 194 ALA F N 4585 C CA . ALA C 216 ? 0.4351 0.4458 0.6024 -0.0607 0.0254 -0.0636 194 ALA F CA 4586 C C . ALA C 216 ? 0.4564 0.4787 0.6654 -0.0374 0.0123 -0.0554 194 ALA F C 4587 O O . ALA C 216 ? 0.4474 0.4781 0.6976 -0.0283 0.0188 -0.0633 194 ALA F O 4588 C CB . ALA C 216 ? 0.4565 0.4668 0.6189 -0.0712 0.0364 -0.0695 194 ALA F CB 4589 N N . GLY C 217 ? 0.3994 0.4216 0.5972 -0.0293 -0.0059 -0.0413 195 GLY F N 4590 C CA . GLY C 217 ? 0.3816 0.4060 0.6022 -0.0117 -0.0193 -0.0315 195 GLY F CA 4591 C C . GLY C 217 ? 0.4437 0.4552 0.6870 -0.0034 -0.0123 -0.0369 195 GLY F C 4592 O O . GLY C 217 ? 0.4538 0.4524 0.6863 -0.0125 0.0008 -0.0456 195 GLY F O 4593 N N . ARG C 218 ? 0.3998 0.4122 0.6730 0.0140 -0.0224 -0.0319 196 ARG F N 4594 C CA . ARG C 218 ? 0.4180 0.4123 0.7152 0.0277 -0.0211 -0.0342 196 ARG F CA 4595 C C . ARG C 218 ? 0.4795 0.4481 0.7535 0.0344 -0.0351 -0.0184 196 ARG F C 4596 O O . ARG C 218 ? 0.4629 0.4361 0.7166 0.0332 -0.0494 -0.0061 196 ARG F O 4597 C CB . ARG C 218 ? 0.4241 0.4343 0.7713 0.0444 -0.0271 -0.0397 196 ARG F CB 4598 C CG . ARG C 218 ? 0.5594 0.5880 0.9366 0.0357 -0.0044 -0.0624 196 ARG F CG 4599 C CD . ARG C 218 ? 0.6937 0.7402 1.1342 0.0545 -0.0086 -0.0734 196 ARG F CD 4600 N NE . ARG C 218 ? 0.8068 0.8761 1.2784 0.0418 0.0167 -0.0989 196 ARG F NE 4601 C CZ . ARG C 218 ? 0.9772 1.0737 1.4592 0.0327 0.0188 -0.1057 196 ARG F CZ 4602 N NH1 . ARG C 218 ? 0.8017 0.9076 1.2681 0.0365 -0.0042 -0.0887 196 ARG F NH1 4603 N NH2 . ARG C 218 ? 0.8210 0.9325 1.3266 0.0169 0.0468 -0.1314 196 ARG F NH2 4604 N N . PRO C 219 ? 0.4662 0.4031 0.7403 0.0399 -0.0290 -0.0196 197 PRO F N 4605 C CA . PRO C 219 ? 0.4884 0.3918 0.7309 0.0421 -0.0391 -0.0048 197 PRO F CA 4606 C C . PRO C 219 ? 0.5465 0.4421 0.7923 0.0597 -0.0650 0.0116 197 PRO F C 4607 O O . PRO C 219 ? 0.5424 0.4482 0.8271 0.0779 -0.0757 0.0101 197 PRO F O 4608 C CB . PRO C 219 ? 0.5490 0.4149 0.7912 0.0433 -0.0235 -0.0118 197 PRO F CB 4609 C CG . PRO C 219 ? 0.5942 0.4796 0.8621 0.0358 -0.0019 -0.0326 197 PRO F CG 4610 C CD . PRO C 219 ? 0.5063 0.4310 0.8052 0.0419 -0.0095 -0.0357 197 PRO F CD 4611 N N . GLY C 220 ? 0.5125 0.3930 0.7186 0.0523 -0.0746 0.0248 198 GLY F N 4612 C CA . GLY C 220 ? 0.5290 0.3966 0.7225 0.0630 -0.0995 0.0413 198 GLY F CA 4613 C C . GLY C 220 ? 0.5430 0.4520 0.7582 0.0666 -0.1133 0.0416 198 GLY F C 4614 O O . GLY C 220 ? 0.5538 0.4571 0.7605 0.0743 -0.1356 0.0533 198 GLY F O 4615 N N . GLN C 221 ? 0.4588 0.4057 0.6964 0.0591 -0.1001 0.0285 199 GLN F N 4616 C CA . GLN C 221 ? 0.4272 0.4104 0.6840 0.0589 -0.1070 0.0258 199 GLN F CA 4617 C C . GLN C 221 ? 0.4497 0.4475 0.6836 0.0420 -0.0975 0.0240 199 GLN F C 4618 O O . GLN C 221 ? 0.4451 0.4338 0.6588 0.0316 -0.0853 0.0212 199 GLN F O 4619 C CB . GLN C 221 ? 0.4319 0.4410 0.7370 0.0654 -0.0987 0.0104 199 GLN F CB 4620 C CG . GLN C 221 ? 0.6694 0.6741 1.0141 0.0867 -0.1113 0.0088 199 GLN F CG 4621 C CD . GLN C 221 ? 0.9189 0.9615 1.3190 0.0904 -0.1042 -0.0101 199 GLN F CD 4622 O OE1 . GLN C 221 ? 0.8678 0.9150 1.2928 0.0877 -0.0823 -0.0269 199 GLN F OE1 4623 N NE2 . GLN C 221 ? 0.8142 0.8847 1.2336 0.0935 -0.1199 -0.0103 199 GLN F NE2 4624 N N . PHE C 222 ? 0.3866 0.4070 0.6260 0.0399 -0.1038 0.0243 200 PHE F N 4625 C CA . PHE C 222 ? 0.3651 0.3968 0.5873 0.0281 -0.0976 0.0231 200 PHE F CA 4626 C C . PHE C 222 ? 0.4047 0.4418 0.6276 0.0210 -0.0819 0.0138 200 PHE F C 4627 O O . PHE C 222 ? 0.3980 0.4443 0.6404 0.0209 -0.0738 0.0051 200 PHE F O 4628 C CB . PHE C 222 ? 0.3762 0.4267 0.6084 0.0277 -0.1043 0.0228 200 PHE F CB 4629 C CG . PHE C 222 ? 0.3843 0.4395 0.5987 0.0185 -0.0995 0.0229 200 PHE F CG 4630 C CD1 . PHE C 222 ? 0.4259 0.4758 0.6219 0.0150 -0.1053 0.0284 200 PHE F CD1 4631 C CD2 . PHE C 222 ? 0.4065 0.4671 0.6202 0.0130 -0.0890 0.0171 200 PHE F CD2 4632 C CE1 . PHE C 222 ? 0.4306 0.4835 0.6168 0.0097 -0.1009 0.0270 200 PHE F CE1 4633 C CE2 . PHE C 222 ? 0.4406 0.4992 0.6370 0.0083 -0.0880 0.0191 200 PHE F CE2 4634 C CZ . PHE C 222 ? 0.4149 0.4712 0.6022 0.0084 -0.0941 0.0235 200 PHE F CZ 4635 N N . GLY C 223 ? 0.3591 0.3905 0.5607 0.0134 -0.0776 0.0138 201 GLY F N 4636 C CA . GLY C 223 ? 0.3558 0.3906 0.5501 0.0051 -0.0676 0.0061 201 GLY F CA 4637 C C . GLY C 223 ? 0.4161 0.4388 0.6075 0.0009 -0.0578 -0.0003 201 GLY F C 4638 O O . GLY C 223 ? 0.4173 0.4420 0.6018 -0.0078 -0.0490 -0.0086 201 GLY F O 4639 N N . ASP C 224 ? 0.3823 0.3873 0.5725 0.0049 -0.0589 0.0034 202 ASP F N 4640 C CA . ASP C 224 ? 0.3992 0.3851 0.5830 -0.0004 -0.0474 -0.0029 202 ASP F CA 4641 C C . ASP C 224 ? 0.4430 0.4381 0.6101 -0.0154 -0.0417 -0.0108 202 ASP F C 4642 O O . ASP C 224 ? 0.4521 0.4418 0.6146 -0.0248 -0.0300 -0.0211 202 ASP F O 4643 C CB . ASP C 224 ? 0.4480 0.4036 0.6235 0.0058 -0.0512 0.0055 202 ASP F CB 4644 C CG . ASP C 224 ? 0.5782 0.5268 0.7306 0.0005 -0.0583 0.0133 202 ASP F CG 4645 O OD1 . ASP C 224 ? 0.6172 0.5323 0.7488 -0.0009 -0.0579 0.0192 202 ASP F OD1 4646 O OD2 . ASP C 224 ? 0.6312 0.6036 0.7840 -0.0030 -0.0631 0.0131 202 ASP F OD2 4647 N N . ILE C 225 ? 0.3806 0.3920 0.5424 -0.0174 -0.0508 -0.0079 203 ILE F N 4648 C CA . ILE C 225 ? 0.3723 0.4025 0.5291 -0.0272 -0.0521 -0.0161 203 ILE F CA 4649 C C . ILE C 225 ? 0.4015 0.4505 0.5614 -0.0210 -0.0648 -0.0115 203 ILE F C 4650 O O . ILE C 225 ? 0.3858 0.4349 0.5502 -0.0132 -0.0708 -0.0034 203 ILE F O 4651 C CB . ILE C 225 ? 0.4197 0.4483 0.5723 -0.0361 -0.0476 -0.0217 203 ILE F CB 4652 C CG1 . ILE C 225 ? 0.4194 0.4779 0.5798 -0.0445 -0.0513 -0.0346 203 ILE F CG1 4653 C CG2 . ILE C 225 ? 0.4268 0.4464 0.5762 -0.0314 -0.0516 -0.0129 203 ILE F CG2 4654 C CD1 . ILE C 225 ? 0.5328 0.5921 0.6920 -0.0612 -0.0386 -0.0500 203 ILE F CD1 4655 N N . GLN C 226 ? 0.3605 0.4199 0.5132 -0.0253 -0.0689 -0.0159 204 GLN F N 4656 C CA . GLN C 226 ? 0.3546 0.4212 0.5017 -0.0195 -0.0818 -0.0098 204 GLN F CA 4657 C C . GLN C 226 ? 0.4149 0.4990 0.5598 -0.0212 -0.0955 -0.0151 204 GLN F C 4658 O O . GLN C 226 ? 0.4232 0.5122 0.5589 -0.0312 -0.0955 -0.0237 204 GLN F O 4659 C CB . GLN C 226 ? 0.3827 0.4359 0.5149 -0.0223 -0.0768 -0.0072 204 GLN F CB 4660 C CG . GLN C 226 ? 0.5339 0.5790 0.6797 -0.0170 -0.0680 -0.0035 204 GLN F CG 4661 C CD . GLN C 226 ? 0.7553 0.7911 0.8949 -0.0240 -0.0558 -0.0086 204 GLN F CD 4662 O OE1 . GLN C 226 ? 0.7011 0.7310 0.8253 -0.0353 -0.0477 -0.0166 204 GLN F OE1 4663 N NE2 . GLN C 226 ? 0.6537 0.6893 0.8066 -0.0199 -0.0520 -0.0069 204 GLN F NE2 4664 N N . SER C 227 ? 0.3689 0.4630 0.5245 -0.0111 -0.1081 -0.0114 205 SER F N 4665 C CA . SER C 227 ? 0.3772 0.4913 0.5413 -0.0065 -0.1263 -0.0165 205 SER F CA 4666 C C . SER C 227 ? 0.4444 0.5462 0.5966 0.0058 -0.1416 -0.0043 205 SER F C 4667 O O . SER C 227 ? 0.4277 0.5208 0.5866 0.0130 -0.1374 0.0020 205 SER F O 4668 C CB . SER C 227 ? 0.4066 0.5438 0.6042 -0.0051 -0.1237 -0.0279 205 SER F CB 4669 O OG . SER C 227 ? 0.5223 0.6876 0.7405 -0.0004 -0.1412 -0.0382 205 SER F OG 4670 N N . ARG C 228 ? 0.4351 0.5313 0.5641 0.0068 -0.1597 -0.0006 206 ARG F N 4671 C CA . ARG C 228 ? 0.4624 0.5357 0.5689 0.0178 -0.1763 0.0129 206 ARG F CA 4672 C C . ARG C 228 ? 0.5078 0.5912 0.6475 0.0361 -0.1858 0.0132 206 ARG F C 4673 O O . ARG C 228 ? 0.5130 0.5718 0.6416 0.0429 -0.1840 0.0235 206 ARG F O 4674 C CB . ARG C 228 ? 0.5055 0.5708 0.5785 0.0156 -0.1995 0.0161 206 ARG F CB 4675 C CG . ARG C 228 ? 0.6531 0.6878 0.6973 0.0291 -0.2226 0.0317 206 ARG F CG 4676 C CD . ARG C 228 ? 0.7933 0.8293 0.8170 0.0340 -0.2569 0.0341 206 ARG F CD 4677 N NE . ARG C 228 ? 0.8598 0.9433 0.9404 0.0491 -0.2765 0.0207 206 ARG F NE 4678 C CZ . ARG C 228 ? 1.0401 1.1291 1.1465 0.0736 -0.3030 0.0237 206 ARG F CZ 4679 N NH1 . ARG C 228 ? 0.9141 0.9576 0.9885 0.0864 -0.3135 0.0425 206 ARG F NH1 4680 N NH2 . ARG C 228 ? 0.8444 0.9839 1.0118 0.0851 -0.3170 0.0060 206 ARG F NH2 4681 N N . THR C 229 ? 0.4524 0.5720 0.6343 0.0417 -0.1926 -0.0011 207 THR F N 4682 C CA . THR C 229 ? 0.4411 0.5779 0.6655 0.0569 -0.1973 -0.0082 207 THR F CA 4683 C C . THR C 229 ? 0.4588 0.6282 0.7221 0.0469 -0.1783 -0.0278 207 THR F C 4684 O O . THR C 229 ? 0.4472 0.6286 0.7063 0.0323 -0.1708 -0.0358 207 THR F O 4685 C CB . THR C 229 ? 0.5827 0.7320 0.8238 0.0756 -0.2299 -0.0097 207 THR F CB 4686 O OG1 . THR C 229 ? 0.5957 0.7714 0.8393 0.0685 -0.2438 -0.0194 207 THR F OG1 4687 C CG2 . THR C 229 ? 0.6083 0.7137 0.8086 0.0883 -0.2481 0.0113 207 THR F CG2 4688 N N . PRO C 230 ? 0.4023 0.5827 0.6994 0.0516 -0.1679 -0.0375 208 PRO F N 4689 C CA . PRO C 230 ? 0.3802 0.5837 0.7030 0.0366 -0.1466 -0.0568 208 PRO F CA 4690 C C . PRO C 230 ? 0.4269 0.6730 0.7887 0.0337 -0.1539 -0.0793 208 PRO F C 4691 O O . PRO C 230 ? 0.4123 0.6726 0.7847 0.0153 -0.1338 -0.0957 208 PRO F O 4692 C CB . PRO C 230 ? 0.3964 0.5958 0.7386 0.0401 -0.1332 -0.0620 208 PRO F CB 4693 C CG . PRO C 230 ? 0.4649 0.6350 0.7868 0.0552 -0.1443 -0.0432 208 PRO F CG 4694 C CD . PRO C 230 ? 0.4293 0.5961 0.7376 0.0670 -0.1710 -0.0328 208 PRO F CD 4695 N N . GLU C 231 ? 0.3974 0.6619 0.7779 0.0508 -0.1834 -0.0804 209 GLU F N 4696 C CA . GLU C 231 ? 0.3976 0.7100 0.8219 0.0511 -0.1978 -0.1032 209 GLU F CA 4697 C C . GLU C 231 ? 0.4536 0.7684 0.8469 0.0407 -0.2119 -0.0994 209 GLU F C 4698 O O . GLU C 231 ? 0.4520 0.8085 0.8773 0.0356 -0.2224 -0.1200 209 GLU F O 4699 C CB . GLU C 231 ? 0.4314 0.7652 0.9014 0.0792 -0.2271 -0.1084 209 GLU F CB 4700 C CG . GLU C 231 ? 0.5624 0.9147 1.0874 0.0852 -0.2096 -0.1279 209 GLU F CG 4701 C CD . GLU C 231 ? 0.8360 1.1462 1.3364 0.0875 -0.1903 -0.1132 209 GLU F CD 4702 O OE1 . GLU C 231 ? 0.7675 1.0829 1.2853 0.0733 -0.1597 -0.1290 209 GLU F OE1 4703 O OE2 . GLU C 231 ? 0.7737 1.0442 1.2345 0.1007 -0.2046 -0.0874 209 GLU F OE2 4704 N N . SER C 232 ? 0.4156 0.6878 0.7491 0.0355 -0.2100 -0.0762 210 SER F N 4705 C CA . SER C 232 ? 0.4323 0.6966 0.7264 0.0229 -0.2183 -0.0715 210 SER F CA 4706 C C . SER C 232 ? 0.4678 0.7575 0.7740 -0.0004 -0.2008 -0.0930 210 SER F C 4707 O O . SER C 232 ? 0.4416 0.7279 0.7564 -0.0132 -0.1711 -0.1011 210 SER F O 4708 C CB . SER C 232 ? 0.4869 0.7016 0.7238 0.0177 -0.2070 -0.0489 210 SER F CB 4709 O OG . SER C 232 ? 0.6255 0.8294 0.8233 0.0024 -0.2089 -0.0472 210 SER F OG 4710 N N . LYS C 233 ? 0.4437 0.7547 0.7452 -0.0074 -0.2202 -0.1020 211 LYS F N 4711 C CA . LYS C 233 ? 0.4394 0.7747 0.7495 -0.0319 -0.2058 -0.1246 211 LYS F CA 4712 C C . LYS C 233 ? 0.4895 0.7839 0.7480 -0.0513 -0.1805 -0.1157 211 LYS F C 4713 O O . LYS C 233 ? 0.4745 0.7650 0.7369 -0.0691 -0.1510 -0.1275 211 LYS F O 4714 C CB . LYS C 233 ? 0.4982 0.8736 0.8224 -0.0321 -0.2399 -0.1383 211 LYS F CB 4715 C CG . LYS C 233 ? 0.6784 1.1092 1.0572 -0.0474 -0.2326 -0.1734 211 LYS F CG 4716 C CD . LYS C 233 ? 0.7932 1.2713 1.2443 -0.0273 -0.2488 -0.1896 211 LYS F CD 4717 C CE . LYS C 233 ? 0.9294 1.4735 1.4398 -0.0415 -0.2519 -0.2281 211 LYS F CE 4718 N NZ . LYS C 233 ? 1.0745 1.6495 1.5837 -0.0375 -0.2963 -0.2323 211 LYS F NZ 4719 N N . ASP C 234 ? 0.4626 0.7235 0.6726 -0.0484 -0.1908 -0.0959 212 ASP F N 4720 C CA . ASP C 234 ? 0.4664 0.6898 0.6330 -0.0646 -0.1673 -0.0894 212 ASP F CA 4721 C C . ASP C 234 ? 0.4825 0.6709 0.6403 -0.0556 -0.1481 -0.0722 212 ASP F C 4722 O O . ASP C 234 ? 0.4709 0.6511 0.6298 -0.0380 -0.1604 -0.0578 212 ASP F O 4723 C CB . ASP C 234 ? 0.5320 0.7390 0.6501 -0.0716 -0.1850 -0.0823 212 ASP F CB 4724 C CG . ASP C 234 ? 0.6753 0.8492 0.7546 -0.0919 -0.1579 -0.0830 212 ASP F CG 4725 O OD1 . ASP C 234 ? 0.6814 0.8632 0.7671 -0.1102 -0.1389 -0.1005 212 ASP F OD1 4726 O OD2 . ASP C 234 ? 0.7677 0.9070 0.8113 -0.0906 -0.1540 -0.0682 212 ASP F OD2 4727 N N . VAL C 235 ? 0.4215 0.5890 0.5719 -0.0672 -0.1191 -0.0747 213 VAL F N 4728 C CA . VAL C 235 ? 0.3980 0.5357 0.5437 -0.0595 -0.1025 -0.0608 213 VAL F CA 4729 C C . VAL C 235 ? 0.4447 0.5533 0.5664 -0.0701 -0.0827 -0.0601 213 VAL F C 4730 O O . VAL C 235 ? 0.4548 0.5630 0.5675 -0.0865 -0.0726 -0.0734 213 VAL F O 4731 C CB . VAL C 235 ? 0.4269 0.5668 0.5981 -0.0567 -0.0895 -0.0635 213 VAL F CB 4732 C CG1 . VAL C 235 ? 0.4108 0.5746 0.6086 -0.0440 -0.1045 -0.0638 213 VAL F CG1 4733 C CG2 . VAL C 235 ? 0.4327 0.5755 0.6094 -0.0748 -0.0714 -0.0809 213 VAL F CG2 4734 N N . TYR C 236 ? 0.3840 0.4701 0.4999 -0.0613 -0.0757 -0.0474 214 TYR F N 4735 C CA . TYR C 236 ? 0.3869 0.4487 0.4932 -0.0677 -0.0554 -0.0492 214 TYR F CA 4736 C C . TYR C 236 ? 0.4158 0.4653 0.5415 -0.0622 -0.0417 -0.0482 214 TYR F C 4737 O O . TYR C 236 ? 0.3911 0.4435 0.5294 -0.0509 -0.0483 -0.0393 214 TYR F O 4738 C CB . TYR C 236 ? 0.4040 0.4519 0.4982 -0.0627 -0.0551 -0.0399 214 TYR F CB 4739 C CG . TYR C 236 ? 0.4273 0.4567 0.5294 -0.0645 -0.0330 -0.0442 214 TYR F CG 4740 C CD1 . TYR C 236 ? 0.4778 0.4954 0.5661 -0.0804 -0.0158 -0.0576 214 TYR F CD1 4741 C CD2 . TYR C 236 ? 0.4171 0.4421 0.5437 -0.0503 -0.0299 -0.0370 214 TYR F CD2 4742 C CE1 . TYR C 236 ? 0.4917 0.4944 0.5970 -0.0798 0.0057 -0.0650 214 TYR F CE1 4743 C CE2 . TYR C 236 ? 0.4335 0.4461 0.5774 -0.0482 -0.0131 -0.0429 214 TYR F CE2 4744 C CZ . TYR C 236 ? 0.5499 0.5519 0.6864 -0.0619 0.0055 -0.0575 214 TYR F CZ 4745 O OH . TYR C 236 ? 0.5691 0.5609 0.7316 -0.0578 0.0232 -0.0665 214 TYR F OH 4746 N N . ALA C 237 ? 0.3845 0.4155 0.5084 -0.0707 -0.0229 -0.0570 215 ALA F N 4747 C CA . ALA C 237 ? 0.3816 0.3901 0.5159 -0.0647 -0.0122 -0.0539 215 ALA F CA 4748 C C . ALA C 237 ? 0.4443 0.4263 0.5829 -0.0634 0.0051 -0.0581 215 ALA F C 4749 O O . ALA C 237 ? 0.4577 0.4347 0.5875 -0.0772 0.0187 -0.0717 215 ALA F O 4750 C CB . ALA C 237 ? 0.4008 0.4087 0.5308 -0.0767 -0.0065 -0.0627 215 ALA F CB 4751 N N . ASN C 238 ? 0.3952 0.3614 0.5495 -0.0466 0.0036 -0.0478 216 ASN F N 4752 C CA . ASN C 238 ? 0.4105 0.3526 0.5812 -0.0383 0.0162 -0.0512 216 ASN F CA 4753 C C . ASN C 238 ? 0.4686 0.3865 0.6448 -0.0222 0.0075 -0.0374 216 ASN F C 4754 O O . ASN C 238 ? 0.4485 0.3731 0.6405 -0.0063 -0.0067 -0.0267 216 ASN F O 4755 C CB . ASN C 238 ? 0.4047 0.3614 0.5946 -0.0329 0.0181 -0.0547 216 ASN F CB 4756 C CG . ASN C 238 ? 0.6946 0.6344 0.9132 -0.0245 0.0335 -0.0645 216 ASN F CG 4757 O OD1 . ASN C 238 ? 0.6536 0.5667 0.8729 -0.0258 0.0469 -0.0715 216 ASN F OD1 4758 N ND2 . ASN C 238 ? 0.5776 0.5325 0.8236 -0.0162 0.0337 -0.0676 216 ASN F ND2 4759 N N . THR C 239 ? 0.4049 0.4480 0.6155 -0.0383 0.0316 -0.0170 217 THR F N 4760 C CA . THR C 239 ? 0.3726 0.4332 0.6067 -0.0198 0.0174 -0.0333 217 THR F CA 4761 C C . THR C 239 ? 0.4129 0.4860 0.6481 -0.0157 0.0290 -0.0450 217 THR F C 4762 O O . THR C 239 ? 0.3895 0.4719 0.6388 -0.0006 0.0167 -0.0580 217 THR F O 4763 C CB . THR C 239 ? 0.4562 0.5157 0.6684 -0.0074 -0.0039 -0.0324 217 THR F CB 4764 O OG1 . THR C 239 ? 0.4541 0.5078 0.6231 -0.0105 0.0024 -0.0256 217 THR F OG1 4765 C CG2 . THR C 239 ? 0.4441 0.4941 0.6639 -0.0080 -0.0213 -0.0262 217 THR F CG2 4766 N N . GLN C 240 ? 0.3851 0.4566 0.6036 -0.0285 0.0509 -0.0411 218 GLN F N 4767 C CA . GLN C 240 ? 0.3767 0.4597 0.5961 -0.0261 0.0615 -0.0528 218 GLN F CA 4768 C C . GLN C 240 ? 0.4098 0.4934 0.6005 -0.0134 0.0485 -0.0543 218 GLN F C 4769 O O . GLN C 240 ? 0.3925 0.4838 0.5949 -0.0031 0.0424 -0.0674 218 GLN F O 4770 C CB . GLN C 240 ? 0.3851 0.4816 0.6569 -0.0220 0.0632 -0.0721 218 GLN F CB 4771 C CG . GLN C 240 ? 0.6160 0.7236 0.8981 -0.0293 0.0832 -0.0835 218 GLN F CG 4772 C CD . GLN C 240 ? 0.8901 1.0103 1.2315 -0.0275 0.0856 -0.1044 218 GLN F CD 4773 O OE1 . GLN C 240 ? 0.8262 0.9500 1.1919 -0.0111 0.0668 -0.1208 218 GLN F OE1 4774 N NE2 . GLN C 240 ? 0.8166 0.9423 1.1822 -0.0442 0.1090 -0.1051 218 GLN F NE2 4775 N N . LEU C 241 ? 0.3693 0.4424 0.5231 -0.0146 0.0435 -0.0412 219 LEU F N 4776 C CA . LEU C 241 ? 0.3562 0.4291 0.4839 -0.0055 0.0336 -0.0408 219 LEU F CA 4777 C C . LEU C 241 ? 0.4084 0.4837 0.5186 -0.0081 0.0448 -0.0430 219 LEU F C 4778 O O . LEU C 241 ? 0.4202 0.4896 0.5105 -0.0176 0.0571 -0.0361 219 LEU F O 4779 C CB . LEU C 241 ? 0.3623 0.4244 0.4650 -0.0064 0.0243 -0.0296 219 LEU F CB 4780 C CG . LEU C 241 ? 0.4131 0.4757 0.4927 0.0010 0.0158 -0.0294 219 LEU F CG 4781 C CD1 . LEU C 241 ? 0.3984 0.4705 0.4908 0.0133 0.0044 -0.0379 219 LEU F CD1 4782 C CD2 . LEU C 241 ? 0.4541 0.5055 0.5145 -0.0014 0.0076 -0.0218 219 LEU F CD2 4783 N N . VAL C 242 ? 0.3514 0.4337 0.4686 0.0011 0.0389 -0.0532 220 VAL F N 4784 C CA . VAL C 242 ? 0.3489 0.4343 0.4552 0.0011 0.0444 -0.0580 220 VAL F CA 4785 C C . VAL C 242 ? 0.3862 0.4681 0.4760 0.0104 0.0313 -0.0572 220 VAL F C 4786 O O . VAL C 242 ? 0.3742 0.4554 0.4730 0.0193 0.0198 -0.0625 220 VAL F O 4787 C CB . VAL C 242 ? 0.3968 0.4925 0.5336 0.0009 0.0508 -0.0741 220 VAL F CB 4788 C CG1 . VAL C 242 ? 0.3959 0.4958 0.5229 0.0016 0.0537 -0.0806 220 VAL F CG1 4789 C CG2 . VAL C 242 ? 0.4052 0.5057 0.5620 -0.0106 0.0677 -0.0751 220 VAL F CG2 4790 N N . LEU C 243 ? 0.3429 0.4211 0.4078 0.0083 0.0331 -0.0508 221 LEU F N 4791 C CA . LEU C 243 ? 0.3342 0.4087 0.3844 0.0141 0.0238 -0.0485 221 LEU F CA 4792 C C . LEU C 243 ? 0.3759 0.4511 0.4313 0.0183 0.0198 -0.0572 221 LEU F C 4793 O O . LEU C 243 ? 0.3740 0.4543 0.4362 0.0156 0.0260 -0.0638 221 LEU F O 4794 C CB . LEU C 243 ? 0.3400 0.4096 0.3681 0.0106 0.0258 -0.0398 221 LEU F CB 4795 C CG . LEU C 243 ? 0.4008 0.4662 0.4210 0.0099 0.0214 -0.0330 221 LEU F CG 4796 C CD1 . LEU C 243 ? 0.4041 0.4703 0.4375 0.0087 0.0203 -0.0327 221 LEU F CD1 4797 C CD2 . LEU C 243 ? 0.4425 0.5000 0.4447 0.0063 0.0229 -0.0280 221 LEU F CD2 4798 N N . GLN C 244 ? 0.3260 0.3948 0.3766 0.0251 0.0088 -0.0579 222 GLN F N 4799 C CA . GLN C 244 ? 0.3257 0.3887 0.3780 0.0299 0.0000 -0.0654 222 GLN F CA 4800 C C . GLN C 244 ? 0.3734 0.4289 0.4057 0.0290 -0.0036 -0.0576 222 GLN F C 4801 O O . GLN C 244 ? 0.3668 0.4214 0.3854 0.0262 -0.0001 -0.0476 222 GLN F O 4802 C CB . GLN C 244 ? 0.3478 0.4023 0.4058 0.0389 -0.0122 -0.0722 222 GLN F CB 4803 C CG . GLN C 244 ? 0.5194 0.5811 0.6064 0.0412 -0.0113 -0.0836 222 GLN F CG 4804 C CD . GLN C 244 ? 0.7572 0.8086 0.8493 0.0528 -0.0261 -0.0912 222 GLN F CD 4805 O OE1 . GLN C 244 ? 0.7030 0.7427 0.7710 0.0583 -0.0341 -0.0847 222 GLN F OE1 4806 N NE2 . GLN C 244 ? 0.6613 0.7167 0.7856 0.0569 -0.0295 -0.1064 222 GLN F NE2 4807 N N . ARG C 245 ? 0.3314 0.3812 0.3656 0.0313 -0.0117 -0.0636 223 ARG F N 4808 C CA . ARG C 245 ? 0.3347 0.3754 0.3546 0.0300 -0.0170 -0.0567 223 ARG F CA 4809 C C . ARG C 245 ? 0.3966 0.4220 0.3968 0.0315 -0.0223 -0.0478 223 ARG F C 4810 O O . ARG C 245 ? 0.4014 0.4160 0.3983 0.0375 -0.0314 -0.0524 223 ARG F O 4811 C CB . ARG C 245 ? 0.3394 0.3772 0.3696 0.0328 -0.0276 -0.0671 223 ARG F CB 4812 C CG . ARG C 245 ? 0.4657 0.4936 0.4857 0.0310 -0.0346 -0.0600 223 ARG F CG 4813 C CD . ARG C 245 ? 0.5831 0.6089 0.6165 0.0347 -0.0483 -0.0722 223 ARG F CD 4814 N NE . ARG C 245 ? 0.6840 0.6964 0.7091 0.0331 -0.0581 -0.0642 223 ARG F NE 4815 C CZ . ARG C 245 ? 0.8551 0.8750 0.8848 0.0308 -0.0551 -0.0610 223 ARG F CZ 4816 N NH1 . ARG C 245 ? 0.6869 0.7251 0.7230 0.0306 -0.0431 -0.0647 223 ARG F NH1 4817 N NH2 . ARG C 245 ? 0.6940 0.7006 0.7209 0.0290 -0.0651 -0.0541 223 ARG F NH2 4818 N N . PRO C 246 ? 0.3558 0.3795 0.3428 0.0264 -0.0166 -0.0364 224 PRO F N 4819 C CA . PRO C 246 ? 0.3705 0.3812 0.3366 0.0260 -0.0174 -0.0281 224 PRO F CA 4820 C C . PRO C 246 ? 0.4458 0.4332 0.3966 0.0279 -0.0301 -0.0264 224 PRO F C 4821 O O . PRO C 246 ? 0.4426 0.4253 0.4018 0.0277 -0.0386 -0.0299 224 PRO F O 4822 C CB . PRO C 246 ? 0.3881 0.4058 0.3521 0.0185 -0.0066 -0.0197 224 PRO F CB 4823 C CG . PRO C 246 ? 0.4323 0.4574 0.4116 0.0167 -0.0069 -0.0227 224 PRO F CG 4824 C CD . PRO C 246 ? 0.3654 0.3985 0.3567 0.0211 -0.0089 -0.0323 224 PRO F CD 4825 N N . ALA C 247 ? 0.4247 0.3959 0.3511 0.0304 -0.0328 -0.0215 225 ALA F N 4826 C CA . ALA C 247 ? 0.4561 0.3972 0.3576 0.0324 -0.0462 -0.0176 225 ALA F CA 4827 C C . ALA C 247 ? 0.5196 0.4502 0.4120 0.0223 -0.0433 -0.0055 225 ALA F C 4828 O O . ALA C 247 ? 0.5014 0.4477 0.4018 0.0142 -0.0281 0.0008 225 ALA F O 4829 C CB . ALA C 247 ? 0.4906 0.4168 0.3619 0.0374 -0.0465 -0.0140 225 ALA F CB 4830 N N . ALA C 248 ? 0.5032 0.4060 0.3819 0.0232 -0.0600 -0.0035 226 ALA F N 4831 C CA . ALA C 248 ? 0.5190 0.4065 0.3907 0.0137 -0.0616 0.0082 226 ALA F CA 4832 C C . ALA C 248 ? 0.5848 0.4689 0.4351 0.0025 -0.0421 0.0244 226 ALA F C 4833 O O . ALA C 248 ? 0.6084 0.4754 0.4244 0.0029 -0.0385 0.0308 226 ALA F O 4834 C CB . ALA C 248 ? 0.5643 0.4154 0.4174 0.0176 -0.0861 0.0080 226 ALA F CB 4835 N N . GLY C 249 ? 0.5226 0.4244 0.3952 -0.0065 -0.0295 0.0284 227 GLY F N 4836 C CA . GLY C 249 ? 0.5317 0.4368 0.3970 -0.0187 -0.0089 0.0399 227 GLY F CA 4837 C C . GLY C 249 ? 0.5711 0.4942 0.4288 -0.0179 0.0082 0.0374 227 GLY F C 4838 O O . GLY C 249 ? 0.5889 0.5092 0.4296 -0.0270 0.0247 0.0459 227 GLY F O 4839 N N . THR C 250 ? 0.4943 0.4368 0.3664 -0.0077 0.0047 0.0252 228 THR F N 4840 C CA . THR C 250 ? 0.4803 0.4403 0.3494 -0.0045 0.0156 0.0203 228 THR F CA 4841 C C . THR C 250 ? 0.4867 0.4769 0.3901 -0.0037 0.0215 0.0112 228 THR F C 4842 O O . THR C 250 ? 0.4576 0.4545 0.3798 0.0014 0.0125 0.0045 228 THR F O 4843 C CB . THR C 250 ? 0.5832 0.5313 0.4332 0.0079 0.0030 0.0149 228 THR F CB 4844 O OG1 . THR C 250 ? 0.6256 0.5400 0.4374 0.0078 -0.0041 0.0236 228 THR F OG1 4845 C CG2 . THR C 250 ? 0.5512 0.5173 0.4009 0.0135 0.0103 0.0084 228 THR F CG2 4846 N N . VAL C 251 ? 0.4383 0.4454 0.3479 -0.0087 0.0361 0.0098 229 VAL F N 4847 C CA . VAL C 251 ? 0.4040 0.4350 0.3421 -0.0072 0.0387 0.0003 229 VAL F CA 4848 C C . VAL C 251 ? 0.4434 0.4841 0.3779 0.0013 0.0360 -0.0068 229 VAL F C 4849 O O . VAL C 251 ? 0.4486 0.4947 0.3719 0.0012 0.0434 -0.0081 229 VAL F O 4850 C CB . VAL C 251 ? 0.4500 0.4948 0.4064 -0.0162 0.0519 -0.0019 229 VAL F CB 4851 C CG1 . VAL C 251 ? 0.4186 0.4802 0.4025 -0.0126 0.0477 -0.0127 229 VAL F CG1 4852 C CG2 . VAL C 251 ? 0.4617 0.4949 0.4225 -0.0254 0.0555 0.0060 229 VAL F CG2 4853 N N . HIS C 252 ? 0.3815 0.4244 0.3262 0.0084 0.0256 -0.0117 230 HIS F N 4854 C CA . HIS C 252 ? 0.3682 0.4193 0.3168 0.0164 0.0204 -0.0186 230 HIS F CA 4855 C C . HIS C 252 ? 0.3954 0.4500 0.3614 0.0190 0.0138 -0.0224 230 HIS F C 4856 O O . HIS C 252 ? 0.3852 0.4349 0.3555 0.0165 0.0124 -0.0207 230 HIS F O 4857 C CB . HIS C 252 ? 0.3981 0.4369 0.3251 0.0240 0.0148 -0.0184 230 HIS F CB 4858 C CG . HIS C 252 ? 0.4471 0.4693 0.3702 0.0295 0.0030 -0.0190 230 HIS F CG 4859 N ND1 . HIS C 252 ? 0.4747 0.4906 0.3948 0.0402 -0.0076 -0.0256 230 HIS F ND1 4860 C CD2 . HIS C 252 ? 0.4718 0.4833 0.3968 0.0265 -0.0015 -0.0165 230 HIS F CD2 4861 C CE1 . HIS C 252 ? 0.4723 0.4742 0.3941 0.0429 -0.0175 -0.0279 230 HIS F CE1 4862 N NE2 . HIS C 252 ? 0.4747 0.4743 0.3992 0.0349 -0.0144 -0.0227 230 HIS F NE2 4863 N N . VAL C 253 ? 0.3409 0.4041 0.3171 0.0237 0.0103 -0.0279 231 VAL F N 4864 C CA . VAL C 253 ? 0.3249 0.3902 0.3150 0.0242 0.0072 -0.0304 231 VAL F CA 4865 C C . VAL C 253 ? 0.3723 0.4352 0.3679 0.0312 0.0008 -0.0352 231 VAL F C 4866 O O . VAL C 253 ? 0.3600 0.4294 0.3652 0.0347 -0.0024 -0.0388 231 VAL F O 4867 C CB . VAL C 253 ? 0.3641 0.4375 0.3643 0.0213 0.0079 -0.0319 231 VAL F CB 4868 C CG1 . VAL C 253 ? 0.3582 0.4287 0.3642 0.0195 0.0077 -0.0316 231 VAL F CG1 4869 C CG2 . VAL C 253 ? 0.3626 0.4382 0.3622 0.0166 0.0116 -0.0312 231 VAL F CG2 4870 N N . PRO C 254 ? 0.3360 0.3889 0.3290 0.0340 -0.0035 -0.0371 232 PRO F N 4871 C CA . PRO C 254 ? 0.3336 0.3839 0.3380 0.0418 -0.0113 -0.0453 232 PRO F CA 4872 C C . PRO C 254 ? 0.3662 0.4254 0.3939 0.0387 -0.0077 -0.0495 232 PRO F C 4873 O O . PRO C 254 ? 0.3563 0.4185 0.3855 0.0318 -0.0007 -0.0470 232 PRO F O 4874 C CB . PRO C 254 ? 0.3714 0.4063 0.3665 0.0454 -0.0190 -0.0479 232 PRO F CB 4875 C CG . PRO C 254 ? 0.4279 0.4617 0.4166 0.0376 -0.0138 -0.0418 232 PRO F CG 4876 C CD . PRO C 254 ? 0.3641 0.4073 0.3482 0.0311 -0.0040 -0.0342 232 PRO F CD 4877 N N . TYR C 255 ? 0.3166 0.3793 0.3621 0.0438 -0.0121 -0.0559 233 TYR F N 4878 C CA . TYR C 255 ? 0.3048 0.3748 0.3737 0.0391 -0.0067 -0.0589 233 TYR F CA 4879 C C . TYR C 255 ? 0.3513 0.4219 0.4468 0.0466 -0.0140 -0.0702 233 TYR F C 4880 O O . TYR C 255 ? 0.3503 0.4161 0.4441 0.0574 -0.0257 -0.0750 233 TYR F O 4881 C CB . TYR C 255 ? 0.3142 0.3891 0.3809 0.0329 -0.0024 -0.0510 233 TYR F CB 4882 C CG . TYR C 255 ? 0.3322 0.4102 0.4021 0.0396 -0.0115 -0.0521 233 TYR F CG 4883 C CD1 . TYR C 255 ? 0.3525 0.4339 0.4461 0.0423 -0.0169 -0.0564 233 TYR F CD1 4884 C CD2 . TYR C 255 ? 0.3444 0.4233 0.3960 0.0429 -0.0144 -0.0501 233 TYR F CD2 4885 C CE1 . TYR C 255 ? 0.3596 0.4455 0.4584 0.0501 -0.0278 -0.0595 233 TYR F CE1 4886 C CE2 . TYR C 255 ? 0.3546 0.4395 0.4098 0.0499 -0.0225 -0.0539 233 TYR F CE2 4887 C CZ . TYR C 255 ? 0.4410 0.5296 0.5197 0.0544 -0.0306 -0.0590 233 TYR F CZ 4888 O OH . TYR C 255 ? 0.4474 0.5433 0.5317 0.0628 -0.0409 -0.0646 233 TYR F OH 4889 N N . SER C 256 ? 0.3040 0.3804 0.4243 0.0408 -0.0065 -0.0753 234 SER F N 4890 C CA . SER C 256 ? 0.2997 0.3790 0.4553 0.0457 -0.0110 -0.0876 234 SER F CA 4891 C C . SER C 256 ? 0.3431 0.4284 0.5141 0.0371 -0.0033 -0.0812 234 SER F C 4892 O O . SER C 256 ? 0.3414 0.4281 0.5027 0.0246 0.0105 -0.0723 234 SER F O 4893 C CB . SER C 256 ? 0.3476 0.4295 0.5249 0.0444 -0.0071 -0.1012 234 SER F CB 4894 O OG . SER C 256 ? 0.4661 0.5556 0.6415 0.0309 0.0108 -0.0966 234 SER F OG 4895 N N . GLN C 257 ? 0.2933 0.3794 0.4847 0.0445 -0.0141 -0.0854 235 GLN F N 4896 C CA . GLN C 257 ? 0.2886 0.3773 0.4965 0.0373 -0.0113 -0.0791 235 GLN F CA 4897 C C . GLN C 257 ? 0.3340 0.4254 0.5825 0.0469 -0.0234 -0.0912 235 GLN F C 4898 O O . GLN C 257 ? 0.3264 0.4158 0.5770 0.0630 -0.0395 -0.1012 235 GLN F O 4899 C CB . GLN C 257 ? 0.3036 0.3901 0.4844 0.0371 -0.0171 -0.0675 235 GLN F CB 4900 C CG . GLN C 257 ? 0.4659 0.5492 0.6518 0.0264 -0.0145 -0.0576 235 GLN F CG 4901 C CD . GLN C 257 ? 0.6745 0.7557 0.8386 0.0284 -0.0245 -0.0511 235 GLN F CD 4902 O OE1 . GLN C 257 ? 0.6024 0.6890 0.7589 0.0396 -0.0351 -0.0564 235 GLN F OE1 4903 N NE2 . GLN C 257 ? 0.5771 0.6494 0.7308 0.0175 -0.0219 -0.0407 235 GLN F NE2 4904 N N . ALA C 258 ? 0.2940 0.3879 0.5737 0.0371 -0.0159 -0.0901 236 ALA F N 4905 C CA . ALA C 258 ? 0.2881 0.3850 0.6146 0.0449 -0.0273 -0.1016 236 ALA F CA 4906 C C . ALA C 258 ? 0.3351 0.4309 0.6571 0.0557 -0.0471 -0.0985 236 ALA F C 4907 O O . ALA C 258 ? 0.3337 0.4268 0.6341 0.0473 -0.0454 -0.0845 236 ALA F O 4908 C CB . ALA C 258 ? 0.3047 0.4035 0.6634 0.0280 -0.0109 -0.0983 236 ALA F CB 4909 N N . PRO C 259 ? 0.2879 0.3851 0.6280 0.0756 -0.0677 -0.1130 237 PRO F N 4910 C CA . PRO C 259 ? 0.2827 0.3821 0.6180 0.0873 -0.0867 -0.1126 237 PRO F CA 4911 C C . PRO C 259 ? 0.3308 0.4319 0.6941 0.0795 -0.0913 -0.1063 237 PRO F C 4912 O O . PRO C 259 ? 0.3281 0.4274 0.7234 0.0674 -0.0813 -0.1044 237 PRO F O 4913 C CB . PRO C 259 ? 0.3050 0.4034 0.6566 0.1107 -0.1068 -0.1317 237 PRO F CB 4914 C CG . PRO C 259 ? 0.3618 0.4574 0.7468 0.1096 -0.1012 -0.1435 237 PRO F CG 4915 C CD . PRO C 259 ? 0.3074 0.4028 0.6712 0.0898 -0.0766 -0.1324 237 PRO F CD 4916 N N . SER C 260 ? 0.5514 0.3191 0.5603 -0.0101 -0.0735 0.0564 238 SER F N 4917 C CA . SER C 260 ? 0.4923 0.3163 0.5294 -0.0133 -0.0732 0.0473 238 SER F CA 4918 C C . SER C 260 ? 0.5174 0.3703 0.5842 0.0051 -0.0938 0.0540 238 SER F C 4919 O O . SER C 260 ? 0.5375 0.3743 0.5878 0.0111 -0.1122 0.0665 238 SER F O 4920 C CB . SER C 260 ? 0.5420 0.3657 0.5509 -0.0346 -0.0637 0.0423 238 SER F CB 4921 O OG . SER C 260 ? 0.5986 0.4719 0.6368 -0.0350 -0.0639 0.0335 238 SER F OG 4922 N N . GLY C 261 ? 0.4303 0.3235 0.5370 0.0113 -0.0900 0.0445 239 GLY F N 4923 C CA . GLY C 261 ? 0.4001 0.3245 0.5385 0.0240 -0.1029 0.0455 239 GLY F CA 4924 C C . GLY C 261 ? 0.4345 0.3770 0.5645 0.0176 -0.1093 0.0475 239 GLY F C 4925 O O . GLY C 261 ? 0.4242 0.3780 0.5652 0.0254 -0.1241 0.0521 239 GLY F O 4926 N N . PHE C 262 ? 0.3853 0.3322 0.4993 0.0028 -0.0973 0.0415 240 PHE F N 4927 C CA . PHE C 262 ? 0.3721 0.3326 0.4788 -0.0047 -0.0985 0.0402 240 PHE F CA 4928 C C . PHE C 262 ? 0.4623 0.3939 0.5338 -0.0107 -0.1075 0.0496 240 PHE F C 4929 O O . PHE C 262 ? 0.4540 0.3949 0.5242 -0.0106 -0.1173 0.0524 240 PHE F O 4930 C CB . PHE C 262 ? 0.3805 0.3547 0.4886 -0.0165 -0.0833 0.0280 240 PHE F CB 4931 C CG . PHE C 262 ? 0.3936 0.3785 0.4982 -0.0241 -0.0807 0.0232 240 PHE F CG 4932 C CD1 . PHE C 262 ? 0.4072 0.4138 0.5302 -0.0171 -0.0864 0.0231 240 PHE F CD1 4933 C CD2 . PHE C 262 ? 0.4438 0.4142 0.5264 -0.0404 -0.0691 0.0165 240 PHE F CD2 4934 C CE1 . PHE C 262 ? 0.4174 0.4304 0.5392 -0.0234 -0.0820 0.0172 240 PHE F CE1 4935 C CE2 . PHE C 262 ? 0.4767 0.4573 0.5607 -0.0482 -0.0631 0.0085 240 PHE F CE2 4936 C CZ . PHE C 262 ? 0.4273 0.4291 0.5323 -0.0383 -0.0702 0.0091 240 PHE F CZ 4937 N N . LYS C 263 ? 0.4649 0.3569 0.5024 -0.0181 -0.1040 0.0543 241 LYS F N 4938 C CA . LYS C 263 ? 0.5190 0.3701 0.5081 -0.0265 -0.1135 0.0656 241 LYS F CA 4939 C C . LYS C 263 ? 0.5890 0.4360 0.5843 -0.0080 -0.1417 0.0794 241 LYS F C 4940 O O . LYS C 263 ? 0.6102 0.4461 0.5785 -0.0126 -0.1569 0.0869 241 LYS F O 4941 C CB . LYS C 263 ? 0.6031 0.4045 0.5506 -0.0383 -0.1022 0.0683 241 LYS F CB 4942 C CG . LYS C 263 ? 0.7985 0.5980 0.7284 -0.0641 -0.0749 0.0526 241 LYS F CG 4943 C CD . LYS C 263 ? 1.0005 0.7408 0.8768 -0.0814 -0.0624 0.0556 241 LYS F CD 4944 C CE . LYS C 263 ? 1.2056 0.9041 1.0193 -0.1052 -0.0577 0.0589 241 LYS F CE 4945 N NZ . LYS C 263 ? 1.3039 1.0295 1.1263 -0.1292 -0.0304 0.0354 241 LYS F NZ 4946 N N . TYR C 264 ? 0.5335 0.3926 0.5676 0.0118 -0.1484 0.0800 242 TYR F N 4947 C CA . TYR C 264 ? 0.5403 0.4066 0.5989 0.0324 -0.1744 0.0877 242 TYR F CA 4948 C C . TYR C 264 ? 0.5470 0.4593 0.6353 0.0330 -0.1811 0.0811 242 TYR F C 4949 O O . TYR C 264 ? 0.5623 0.4754 0.6449 0.0371 -0.2043 0.0878 242 TYR F O 4950 C CB . TYR C 264 ? 0.5499 0.4201 0.6495 0.0508 -0.1724 0.0839 242 TYR F CB 4951 C CG . TYR C 264 ? 0.5869 0.4681 0.7233 0.0742 -0.1988 0.0878 242 TYR F CG 4952 C CD1 . TYR C 264 ? 0.6733 0.5144 0.7846 0.0865 -0.2264 0.1041 242 TYR F CD1 4953 C CD2 . TYR C 264 ? 0.5531 0.4839 0.7496 0.0835 -0.1968 0.0740 242 TYR F CD2 4954 C CE1 . TYR C 264 ? 0.6967 0.5540 0.8508 0.1111 -0.2551 0.1058 242 TYR F CE1 4955 C CE2 . TYR C 264 ? 0.5735 0.5225 0.8145 0.1043 -0.2197 0.0724 242 TYR F CE2 4956 C CZ . TYR C 264 ? 0.7273 0.6429 0.9518 0.1199 -0.2507 0.0880 242 TYR F CZ 4957 O OH . TYR C 264 ? 0.7565 0.6957 1.0332 0.1433 -0.2776 0.0848 242 TYR F OH 4958 N N . TRP C 265 ? 0.4525 0.3990 0.5670 0.0272 -0.1617 0.0682 243 TRP F N 4959 C CA . TRP C 265 ? 0.4170 0.3995 0.5542 0.0251 -0.1631 0.0612 243 TRP F CA 4960 C C . TRP C 265 ? 0.4839 0.4588 0.5868 0.0108 -0.1679 0.0641 243 TRP F C 4961 O O . TRP C 265 ? 0.4760 0.4689 0.5887 0.0110 -0.1804 0.0628 243 TRP F O 4962 C CB . TRP C 265 ? 0.3580 0.3653 0.5184 0.0217 -0.1424 0.0498 243 TRP F CB 4963 C CG . TRP C 265 ? 0.3471 0.3798 0.5209 0.0171 -0.1409 0.0436 243 TRP F CG 4964 C CD1 . TRP C 265 ? 0.3729 0.4292 0.5769 0.0219 -0.1469 0.0382 243 TRP F CD1 4965 C CD2 . TRP C 265 ? 0.3375 0.3716 0.4950 0.0056 -0.1317 0.0405 243 TRP F CD2 4966 N NE1 . TRP C 265 ? 0.3539 0.4221 0.5555 0.0122 -0.1410 0.0330 243 TRP F NE1 4967 C CE2 . TRP C 265 ? 0.3736 0.4271 0.5474 0.0039 -0.1322 0.0350 243 TRP F CE2 4968 C CE3 . TRP C 265 ? 0.3584 0.3798 0.4932 -0.0036 -0.1213 0.0391 243 TRP F CE3 4969 C CZ2 . TRP C 265 ? 0.3604 0.4148 0.5244 -0.0052 -0.1234 0.0308 243 TRP F CZ2 4970 C CZ3 . TRP C 265 ? 0.3688 0.3968 0.5016 -0.0107 -0.1134 0.0332 243 TRP F CZ3 4971 C CH2 . TRP C 265 ? 0.3673 0.4086 0.5126 -0.0107 -0.1148 0.0303 243 TRP F CH2 4972 N N . LEU C 266 ? 0.4623 0.4110 0.5258 -0.0039 -0.1560 0.0652 244 LEU F N 4973 C CA . LEU C 266 ? 0.4842 0.4206 0.5108 -0.0218 -0.1543 0.0645 244 LEU F CA 4974 C C . LEU C 266 ? 0.5827 0.5016 0.5800 -0.0229 -0.1804 0.0755 244 LEU F C 4975 O O . LEU C 266 ? 0.5867 0.5105 0.5676 -0.0356 -0.1828 0.0720 244 LEU F O 4976 C CB . LEU C 266 ? 0.5076 0.4161 0.4994 -0.0387 -0.1344 0.0608 244 LEU F CB 4977 C CG . LEU C 266 ? 0.5486 0.4726 0.5452 -0.0530 -0.1124 0.0457 244 LEU F CG 4978 C CD1 . LEU C 266 ? 0.4968 0.4570 0.5425 -0.0412 -0.1032 0.0366 244 LEU F CD1 4979 C CD2 . LEU C 266 ? 0.6151 0.5120 0.5783 -0.0727 -0.0929 0.0388 244 LEU F CD2 4980 N N . LYS C 267 ? 0.5745 0.4720 0.5656 -0.0090 -0.2014 0.0881 245 LYS F N 4981 C CA . LYS C 267 ? 0.6243 0.5032 0.5887 -0.0052 -0.2343 0.1009 245 LYS F CA 4982 C C . LYS C 267 ? 0.6491 0.5709 0.6720 0.0158 -0.2573 0.0979 245 LYS F C 4983 O O . LYS C 267 ? 0.6733 0.5990 0.6872 0.0169 -0.2855 0.1026 245 LYS F O 4984 C CB . LYS C 267 ? 0.7212 0.5423 0.6392 -0.0014 -0.2461 0.1175 245 LYS F CB 4985 C CG . LYS C 267 ? 1.0044 0.7862 0.8649 -0.0051 -0.2797 0.1341 245 LYS F CG 4986 C CD . LYS C 267 ? 1.2074 0.9271 1.0271 0.0056 -0.2962 0.1533 245 LYS F CD 4987 C CE . LYS C 267 ? 1.3421 1.0767 1.2160 0.0413 -0.3272 0.1599 245 LYS F CE 4988 N NZ . LYS C 267 ? 1.5227 1.1914 1.3602 0.0536 -0.3382 0.1775 245 LYS F NZ 4989 N N . GLU C 268 ? 0.5559 0.5108 0.6378 0.0296 -0.2443 0.0877 246 GLU F N 4990 C CA . GLU C 268 ? 0.5287 0.5266 0.6731 0.0467 -0.2584 0.0793 246 GLU F CA 4991 C C . GLU C 268 ? 0.5238 0.5668 0.7011 0.0368 -0.2435 0.0627 246 GLU F C 4992 O O . GLU C 268 ? 0.5052 0.5851 0.7307 0.0451 -0.2541 0.0526 246 GLU F O 4993 C CB . GLU C 268 ? 0.5334 0.5340 0.7199 0.0661 -0.2520 0.0762 246 GLU F CB 4994 C CG . GLU C 268 ? 0.7310 0.6853 0.8936 0.0802 -0.2689 0.0917 246 GLU F CG 4995 C CD . GLU C 268 ? 1.0757 1.0205 1.2395 0.0977 -0.3109 0.1029 246 GLU F CD 4996 O OE1 . GLU C 268 ? 1.0135 1.0045 1.2335 0.1096 -0.3279 0.0924 246 GLU F OE1 4997 O OE2 . GLU C 268 ? 1.0738 0.9630 1.1820 0.0993 -0.3275 0.1216 246 GLU F OE2 4998 N N . ARG C 269 ? 0.4535 0.4920 0.6070 0.0191 -0.2188 0.0584 247 ARG F N 4999 C CA . ARG C 269 ? 0.4120 0.4799 0.5865 0.0091 -0.2019 0.0448 247 ARG F CA 5000 C C . ARG C 269 ? 0.4625 0.5552 0.6476 0.0019 -0.2164 0.0376 247 ARG F C 5001 O O . ARG C 269 ? 0.4330 0.5550 0.6522 -0.0013 -0.2057 0.0242 247 ARG F O 5002 C CB . ARG C 269 ? 0.3958 0.4481 0.5419 -0.0048 -0.1773 0.0430 247 ARG F CB 5003 C CG . ARG C 269 ? 0.5347 0.5585 0.6304 -0.0194 -0.1788 0.0485 247 ARG F CG 5004 C CD . ARG C 269 ? 0.6192 0.6304 0.7012 -0.0276 -0.1538 0.0442 247 ARG F CD 5005 N NE . ARG C 269 ? 0.7411 0.7223 0.7763 -0.0434 -0.1503 0.0465 247 ARG F NE 5006 C CZ . ARG C 269 ? 0.9226 0.8989 0.9393 -0.0602 -0.1363 0.0376 247 ARG F CZ 5007 N NH1 . ARG C 269 ? 0.7404 0.7371 0.7813 -0.0609 -0.1262 0.0278 247 ARG F NH1 5008 N NH2 . ARG C 269 ? 0.7929 0.7397 0.7649 -0.0779 -0.1297 0.0371 247 ARG F NH2 5009 N N . GLY C 270 ? 0.4521 0.5305 0.6035 -0.0033 -0.2395 0.0457 248 GLY F N 5010 C CA . GLY C 270 ? 0.4611 0.5624 0.6160 -0.0131 -0.2566 0.0385 248 GLY F CA 5011 C C . GLY C 270 ? 0.4949 0.5944 0.6266 -0.0362 -0.2339 0.0290 248 GLY F C 5012 O O . GLY C 270 ? 0.4844 0.5583 0.5879 -0.0438 -0.2111 0.0313 248 GLY F O 5013 N N . ALA C 271 ? 0.4474 0.5753 0.5949 -0.0474 -0.2393 0.0162 249 ALA F N 5014 C CA . ALA C 271 ? 0.4419 0.5663 0.5694 -0.0700 -0.2173 0.0051 249 ALA F CA 5015 C C . ALA C 271 ? 0.4478 0.5750 0.5991 -0.0694 -0.1844 -0.0034 249 ALA F C 5016 O O . ALA C 271 ? 0.4179 0.5680 0.6113 -0.0598 -0.1806 -0.0094 249 ALA F O 5017 C CB . ALA C 271 ? 0.4691 0.6223 0.6057 -0.0840 -0.2335 -0.0075 249 ALA F CB 5018 N N . SER C 272 ? 0.4012 0.5026 0.5242 -0.0800 -0.1609 -0.0046 250 SER F N 5019 C CA . SER C 272 ? 0.3730 0.4675 0.5089 -0.0783 -0.1336 -0.0098 250 SER F CA 5020 C C . SER C 272 ? 0.4212 0.5279 0.5700 -0.0923 -0.1216 -0.0247 250 SER F C 5021 O O . SER C 272 ? 0.4325 0.5569 0.5816 -0.1055 -0.1332 -0.0333 250 SER F O 5022 C CB . SER C 272 ? 0.4213 0.4858 0.5301 -0.0810 -0.1164 -0.0072 250 SER F CB 5023 O OG . SER C 272 ? 0.5568 0.6093 0.6369 -0.1002 -0.1111 -0.0147 250 SER F OG 5024 N N . LEU C 273 ? 0.3638 0.4578 0.5194 -0.0909 -0.0991 -0.0280 251 LEU F N 5025 C CA . LEU C 273 ? 0.3688 0.4626 0.5293 -0.1060 -0.0820 -0.0416 251 LEU F CA 5026 C C . LEU C 273 ? 0.4444 0.5269 0.5817 -0.1261 -0.0741 -0.0516 251 LEU F C 5027 O O . LEU C 273 ? 0.4529 0.5466 0.5968 -0.1434 -0.0673 -0.0661 251 LEU F O 5028 C CB . LEU C 273 ? 0.3659 0.4335 0.5235 -0.1001 -0.0611 -0.0388 251 LEU F CB 5029 C CG . LEU C 273 ? 0.4097 0.4902 0.5895 -0.0917 -0.0611 -0.0376 251 LEU F CG 5030 C CD1 . LEU C 273 ? 0.4170 0.4635 0.5792 -0.0833 -0.0474 -0.0288 251 LEU F CD1 5031 C CD2 . LEU C 273 ? 0.4472 0.5513 0.6494 -0.1079 -0.0538 -0.0551 251 LEU F CD2 5032 N N . GLN C 274 ? 0.4106 0.4724 0.5216 -0.1267 -0.0731 -0.0469 252 GLN F N 5033 C CA . GLN C 274 ? 0.4370 0.4848 0.5220 -0.1475 -0.0634 -0.0578 252 GLN F CA 5034 C C . GLN C 274 ? 0.5000 0.5762 0.5815 -0.1656 -0.0826 -0.0665 252 GLN F C 5035 O O . GLN C 274 ? 0.5212 0.5941 0.5890 -0.1882 -0.0724 -0.0813 252 GLN F O 5036 C CB . GLN C 274 ? 0.4632 0.4885 0.5248 -0.1448 -0.0593 -0.0526 252 GLN F CB 5037 C CG . GLN C 274 ? 0.6965 0.7065 0.7261 -0.1692 -0.0491 -0.0652 252 GLN F CG 5038 C CD . GLN C 274 ? 0.9611 0.9485 0.9900 -0.1797 -0.0209 -0.0797 252 GLN F CD 5039 O OE1 . GLN C 274 ? 0.9028 0.8675 0.9430 -0.1659 -0.0033 -0.0788 252 GLN F OE1 5040 N NE2 . GLN C 274 ? 0.8839 0.8751 0.8987 -0.2046 -0.0171 -0.0939 252 GLN F NE2 5041 N N . HIS C 275 ? 0.4417 0.5452 0.5375 -0.1548 -0.1114 -0.0582 253 HIS F N 5042 C CA . HIS C 275 ? 0.4558 0.5900 0.5535 -0.1654 -0.1394 -0.0637 253 HIS F CA 5043 C C . HIS C 275 ? 0.4801 0.6571 0.6275 -0.1631 -0.1480 -0.0751 253 HIS F C 5044 O O . HIS C 275 ? 0.4928 0.6990 0.6487 -0.1788 -0.1628 -0.0888 253 HIS F O 5045 C CB . HIS C 275 ? 0.4787 0.6093 0.5567 -0.1538 -0.1696 -0.0468 253 HIS F CB 5046 C CG . HIS C 275 ? 0.5401 0.6297 0.5712 -0.1586 -0.1576 -0.0384 253 HIS F CG 5047 N ND1 . HIS C 275 ? 0.6060 0.6770 0.5894 -0.1833 -0.1570 -0.0442 253 HIS F ND1 5048 C CD2 . HIS C 275 ? 0.5447 0.6117 0.5727 -0.1443 -0.1441 -0.0283 253 HIS F CD2 5049 C CE1 . HIS C 275 ? 0.6064 0.6440 0.5615 -0.1835 -0.1406 -0.0386 253 HIS F CE1 5050 N NE2 . HIS C 275 ? 0.5732 0.6096 0.5563 -0.1599 -0.1334 -0.0293 253 HIS F NE2 5051 N N . THR C 276 ? 0.4003 0.5829 0.5810 -0.1459 -0.1384 -0.0720 254 THR F N 5052 C CA . THR C 276 ? 0.3810 0.6047 0.6134 -0.1444 -0.1418 -0.0860 254 THR F CA 5053 C C . THR C 276 ? 0.4267 0.6480 0.6709 -0.1621 -0.1085 -0.1041 254 THR F C 5054 O O . THR C 276 ? 0.4167 0.6768 0.7025 -0.1702 -0.1089 -0.1229 254 THR F O 5055 C CB . THR C 276 ? 0.4505 0.6864 0.7141 -0.1178 -0.1549 -0.0751 254 THR F CB 5056 O OG1 . THR C 276 ? 0.4286 0.6299 0.6769 -0.1083 -0.1315 -0.0642 254 THR F OG1 5057 C CG2 . THR C 276 ? 0.4399 0.6782 0.6939 -0.1019 -0.1908 -0.0592 254 THR F CG2 5058 N N . ALA C 277 ? 0.5270 0.3812 0.7768 0.0082 -0.0631 0.0807 255 ALA F N 5059 C CA . ALA C 277 ? 0.5080 0.3770 0.7555 0.0108 -0.0505 0.0701 255 ALA F CA 5060 C C . ALA C 277 ? 0.5370 0.4322 0.8078 0.0136 -0.0582 0.0794 255 ALA F C 5061 O O . ALA C 277 ? 0.5206 0.4283 0.7862 0.0060 -0.0759 0.0911 255 ALA F O 5062 C CB . ALA C 277 ? 0.5083 0.3788 0.7129 0.0000 -0.0475 0.0588 255 ALA F CB 5063 N N . PRO C 278 ? 0.4902 0.3935 0.7834 0.0226 -0.0444 0.0735 256 PRO F N 5064 C CA . PRO C 278 ? 0.4704 0.3990 0.7845 0.0242 -0.0516 0.0822 256 PRO F CA 5065 C C . PRO C 278 ? 0.5011 0.4452 0.7826 0.0141 -0.0563 0.0781 256 PRO F C 5066 O O . PRO C 278 ? 0.4939 0.4304 0.7403 0.0070 -0.0531 0.0685 256 PRO F O 5067 C CB . PRO C 278 ? 0.4959 0.4260 0.8401 0.0359 -0.0320 0.0744 256 PRO F CB 5068 C CG . PRO C 278 ? 0.5754 0.4785 0.9188 0.0409 -0.0156 0.0635 256 PRO F CG 5069 C CD . PRO C 278 ? 0.5232 0.4121 0.8220 0.0300 -0.0210 0.0586 256 PRO F CD 5070 N N . PHE C 279 ? 0.4456 0.4110 0.7402 0.0131 -0.0643 0.0861 257 PHE F N 5071 C CA . PHE C 279 ? 0.4268 0.4072 0.6961 0.0045 -0.0686 0.0834 257 PHE F CA 5072 C C . PHE C 279 ? 0.4802 0.4586 0.7162 -0.0079 -0.0808 0.0857 257 PHE F C 5073 O O . PHE C 279 ? 0.4634 0.4493 0.6751 -0.0144 -0.0800 0.0794 257 PHE F O 5074 C CB . PHE C 279 ? 0.4417 0.4234 0.6977 0.0065 -0.0516 0.0677 257 PHE F CB 5075 C CG . PHE C 279 ? 0.4643 0.4481 0.7498 0.0167 -0.0370 0.0636 257 PHE F CG 5076 C CD1 . PHE C 279 ? 0.5180 0.4842 0.8045 0.0219 -0.0194 0.0520 257 PHE F CD1 5077 C CD2 . PHE C 279 ? 0.4811 0.4841 0.7924 0.0197 -0.0396 0.0708 257 PHE F CD2 5078 C CE1 . PHE C 279 ? 0.5353 0.5025 0.8488 0.0304 -0.0029 0.0466 257 PHE F CE1 5079 C CE2 . PHE C 279 ? 0.5204 0.5268 0.8612 0.0288 -0.0245 0.0665 257 PHE F CE2 5080 C CZ . PHE C 279 ? 0.5119 0.5003 0.8539 0.0342 -0.0053 0.0539 257 PHE F CZ 5081 N N . GLY C 280 ? 0.4550 0.4233 0.6919 -0.0114 -0.0917 0.0949 258 GLY F N 5082 C CA . GLY C 280 ? 0.4579 0.4229 0.6655 -0.0242 -0.1026 0.0979 258 GLY F CA 5083 C C . GLY C 280 ? 0.5140 0.4711 0.6904 -0.0284 -0.0941 0.0845 258 GLY F C 5084 O O . GLY C 280 ? 0.5035 0.4654 0.6559 -0.0386 -0.0987 0.0832 258 GLY F O 5085 N N . CYS C 281 ? 0.4861 0.4304 0.6633 -0.0215 -0.0811 0.0747 259 CYS F N 5086 C CA . CYS C 281 ? 0.4899 0.4255 0.6393 -0.0262 -0.0736 0.0631 259 CYS F CA 5087 C C . CYS C 281 ? 0.5495 0.4767 0.6797 -0.0358 -0.0824 0.0667 259 CYS F C 5088 O O . CYS C 281 ? 0.5580 0.4741 0.6967 -0.0358 -0.0894 0.0749 259 CYS F O 5089 C CB . CYS C 281 ? 0.5075 0.4279 0.6604 -0.0192 -0.0588 0.0532 259 CYS F CB 5090 S SG . CYS C 281 ? 0.5500 0.4797 0.7167 -0.0112 -0.0448 0.0451 259 CYS F SG 5091 N N . GLN C 282 ? 0.5010 0.4334 0.6069 -0.0441 -0.0820 0.0609 260 GLN F N 5092 C CA . GLN C 282 ? 0.5077 0.4339 0.5937 -0.0544 -0.0878 0.0622 260 GLN F CA 5093 C C . GLN C 282 ? 0.5657 0.4799 0.6380 -0.0548 -0.0788 0.0525 260 GLN F C 5094 O O . GLN C 282 ? 0.5523 0.4720 0.6200 -0.0531 -0.0711 0.0445 260 GLN F O 5095 C CB . GLN C 282 ? 0.5138 0.4554 0.5857 -0.0639 -0.0918 0.0622 260 GLN F CB 5096 C CG . GLN C 282 ? 0.7265 0.6791 0.8062 -0.0664 -0.0997 0.0705 260 GLN F CG 5097 C CD . GLN C 282 ? 1.0101 0.9546 1.0924 -0.0722 -0.1120 0.0827 260 GLN F CD 5098 O OE1 . GLN C 282 ? 0.9651 0.9057 1.0681 -0.0658 -0.1169 0.0910 260 GLN F OE1 5099 N NE2 . GLN C 282 ? 0.9240 0.8659 0.9865 -0.0851 -0.1173 0.0848 260 GLN F NE2 5100 N N . ILE C 283 ? 0.5414 0.4379 0.6068 -0.0577 -0.0805 0.0539 261 ILE F N 5101 C CA . ILE C 283 ? 0.5514 0.4336 0.6012 -0.0602 -0.0728 0.0455 261 ILE F CA 5102 C C . ILE C 283 ? 0.6038 0.4867 0.6319 -0.0725 -0.0779 0.0455 261 ILE F C 5103 O O . ILE C 283 ? 0.6069 0.4857 0.6310 -0.0784 -0.0861 0.0522 261 ILE F O 5104 C CB . ILE C 283 ? 0.6136 0.4718 0.6718 -0.0536 -0.0667 0.0443 261 ILE F CB 5105 C CG1 . ILE C 283 ? 0.6169 0.4769 0.7024 -0.0408 -0.0599 0.0442 261 ILE F CG1 5106 C CG2 . ILE C 283 ? 0.6397 0.4797 0.6767 -0.0587 -0.0580 0.0348 261 ILE F CG2 5107 C CD1 . ILE C 283 ? 0.7019 0.5708 0.7874 -0.0370 -0.0481 0.0346 261 ILE F CD1 5108 N N . ALA C 284 ? 0.5543 0.4433 0.5698 -0.0770 -0.0735 0.0386 262 ALA F N 5109 C CA . ALA C 284 ? 0.5531 0.4461 0.5523 -0.0884 -0.0771 0.0383 262 ALA F CA 5110 C C . ALA C 284 ? 0.6194 0.4967 0.6027 -0.0934 -0.0727 0.0328 262 ALA F C 5111 O O . ALA C 284 ? 0.6207 0.4869 0.6037 -0.0886 -0.0651 0.0275 262 ALA F O 5112 C CB . ALA C 284 ? 0.5416 0.4581 0.5437 -0.0905 -0.0774 0.0370 262 ALA F CB 5113 N N . THR C 285 ? 0.5853 0.4609 0.5542 -0.1045 -0.0770 0.0341 263 THR F N 5114 C CA . THR C 285 ? 0.6017 0.4623 0.5523 -0.1128 -0.0750 0.0304 263 THR F CA 5115 C C . THR C 285 ? 0.6442 0.5224 0.5896 -0.1223 -0.0785 0.0308 263 THR F C 5116 O O . THR C 285 ? 0.6199 0.5204 0.5768 -0.1220 -0.0812 0.0334 263 THR F O 5117 C CB . THR C 285 ? 0.7259 0.5642 0.6649 -0.1180 -0.0777 0.0329 263 THR F CB 5118 O OG1 . THR C 285 ? 0.7425 0.5597 0.6625 -0.1247 -0.0734 0.0280 263 THR F OG1 5119 C CG2 . THR C 285 ? 0.7062 0.5548 0.6406 -0.1279 -0.0860 0.0388 263 THR F CG2 5120 N N . ASN C 286 ? 0.6185 0.4853 0.5469 -0.1315 -0.0782 0.0286 264 ASN F N 5121 C CA . ASN C 286 ? 0.6123 0.4932 0.5368 -0.1421 -0.0831 0.0307 264 ASN F CA 5122 C C . ASN C 286 ? 0.6345 0.5400 0.5762 -0.1371 -0.0834 0.0310 264 ASN F C 5123 O O . ASN C 286 ? 0.6132 0.5409 0.5690 -0.1382 -0.0867 0.0345 264 ASN F O 5124 C CB . ASN C 286 ? 0.6300 0.5183 0.5523 -0.1518 -0.0893 0.0357 264 ASN F CB 5125 C CG . ASN C 286 ? 0.9577 0.8550 0.8747 -0.1649 -0.0948 0.0389 264 ASN F CG 5126 O OD1 . ASN C 286 ? 0.9131 0.7947 0.8122 -0.1734 -0.0961 0.0380 264 ASN F OD1 5127 N ND2 . ASN C 286 ? 0.8444 0.7664 0.7769 -0.1681 -0.0981 0.0429 264 ASN F ND2 5128 N N . PRO C 287 ? 0.5874 0.4886 0.5286 -0.1320 -0.0792 0.0272 265 PRO F N 5129 C CA . PRO C 287 ? 0.6042 0.4801 0.5307 -0.1305 -0.0720 0.0214 265 PRO F CA 5130 C C . PRO C 287 ? 0.6443 0.5142 0.5827 -0.1169 -0.0653 0.0187 265 PRO F C 5131 O O . PRO C 287 ? 0.6185 0.5058 0.5751 -0.1090 -0.0673 0.0217 265 PRO F O 5132 C CB . PRO C 287 ? 0.6248 0.5057 0.5482 -0.1335 -0.0717 0.0199 265 PRO F CB 5133 C CG . PRO C 287 ? 0.6513 0.5611 0.5981 -0.1270 -0.0760 0.0239 265 PRO F CG 5134 C CD . PRO C 287 ? 0.5852 0.5081 0.5422 -0.1279 -0.0805 0.0283 265 PRO F CD 5135 N N . VAL C 288 ? 0.6175 0.4621 0.5465 -0.1147 -0.0570 0.0133 266 VAL F N 5136 C CA . VAL C 288 ? 0.6106 0.4502 0.5562 -0.1013 -0.0508 0.0120 266 VAL F CA 5137 C C . VAL C 288 ? 0.6347 0.4896 0.5953 -0.0926 -0.0469 0.0102 266 VAL F C 5138 O O . VAL C 288 ? 0.6331 0.4864 0.5841 -0.0966 -0.0428 0.0057 266 VAL F O 5139 C CB . VAL C 288 ? 0.6890 0.4980 0.6282 -0.0993 -0.0421 0.0074 266 VAL F CB 5140 C CG1 . VAL C 288 ? 0.7049 0.4987 0.6285 -0.1086 -0.0473 0.0102 266 VAL F CG1 5141 C CG2 . VAL C 288 ? 0.7070 0.4975 0.6316 -0.1024 -0.0298 -0.0020 266 VAL F CG2 5142 N N . ARG C 289 ? 0.5679 0.4380 0.5498 -0.0829 -0.0497 0.0145 267 ARG F N 5143 C CA . ARG C 289 ? 0.5453 0.4317 0.5420 -0.0752 -0.0474 0.0140 267 ARG F CA 5144 C C . ARG C 289 ? 0.5795 0.4721 0.5983 -0.0645 -0.0481 0.0183 267 ARG F C 5145 O O . ARG C 289 ? 0.5754 0.4665 0.5988 -0.0645 -0.0542 0.0241 267 ARG F O 5146 C CB . ARG C 289 ? 0.5314 0.4400 0.5283 -0.0796 -0.0542 0.0165 267 ARG F CB 5147 C CG . ARG C 289 ? 0.6596 0.5810 0.6609 -0.0826 -0.0623 0.0223 267 ARG F CG 5148 C CD . ARG C 289 ? 0.7835 0.7197 0.7819 -0.0900 -0.0668 0.0234 267 ARG F CD 5149 N NE . ARG C 289 ? 0.8919 0.8422 0.8974 -0.0922 -0.0712 0.0274 267 ARG F NE 5150 C CZ . ARG C 289 ? 1.0901 1.0379 1.0885 -0.1002 -0.0747 0.0298 267 ARG F CZ 5151 N NH1 . ARG C 289 ? 0.9537 0.8853 0.9376 -0.1064 -0.0754 0.0292 267 ARG F NH1 5152 N NH2 . ARG C 289 ? 0.9211 0.8817 0.9251 -0.1032 -0.0767 0.0323 267 ARG F NH2 5153 N N . ALA C 290 ? 0.5240 0.4238 0.5559 -0.0569 -0.0428 0.0163 268 ALA F N 5154 C CA . ALA C 290 ? 0.5105 0.4191 0.5654 -0.0477 -0.0443 0.0215 268 ALA F CA 5155 C C . ALA C 290 ? 0.5328 0.4642 0.5918 -0.0486 -0.0510 0.0251 268 ALA F C 5156 O O . ALA C 290 ? 0.5196 0.4594 0.5752 -0.0492 -0.0481 0.0211 268 ALA F O 5157 C CB . ALA C 290 ? 0.5264 0.4288 0.5942 -0.0397 -0.0330 0.0168 268 ALA F CB 5158 N N . VAL C 291 ? 0.4793 0.4185 0.5430 -0.0503 -0.0597 0.0323 269 VAL F N 5159 C CA . VAL C 291 ? 0.4593 0.4168 0.5243 -0.0528 -0.0648 0.0349 269 VAL F CA 5160 C C . VAL C 291 ? 0.4988 0.4639 0.5800 -0.0481 -0.0685 0.0413 269 VAL F C 5161 O O . VAL C 291 ? 0.5010 0.4594 0.5912 -0.0466 -0.0731 0.0479 269 VAL F O 5162 C CB . VAL C 291 ? 0.5090 0.4702 0.5620 -0.0622 -0.0705 0.0368 269 VAL F CB 5163 C CG1 . VAL C 291 ? 0.4920 0.4701 0.5451 -0.0650 -0.0713 0.0362 269 VAL F CG1 5164 C CG2 . VAL C 291 ? 0.5150 0.4676 0.5544 -0.0676 -0.0685 0.0328 269 VAL F CG2 5165 N N . ASN C 292 ? 0.4404 0.4191 0.5259 -0.0466 -0.0675 0.0402 270 ASN F N 5166 C CA . ASN C 292 ? 0.4313 0.4195 0.5298 -0.0444 -0.0718 0.0464 270 ASN F CA 5167 C C . ASN C 292 ? 0.4860 0.4705 0.6056 -0.0362 -0.0706 0.0507 270 ASN F C 5168 O O . ASN C 292 ? 0.4826 0.4698 0.6144 -0.0365 -0.0787 0.0603 270 ASN F O 5169 C CB . ASN C 292 ? 0.4370 0.4294 0.5284 -0.0531 -0.0807 0.0529 270 ASN F CB 5170 C CG . ASN C 292 ? 0.6735 0.6699 0.7483 -0.0609 -0.0793 0.0479 270 ASN F CG 5171 O OD1 . ASN C 292 ? 0.5779 0.5793 0.6497 -0.0594 -0.0736 0.0411 270 ASN F OD1 5172 N ND2 . ASN C 292 ? 0.5723 0.5667 0.6374 -0.0700 -0.0845 0.0517 270 ASN F ND2 5173 N N . CYS C 293 ? 0.4476 0.4259 0.5723 -0.0298 -0.0605 0.0440 271 CYS F N 5174 C CA . CYS C 293 ? 0.4516 0.4269 0.5999 -0.0210 -0.0555 0.0460 271 CYS F CA 5175 C C . CYS C 293 ? 0.4878 0.4793 0.6488 -0.0186 -0.0557 0.0483 271 CYS F C 5176 O O . CYS C 293 ? 0.4751 0.4712 0.6277 -0.0190 -0.0492 0.0410 271 CYS F O 5177 C CB . CYS C 293 ? 0.4676 0.4283 0.6129 -0.0174 -0.0420 0.0362 271 CYS F CB 5178 S SG . CYS C 293 ? 0.5362 0.4747 0.6681 -0.0206 -0.0415 0.0342 271 CYS F SG 5179 N N . ALA C 294 ? 0.4428 0.4428 0.6224 -0.0176 -0.0648 0.0594 272 ALA F N 5180 C CA . ALA C 294 ? 0.4304 0.4460 0.6221 -0.0169 -0.0669 0.0634 272 ALA F CA 5181 C C . ALA C 294 ? 0.4815 0.4999 0.6977 -0.0076 -0.0560 0.0607 272 ALA F C 5182 O O . ALA C 294 ? 0.4781 0.5021 0.7235 -0.0027 -0.0591 0.0698 272 ALA F O 5183 C CB . ALA C 294 ? 0.4407 0.4636 0.6409 -0.0222 -0.0820 0.0774 272 ALA F CB 5184 N N . VAL C 295 ? 0.4399 0.4540 0.6445 -0.0064 -0.0431 0.0486 273 VAL F N 5185 C CA . VAL C 295 ? 0.4425 0.4571 0.6644 0.0002 -0.0293 0.0430 273 VAL F CA 5186 C C . VAL C 295 ? 0.4886 0.5095 0.6948 -0.0036 -0.0231 0.0351 273 VAL F C 5187 O O . VAL C 295 ? 0.4826 0.4973 0.6615 -0.0094 -0.0224 0.0283 273 VAL F O 5188 C CB . VAL C 295 ? 0.5085 0.5046 0.7363 0.0054 -0.0165 0.0362 273 VAL F CB 5189 C CG1 . VAL C 295 ? 0.5130 0.4932 0.7069 -0.0010 -0.0122 0.0262 273 VAL F CG1 5190 C CG2 . VAL C 295 ? 0.5133 0.5099 0.7637 0.0122 -0.0001 0.0305 273 VAL F CG2 5191 N N . GLY C 296 ? 0.4421 0.4759 0.6673 -0.0008 -0.0200 0.0374 274 GLY F N 5192 C CA . GLY C 296 ? 0.4348 0.4749 0.6482 -0.0045 -0.0146 0.0313 274 GLY F CA 5193 C C . GLY C 296 ? 0.4720 0.5202 0.6662 -0.0114 -0.0262 0.0343 274 GLY F C 5194 O O . GLY C 296 ? 0.4601 0.5128 0.6546 -0.0136 -0.0384 0.0424 274 GLY F O 5195 N N . ASN C 297 ? 0.4295 0.4780 0.6065 -0.0158 -0.0220 0.0276 275 ASN F N 5196 C CA . ASN C 297 ? 0.4188 0.4729 0.5788 -0.0217 -0.0304 0.0288 275 ASN F CA 5197 C C . ASN C 297 ? 0.4763 0.5204 0.6110 -0.0265 -0.0291 0.0216 275 ASN F C 5198 O O . ASN C 297 ? 0.4794 0.5122 0.6066 -0.0269 -0.0215 0.0155 275 ASN F O 5199 C CB . ASN C 297 ? 0.4178 0.4840 0.5852 -0.0230 -0.0299 0.0308 275 ASN F CB 5200 C CG . ASN C 297 ? 0.6896 0.7542 0.8596 -0.0226 -0.0170 0.0239 275 ASN F CG 5201 O OD1 . ASN C 297 ? 0.6134 0.6836 0.8066 -0.0181 -0.0096 0.0251 275 ASN F OD1 5202 N ND2 . ASN C 297 ? 0.5869 0.6439 0.7342 -0.0281 -0.0139 0.0170 275 ASN F ND2 5203 N N . MET C 298 ? 0.4322 0.4799 0.5547 -0.0307 -0.0364 0.0227 276 MET F N 5204 C CA . MET C 298 ? 0.4341 0.4748 0.5381 -0.0351 -0.0375 0.0184 276 MET F CA 5205 C C . MET C 298 ? 0.4777 0.5227 0.5743 -0.0388 -0.0404 0.0182 276 MET F C 5206 O O . MET C 298 ? 0.4640 0.5150 0.5620 -0.0394 -0.0460 0.0214 276 MET F O 5207 C CB . MET C 298 ? 0.4630 0.5010 0.5622 -0.0359 -0.0434 0.0200 276 MET F CB 5208 C CG . MET C 298 ? 0.5148 0.5463 0.6002 -0.0401 -0.0447 0.0168 276 MET F CG 5209 S SD . MET C 298 ? 0.5662 0.5984 0.6499 -0.0415 -0.0507 0.0188 276 MET F SD 5210 C CE . MET C 298 ? 0.5337 0.5572 0.6178 -0.0401 -0.0482 0.0186 276 MET F CE 5211 N N . PRO C 299 ? 0.4422 0.4822 0.5289 -0.0427 -0.0366 0.0143 277 PRO F N 5212 C CA . PRO C 299 ? 0.4376 0.4798 0.5171 -0.0467 -0.0407 0.0150 277 PRO F CA 5213 C C . PRO C 299 ? 0.4828 0.5222 0.5561 -0.0485 -0.0479 0.0162 277 PRO F C 5214 O O . PRO C 299 ? 0.4797 0.5132 0.5481 -0.0499 -0.0488 0.0153 277 PRO F O 5215 C CB . PRO C 299 ? 0.4722 0.5079 0.5414 -0.0520 -0.0346 0.0110 277 PRO F CB 5216 C CG . PRO C 299 ? 0.5374 0.5679 0.6102 -0.0500 -0.0250 0.0071 277 PRO F CG 5217 C CD . PRO C 299 ? 0.4757 0.5056 0.5549 -0.0452 -0.0285 0.0091 277 PRO F CD 5218 N N . ILE C 300 ? 0.4356 0.4791 0.5106 -0.0487 -0.0525 0.0184 278 ILE F N 5219 C CA . ILE C 300 ? 0.4322 0.4741 0.5072 -0.0493 -0.0577 0.0194 278 ILE F CA 5220 C C . ILE C 300 ? 0.4866 0.5267 0.5586 -0.0523 -0.0615 0.0208 278 ILE F C 5221 O O . ILE C 300 ? 0.4795 0.5221 0.5515 -0.0525 -0.0609 0.0212 278 ILE F O 5222 C CB . ILE C 300 ? 0.4653 0.5112 0.5471 -0.0465 -0.0579 0.0199 278 ILE F CB 5223 C CG1 . ILE C 300 ? 0.4708 0.5158 0.5540 -0.0450 -0.0565 0.0195 278 ILE F CG1 5224 C CG2 . ILE C 300 ? 0.4735 0.5186 0.5589 -0.0467 -0.0603 0.0198 278 ILE F CG2 5225 C CD1 . ILE C 300 ? 0.5600 0.6083 0.6466 -0.0444 -0.0563 0.0207 278 ILE F CD1 5226 N N . SER C 301 ? 0.4518 0.4871 0.5216 -0.0553 -0.0665 0.0225 279 SER F N 5227 C CA . SER C 301 ? 0.4558 0.4877 0.5246 -0.0585 -0.0723 0.0255 279 SER F CA 5228 C C . SER C 301 ? 0.5046 0.5374 0.5870 -0.0554 -0.0764 0.0278 279 SER F C 5229 O O . SER C 301 ? 0.4988 0.5325 0.5868 -0.0551 -0.0784 0.0291 279 SER F O 5230 C CB . SER C 301 ? 0.5141 0.5391 0.5704 -0.0665 -0.0763 0.0275 279 SER F CB 5231 O OG . SER C 301 ? 0.6339 0.6547 0.6892 -0.0707 -0.0840 0.0322 279 SER F OG 5232 N N . ILE C 302 ? 0.4631 0.4954 0.5517 -0.0532 -0.0764 0.0279 280 ILE F N 5233 C CA . ILE C 302 ? 0.4610 0.4931 0.5660 -0.0495 -0.0773 0.0288 280 ILE F CA 5234 C C . ILE C 302 ? 0.5181 0.5443 0.6279 -0.0509 -0.0835 0.0330 280 ILE F C 5235 O O . ILE C 302 ? 0.5148 0.5372 0.6179 -0.0519 -0.0821 0.0317 280 ILE F O 5236 C CB . ILE C 302 ? 0.4967 0.5309 0.6063 -0.0458 -0.0688 0.0235 280 ILE F CB 5237 C CG1 . ILE C 302 ? 0.4977 0.5365 0.5994 -0.0459 -0.0643 0.0207 280 ILE F CG1 5238 C CG2 . ILE C 302 ? 0.5064 0.5409 0.6351 -0.0421 -0.0666 0.0230 280 ILE F CG2 5239 C CD1 . ILE C 302 ? 0.5930 0.6319 0.6894 -0.0467 -0.0585 0.0173 280 ILE F CD1 5240 N N . ASP C 303 ? 0.4797 0.5049 0.6021 -0.0515 -0.0914 0.0390 281 ASP F N 5241 C CA . ASP C 303 ? 0.4860 0.5050 0.6173 -0.0527 -0.0994 0.0451 281 ASP F CA 5242 C C . ASP C 303 ? 0.5329 0.5519 0.6888 -0.0449 -0.0944 0.0433 281 ASP F C 5243 O O . ASP C 303 ? 0.5257 0.5491 0.7034 -0.0418 -0.0964 0.0466 281 ASP F O 5244 C CB . ASP C 303 ? 0.5188 0.5361 0.6512 -0.0593 -0.1126 0.0545 281 ASP F CB 5245 C CG . ASP C 303 ? 0.6703 0.6790 0.8024 -0.0645 -0.1236 0.0624 281 ASP F CG 5246 O OD1 . ASP C 303 ? 0.6812 0.6874 0.8350 -0.0590 -0.1256 0.0653 281 ASP F OD1 5247 O OD2 . ASP C 303 ? 0.7591 0.7626 0.8694 -0.0746 -0.1299 0.0656 281 ASP F OD2 5248 N N . ILE C 304 ? 0.4802 0.5034 0.4733 0.0119 -0.0164 -0.0163 282 ILE F N 5249 C CA . ILE C 304 ? 0.4799 0.5024 0.4727 0.0109 -0.0149 -0.0166 282 ILE F CA 5250 C C . ILE C 304 ? 0.5342 0.5556 0.5275 0.0112 -0.0137 -0.0169 282 ILE F C 5251 O O . ILE C 304 ? 0.5277 0.5490 0.5209 0.0114 -0.0134 -0.0170 282 ILE F O 5252 C CB . ILE C 304 ? 0.5193 0.5421 0.5107 0.0096 -0.0145 -0.0172 282 ILE F CB 5253 C CG1 . ILE C 304 ? 0.5236 0.5473 0.5143 0.0092 -0.0159 -0.0172 282 ILE F CG1 5254 C CG2 . ILE C 304 ? 0.5297 0.5519 0.5208 0.0088 -0.0133 -0.0175 282 ILE F CG2 5255 C CD1 . ILE C 304 ? 0.6085 0.6325 0.5980 0.0085 -0.0161 -0.0178 282 ILE F CD1 5256 N N . PRO C 305 ? 0.4957 0.5162 0.4895 0.0113 -0.0130 -0.0169 283 PRO F N 5257 C CA . PRO C 305 ? 0.4955 0.5147 0.4896 0.0116 -0.0120 -0.0174 283 PRO F CA 5258 C C . PRO C 305 ? 0.5519 0.5709 0.5451 0.0107 -0.0111 -0.0181 283 PRO F C 5259 O O . PRO C 305 ? 0.5460 0.5656 0.5384 0.0098 -0.0110 -0.0182 283 PRO F O 5260 C CB . PRO C 305 ? 0.5170 0.5355 0.5118 0.0119 -0.0116 -0.0174 283 PRO F CB 5261 C CG . PRO C 305 ? 0.5726 0.5922 0.5670 0.0112 -0.0120 -0.0170 283 PRO F CG 5262 C CD . PRO C 305 ? 0.5153 0.5360 0.5095 0.0112 -0.0131 -0.0166 283 PRO F CD 5263 N N . GLU C 306 ? 0.5154 0.5334 0.5087 0.0109 -0.0106 -0.0184 284 GLU F N 5264 C CA . GLU C 306 ? 0.5171 0.5348 0.5098 0.0101 -0.0101 -0.0190 284 GLU F CA 5265 C C . GLU C 306 ? 0.5750 0.5926 0.5671 0.0094 -0.0096 -0.0196 284 GLU F C 5266 O O . GLU C 306 ? 0.5691 0.5869 0.5605 0.0088 -0.0096 -0.0198 284 GLU F O 5267 C CB . GLU C 306 ? 0.5343 0.5509 0.5272 0.0105 -0.0099 -0.0192 284 GLU F CB 5268 C CG . GLU C 306 ? 0.6628 0.6779 0.6562 0.0112 -0.0096 -0.0198 284 GLU F CG 5269 C CD . GLU C 306 ? 0.9035 0.9172 0.8970 0.0116 -0.0095 -0.0201 284 GLU F CD 5270 O OE1 . GLU C 306 ? 0.8222 0.8350 0.8165 0.0127 -0.0095 -0.0200 284 GLU F OE1 5271 O OE2 . GLU C 306 ? 0.8175 0.8311 0.8106 0.0109 -0.0094 -0.0204 284 GLU F OE2 5272 N N . ALA C 307 ? 0.5392 0.5564 0.5314 0.0097 -0.0094 -0.0198 285 ALA F N 5273 C CA . ALA C 307 ? 0.5410 0.5585 0.5327 0.0093 -0.0090 -0.0203 285 ALA F CA 5274 C C . ALA C 307 ? 0.5976 0.6164 0.5887 0.0088 -0.0091 -0.0201 285 ALA F C 5275 O O . ALA C 307 ? 0.5952 0.6143 0.5858 0.0085 -0.0089 -0.0206 285 ALA F O 5276 C CB . ALA C 307 ? 0.5500 0.5671 0.5422 0.0098 -0.0087 -0.0204 285 ALA F CB 5277 N N . ALA C 308 ? 0.5571 0.5766 0.5484 0.0087 -0.0095 -0.0194 286 ALA F N 5278 C CA . ALA C 308 ? 0.5572 0.5776 0.5479 0.0081 -0.0097 -0.0192 286 ALA F CA 5279 C C . ALA C 308 ? 0.6127 0.6330 0.6027 0.0077 -0.0097 -0.0196 286 ALA F C 5280 O O . ALA C 308 ? 0.6077 0.6283 0.5970 0.0074 -0.0096 -0.0198 286 ALA F O 5281 C CB . ALA C 308 ? 0.5654 0.5865 0.5564 0.0082 -0.0104 -0.0185 286 ALA F CB 5282 N N . PHE C 309 ? 0.5743 0.5940 0.5644 0.0078 -0.0098 -0.0196 287 PHE F N 5283 C CA . PHE C 309 ? 0.5745 0.5940 0.5643 0.0074 -0.0099 -0.0199 287 PHE F CA 5284 C C . PHE C 309 ? 0.6305 0.6494 0.6200 0.0074 -0.0098 -0.0204 287 PHE F C 5285 O O . PHE C 309 ? 0.6239 0.6423 0.6136 0.0076 -0.0096 -0.0207 287 PHE F O 5286 C CB . PHE C 309 ? 0.5963 0.6158 0.5864 0.0075 -0.0103 -0.0195 287 PHE F CB 5287 C CG . PHE C 309 ? 0.6143 0.6346 0.6044 0.0076 -0.0108 -0.0191 287 PHE F CG 5288 C CD1 . PHE C 309 ? 0.6535 0.6742 0.6429 0.0071 -0.0112 -0.0192 287 PHE F CD1 5289 C CD2 . PHE C 309 ? 0.6404 0.6610 0.6311 0.0083 -0.0111 -0.0186 287 PHE F CD2 5290 C CE1 . PHE C 309 ? 0.6645 0.6860 0.6537 0.0072 -0.0119 -0.0190 287 PHE F CE1 5291 C CE2 . PHE C 309 ? 0.6757 0.6972 0.6664 0.0085 -0.0120 -0.0183 287 PHE F CE2 5292 C CZ . PHE C 309 ? 0.6520 0.6740 0.6418 0.0080 -0.0125 -0.0185 287 PHE F CZ 5293 N N . THR C 310 ? 0.5936 0.6123 0.5827 0.0071 -0.0100 -0.0207 288 THR F N 5294 C CA . THR C 310 ? 0.5952 0.6134 0.5842 0.0073 -0.0102 -0.0212 288 THR F CA 5295 C C . THR C 310 ? 0.6492 0.6668 0.6383 0.0070 -0.0107 -0.0210 288 THR F C 5296 O O . THR C 310 ? 0.6436 0.6614 0.6326 0.0067 -0.0107 -0.0208 288 THR F O 5297 C CB . THR C 310 ? 0.7067 0.7252 0.6951 0.0076 -0.0101 -0.0216 288 THR F CB 5298 O OG1 . THR C 310 ? 0.7084 0.7271 0.6964 0.0074 -0.0100 -0.0214 288 THR F OG1 5299 C CG2 . THR C 310 ? 0.6917 0.7109 0.6800 0.0079 -0.0098 -0.0218 288 THR F CG2 5300 N N . ARG C 311 ? 0.6104 0.6275 0.5999 0.0070 -0.0112 -0.0211 289 ARG F N 5301 C CA . ARG C 311 ? 0.6108 0.6275 0.6007 0.0066 -0.0118 -0.0207 289 ARG F CA 5302 C C . ARG C 311 ? 0.6669 0.6832 0.6566 0.0068 -0.0122 -0.0209 289 ARG F C 5303 O O . ARG C 311 ? 0.6630 0.6792 0.6522 0.0073 -0.0122 -0.0215 289 ARG F O 5304 C CB . ARG C 311 ? 0.6144 0.6305 0.6047 0.0065 -0.0124 -0.0207 289 ARG F CB 5305 C CG . ARG C 311 ? 0.7449 0.7611 0.7355 0.0064 -0.0121 -0.0205 289 ARG F CG 5306 C CD . ARG C 311 ? 0.8716 0.8872 0.8626 0.0060 -0.0129 -0.0204 289 ARG F CD 5307 N NE . ARG C 311 ? 0.9869 1.0018 0.9775 0.0063 -0.0137 -0.0212 289 ARG F NE 5308 C CZ . ARG C 311 ? 1.1712 1.1854 1.1621 0.0060 -0.0149 -0.0213 289 ARG F CZ 5309 N NH1 . ARG C 311 ? 1.0134 1.0276 1.0050 0.0054 -0.0153 -0.0205 289 ARG F NH1 5310 N NH2 . ARG C 311 ? 1.0036 1.0173 0.9939 0.0063 -0.0158 -0.0223 289 ARG F NH2 5311 N N . VAL C 312 ? 0.6275 0.6436 0.6175 0.0065 -0.0124 -0.0205 290 VAL F N 5312 C CA . VAL C 312 ? 0.6278 0.6431 0.6177 0.0067 -0.0128 -0.0207 290 VAL F CA 5313 C C . VAL C 312 ? 0.6848 0.6993 0.6750 0.0074 -0.0138 -0.0210 290 VAL F C 5314 O O . VAL C 312 ? 0.6800 0.6939 0.6699 0.0080 -0.0140 -0.0215 290 VAL F O 5315 C CB . VAL C 312 ? 0.6762 0.6914 0.6666 0.0062 -0.0130 -0.0201 290 VAL F CB 5316 C CG1 . VAL C 312 ? 0.6739 0.6879 0.6641 0.0065 -0.0133 -0.0205 290 VAL F CG1 5317 C CG2 . VAL C 312 ? 0.6727 0.6890 0.6629 0.0057 -0.0123 -0.0199 290 VAL F CG2 5318 N N . VAL C 313 ? 0.6475 0.6620 0.6382 0.0072 -0.0146 -0.0208 291 VAL F N 5319 C CA . VAL C 313 ? 0.6486 0.6625 0.6395 0.0079 -0.0159 -0.0212 291 VAL F CA 5320 C C . VAL C 313 ? 0.7046 0.7189 0.6946 0.0087 -0.0158 -0.0220 291 VAL F C 5321 O O . VAL C 313 ? 0.7003 0.7144 0.6902 0.0096 -0.0166 -0.0225 291 VAL F O 5322 C CB . VAL C 313 ? 0.6983 0.7120 0.6898 0.0074 -0.0169 -0.0208 291 VAL F CB 5323 C CG1 . VAL C 313 ? 0.6968 0.7099 0.6885 0.0081 -0.0189 -0.0212 291 VAL F CG1 5324 C CG2 . VAL C 313 ? 0.6952 0.7090 0.6876 0.0065 -0.0169 -0.0198 291 VAL F CG2 5325 N N . ASP C 314 ? 0.6657 0.6808 0.6552 0.0084 -0.0147 -0.0222 292 ASP F N 5326 C CA . ASP C 314 ? 0.6659 0.6817 0.6548 0.0089 -0.0143 -0.0229 292 ASP F CA 5327 C C . ASP C 314 ? 0.7175 0.7337 0.7059 0.0094 -0.0136 -0.0230 292 ASP F C 5328 O O . ASP C 314 ? 0.7124 0.7294 0.7003 0.0101 -0.0136 -0.0235 292 ASP F O 5329 C CB . ASP C 314 ? 0.6897 0.7060 0.6784 0.0085 -0.0135 -0.0229 292 ASP F CB 5330 C CG . ASP C 314 ? 0.8230 0.8388 0.8120 0.0082 -0.0142 -0.0231 292 ASP F CG 5331 O OD1 . ASP C 314 ? 0.8305 0.8461 0.8190 0.0087 -0.0153 -0.0239 292 ASP F OD1 5332 O OD2 . ASP C 314 ? 0.8997 0.9152 0.8891 0.0076 -0.0139 -0.0226 292 ASP F OD2 5333 N N . ALA C 315 ? 0.6759 0.6917 0.6644 0.0090 -0.0132 -0.0226 293 ALA F N 5334 C CA . ALA C 315 ? 0.6743 0.6901 0.6622 0.0093 -0.0126 -0.0228 293 ALA F CA 5335 C C . ALA C 315 ? 0.7246 0.7394 0.7126 0.0103 -0.0134 -0.0231 293 ALA F C 5336 O O . ALA C 315 ? 0.7185 0.7324 0.7071 0.0104 -0.0144 -0.0230 293 ALA F O 5337 C CB . ALA C 315 ? 0.6831 0.6989 0.6710 0.0085 -0.0119 -0.0224 293 ALA F CB 5338 N N . PRO C 316 ? 1.3231 0.7197 0.8791 0.1201 -0.3674 -0.0107 294 PRO F N 5339 C CA . PRO C 316 ? 1.3782 0.7024 0.8779 0.1280 -0.3736 -0.0254 294 PRO F CA 5340 C C . PRO C 316 ? 1.4247 0.7132 0.8906 0.0674 -0.3784 -0.0181 294 PRO F C 5341 O O . PRO C 316 ? 1.3442 0.6944 0.8486 0.0276 -0.3603 -0.0091 294 PRO F O 5342 C CB . PRO C 316 ? 1.3548 0.7478 0.8921 0.1597 -0.3395 -0.0408 294 PRO F CB 5343 C CG . PRO C 316 ? 1.3566 0.8454 0.9583 0.1823 -0.3240 -0.0354 294 PRO F CG 5344 C CD . PRO C 316 ? 1.2669 0.7685 0.8863 0.1386 -0.3325 -0.0145 294 PRO F CD 5345 N N . SER C 317 ? 1.4706 0.6599 0.8602 0.0608 -0.4041 -0.0220 295 SER F N 5346 C CA . SER C 317 ? 1.4779 0.6355 0.8262 0.0018 -0.4124 -0.0132 295 SER F CA 5347 C C . SER C 317 ? 1.5058 0.6813 0.8537 0.0013 -0.3881 -0.0237 295 SER F C 5348 O O . SER C 317 ? 1.5401 0.6847 0.8683 0.0436 -0.3844 -0.0393 295 SER F O 5349 C CB . SER C 317 ? 1.6385 0.6761 0.8941 -0.0172 -0.4591 -0.0064 295 SER F CB 5350 O OG . SER C 317 ? 1.8411 0.7923 1.0271 0.0036 -0.4716 -0.0184 295 SER F OG 5351 N N . LEU C 318 ? 1.4024 0.6299 0.7715 -0.0450 -0.3718 -0.0154 296 LEU F N 5352 C CA . LEU C 318 ? 1.3734 0.6246 0.7462 -0.0512 -0.3499 -0.0217 296 LEU F CA 5353 C C . LEU C 318 ? 1.4734 0.6727 0.7799 -0.0984 -0.3681 -0.0122 296 LEU F C 5354 O O . LEU C 318 ? 1.4625 0.6733 0.7580 -0.1457 -0.3803 0.0026 296 LEU F O 5355 C CB . LEU C 318 ? 1.2670 0.6250 0.7189 -0.0561 -0.3143 -0.0215 296 LEU F CB 5356 C CG . LEU C 318 ? 1.2835 0.6951 0.7904 -0.0103 -0.2918 -0.0325 296 LEU F CG 5357 C CD1 . LEU C 318 ? 1.1988 0.6956 0.7657 -0.0235 -0.2649 -0.0296 296 LEU F CD1 5358 C CD2 . LEU C 318 ? 1.3483 0.7364 0.8362 0.0257 -0.2848 -0.0485 296 LEU F CD2 5359 N N . THR C 319 ? 1.4826 0.6287 0.7422 -0.0874 -0.3701 -0.0205 297 THR F N 5360 C CA . THR C 319 ? 1.5415 0.6300 0.7265 -0.1313 -0.3885 -0.0108 297 THR F CA 5361 C C . THR C 319 ? 1.5680 0.6803 0.7626 -0.1247 -0.3636 -0.0185 297 THR F C 5362 O O . THR C 319 ? 1.5224 0.6714 0.7646 -0.0809 -0.3389 -0.0343 297 THR F O 5363 C CB . THR C 319 ? 1.7767 0.7314 0.8608 -0.1265 -0.4305 -0.0114 297 THR F CB 5364 O OG1 . THR C 319 ? 1.7924 0.7281 0.8768 -0.1240 -0.4528 -0.0057 297 THR F OG1 5365 C CG2 . THR C 319 ? 1.8369 0.7219 0.8276 -0.1842 -0.4580 0.0041 297 THR F CG2 5366 N N . ASP C 320 ? 1.5525 0.6483 0.7000 -0.1724 -0.3717 -0.0055 298 ASP F N 5367 C CA . ASP C 320 ? 1.5405 0.6497 0.6837 -0.1790 -0.3543 -0.0075 298 ASP F CA 5368 C C . ASP C 320 ? 1.4787 0.6937 0.7181 -0.1560 -0.3154 -0.0156 298 ASP F C 5369 O O . ASP C 320 ? 1.4686 0.6841 0.7185 -0.1281 -0.2986 -0.0292 298 ASP F O 5370 C CB . ASP C 320 ? 1.6669 0.6683 0.7322 -0.1541 -0.3675 -0.0210 298 ASP F CB 5371 C CG . ASP C 320 ? 1.9296 0.8088 0.8817 -0.1827 -0.4107 -0.0112 298 ASP F CG 5372 O OD1 . ASP C 320 ? 1.9670 0.8324 0.8673 -0.2419 -0.4257 0.0091 298 ASP F OD1 5373 O OD2 . ASP C 320 ? 2.0835 0.8799 0.9942 -0.1462 -0.4316 -0.0231 298 ASP F OD2 5374 N N . MET C 321 ? 1.3533 0.6540 0.6571 -0.1692 -0.3030 -0.0076 299 MET F N 5375 C CA . MET C 321 ? 1.2568 0.6480 0.6431 -0.1511 -0.2716 -0.0134 299 MET F CA 5376 C C . MET C 321 ? 1.2647 0.7065 0.6658 -0.1797 -0.2595 -0.0035 299 MET F C 5377 O O . MET C 321 ? 1.2695 0.7230 0.6469 -0.2200 -0.2706 0.0124 299 MET F O 5378 C CB . MET C 321 ? 1.2283 0.6765 0.6714 -0.1440 -0.2646 -0.0124 299 MET F CB 5379 C CG . MET C 321 ? 1.2914 0.7141 0.7423 -0.1065 -0.2689 -0.0228 299 MET F CG 5380 S SD . MET C 321 ? 1.2594 0.7664 0.7919 -0.0894 -0.2479 -0.0246 299 MET F SD 5381 C CE . MET C 321 ? 1.2035 0.7326 0.7353 -0.1321 -0.2585 -0.0099 299 MET F CE 5382 N N . SER C 322 ? 1.1773 0.6542 0.6174 -0.1599 -0.2379 -0.0119 300 SER F N 5383 C CA . SER C 322 ? 1.1359 0.6622 0.5976 -0.1795 -0.2257 -0.0037 300 SER F CA 5384 C C . SER C 322 ? 1.1099 0.6999 0.6415 -0.1549 -0.2036 -0.0119 300 SER F C 5385 O O . SER C 322 ? 1.0969 0.6829 0.6468 -0.1243 -0.1964 -0.0252 300 SER F O 5386 C CB . SER C 322 ? 1.2325 0.7093 0.6437 -0.1904 -0.2295 -0.0034 300 SER F CB 5387 O OG . SER C 322 ? 1.3618 0.8062 0.7696 -0.1552 -0.2217 -0.0223 300 SER F OG 5388 N N . CYS C 323 ? 1.0171 0.6660 0.5835 -0.1683 -0.1951 -0.0031 301 CYS F N 5389 C CA . CYS C 323 ? 0.9566 0.6552 0.5784 -0.1494 -0.1794 -0.0088 301 CYS F CA 5390 C C . CYS C 323 ? 0.9822 0.7083 0.6164 -0.1606 -0.1735 -0.0023 301 CYS F C 5391 O O . CYS C 323 ? 0.9783 0.7250 0.6042 -0.1832 -0.1784 0.0111 301 CYS F O 5392 C CB . CYS C 323 ? 0.9247 0.6636 0.5803 -0.1447 -0.1768 -0.0075 301 CYS F CB 5393 S SG . CYS C 323 ? 0.9222 0.7065 0.6296 -0.1253 -0.1630 -0.0127 301 CYS F SG 5394 N N . GLU C 324 ? 0.9190 0.6509 0.5728 -0.1467 -0.1645 -0.0105 302 GLU F N 5395 C CA . GLU C 324 ? 0.9004 0.6539 0.5667 -0.1570 -0.1609 -0.0048 302 GLU F CA 5396 C C . GLU C 324 ? 0.9050 0.6898 0.6115 -0.1416 -0.1549 -0.0096 302 GLU F C 5397 O O . GLU C 324 ? 0.8935 0.6753 0.6084 -0.1257 -0.1509 -0.0200 302 GLU F O 5398 C CB . GLU C 324 ? 0.9526 0.6706 0.5859 -0.1654 -0.1601 -0.0089 302 GLU F CB 5399 C CG . GLU C 324 ? 1.0879 0.8226 0.7255 -0.1852 -0.1592 0.0004 302 GLU F CG 5400 C CD . GLU C 324 ? 1.3538 1.0912 1.0002 -0.1807 -0.1523 -0.0097 302 GLU F CD 5401 O OE1 . GLU C 324 ? 1.2695 1.0364 0.9418 -0.1881 -0.1530 -0.0034 302 GLU F OE1 5402 O OE2 . GLU C 324 ? 1.3053 1.0169 0.9302 -0.1699 -0.1477 -0.0240 302 GLU F OE2 5403 N N . VAL C 325 ? 0.8374 0.6514 0.5642 -0.1470 -0.1568 -0.0009 303 VAL F N 5404 C CA . VAL C 325 ? 0.8116 0.6422 0.5644 -0.1358 -0.1567 -0.0034 303 VAL F CA 5405 C C . VAL C 325 ? 0.8597 0.6902 0.6115 -0.1495 -0.1598 0.0010 303 VAL F C 5406 O O . VAL C 325 ? 0.8526 0.6975 0.6095 -0.1586 -0.1652 0.0123 303 VAL F O 5407 C CB . VAL C 325 ? 0.8469 0.7027 0.6196 -0.1237 -0.1594 0.0002 303 VAL F CB 5408 C CG1 . VAL C 325 ? 0.8390 0.6943 0.6249 -0.1121 -0.1637 -0.0024 303 VAL F CG1 5409 C CG2 . VAL C 325 ? 0.8423 0.6990 0.6139 -0.1154 -0.1561 -0.0048 303 VAL F CG2 5410 N N . PRO C 326 ? 0.8193 0.6399 0.5640 -0.1529 -0.1568 -0.0072 304 PRO F N 5411 C CA . PRO C 326 ? 0.8221 0.6446 0.5628 -0.1718 -0.1606 -0.0031 304 PRO F CA 5412 C C . PRO C 326 ? 0.8635 0.6947 0.6188 -0.1734 -0.1716 0.0026 304 PRO F C 5413 O O . PRO C 326 ? 0.8661 0.6980 0.6191 -0.1914 -0.1793 0.0105 304 PRO F O 5414 C CB . PRO C 326 ? 0.8549 0.6729 0.5814 -0.1733 -0.1529 -0.0160 304 PRO F CB 5415 C CG . PRO C 326 ? 0.9026 0.7256 0.6371 -0.1517 -0.1487 -0.0248 304 PRO F CG 5416 C CD . PRO C 326 ? 0.8406 0.6562 0.5810 -0.1406 -0.1503 -0.0198 304 PRO F CD 5417 N N . ALA C 327 ? 0.8119 0.6429 0.5760 -0.1568 -0.1745 -0.0010 305 ALA F N 5418 C CA . ALA C 327 ? 0.8169 0.6401 0.5820 -0.1564 -0.1888 0.0033 305 ALA F CA 5419 C C . ALA C 327 ? 0.8660 0.6825 0.6364 -0.1327 -0.1909 0.0007 305 ALA F C 5420 O O . ALA C 327 ? 0.8509 0.6692 0.6216 -0.1240 -0.1824 -0.0063 305 ALA F O 5421 C CB . ALA C 327 ? 0.8343 0.6561 0.5858 -0.1739 -0.1935 0.0001 305 ALA F CB 5422 N N . CYS C 328 ? 0.8383 0.6470 0.6114 -0.1208 -0.2029 0.0060 306 CYS F N 5423 C CA . CYS C 328 ? 0.8481 0.6463 0.6205 -0.0952 -0.2059 0.0012 306 CYS F CA 5424 C C . CYS C 328 ? 0.9346 0.7053 0.6951 -0.0825 -0.2257 0.0044 306 CYS F C 5425 O O . CYS C 328 ? 0.9357 0.7133 0.7035 -0.0819 -0.2349 0.0125 306 CYS F O 5426 C CB . CYS C 328 ? 0.8343 0.6624 0.6243 -0.0784 -0.1930 -0.0015 306 CYS F CB 5427 S SG . CYS C 328 ? 0.8953 0.7140 0.6810 -0.0511 -0.1911 -0.0119 306 CYS F SG 5428 N N . THR C 329 ? 0.9212 0.6570 0.6595 -0.0715 -0.2338 -0.0014 307 THR F N 5429 C CA . THR C 329 ? 0.9702 0.6607 0.6831 -0.0542 -0.2557 -0.0015 307 THR F CA 5430 C C . THR C 329 ? 1.0370 0.7129 0.7398 -0.0262 -0.2504 -0.0128 307 THR F C 5431 O O . THR C 329 ? 1.0268 0.6934 0.7169 -0.0379 -0.2434 -0.0164 307 THR F O 5432 C CB . THR C 329 ? 1.1131 0.7579 0.7882 -0.0838 -0.2775 0.0050 307 THR F CB 5433 O OG1 . THR C 329 ? 1.0959 0.7616 0.7827 -0.1105 -0.2803 0.0142 307 THR F OG1 5434 C CG2 . THR C 329 ? 1.1665 0.7448 0.8003 -0.0680 -0.3063 0.0055 307 THR F CG2 5435 N N . HIS C 330 ? 1.0144 0.6951 0.7238 0.0110 -0.2529 -0.0185 308 HIS F N 5436 C CA . HIS C 330 ? 1.0339 0.7030 0.7313 0.0396 -0.2469 -0.0317 308 HIS F CA 5437 C C . HIS C 330 ? 1.1514 0.7371 0.7927 0.0464 -0.2693 -0.0359 308 HIS F C 5438 O O . HIS C 330 ? 1.2012 0.7456 0.8194 0.0703 -0.2907 -0.0371 308 HIS F O 5439 C CB . HIS C 330 ? 1.0364 0.7594 0.7637 0.0771 -0.2365 -0.0386 308 HIS F CB 5440 C CG . HIS C 330 ? 1.1144 0.8352 0.8435 0.1060 -0.2536 -0.0360 308 HIS F CG 5441 N ND1 . HIS C 330 ? 1.2070 0.8708 0.9006 0.1433 -0.2724 -0.0459 308 HIS F ND1 5442 C CD2 . HIS C 330 ? 1.1150 0.8830 0.8746 0.1039 -0.2554 -0.0242 308 HIS F CD2 5443 C CE1 . HIS C 330 ? 1.2170 0.8970 0.9242 0.1658 -0.2858 -0.0400 308 HIS F CE1 5444 N NE2 . HIS C 330 ? 1.1644 0.9106 0.9131 0.1411 -0.2756 -0.0257 308 HIS F NE2 5445 N N . SER C 331 ? 1.1097 0.6674 0.7243 0.0224 -0.2671 -0.0361 309 SER F N 5446 C CA . SER C 331 ? 1.1774 0.6519 0.7274 0.0163 -0.2894 -0.0367 309 SER F CA 5447 C C . SER C 331 ? 1.2240 0.6898 0.7562 0.0079 -0.2769 -0.0419 309 SER F C 5448 O O . SER C 331 ? 1.1608 0.6856 0.7340 0.0085 -0.2519 -0.0455 309 SER F O 5449 C CB . SER C 331 ? 1.2388 0.6832 0.7605 -0.0259 -0.3106 -0.0218 309 SER F CB 5450 O OG . SER C 331 ? 1.2875 0.7855 0.8364 -0.0615 -0.2939 -0.0145 309 SER F OG 5451 N N . SER C 332 ? 1.2500 0.6375 0.7154 -0.0032 -0.2971 -0.0406 310 SER F N 5452 C CA . SER C 332 ? 1.2602 0.6279 0.6963 -0.0173 -0.2901 -0.0422 310 SER F CA 5453 C C . SER C 332 ? 1.2454 0.6654 0.7054 -0.0604 -0.2773 -0.0290 310 SER F C 5454 O O . SER C 332 ? 1.2150 0.6600 0.6865 -0.0659 -0.2602 -0.0306 310 SER F O 5455 C CB . SER C 332 ? 1.4073 0.6695 0.7544 -0.0244 -0.3201 -0.0407 310 SER F CB 5456 O OG . SER C 332 ? 1.5820 0.7909 0.9031 0.0245 -0.3317 -0.0564 310 SER F OG 5457 N N . ASP C 333 ? 1.1781 0.6175 0.6453 -0.0892 -0.2861 -0.0165 311 ASP F N 5458 C CA . ASP C 333 ? 1.1218 0.6183 0.6122 -0.1243 -0.2750 -0.0057 311 ASP F CA 5459 C C . ASP C 333 ? 1.0808 0.6535 0.6420 -0.1118 -0.2503 -0.0101 311 ASP F C 5460 O O . ASP C 333 ? 1.0610 0.6448 0.6509 -0.0822 -0.2427 -0.0189 311 ASP F O 5461 C CB . ASP C 333 ? 1.1767 0.6573 0.6296 -0.1646 -0.2984 0.0089 311 ASP F CB 5462 C CG . ASP C 333 ? 1.3099 0.7964 0.7788 -0.1634 -0.3080 0.0099 311 ASP F CG 5463 O OD1 . ASP C 333 ? 1.3540 0.7958 0.8125 -0.1359 -0.3202 0.0038 311 ASP F OD1 5464 O OD2 . ASP C 333 ? 1.3519 0.8891 0.8419 -0.1894 -0.3040 0.0167 311 ASP F OD2 5465 N N . PHE C 334 ? 0.9844 0.6092 0.5687 -0.1341 -0.2394 -0.0036 312 PHE F N 5466 C CA . PHE C 334 ? 0.9177 0.6012 0.5555 -0.1248 -0.2192 -0.0077 312 PHE F CA 5467 C C . PHE C 334 ? 0.9483 0.6434 0.5982 -0.1301 -0.2246 -0.0059 312 PHE F C 5468 O O . PHE C 334 ? 0.9292 0.6539 0.5824 -0.1520 -0.2244 -0.0011 312 PHE F O 5469 C CB . PHE C 334 ? 0.9082 0.6368 0.5618 -0.1384 -0.2066 -0.0038 312 PHE F CB 5470 C CG . PHE C 334 ? 0.9315 0.6523 0.5777 -0.1351 -0.2008 -0.0038 312 PHE F CG 5471 C CD1 . PHE C 334 ? 0.9454 0.6777 0.6190 -0.1142 -0.1864 -0.0118 312 PHE F CD1 5472 C CD2 . PHE C 334 ? 0.9914 0.6938 0.5984 -0.1582 -0.2114 0.0060 312 PHE F CD2 5473 C CE1 . PHE C 334 ? 0.9628 0.6878 0.6282 -0.1151 -0.1819 -0.0114 312 PHE F CE1 5474 C CE2 . PHE C 334 ? 1.0337 0.7273 0.6314 -0.1588 -0.2063 0.0073 312 PHE F CE2 5475 C CZ . PHE C 334 ? 0.9823 0.6874 0.6111 -0.1366 -0.1910 -0.0020 312 PHE F CZ 5476 N N . GLY C 335 ? 0.9080 0.5839 0.5634 -0.1098 -0.2294 -0.0098 313 GLY F N 5477 C CA . GLY C 335 ? 0.8982 0.5810 0.5642 -0.1144 -0.2361 -0.0064 313 GLY F CA 5478 C C . GLY C 335 ? 0.8919 0.6211 0.5992 -0.1081 -0.2178 -0.0089 313 GLY F C 5479 O O . GLY C 335 ? 0.8818 0.6197 0.5975 -0.1159 -0.2216 -0.0048 313 GLY F O 5480 N N . GLY C 336 ? 0.8143 0.5679 0.5413 -0.0975 -0.2003 -0.0141 314 GLY F N 5481 C CA . GLY C 336 ? 0.7775 0.5640 0.5314 -0.0942 -0.1859 -0.0158 314 GLY F CA 5482 C C . GLY C 336 ? 0.8014 0.6081 0.5602 -0.1054 -0.1758 -0.0175 314 GLY F C 5483 O O . GLY C 336 ? 0.7954 0.6048 0.5479 -0.1080 -0.1739 -0.0184 314 GLY F O 5484 N N . VAL C 337 ? 0.7424 0.5633 0.5095 -0.1110 -0.1700 -0.0177 315 VAL F N 5485 C CA . VAL C 337 ? 0.7301 0.5663 0.4981 -0.1143 -0.1606 -0.0225 315 VAL F CA 5486 C C . VAL C 337 ? 0.7715 0.6047 0.5430 -0.1073 -0.1535 -0.0243 315 VAL F C 5487 O O . VAL C 337 ? 0.7679 0.5984 0.5395 -0.1126 -0.1557 -0.0197 315 VAL F O 5488 C CB . VAL C 337 ? 0.7851 0.6329 0.5454 -0.1318 -0.1630 -0.0225 315 VAL F CB 5489 C CG1 . VAL C 337 ? 0.7820 0.6471 0.5414 -0.1276 -0.1518 -0.0311 315 VAL F CG1 5490 C CG2 . VAL C 337 ? 0.7933 0.6451 0.5413 -0.1468 -0.1739 -0.0183 315 VAL F CG2 5491 N N . ALA C 338 ? 0.7251 0.5575 0.4954 -0.0979 -0.1478 -0.0292 316 ALA F N 5492 C CA . ALA C 338 ? 0.7304 0.5490 0.4920 -0.0957 -0.1460 -0.0298 316 ALA F CA 5493 C C . ALA C 338 ? 0.7919 0.6000 0.5403 -0.0868 -0.1427 -0.0378 316 ALA F C 5494 O O . ALA C 338 ? 0.7825 0.6022 0.5374 -0.0754 -0.1406 -0.0419 316 ALA F O 5495 C CB . ALA C 338 ? 0.7345 0.5530 0.5009 -0.0918 -0.1476 -0.0270 316 ALA F CB 5496 N N . ILE C 339 ? 0.7693 0.5548 0.4958 -0.0912 -0.1432 -0.0396 317 ILE F N 5497 C CA . ILE C 339 ? 0.7974 0.5603 0.5014 -0.0775 -0.1420 -0.0497 317 ILE F CA 5498 C C . ILE C 339 ? 0.8713 0.5937 0.5487 -0.0778 -0.1507 -0.0470 317 ILE F C 5499 O O . ILE C 339 ? 0.8787 0.5826 0.5363 -0.0970 -0.1562 -0.0389 317 ILE F O 5500 C CB . ILE C 339 ? 0.8567 0.6142 0.5434 -0.0826 -0.1376 -0.0562 317 ILE F CB 5501 C CG1 . ILE C 339 ? 0.8366 0.6388 0.5462 -0.0874 -0.1319 -0.0582 317 ILE F CG1 5502 C CG2 . ILE C 339 ? 0.9122 0.6368 0.5669 -0.0620 -0.1371 -0.0698 317 ILE F CG2 5503 C CD1 . ILE C 339 ? 0.9393 0.7436 0.6375 -0.1060 -0.1296 -0.0592 317 ILE F CD1 5504 N N . ILE C 340 ? 0.8381 0.5493 0.5128 -0.0598 -0.1543 -0.0516 318 ILE F N 5505 C CA . ILE C 340 ? 0.8706 0.5379 0.5147 -0.0625 -0.1672 -0.0483 318 ILE F CA 5506 C C . ILE C 340 ? 0.9743 0.5926 0.5801 -0.0405 -0.1737 -0.0596 318 ILE F C 5507 O O . ILE C 340 ? 0.9707 0.6022 0.5894 -0.0121 -0.1704 -0.0689 318 ILE F O 5508 C CB . ILE C 340 ? 0.8870 0.5719 0.5527 -0.0636 -0.1708 -0.0422 318 ILE F CB 5509 C CG1 . ILE C 340 ? 0.8485 0.5741 0.5430 -0.0809 -0.1649 -0.0339 318 ILE F CG1 5510 C CG2 . ILE C 340 ? 0.9393 0.5776 0.5686 -0.0713 -0.1878 -0.0379 318 ILE F CG2 5511 C CD1 . ILE C 340 ? 0.9087 0.6633 0.6324 -0.0757 -0.1613 -0.0326 318 ILE F CD1 5512 N N . LYS C 341 ? 0.9818 0.5435 0.5366 -0.0533 -0.1841 -0.0584 319 LYS F N 5513 C CA . LYS C 341 ? 1.0531 0.5479 0.5553 -0.0321 -0.1943 -0.0701 319 LYS F CA 5514 C C . LYS C 341 ? 1.1406 0.5866 0.6128 -0.0314 -0.2153 -0.0649 319 LYS F C 5515 O O . LYS C 341 ? 1.1226 0.5705 0.5916 -0.0633 -0.2244 -0.0499 319 LYS F O 5516 C CB . LYS C 341 ? 1.1338 0.5802 0.5838 -0.0517 -0.1980 -0.0698 319 LYS F CB 5517 C CG . LYS C 341 ? 1.3089 0.7916 0.7787 -0.0465 -0.1794 -0.0791 319 LYS F CG 5518 C CD . LYS C 341 ? 1.4943 0.9313 0.9128 -0.0728 -0.1829 -0.0758 319 LYS F CD 5519 C CE . LYS C 341 ? 1.6250 1.0992 1.0624 -0.0723 -0.1655 -0.0845 319 LYS F CE 5520 N NZ . LYS C 341 ? 1.7939 1.2495 1.2098 -0.0342 -0.1590 -0.1088 319 LYS F NZ 5521 N N . TYR C 342 ? 1.1451 0.5529 0.5964 0.0055 -0.2238 -0.0773 320 TYR F N 5522 C CA . TYR C 342 ? 1.1870 0.5442 0.6090 0.0083 -0.2473 -0.0721 320 TYR F CA 5523 C C . TYR C 342 ? 1.3337 0.6014 0.6908 0.0426 -0.2667 -0.0855 320 TYR F C 5524 O O . TYR C 342 ? 1.3576 0.6157 0.7023 0.0752 -0.2573 -0.1030 320 TYR F O 5525 C CB . TYR C 342 ? 1.1429 0.5639 0.6261 0.0204 -0.2406 -0.0683 320 TYR F CB 5526 C CG . TYR C 342 ? 1.1482 0.6159 0.6687 0.0655 -0.2262 -0.0820 320 TYR F CG 5527 C CD1 . TYR C 342 ? 1.2265 0.6629 0.7292 0.1067 -0.2389 -0.0910 320 TYR F CD1 5528 C CD2 . TYR C 342 ? 1.0925 0.6396 0.6638 0.0658 -0.2020 -0.0847 320 TYR F CD2 5529 C CE1 . TYR C 342 ? 1.2205 0.7161 0.7595 0.1487 -0.2251 -0.1026 320 TYR F CE1 5530 C CE2 . TYR C 342 ? 1.0898 0.6919 0.6925 0.1008 -0.1899 -0.0950 320 TYR F CE2 5531 C CZ . TYR C 342 ? 1.2330 0.8159 0.8220 0.1429 -0.2001 -0.1040 320 TYR F CZ 5532 O OH . TYR C 342 ? 1.2318 0.8844 0.8538 0.1781 -0.1877 -0.1133 320 TYR F OH 5533 N N . ALA C 343 ? 1.3448 0.5469 0.6586 0.0358 -0.2952 -0.0778 321 ALA F N 5534 C CA . ALA C 343 ? 1.4492 0.5521 0.6943 0.0696 -0.3215 -0.0884 321 ALA F CA 5535 C C . ALA C 343 ? 1.4909 0.5980 0.7565 0.0823 -0.3376 -0.0817 321 ALA F C 5536 O O . ALA C 343 ? 1.4885 0.5759 0.7378 0.0408 -0.3566 -0.0640 321 ALA F O 5537 C CB . ALA C 343 ? 1.5535 0.5474 0.7007 0.0332 -0.3500 -0.0806 321 ALA F CB 5538 N N . ALA C 344 ? 1.4316 0.5784 0.7379 0.1365 -0.3281 -0.0944 322 ALA F N 5539 C CA . ALA C 344 ? 1.4203 0.5840 0.7545 0.1531 -0.3406 -0.0874 322 ALA F CA 5540 C C . ALA C 344 ? 1.5794 0.6444 0.8502 0.1968 -0.3737 -0.0963 322 ALA F C 5541 O O . ALA C 344 ? 1.6423 0.6624 0.8745 0.2425 -0.3747 -0.1166 322 ALA F O 5542 C CB . ALA C 344 ? 1.3409 0.6232 0.7624 0.1798 -0.3108 -0.0910 322 ALA F CB 5543 N N . SER C 345 ? 1.5572 0.5872 0.8151 0.1836 -0.4018 -0.0817 323 SER F N 5544 C CA . SER C 345 ? 1.6676 0.5967 0.8632 0.2223 -0.4401 -0.0865 323 SER F CA 5545 C C . SER C 345 ? 1.7076 0.6904 0.9497 0.2974 -0.4303 -0.1009 323 SER F C 5546 O O . SER C 345 ? 1.8059 0.7119 0.9949 0.3539 -0.4513 -0.1171 323 SER F O 5547 C CB . SER C 345 ? 1.7351 0.6194 0.9063 0.1770 -0.4739 -0.0638 323 SER F CB 5548 O OG . SER C 345 ? 1.7400 0.7311 0.9965 0.1602 -0.4559 -0.0501 323 SER F OG 5549 N N . LYS C 346 ? 1.5473 0.6617 0.8838 0.2978 -0.4000 -0.0945 324 LYS F N 5550 C CA . LYS C 346 ? 1.5243 0.7194 0.9153 0.3598 -0.3876 -0.1031 324 LYS F CA 5551 C C . LYS C 346 ? 1.4487 0.7895 0.9278 0.3488 -0.3451 -0.1005 324 LYS F C 5552 O O . LYS C 346 ? 1.3708 0.7435 0.8713 0.2938 -0.3279 -0.0906 324 LYS F O 5553 C CB . LYS C 346 ? 1.5859 0.7626 0.9805 0.3737 -0.4173 -0.0886 324 LYS F CB 5554 C CG . LYS C 346 ? 1.6649 0.8719 1.0916 0.3067 -0.4207 -0.0613 324 LYS F CG 5555 C CD . LYS C 346 ? 1.8130 0.9899 1.2342 0.3188 -0.4540 -0.0469 324 LYS F CD 5556 C CE . LYS C 346 ? 1.8707 1.0595 1.3080 0.2473 -0.4612 -0.0217 324 LYS F CE 5557 N NZ . LYS C 346 ? 2.0157 1.1747 1.4466 0.2546 -0.4951 -0.0061 324 LYS F NZ 5558 N N . LYS C 347 ? 1.3880 0.8167 0.9132 0.4017 -0.3305 -0.1090 325 LYS F N 5559 C CA . LYS C 347 ? 1.2834 0.8508 0.8837 0.3924 -0.2954 -0.1049 325 LYS F CA 5560 C C . LYS C 347 ? 1.2707 0.8969 0.9198 0.3572 -0.2968 -0.0784 325 LYS F C 5561 O O . LYS C 347 ? 1.3031 0.8996 0.9452 0.3715 -0.3214 -0.0682 325 LYS F O 5562 C CB . LYS C 347 ? 1.3321 0.9754 0.9545 0.4612 -0.2821 -0.1239 325 LYS F CB 5563 C CG . LYS C 347 ? 1.3936 1.1739 1.0768 0.4476 -0.2469 -0.1232 325 LYS F CG 5564 C CD . LYS C 347 ? 1.5258 1.3933 1.2292 0.5145 -0.2349 -0.1418 325 LYS F CD 5565 C CE . LYS C 347 ? 1.5514 1.5650 1.3133 0.4929 -0.2050 -0.1357 325 LYS F CE 5566 N NZ . LYS C 347 ? 1.5997 1.7045 1.4123 0.4786 -0.2061 -0.1096 325 LYS F NZ 5567 N N . GLY C 348 ? 1.1396 0.8413 0.8320 0.3111 -0.2723 -0.0674 326 GLY F N 5568 C CA . GLY C 348 ? 1.0767 0.8330 0.8098 0.2727 -0.2701 -0.0433 326 GLY F CA 5569 C C . GLY C 348 ? 1.0488 0.8504 0.8070 0.2189 -0.2472 -0.0352 326 GLY F C 5570 O O . GLY C 348 ? 1.0317 0.8241 0.7790 0.2093 -0.2337 -0.0469 326 GLY F O 5571 N N . LYS C 349 ? 0.9573 0.8050 0.7460 0.1844 -0.2440 -0.0150 327 LYS F N 5572 C CA . LYS C 349 ? 0.8915 0.7734 0.6977 0.1361 -0.2256 -0.0071 327 LYS F CA 5573 C C . LYS C 349 ? 0.9410 0.7538 0.7235 0.0946 -0.2330 -0.0033 327 LYS F C 5574 O O . LYS C 349 ? 0.9609 0.7302 0.7289 0.0838 -0.2521 0.0054 327 LYS F O 5575 C CB . LYS C 349 ? 0.8800 0.8432 0.7213 0.1181 -0.2182 0.0121 327 LYS F CB 5576 C CG . LYS C 349 ? 1.0415 1.0997 0.9081 0.1379 -0.2026 0.0103 327 LYS F CG 5577 C CD . LYS C 349 ? 1.1978 1.3087 1.0817 0.1830 -0.2110 0.0137 327 LYS F CD 5578 C CE . LYS C 349 ? 1.3076 1.4995 1.2193 0.1604 -0.2097 0.0390 327 LYS F CE 5579 N NZ . LYS C 349 ? 1.4529 1.7002 1.3841 0.2066 -0.2200 0.0444 327 LYS F NZ 5580 N N . CYS C 350 ? 0.8719 0.6802 0.6503 0.0709 -0.2190 -0.0094 328 CYS F N 5581 C CA . CYS C 350 ? 0.8641 0.6270 0.6244 0.0330 -0.2224 -0.0068 328 CYS F CA 5582 C C . CYS C 350 ? 0.8516 0.6558 0.6328 0.0016 -0.2049 -0.0013 328 CYS F C 5583 O O . CYS C 350 ? 0.8220 0.6666 0.6175 0.0063 -0.1902 -0.0050 328 CYS F O 5584 C CB . CYS C 350 ? 0.9042 0.6108 0.6301 0.0370 -0.2270 -0.0193 328 CYS F CB 5585 S SG . CYS C 350 ? 1.0394 0.6559 0.7139 0.0525 -0.2583 -0.0216 328 CYS F SG 5586 N N . ALA C 351 ? 0.7908 0.5822 0.5690 -0.0306 -0.2082 0.0070 329 ALA F N 5587 C CA . ALA C 351 ? 0.7486 0.5655 0.5376 -0.0570 -0.1942 0.0102 329 ALA F CA 5588 C C . ALA C 351 ? 0.7826 0.5829 0.5616 -0.0653 -0.1873 0.0005 329 ALA F C 5589 O O . ALA C 351 ? 0.7982 0.5635 0.5576 -0.0693 -0.1964 -0.0032 329 ALA F O 5590 C CB . ALA C 351 ? 0.7551 0.5672 0.5425 -0.0846 -0.1998 0.0206 329 ALA F CB 5591 N N . VAL C 352 ? 0.7093 0.5338 0.4975 -0.0697 -0.1739 -0.0018 330 VAL F N 5592 C CA . VAL C 352 ? 0.6972 0.5131 0.4798 -0.0752 -0.1677 -0.0094 330 VAL F CA 5593 C C . VAL C 352 ? 0.7282 0.5499 0.5111 -0.0940 -0.1622 -0.0079 330 VAL F C 5594 O O . VAL C 352 ? 0.7145 0.5495 0.5002 -0.0997 -0.1579 -0.0034 330 VAL F O 5595 C CB . VAL C 352 ? 0.7387 0.5703 0.5264 -0.0624 -0.1601 -0.0148 330 VAL F CB 5596 C CG1 . VAL C 352 ? 0.7315 0.5524 0.5135 -0.0680 -0.1563 -0.0205 330 VAL F CG1 5597 C CG2 . VAL C 352 ? 0.7551 0.5866 0.5409 -0.0393 -0.1634 -0.0192 330 VAL F CG2 5598 N N . HIS C 353 ? 0.6847 0.4975 0.4602 -0.1040 -0.1632 -0.0116 331 HIS F N 5599 C CA . HIS C 353 ? 0.6743 0.4968 0.4488 -0.1154 -0.1571 -0.0141 331 HIS F CA 5600 C C . HIS C 353 ? 0.7240 0.5549 0.4959 -0.1164 -0.1549 -0.0201 331 HIS F C 5601 O O . HIS C 353 ? 0.7280 0.5542 0.4918 -0.1228 -0.1621 -0.0187 331 HIS F O 5602 C CB . HIS C 353 ? 0.6888 0.5112 0.4586 -0.1331 -0.1613 -0.0093 331 HIS F CB 5603 C CG . HIS C 353 ? 0.7297 0.5607 0.4950 -0.1412 -0.1530 -0.0136 331 HIS F CG 5604 N ND1 . HIS C 353 ? 0.7547 0.6010 0.5154 -0.1509 -0.1506 -0.0199 331 HIS F ND1 5605 C CD2 . HIS C 353 ? 0.7541 0.5790 0.5130 -0.1407 -0.1476 -0.0127 331 HIS F CD2 5606 C CE1 . HIS C 353 ? 0.7527 0.5999 0.5062 -0.1504 -0.1424 -0.0255 331 HIS F CE1 5607 N NE2 . HIS C 353 ? 0.7605 0.5880 0.5088 -0.1458 -0.1416 -0.0208 331 HIS F NE2 5608 N N . SER C 354 ? 0.6774 0.5195 0.4519 -0.1105 -0.1470 -0.0259 332 SER F N 5609 C CA . SER C 354 ? 0.6756 0.5384 0.4519 -0.1073 -0.1441 -0.0310 332 SER F CA 5610 C C . SER C 354 ? 0.7353 0.6230 0.5079 -0.1203 -0.1429 -0.0338 332 SER F C 5611 O O . SER C 354 ? 0.7327 0.6196 0.5016 -0.1220 -0.1386 -0.0376 332 SER F O 5612 C CB . SER C 354 ? 0.7207 0.5820 0.4991 -0.0898 -0.1390 -0.0366 332 SER F CB 5613 O OG . SER C 354 ? 0.8297 0.7173 0.6137 -0.0823 -0.1372 -0.0402 332 SER F OG 5614 N N . MET C 355 ? 0.7017 0.6127 0.4706 -0.1336 -0.1477 -0.0312 333 MET F N 5615 C CA . MET C 355 ? 0.7081 0.6562 0.4715 -0.1523 -0.1482 -0.0327 333 MET F CA 5616 C C . MET C 355 ? 0.7571 0.7534 0.5300 -0.1369 -0.1373 -0.0427 333 MET F C 5617 O O . MET C 355 ? 0.7557 0.7959 0.5265 -0.1479 -0.1342 -0.0473 333 MET F O 5618 C CB . MET C 355 ? 0.7521 0.7031 0.4977 -0.1804 -0.1625 -0.0227 333 MET F CB 5619 C CG . MET C 355 ? 0.8157 0.7160 0.5464 -0.1920 -0.1762 -0.0150 333 MET F CG 5620 S SD . MET C 355 ? 0.8745 0.7708 0.6034 -0.2087 -0.1786 -0.0143 333 MET F SD 5621 C CE . MET C 355 ? 0.8530 0.7843 0.5583 -0.2507 -0.1916 -0.0091 333 MET F CE 5622 N N . THR C 356 ? 0.7134 0.7031 0.4959 -0.1104 -0.1325 -0.0464 334 THR F N 5623 C CA . THR C 356 ? 0.7178 0.7440 0.5090 -0.0855 -0.1246 -0.0564 334 THR F CA 5624 C C . THR C 356 ? 0.7856 0.7704 0.5695 -0.0618 -0.1202 -0.0663 334 THR F C 5625 O O . THR C 356 ? 0.7806 0.7174 0.5598 -0.0586 -0.1245 -0.0618 334 THR F O 5626 C CB . THR C 356 ? 0.8178 0.8617 0.6186 -0.0772 -0.1277 -0.0502 334 THR F CB 5627 O OG1 . THR C 356 ? 0.8113 0.8743 0.6058 -0.1070 -0.1351 -0.0381 334 THR F OG1 5628 C CG2 . THR C 356 ? 0.8079 0.9030 0.6204 -0.0500 -0.1218 -0.0586 334 THR F CG2 5629 N N . ASN C 357 ? 0.7640 0.7673 0.5413 -0.0478 -0.1128 -0.0797 335 ASN F N 5630 C CA . ASN C 357 ? 0.7941 0.7493 0.5507 -0.0277 -0.1107 -0.0900 335 ASN F CA 5631 C C . ASN C 357 ? 0.8651 0.7872 0.6152 0.0029 -0.1161 -0.0932 335 ASN F C 5632 O O . ASN C 357 ? 0.8901 0.7521 0.6132 0.0107 -0.1208 -0.0961 335 ASN F O 5633 C CB . ASN C 357 ? 0.8356 0.8181 0.5810 -0.0191 -0.1011 -0.1060 335 ASN F CB 5634 C CG . ASN C 357 ? 1.1359 1.1399 0.8807 -0.0550 -0.0985 -0.1020 335 ASN F CG 5635 O OD1 . ASN C 357 ? 1.0638 1.0278 0.8015 -0.0794 -0.1037 -0.0912 335 ASN F OD1 5636 N ND2 . ASN C 357 ? 1.0337 1.1065 0.7853 -0.0600 -0.0917 -0.1100 335 ASN F ND2 5637 N N . ALA C 358 ? 0.8113 0.7701 0.5813 0.0157 -0.1179 -0.0906 336 ALA F N 5638 C CA . ALA C 358 ? 0.8292 0.7617 0.5955 0.0425 -0.1259 -0.0915 336 ALA F CA 5639 C C . ALA C 358 ? 0.8671 0.7514 0.6296 0.0253 -0.1356 -0.0781 336 ALA F C 5640 O O . ALA C 358 ? 0.8847 0.7318 0.6348 0.0401 -0.1456 -0.0777 336 ALA F O 5641 C CB . ALA C 358 ? 0.8285 0.8284 0.6197 0.0591 -0.1244 -0.0911 336 ALA F CB 5642 N N . VAL C 359 ? 0.7929 0.6788 0.5634 -0.0052 -0.1340 -0.0677 337 VAL F N 5643 C CA . VAL C 359 ? 0.7781 0.6327 0.5473 -0.0211 -0.1405 -0.0569 337 VAL F CA 5644 C C . VAL C 359 ? 0.8236 0.6507 0.5803 -0.0395 -0.1401 -0.0534 337 VAL F C 5645 O O . VAL C 359 ? 0.8091 0.6520 0.5689 -0.0505 -0.1349 -0.0540 337 VAL F O 5646 C CB . VAL C 359 ? 0.8001 0.6849 0.5887 -0.0344 -0.1403 -0.0480 337 VAL F CB 5647 C CG1 . VAL C 359 ? 0.7898 0.6470 0.5759 -0.0472 -0.1448 -0.0404 337 VAL F CG1 5648 C CG2 . VAL C 359 ? 0.7991 0.7174 0.5996 -0.0202 -0.1416 -0.0477 337 VAL F CG2 5649 N N . THR C 360 ? 0.7897 0.5808 0.5311 -0.0456 -0.1471 -0.0480 338 THR F N 5650 C CA . THR C 360 ? 0.7869 0.5620 0.5169 -0.0639 -0.1480 -0.0413 338 THR F CA 5651 C C . THR C 360 ? 0.8155 0.5956 0.5534 -0.0750 -0.1515 -0.0324 338 THR F C 5652 O O . THR C 360 ? 0.8169 0.5873 0.5495 -0.0730 -0.1578 -0.0310 338 THR F O 5653 C CB . THR C 360 ? 0.9335 0.6660 0.6264 -0.0646 -0.1538 -0.0430 338 THR F CB 5654 O OG1 . THR C 360 ? 0.9576 0.6836 0.6405 -0.0445 -0.1507 -0.0559 338 THR F OG1 5655 C CG2 . THR C 360 ? 0.9159 0.6427 0.5973 -0.0864 -0.1528 -0.0349 338 THR F CG2 5656 N N . ILE C 361 ? 0.7515 0.5478 0.5007 -0.0853 -0.1484 -0.0269 339 ILE F N 5657 C CA . ILE C 361 ? 0.7353 0.5451 0.4929 -0.0900 -0.1498 -0.0214 339 ILE F CA 5658 C C . ILE C 361 ? 0.7947 0.6053 0.5378 -0.1034 -0.1539 -0.0127 339 ILE F C 5659 O O . ILE C 361 ? 0.7955 0.6023 0.5303 -0.1117 -0.1537 -0.0083 339 ILE F O 5660 C CB . ILE C 361 ? 0.7578 0.5833 0.5325 -0.0869 -0.1466 -0.0217 339 ILE F CB 5661 C CG1 . ILE C 361 ? 0.7592 0.5864 0.5392 -0.0837 -0.1451 -0.0264 339 ILE F CG1 5662 C CG2 . ILE C 361 ? 0.7614 0.5995 0.5422 -0.0833 -0.1469 -0.0205 339 ILE F CG2 5663 C CD1 . ILE C 361 ? 0.8477 0.6782 0.6301 -0.0783 -0.1451 -0.0292 339 ILE F CD1 5664 N N . ARG C 362 ? 0.7546 0.5752 0.4928 -0.1096 -0.1582 -0.0089 340 ARG F N 5665 C CA . ARG C 362 ? 0.7636 0.5986 0.4852 -0.1279 -0.1638 0.0017 340 ARG F CA 5666 C C . ARG C 362 ? 0.7968 0.6713 0.5362 -0.1273 -0.1590 0.0077 340 ARG F C 5667 O O . ARG C 362 ? 0.8005 0.6840 0.5264 -0.1430 -0.1624 0.0187 340 ARG F O 5668 C CB . ARG C 362 ? 0.7753 0.6213 0.4883 -0.1374 -0.1702 0.0035 340 ARG F CB 5669 C CG . ARG C 362 ? 0.9346 0.7915 0.6171 -0.1654 -0.1809 0.0166 340 ARG F CG 5670 C CD . ARG C 362 ? 1.0716 0.9694 0.7565 -0.1767 -0.1837 0.0187 340 ARG F CD 5671 N NE . ARG C 362 ? 1.2419 1.1132 0.8849 -0.2047 -0.2015 0.0265 340 ARG F NE 5672 C CZ . ARG C 362 ? 1.4452 1.3336 1.0819 -0.2191 -0.2084 0.0270 340 ARG F CZ 5673 N NH1 . ARG C 362 ? 1.2601 1.1932 0.9305 -0.2057 -0.1960 0.0184 340 ARG F NH1 5674 N NH2 . ARG C 362 ? 1.3267 1.1817 0.9177 -0.2485 -0.2294 0.0360 340 ARG F NH2 5675 N N . GLU C 363 ? 0.7370 0.6312 0.5017 -0.1089 -0.1529 0.0012 341 GLU F N 5676 C CA . GLU C 363 ? 0.7273 0.6543 0.5085 -0.0990 -0.1506 0.0044 341 GLU F CA 5677 C C . GLU C 363 ? 0.7772 0.6856 0.5632 -0.0963 -0.1512 0.0062 341 GLU F C 5678 O O . GLU C 363 ? 0.7710 0.6493 0.5569 -0.0925 -0.1505 -0.0008 341 GLU F O 5679 C CB . GLU C 363 ? 0.7408 0.6819 0.5358 -0.0773 -0.1467 -0.0056 341 GLU F CB 5680 C CG . GLU C 363 ? 0.8712 0.8404 0.6631 -0.0815 -0.1452 -0.0083 341 GLU F CG 5681 C CD . GLU C 363 ? 1.1143 1.0546 0.8980 -0.0875 -0.1458 -0.0145 341 GLU F CD 5682 O OE1 . GLU C 363 ? 1.0251 0.9284 0.8015 -0.0935 -0.1487 -0.0140 341 GLU F OE1 5683 O OE2 . GLU C 363 ? 1.0362 0.9973 0.8201 -0.0871 -0.1437 -0.0194 341 GLU F OE2 5684 N N . ALA C 364 ? 0.7370 0.6696 0.5271 -0.1007 -0.1536 0.0170 342 ALA F N 5685 C CA . ALA C 364 ? 0.7376 0.6558 0.5313 -0.1029 -0.1566 0.0213 342 ALA F CA 5686 C C . ALA C 364 ? 0.7920 0.7188 0.6014 -0.0799 -0.1606 0.0192 342 ALA F C 5687 O O . ALA C 364 ? 0.7940 0.6924 0.6021 -0.0794 -0.1662 0.0180 342 ALA F O 5688 C CB . ALA C 364 ? 0.7521 0.6854 0.5356 -0.1256 -0.1592 0.0370 342 ALA F CB 5689 N N . GLU C 365 ? 0.7506 0.7157 0.5704 -0.0610 -0.1595 0.0182 343 GLU F N 5690 C CA . GLU C 365 ? 0.7646 0.7344 0.5937 -0.0305 -0.1647 0.0136 343 GLU F CA 5691 C C . GLU C 365 ? 0.8197 0.8115 0.6517 -0.0053 -0.1593 0.0011 343 GLU F C 5692 O O . GLU C 365 ? 0.8016 0.8374 0.6370 -0.0131 -0.1524 0.0024 343 GLU F O 5693 C CB . GLU C 365 ? 0.7871 0.7928 0.6282 -0.0265 -0.1711 0.0279 343 GLU F CB 5694 C CG . GLU C 365 ? 0.9161 0.9954 0.7669 -0.0343 -0.1665 0.0401 343 GLU F CG 5695 C CD . GLU C 365 ? 1.2061 1.3393 1.0751 -0.0136 -0.1723 0.0506 343 GLU F CD 5696 O OE1 . GLU C 365 ? 1.1626 1.2866 1.0337 -0.0247 -0.1807 0.0643 343 GLU F OE1 5697 O OE2 . GLU C 365 ? 1.1386 1.3285 1.0202 0.0140 -0.1686 0.0452 343 GLU F OE2 5698 N N . ILE C 366 ? 0.8032 0.7601 0.6273 0.0219 -0.1642 -0.0110 344 ILE F N 5699 C CA . ILE C 366 ? 0.8184 0.7859 0.6387 0.0496 -0.1594 -0.0259 344 ILE F CA 5700 C C . ILE C 366 ? 0.9089 0.8641 0.7236 0.0909 -0.1688 -0.0331 344 ILE F C 5701 O O . ILE C 366 ? 0.9252 0.8333 0.7291 0.0933 -0.1828 -0.0286 344 ILE F O 5702 C CB . ILE C 366 ? 0.8610 0.7839 0.6632 0.0401 -0.1557 -0.0367 344 ILE F CB 5703 C CG1 . ILE C 366 ? 0.8920 0.7414 0.6708 0.0364 -0.1668 -0.0386 344 ILE F CG1 5704 C CG2 . ILE C 366 ? 0.8365 0.7770 0.6440 0.0084 -0.1478 -0.0315 344 ILE F CG2 5705 C CD1 . ILE C 366 ? 1.0368 0.8431 0.7886 0.0626 -0.1730 -0.0517 344 ILE F CD1 5706 N N . GLU C 367 ? 0.8822 0.8773 0.7004 0.1236 -0.1626 -0.0453 345 GLU F N 5707 C CA . GLU C 367 ? 0.9303 0.9123 0.7389 0.1727 -0.1716 -0.0562 345 GLU F CA 5708 C C . GLU C 367 ? 1.0276 0.9214 0.7951 0.1870 -0.1783 -0.0731 345 GLU F C 5709 O O . GLU C 367 ? 1.0217 0.9171 0.7793 0.1857 -0.1672 -0.0853 345 GLU F O 5710 C CB . GLU C 367 ? 0.9474 1.0248 0.7780 0.2052 -0.1607 -0.0630 345 GLU F CB 5711 C CG . GLU C 367 ? 1.0847 1.2228 0.9402 0.2266 -0.1673 -0.0506 345 GLU F CG 5712 C CD . GLU C 367 ? 1.4081 1.4977 1.2482 0.2776 -0.1847 -0.0589 345 GLU F CD 5713 O OE1 . GLU C 367 ? 1.3833 1.4934 1.2173 0.3295 -0.1825 -0.0779 345 GLU F OE1 5714 O OE2 . GLU C 367 ? 1.3451 1.3746 1.1758 0.2658 -0.2020 -0.0469 345 GLU F OE2 5715 N N . VAL C 368 ? 1.0298 0.8434 0.7681 0.1946 -0.1986 -0.0717 346 VAL F N 5716 C CA . VAL C 368 ? 1.0883 0.8065 0.7744 0.2029 -0.2107 -0.0842 346 VAL F CA 5717 C C . VAL C 368 ? 1.2089 0.9034 0.8686 0.2626 -0.2187 -0.1030 346 VAL F C 5718 O O . VAL C 368 ? 1.2174 0.9466 0.8950 0.2979 -0.2249 -0.1018 346 VAL F O 5719 C CB . VAL C 368 ? 1.1583 0.7942 0.8124 0.1688 -0.2309 -0.0727 346 VAL F CB 5720 C CG1 . VAL C 368 ? 1.0905 0.7519 0.7665 0.1169 -0.2200 -0.0598 346 VAL F CG1 5721 C CG2 . VAL C 368 ? 1.1892 0.7978 0.8372 0.1810 -0.2535 -0.0633 346 VAL F CG2 5722 N N . GLU C 369 ? 1.2151 0.8523 0.8306 0.2753 -0.2186 -0.1205 347 GLU F N 5723 C CA . GLU C 369 ? 1.2946 0.8985 0.8748 0.3358 -0.2254 -0.1429 347 GLU F CA 5724 C C . GLU C 369 ? 1.4424 0.9064 0.9425 0.3425 -0.2532 -0.1494 347 GLU F C 5725 O O . GLU C 369 ? 1.5026 0.9118 0.9752 0.3756 -0.2778 -0.1504 347 GLU F O 5726 C CB . GLU C 369 ? 1.2997 0.9669 0.8915 0.3540 -0.2001 -0.1620 347 GLU F CB 5727 C CG . GLU C 369 ? 1.3649 1.1705 1.0220 0.3657 -0.1800 -0.1594 347 GLU F CG 5728 C CD . GLU C 369 ? 1.6539 1.5136 1.3112 0.4291 -0.1709 -0.1835 347 GLU F CD 5729 O OE1 . GLU C 369 ? 1.5711 1.4819 1.2328 0.4271 -0.1508 -0.1974 347 GLU F OE1 5730 O OE2 . GLU C 369 ? 1.6170 1.4715 1.2697 0.4818 -0.1844 -0.1889 347 GLU F OE2 5731 N N . GLY C 370 ? 1.4140 0.8207 0.8739 0.3088 -0.2517 -0.1517 348 GLY F N 5732 C CA . GLY C 370 ? 1.5106 0.7827 0.8836 0.3028 -0.2788 -0.1549 348 GLY F CA 5733 C C . GLY C 370 ? 1.5481 0.7892 0.8934 0.2496 -0.2727 -0.1491 348 GLY F C 5734 O O . GLY C 370 ? 1.4879 0.7434 0.8512 0.1963 -0.2735 -0.1287 348 GLY F O 5735 N N . ASN C 371 ? 1.5600 0.7614 0.8603 0.2647 -0.2664 -0.1673 349 ASN F N 5736 C CA . ASN C 371 ? 1.5541 0.7277 0.8246 0.2160 -0.2604 -0.1617 349 ASN F CA 5737 C C . ASN C 371 ? 1.5125 0.7959 0.8485 0.2055 -0.2260 -0.1653 349 ASN F C 5738 O O . ASN C 371 ? 1.5301 0.8021 0.8406 0.2034 -0.2147 -0.1771 349 ASN F O 5739 C CB . ASN C 371 ? 1.6932 0.7436 0.8629 0.2301 -0.2780 -0.1767 349 ASN F CB 5740 C CG . ASN C 371 ? 2.1004 1.0255 1.1887 0.2236 -0.3181 -0.1684 349 ASN F CG 5741 O OD1 . ASN C 371 ? 2.0934 0.9802 1.1652 0.2698 -0.3368 -0.1767 349 ASN F OD1 5742 N ND2 . ASN C 371 ? 2.0281 0.8868 1.0594 0.1647 -0.3347 -0.1507 349 ASN F ND2 5743 N N . SER C 372 ? 1.3726 0.7567 0.7872 0.1955 -0.2117 -0.1539 350 SER F N 5744 C CA . SER C 372 ? 1.2863 0.7735 0.7613 0.1817 -0.1844 -0.1537 350 SER F CA 5745 C C . SER C 372 ? 1.2582 0.7741 0.7647 0.1255 -0.1804 -0.1314 350 SER F C 5746 O O . SER C 372 ? 1.2671 0.7279 0.7461 0.0963 -0.1961 -0.1178 350 SER F O 5747 C CB . SER C 372 ? 1.2941 0.8751 0.8257 0.2165 -0.1728 -0.1589 350 SER F CB 5748 O OG . SER C 372 ? 1.4807 1.0473 0.9880 0.2754 -0.1762 -0.1804 350 SER F OG 5749 N N . GLN C 373 ? 1.1405 0.7428 0.7001 0.1107 -0.1611 -0.1281 351 GLN F N 5750 C CA . GLN C 373 ? 1.0724 0.7063 0.6635 0.0666 -0.1568 -0.1100 351 GLN F CA 5751 C C . GLN C 373 ? 1.0532 0.7710 0.7020 0.0650 -0.1467 -0.1033 351 GLN F C 5752 O O . GLN C 373 ? 1.0415 0.8138 0.7097 0.0883 -0.1375 -0.1125 351 GLN F O 5753 C CB . GLN C 373 ? 1.0841 0.7143 0.6629 0.0385 -0.1492 -0.1095 351 GLN F CB 5754 C CG . GLN C 373 ? 1.2770 0.9517 0.8639 0.0515 -0.1338 -0.1246 351 GLN F CG 5755 C CD . GLN C 373 ? 1.4940 1.1903 1.0901 0.0142 -0.1264 -0.1172 351 GLN F CD 5756 O OE1 . GLN C 373 ? 1.3854 1.1444 1.0214 -0.0006 -0.1194 -0.1109 351 GLN F OE1 5757 N NE2 . GLN C 373 ? 1.4339 1.0750 0.9883 -0.0038 -0.1304 -0.1164 351 GLN F NE2 5758 N N . LEU C 374 ? 0.9644 0.6937 0.6355 0.0365 -0.1490 -0.0873 352 LEU F N 5759 C CA . LEU C 374 ? 0.9079 0.7001 0.6213 0.0283 -0.1426 -0.0787 352 LEU F CA 5760 C C . LEU C 374 ? 0.9144 0.7275 0.6428 -0.0034 -0.1372 -0.0704 352 LEU F C 5761 O O . LEU C 374 ? 0.9130 0.6935 0.6273 -0.0214 -0.1406 -0.0661 352 LEU F O 5762 C CB . LEU C 374 ? 0.9017 0.6860 0.6245 0.0287 -0.1515 -0.0689 352 LEU F CB 5763 C CG . LEU C 374 ? 0.9623 0.7044 0.6719 0.0044 -0.1608 -0.0593 352 LEU F CG 5764 C CD1 . LEU C 374 ? 0.9180 0.6935 0.6552 -0.0177 -0.1561 -0.0489 352 LEU F CD1 5765 C CD2 . LEU C 374 ? 1.0305 0.7306 0.7196 0.0136 -0.1759 -0.0574 352 LEU F CD2 5766 N N . GLN C 375 ? 0.8364 0.7032 0.5893 -0.0111 -0.1315 -0.0667 353 GLN F N 5767 C CA . GLN C 375 ? 0.8060 0.6851 0.5676 -0.0383 -0.1309 -0.0587 353 GLN F CA 5768 C C . GLN C 375 ? 0.8259 0.7197 0.6024 -0.0485 -0.1342 -0.0479 353 GLN F C 5769 O O . GLN C 375 ? 0.8143 0.7417 0.5996 -0.0433 -0.1334 -0.0454 353 GLN F O 5770 C CB . GLN C 375 ? 0.8214 0.7382 0.5838 -0.0468 -0.1257 -0.0633 353 GLN F CB 5771 C CG . GLN C 375 ? 1.0264 0.9363 0.7879 -0.0745 -0.1295 -0.0558 353 GLN F CG 5772 C CD . GLN C 375 ? 1.2891 1.2362 1.0478 -0.0898 -0.1276 -0.0586 353 GLN F CD 5773 O OE1 . GLN C 375 ? 1.2283 1.2204 0.9922 -0.0978 -0.1286 -0.0557 353 GLN F OE1 5774 N NE2 . GLN C 375 ? 1.2080 1.1394 0.9554 -0.0998 -0.1262 -0.0622 353 GLN F NE2 5775 N N . ILE C 376 ? 0.7697 0.6399 0.5461 -0.0622 -0.1381 -0.0414 354 ILE F N 5776 C CA . ILE C 376 ? 0.7536 0.6258 0.5357 -0.0707 -0.1414 -0.0335 354 ILE F CA 5777 C C . ILE C 376 ? 0.7943 0.6609 0.5723 -0.0860 -0.1458 -0.0292 354 ILE F C 5778 O O . ILE C 376 ? 0.7898 0.6466 0.5655 -0.0901 -0.1468 -0.0304 354 ILE F O 5779 C CB . ILE C 376 ? 0.7937 0.6440 0.5766 -0.0666 -0.1433 -0.0317 354 ILE F CB 5780 C CG1 . ILE C 376 ? 0.8051 0.6325 0.5812 -0.0696 -0.1448 -0.0330 354 ILE F CG1 5781 C CG2 . ILE C 376 ? 0.8109 0.6643 0.5951 -0.0537 -0.1441 -0.0326 354 ILE F CG2 5782 C CD1 . ILE C 376 ? 0.8901 0.7135 0.6687 -0.0757 -0.1465 -0.0295 354 ILE F CD1 5783 N N . SER C 377 ? 0.7500 0.6177 0.5223 -0.0947 -0.1505 -0.0232 355 SER F N 5784 C CA . SER C 377 ? 0.7577 0.6060 0.5161 -0.1060 -0.1593 -0.0193 355 SER F CA 5785 C C . SER C 377 ? 0.8039 0.6271 0.5595 -0.0983 -0.1604 -0.0198 355 SER F C 5786 O O . SER C 377 ? 0.7969 0.6215 0.5524 -0.0971 -0.1576 -0.0185 355 SER F O 5787 C CB . SER C 377 ? 0.8180 0.6777 0.5578 -0.1251 -0.1675 -0.0121 355 SER F CB 5788 O OG . SER C 377 ? 0.9297 0.8243 0.6723 -0.1337 -0.1659 -0.0129 355 SER F OG 5789 N N . PHE C 378 ? 0.7611 0.5669 0.5153 -0.0922 -0.1641 -0.0218 356 PHE F N 5790 C CA . PHE C 378 ? 0.7638 0.5557 0.5161 -0.0801 -0.1636 -0.0252 356 PHE F CA 5791 C C . PHE C 378 ? 0.8413 0.6036 0.5742 -0.0735 -0.1747 -0.0262 356 PHE F C 5792 O O . PHE C 378 ? 0.8445 0.5974 0.5708 -0.0783 -0.1840 -0.0230 356 PHE F O 5793 C CB . PHE C 378 ? 0.7677 0.5789 0.5393 -0.0715 -0.1557 -0.0284 356 PHE F CB 5794 C CG . PHE C 378 ? 0.7821 0.6025 0.5617 -0.0696 -0.1573 -0.0271 356 PHE F CG 5795 C CD1 . PHE C 378 ? 0.8109 0.6380 0.5939 -0.0790 -0.1556 -0.0247 356 PHE F CD1 5796 C CD2 . PHE C 378 ? 0.8173 0.6425 0.5998 -0.0572 -0.1603 -0.0283 356 PHE F CD2 5797 C CE1 . PHE C 378 ? 0.8217 0.6561 0.6085 -0.0822 -0.1576 -0.0211 356 PHE F CE1 5798 C CE2 . PHE C 378 ? 0.8491 0.6898 0.6404 -0.0575 -0.1626 -0.0239 356 PHE F CE2 5799 C CZ . PHE C 378 ? 0.8152 0.6587 0.6076 -0.0732 -0.1614 -0.0192 356 PHE F CZ 5800 N N . SER C 379 ? 0.8194 0.5636 0.5398 -0.0616 -0.1749 -0.0312 357 SER F N 5801 C CA . SER C 379 ? 0.8599 0.5667 0.5549 -0.0467 -0.1865 -0.0354 357 SER F CA 5802 C C . SER C 379 ? 0.9129 0.6390 0.6232 -0.0199 -0.1790 -0.0451 357 SER F C 5803 O O . SER C 379 ? 0.8907 0.6400 0.6120 -0.0186 -0.1672 -0.0495 357 SER F O 5804 C CB . SER C 379 ? 0.9440 0.6052 0.5969 -0.0560 -0.1955 -0.0341 357 SER F CB 5805 O OG . SER C 379 ? 1.1080 0.7160 0.7236 -0.0417 -0.2120 -0.0381 357 SER F OG 5806 N N . THR C 380 ? 0.8929 0.6157 0.6042 0.0004 -0.1868 -0.0476 358 THR F N 5807 C CA . THR C 380 ? 0.8958 0.6508 0.6229 0.0299 -0.1809 -0.0565 358 THR F CA 5808 C C . THR C 380 ? 0.9972 0.7206 0.7054 0.0596 -0.1966 -0.0611 358 THR F C 5809 O O . THR C 380 ? 1.0157 0.6961 0.7035 0.0509 -0.2136 -0.0541 358 THR F O 5810 C CB . THR C 380 ? 0.9530 0.7736 0.7187 0.0222 -0.1696 -0.0511 358 THR F CB 5811 O OG1 . THR C 380 ? 0.9528 0.8198 0.7325 0.0456 -0.1626 -0.0588 358 THR F OG1 5812 C CG2 . THR C 380 ? 0.9225 0.7489 0.6992 0.0125 -0.1770 -0.0404 358 THR F CG2 5813 N N . ALA C 381 ? 0.9752 0.7222 0.6884 0.0950 -0.1922 -0.0731 359 ALA F N 5814 C CA . ALA C 381 ? 1.0275 0.7493 0.7241 0.1344 -0.2072 -0.0801 359 ALA F CA 5815 C C . ALA C 381 ? 1.0539 0.8517 0.7926 0.1532 -0.2029 -0.0766 359 ALA F C 5816 O O . ALA C 381 ? 1.0866 0.8730 0.8204 0.1835 -0.2177 -0.0774 359 ALA F O 5817 C CB . ALA C 381 ? 1.0895 0.7819 0.7544 0.1676 -0.2059 -0.0990 359 ALA F CB 5818 N N . LEU C 382 ? 0.9533 0.8268 0.7289 0.1331 -0.1851 -0.0708 360 LEU F N 5819 C CA . LEU C 382 ? 0.9243 0.8806 0.7364 0.1397 -0.1801 -0.0634 360 LEU F CA 5820 C C . LEU C 382 ? 0.9529 0.9071 0.7763 0.1160 -0.1896 -0.0452 360 LEU F C 5821 O O . LEU C 382 ? 0.9289 0.8478 0.7444 0.0809 -0.1904 -0.0374 360 LEU F O 5822 C CB . LEU C 382 ? 0.8828 0.9111 0.7163 0.1185 -0.1617 -0.0623 360 LEU F CB 5823 C CG . LEU C 382 ? 0.9560 1.0282 0.7903 0.1438 -0.1502 -0.0791 360 LEU F CG 5824 C CD1 . LEU C 382 ? 0.9269 1.0188 0.7622 0.1088 -0.1378 -0.0785 360 LEU F CD1 5825 C CD2 . LEU C 382 ? 0.9886 1.1562 0.8496 0.1715 -0.1469 -0.0795 360 LEU F CD2 5826 N N . ALA C 383 ? 0.9137 0.9121 0.7561 0.1358 -0.1963 -0.0383 361 ALA F N 5827 C CA . ALA C 383 ? 0.8957 0.9005 0.7495 0.1130 -0.2055 -0.0196 361 ALA F CA 5828 C C . ALA C 383 ? 0.8922 0.9517 0.7635 0.0726 -0.1919 -0.0068 361 ALA F C 5829 O O . ALA C 383 ? 0.8709 0.9081 0.7381 0.0386 -0.1948 0.0051 361 ALA F O 5830 C CB . ALA C 383 ? 0.9309 0.9721 0.7996 0.1486 -0.2176 -0.0150 361 ALA F CB 5831 N N . SER C 384 ? 0.8294 0.9572 0.7138 0.0751 -0.1786 -0.0099 362 SER F N 5832 C CA . SER C 384 ? 0.7937 0.9670 0.6828 0.0354 -0.1694 0.0019 362 SER F CA 5833 C C . SER C 384 ? 0.8290 0.9834 0.7055 0.0240 -0.1591 -0.0097 362 SER F C 5834 O O . SER C 384 ? 0.8249 1.0253 0.7067 0.0379 -0.1514 -0.0190 362 SER F O 5835 C CB . SER C 384 ? 0.8333 1.1089 0.7429 0.0399 -0.1668 0.0119 362 SER F CB 5836 O OG . SER C 384 ? 0.9252 1.2361 0.8274 -0.0056 -0.1626 0.0262 362 SER F OG 5837 N N . ALA C 385 ? 0.7747 0.8638 0.6347 0.0005 -0.1595 -0.0096 363 ALA F N 5838 C CA . ALA C 385 ? 0.7639 0.8277 0.6120 -0.0108 -0.1524 -0.0183 363 ALA F CA 5839 C C . ALA C 385 ? 0.7922 0.8753 0.6326 -0.0466 -0.1494 -0.0093 363 ALA F C 5840 O O . ALA C 385 ? 0.7840 0.8368 0.6129 -0.0701 -0.1528 -0.0007 363 ALA F O 5841 C CB . ALA C 385 ? 0.7798 0.7694 0.6134 -0.0118 -0.1559 -0.0236 363 ALA F CB 5842 N N . GLU C 386 ? 0.7424 0.8736 0.5838 -0.0512 -0.1445 -0.0119 364 GLU F N 5843 C CA . GLU C 386 ? 0.7357 0.8812 0.5607 -0.0876 -0.1462 -0.0034 364 GLU F CA 5844 C C . GLU C 386 ? 0.7775 0.8867 0.5933 -0.0901 -0.1432 -0.0139 364 GLU F C 5845 O O . GLU C 386 ? 0.7722 0.9085 0.5952 -0.0759 -0.1371 -0.0245 364 GLU F O 5846 C CB . GLU C 386 ? 0.7541 0.9903 0.5844 -0.0973 -0.1455 0.0034 364 GLU F CB 5847 C CG . GLU C 386 ? 0.8960 1.1522 0.7056 -0.1382 -0.1545 0.0237 364 GLU F CG 5848 C CD . GLU C 386 ? 1.1552 1.4554 0.9785 -0.1329 -0.1567 0.0363 364 GLU F CD 5849 O OE1 . GLU C 386 ? 1.0830 1.4748 0.9169 -0.1354 -0.1562 0.0440 364 GLU F OE1 5850 O OE2 . GLU C 386 ? 1.0864 1.3358 0.9105 -0.1272 -0.1594 0.0390 364 GLU F OE2 5851 N N . PHE C 387 ? 0.7310 0.7799 0.5308 -0.1053 -0.1472 -0.0116 365 PHE F N 5852 C CA . PHE C 387 ? 0.7270 0.7421 0.5198 -0.1074 -0.1460 -0.0189 365 PHE F CA 5853 C C . PHE C 387 ? 0.7818 0.7592 0.5510 -0.1327 -0.1546 -0.0123 365 PHE F C 5854 O O . PHE C 387 ? 0.7863 0.7392 0.5409 -0.1429 -0.1605 -0.0052 365 PHE F O 5855 C CB . PHE C 387 ? 0.7463 0.7216 0.5470 -0.0833 -0.1418 -0.0281 365 PHE F CB 5856 C CG . PHE C 387 ? 0.7646 0.6993 0.5631 -0.0811 -0.1448 -0.0250 365 PHE F CG 5857 C CD1 . PHE C 387 ? 0.8031 0.7435 0.6084 -0.0726 -0.1466 -0.0220 365 PHE F CD1 5858 C CD2 . PHE C 387 ? 0.7929 0.6892 0.5832 -0.0865 -0.1461 -0.0254 365 PHE F CD2 5859 C CE1 . PHE C 387 ? 0.8150 0.7227 0.6165 -0.0748 -0.1494 -0.0198 365 PHE F CE1 5860 C CE2 . PHE C 387 ? 0.8287 0.7000 0.6173 -0.0842 -0.1474 -0.0243 365 PHE F CE2 5861 C CZ . PHE C 387 ? 0.8038 0.6803 0.5969 -0.0807 -0.1489 -0.0218 365 PHE F CZ 5862 N N . ARG C 388 ? 0.7384 0.7073 0.5004 -0.1418 -0.1565 -0.0151 366 ARG F N 5863 C CA . ARG C 388 ? 0.7539 0.6810 0.4909 -0.1615 -0.1680 -0.0098 366 ARG F CA 5864 C C . ARG C 388 ? 0.7904 0.6754 0.5344 -0.1451 -0.1657 -0.0154 366 ARG F C 5865 O O . ARG C 388 ? 0.7700 0.6645 0.5294 -0.1343 -0.1579 -0.0214 366 ARG F O 5866 C CB . ARG C 388 ? 0.7751 0.7269 0.4958 -0.1897 -0.1762 -0.0055 366 ARG F CB 5867 C CG . ARG C 388 ? 0.9315 0.9323 0.6370 -0.2154 -0.1823 0.0040 366 ARG F CG 5868 C CD . ARG C 388 ? 1.0899 1.1324 0.7828 -0.2450 -0.1886 0.0067 366 ARG F CD 5869 N NE . ARG C 388 ? 1.1951 1.2928 0.9186 -0.2263 -0.1725 -0.0057 366 ARG F NE 5870 C CZ . ARG C 388 ? 1.3877 1.5101 1.1080 -0.2422 -0.1726 -0.0097 366 ARG F CZ 5871 N NH1 . ARG C 388 ? 1.2532 1.3505 0.9426 -0.2795 -0.1903 -0.0004 366 ARG F NH1 5872 N NH2 . ARG C 388 ? 1.2111 1.3781 0.9543 -0.2212 -0.1566 -0.0235 366 ARG F NH2 5873 N N . VAL C 389 ? 0.7582 0.5989 0.4876 -0.1431 -0.1726 -0.0133 367 VAL F N 5874 C CA . VAL C 389 ? 0.7502 0.5635 0.4868 -0.1269 -0.1712 -0.0169 367 VAL F CA 5875 C C . VAL C 389 ? 0.8201 0.6003 0.5344 -0.1365 -0.1855 -0.0130 367 VAL F C 5876 O O . VAL C 389 ? 0.8461 0.5944 0.5301 -0.1452 -0.1981 -0.0096 367 VAL F O 5877 C CB . VAL C 389 ? 0.7962 0.5954 0.5377 -0.1093 -0.1664 -0.0203 367 VAL F CB 5878 C CG1 . VAL C 389 ? 0.7922 0.5798 0.5415 -0.0940 -0.1650 -0.0229 367 VAL F CG1 5879 C CG2 . VAL C 389 ? 0.7721 0.5970 0.5315 -0.1027 -0.1569 -0.0224 367 VAL F CG2 5880 N N . GLN C 390 ? 0.7666 0.5485 0.4904 -0.1362 -0.1859 -0.0124 368 GLN F N 5881 C CA . GLN C 390 ? 0.7914 0.5409 0.4960 -0.1436 -0.2019 -0.0075 368 GLN F CA 5882 C C . GLN C 390 ? 0.8419 0.5729 0.5546 -0.1172 -0.2020 -0.0093 368 GLN F C 5883 O O . GLN C 390 ? 0.8129 0.5662 0.5490 -0.1089 -0.1932 -0.0088 368 GLN F O 5884 C CB . GLN C 390 ? 0.8035 0.5707 0.5109 -0.1652 -0.2048 -0.0035 368 GLN F CB 5885 C CG . GLN C 390 ? 1.0561 0.7860 0.7376 -0.1801 -0.2269 0.0042 368 GLN F CG 5886 C CD . GLN C 390 ? 1.3136 1.0640 0.9978 -0.2062 -0.2296 0.0086 368 GLN F CD 5887 O OE1 . GLN C 390 ? 1.2432 0.9993 0.9448 -0.2012 -0.2252 0.0106 368 GLN F OE1 5888 N NE2 . GLN C 390 ? 1.2423 1.0082 0.9066 -0.2382 -0.2375 0.0113 368 GLN F NE2 5889 N N . VAL C 391 ? 0.8326 0.5253 0.5222 -0.1040 -0.2122 -0.0115 369 VAL F N 5890 C CA . VAL C 391 ? 0.8437 0.5245 0.5379 -0.0736 -0.2135 -0.0152 369 VAL F CA 5891 C C . VAL C 391 ? 0.9374 0.5763 0.6063 -0.0752 -0.2359 -0.0098 369 VAL F C 5892 O O . VAL C 391 ? 0.9787 0.5678 0.6057 -0.0873 -0.2541 -0.0083 369 VAL F O 5893 C CB . VAL C 391 ? 0.9099 0.5755 0.5924 -0.0526 -0.2092 -0.0245 369 VAL F CB 5894 C CG1 . VAL C 391 ? 0.9163 0.5910 0.6104 -0.0176 -0.2066 -0.0305 369 VAL F CG1 5895 C CG2 . VAL C 391 ? 0.8699 0.5697 0.5708 -0.0602 -0.1923 -0.0269 369 VAL F CG2 5896 N N . CYS C 392 ? 0.8835 0.5413 0.5736 -0.0690 -0.2370 -0.0044 370 CYS F N 5897 C CA . CYS C 392 ? 0.9200 0.5447 0.5926 -0.0726 -0.2593 0.0035 370 CYS F CA 5898 C C . CYS C 392 ? 0.9832 0.5939 0.6344 -0.1163 -0.2713 0.0111 370 CYS F C 5899 O O . CYS C 392 ? 0.9342 0.5880 0.6085 -0.1377 -0.2579 0.0138 370 CYS F O 5900 C CB . CYS C 392 ? 0.9868 0.5543 0.6260 -0.0418 -0.2786 -0.0016 370 CYS F CB 5901 S SG . CYS C 392 ? 1.0414 0.6337 0.7076 0.0053 -0.2790 -0.0021 370 CYS F SG 5902 N N . SER C 393 ? 1.0051 0.5572 0.6074 -0.1311 -0.2965 0.0140 371 SER F N 5903 C CA . SER C 393 ? 1.0198 0.5656 0.5956 -0.1785 -0.3109 0.0226 371 SER F CA 5904 C C . SER C 393 ? 1.0935 0.6296 0.6358 -0.2017 -0.3138 0.0218 371 SER F C 5905 O O . SER C 393 ? 1.1056 0.6430 0.6198 -0.2443 -0.3278 0.0300 371 SER F O 5906 C CB . SER C 393 ? 1.1225 0.6122 0.6618 -0.1915 -0.3443 0.0326 371 SER F CB 5907 O OG . SER C 393 ? 1.2040 0.7187 0.7779 -0.1827 -0.3412 0.0377 371 SER F OG 5908 N N . THR C 394 ? 1.0510 0.5848 0.5959 -0.1776 -0.3006 0.0133 372 THR F N 5909 C CA . THR C 394 ? 1.0681 0.5958 0.5823 -0.1989 -0.3025 0.0147 372 THR F CA 5910 C C . THR C 394 ? 1.0576 0.6549 0.6172 -0.1931 -0.2724 0.0093 372 THR F C 5911 O O . THR C 394 ? 1.0137 0.6342 0.6128 -0.1614 -0.2529 0.0011 372 THR F O 5912 C CB . THR C 394 ? 1.2416 0.6900 0.7026 -0.1830 -0.3199 0.0115 372 THR F CB 5913 O OG1 . THR C 394 ? 1.2978 0.6786 0.7237 -0.1730 -0.3470 0.0134 372 THR F OG1 5914 C CG2 . THR C 394 ? 1.2653 0.6899 0.6728 -0.2202 -0.3330 0.0194 372 THR F CG2 5915 N N . GLN C 395 ? 1.0108 0.6429 0.5616 -0.2246 -0.2710 0.0149 373 GLN F N 5916 C CA . GLN C 395 ? 0.9586 0.6546 0.5472 -0.2190 -0.2470 0.0110 373 GLN F CA 5917 C C . GLN C 395 ? 1.0296 0.7122 0.5980 -0.2192 -0.2463 0.0123 373 GLN F C 5918 O O . GLN C 395 ? 1.0773 0.7182 0.5927 -0.2436 -0.2663 0.0206 373 GLN F O 5919 C CB . GLN C 395 ? 0.9540 0.7140 0.5532 -0.2480 -0.2433 0.0153 373 GLN F CB 5920 C CG . GLN C 395 ? 1.1250 0.9162 0.7593 -0.2403 -0.2320 0.0098 373 GLN F CG 5921 C CD . GLN C 395 ? 1.3680 1.2193 1.0042 -0.2697 -0.2304 0.0118 373 GLN F CD 5922 O OE1 . GLN C 395 ? 1.3374 1.1844 0.9548 -0.2977 -0.2445 0.0171 373 GLN F OE1 5923 N NE2 . GLN C 395 ? 1.2381 1.1501 0.8967 -0.2630 -0.2139 0.0072 373 GLN F NE2 5924 N N . VAL C 396 ? 0.9502 0.6645 0.5557 -0.1958 -0.2255 0.0056 374 VAL F N 5925 C CA . VAL C 396 ? 0.9566 0.6664 0.5507 -0.1961 -0.2220 0.0072 374 VAL F CA 5926 C C . VAL C 396 ? 0.9630 0.7422 0.5963 -0.1944 -0.2051 0.0078 374 VAL F C 5927 O O . VAL C 396 ? 0.9174 0.7268 0.5908 -0.1737 -0.1911 0.0002 374 VAL F O 5928 C CB . VAL C 396 ? 1.0229 0.6845 0.6104 -0.1678 -0.2193 -0.0019 374 VAL F CB 5929 C CG1 . VAL C 396 ? 0.9748 0.6646 0.6114 -0.1365 -0.2014 -0.0119 374 VAL F CG1 5930 C CG2 . VAL C 396 ? 1.0404 0.6872 0.6039 -0.1762 -0.2190 0.0011 374 VAL F CG2 5931 N N . HIS C 397 ? 0.9363 0.7387 0.5530 -0.2169 -0.2087 0.0178 375 HIS F N 5932 C CA . HIS C 397 ? 0.9001 0.7702 0.5511 -0.2127 -0.1958 0.0197 375 HIS F CA 5933 C C . HIS C 397 ? 0.9347 0.7953 0.6039 -0.1918 -0.1859 0.0158 375 HIS F C 5934 O O . HIS C 397 ? 0.9554 0.7739 0.5964 -0.1990 -0.1913 0.0188 375 HIS F O 5935 C CB . HIS C 397 ? 0.9275 0.8419 0.5551 -0.2482 -0.2051 0.0352 375 HIS F CB 5936 C CG . HIS C 397 ? 0.9361 0.9323 0.6020 -0.2386 -0.1929 0.0369 375 HIS F CG 5937 N ND1 . HIS C 397 ? 0.9344 0.9911 0.6298 -0.2278 -0.1846 0.0302 375 HIS F ND1 5938 C CD2 . HIS C 397 ? 0.9496 0.9733 0.6265 -0.2358 -0.1889 0.0439 375 HIS F CD2 5939 C CE1 . HIS C 397 ? 0.9072 1.0253 0.6302 -0.2138 -0.1762 0.0320 375 HIS F CE1 5940 N NE2 . HIS C 397 ? 0.9183 1.0202 0.6329 -0.2191 -0.1792 0.0416 375 HIS F NE2 5941 N N . CYS C 398 ? 0.8572 0.7526 0.5678 -0.1677 -0.1731 0.0089 376 CYS F N 5942 C CA . CYS C 398 ? 0.8424 0.7333 0.5709 -0.1513 -0.1663 0.0061 376 CYS F CA 5943 C C . CYS C 398 ? 0.8744 0.8202 0.6242 -0.1484 -0.1633 0.0121 376 CYS F C 5944 O O . CYS C 398 ? 0.8544 0.8422 0.6237 -0.1369 -0.1593 0.0087 376 CYS F O 5945 C CB . CYS C 398 ? 0.8310 0.7031 0.5798 -0.1268 -0.1593 -0.0056 376 CYS F CB 5946 S SG . CYS C 398 ? 0.8988 0.7188 0.6290 -0.1228 -0.1622 -0.0120 376 CYS F SG 5947 N N . ALA C 399 ? 0.8376 0.7837 0.5821 -0.1573 -0.1655 0.0207 377 ALA F N 5948 C CA . ALA C 399 ? 0.8249 0.8224 0.5899 -0.1532 -0.1650 0.0289 377 ALA F CA 5949 C C . ALA C 399 ? 0.8635 0.8395 0.6462 -0.1342 -0.1631 0.0238 377 ALA F C 5950 O O . ALA C 399 ? 0.8663 0.8033 0.6351 -0.1442 -0.1642 0.0242 377 ALA F O 5951 C CB . ALA C 399 ? 0.8529 0.8683 0.5938 -0.1855 -0.1722 0.0469 377 ALA F CB 5952 N N . ALA C 400 ? 0.8077 0.8053 0.6154 -0.1075 -0.1617 0.0179 378 ALA F N 5953 C CA . ALA C 400 ? 0.8048 0.7754 0.6214 -0.0926 -0.1650 0.0140 378 ALA F CA 5954 C C . ALA C 400 ? 0.8541 0.8569 0.6886 -0.0734 -0.1709 0.0186 378 ALA F C 5955 O O . ALA C 400 ? 0.8494 0.8904 0.6963 -0.0517 -0.1692 0.0145 378 ALA F O 5956 C CB . ALA C 400 ? 0.8143 0.7491 0.6293 -0.0775 -0.1626 0.0005 378 ALA F CB 5957 N N . GLU C 401 ? 0.8141 0.8016 0.6486 -0.0801 -0.1788 0.0263 379 GLU F N 5958 C CA . GLU C 401 ? 0.8219 0.8282 0.6706 -0.0609 -0.1891 0.0320 379 GLU F CA 5959 C C . GLU C 401 ? 0.8813 0.8298 0.7202 -0.0500 -0.1988 0.0238 379 GLU F C 5960 O O . GLU C 401 ? 0.8787 0.7957 0.7069 -0.0722 -0.2042 0.0281 379 GLU F O 5961 C CB . GLU C 401 ? 0.8392 0.8710 0.6904 -0.0846 -0.1945 0.0508 379 GLU F CB 5962 C CG . GLU C 401 ? 0.9928 1.0563 0.8627 -0.0621 -0.2065 0.0594 379 GLU F CG 5963 C CD . GLU C 401 ? 1.2700 1.3493 1.1412 -0.0885 -0.2148 0.0800 379 GLU F CD 5964 O OE1 . GLU C 401 ? 1.2092 1.3537 1.0969 -0.0838 -0.2177 0.0943 379 GLU F OE1 5965 O OE2 . GLU C 401 ? 1.2022 1.2348 1.0578 -0.1148 -0.2185 0.0824 379 GLU F OE2 5966 N N . CYS C 402 ? 0.8490 0.7824 0.6854 -0.0197 -0.2015 0.0118 380 CYS F N 5967 C CA . CYS C 402 ? 0.8715 0.7435 0.6868 -0.0127 -0.2140 0.0052 380 CYS F CA 5968 C C . CYS C 402 ? 0.9471 0.8028 0.7583 0.0101 -0.2340 0.0088 380 CYS F C 5969 O O . CYS C 402 ? 0.9502 0.8434 0.7768 0.0411 -0.2350 0.0081 380 CYS F O 5970 C CB . CYS C 402 ? 0.8834 0.7330 0.6857 0.0012 -0.2077 -0.0089 380 CYS F CB 5971 S SG . CYS C 402 ? 0.8951 0.7640 0.7030 -0.0217 -0.1878 -0.0120 380 CYS F SG 5972 N N . HIS C 403 ? 0.9212 0.7243 0.7101 -0.0060 -0.2516 0.0132 381 HIS F N 5973 C CA . HIS C 403 ? 0.9607 0.7328 0.7374 0.0094 -0.2769 0.0190 381 HIS F CA 5974 C C . HIS C 403 ? 1.0664 0.7643 0.8017 0.0294 -0.2963 0.0090 381 HIS F C 5975 O O . HIS C 403 ? 1.0606 0.7286 0.7740 0.0151 -0.2912 0.0019 381 HIS F O 5976 C CB . HIS C 403 ? 0.9640 0.7286 0.7387 -0.0293 -0.2880 0.0341 381 HIS F CB 5977 C CG . HIS C 403 ? 0.9614 0.7870 0.7656 -0.0498 -0.2718 0.0447 381 HIS F CG 5978 N ND1 . HIS C 403 ? 0.9519 0.7837 0.7543 -0.0867 -0.2574 0.0456 381 HIS F ND1 5979 C CD2 . HIS C 403 ? 0.9711 0.8527 0.8016 -0.0375 -0.2688 0.0546 381 HIS F CD2 5980 C CE1 . HIS C 403 ? 0.9214 0.7994 0.7418 -0.0982 -0.2480 0.0561 381 HIS F CE1 5981 N NE2 . HIS C 403 ? 0.9340 0.8475 0.7725 -0.0729 -0.2544 0.0636 381 HIS F NE2 5982 N N . PRO C 404 ? 1.0802 0.7448 0.7996 0.0631 -0.3200 0.0088 382 PRO F N 5983 C CA . PRO C 404 ? 1.1499 0.7284 0.8161 0.0818 -0.3417 -0.0012 382 PRO F CA 5984 C C . PRO C 404 ? 1.2324 0.7396 0.8513 0.0374 -0.3647 0.0070 382 PRO F C 5985 O O . PRO C 404 ? 1.2123 0.7277 0.8379 0.0034 -0.3740 0.0210 382 PRO F O 5986 C CB . PRO C 404 ? 1.2290 0.7930 0.8908 0.1335 -0.3626 -0.0033 382 PRO F CB 5987 C CG . PRO C 404 ? 1.2310 0.8949 0.9528 0.1448 -0.3452 0.0044 382 PRO F CG 5988 C CD . PRO C 404 ? 1.1091 0.8098 0.8533 0.0880 -0.3300 0.0178 382 PRO F CD 5989 N N . PRO C 405 ? 1.2379 0.6781 0.8051 0.0327 -0.3749 -0.0002 383 PRO F N 5990 C CA . PRO C 405 ? 1.2722 0.6537 0.7892 -0.0160 -0.3992 0.0102 383 PRO F CA 5991 C C . PRO C 405 ? 1.4174 0.7116 0.8792 -0.0107 -0.4436 0.0169 383 PRO F C 5992 O O . PRO C 405 ? 1.4545 0.7254 0.9139 0.0402 -0.4555 0.0105 383 PRO F O 5993 C CB . PRO C 405 ? 1.3045 0.6596 0.7884 -0.0266 -0.3909 0.0026 383 PRO F CB 5994 C CG . PRO C 405 ? 1.3671 0.7276 0.8622 0.0267 -0.3753 -0.0141 383 PRO F CG 5995 C CD . PRO C 405 ? 1.2839 0.7009 0.8313 0.0664 -0.3661 -0.0168 383 PRO F CD 5996 N N . LYS C 406 ? 1.4133 0.6619 0.8286 -0.0635 -0.4697 0.0299 384 LYS F N 5997 C CA . LYS C 406 ? 1.5099 0.6658 0.8616 -0.0716 -0.5182 0.0395 384 LYS F CA 5998 C C . LYS C 406 ? 1.6750 0.7205 0.9486 -0.0410 -0.5470 0.0305 384 LYS F C 5999 O O . LYS C 406 ? 1.7572 0.7234 0.9868 -0.0175 -0.5852 0.0327 384 LYS F O 6000 C CB . LYS C 406 ? 1.5463 0.6944 0.8678 -0.1454 -0.5383 0.0571 384 LYS F CB 6001 C CG . LYS C 406 ? 1.7204 0.8608 1.0007 -0.1920 -0.5356 0.0590 384 LYS F CG 6002 C CD . LYS C 406 ? 1.8827 0.9949 1.1092 -0.2620 -0.5695 0.0770 384 LYS F CD 6003 C CE . LYS C 406 ? 2.0204 1.1390 1.2058 -0.3097 -0.5677 0.0814 384 LYS F CE 6004 N NZ . LYS C 406 ? 2.1704 1.2780 1.3036 -0.3833 -0.6004 0.0998 384 LYS F NZ 6005 N N . ASP C 407 ? 1.6391 0.6743 0.8910 -0.0413 -0.5306 0.0208 385 ASP F N 6006 C CA . ASP C 407 ? 1.7470 0.6727 0.9160 -0.0178 -0.5552 0.0116 385 ASP F CA 6007 C C . ASP C 407 ? 1.7994 0.7400 0.9947 0.0537 -0.5303 -0.0112 385 ASP F C 6008 O O . ASP C 407 ? 1.6990 0.7369 0.9649 0.0638 -0.4873 -0.0188 385 ASP F O 6009 C CB . ASP C 407 ? 1.7915 0.6850 0.9020 -0.0754 -0.5603 0.0194 385 ASP F CB 6010 C CG . ASP C 407 ? 1.9447 0.8222 1.0151 -0.1490 -0.5897 0.0417 385 ASP F CG 6011 O OD1 . ASP C 407 ? 1.8663 0.8350 0.9819 -0.1928 -0.5651 0.0497 385 ASP F OD1 6012 O OD2 . ASP C 407 ? 2.1276 0.9012 1.1181 -0.1627 -0.6387 0.0507 385 ASP F OD2 6013 N N . HIS C 408 ? 1.8730 0.7139 1.0057 0.1029 -0.5596 -0.0227 386 HIS F N 6014 C CA . HIS C 408 ? 1.8933 0.7382 1.0369 0.1758 -0.5411 -0.0474 386 HIS F CA 6015 C C . HIS C 408 ? 1.9933 0.7768 1.0743 0.1699 -0.5362 -0.0584 386 HIS F C 6016 O O . HIS C 408 ? 1.9657 0.7876 1.0732 0.2126 -0.5064 -0.0781 386 HIS F O 6017 C CB . HIS C 408 ? 2.0059 0.7786 1.1148 0.2409 -0.5750 -0.0566 386 HIS F CB 6018 C CG . HIS C 408 ? 1.9828 0.8626 1.1831 0.2874 -0.5557 -0.0593 386 HIS F CG 6019 N ND1 . HIS C 408 ? 1.9806 0.9306 1.2279 0.3531 -0.5253 -0.0808 386 HIS F ND1 6020 C CD2 . HIS C 408 ? 1.9627 0.8925 1.2101 0.2722 -0.5639 -0.0416 386 HIS F CD2 6021 C CE1 . HIS C 408 ? 1.9169 0.9603 1.2377 0.3747 -0.5166 -0.0739 386 HIS F CE1 6022 N NE2 . HIS C 408 ? 1.9090 0.9405 1.2322 0.3278 -0.5390 -0.0502 386 HIS F NE2 6023 N N . ILE C 409 ? 2.0222 0.7129 1.0166 0.1134 -0.5667 -0.0444 387 ILE F N 6024 C CA . ILE C 409 ? 2.0785 0.7010 0.9999 0.0948 -0.5681 -0.0490 387 ILE F CA 6025 C C . ILE C 409 ? 2.0633 0.7392 0.9951 0.0144 -0.5551 -0.0283 387 ILE F C 6026 O O . ILE C 409 ? 2.0551 0.7297 0.9724 -0.0399 -0.5769 -0.0074 387 ILE F O 6027 C CB . ILE C 409 ? 2.2924 0.7394 1.0794 0.1055 -0.6222 -0.0515 387 ILE F CB 6028 C CG1 . ILE C 409 ? 2.3779 0.7711 1.1537 0.1949 -0.6385 -0.0736 387 ILE F CG1 6029 C CG2 . ILE C 409 ? 2.3704 0.7380 1.0699 0.0794 -0.6260 -0.0537 387 ILE F CG2 6030 C CD1 . ILE C 409 ? 2.4399 0.8914 1.2661 0.2735 -0.5982 -0.1047 387 ILE F CD1 6031 N N . VAL C 410 ? 1.9704 0.6986 0.9283 0.0083 -0.5198 -0.0344 388 VAL F N 6032 C CA . VAL C 410 ? 1.9026 0.6929 0.8769 -0.0572 -0.5030 -0.0171 388 VAL F CA 6033 C C . VAL C 410 ? 2.0510 0.7498 0.9227 -0.0953 -0.5231 -0.0095 388 VAL F C 6034 O O . VAL C 410 ? 2.1312 0.7422 0.9421 -0.0601 -0.5318 -0.0248 388 VAL F O 6035 C CB . VAL C 410 ? 1.8154 0.7422 0.9010 -0.0428 -0.4505 -0.0248 388 VAL F CB 6036 C CG1 . VAL C 410 ? 1.8180 0.7426 0.9057 -0.0037 -0.4265 -0.0444 388 VAL F CG1 6037 C CG2 . VAL C 410 ? 1.7326 0.7395 0.8520 -0.1030 -0.4352 -0.0064 388 VAL F CG2 6038 N N . ASN C 411 ? 2.0017 0.7231 0.8505 -0.1677 -0.5313 0.0144 389 ASN F N 6039 C CA . ASN C 411 ? 2.0852 0.7340 0.8355 -0.2179 -0.5522 0.0285 389 ASN F CA 6040 C C . ASN C 411 ? 2.0733 0.7975 0.8622 -0.2323 -0.5144 0.0297 389 ASN F C 6041 O O . ASN C 411 ? 2.1246 0.8034 0.8379 -0.2786 -0.5285 0.0444 389 ASN F O 6042 C CB . ASN C 411 ? 2.1429 0.7687 0.8301 -0.2933 -0.5905 0.0569 389 ASN F CB 6043 C CG . ASN C 411 ? 2.3260 1.0940 1.0998 -0.3317 -0.5668 0.0706 389 ASN F CG 6044 O OD1 . ASN C 411 ? 2.2068 1.0494 0.9989 -0.3704 -0.5478 0.0828 389 ASN F OD1 6045 N ND2 . ASN C 411 ? 2.1815 0.9898 1.0084 -0.3201 -0.5678 0.0686 389 ASN F ND2 6046 N N . TYR C 412 ? 1.9216 0.7563 0.8219 -0.1954 -0.4695 0.0159 390 TYR F N 6047 C CA . TYR C 412 ? 1.8509 0.7614 0.7975 -0.2040 -0.4339 0.0160 390 TYR F CA 6048 C C . TYR C 412 ? 1.8580 0.8086 0.8730 -0.1412 -0.3992 -0.0098 390 TYR F C 6049 O O . TYR C 412 ? 1.8081 0.7998 0.8849 -0.1009 -0.3889 -0.0220 390 TYR F O 6050 C CB . TYR C 412 ? 1.7653 0.7943 0.7773 -0.2471 -0.4166 0.0342 390 TYR F CB 6051 C CG . TYR C 412 ? 1.7151 0.8157 0.8025 -0.2337 -0.4080 0.0317 390 TYR F CG 6052 C CD1 . TYR C 412 ? 1.7693 0.8558 0.8266 -0.2683 -0.4362 0.0457 390 TYR F CD1 6053 C CD2 . TYR C 412 ? 1.6295 0.8132 0.8133 -0.1931 -0.3727 0.0170 390 TYR F CD2 6054 C CE1 . TYR C 412 ? 1.7154 0.8661 0.8386 -0.2597 -0.4278 0.0437 390 TYR F CE1 6055 C CE2 . TYR C 412 ? 1.5807 0.8245 0.8259 -0.1849 -0.3654 0.0160 390 TYR F CE2 6056 C CZ . TYR C 412 ? 1.7042 0.9316 0.9204 -0.2174 -0.3919 0.0289 390 TYR F CZ 6057 O OH . TYR C 412 ? 1.6603 0.9446 0.9335 -0.2124 -0.3844 0.0281 390 TYR F OH 6058 N N . PRO C 413 ? 1.8309 0.7733 0.8324 -0.1367 -0.3822 -0.0168 391 PRO F N 6059 C CA . PRO C 413 ? 1.7871 0.7729 0.8479 -0.0831 -0.3509 -0.0410 391 PRO F CA 6060 C C . PRO C 413 ? 1.7135 0.8304 0.8834 -0.0834 -0.3155 -0.0395 391 PRO F C 6061 O O . PRO C 413 ? 1.6540 0.8266 0.8502 -0.1247 -0.3112 -0.0208 391 PRO F O 6062 C CB . PRO C 413 ? 1.8772 0.7975 0.8712 -0.0875 -0.3502 -0.0470 391 PRO F CB 6063 C CG . PRO C 413 ? 1.9736 0.8551 0.8997 -0.1546 -0.3713 -0.0198 391 PRO F CG 6064 C CD . PRO C 413 ? 1.8914 0.8020 0.8299 -0.1873 -0.3891 -0.0001 391 PRO F CD 6065 N N . ALA C 414 ? 1.6321 0.7977 0.8603 -0.0365 -0.2921 -0.0596 392 ALA F N 6066 C CA . ALA C 414 ? 1.5225 0.7992 0.8437 -0.0334 -0.2619 -0.0602 392 ALA F CA 6067 C C . ALA C 414 ? 1.5587 0.8678 0.9061 -0.0031 -0.2381 -0.0791 392 ALA F C 6068 O O . ALA C 414 ? 1.6236 0.8752 0.9236 0.0248 -0.2426 -0.0954 392 ALA F O 6069 C CB . ALA C 414 ? 1.4869 0.8096 0.8607 -0.0161 -0.2620 -0.0602 392 ALA F CB 6070 N N . SER C 415 ? 1.4317 0.8307 0.8494 -0.0094 -0.2142 -0.0773 393 SER F N 6071 C CA . SER C 415 ? 1.4456 0.8912 0.8933 0.0090 -0.1921 -0.0921 393 SER F CA 6072 C C . SER C 415 ? 1.5987 1.0703 1.0684 0.0585 -0.1869 -0.1116 393 SER F C 6073 O O . SER C 415 ? 1.5901 1.0873 1.0904 0.0713 -0.1920 -0.1081 393 SER F O 6074 C CB . SER C 415 ? 1.4075 0.9330 0.9159 -0.0161 -0.1750 -0.0816 393 SER F CB 6075 O OG . SER C 415 ? 1.5174 1.0304 1.0096 -0.0563 -0.1786 -0.0642 393 SER F OG # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 MET 1 0 ? ? ? A . n A 1 2 SER 2 1 ? ? ? A . n A 1 3 LEU 3 2 ? ? ? A . n A 1 4 ALA 4 3 ? ? ? A . n A 1 5 ILE 5 4 ? ? ? A . n A 1 6 PRO 6 5 ? ? ? A . n A 1 7 VAL 7 6 ? ? ? A . n A 1 8 MET 8 7 7 MET MET A . n A 1 9 CYS 9 8 8 CYS CYS A . n A 1 10 LEU 10 9 9 LEU LEU A . n A 1 11 LEU 11 10 10 LEU LEU A . n A 1 12 ALA 12 11 11 ALA ALA A . n A 1 13 ASN 13 12 12 ASN ASN A . n A 1 14 THR 14 13 13 THR THR A . n A 1 15 THR 15 14 14 THR THR A . n A 1 16 PHE 16 15 15 PHE PHE A . n A 1 17 PRO 17 16 16 PRO PRO A . n A 1 18 CYS 18 17 17 CYS CYS A . n A 1 19 SER 19 18 18 SER SER A . n A 1 20 GLN 20 19 19 GLN GLN A . n A 1 21 PRO 21 20 20 PRO PRO A . n A 1 22 PRO 22 21 21 PRO PRO A . n A 1 23 CYS 23 22 22 CYS CYS A . n A 1 24 THR 24 23 23 THR THR A . n A 1 25 PRO 25 24 24 PRO PRO A . n A 1 26 CYS 26 25 25 CYS CYS A . n A 1 27 CYS 27 26 26 CYS CYS A . n A 1 28 TYR 28 27 27 TYR TYR A . n A 1 29 GLU 29 28 28 GLU GLU A . n A 1 30 LYS 30 29 29 LYS LYS A . n A 1 31 GLU 31 30 30 GLU GLU A . n A 1 32 PRO 32 31 31 PRO PRO A . n A 1 33 GLU 33 32 32 GLU GLU A . n A 1 34 GLU 34 33 33 GLU GLU A . n A 1 35 THR 35 34 34 THR THR A . n A 1 36 LEU 36 35 35 LEU LEU A . n A 1 37 ARG 37 36 36 ARG ARG A . n A 1 38 MET 38 37 37 MET MET A . n A 1 39 LEU 39 38 38 LEU LEU A . n A 1 40 GLU 40 39 39 GLU GLU A . n A 1 41 ASP 41 40 40 ASP ASP A . n A 1 42 ASN 42 41 41 ASN ASN A . n A 1 43 VAL 43 42 42 VAL VAL A . n A 1 44 MET 44 43 43 MET MET A . n A 1 45 ARG 45 44 44 ARG ARG A . n A 1 46 PRO 46 45 45 PRO PRO A . n A 1 47 GLY 47 46 46 GLY GLY A . n A 1 48 TYR 48 47 47 TYR TYR A . n A 1 49 TYR 49 48 48 TYR TYR A . n A 1 50 GLN 50 49 49 GLN GLN A . n A 1 51 LEU 51 50 50 LEU LEU A . n A 1 52 LEU 52 51 51 LEU LEU A . n A 1 53 GLN 53 52 52 GLN GLN A . n A 1 54 ALA 54 53 53 ALA ALA A . n A 1 55 SER 55 54 54 SER SER A . n A 1 56 LEU 56 55 55 LEU LEU A . n A 1 57 THR 57 56 56 THR THR A . n A 1 58 CYS 58 57 57 CYS CYS A . n A 1 59 SER 59 58 58 SER SER A . n A 1 60 PRO 60 59 ? ? ? A . n A 1 61 HIS 61 60 ? ? ? A . n A 1 62 ARG 62 61 ? ? ? A . n A 1 63 GLN 63 62 ? ? ? A . n A 1 64 ARG 64 63 ? ? ? A . n A 1 65 ARG 65 64 ? ? ? A . n B 2 1 SER 1 1 ? ? ? B . n B 2 2 THR 2 2 ? ? ? B . n B 2 3 LYS 3 3 ? ? ? B . n B 2 4 ASP 4 4 ? ? ? B . n B 2 5 ASN 5 5 5 ASN ASN B . n B 2 6 PHE 6 6 6 PHE PHE B . n B 2 7 ASN 7 7 7 ASN ASN B . n B 2 8 VAL 8 8 8 VAL VAL B . n B 2 9 TYR 9 9 9 TYR TYR B . n B 2 10 LYS 10 10 10 LYS LYS B . n B 2 11 ALA 11 11 11 ALA ALA B . n B 2 12 THR 12 12 12 THR THR B . n B 2 13 ARG 13 13 13 ARG ARG B . n B 2 14 PRO 14 14 14 PRO PRO B . n B 2 15 TYR 15 15 15 TYR TYR B . n B 2 16 LEU 16 16 16 LEU LEU B . n B 2 17 ALA 17 17 17 ALA ALA B . n B 2 18 HIS 18 18 18 HIS HIS B . n B 2 19 CYS 19 19 19 CYS CYS B . n B 2 20 PRO 20 20 20 PRO PRO B . n B 2 21 ASP 21 21 21 ASP ASP B . n B 2 22 CYS 22 22 22 CYS CYS B . n B 2 23 GLY 23 23 23 GLY GLY B . n B 2 24 GLU 24 24 24 GLU GLU B . n B 2 25 GLY 25 25 25 GLY GLY B . n B 2 26 HIS 26 26 26 HIS HIS B . n B 2 27 SER 27 27 27 SER SER B . n B 2 28 CYS 28 28 28 CYS CYS B . n B 2 29 HIS 29 29 29 HIS HIS B . n B 2 30 SER 30 30 30 SER SER B . n B 2 31 PRO 31 31 31 PRO PRO B . n B 2 32 VAL 32 32 32 VAL VAL B . n B 2 33 ALA 33 33 33 ALA ALA B . n B 2 34 LEU 34 34 34 LEU LEU B . n B 2 35 GLU 35 35 35 GLU GLU B . n B 2 36 ARG 36 36 36 ARG ARG B . n B 2 37 ILE 37 37 37 ILE ILE B . n B 2 38 ARG 38 38 38 ARG ARG B . n B 2 39 ASN 39 39 39 ASN ASN B . n B 2 40 GLU 40 40 40 GLU GLU B . n B 2 41 ALA 41 41 41 ALA ALA B . n B 2 42 THR 42 42 42 THR THR B . n B 2 43 ASP 43 43 43 ASP ASP B . n B 2 44 GLY 44 44 44 GLY GLY B . n B 2 45 THR 45 45 45 THR THR B . n B 2 46 LEU 46 46 46 LEU LEU B . n B 2 47 LYS 47 47 47 LYS LYS B . n B 2 48 ILE 48 48 48 ILE ILE B . n B 2 49 GLN 49 49 49 GLN GLN B . n B 2 50 VAL 50 50 50 VAL VAL B . n B 2 51 SER 51 51 51 SER SER B . n B 2 52 LEU 52 52 52 LEU LEU B . n B 2 53 GLN 53 53 53 GLN GLN B . n B 2 54 ILE 54 54 54 ILE ILE B . n B 2 55 GLY 55 55 55 GLY GLY B . n B 2 56 ILE 56 56 56 ILE ILE B . n B 2 57 LYS 57 57 57 LYS LYS B . n B 2 58 THR 58 58 58 THR THR B . n B 2 59 ASP 59 59 59 ASP ASP B . n B 2 60 ASP 60 60 60 ASP ASP B . n B 2 61 SER 61 61 61 SER SER B . n B 2 62 HIS 62 62 62 HIS HIS B . n B 2 63 ASP 63 63 63 ASP ASP B . n B 2 64 TRP 64 64 64 TRP TRP B . n B 2 65 THR 65 65 65 THR THR B . n B 2 66 LYS 66 66 66 LYS LYS B . n B 2 67 LEU 67 67 67 LEU LEU B . n B 2 68 ARG 68 68 68 ARG ARG B . n B 2 69 TYR 69 69 69 TYR TYR B . n B 2 70 MET 70 70 70 MET MET B . n B 2 71 ASP 71 71 71 ASP ASP B . n B 2 72 ASN 72 72 72 ASN ASN B . n B 2 73 HIS 73 73 73 HIS HIS B . n B 2 74 MET 74 74 74 MET MET B . n B 2 75 PRO 75 75 75 PRO PRO B . n B 2 76 ALA 76 76 76 ALA ALA B . n B 2 77 ASP 77 77 77 ASP ASP B . n B 2 78 ALA 78 78 78 ALA ALA B . n B 2 79 GLU 79 79 79 GLU GLU B . n B 2 80 ARG 80 80 80 ARG ARG B . n B 2 81 ALA 81 81 81 ALA ALA B . n B 2 82 GLY 82 82 82 GLY GLY B . n B 2 83 LEU 83 83 83 LEU LEU B . n B 2 84 PHE 84 84 84 PHE PHE B . n B 2 85 VAL 85 85 85 VAL VAL B . n B 2 86 ARG 86 86 86 ARG ARG B . n B 2 87 THR 87 87 87 THR THR B . n B 2 88 SER 88 88 88 SER SER B . n B 2 89 ALA 89 89 89 ALA ALA B . n B 2 90 PRO 90 90 90 PRO PRO B . n B 2 91 CYS 91 91 91 CYS CYS B . n B 2 92 THR 92 92 92 THR THR B . n B 2 93 ILE 93 93 93 ILE ILE B . n B 2 94 THR 94 94 94 THR THR B . n B 2 95 GLY 95 95 95 GLY GLY B . n B 2 96 THR 96 96 96 THR THR B . n B 2 97 MET 97 97 97 MET MET B . n B 2 98 GLY 98 98 98 GLY GLY B . n B 2 99 HIS 99 99 99 HIS HIS B . n B 2 100 PHE 100 100 100 PHE PHE B . n B 2 101 ILE 101 101 101 ILE ILE B . n B 2 102 LEU 102 102 102 LEU LEU B . n B 2 103 ALA 103 103 103 ALA ALA B . n B 2 104 ARG 104 104 104 ARG ARG B . n B 2 105 CYS 105 105 105 CYS CYS B . n B 2 106 PRO 106 106 106 PRO PRO B . n B 2 107 LYS 107 107 107 LYS LYS B . n B 2 108 GLY 108 108 108 GLY GLY B . n B 2 109 GLU 109 109 109 GLU GLU B . n B 2 110 THR 110 110 110 THR THR B . n B 2 111 LEU 111 111 111 LEU LEU B . n B 2 112 THR 112 112 112 THR THR B . n B 2 113 VAL 113 113 113 VAL VAL B . n B 2 114 GLY 114 114 114 GLY GLY B . n B 2 115 PHE 115 115 115 PHE PHE B . n B 2 116 THR 116 116 116 THR THR B . n B 2 117 ASP 117 117 117 ASP ASP B . n B 2 118 SER 118 118 118 SER SER B . n B 2 119 ARG 119 119 119 ARG ARG B . n B 2 120 LYS 120 120 120 LYS LYS B . n B 2 121 ILE 121 121 121 ILE ILE B . n B 2 122 SER 122 122 122 SER SER B . n B 2 123 HIS 123 123 123 HIS HIS B . n B 2 124 SER 124 124 124 SER SER B . n B 2 125 CYS 125 125 125 CYS CYS B . n B 2 126 THR 126 126 126 THR THR B . n B 2 127 HIS 127 127 127 HIS HIS B . n B 2 128 PRO 128 128 128 PRO PRO B . n B 2 129 PHE 129 129 129 PHE PHE B . n B 2 130 HIS 130 130 130 HIS HIS B . n B 2 131 HIS 131 131 131 HIS HIS B . n B 2 132 ASP 132 132 132 ASP ASP B . n B 2 133 PRO 133 133 133 PRO PRO B . n B 2 134 PRO 134 134 134 PRO PRO B . n B 2 135 VAL 135 135 135 VAL VAL B . n B 2 136 ILE 136 136 136 ILE ILE B . n B 2 137 GLY 137 137 137 GLY GLY B . n B 2 138 ARG 138 138 138 ARG ARG B . n B 2 139 GLU 139 139 139 GLU GLU B . n B 2 140 LYS 140 140 140 LYS LYS B . n B 2 141 PHE 141 141 141 PHE PHE B . n B 2 142 HIS 142 142 142 HIS HIS B . n B 2 143 SER 143 143 143 SER SER B . n B 2 144 ARG 144 144 144 ARG ARG B . n B 2 145 PRO 145 145 145 PRO PRO B . n B 2 146 GLN 146 146 146 GLN GLN B . n B 2 147 HIS 147 147 147 HIS HIS B . n B 2 148 GLY 148 148 148 GLY GLY B . n B 2 149 LYS 149 149 149 LYS LYS B . n B 2 150 GLU 150 150 150 GLU GLU B . n B 2 151 LEU 151 151 151 LEU LEU B . n B 2 152 PRO 152 152 152 PRO PRO B . n B 2 153 CYS 153 153 153 CYS CYS B . n B 2 154 SER 154 154 154 SER SER B . n B 2 155 THR 155 155 155 THR THR B . n B 2 156 TYR 156 156 156 TYR TYR B . n B 2 157 VAL 157 157 157 VAL VAL B . n B 2 158 GLN 158 158 158 GLN GLN B . n B 2 159 SER 159 159 159 SER SER B . n B 2 160 THR 160 160 160 THR THR B . n B 2 161 ALA 161 161 161 ALA ALA B . n B 2 162 ALA 162 162 162 ALA ALA B . n B 2 163 THR 163 163 163 THR THR B . n B 2 164 THR 164 164 164 THR THR B . n B 2 165 GLU 165 165 165 GLU GLU B . n B 2 166 GLU 166 166 166 GLU GLU B . n B 2 167 ILE 167 167 167 ILE ILE B . n B 2 168 GLU 168 168 168 GLU GLU B . n B 2 169 VAL 169 169 169 VAL VAL B . n B 2 170 HIS 170 170 170 HIS HIS B . n B 2 171 MET 171 171 171 MET MET B . n B 2 172 PRO 172 172 172 PRO PRO B . n B 2 173 PRO 173 173 173 PRO PRO B . n B 2 174 ASP 174 174 174 ASP ASP B . n B 2 175 THR 175 175 175 THR THR B . n B 2 176 PRO 176 176 176 PRO PRO B . n B 2 177 ASP 177 177 177 ASP ASP B . n B 2 178 ARG 178 178 178 ARG ARG B . n B 2 179 THR 179 179 179 THR THR B . n B 2 180 LEU 180 180 180 LEU LEU B . n B 2 181 MET 181 181 181 MET MET B . n B 2 182 SER 182 182 182 SER SER B . n B 2 183 GLN 183 183 183 GLN GLN B . n B 2 184 GLN 184 184 184 GLN GLN B . n B 2 185 SER 185 185 185 SER SER B . n B 2 186 GLY 186 186 186 GLY GLY B . n B 2 187 ASN 187 187 187 ASN ASN B . n B 2 188 VAL 188 188 188 VAL VAL B . n B 2 189 LYS 189 189 189 LYS LYS B . n B 2 190 ILE 190 190 190 ILE ILE B . n B 2 191 THR 191 191 191 THR THR B . n B 2 192 VAL 192 192 192 VAL VAL B . n B 2 193 ASN 193 193 193 ASN ASN B . n B 2 194 GLY 194 194 194 GLY GLY B . n B 2 195 GLN 195 195 195 GLN GLN B . n B 2 196 THR 196 196 196 THR THR B . n B 2 197 VAL 197 197 197 VAL VAL B . n B 2 198 ARG 198 198 198 ARG ARG B . n B 2 199 TYR 199 199 199 TYR TYR B . n B 2 200 LYS 200 200 200 LYS LYS B . n B 2 201 CYS 201 201 201 CYS CYS B . n B 2 202 ASN 202 202 202 ASN ASN B . n B 2 203 CYS 203 203 203 CYS CYS B . n B 2 204 GLY 204 204 204 GLY GLY B . n B 2 205 GLY 205 205 205 GLY GLY B . n B 2 206 SER 206 206 206 SER SER B . n B 2 207 ASN 207 207 207 ASN ASN B . n B 2 208 GLU 208 208 208 GLU GLU B . n B 2 209 GLY 209 209 209 GLY GLY B . n B 2 210 LEU 210 210 210 LEU LEU B . n B 2 211 THR 211 211 211 THR THR B . n B 2 212 THR 212 212 212 THR THR B . n B 2 213 THR 213 213 213 THR THR B . n B 2 214 ASP 214 214 214 ASP ASP B . n B 2 215 LYS 215 215 215 LYS LYS B . n B 2 216 VAL 216 216 216 VAL VAL B . n B 2 217 ILE 217 217 217 ILE ILE B . n B 2 218 ASN 218 218 218 ASN ASN B . n B 2 219 ASN 219 219 219 ASN ASN B . n B 2 220 CYS 220 220 220 CYS CYS B . n B 2 221 LYS 221 221 221 LYS LYS B . n B 2 222 VAL 222 222 222 VAL VAL B . n B 2 223 ASP 223 223 223 ASP ASP B . n B 2 224 GLN 224 224 224 GLN GLN B . n B 2 225 CYS 225 225 225 CYS CYS B . n B 2 226 HIS 226 226 226 HIS HIS B . n B 2 227 ALA 227 227 227 ALA ALA B . n B 2 228 ALA 228 228 228 ALA ALA B . n B 2 229 VAL 229 229 229 VAL VAL B . n B 2 230 THR 230 230 230 THR THR B . n B 2 231 ASN 231 231 231 ASN ASN B . n B 2 232 HIS 232 232 232 HIS HIS B . n B 2 233 LYS 233 233 233 LYS LYS B . n B 2 234 LYS 234 234 234 LYS LYS B . n B 2 235 TRP 235 235 235 TRP TRP B . n B 2 236 GLN 236 236 236 GLN GLN B . n B 2 237 TYR 237 237 237 TYR TYR B . n B 2 238 ASN 238 238 238 ASN ASN B . n B 2 239 SER 239 239 239 SER SER B . n B 2 240 PRO 240 240 240 PRO PRO B . n B 2 241 LEU 241 241 241 LEU LEU B . n B 2 242 VAL 242 242 242 VAL VAL B . n B 2 243 PRO 243 243 243 PRO PRO B . n B 2 244 ARG 244 244 244 ARG ARG B . n B 2 245 ASN 245 245 245 ASN ASN B . n B 2 246 ALA 246 246 246 ALA ALA B . n B 2 247 GLU 247 247 247 GLU GLU B . n B 2 248 LEU 248 248 248 LEU LEU B . n B 2 249 GLY 249 249 249 GLY GLY B . n B 2 250 ASP 250 250 250 ASP ASP B . n B 2 251 ARG 251 251 251 ARG ARG B . n B 2 252 LYS 252 252 252 LYS LYS B . n B 2 253 GLY 253 253 253 GLY GLY B . n B 2 254 LYS 254 254 254 LYS LYS B . n B 2 255 ILE 255 255 255 ILE ILE B . n B 2 256 HIS 256 256 256 HIS HIS B . n B 2 257 ILE 257 257 257 ILE ILE B . n B 2 258 PRO 258 258 258 PRO PRO B . n B 2 259 PHE 259 259 259 PHE PHE B . n B 2 260 PRO 260 260 260 PRO PRO B . n B 2 261 LEU 261 261 261 LEU LEU B . n B 2 262 ALA 262 262 262 ALA ALA B . n B 2 263 ASN 263 263 263 ASN ASN B . n B 2 264 VAL 264 264 264 VAL VAL B . n B 2 265 THR 265 265 265 THR THR B . n B 2 266 CYS 266 266 266 CYS CYS B . n B 2 267 ARG 267 267 267 ARG ARG B . n B 2 268 VAL 268 268 268 VAL VAL B . n B 2 269 PRO 269 269 269 PRO PRO B . n B 2 270 LYS 270 270 270 LYS LYS B . n B 2 271 ALA 271 271 271 ALA ALA B . n B 2 272 ARG 272 272 272 ARG ARG B . n B 2 273 ASN 273 273 273 ASN ASN B . n B 2 274 PRO 274 274 274 PRO PRO B . n B 2 275 THR 275 275 275 THR THR B . n B 2 276 VAL 276 276 276 VAL VAL B . n B 2 277 THR 277 277 277 THR THR B . n B 2 278 TYR 278 278 278 TYR TYR B . n B 2 279 GLY 279 279 279 GLY GLY B . n B 2 280 LYS 280 280 280 LYS LYS B . n B 2 281 ASN 281 281 281 ASN ASN B . n B 2 282 GLN 282 282 282 GLN GLN B . n B 2 283 VAL 283 283 283 VAL VAL B . n B 2 284 ILE 284 284 284 ILE ILE B . n B 2 285 MET 285 285 285 MET MET B . n B 2 286 LEU 286 286 286 LEU LEU B . n B 2 287 LEU 287 287 287 LEU LEU B . n B 2 288 TYR 288 288 288 TYR TYR B . n B 2 289 PRO 289 289 289 PRO PRO B . n B 2 290 ASP 290 290 290 ASP ASP B . n B 2 291 HIS 291 291 291 HIS HIS B . n B 2 292 PRO 292 292 292 PRO PRO B . n B 2 293 THR 293 293 293 THR THR B . n B 2 294 LEU 294 294 294 LEU LEU B . n B 2 295 LEU 295 295 295 LEU LEU B . n B 2 296 SER 296 296 296 SER SER B . n B 2 297 TYR 297 297 297 TYR TYR B . n B 2 298 ARG 298 298 298 ARG ARG B . n B 2 299 ASN 299 299 299 ASN ASN B . n B 2 300 MET 300 300 300 MET MET B . n B 2 301 GLY 301 301 301 GLY GLY B . n B 2 302 GLU 302 302 302 GLU GLU B . n B 2 303 GLU 303 303 303 GLU GLU B . n B 2 304 PRO 304 304 304 PRO PRO B . n B 2 305 ASN 305 305 305 ASN ASN B . n B 2 306 TYR 306 306 306 TYR TYR B . n B 2 307 GLN 307 307 307 GLN GLN B . n B 2 308 GLU 308 308 308 GLU GLU B . n B 2 309 GLU 309 309 309 GLU GLU B . n B 2 310 TRP 310 310 310 TRP TRP B . n B 2 311 VAL 311 311 311 VAL VAL B . n B 2 312 MET 312 312 312 MET MET B . n B 2 313 HIS 313 313 313 HIS HIS B . n B 2 314 LYS 314 314 314 LYS LYS B . n B 2 315 LYS 315 315 315 LYS LYS B . n B 2 316 GLU 316 316 316 GLU GLU B . n B 2 317 VAL 317 317 317 VAL VAL B . n B 2 318 VAL 318 318 318 VAL VAL B . n B 2 319 LEU 319 319 319 LEU LEU B . n B 2 320 THR 320 320 320 THR THR B . n B 2 321 VAL 321 321 321 VAL VAL B . n B 2 322 PRO 322 322 322 PRO PRO B . n B 2 323 THR 323 323 323 THR THR B . n B 2 324 GLU 324 324 324 GLU GLU B . n B 2 325 GLY 325 325 325 GLY GLY B . n B 2 326 LEU 326 326 326 LEU LEU B . n B 2 327 GLU 327 327 327 GLU GLU B . n B 2 328 VAL 328 328 328 VAL VAL B . n B 2 329 THR 329 329 329 THR THR B . n B 2 330 TRP 330 330 330 TRP TRP B . n B 2 331 GLY 331 331 331 GLY GLY B . n B 2 332 ASN 332 332 332 ASN ASN B . n B 2 333 ASN 333 333 333 ASN ASN B . n B 2 334 GLU 334 334 334 GLU GLU B . n B 2 335 PRO 335 335 335 PRO PRO B . n B 2 336 TYR 336 336 336 TYR TYR B . n B 2 337 LYS 337 337 337 LYS LYS B . n B 2 338 TYR 338 338 338 TYR TYR B . n B 2 339 TRP 339 339 339 TRP TRP B . n B 2 340 PRO 340 340 340 PRO PRO B . n B 2 341 GLN 341 341 341 GLN GLN B . n B 2 342 LEU 342 342 342 LEU LEU B . n B 2 343 SER 343 343 ? ? ? B . n B 2 344 THR 344 344 ? ? ? B . n B 2 345 ASN 345 345 ? ? ? B . n B 2 346 GLY 346 346 ? ? ? B . n B 2 347 THR 347 347 ? ? ? B . n B 2 348 ALA 348 348 ? ? ? B . n B 2 349 HIS 349 349 ? ? ? B . n B 2 350 GLY 350 350 ? ? ? B . n B 2 351 HIS 351 351 ? ? ? B . n B 2 352 PRO 352 352 ? ? ? B . n B 2 353 HIS 353 353 ? ? ? B . n B 2 354 GLU 354 354 ? ? ? B . n B 2 355 ILE 355 355 ? ? ? B . n B 2 356 ILE 356 356 ? ? ? B . n B 2 357 LEU 357 357 ? ? ? B . n B 2 358 TYR 358 358 ? ? ? B . n B 2 359 TYR 359 359 ? ? ? B . n B 2 360 TYR 360 360 ? ? ? B . n C 3 1 GLU 1 -21 ? ? ? F . n C 3 2 LEU 2 -20 ? ? ? F . n C 3 3 TYR 3 -19 ? ? ? F . n C 3 4 GLY 4 -18 ? ? ? F . n C 3 5 GLY 5 -17 ? ? ? F . n C 3 6 GLY 6 -16 ? ? ? F . n C 3 7 GLY 7 -15 ? ? ? F . n C 3 8 SER 8 -14 ? ? ? F . n C 3 9 GLY 9 -13 ? ? ? F . n C 3 10 GLY 10 -12 ? ? ? F . n C 3 11 GLY 11 -11 ? ? ? F . n C 3 12 GLY 12 -10 ? ? ? F . n C 3 13 SER 13 -9 ? ? ? F . n C 3 14 GLY 14 -8 ? ? ? F . n C 3 15 GLY 15 -7 ? ? ? F . n C 3 16 GLY 16 -6 ? ? ? F . n C 3 17 GLY 17 -5 ? ? ? F . n C 3 18 SER 18 -4 ? ? ? F . n C 3 19 GLY 19 -3 ? ? ? F . n C 3 20 GLY 20 -2 ? ? ? F . n C 3 21 GLY 21 -1 -1 GLY GLY F . n C 3 22 GLY 22 0 0 GLY GLY F . n C 3 23 TYR 23 1 1 TYR TYR F . n C 3 24 GLU 24 2 2 GLU GLU F . n C 3 25 HIS 25 3 3 HIS HIS F . n C 3 26 VAL 26 4 4 VAL VAL F . n C 3 27 THR 27 5 5 THR THR F . n C 3 28 VAL 28 6 6 VAL VAL F . n C 3 29 ILE 29 7 7 ILE ILE F . n C 3 30 PRO 30 8 8 PRO PRO F . n C 3 31 ASN 31 9 9 ASN ASN F . n C 3 32 THR 32 10 10 THR THR F . n C 3 33 VAL 33 11 11 VAL VAL F . n C 3 34 GLY 34 12 12 GLY GLY F . n C 3 35 VAL 35 13 13 VAL VAL F . n C 3 36 PRO 36 14 14 PRO PRO F . n C 3 37 TYR 37 15 15 TYR TYR F . n C 3 38 LYS 38 16 16 LYS LYS F . n C 3 39 THR 39 17 17 THR THR F . n C 3 40 LEU 40 18 18 LEU LEU F . n C 3 41 VAL 41 19 19 VAL VAL F . n C 3 42 ASN 42 20 20 ASN ASN F . n C 3 43 ARG 43 21 21 ARG ARG F . n C 3 44 PRO 44 22 22 PRO PRO F . n C 3 45 GLY 45 23 23 GLY GLY F . n C 3 46 TYR 46 24 24 TYR TYR F . n C 3 47 SER 47 25 25 SER SER F . n C 3 48 PRO 48 26 26 PRO PRO F . n C 3 49 MET 49 27 27 MET MET F . n C 3 50 VAL 50 28 28 VAL VAL F . n C 3 51 LEU 51 29 29 LEU LEU F . n C 3 52 GLU 52 30 30 GLU GLU F . n C 3 53 MET 53 31 31 MET MET F . n C 3 54 GLU 54 32 32 GLU GLU F . n C 3 55 LEU 55 33 33 LEU LEU F . n C 3 56 LEU 56 34 34 LEU LEU F . n C 3 57 SER 57 35 35 SER SER F . n C 3 58 VAL 58 36 36 VAL VAL F . n C 3 59 THR 59 37 37 THR THR F . n C 3 60 LEU 60 38 38 LEU LEU F . n C 3 61 GLU 61 39 39 GLU GLU F . n C 3 62 PRO 62 40 40 PRO PRO F . n C 3 63 THR 63 41 41 THR THR F . n C 3 64 LEU 64 42 42 LEU LEU F . n C 3 65 SER 65 43 43 SER SER F . n C 3 66 LEU 66 44 44 LEU LEU F . n C 3 67 ASP 67 45 45 ASP ASP F . n C 3 68 TYR 68 46 46 TYR TYR F . n C 3 69 ILE 69 47 47 ILE ILE F . n C 3 70 THR 70 48 48 THR THR F . n C 3 71 CYS 71 49 49 CYS CYS F . n C 3 72 GLU 72 50 50 GLU GLU F . n C 3 73 TYR 73 51 51 TYR TYR F . n C 3 74 LYS 74 52 52 LYS LYS F . n C 3 75 THR 75 53 53 THR THR F . n C 3 76 VAL 76 54 54 VAL VAL F . n C 3 77 ILE 77 55 55 ILE ILE F . n C 3 78 PRO 78 56 56 PRO PRO F . n C 3 79 SER 79 57 57 SER SER F . n C 3 80 PRO 80 58 58 PRO PRO F . n C 3 81 TYR 81 59 59 TYR TYR F . n C 3 82 VAL 82 60 60 VAL VAL F . n C 3 83 LYS 83 61 61 LYS LYS F . n C 3 84 CYS 84 62 62 CYS CYS F . n C 3 85 CYS 85 63 63 CYS CYS F . n C 3 86 GLY 86 64 64 GLY GLY F . n C 3 87 THR 87 65 65 THR THR F . n C 3 88 ALA 88 66 66 ALA ALA F . n C 3 89 GLU 89 67 67 GLU GLU F . n C 3 90 CYS 90 68 68 CYS CYS F . n C 3 91 LYS 91 69 69 LYS LYS F . n C 3 92 ASP 92 70 70 ASP ASP F . n C 3 93 LYS 93 71 71 LYS LYS F . n C 3 94 ASN 94 72 72 ASN ASN F . n C 3 95 LEU 95 73 73 LEU LEU F . n C 3 96 PRO 96 74 74 PRO PRO F . n C 3 97 ASP 97 75 75 ASP ASP F . n C 3 98 TYR 98 76 76 TYR TYR F . n C 3 99 SER 99 77 77 SER SER F . n C 3 100 CYS 100 78 78 CYS CYS F . n C 3 101 LYS 101 79 79 LYS LYS F . n C 3 102 VAL 102 80 80 VAL VAL F . n C 3 103 PHE 103 81 81 PHE PHE F . n C 3 104 THR 104 82 82 THR THR F . n C 3 105 GLY 105 83 83 GLY GLY F . n C 3 106 VAL 106 84 84 VAL VAL F . n C 3 107 TYR 107 85 85 TYR TYR F . n C 3 108 PRO 108 86 86 PRO PRO F . n C 3 109 PHE 109 87 87 PHE PHE F . n C 3 110 MET 110 88 88 MET MET F . n C 3 111 TRP 111 89 89 TRP TRP F . n C 3 112 GLY 112 90 90 GLY GLY F . n C 3 113 GLY 113 91 91 GLY GLY F . n C 3 114 ALA 114 92 92 ALA ALA F . n C 3 115 TYR 115 93 93 TYR TYR F . n C 3 116 CYS 116 94 94 CYS CYS F . n C 3 117 PHE 117 95 95 PHE PHE F . n C 3 118 CYS 118 96 96 CYS CYS F . n C 3 119 ASP 119 97 97 ASP ASP F . n C 3 120 ALA 120 98 98 ALA ALA F . n C 3 121 GLU 121 99 99 GLU GLU F . n C 3 122 ASN 122 100 100 ASN ASN F . n C 3 123 THR 123 101 101 THR THR F . n C 3 124 GLN 124 102 102 GLN GLN F . n C 3 125 LEU 125 103 103 LEU LEU F . n C 3 126 SER 126 104 104 SER SER F . n C 3 127 GLU 127 105 105 GLU GLU F . n C 3 128 ALA 128 106 106 ALA ALA F . n C 3 129 HIS 129 107 107 HIS HIS F . n C 3 130 VAL 130 108 108 VAL VAL F . n C 3 131 GLU 131 109 109 GLU GLU F . n C 3 132 LYS 132 110 110 LYS LYS F . n C 3 133 SER 133 111 111 SER SER F . n C 3 134 GLU 134 112 112 GLU GLU F . n C 3 135 SER 135 113 113 SER SER F . n C 3 136 CYS 136 114 114 CYS CYS F . n C 3 137 LYS 137 115 115 LYS LYS F . n C 3 138 THR 138 116 116 THR THR F . n C 3 139 GLU 139 117 117 GLU GLU F . n C 3 140 PHE 140 118 118 PHE PHE F . n C 3 141 ALA 141 119 119 ALA ALA F . n C 3 142 SER 142 120 120 SER SER F . n C 3 143 ALA 143 121 121 ALA ALA F . n C 3 144 TYR 144 122 122 TYR TYR F . n C 3 145 ARG 145 123 123 ARG ARG F . n C 3 146 ALA 146 124 124 ALA ALA F . n C 3 147 HIS 147 125 125 HIS HIS F . n C 3 148 THR 148 126 126 THR THR F . n C 3 149 ALA 149 127 127 ALA ALA F . n C 3 150 SER 150 128 128 SER SER F . n C 3 151 ALA 151 129 129 ALA ALA F . n C 3 152 SER 152 130 130 SER SER F . n C 3 153 ALA 153 131 131 ALA ALA F . n C 3 154 LYS 154 132 132 LYS LYS F . n C 3 155 LEU 155 133 133 LEU LEU F . n C 3 156 ARG 156 134 134 ARG ARG F . n C 3 157 VAL 157 135 135 VAL VAL F . n C 3 158 LEU 158 136 136 LEU LEU F . n C 3 159 TYR 159 137 137 TYR TYR F . n C 3 160 GLN 160 138 138 GLN GLN F . n C 3 161 GLY 161 139 139 GLY GLY F . n C 3 162 ASN 162 140 140 ASN ASN F . n C 3 163 ASN 163 141 141 ASN ASN F . n C 3 164 ILE 164 142 142 ILE ILE F . n C 3 165 THR 165 143 143 THR THR F . n C 3 166 VAL 166 144 144 VAL VAL F . n C 3 167 THR 167 145 145 THR THR F . n C 3 168 ALA 168 146 146 ALA ALA F . n C 3 169 TYR 169 147 147 TYR TYR F . n C 3 170 ALA 170 148 148 ALA ALA F . n C 3 171 ASN 171 149 149 ASN ASN F . n C 3 172 GLY 172 150 150 GLY GLY F . n C 3 173 ASP 173 151 151 ASP ASP F . n C 3 174 HIS 174 152 152 HIS HIS F . n C 3 175 ALA 175 153 153 ALA ALA F . n C 3 176 VAL 176 154 154 VAL VAL F . n C 3 177 THR 177 155 155 THR THR F . n C 3 178 VAL 178 156 156 VAL VAL F . n C 3 179 LYS 179 157 157 LYS LYS F . n C 3 180 ASP 180 158 158 ASP ASP F . n C 3 181 ALA 181 159 159 ALA ALA F . n C 3 182 LYS 182 160 160 LYS LYS F . n C 3 183 PHE 183 161 161 PHE PHE F . n C 3 184 ILE 184 162 162 ILE ILE F . n C 3 185 VAL 185 163 163 VAL VAL F . n C 3 186 GLY 186 164 164 GLY GLY F . n C 3 187 PRO 187 165 165 PRO PRO F . n C 3 188 MET 188 166 166 MET MET F . n C 3 189 SER 189 167 167 SER SER F . n C 3 190 SER 190 168 168 SER SER F . n C 3 191 ALA 191 169 169 ALA ALA F . n C 3 192 TRP 192 170 170 TRP TRP F . n C 3 193 THR 193 171 171 THR THR F . n C 3 194 PRO 194 172 172 PRO PRO F . n C 3 195 PHE 195 173 173 PHE PHE F . n C 3 196 ASP 196 174 174 ASP ASP F . n C 3 197 ASN 197 175 175 ASN ASN F . n C 3 198 LYS 198 176 176 LYS LYS F . n C 3 199 ILE 199 177 177 ILE ILE F . n C 3 200 VAL 200 178 178 VAL VAL F . n C 3 201 VAL 201 179 179 VAL VAL F . n C 3 202 TYR 202 180 180 TYR TYR F . n C 3 203 LYS 203 181 181 LYS LYS F . n C 3 204 GLY 204 182 182 GLY GLY F . n C 3 205 ASP 205 183 183 ASP ASP F . n C 3 206 VAL 206 184 184 VAL VAL F . n C 3 207 TYR 207 185 185 TYR TYR F . n C 3 208 ASN 208 186 186 ASN ASN F . n C 3 209 MET 209 187 187 MET MET F . n C 3 210 ASP 210 188 188 ASP ASP F . n C 3 211 TYR 211 189 189 TYR TYR F . n C 3 212 PRO 212 190 190 PRO PRO F . n C 3 213 PRO 213 191 191 PRO PRO F . n C 3 214 PHE 214 192 192 PHE PHE F . n C 3 215 GLY 215 193 193 GLY GLY F . n C 3 216 ALA 216 194 194 ALA ALA F . n C 3 217 GLY 217 195 195 GLY GLY F . n C 3 218 ARG 218 196 196 ARG ARG F . n C 3 219 PRO 219 197 197 PRO PRO F . n C 3 220 GLY 220 198 198 GLY GLY F . n C 3 221 GLN 221 199 199 GLN GLN F . n C 3 222 PHE 222 200 200 PHE PHE F . n C 3 223 GLY 223 201 201 GLY GLY F . n C 3 224 ASP 224 202 202 ASP ASP F . n C 3 225 ILE 225 203 203 ILE ILE F . n C 3 226 GLN 226 204 204 GLN GLN F . n C 3 227 SER 227 205 205 SER SER F . n C 3 228 ARG 228 206 206 ARG ARG F . n C 3 229 THR 229 207 207 THR THR F . n C 3 230 PRO 230 208 208 PRO PRO F . n C 3 231 GLU 231 209 209 GLU GLU F . n C 3 232 SER 232 210 210 SER SER F . n C 3 233 LYS 233 211 211 LYS LYS F . n C 3 234 ASP 234 212 212 ASP ASP F . n C 3 235 VAL 235 213 213 VAL VAL F . n C 3 236 TYR 236 214 214 TYR TYR F . n C 3 237 ALA 237 215 215 ALA ALA F . n C 3 238 ASN 238 216 216 ASN ASN F . n C 3 239 THR 239 217 217 THR THR F . n C 3 240 GLN 240 218 218 GLN GLN F . n C 3 241 LEU 241 219 219 LEU LEU F . n C 3 242 VAL 242 220 220 VAL VAL F . n C 3 243 LEU 243 221 221 LEU LEU F . n C 3 244 GLN 244 222 222 GLN GLN F . n C 3 245 ARG 245 223 223 ARG ARG F . n C 3 246 PRO 246 224 224 PRO PRO F . n C 3 247 ALA 247 225 225 ALA ALA F . n C 3 248 ALA 248 226 226 ALA ALA F . n C 3 249 GLY 249 227 227 GLY GLY F . n C 3 250 THR 250 228 228 THR THR F . n C 3 251 VAL 251 229 229 VAL VAL F . n C 3 252 HIS 252 230 230 HIS HIS F . n C 3 253 VAL 253 231 231 VAL VAL F . n C 3 254 PRO 254 232 232 PRO PRO F . n C 3 255 TYR 255 233 233 TYR TYR F . n C 3 256 SER 256 234 234 SER SER F . n C 3 257 GLN 257 235 235 GLN GLN F . n C 3 258 ALA 258 236 236 ALA ALA F . n C 3 259 PRO 259 237 237 PRO PRO F . n C 3 260 SER 260 238 238 SER SER F . n C 3 261 GLY 261 239 239 GLY GLY F . n C 3 262 PHE 262 240 240 PHE PHE F . n C 3 263 LYS 263 241 241 LYS LYS F . n C 3 264 TYR 264 242 242 TYR TYR F . n C 3 265 TRP 265 243 243 TRP TRP F . n C 3 266 LEU 266 244 244 LEU LEU F . n C 3 267 LYS 267 245 245 LYS LYS F . n C 3 268 GLU 268 246 246 GLU GLU F . n C 3 269 ARG 269 247 247 ARG ARG F . n C 3 270 GLY 270 248 248 GLY GLY F . n C 3 271 ALA 271 249 249 ALA ALA F . n C 3 272 SER 272 250 250 SER SER F . n C 3 273 LEU 273 251 251 LEU LEU F . n C 3 274 GLN 274 252 252 GLN GLN F . n C 3 275 HIS 275 253 253 HIS HIS F . n C 3 276 THR 276 254 254 THR THR F . n C 3 277 ALA 277 255 255 ALA ALA F . n C 3 278 PRO 278 256 256 PRO PRO F . n C 3 279 PHE 279 257 257 PHE PHE F . n C 3 280 GLY 280 258 258 GLY GLY F . n C 3 281 CYS 281 259 259 CYS CYS F . n C 3 282 GLN 282 260 260 GLN GLN F . n C 3 283 ILE 283 261 261 ILE ILE F . n C 3 284 ALA 284 262 262 ALA ALA F . n C 3 285 THR 285 263 263 THR THR F . n C 3 286 ASN 286 264 264 ASN ASN F . n C 3 287 PRO 287 265 265 PRO PRO F . n C 3 288 VAL 288 266 266 VAL VAL F . n C 3 289 ARG 289 267 267 ARG ARG F . n C 3 290 ALA 290 268 268 ALA ALA F . n C 3 291 VAL 291 269 269 VAL VAL F . n C 3 292 ASN 292 270 270 ASN ASN F . n C 3 293 CYS 293 271 271 CYS CYS F . n C 3 294 ALA 294 272 272 ALA ALA F . n C 3 295 VAL 295 273 273 VAL VAL F . n C 3 296 GLY 296 274 274 GLY GLY F . n C 3 297 ASN 297 275 275 ASN ASN F . n C 3 298 MET 298 276 276 MET MET F . n C 3 299 PRO 299 277 277 PRO PRO F . n C 3 300 ILE 300 278 278 ILE ILE F . n C 3 301 SER 301 279 279 SER SER F . n C 3 302 ILE 302 280 280 ILE ILE F . n C 3 303 ASP 303 281 281 ASP ASP F . n C 3 304 ILE 304 282 282 ILE ILE F . n C 3 305 PRO 305 283 283 PRO PRO F . n C 3 306 GLU 306 284 284 GLU GLU F . n C 3 307 ALA 307 285 285 ALA ALA F . n C 3 308 ALA 308 286 286 ALA ALA F . n C 3 309 PHE 309 287 287 PHE PHE F . n C 3 310 THR 310 288 288 THR THR F . n C 3 311 ARG 311 289 289 ARG ARG F . n C 3 312 VAL 312 290 290 VAL VAL F . n C 3 313 VAL 313 291 291 VAL VAL F . n C 3 314 ASP 314 292 292 ASP ASP F . n C 3 315 ALA 315 293 293 ALA ALA F . n C 3 316 PRO 316 294 294 PRO PRO F . n C 3 317 SER 317 295 295 SER SER F . n C 3 318 LEU 318 296 296 LEU LEU F . n C 3 319 THR 319 297 297 THR THR F . n C 3 320 ASP 320 298 298 ASP ASP F . n C 3 321 MET 321 299 299 MET MET F . n C 3 322 SER 322 300 300 SER SER F . n C 3 323 CYS 323 301 301 CYS CYS F . n C 3 324 GLU 324 302 302 GLU GLU F . n C 3 325 VAL 325 303 303 VAL VAL F . n C 3 326 PRO 326 304 304 PRO PRO F . n C 3 327 ALA 327 305 305 ALA ALA F . n C 3 328 CYS 328 306 306 CYS CYS F . n C 3 329 THR 329 307 307 THR THR F . n C 3 330 HIS 330 308 308 HIS HIS F . n C 3 331 SER 331 309 309 SER SER F . n C 3 332 SER 332 310 310 SER SER F . n C 3 333 ASP 333 311 311 ASP ASP F . n C 3 334 PHE 334 312 312 PHE PHE F . n C 3 335 GLY 335 313 313 GLY GLY F . n C 3 336 GLY 336 314 314 GLY GLY F . n C 3 337 VAL 337 315 315 VAL VAL F . n C 3 338 ALA 338 316 316 ALA ALA F . n C 3 339 ILE 339 317 317 ILE ILE F . n C 3 340 ILE 340 318 318 ILE ILE F . n C 3 341 LYS 341 319 319 LYS LYS F . n C 3 342 TYR 342 320 320 TYR TYR F . n C 3 343 ALA 343 321 321 ALA ALA F . n C 3 344 ALA 344 322 322 ALA ALA F . n C 3 345 SER 345 323 323 SER SER F . n C 3 346 LYS 346 324 324 LYS LYS F . n C 3 347 LYS 347 325 325 LYS LYS F . n C 3 348 GLY 348 326 326 GLY GLY F . n C 3 349 LYS 349 327 327 LYS LYS F . n C 3 350 CYS 350 328 328 CYS CYS F . n C 3 351 ALA 351 329 329 ALA ALA F . n C 3 352 VAL 352 330 330 VAL VAL F . n C 3 353 HIS 353 331 331 HIS HIS F . n C 3 354 SER 354 332 332 SER SER F . n C 3 355 MET 355 333 333 MET MET F . n C 3 356 THR 356 334 334 THR THR F . n C 3 357 ASN 357 335 335 ASN ASN F . n C 3 358 ALA 358 336 336 ALA ALA F . n C 3 359 VAL 359 337 337 VAL VAL F . n C 3 360 THR 360 338 338 THR THR F . n C 3 361 ILE 361 339 339 ILE ILE F . n C 3 362 ARG 362 340 340 ARG ARG F . n C 3 363 GLU 363 341 341 GLU GLU F . n C 3 364 ALA 364 342 342 ALA ALA F . n C 3 365 GLU 365 343 343 GLU GLU F . n C 3 366 ILE 366 344 344 ILE ILE F . n C 3 367 GLU 367 345 345 GLU GLU F . n C 3 368 VAL 368 346 346 VAL VAL F . n C 3 369 GLU 369 347 347 GLU GLU F . n C 3 370 GLY 370 348 348 GLY GLY F . n C 3 371 ASN 371 349 349 ASN ASN F . n C 3 372 SER 372 350 350 SER SER F . n C 3 373 GLN 373 351 351 GLN GLN F . n C 3 374 LEU 374 352 352 LEU LEU F . n C 3 375 GLN 375 353 353 GLN GLN F . n C 3 376 ILE 376 354 354 ILE ILE F . n C 3 377 SER 377 355 355 SER SER F . n C 3 378 PHE 378 356 356 PHE PHE F . n C 3 379 SER 379 357 357 SER SER F . n C 3 380 THR 380 358 358 THR THR F . n C 3 381 ALA 381 359 359 ALA ALA F . n C 3 382 LEU 382 360 360 LEU LEU F . n C 3 383 ALA 383 361 361 ALA ALA F . n C 3 384 SER 384 362 362 SER SER F . n C 3 385 ALA 385 363 363 ALA ALA F . n C 3 386 GLU 386 364 364 GLU GLU F . n C 3 387 PHE 387 365 365 PHE PHE F . n C 3 388 ARG 388 366 366 ARG ARG F . n C 3 389 VAL 389 367 367 VAL VAL F . n C 3 390 GLN 390 368 368 GLN GLN F . n C 3 391 VAL 391 369 369 VAL VAL F . n C 3 392 CYS 392 370 370 CYS CYS F . n C 3 393 SER 393 371 371 SER SER F . n C 3 394 THR 394 372 372 THR THR F . n C 3 395 GLN 395 373 373 GLN GLN F . n C 3 396 VAL 396 374 374 VAL VAL F . n C 3 397 HIS 397 375 375 HIS HIS F . n C 3 398 CYS 398 376 376 CYS CYS F . n C 3 399 ALA 399 377 377 ALA ALA F . n C 3 400 ALA 400 378 378 ALA ALA F . n C 3 401 GLU 401 379 379 GLU GLU F . n C 3 402 CYS 402 380 380 CYS CYS F . n C 3 403 HIS 403 381 381 HIS HIS F . n C 3 404 PRO 404 382 382 PRO PRO F . n C 3 405 PRO 405 383 383 PRO PRO F . n C 3 406 LYS 406 384 384 LYS LYS F . n C 3 407 ASP 407 385 385 ASP ASP F . n C 3 408 HIS 408 386 386 HIS HIS F . n C 3 409 ILE 409 387 387 ILE ILE F . n C 3 410 VAL 410 388 388 VAL VAL F . n C 3 411 ASN 411 389 389 ASN ASN F . n C 3 412 TYR 412 390 390 TYR TYR F . n C 3 413 PRO 413 391 391 PRO PRO F . n C 3 414 ALA 414 392 392 ALA ALA F . n C 3 415 SER 415 393 393 SER SER F . n C 3 416 HIS 416 394 ? ? ? F . n C 3 417 THR 417 395 ? ? ? F . n C 3 418 THR 418 396 ? ? ? F . n C 3 419 LEU 419 397 ? ? ? F . n C 3 420 GLY 420 398 ? ? ? F . n C 3 421 VAL 421 399 ? ? ? F . n C 3 422 GLN 422 400 ? ? ? F . n C 3 423 ASP 423 401 ? ? ? F . n C 3 424 ILE 424 402 ? ? ? F . n C 3 425 SER 425 403 ? ? ? F . n C 3 426 ALA 426 404 ? ? ? F . n C 3 427 THR 427 405 ? ? ? F . n C 3 428 ALA 428 406 ? ? ? F . n C 3 429 MET 429 407 ? ? ? F . n C 3 430 SER 430 408 ? ? ? F . n C 3 431 TRP 431 409 ? ? ? F . n C 3 432 VAL 432 410 ? ? ? F . n C 3 433 GLN 433 411 ? ? ? F . n C 3 434 LYS 434 412 ? ? ? F . n C 3 435 GLY 435 413 ? ? ? F . n C 3 436 PRO 436 414 ? ? ? F . n C 3 437 PHE 437 415 ? ? ? F . n C 3 438 GLU 438 416 ? ? ? F . n C 3 439 ASP 439 417 ? ? ? F . n C 3 440 ASP 440 418 ? ? ? F . n C 3 441 ASP 441 419 ? ? ? F . n C 3 442 ASP 442 420 ? ? ? F . n C 3 443 LYS 443 421 ? ? ? F . n C 3 444 ALA 444 422 ? ? ? F . n C 3 445 GLY 445 423 ? ? ? F . n C 3 446 TRP 446 424 ? ? ? F . n C 3 447 SER 447 425 ? ? ? F . n C 3 448 HIS 448 426 ? ? ? F . n C 3 449 PRO 449 427 ? ? ? F . n C 3 450 GLN 450 428 ? ? ? F . n C 3 451 PHE 451 429 ? ? ? F . n C 3 452 GLU 452 430 ? ? ? F . n C 3 453 LYS 453 431 ? ? ? F . n C 3 454 GLY 454 432 ? ? ? F . n C 3 455 GLY 455 433 ? ? ? F . n C 3 456 GLY 456 434 ? ? ? F . n C 3 457 SER 457 435 ? ? ? F . n C 3 458 GLY 458 436 ? ? ? F . n C 3 459 GLY 459 437 ? ? ? F . n C 3 460 GLY 460 438 ? ? ? F . n C 3 461 SER 461 439 ? ? ? F . n C 3 462 GLY 462 440 ? ? ? F . n C 3 463 GLY 463 441 ? ? ? F . n C 3 464 GLY 464 442 ? ? ? F . n C 3 465 SER 465 443 ? ? ? F . n C 3 466 TRP 466 444 ? ? ? F . n C 3 467 SER 467 445 ? ? ? F . n C 3 468 HIS 468 446 ? ? ? F . n C 3 469 PRO 469 447 ? ? ? F . n C 3 470 GLN 470 448 ? ? ? F . n C 3 471 PHE 471 449 ? ? ? F . n C 3 472 GLU 472 450 ? ? ? F . n C 3 473 LYS 473 451 ? ? ? F . n # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 C ASN 163 F ASN 141 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 263 B ASN 263 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details trimeric _pdbx_struct_assembly.oligomeric_count 3 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 7690 ? 1 MORE -21 ? 1 'SSA (A^2)' 37660 ? # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _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 2010-12-01 2 'Structure model' 1 1 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Version format compliance' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] 'X-RAY DIFFRACTION' 1 ? refined -56.6176 -12.9749 -35.3159 -0.0395 0.0222 0.1451 0.0195 -0.0632 -0.0213 1.2512 1.6013 0.0000 -0.7056 0.1427 -0.2701 -0.0009 -0.0050 0.0059 0.0098 0.0330 0.0402 -0.0057 -0.0343 -0.0199 'X-RAY DIFFRACTION' 2 ? refined -36.0388 -15.8476 -17.4125 0.0705 -0.1991 -0.0259 -0.0272 0.1492 -0.0639 2.4475 5.8540 0.7329 2.8389 0.6951 1.4790 -0.0155 -0.0617 0.0772 -0.0244 0.0168 0.1307 0.3762 0.0299 -0.1015 'X-RAY DIFFRACTION' 3 ? refined -50.1963 -45.5195 -31.6189 -0.0193 0.0258 0.0503 -0.1106 0.0647 0.0071 4.7207 0.6878 2.1543 0.0425 -1.0363 0.4078 -0.0004 0.0098 -0.0095 0.0315 -0.0942 -0.0186 -0.0514 0.1294 0.0091 'X-RAY DIFFRACTION' 4 ? refined -3.5067 13.0088 -9.1447 0.0037 -0.0478 -0.0079 -0.0825 -0.1399 -0.0366 3.9550 1.3193 3.5027 -1.3893 2.8998 2.2324 -0.0065 -0.0067 0.0132 -0.1200 -0.0005 -0.0478 0.1034 -0.0105 0.0704 'X-RAY DIFFRACTION' 5 ? refined -12.7721 36.0262 -28.0040 -0.0349 0.0091 0.0516 -0.0455 -0.0573 0.0193 1.1907 2.3282 1.1425 1.5837 -0.0788 -0.4812 -0.0009 -0.0145 0.0154 -0.0174 -0.0146 0.0322 -0.0443 0.0589 0.0042 'X-RAY DIFFRACTION' 6 ? refined -18.1891 1.3197 -33.6945 -0.1014 -0.0492 0.0708 0.0078 -0.0941 0.0237 2.3997 5.1903 3.7829 1.9330 -0.8171 2.2726 0.0076 -0.0337 0.0261 0.0344 -0.0272 -0.0719 -0.0537 -0.0544 -0.0097 'X-RAY DIFFRACTION' 7 ? refined -30.2185 -29.0831 -36.5390 -0.0267 0.0323 -0.0297 0.0127 0.0113 -0.0279 1.9558 3.5035 0.8761 -0.5215 1.4665 1.8386 0.0056 -0.0079 0.0024 -0.0397 -0.0598 0.0536 -0.0297 0.0558 -0.0090 'X-RAY DIFFRACTION' 8 ? refined -14.5514 59.9645 -26.5908 -0.0033 0.0150 -0.0136 0.0072 -0.0101 -0.0205 0.0000 0.0000 0.0000 -0.1013 0.1872 0.0311 -0.0018 -0.0048 0.0066 -0.0144 0.0145 0.0011 0.0115 -0.0137 0.0018 'X-RAY DIFFRACTION' 9 ? refined -1.9377 48.9606 -9.1154 0.0986 -0.0740 -0.1196 -0.0791 -0.1466 -0.0282 1.5410 0.9723 7.7003 2.0436 2.3410 -0.8683 -0.0032 -0.0162 0.0194 -0.0151 0.0187 -0.0010 0.0320 -0.1250 0.0405 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection_details _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection 'X-RAY DIFFRACTION' 1 1 ? ? ? ? '{A|7:58}' ? ? ? ? ? 'X-RAY DIFFRACTION' 2 2 ? ? ? ? '{B|5:169 233:268}' ? ? ? ? ? 'X-RAY DIFFRACTION' 3 3 ? ? ? ? '{B|170:232}' ? ? ? ? ? 'X-RAY DIFFRACTION' 4 4 ? ? ? ? '{B|269:342}' ? ? ? ? ? 'X-RAY DIFFRACTION' 5 5 ? ? ? ? '{F|-1-39 127:171 255:281}' ? ? ? ? ? 'X-RAY DIFFRACTION' 6 6 ? ? ? ? '{F|40:51 111:126 172:216 238:254}' ? ? ? ? ? 'X-RAY DIFFRACTION' 7 7 ? ? ? ? '{F|52:110 217:237}' ? ? ? ? ? 'X-RAY DIFFRACTION' 8 8 ? ? ? ? '{F|282:293}' ? ? ? ? ? 'X-RAY DIFFRACTION' 9 9 ? ? ? ? '{F|294:393}' ? ? ? ? ? # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal DNA 'data collection' . ? 1 PHASER phasing . ? 2 BUSTER refinement 2.9.3 ? 3 XDS 'data reduction' . ? 4 SCALA 'data scaling' . ? 5 # _pdbx_entry_details.entry_id 3N42 _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details 'THE RESIDUES ARE PART OF THE LINKER BETWEEN P AND F CHAINS. LINKER WAS CLEAVED BY CHYMOTRYPSIN BEFORE CRYSTALLIZATION.' _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 ALA A 11 ? ? 55.18 -77.10 2 1 ASN A 12 ? ? -143.48 27.82 3 1 THR A 14 ? ? 69.91 117.31 4 1 CYS A 57 ? ? -172.77 144.57 5 1 PHE B 6 ? ? 39.76 105.07 6 1 ASP B 60 ? ? 79.30 -11.88 7 1 ASN B 72 ? ? 35.57 73.54 8 1 HIS B 73 ? ? 94.16 -35.26 9 1 THR B 87 ? ? -112.38 -94.60 10 1 MET B 97 ? ? -164.44 117.04 11 1 ASP B 117 ? ? -83.28 -158.59 12 1 LYS B 120 ? ? 56.80 13.70 13 1 ASP B 132 ? ? -156.79 82.27 14 1 ALA B 161 ? ? -28.50 128.87 15 1 THR B 164 ? ? 58.22 -89.44 16 1 SER B 185 ? ? 81.24 -35.26 17 1 ASN B 187 ? ? -122.05 -167.57 18 1 ASN B 202 ? ? -88.57 47.11 19 1 ASN B 207 ? ? -147.65 13.27 20 1 ASN B 231 ? ? -109.32 78.38 21 1 ASN B 238 ? ? -68.93 74.87 22 1 GLU B 247 ? ? -91.32 34.18 23 1 ASP B 250 ? ? -96.31 41.13 24 1 MET B 300 ? ? -92.54 39.42 25 1 GLU F 99 ? ? -79.03 26.98 26 1 HIS F 125 ? ? -121.71 -129.27 27 1 LYS F 181 ? ? 54.26 -107.08 28 1 PRO F 191 ? ? -55.71 -174.15 29 1 ALA F 194 ? ? -148.21 35.70 30 1 SER F 210 ? ? -52.10 -178.57 31 1 GLU F 246 ? ? -96.60 39.71 32 1 ASN F 349 ? ? -96.24 51.21 33 1 CYS F 370 ? ? 65.23 -112.35 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A MET 0 ? A MET 1 2 1 Y 1 A SER 1 ? A SER 2 3 1 Y 1 A LEU 2 ? A LEU 3 4 1 Y 1 A ALA 3 ? A ALA 4 5 1 Y 1 A ILE 4 ? A ILE 5 6 1 Y 1 A PRO 5 ? A PRO 6 7 1 Y 1 A VAL 6 ? A VAL 7 8 1 Y 1 A PRO 59 ? A PRO 60 9 1 Y 1 A HIS 60 ? A HIS 61 10 1 Y 1 A ARG 61 ? A ARG 62 11 1 Y 1 A GLN 62 ? A GLN 63 12 1 Y 1 A ARG 63 ? A ARG 64 13 1 Y 1 A ARG 64 ? A ARG 65 14 1 Y 1 B SER 1 ? B SER 1 15 1 Y 1 B THR 2 ? B THR 2 16 1 Y 1 B LYS 3 ? B LYS 3 17 1 Y 1 B ASP 4 ? B ASP 4 18 1 Y 1 B SER 343 ? B SER 343 19 1 Y 1 B THR 344 ? B THR 344 20 1 Y 1 B ASN 345 ? B ASN 345 21 1 Y 1 B GLY 346 ? B GLY 346 22 1 Y 1 B THR 347 ? B THR 347 23 1 Y 1 B ALA 348 ? B ALA 348 24 1 Y 1 B HIS 349 ? B HIS 349 25 1 Y 1 B GLY 350 ? B GLY 350 26 1 Y 1 B HIS 351 ? B HIS 351 27 1 Y 1 B PRO 352 ? B PRO 352 28 1 Y 1 B HIS 353 ? B HIS 353 29 1 Y 1 B GLU 354 ? B GLU 354 30 1 Y 1 B ILE 355 ? B ILE 355 31 1 Y 1 B ILE 356 ? B ILE 356 32 1 Y 1 B LEU 357 ? B LEU 357 33 1 Y 1 B TYR 358 ? B TYR 358 34 1 Y 1 B TYR 359 ? B TYR 359 35 1 Y 1 B TYR 360 ? B TYR 360 36 1 Y 1 F GLU -21 ? C GLU 1 37 1 Y 1 F LEU -20 ? C LEU 2 38 1 Y 1 F TYR -19 ? C TYR 3 39 1 Y 1 F GLY -18 ? C GLY 4 40 1 Y 1 F GLY -17 ? C GLY 5 41 1 Y 1 F GLY -16 ? C GLY 6 42 1 Y 1 F GLY -15 ? C GLY 7 43 1 Y 1 F SER -14 ? C SER 8 44 1 Y 1 F GLY -13 ? C GLY 9 45 1 Y 1 F GLY -12 ? C GLY 10 46 1 Y 1 F GLY -11 ? C GLY 11 47 1 Y 1 F GLY -10 ? C GLY 12 48 1 Y 1 F SER -9 ? C SER 13 49 1 Y 1 F GLY -8 ? C GLY 14 50 1 Y 1 F GLY -7 ? C GLY 15 51 1 Y 1 F GLY -6 ? C GLY 16 52 1 Y 1 F GLY -5 ? C GLY 17 53 1 Y 1 F SER -4 ? C SER 18 54 1 Y 1 F GLY -3 ? C GLY 19 55 1 Y 1 F GLY -2 ? C GLY 20 56 1 Y 1 F HIS 394 ? C HIS 416 57 1 Y 1 F THR 395 ? C THR 417 58 1 Y 1 F THR 396 ? C THR 418 59 1 Y 1 F LEU 397 ? C LEU 419 60 1 Y 1 F GLY 398 ? C GLY 420 61 1 Y 1 F VAL 399 ? C VAL 421 62 1 Y 1 F GLN 400 ? C GLN 422 63 1 Y 1 F ASP 401 ? C ASP 423 64 1 Y 1 F ILE 402 ? C ILE 424 65 1 Y 1 F SER 403 ? C SER 425 66 1 Y 1 F ALA 404 ? C ALA 426 67 1 Y 1 F THR 405 ? C THR 427 68 1 Y 1 F ALA 406 ? C ALA 428 69 1 Y 1 F MET 407 ? C MET 429 70 1 Y 1 F SER 408 ? C SER 430 71 1 Y 1 F TRP 409 ? C TRP 431 72 1 Y 1 F VAL 410 ? C VAL 432 73 1 Y 1 F GLN 411 ? C GLN 433 74 1 Y 1 F LYS 412 ? C LYS 434 75 1 Y 1 F GLY 413 ? C GLY 435 76 1 Y 1 F PRO 414 ? C PRO 436 77 1 Y 1 F PHE 415 ? C PHE 437 78 1 Y 1 F GLU 416 ? C GLU 438 79 1 Y 1 F ASP 417 ? C ASP 439 80 1 Y 1 F ASP 418 ? C ASP 440 81 1 Y 1 F ASP 419 ? C ASP 441 82 1 Y 1 F ASP 420 ? C ASP 442 83 1 Y 1 F LYS 421 ? C LYS 443 84 1 Y 1 F ALA 422 ? C ALA 444 85 1 Y 1 F GLY 423 ? C GLY 445 86 1 Y 1 F TRP 424 ? C TRP 446 87 1 Y 1 F SER 425 ? C SER 447 88 1 Y 1 F HIS 426 ? C HIS 448 89 1 Y 1 F PRO 427 ? C PRO 449 90 1 Y 1 F GLN 428 ? C GLN 450 91 1 Y 1 F PHE 429 ? C PHE 451 92 1 Y 1 F GLU 430 ? C GLU 452 93 1 Y 1 F LYS 431 ? C LYS 453 94 1 Y 1 F GLY 432 ? C GLY 454 95 1 Y 1 F GLY 433 ? C GLY 455 96 1 Y 1 F GLY 434 ? C GLY 456 97 1 Y 1 F SER 435 ? C SER 457 98 1 Y 1 F GLY 436 ? C GLY 458 99 1 Y 1 F GLY 437 ? C GLY 459 100 1 Y 1 F GLY 438 ? C GLY 460 101 1 Y 1 F SER 439 ? C SER 461 102 1 Y 1 F GLY 440 ? C GLY 462 103 1 Y 1 F GLY 441 ? C GLY 463 104 1 Y 1 F GLY 442 ? C GLY 464 105 1 Y 1 F SER 443 ? C SER 465 106 1 Y 1 F TRP 444 ? C TRP 466 107 1 Y 1 F SER 445 ? C SER 467 108 1 Y 1 F HIS 446 ? C HIS 468 109 1 Y 1 F PRO 447 ? C PRO 469 110 1 Y 1 F GLN 448 ? C GLN 470 111 1 Y 1 F PHE 449 ? C PHE 471 112 1 Y 1 F GLU 450 ? C GLU 472 113 1 Y 1 F LYS 451 ? C LYS 473 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 4 N-ACETYL-D-GLUCOSAMINE NAG 5 '2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE' NDG 6 water HOH # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code D 4 NAG 1 1001 1001 NAG NAG B . E 4 NAG 1 1001 1001 NAG NAG F . F 5 NDG 2 1002 1002 NDG NDG F . G 6 HOH 1 361 343 HOH HOH B . G 6 HOH 2 362 344 HOH HOH B . G 6 HOH 3 363 345 HOH HOH B . G 6 HOH 4 364 346 HOH HOH B . G 6 HOH 5 365 347 HOH HOH B . G 6 HOH 6 366 348 HOH HOH B . G 6 HOH 7 367 349 HOH HOH B . G 6 HOH 8 368 350 HOH HOH B . G 6 HOH 9 369 351 HOH HOH B . G 6 HOH 10 370 352 HOH HOH B . G 6 HOH 11 390 390 HOH HOH B . G 6 HOH 12 425 425 HOH HOH B . G 6 HOH 13 507 507 HOH HOH B . G 6 HOH 14 530 530 HOH HOH B . G 6 HOH 15 532 532 HOH HOH B . G 6 HOH 16 534 534 HOH HOH B . G 6 HOH 17 538 538 HOH HOH B . G 6 HOH 18 551 551 HOH HOH B . G 6 HOH 19 552 552 HOH HOH B . G 6 HOH 20 553 553 HOH HOH B . G 6 HOH 21 555 555 HOH HOH B . G 6 HOH 22 561 561 HOH HOH B . G 6 HOH 23 562 562 HOH HOH B . G 6 HOH 24 564 564 HOH HOH B . G 6 HOH 25 570 570 HOH HOH B . G 6 HOH 26 576 576 HOH HOH B . H 6 HOH 1 452 394 HOH HOH F . H 6 HOH 2 453 395 HOH HOH F . H 6 HOH 3 454 396 HOH HOH F . H 6 HOH 4 455 397 HOH HOH F . H 6 HOH 5 456 398 HOH HOH F . H 6 HOH 6 457 399 HOH HOH F . H 6 HOH 7 458 400 HOH HOH F . H 6 HOH 8 459 401 HOH HOH F . H 6 HOH 9 460 402 HOH HOH F . H 6 HOH 10 461 403 HOH HOH F . H 6 HOH 11 462 404 HOH HOH F . H 6 HOH 12 463 405 HOH HOH F . H 6 HOH 13 464 406 HOH HOH F . H 6 HOH 14 465 407 HOH HOH F . H 6 HOH 15 466 408 HOH HOH F . H 6 HOH 16 467 409 HOH HOH F . H 6 HOH 17 468 410 HOH HOH F . H 6 HOH 18 469 414 HOH HOH F . H 6 HOH 19 470 421 HOH HOH F . H 6 HOH 20 496 496 HOH HOH F . H 6 HOH 21 504 504 HOH HOH F . H 6 HOH 22 505 505 HOH HOH F . H 6 HOH 23 506 506 HOH HOH F . H 6 HOH 24 510 510 HOH HOH F . H 6 HOH 25 511 511 HOH HOH F . H 6 HOH 26 512 512 HOH HOH F . H 6 HOH 27 513 513 HOH HOH F . H 6 HOH 28 514 514 HOH HOH F . H 6 HOH 29 515 515 HOH HOH F . H 6 HOH 30 516 516 HOH HOH F . H 6 HOH 31 517 517 HOH HOH F . H 6 HOH 32 518 518 HOH HOH F . H 6 HOH 33 519 519 HOH HOH F . H 6 HOH 34 520 520 HOH HOH F . H 6 HOH 35 521 521 HOH HOH F . H 6 HOH 36 522 522 HOH HOH F . H 6 HOH 37 523 523 HOH HOH F . H 6 HOH 38 524 524 HOH HOH F . H 6 HOH 39 525 525 HOH HOH F . H 6 HOH 40 526 526 HOH HOH F . H 6 HOH 41 527 527 HOH HOH F . H 6 HOH 42 529 529 HOH HOH F . H 6 HOH 43 536 536 HOH HOH F . H 6 HOH 44 537 537 HOH HOH F . H 6 HOH 45 542 542 HOH HOH F . H 6 HOH 46 545 545 HOH HOH F . H 6 HOH 47 546 546 HOH HOH F . H 6 HOH 48 547 547 HOH HOH F . H 6 HOH 49 549 549 HOH HOH F . H 6 HOH 50 557 557 HOH HOH F . H 6 HOH 51 559 559 HOH HOH F . H 6 HOH 52 563 563 HOH HOH F . H 6 HOH 53 565 565 HOH HOH F . H 6 HOH 54 567 567 HOH HOH F . H 6 HOH 55 568 568 HOH HOH F . H 6 HOH 56 569 569 HOH HOH F . H 6 HOH 57 571 571 HOH HOH F . H 6 HOH 58 572 572 HOH HOH F . H 6 HOH 59 573 573 HOH HOH F . H 6 HOH 60 574 574 HOH HOH F . H 6 HOH 61 575 575 HOH HOH F . H 6 HOH 62 577 577 HOH HOH F . #