data_27783 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27783 _Entry.Title ; Backbone 1H, 15N, 13C Chemical Shift Assignment of the Pr state of monomeric PAS-GAF-PHY from Deinococcus radiodurans ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-02-13 _Entry.Accession_date 2019-02-13 _Entry.Last_release_date 2019-02-13 _Entry.Original_release_date 2019-02-13 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Emil Gustavsson . . . . 27783 2 Linnea Isaksson . . . . 27783 3 Cecilia Persson . . . . 27783 4 Maxim Mayzel . . . . 27783 5 Ulrika Brath . . . . 27783 6 Lidija Vrhovac . . . . 27783 7 Janne Ihalainen . . . . 27783 8 Goran Karlsson . . . . 27783 9 Vladislav Orekhov . . . . 27783 10 Sebastian Westenhoff . . . . 27783 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27783 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 791 27783 '15N chemical shifts' 251 27783 '1H chemical shifts' 251 27783 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-04-04 2019-02-13 update BMRB 'update Polymer_type' 27783 1 . . 2019-12-10 2019-02-13 original author 'original release' 27783 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27784 'the Pfr state of monomeric PAS-GAF-PHY' 27783 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27783 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; A photoactivated soft-to-rigid transition in the bacteriophytochrome PHY tongue - a solution NMR study of a 57 kDa protein ; _Citation.Status 'in press' _Citation.Type journal _Citation.Journal_abbrev 'Biophys. J.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Emil Gustavsson . . . . 27783 1 2 Linnea Isaksson . . . . 27783 1 3 Cecilia Persson . . . . 27783 1 4 Maxim Mayzel . . . . 27783 1 5 Ulrika Brath . . . . 27783 1 6 Lidija Vrhovac . . . . 27783 1 7 Janne Ihalainen . . . . 27783 1 8 Goran Karlsson . . . . 27783 1 9 Vladislav Orekhov . . . . 27783 1 10 Sebastian Westenhoff . . . . 27783 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27783 _Assembly.ID 1 _Assembly.Name 'PAS-GAF-PHY monomer' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 57000 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 PAS-GAF-PHY 1 $Phytochrome A . yes native no no . . . 27783 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Phytochrome _Entity.Sf_category entity _Entity.Sf_framecode Phytochrome _Entity.Entry_ID 27783 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Phytochrome _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MSRDPLPFFPPLYLGGPEIT TENCEREPIHIPGSIQPHGA LLTADGHSGEVLQMSLNAAT FLGQEPTVLRGQTLAALLPE QWPALQAALPPGCPDALQYR ATLDWPAAGHLSLTVHRVGE LLILEFEPTEAWDSTGPHAL RNAMSALESAPNLRALAEVA TQTVRELTGFDRVMLYKFAP DATGEVIAEARREGLHAFLG HRFPASDIPAQARALYTRHL LRLTADTRAAAVPLDPVLNP QTNAPTPLGGAVLRATSPMH MQYLRNMGVGSSLSVSVVVG GQLWGLIACHHQTPYVLPPD LRTTLEYLGRELSEQVQVKE AADVAAFRQSLREHHARVAL AAAHSLSPHDTLSDPALDLL GLMRAGGLILRFEGRWQTLG EVPPAPAVDALLAWLETQPG ALVQTDALGQLWPAGADLAP SAAGLLAISVGEGWSECLVW LRPELRLEVAWGGATPDQAK DDLGPRHSFDTYLEEKRGYA EPWHPGEIEEAQDLRDTLTG ALEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 509 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and other bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 57000 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 27783 1 2 . SER . 27783 1 3 . ARG . 27783 1 4 . ASP . 27783 1 5 . PRO . 27783 1 6 . LEU . 27783 1 7 . PRO . 27783 1 8 . PHE . 27783 1 9 . PHE . 27783 1 10 . PRO . 27783 1 11 . PRO . 27783 1 12 . LEU . 27783 1 13 . TYR . 27783 1 14 . LEU . 27783 1 15 . GLY . 27783 1 16 . GLY . 27783 1 17 . PRO . 27783 1 18 . GLU . 27783 1 19 . ILE . 27783 1 20 . THR . 27783 1 21 . THR . 27783 1 22 . GLU . 27783 1 23 . ASN . 27783 1 24 . CYS . 27783 1 25 . GLU . 27783 1 26 . ARG . 27783 1 27 . GLU . 27783 1 28 . PRO . 27783 1 29 . ILE . 27783 1 30 . HIS . 27783 1 31 . ILE . 27783 1 32 . PRO . 27783 1 33 . GLY . 27783 1 34 . SER . 27783 1 35 . ILE . 27783 1 36 . GLN . 27783 1 37 . PRO . 27783 1 38 . HIS . 27783 1 39 . GLY . 27783 1 40 . ALA . 27783 1 41 . LEU . 27783 1 42 . LEU . 27783 1 43 . THR . 27783 1 44 . ALA . 27783 1 45 . ASP . 27783 1 46 . GLY . 27783 1 47 . HIS . 27783 1 48 . SER . 27783 1 49 . GLY . 27783 1 50 . GLU . 27783 1 51 . VAL . 27783 1 52 . LEU . 27783 1 53 . GLN . 27783 1 54 . MET . 27783 1 55 . SER . 27783 1 56 . LEU . 27783 1 57 . ASN . 27783 1 58 . ALA . 27783 1 59 . ALA . 27783 1 60 . THR . 27783 1 61 . PHE . 27783 1 62 . LEU . 27783 1 63 . GLY . 27783 1 64 . GLN . 27783 1 65 . GLU . 27783 1 66 . PRO . 27783 1 67 . THR . 27783 1 68 . VAL . 27783 1 69 . LEU . 27783 1 70 . ARG . 27783 1 71 . GLY . 27783 1 72 . GLN . 27783 1 73 . THR . 27783 1 74 . LEU . 27783 1 75 . ALA . 27783 1 76 . ALA . 27783 1 77 . LEU . 27783 1 78 . LEU . 27783 1 79 . PRO . 27783 1 80 . GLU . 27783 1 81 . GLN . 27783 1 82 . TRP . 27783 1 83 . PRO . 27783 1 84 . ALA . 27783 1 85 . LEU . 27783 1 86 . GLN . 27783 1 87 . ALA . 27783 1 88 . ALA . 27783 1 89 . LEU . 27783 1 90 . PRO . 27783 1 91 . PRO . 27783 1 92 . GLY . 27783 1 93 . CYS . 27783 1 94 . PRO . 27783 1 95 . ASP . 27783 1 96 . ALA . 27783 1 97 . LEU . 27783 1 98 . GLN . 27783 1 99 . TYR . 27783 1 100 . ARG . 27783 1 101 . ALA . 27783 1 102 . THR . 27783 1 103 . LEU . 27783 1 104 . ASP . 27783 1 105 . TRP . 27783 1 106 . PRO . 27783 1 107 . ALA . 27783 1 108 . ALA . 27783 1 109 . GLY . 27783 1 110 . HIS . 27783 1 111 . LEU . 27783 1 112 . SER . 27783 1 113 . LEU . 27783 1 114 . THR . 27783 1 115 . VAL . 27783 1 116 . HIS . 27783 1 117 . ARG . 27783 1 118 . VAL . 27783 1 119 . GLY . 27783 1 120 . GLU . 27783 1 121 . LEU . 27783 1 122 . LEU . 27783 1 123 . ILE . 27783 1 124 . LEU . 27783 1 125 . GLU . 27783 1 126 . PHE . 27783 1 127 . GLU . 27783 1 128 . PRO . 27783 1 129 . THR . 27783 1 130 . GLU . 27783 1 131 . ALA . 27783 1 132 . TRP . 27783 1 133 . ASP . 27783 1 134 . SER . 27783 1 135 . THR . 27783 1 136 . GLY . 27783 1 137 . PRO . 27783 1 138 . HIS . 27783 1 139 . ALA . 27783 1 140 . LEU . 27783 1 141 . ARG . 27783 1 142 . ASN . 27783 1 143 . ALA . 27783 1 144 . MET . 27783 1 145 . SER . 27783 1 146 . ALA . 27783 1 147 . LEU . 27783 1 148 . GLU . 27783 1 149 . SER . 27783 1 150 . ALA . 27783 1 151 . PRO . 27783 1 152 . ASN . 27783 1 153 . LEU . 27783 1 154 . ARG . 27783 1 155 . ALA . 27783 1 156 . LEU . 27783 1 157 . ALA . 27783 1 158 . GLU . 27783 1 159 . VAL . 27783 1 160 . ALA . 27783 1 161 . THR . 27783 1 162 . GLN . 27783 1 163 . THR . 27783 1 164 . VAL . 27783 1 165 . ARG . 27783 1 166 . GLU . 27783 1 167 . LEU . 27783 1 168 . THR . 27783 1 169 . GLY . 27783 1 170 . PHE . 27783 1 171 . ASP . 27783 1 172 . ARG . 27783 1 173 . VAL . 27783 1 174 . MET . 27783 1 175 . LEU . 27783 1 176 . TYR . 27783 1 177 . LYS . 27783 1 178 . PHE . 27783 1 179 . ALA . 27783 1 180 . PRO . 27783 1 181 . ASP . 27783 1 182 . ALA . 27783 1 183 . THR . 27783 1 184 . GLY . 27783 1 185 . GLU . 27783 1 186 . VAL . 27783 1 187 . ILE . 27783 1 188 . ALA . 27783 1 189 . GLU . 27783 1 190 . ALA . 27783 1 191 . ARG . 27783 1 192 . ARG . 27783 1 193 . GLU . 27783 1 194 . GLY . 27783 1 195 . LEU . 27783 1 196 . HIS . 27783 1 197 . ALA . 27783 1 198 . PHE . 27783 1 199 . LEU . 27783 1 200 . GLY . 27783 1 201 . HIS . 27783 1 202 . ARG . 27783 1 203 . PHE . 27783 1 204 . PRO . 27783 1 205 . ALA . 27783 1 206 . SER . 27783 1 207 . ASP . 27783 1 208 . ILE . 27783 1 209 . PRO . 27783 1 210 . ALA . 27783 1 211 . GLN . 27783 1 212 . ALA . 27783 1 213 . ARG . 27783 1 214 . ALA . 27783 1 215 . LEU . 27783 1 216 . TYR . 27783 1 217 . THR . 27783 1 218 . ARG . 27783 1 219 . HIS . 27783 1 220 . LEU . 27783 1 221 . LEU . 27783 1 222 . ARG . 27783 1 223 . LEU . 27783 1 224 . THR . 27783 1 225 . ALA . 27783 1 226 . ASP . 27783 1 227 . THR . 27783 1 228 . ARG . 27783 1 229 . ALA . 27783 1 230 . ALA . 27783 1 231 . ALA . 27783 1 232 . VAL . 27783 1 233 . PRO . 27783 1 234 . LEU . 27783 1 235 . ASP . 27783 1 236 . PRO . 27783 1 237 . VAL . 27783 1 238 . LEU . 27783 1 239 . ASN . 27783 1 240 . PRO . 27783 1 241 . GLN . 27783 1 242 . THR . 27783 1 243 . ASN . 27783 1 244 . ALA . 27783 1 245 . PRO . 27783 1 246 . THR . 27783 1 247 . PRO . 27783 1 248 . LEU . 27783 1 249 . GLY . 27783 1 250 . GLY . 27783 1 251 . ALA . 27783 1 252 . VAL . 27783 1 253 . LEU . 27783 1 254 . ARG . 27783 1 255 . ALA . 27783 1 256 . THR . 27783 1 257 . SER . 27783 1 258 . PRO . 27783 1 259 . MET . 27783 1 260 . HIS . 27783 1 261 . MET . 27783 1 262 . GLN . 27783 1 263 . TYR . 27783 1 264 . LEU . 27783 1 265 . ARG . 27783 1 266 . ASN . 27783 1 267 . MET . 27783 1 268 . GLY . 27783 1 269 . VAL . 27783 1 270 . GLY . 27783 1 271 . SER . 27783 1 272 . SER . 27783 1 273 . LEU . 27783 1 274 . SER . 27783 1 275 . VAL . 27783 1 276 . SER . 27783 1 277 . VAL . 27783 1 278 . VAL . 27783 1 279 . VAL . 27783 1 280 . GLY . 27783 1 281 . GLY . 27783 1 282 . GLN . 27783 1 283 . LEU . 27783 1 284 . TRP . 27783 1 285 . GLY . 27783 1 286 . LEU . 27783 1 287 . ILE . 27783 1 288 . ALA . 27783 1 289 . CYS . 27783 1 290 . HIS . 27783 1 291 . HIS . 27783 1 292 . GLN . 27783 1 293 . THR . 27783 1 294 . PRO . 27783 1 295 . TYR . 27783 1 296 . VAL . 27783 1 297 . LEU . 27783 1 298 . PRO . 27783 1 299 . PRO . 27783 1 300 . ASP . 27783 1 301 . LEU . 27783 1 302 . ARG . 27783 1 303 . THR . 27783 1 304 . THR . 27783 1 305 . LEU . 27783 1 306 . GLU . 27783 1 307 . TYR . 27783 1 308 . LEU . 27783 1 309 . GLY . 27783 1 310 . ARG . 27783 1 311 . GLU . 27783 1 312 . LEU . 27783 1 313 . SER . 27783 1 314 . GLU . 27783 1 315 . GLN . 27783 1 316 . VAL . 27783 1 317 . GLN . 27783 1 318 . VAL . 27783 1 319 . LYS . 27783 1 320 . GLU . 27783 1 321 . ALA . 27783 1 322 . ALA . 27783 1 323 . ASP . 27783 1 324 . VAL . 27783 1 325 . ALA . 27783 1 326 . ALA . 27783 1 327 . PHE . 27783 1 328 . ARG . 27783 1 329 . GLN . 27783 1 330 . SER . 27783 1 331 . LEU . 27783 1 332 . ARG . 27783 1 333 . GLU . 27783 1 334 . HIS . 27783 1 335 . HIS . 27783 1 336 . ALA . 27783 1 337 . ARG . 27783 1 338 . VAL . 27783 1 339 . ALA . 27783 1 340 . LEU . 27783 1 341 . ALA . 27783 1 342 . ALA . 27783 1 343 . ALA . 27783 1 344 . HIS . 27783 1 345 . SER . 27783 1 346 . LEU . 27783 1 347 . SER . 27783 1 348 . PRO . 27783 1 349 . HIS . 27783 1 350 . ASP . 27783 1 351 . THR . 27783 1 352 . LEU . 27783 1 353 . SER . 27783 1 354 . ASP . 27783 1 355 . PRO . 27783 1 356 . ALA . 27783 1 357 . LEU . 27783 1 358 . ASP . 27783 1 359 . LEU . 27783 1 360 . LEU . 27783 1 361 . GLY . 27783 1 362 . LEU . 27783 1 363 . MET . 27783 1 364 . ARG . 27783 1 365 . ALA . 27783 1 366 . GLY . 27783 1 367 . GLY . 27783 1 368 . LEU . 27783 1 369 . ILE . 27783 1 370 . LEU . 27783 1 371 . ARG . 27783 1 372 . PHE . 27783 1 373 . GLU . 27783 1 374 . GLY . 27783 1 375 . ARG . 27783 1 376 . TRP . 27783 1 377 . GLN . 27783 1 378 . THR . 27783 1 379 . LEU . 27783 1 380 . GLY . 27783 1 381 . GLU . 27783 1 382 . VAL . 27783 1 383 . PRO . 27783 1 384 . PRO . 27783 1 385 . ALA . 27783 1 386 . PRO . 27783 1 387 . ALA . 27783 1 388 . VAL . 27783 1 389 . ASP . 27783 1 390 . ALA . 27783 1 391 . LEU . 27783 1 392 . LEU . 27783 1 393 . ALA . 27783 1 394 . TRP . 27783 1 395 . LEU . 27783 1 396 . GLU . 27783 1 397 . THR . 27783 1 398 . GLN . 27783 1 399 . PRO . 27783 1 400 . GLY . 27783 1 401 . ALA . 27783 1 402 . LEU . 27783 1 403 . VAL . 27783 1 404 . GLN . 27783 1 405 . THR . 27783 1 406 . ASP . 27783 1 407 . ALA . 27783 1 408 . LEU . 27783 1 409 . GLY . 27783 1 410 . GLN . 27783 1 411 . LEU . 27783 1 412 . TRP . 27783 1 413 . PRO . 27783 1 414 . ALA . 27783 1 415 . GLY . 27783 1 416 . ALA . 27783 1 417 . ASP . 27783 1 418 . LEU . 27783 1 419 . ALA . 27783 1 420 . PRO . 27783 1 421 . SER . 27783 1 422 . ALA . 27783 1 423 . ALA . 27783 1 424 . GLY . 27783 1 425 . LEU . 27783 1 426 . LEU . 27783 1 427 . ALA . 27783 1 428 . ILE . 27783 1 429 . SER . 27783 1 430 . VAL . 27783 1 431 . GLY . 27783 1 432 . GLU . 27783 1 433 . GLY . 27783 1 434 . TRP . 27783 1 435 . SER . 27783 1 436 . GLU . 27783 1 437 . CYS . 27783 1 438 . LEU . 27783 1 439 . VAL . 27783 1 440 . TRP . 27783 1 441 . LEU . 27783 1 442 . ARG . 27783 1 443 . PRO . 27783 1 444 . GLU . 27783 1 445 . LEU . 27783 1 446 . ARG . 27783 1 447 . LEU . 27783 1 448 . GLU . 27783 1 449 . VAL . 27783 1 450 . ALA . 27783 1 451 . TRP . 27783 1 452 . GLY . 27783 1 453 . GLY . 27783 1 454 . ALA . 27783 1 455 . THR . 27783 1 456 . PRO . 27783 1 457 . ASP . 27783 1 458 . GLN . 27783 1 459 . ALA . 27783 1 460 . LYS . 27783 1 461 . ASP . 27783 1 462 . ASP . 27783 1 463 . LEU . 27783 1 464 . GLY . 27783 1 465 . PRO . 27783 1 466 . ARG . 27783 1 467 . HIS . 27783 1 468 . SER . 27783 1 469 . PHE . 27783 1 470 . ASP . 27783 1 471 . THR . 27783 1 472 . TYR . 27783 1 473 . LEU . 27783 1 474 . GLU . 27783 1 475 . GLU . 27783 1 476 . LYS . 27783 1 477 . ARG . 27783 1 478 . GLY . 27783 1 479 . TYR . 27783 1 480 . ALA . 27783 1 481 . GLU . 27783 1 482 . PRO . 27783 1 483 . TRP . 27783 1 484 . HIS . 27783 1 485 . PRO . 27783 1 486 . GLY . 27783 1 487 . GLU . 27783 1 488 . ILE . 27783 1 489 . GLU . 27783 1 490 . GLU . 27783 1 491 . ALA . 27783 1 492 . GLN . 27783 1 493 . ASP . 27783 1 494 . LEU . 27783 1 495 . ARG . 27783 1 496 . ASP . 27783 1 497 . THR . 27783 1 498 . LEU . 27783 1 499 . THR . 27783 1 500 . GLY . 27783 1 501 . ALA . 27783 1 502 . LEU . 27783 1 503 . GLU . 27783 1 504 . HIS . 27783 1 505 . HIS . 27783 1 506 . HIS . 27783 1 507 . HIS . 27783 1 508 . HIS . 27783 1 509 . HIS . 27783 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 27783 1 . SER 2 2 27783 1 . ARG 3 3 27783 1 . ASP 4 4 27783 1 . PRO 5 5 27783 1 . LEU 6 6 27783 1 . PRO 7 7 27783 1 . PHE 8 8 27783 1 . PHE 9 9 27783 1 . PRO 10 10 27783 1 . PRO 11 11 27783 1 . LEU 12 12 27783 1 . TYR 13 13 27783 1 . LEU 14 14 27783 1 . GLY 15 15 27783 1 . GLY 16 16 27783 1 . PRO 17 17 27783 1 . GLU 18 18 27783 1 . ILE 19 19 27783 1 . THR 20 20 27783 1 . THR 21 21 27783 1 . GLU 22 22 27783 1 . ASN 23 23 27783 1 . CYS 24 24 27783 1 . GLU 25 25 27783 1 . ARG 26 26 27783 1 . GLU 27 27 27783 1 . PRO 28 28 27783 1 . ILE 29 29 27783 1 . HIS 30 30 27783 1 . ILE 31 31 27783 1 . PRO 32 32 27783 1 . GLY 33 33 27783 1 . SER 34 34 27783 1 . ILE 35 35 27783 1 . GLN 36 36 27783 1 . PRO 37 37 27783 1 . HIS 38 38 27783 1 . GLY 39 39 27783 1 . ALA 40 40 27783 1 . LEU 41 41 27783 1 . LEU 42 42 27783 1 . THR 43 43 27783 1 . ALA 44 44 27783 1 . ASP 45 45 27783 1 . GLY 46 46 27783 1 . HIS 47 47 27783 1 . SER 48 48 27783 1 . GLY 49 49 27783 1 . GLU 50 50 27783 1 . VAL 51 51 27783 1 . LEU 52 52 27783 1 . GLN 53 53 27783 1 . MET 54 54 27783 1 . SER 55 55 27783 1 . LEU 56 56 27783 1 . ASN 57 57 27783 1 . ALA 58 58 27783 1 . ALA 59 59 27783 1 . THR 60 60 27783 1 . PHE 61 61 27783 1 . LEU 62 62 27783 1 . GLY 63 63 27783 1 . GLN 64 64 27783 1 . GLU 65 65 27783 1 . PRO 66 66 27783 1 . THR 67 67 27783 1 . VAL 68 68 27783 1 . LEU 69 69 27783 1 . ARG 70 70 27783 1 . GLY 71 71 27783 1 . GLN 72 72 27783 1 . THR 73 73 27783 1 . LEU 74 74 27783 1 . ALA 75 75 27783 1 . ALA 76 76 27783 1 . LEU 77 77 27783 1 . LEU 78 78 27783 1 . PRO 79 79 27783 1 . GLU 80 80 27783 1 . GLN 81 81 27783 1 . TRP 82 82 27783 1 . PRO 83 83 27783 1 . ALA 84 84 27783 1 . LEU 85 85 27783 1 . GLN 86 86 27783 1 . ALA 87 87 27783 1 . ALA 88 88 27783 1 . LEU 89 89 27783 1 . PRO 90 90 27783 1 . PRO 91 91 27783 1 . GLY 92 92 27783 1 . CYS 93 93 27783 1 . PRO 94 94 27783 1 . ASP 95 95 27783 1 . ALA 96 96 27783 1 . LEU 97 97 27783 1 . GLN 98 98 27783 1 . TYR 99 99 27783 1 . ARG 100 100 27783 1 . ALA 101 101 27783 1 . THR 102 102 27783 1 . LEU 103 103 27783 1 . ASP 104 104 27783 1 . TRP 105 105 27783 1 . PRO 106 106 27783 1 . ALA 107 107 27783 1 . ALA 108 108 27783 1 . GLY 109 109 27783 1 . HIS 110 110 27783 1 . LEU 111 111 27783 1 . SER 112 112 27783 1 . LEU 113 113 27783 1 . THR 114 114 27783 1 . VAL 115 115 27783 1 . HIS 116 116 27783 1 . ARG 117 117 27783 1 . VAL 118 118 27783 1 . GLY 119 119 27783 1 . GLU 120 120 27783 1 . LEU 121 121 27783 1 . LEU 122 122 27783 1 . ILE 123 123 27783 1 . LEU 124 124 27783 1 . GLU 125 125 27783 1 . PHE 126 126 27783 1 . GLU 127 127 27783 1 . PRO 128 128 27783 1 . THR 129 129 27783 1 . GLU 130 130 27783 1 . ALA 131 131 27783 1 . TRP 132 132 27783 1 . ASP 133 133 27783 1 . SER 134 134 27783 1 . THR 135 135 27783 1 . GLY 136 136 27783 1 . PRO 137 137 27783 1 . HIS 138 138 27783 1 . ALA 139 139 27783 1 . LEU 140 140 27783 1 . ARG 141 141 27783 1 . ASN 142 142 27783 1 . ALA 143 143 27783 1 . MET 144 144 27783 1 . SER 145 145 27783 1 . ALA 146 146 27783 1 . LEU 147 147 27783 1 . GLU 148 148 27783 1 . SER 149 149 27783 1 . ALA 150 150 27783 1 . PRO 151 151 27783 1 . ASN 152 152 27783 1 . LEU 153 153 27783 1 . ARG 154 154 27783 1 . ALA 155 155 27783 1 . LEU 156 156 27783 1 . ALA 157 157 27783 1 . GLU 158 158 27783 1 . VAL 159 159 27783 1 . ALA 160 160 27783 1 . THR 161 161 27783 1 . GLN 162 162 27783 1 . THR 163 163 27783 1 . VAL 164 164 27783 1 . ARG 165 165 27783 1 . GLU 166 166 27783 1 . LEU 167 167 27783 1 . THR 168 168 27783 1 . GLY 169 169 27783 1 . PHE 170 170 27783 1 . ASP 171 171 27783 1 . ARG 172 172 27783 1 . VAL 173 173 27783 1 . MET 174 174 27783 1 . LEU 175 175 27783 1 . TYR 176 176 27783 1 . LYS 177 177 27783 1 . PHE 178 178 27783 1 . ALA 179 179 27783 1 . PRO 180 180 27783 1 . ASP 181 181 27783 1 . ALA 182 182 27783 1 . THR 183 183 27783 1 . GLY 184 184 27783 1 . GLU 185 185 27783 1 . VAL 186 186 27783 1 . ILE 187 187 27783 1 . ALA 188 188 27783 1 . GLU 189 189 27783 1 . ALA 190 190 27783 1 . ARG 191 191 27783 1 . ARG 192 192 27783 1 . GLU 193 193 27783 1 . GLY 194 194 27783 1 . LEU 195 195 27783 1 . HIS 196 196 27783 1 . ALA 197 197 27783 1 . PHE 198 198 27783 1 . LEU 199 199 27783 1 . GLY 200 200 27783 1 . HIS 201 201 27783 1 . ARG 202 202 27783 1 . PHE 203 203 27783 1 . PRO 204 204 27783 1 . ALA 205 205 27783 1 . SER 206 206 27783 1 . ASP 207 207 27783 1 . ILE 208 208 27783 1 . PRO 209 209 27783 1 . ALA 210 210 27783 1 . GLN 211 211 27783 1 . ALA 212 212 27783 1 . ARG 213 213 27783 1 . ALA 214 214 27783 1 . LEU 215 215 27783 1 . TYR 216 216 27783 1 . THR 217 217 27783 1 . ARG 218 218 27783 1 . HIS 219 219 27783 1 . LEU 220 220 27783 1 . LEU 221 221 27783 1 . ARG 222 222 27783 1 . LEU 223 223 27783 1 . THR 224 224 27783 1 . ALA 225 225 27783 1 . ASP 226 226 27783 1 . THR 227 227 27783 1 . ARG 228 228 27783 1 . ALA 229 229 27783 1 . ALA 230 230 27783 1 . ALA 231 231 27783 1 . VAL 232 232 27783 1 . PRO 233 233 27783 1 . LEU 234 234 27783 1 . ASP 235 235 27783 1 . PRO 236 236 27783 1 . VAL 237 237 27783 1 . LEU 238 238 27783 1 . ASN 239 239 27783 1 . PRO 240 240 27783 1 . GLN 241 241 27783 1 . THR 242 242 27783 1 . ASN 243 243 27783 1 . ALA 244 244 27783 1 . PRO 245 245 27783 1 . THR 246 246 27783 1 . PRO 247 247 27783 1 . LEU 248 248 27783 1 . GLY 249 249 27783 1 . GLY 250 250 27783 1 . ALA 251 251 27783 1 . VAL 252 252 27783 1 . LEU 253 253 27783 1 . ARG 254 254 27783 1 . ALA 255 255 27783 1 . THR 256 256 27783 1 . SER 257 257 27783 1 . PRO 258 258 27783 1 . MET 259 259 27783 1 . HIS 260 260 27783 1 . MET 261 261 27783 1 . GLN 262 262 27783 1 . TYR 263 263 27783 1 . LEU 264 264 27783 1 . ARG 265 265 27783 1 . ASN 266 266 27783 1 . MET 267 267 27783 1 . GLY 268 268 27783 1 . VAL 269 269 27783 1 . GLY 270 270 27783 1 . SER 271 271 27783 1 . SER 272 272 27783 1 . LEU 273 273 27783 1 . SER 274 274 27783 1 . VAL 275 275 27783 1 . SER 276 276 27783 1 . VAL 277 277 27783 1 . VAL 278 278 27783 1 . VAL 279 279 27783 1 . GLY 280 280 27783 1 . GLY 281 281 27783 1 . GLN 282 282 27783 1 . LEU 283 283 27783 1 . TRP 284 284 27783 1 . GLY 285 285 27783 1 . LEU 286 286 27783 1 . ILE 287 287 27783 1 . ALA 288 288 27783 1 . CYS 289 289 27783 1 . HIS 290 290 27783 1 . HIS 291 291 27783 1 . GLN 292 292 27783 1 . THR 293 293 27783 1 . PRO 294 294 27783 1 . TYR 295 295 27783 1 . VAL 296 296 27783 1 . LEU 297 297 27783 1 . PRO 298 298 27783 1 . PRO 299 299 27783 1 . ASP 300 300 27783 1 . LEU 301 301 27783 1 . ARG 302 302 27783 1 . THR 303 303 27783 1 . THR 304 304 27783 1 . LEU 305 305 27783 1 . GLU 306 306 27783 1 . TYR 307 307 27783 1 . LEU 308 308 27783 1 . GLY 309 309 27783 1 . ARG 310 310 27783 1 . GLU 311 311 27783 1 . LEU 312 312 27783 1 . SER 313 313 27783 1 . GLU 314 314 27783 1 . GLN 315 315 27783 1 . VAL 316 316 27783 1 . GLN 317 317 27783 1 . VAL 318 318 27783 1 . LYS 319 319 27783 1 . GLU 320 320 27783 1 . ALA 321 321 27783 1 . ALA 322 322 27783 1 . ASP 323 323 27783 1 . VAL 324 324 27783 1 . ALA 325 325 27783 1 . ALA 326 326 27783 1 . PHE 327 327 27783 1 . ARG 328 328 27783 1 . GLN 329 329 27783 1 . SER 330 330 27783 1 . LEU 331 331 27783 1 . ARG 332 332 27783 1 . GLU 333 333 27783 1 . HIS 334 334 27783 1 . HIS 335 335 27783 1 . ALA 336 336 27783 1 . ARG 337 337 27783 1 . VAL 338 338 27783 1 . ALA 339 339 27783 1 . LEU 340 340 27783 1 . ALA 341 341 27783 1 . ALA 342 342 27783 1 . ALA 343 343 27783 1 . HIS 344 344 27783 1 . SER 345 345 27783 1 . LEU 346 346 27783 1 . SER 347 347 27783 1 . PRO 348 348 27783 1 . HIS 349 349 27783 1 . ASP 350 350 27783 1 . THR 351 351 27783 1 . LEU 352 352 27783 1 . SER 353 353 27783 1 . ASP 354 354 27783 1 . PRO 355 355 27783 1 . ALA 356 356 27783 1 . LEU 357 357 27783 1 . ASP 358 358 27783 1 . LEU 359 359 27783 1 . LEU 360 360 27783 1 . GLY 361 361 27783 1 . LEU 362 362 27783 1 . MET 363 363 27783 1 . ARG 364 364 27783 1 . ALA 365 365 27783 1 . GLY 366 366 27783 1 . GLY 367 367 27783 1 . LEU 368 368 27783 1 . ILE 369 369 27783 1 . LEU 370 370 27783 1 . ARG 371 371 27783 1 . PHE 372 372 27783 1 . GLU 373 373 27783 1 . GLY 374 374 27783 1 . ARG 375 375 27783 1 . TRP 376 376 27783 1 . GLN 377 377 27783 1 . THR 378 378 27783 1 . LEU 379 379 27783 1 . GLY 380 380 27783 1 . GLU 381 381 27783 1 . VAL 382 382 27783 1 . PRO 383 383 27783 1 . PRO 384 384 27783 1 . ALA 385 385 27783 1 . PRO 386 386 27783 1 . ALA 387 387 27783 1 . VAL 388 388 27783 1 . ASP 389 389 27783 1 . ALA 390 390 27783 1 . LEU 391 391 27783 1 . LEU 392 392 27783 1 . ALA 393 393 27783 1 . TRP 394 394 27783 1 . LEU 395 395 27783 1 . GLU 396 396 27783 1 . THR 397 397 27783 1 . GLN 398 398 27783 1 . PRO 399 399 27783 1 . GLY 400 400 27783 1 . ALA 401 401 27783 1 . LEU 402 402 27783 1 . VAL 403 403 27783 1 . GLN 404 404 27783 1 . THR 405 405 27783 1 . ASP 406 406 27783 1 . ALA 407 407 27783 1 . LEU 408 408 27783 1 . GLY 409 409 27783 1 . GLN 410 410 27783 1 . LEU 411 411 27783 1 . TRP 412 412 27783 1 . PRO 413 413 27783 1 . ALA 414 414 27783 1 . GLY 415 415 27783 1 . ALA 416 416 27783 1 . ASP 417 417 27783 1 . LEU 418 418 27783 1 . ALA 419 419 27783 1 . PRO 420 420 27783 1 . SER 421 421 27783 1 . ALA 422 422 27783 1 . ALA 423 423 27783 1 . GLY 424 424 27783 1 . LEU 425 425 27783 1 . LEU 426 426 27783 1 . ALA 427 427 27783 1 . ILE 428 428 27783 1 . SER 429 429 27783 1 . VAL 430 430 27783 1 . GLY 431 431 27783 1 . GLU 432 432 27783 1 . GLY 433 433 27783 1 . TRP 434 434 27783 1 . SER 435 435 27783 1 . GLU 436 436 27783 1 . CYS 437 437 27783 1 . LEU 438 438 27783 1 . VAL 439 439 27783 1 . TRP 440 440 27783 1 . LEU 441 441 27783 1 . ARG 442 442 27783 1 . PRO 443 443 27783 1 . GLU 444 444 27783 1 . LEU 445 445 27783 1 . ARG 446 446 27783 1 . LEU 447 447 27783 1 . GLU 448 448 27783 1 . VAL 449 449 27783 1 . ALA 450 450 27783 1 . TRP 451 451 27783 1 . GLY 452 452 27783 1 . GLY 453 453 27783 1 . ALA 454 454 27783 1 . THR 455 455 27783 1 . PRO 456 456 27783 1 . ASP 457 457 27783 1 . GLN 458 458 27783 1 . ALA 459 459 27783 1 . LYS 460 460 27783 1 . ASP 461 461 27783 1 . ASP 462 462 27783 1 . LEU 463 463 27783 1 . GLY 464 464 27783 1 . PRO 465 465 27783 1 . ARG 466 466 27783 1 . HIS 467 467 27783 1 . SER 468 468 27783 1 . PHE 469 469 27783 1 . ASP 470 470 27783 1 . THR 471 471 27783 1 . TYR 472 472 27783 1 . LEU 473 473 27783 1 . GLU 474 474 27783 1 . GLU 475 475 27783 1 . LYS 476 476 27783 1 . ARG 477 477 27783 1 . GLY 478 478 27783 1 . TYR 479 479 27783 1 . ALA 480 480 27783 1 . GLU 481 481 27783 1 . PRO 482 482 27783 1 . TRP 483 483 27783 1 . HIS 484 484 27783 1 . PRO 485 485 27783 1 . GLY 486 486 27783 1 . GLU 487 487 27783 1 . ILE 488 488 27783 1 . GLU 489 489 27783 1 . GLU 490 490 27783 1 . ALA 491 491 27783 1 . GLN 492 492 27783 1 . ASP 493 493 27783 1 . LEU 494 494 27783 1 . ARG 495 495 27783 1 . ASP 496 496 27783 1 . THR 497 497 27783 1 . LEU 498 498 27783 1 . THR 499 499 27783 1 . GLY 500 500 27783 1 . ALA 501 501 27783 1 . LEU 502 502 27783 1 . GLU 503 503 27783 1 . HIS 504 504 27783 1 . HIS 505 505 27783 1 . HIS 506 506 27783 1 . HIS 507 507 27783 1 . HIS 508 508 27783 1 . HIS 509 509 27783 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 27783 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Phytochrome . 1299 organism . 'Deinococcus radiodurans' 'Deinococcus radiodurans' . . Bacteria . Deinococcus radiodurans . . . . . . . . . . . . . 27783 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 27783 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Phytochrome . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET21b . . . 27783 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Pr_state _Sample.Sf_category sample _Sample.Sf_framecode Pr_state _Sample.Entry_ID 27783 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Phytochrome '[U-13C; U-15N; U-2H]' . . 1 $Phytochrome . . 0.8 . . mM . . . . 27783 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 27783 1 3 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 27783 1 4 azide 'natural abundance' . . . . . . 0.02 . . % . . . . 27783 1 5 'Complete EDTA free' 'natural abundance' . . . . . . 2 . . tablet/100mL . . . . 27783 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27783 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.075 . M 27783 1 pH 6.9 . pH 27783 1 pressure 1 . atm 27783 1 temperature 273 . K 27783 1 stop_ save_ ############################ # Computer software used # ############################ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 27783 _Software.ID 1 _Software.Type . _Software.Name CCPN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 27783 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 27783 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27783 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27783 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 27783 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27783 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCO' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 2 '3D HNCA' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 4 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 5 '3D HN(CO)CACB' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 6 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 7 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 8 '3D 1H-15N NOESY TROSY' no . . . . . . . . . . . . 1 $Pr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27783 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27783 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27783 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27783 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27783 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27783 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 27783 1 2 '3D HNCA' . . . 27783 1 3 '3D HNCACB' . . . 27783 1 4 '3D HN(CO)CA' . . . 27783 1 5 '3D HN(CO)CACB' . . . 27783 1 6 '3D HN(CA)CO' . . . 27783 1 7 '2D 1H-15N TROSY' . . . 27783 1 8 '3D 1H-15N NOESY TROSY' . . . 27783 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 32 32 PRO C C 13 179.3508 . . 1 . . . . . 32 P CO . 27783 1 2 . 1 . 1 32 32 PRO CA C 13 65.0994 . . 1 . . . . . 32 P CA . 27783 1 3 . 1 . 1 32 32 PRO CB C 13 30.7436 . . 1 . . . . . 32 P CB . 27783 1 4 . 1 . 1 33 33 GLY H H 1 8.7487 . . 1 . . . . . 33 G HN . 27783 1 5 . 1 . 1 33 33 GLY C C 13 172.2746 . . 1 . . . . . 33 G CO . 27783 1 6 . 1 . 1 33 33 GLY CA C 13 46.4037 . . 1 . . . . . 33 G CA . 27783 1 7 . 1 . 1 33 33 GLY N N 15 110.2037 . . 1 . . . . . 33 G N . 27783 1 8 . 1 . 1 34 34 SER H H 1 7.0742 . . 1 . . . . . 34 S HN . 27783 1 9 . 1 . 1 34 34 SER C C 13 172.8293 . . 1 . . . . . 34 S CO . 27783 1 10 . 1 . 1 34 34 SER CA C 13 56.1415 . . 1 . . . . . 34 S CA . 27783 1 11 . 1 . 1 34 34 SER CB C 13 65.2001 . . 1 . . . . . 34 S CB . 27783 1 12 . 1 . 1 34 34 SER N N 15 108.7506 . . 1 . . . . . 34 S N . 27783 1 13 . 1 . 1 35 35 ILE H H 1 8.8990 . . 1 . . . . . 35 I HN . 27783 1 14 . 1 . 1 35 35 ILE C C 13 175.4873 . . 1 . . . . . 35 I CO . 27783 1 15 . 1 . 1 35 35 ILE CA C 13 58.4884 . . 1 . . . . . 35 I CA . 27783 1 16 . 1 . 1 35 35 ILE CB C 13 43.0997 . . 1 . . . . . 35 I CB . 27783 1 17 . 1 . 1 35 35 ILE N N 15 111.1175 . . 1 . . . . . 35 I N . 27783 1 18 . 1 . 1 36 36 GLN H H 1 8.9866 . . 1 . . . . . 36 Q HN . 27783 1 19 . 1 . 1 36 36 GLN CA C 13 54.0277 . . 1 . . . . . 36 Q CA . 27783 1 20 . 1 . 1 36 36 GLN CB C 13 29.7173 . . 1 . . . . . 36 Q CB . 27783 1 21 . 1 . 1 36 36 GLN N N 15 121.8630 . . 1 . . . . . 36 Q N . 27783 1 22 . 1 . 1 37 37 PRO C C 13 176.8596 . . 1 . . . . . 37 P CO . 27783 1 23 . 1 . 1 37 37 PRO CA C 13 64.1850 . . 1 . . . . . 37 P CA . 27783 1 24 . 1 . 1 37 37 PRO CB C 13 31.2601 . . 1 . . . . . 37 P CB . 27783 1 25 . 1 . 1 38 38 HIS H H 1 7.6869 . . 1 . . . . . 38 H HN . 27783 1 26 . 1 . 1 38 38 HIS C C 13 173.8081 . . 1 . . . . . 38 H CO . 27783 1 27 . 1 . 1 38 38 HIS CA C 13 57.2678 . . 1 . . . . . 38 H CA . 27783 1 28 . 1 . 1 38 38 HIS CB C 13 29.3216 . . 1 . . . . . 38 H CB . 27783 1 29 . 1 . 1 38 38 HIS N N 15 117.2866 . . 1 . . . . . 38 H N . 27783 1 30 . 1 . 1 39 39 GLY H H 1 6.7822 . . 1 . . . . . 39 G HN . 27783 1 31 . 1 . 1 39 39 GLY C C 13 169.1193 . . 1 . . . . . 39 G CO . 27783 1 32 . 1 . 1 39 39 GLY CA C 13 43.7125 . . 1 . . . . . 39 G CA . 27783 1 33 . 1 . 1 39 39 GLY N N 15 106.6100 . . 1 . . . . . 39 G N . 27783 1 34 . 1 . 1 40 40 ALA H H 1 8.2165 . . 1 . . . . . 40 A HN . 27783 1 35 . 1 . 1 40 40 ALA C C 13 174.0058 . . 1 . . . . . 40 A CO . 27783 1 36 . 1 . 1 40 40 ALA CA C 13 49.3195 . . 1 . . . . . 40 A CA . 27783 1 37 . 1 . 1 40 40 ALA CB C 13 21.5910 . . 1 . . . . . 40 A CB . 27783 1 38 . 1 . 1 40 40 ALA N N 15 116.5520 . . 1 . . . . . 40 A N . 27783 1 39 . 1 . 1 41 41 LEU H H 1 8.0945 . . 1 . . . . . 41 L HN . 27783 1 40 . 1 . 1 41 41 LEU C C 13 174.8172 . . 1 . . . . . 41 L CO . 27783 1 41 . 1 . 1 41 41 LEU CA C 13 53.7322 . . 1 . . . . . 41 L CA . 27783 1 42 . 1 . 1 41 41 LEU CB C 13 48.0317 . . 1 . . . . . 41 L CB . 27783 1 43 . 1 . 1 41 41 LEU N N 15 122.0958 . . 1 . . . . . 41 L N . 27783 1 44 . 1 . 1 42 42 LEU H H 1 9.4617 . . 1 . . . . . 42 L HN . 27783 1 45 . 1 . 1 42 42 LEU CA C 13 53.3831 . . 1 . . . . . 42 L CA . 27783 1 46 . 1 . 1 42 42 LEU N N 15 124.2267 . . 1 . . . . . 42 L N . 27783 1 47 . 1 . 1 43 43 THR H H 1 9.0294 . . 1 . . . . . 43 T HN . 27783 1 48 . 1 . 1 43 43 THR C C 13 174.0645 . . 1 . . . . . 43 T CO . 27783 1 49 . 1 . 1 43 43 THR CA C 13 58.6608 . . 1 . . . . . 43 T CA . 27783 1 50 . 1 . 1 43 43 THR CB C 13 69.9319 . . 1 . . . . . 43 T CB . 27783 1 51 . 1 . 1 43 43 THR N N 15 111.8009 . . 1 . . . . . 43 T N . 27783 1 52 . 1 . 1 44 44 ALA H H 1 9.3844 . . 1 . . . . . 44 A HN . 27783 1 53 . 1 . 1 44 44 ALA C C 13 175.4066 . . 1 . . . . . 44 A CO . 27783 1 54 . 1 . 1 44 44 ALA CA C 13 49.4850 . . 1 . . . . . 44 A CA . 27783 1 55 . 1 . 1 44 44 ALA CB C 13 23.1325 . . 1 . . . . . 44 A CB . 27783 1 56 . 1 . 1 44 44 ALA N N 15 123.5085 . . 1 . . . . . 44 A N . 27783 1 57 . 1 . 1 45 45 ASP H H 1 8.8342 . . 1 . . . . . 45 D HN . 27783 1 58 . 1 . 1 45 45 ASP C C 13 178.3220 . . 1 . . . . . 45 D CO . 27783 1 59 . 1 . 1 45 45 ASP CA C 13 55.4054 . . 1 . . . . . 45 D CA . 27783 1 60 . 1 . 1 45 45 ASP CB C 13 43.8175 . . 1 . . . . . 45 D CB . 27783 1 61 . 1 . 1 45 45 ASP N N 15 122.7416 . . 1 . . . . . 45 D N . 27783 1 62 . 1 . 1 46 46 GLY H H 1 8.8990 . . 1 . . . . . 46 G HN . 27783 1 63 . 1 . 1 46 46 GLY C C 13 173.2018 . . 1 . . . . . 46 G CO . 27783 1 64 . 1 . 1 46 46 GLY CA C 13 46.2838 . . 1 . . . . . 46 G CA . 27783 1 65 . 1 . 1 46 46 GLY N N 15 112.7619 . . 1 . . . . . 46 G N . 27783 1 66 . 1 . 1 47 47 HIS H H 1 9.0893 . . 1 . . . . . 47 H HN . 27783 1 67 . 1 . 1 47 47 HIS C C 13 176.6909 . . 1 . . . . . 47 H CO . 27783 1 68 . 1 . 1 47 47 HIS CA C 13 57.6452 . . 1 . . . . . 47 H CA . 27783 1 69 . 1 . 1 47 47 HIS CB C 13 30.8307 . . 1 . . . . . 47 H CB . 27783 1 70 . 1 . 1 47 47 HIS N N 15 119.6119 . . 1 . . . . . 47 H N . 27783 1 71 . 1 . 1 48 48 SER H H 1 9.3692 . . 1 . . . . . 48 S HN . 27783 1 72 . 1 . 1 48 48 SER C C 13 177.0804 . . 1 . . . . . 48 S CO . 27783 1 73 . 1 . 1 48 48 SER CA C 13 58.3002 . . 1 . . . . . 48 S CA . 27783 1 74 . 1 . 1 48 48 SER CB C 13 64.6621 . . 1 . . . . . 48 S CB . 27783 1 75 . 1 . 1 48 48 SER N N 15 114.2352 . . 1 . . . . . 48 S N . 27783 1 76 . 1 . 1 49 49 GLY H H 1 8.3819 . . 1 . . . . . 49 G HN . 27783 1 77 . 1 . 1 49 49 GLY C C 13 173.9560 . . 1 . . . . . 49 G CO . 27783 1 78 . 1 . 1 49 49 GLY CA C 13 46.0822 . . 1 . . . . . 49 G CA . 27783 1 79 . 1 . 1 49 49 GLY N N 15 111.5094 . . 1 . . . . . 49 G N . 27783 1 80 . 1 . 1 50 50 GLU H H 1 8.1626 . . 1 . . . . . 50 E HN . 27783 1 81 . 1 . 1 50 50 GLU C C 13 176.1371 . . 1 . . . . . 50 E CO . 27783 1 82 . 1 . 1 50 50 GLU CA C 13 57.0737 . . 1 . . . . . 50 E CA . 27783 1 83 . 1 . 1 50 50 GLU CB C 13 29.8910 . . 1 . . . . . 50 E CB . 27783 1 84 . 1 . 1 50 50 GLU N N 15 121.8367 . . 1 . . . . . 50 E N . 27783 1 85 . 1 . 1 51 51 VAL H H 1 8.7306 . . 1 . . . . . 51 V HN . 27783 1 86 . 1 . 1 51 51 VAL C C 13 176.0755 . . 1 . . . . . 51 V CO . 27783 1 87 . 1 . 1 51 51 VAL CA C 13 64.3161 . . 1 . . . . . 51 V CA . 27783 1 88 . 1 . 1 51 51 VAL CB C 13 30.7766 . . 1 . . . . . 51 V CB . 27783 1 89 . 1 . 1 51 51 VAL N N 15 126.4618 . . 1 . . . . . 51 V N . 27783 1 90 . 1 . 1 52 52 LEU H H 1 9.2635 . . 1 . . . . . 52 L HN . 27783 1 91 . 1 . 1 52 52 LEU C C 13 176.9509 . . 1 . . . . . 52 L CO . 27783 1 92 . 1 . 1 52 52 LEU CA C 13 55.4477 . . 1 . . . . . 52 L CA . 27783 1 93 . 1 . 1 52 52 LEU CB C 13 43.2836 . . 1 . . . . . 52 L CB . 27783 1 94 . 1 . 1 52 52 LEU N N 15 129.6550 . . 1 . . . . . 52 L N . 27783 1 95 . 1 . 1 53 53 GLN H H 1 7.6071 . . 1 . . . . . 53 Q HN . 27783 1 96 . 1 . 1 53 53 GLN C C 13 174.7213 . . 1 . . . . . 53 Q CO . 27783 1 97 . 1 . 1 53 53 GLN CA C 13 53.4904 . . 1 . . . . . 53 Q CA . 27783 1 98 . 1 . 1 53 53 GLN CB C 13 34.7708 . . 1 . . . . . 53 Q CB . 27783 1 99 . 1 . 1 53 53 GLN N N 15 114.0639 . . 1 . . . . . 53 Q N . 27783 1 100 . 1 . 1 54 54 MET H H 1 8.4151 . . 1 . . . . . 54 M HN . 27783 1 101 . 1 . 1 54 54 MET C C 13 175.6045 . . 1 . . . . . 54 M CO . 27783 1 102 . 1 . 1 54 54 MET CA C 13 53.4862 . . 1 . . . . . 54 M CA . 27783 1 103 . 1 . 1 54 54 MET CB C 13 36.0943 . . 1 . . . . . 54 M CB . 27783 1 104 . 1 . 1 54 54 MET N N 15 114.9424 . . 1 . . . . . 54 M N . 27783 1 105 . 1 . 1 55 55 SER H H 1 9.3050 . . 1 . . . . . 55 S HN . 27783 1 106 . 1 . 1 55 55 SER C C 13 177.7822 . . 1 . . . . . 55 S CO . 27783 1 107 . 1 . 1 55 55 SER CA C 13 58.4216 . . 1 . . . . . 55 S CA . 27783 1 108 . 1 . 1 55 55 SER CB C 13 63.3364 . . 1 . . . . . 55 S CB . 27783 1 109 . 1 . 1 55 55 SER N N 15 118.9804 . . 1 . . . . . 55 S N . 27783 1 110 . 1 . 1 56 56 LEU H H 1 8.4032 . . 1 . . . . . 56 L HN . 27783 1 111 . 1 . 1 56 56 LEU C C 13 177.0124 . . 1 . . . . . 56 L CO . 27783 1 112 . 1 . 1 56 56 LEU CA C 13 57.4544 . . 1 . . . . . 56 L CA . 27783 1 113 . 1 . 1 56 56 LEU CB C 13 40.9744 . . 1 . . . . . 56 L CB . 27783 1 114 . 1 . 1 56 56 LEU N N 15 121.9005 . . 1 . . . . . 56 L N . 27783 1 115 . 1 . 1 57 57 ASN H H 1 7.9473 . . 1 . . . . . 57 N HN . 27783 1 116 . 1 . 1 57 57 ASN C C 13 176.7472 . . 1 . . . . . 57 N CO . 27783 1 117 . 1 . 1 57 57 ASN CA C 13 52.7065 . . 1 . . . . . 57 N CA . 27783 1 118 . 1 . 1 57 57 ASN CB C 13 37.6634 . . 1 . . . . . 57 N CB . 27783 1 119 . 1 . 1 57 57 ASN N N 15 114.2062 . . 1 . . . . . 57 N N . 27783 1 120 . 1 . 1 58 58 ALA H H 1 8.0318 . . 1 . . . . . 58 A HN . 27783 1 121 . 1 . 1 58 58 ALA C C 13 178.5233 . . 1 . . . . . 58 A CO . 27783 1 122 . 1 . 1 58 58 ALA CA C 13 56.1322 . . 1 . . . . . 58 A CA . 27783 1 123 . 1 . 1 58 58 ALA CB C 13 17.9801 . . 1 . . . . . 58 A CB . 27783 1 124 . 1 . 1 58 58 ALA N N 15 123.5012 . . 1 . . . . . 58 A N . 27783 1 125 . 1 . 1 59 59 ALA H H 1 8.5474 . . 1 . . . . . 59 A HN . 27783 1 126 . 1 . 1 59 59 ALA C C 13 180.0115 . . 1 . . . . . 59 A CO . 27783 1 127 . 1 . 1 59 59 ALA CA C 13 55.4065 . . 1 . . . . . 59 A CA . 27783 1 128 . 1 . 1 59 59 ALA CB C 13 17.3312 . . 1 . . . . . 59 A CB . 27783 1 129 . 1 . 1 59 59 ALA N N 15 118.9852 . . 1 . . . . . 59 A N . 27783 1 130 . 1 . 1 60 60 THR H H 1 7.8864 . . 1 . . . . . 60 T HN . 27783 1 131 . 1 . 1 60 60 THR C C 13 176.2546 . . 1 . . . . . 60 T CO . 27783 1 132 . 1 . 1 60 60 THR CA C 13 65.0990 . . 1 . . . . . 60 T CA . 27783 1 133 . 1 . 1 60 60 THR CB C 13 68.3800 . . 1 . . . . . 60 T CB . 27783 1 134 . 1 . 1 60 60 THR N N 15 113.0446 . . 1 . . . . . 60 T N . 27783 1 135 . 1 . 1 61 61 PHE H H 1 7.8351 . . 1 . . . . . 61 F HN . 27783 1 136 . 1 . 1 61 61 PHE C C 13 176.1394 . . 1 . . . . . 61 F CO . 27783 1 137 . 1 . 1 61 61 PHE CA C 13 60.4683 . . 1 . . . . . 61 F CA . 27783 1 138 . 1 . 1 61 61 PHE CB C 13 39.7291 . . 1 . . . . . 61 F CB . 27783 1 139 . 1 . 1 61 61 PHE N N 15 121.1063 . . 1 . . . . . 61 F N . 27783 1 140 . 1 . 1 62 62 LEU H H 1 8.1172 . . 1 . . . . . 62 L HN . 27783 1 141 . 1 . 1 62 62 LEU C C 13 178.3972 . . 1 . . . . . 62 L CO . 27783 1 142 . 1 . 1 62 62 LEU CA C 13 53.9842 . . 1 . . . . . 62 L CA . 27783 1 143 . 1 . 1 62 62 LEU CB C 13 41.2354 . . 1 . . . . . 62 L CB . 27783 1 144 . 1 . 1 62 62 LEU N N 15 112.6270 . . 1 . . . . . 62 L N . 27783 1 145 . 1 . 1 63 63 GLY H H 1 7.8298 . . 1 . . . . . 63 G HN . 27783 1 146 . 1 . 1 63 63 GLY C C 13 174.0790 . . 1 . . . . . 63 G CO . 27783 1 147 . 1 . 1 63 63 GLY CA C 13 46.5567 . . 1 . . . . . 63 G CA . 27783 1 148 . 1 . 1 63 63 GLY N N 15 109.9802 . . 1 . . . . . 63 G N . 27783 1 149 . 1 . 1 64 64 GLN H H 1 7.7152 . . 1 . . . . . 64 Q HN . 27783 1 150 . 1 . 1 64 64 GLN C C 13 174.2492 . . 1 . . . . . 64 Q CO . 27783 1 151 . 1 . 1 64 64 GLN CA C 13 53.1124 . . 1 . . . . . 64 Q CA . 27783 1 152 . 1 . 1 64 64 GLN CB C 13 32.2069 . . 1 . . . . . 64 Q CB . 27783 1 153 . 1 . 1 64 64 GLN N N 15 116.5782 . . 1 . . . . . 64 Q N . 27783 1 154 . 1 . 1 65 65 GLU H H 1 8.4817 . . 1 . . . . . 65 E HN . 27783 1 155 . 1 . 1 65 65 GLU C C 13 176.8326 . . 1 . . . . . 65 E CO . 27783 1 156 . 1 . 1 65 65 GLU CA C 13 54.4539 . . 1 . . . . . 65 E CA . 27783 1 157 . 1 . 1 65 65 GLU CB C 13 28.9190 . . 1 . . . . . 65 E CB . 27783 1 158 . 1 . 1 65 65 GLU N N 15 120.9827 . . 1 . . . . . 65 E N . 27783 1 159 . 1 . 1 66 66 PRO C C 13 177.8887 . . 1 . . . . . 66 P CO . 27783 1 160 . 1 . 1 66 66 PRO CA C 13 66.0884 . . 1 . . . . . 66 P CA . 27783 1 161 . 1 . 1 66 66 PRO CB C 13 31.1974 . . 1 . . . . . 66 P CB . 27783 1 162 . 1 . 1 67 67 THR H H 1 7.8185 . . 1 . . . . . 67 T HN . 27783 1 163 . 1 . 1 67 67 THR C C 13 176.1483 . . 1 . . . . . 67 T CO . 27783 1 164 . 1 . 1 67 67 THR CA C 13 64.1243 . . 1 . . . . . 67 T CA . 27783 1 165 . 1 . 1 67 67 THR CB C 13 68.2321 . . 1 . . . . . 67 T CB . 27783 1 166 . 1 . 1 67 67 THR N N 15 106.7788 . . 1 . . . . . 67 T N . 27783 1 167 . 1 . 1 68 68 VAL H H 1 7.2677 . . 1 . . . . . 68 V HN . 27783 1 168 . 1 . 1 68 68 VAL C C 13 177.6727 . . 1 . . . . . 68 V CO . 27783 1 169 . 1 . 1 68 68 VAL CA C 13 63.6610 . . 1 . . . . . 68 V CA . 27783 1 170 . 1 . 1 68 68 VAL CB C 13 31.4468 . . 1 . . . . . 68 V CB . 27783 1 171 . 1 . 1 68 68 VAL N N 15 120.8288 . . 1 . . . . . 68 V N . 27783 1 172 . 1 . 1 69 69 LEU H H 1 7.6606 . . 1 . . . . . 69 L HN . 27783 1 173 . 1 . 1 69 69 LEU C C 13 177.3252 . . 1 . . . . . 69 L CO . 27783 1 174 . 1 . 1 69 69 LEU CA C 13 57.0870 . . 1 . . . . . 69 L CA . 27783 1 175 . 1 . 1 69 69 LEU CB C 13 42.3217 . . 1 . . . . . 69 L CB . 27783 1 176 . 1 . 1 69 69 LEU N N 15 120.7335 . . 1 . . . . . 69 L N . 27783 1 177 . 1 . 1 70 70 ARG H H 1 7.6356 . . 1 . . . . . 70 R HN . 27783 1 178 . 1 . 1 70 70 ARG C C 13 176.9421 . . 1 . . . . . 70 R CO . 27783 1 179 . 1 . 1 70 70 ARG CA C 13 57.8894 . . 1 . . . . . 70 R CA . 27783 1 180 . 1 . 1 70 70 ARG CB C 13 29.0660 . . 1 . . . . . 70 R CB . 27783 1 181 . 1 . 1 70 70 ARG N N 15 114.9322 . . 1 . . . . . 70 R N . 27783 1 182 . 1 . 1 71 71 GLY H H 1 7.9695 . . 1 . . . . . 71 G HN . 27783 1 183 . 1 . 1 71 71 GLY C C 13 174.6758 . . 1 . . . . . 71 G CO . 27783 1 184 . 1 . 1 71 71 GLY CA C 13 44.9571 . . 1 . . . . . 71 G CA . 27783 1 185 . 1 . 1 71 71 GLY N N 15 109.8379 . . 1 . . . . . 71 G N . 27783 1 186 . 1 . 1 72 72 GLN H H 1 7.5939 . . 1 . . . . . 72 Q HN . 27783 1 187 . 1 . 1 72 72 GLN C C 13 175.6101 . . 1 . . . . . 72 Q CO . 27783 1 188 . 1 . 1 72 72 GLN CA C 13 55.1217 . . 1 . . . . . 72 Q CA . 27783 1 189 . 1 . 1 72 72 GLN CB C 13 29.7290 . . 1 . . . . . 72 Q CB . 27783 1 190 . 1 . 1 72 72 GLN N N 15 119.9257 . . 1 . . . . . 72 Q N . 27783 1 191 . 1 . 1 73 73 THR H H 1 8.0532 . . 1 . . . . . 73 T HN . 27783 1 192 . 1 . 1 73 73 THR C C 13 176.9687 . . 1 . . . . . 73 T CO . 27783 1 193 . 1 . 1 73 73 THR CA C 13 58.9049 . . 1 . . . . . 73 T CA . 27783 1 194 . 1 . 1 73 73 THR CB C 13 70.7065 . . 1 . . . . . 73 T CB . 27783 1 195 . 1 . 1 73 73 THR N N 15 109.7677 . . 1 . . . . . 73 T N . 27783 1 196 . 1 . 1 74 74 LEU H H 1 8.6778 . . 1 . . . . . 74 L HN . 27783 1 197 . 1 . 1 74 74 LEU C C 13 177.4443 . . 1 . . . . . 74 L CO . 27783 1 198 . 1 . 1 74 74 LEU CA C 13 56.9665 . . 1 . . . . . 74 L CA . 27783 1 199 . 1 . 1 74 74 LEU CB C 13 40.7624 . . 1 . . . . . 74 L CB . 27783 1 200 . 1 . 1 74 74 LEU N N 15 121.2726 . . 1 . . . . . 74 L N . 27783 1 201 . 1 . 1 75 75 ALA H H 1 7.1993 . . 1 . . . . . 75 A HN . 27783 1 202 . 1 . 1 75 75 ALA C C 13 178.4132 . . 1 . . . . . 75 A CO . 27783 1 203 . 1 . 1 75 75 ALA CA C 13 54.3262 . . 1 . . . . . 75 A CA . 27783 1 204 . 1 . 1 75 75 ALA CB C 13 17.2370 . . 1 . . . . . 75 A CB . 27783 1 205 . 1 . 1 75 75 ALA N N 15 118.5178 . . 1 . . . . . 75 A N . 27783 1 206 . 1 . 1 76 76 ALA H H 1 7.0495 . . 1 . . . . . 76 A HN . 27783 1 207 . 1 . 1 76 76 ALA C C 13 179.3928 . . 1 . . . . . 76 A CO . 27783 1 208 . 1 . 1 76 76 ALA CA C 13 52.6549 . . 1 . . . . . 76 A CA . 27783 1 209 . 1 . 1 76 76 ALA CB C 13 18.8063 . . 1 . . . . . 76 A CB . 27783 1 210 . 1 . 1 76 76 ALA N N 15 117.3398 . . 1 . . . . . 76 A N . 27783 1 211 . 1 . 1 77 77 LEU H H 1 7.9066 . . 1 . . . . . 77 L HN . 27783 1 212 . 1 . 1 77 77 LEU C C 13 176.8067 . . 1 . . . . . 77 L CO . 27783 1 213 . 1 . 1 77 77 LEU CA C 13 56.7979 . . 1 . . . . . 77 L CA . 27783 1 214 . 1 . 1 77 77 LEU CB C 13 43.9524 . . 1 . . . . . 77 L CB . 27783 1 215 . 1 . 1 77 77 LEU N N 15 118.7068 . . 1 . . . . . 77 L N . 27783 1 216 . 1 . 1 78 78 LEU H H 1 8.4220 . . 1 . . . . . 78 L HN . 27783 1 217 . 1 . 1 78 78 LEU C C 13 173.9862 . . 1 . . . . . 78 L CO . 27783 1 218 . 1 . 1 78 78 LEU CA C 13 51.2356 . . 1 . . . . . 78 L CA . 27783 1 219 . 1 . 1 78 78 LEU CB C 13 42.3033 . . 1 . . . . . 78 L CB . 27783 1 220 . 1 . 1 78 78 LEU N N 15 116.3146 . . 1 . . . . . 78 L N . 27783 1 221 . 1 . 1 79 79 PRO C C 13 180.0146 . . 1 . . . . . 79 P CO . 27783 1 222 . 1 . 1 79 79 PRO CA C 13 65.7922 . . 1 . . . . . 79 P CA . 27783 1 223 . 1 . 1 79 79 PRO CB C 13 30.8377 . . 1 . . . . . 79 P CB . 27783 1 224 . 1 . 1 80 80 GLU H H 1 8.5360 . . 1 . . . . . 80 E HN . 27783 1 225 . 1 . 1 80 80 GLU C C 13 178.2449 . . 1 . . . . . 80 E CO . 27783 1 226 . 1 . 1 80 80 GLU CA C 13 57.6786 . . 1 . . . . . 80 E CA . 27783 1 227 . 1 . 1 80 80 GLU CB C 13 28.9122 . . 1 . . . . . 80 E CB . 27783 1 228 . 1 . 1 80 80 GLU N N 15 113.6212 . . 1 . . . . . 80 E N . 27783 1 229 . 1 . 1 81 81 GLN H H 1 7.5121 . . 1 . . . . . 81 Q HN . 27783 1 230 . 1 . 1 81 81 GLN C C 13 176.8732 . . 1 . . . . . 81 Q CO . 27783 1 231 . 1 . 1 81 81 GLN CA C 13 57.5311 . . 1 . . . . . 81 Q CA . 27783 1 232 . 1 . 1 81 81 GLN CB C 13 28.0761 . . 1 . . . . . 81 Q CB . 27783 1 233 . 1 . 1 81 81 GLN N N 15 116.6422 . . 1 . . . . . 81 Q N . 27783 1 234 . 1 . 1 82 82 TRP H H 1 8.7561 . . 1 . . . . . 82 W HN . 27783 1 235 . 1 . 1 82 82 TRP C C 13 173.4331 . . 1 . . . . . 82 W CO . 27783 1 236 . 1 . 1 82 82 TRP CA C 13 61.2129 . . 1 . . . . . 82 W CA . 27783 1 237 . 1 . 1 82 82 TRP CB C 13 27.5408 . . 1 . . . . . 82 W CB . 27783 1 238 . 1 . 1 82 82 TRP N N 15 120.3541 . . 1 . . . . . 82 W N . 27783 1 239 . 1 . 1 83 83 PRO C C 13 179.6226 . . 1 . . . . . 83 P CO . 27783 1 240 . 1 . 1 83 83 PRO CA C 13 65.3101 . . 1 . . . . . 83 P CA . 27783 1 241 . 1 . 1 83 83 PRO CB C 13 29.6540 . . 1 . . . . . 83 P CB . 27783 1 242 . 1 . 1 84 84 ALA H H 1 6.7758 . . 1 . . . . . 84 A HN . 27783 1 243 . 1 . 1 84 84 ALA C C 13 180.1095 . . 1 . . . . . 84 A CO . 27783 1 244 . 1 . 1 84 84 ALA CA C 13 54.1574 . . 1 . . . . . 84 A CA . 27783 1 245 . 1 . 1 84 84 ALA CB C 13 17.8612 . . 1 . . . . . 84 A CB . 27783 1 246 . 1 . 1 84 84 ALA N N 15 120.4224 . . 1 . . . . . 84 A N . 27783 1 247 . 1 . 1 85 85 LEU H H 1 8.3961 . . 1 . . . . . 85 L HN . 27783 1 248 . 1 . 1 85 85 LEU C C 13 177.9839 . . 1 . . . . . 85 L CO . 27783 1 249 . 1 . 1 85 85 LEU CA C 13 57.6715 . . 1 . . . . . 85 L CA . 27783 1 250 . 1 . 1 85 85 LEU CB C 13 40.6227 . . 1 . . . . . 85 L CB . 27783 1 251 . 1 . 1 85 85 LEU N N 15 121.5923 . . 1 . . . . . 85 L N . 27783 1 252 . 1 . 1 86 86 GLN H H 1 7.4111 . . 1 . . . . . 86 Q HN . 27783 1 253 . 1 . 1 86 86 GLN C C 13 178.0492 . . 1 . . . . . 86 Q CO . 27783 1 254 . 1 . 1 86 86 GLN CA C 13 58.2829 . . 1 . . . . . 86 Q CA . 27783 1 255 . 1 . 1 86 86 GLN CB C 13 28.8174 . . 1 . . . . . 86 Q CB . 27783 1 256 . 1 . 1 86 86 GLN N N 15 117.0364 . . 1 . . . . . 86 Q N . 27783 1 257 . 1 . 1 87 87 ALA H H 1 6.9582 . . 1 . . . . . 87 A HN . 27783 1 258 . 1 . 1 87 87 ALA C C 13 179.0011 . . 1 . . . . . 87 A CO . 27783 1 259 . 1 . 1 87 87 ALA CA C 13 53.1224 . . 1 . . . . . 87 A CA . 27783 1 260 . 1 . 1 87 87 ALA CB C 13 17.8480 . . 1 . . . . . 87 A CB . 27783 1 261 . 1 . 1 87 87 ALA N N 15 118.0079 . . 1 . . . . . 87 A N . 27783 1 262 . 1 . 1 88 88 ALA H H 1 7.6957 . . 1 . . . . . 88 A HN . 27783 1 263 . 1 . 1 88 88 ALA C C 13 177.5361 . . 1 . . . . . 88 A CO . 27783 1 264 . 1 . 1 88 88 ALA CA C 13 53.4920 . . 1 . . . . . 88 A CA . 27783 1 265 . 1 . 1 88 88 ALA CB C 13 19.6538 . . 1 . . . . . 88 A CB . 27783 1 266 . 1 . 1 88 88 ALA N N 15 118.9914 . . 1 . . . . . 88 A N . 27783 1 267 . 1 . 1 89 89 LEU H H 1 7.1148 . . 1 . . . . . 89 L HN . 27783 1 268 . 1 . 1 89 89 LEU C C 13 177.5434 . . 1 . . . . . 89 L CO . 27783 1 269 . 1 . 1 89 89 LEU CA C 13 50.6589 . . 1 . . . . . 89 L CA . 27783 1 270 . 1 . 1 89 89 LEU CB C 13 40.9821 . . 1 . . . . . 89 L CB . 27783 1 271 . 1 . 1 89 89 LEU N N 15 115.3180 . . 1 . . . . . 89 L N . 27783 1 272 . 1 . 1 94 94 PRO C C 13 178.1127 . . 1 . . . . . 94 P CO . 27783 1 273 . 1 . 1 94 94 PRO CA C 13 63.1122 . . 1 . . . . . 94 P CA . 27783 1 274 . 1 . 1 94 94 PRO CB C 13 31.5955 . . 1 . . . . . 94 P CB . 27783 1 275 . 1 . 1 95 95 ASP H H 1 8.8195 . . 1 . . . . . 95 D HN . 27783 1 276 . 1 . 1 95 95 ASP C C 13 176.0855 . . 1 . . . . . 95 D CO . 27783 1 277 . 1 . 1 95 95 ASP CA C 13 55.5985 . . 1 . . . . . 95 D CA . 27783 1 278 . 1 . 1 95 95 ASP CB C 13 40.3165 . . 1 . . . . . 95 D CB . 27783 1 279 . 1 . 1 95 95 ASP N N 15 123.0123 . . 1 . . . . . 95 D N . 27783 1 280 . 1 . 1 96 96 ALA H H 1 7.1190 . . 1 . . . . . 96 A HN . 27783 1 281 . 1 . 1 96 96 ALA C C 13 177.6421 . . 1 . . . . . 96 A CO . 27783 1 282 . 1 . 1 96 96 ALA CA C 13 51.4931 . . 1 . . . . . 96 A CA . 27783 1 283 . 1 . 1 96 96 ALA CB C 13 18.6958 . . 1 . . . . . 96 A CB . 27783 1 284 . 1 . 1 96 96 ALA N N 15 117.4440 . . 1 . . . . . 96 A N . 27783 1 285 . 1 . 1 97 97 LEU H H 1 7.3566 . . 1 . . . . . 97 L HN . 27783 1 286 . 1 . 1 97 97 LEU C C 13 175.7933 . . 1 . . . . . 97 L CO . 27783 1 287 . 1 . 1 97 97 LEU CA C 13 55.2019 . . 1 . . . . . 97 L CA . 27783 1 288 . 1 . 1 97 97 LEU CB C 13 41.9878 . . 1 . . . . . 97 L CB . 27783 1 289 . 1 . 1 97 97 LEU N N 15 121.0460 . . 1 . . . . . 97 L N . 27783 1 290 . 1 . 1 98 98 GLN H H 1 8.2372 . . 1 . . . . . 98 Q HN . 27783 1 291 . 1 . 1 98 98 GLN C C 13 176.3441 . . 1 . . . . . 98 Q CO . 27783 1 292 . 1 . 1 98 98 GLN CA C 13 53.7050 . . 1 . . . . . 98 Q CA . 27783 1 293 . 1 . 1 98 98 GLN CB C 13 31.3172 . . 1 . . . . . 98 Q CB . 27783 1 294 . 1 . 1 98 98 GLN N N 15 120.8142 . . 1 . . . . . 98 Q N . 27783 1 295 . 1 . 1 99 99 TYR H H 1 9.2946 . . 1 . . . . . 99 Y HN . 27783 1 296 . 1 . 1 99 99 TYR C C 13 173.6665 . . 1 . . . . . 99 Y CO . 27783 1 297 . 1 . 1 99 99 TYR CA C 13 56.8790 . . 1 . . . . . 99 Y CA . 27783 1 298 . 1 . 1 99 99 TYR CB C 13 40.6005 . . 1 . . . . . 99 Y CB . 27783 1 299 . 1 . 1 99 99 TYR N N 15 124.7880 . . 1 . . . . . 99 Y N . 27783 1 300 . 1 . 1 100 100 ARG H H 1 7.6758 . . 1 . . . . . 100 R HN . 27783 1 301 . 1 . 1 100 100 ARG C C 13 174.5641 . . 1 . . . . . 100 R CO . 27783 1 302 . 1 . 1 100 100 ARG CA C 13 53.6844 . . 1 . . . . . 100 R CA . 27783 1 303 . 1 . 1 100 100 ARG CB C 13 32.7568 . . 1 . . . . . 100 R CB . 27783 1 304 . 1 . 1 100 100 ARG N N 15 127.0729 . . 1 . . . . . 100 R N . 27783 1 305 . 1 . 1 101 101 ALA H H 1 8.8148 . . 1 . . . . . 101 A HN . 27783 1 306 . 1 . 1 101 101 ALA C C 13 175.7928 . . 1 . . . . . 101 A CO . 27783 1 307 . 1 . 1 101 101 ALA CA C 13 50.8811 . . 1 . . . . . 101 A CA . 27783 1 308 . 1 . 1 101 101 ALA CB C 13 22.5212 . . 1 . . . . . 101 A CB . 27783 1 309 . 1 . 1 101 101 ALA N N 15 123.5871 . . 1 . . . . . 101 A N . 27783 1 310 . 1 . 1 102 102 THR H H 1 8.3320 . . 1 . . . . . 102 T HN . 27783 1 311 . 1 . 1 102 102 THR C C 13 173.6746 . . 1 . . . . . 102 T CO . 27783 1 312 . 1 . 1 102 102 THR CA C 13 61.1074 . . 1 . . . . . 102 T CA . 27783 1 313 . 1 . 1 102 102 THR CB C 13 69.7807 . . 1 . . . . . 102 T CB . 27783 1 314 . 1 . 1 102 102 THR N N 15 114.9660 . . 1 . . . . . 102 T N . 27783 1 315 . 1 . 1 103 103 LEU H H 1 9.3383 . . 1 . . . . . 103 L HN . 27783 1 316 . 1 . 1 103 103 LEU C C 13 175.4653 . . 1 . . . . . 103 L CO . 27783 1 317 . 1 . 1 103 103 LEU CA C 13 53.5672 . . 1 . . . . . 103 L CA . 27783 1 318 . 1 . 1 103 103 LEU CB C 13 43.4110 . . 1 . . . . . 103 L CB . 27783 1 319 . 1 . 1 103 103 LEU N N 15 124.7272 . . 1 . . . . . 103 L N . 27783 1 320 . 1 . 1 104 104 ASP H H 1 8.6809 . . 1 . . . . . 104 D HN . 27783 1 321 . 1 . 1 104 104 ASP C C 13 175.0476 . . 1 . . . . . 104 D CO . 27783 1 322 . 1 . 1 104 104 ASP CA C 13 53.5413 . . 1 . . . . . 104 D CA . 27783 1 323 . 1 . 1 104 104 ASP CB C 13 40.5839 . . 1 . . . . . 104 D CB . 27783 1 324 . 1 . 1 104 104 ASP N N 15 123.0486 . . 1 . . . . . 104 D N . 27783 1 325 . 1 . 1 105 105 TRP H H 1 8.4112 . . 1 . . . . . 105 W HN . 27783 1 326 . 1 . 1 105 105 TRP CA C 13 53.7091 . . 1 . . . . . 105 W CA . 27783 1 327 . 1 . 1 105 105 TRP CB C 13 31.4044 . . 1 . . . . . 105 W CB . 27783 1 328 . 1 . 1 105 105 TRP N N 15 127.9959 . . 1 . . . . . 105 W N . 27783 1 329 . 1 . 1 106 106 PRO C C 13 177.6664 . . 1 . . . . . 106 P CO . 27783 1 330 . 1 . 1 106 106 PRO CA C 13 65.0326 . . 1 . . . . . 106 P CA . 27783 1 331 . 1 . 1 107 107 ALA H H 1 8.1168 . . 1 . . . . . 107 A HN . 27783 1 332 . 1 . 1 107 107 ALA C C 13 177.4869 . . 1 . . . . . 107 A CO . 27783 1 333 . 1 . 1 107 107 ALA CA C 13 54.0465 . . 1 . . . . . 107 A CA . 27783 1 334 . 1 . 1 107 107 ALA CB C 13 18.0300 . . 1 . . . . . 107 A CB . 27783 1 335 . 1 . 1 107 107 ALA N N 15 119.7594 . . 1 . . . . . 107 A N . 27783 1 336 . 1 . 1 108 108 ALA H H 1 8.2106 . . 1 . . . . . 108 A HN . 27783 1 337 . 1 . 1 108 108 ALA C C 13 177.2455 . . 1 . . . . . 108 A CO . 27783 1 338 . 1 . 1 108 108 ALA CA C 13 52.5185 . . 1 . . . . . 108 A CA . 27783 1 339 . 1 . 1 108 108 ALA CB C 13 20.8135 . . 1 . . . . . 108 A CB . 27783 1 340 . 1 . 1 108 108 ALA N N 15 120.5915 . . 1 . . . . . 108 A N . 27783 1 341 . 1 . 1 109 109 GLY H H 1 8.3569 . . 1 . . . . . 109 G HN . 27783 1 342 . 1 . 1 109 109 GLY C C 13 172.9921 . . 1 . . . . . 109 G CO . 27783 1 343 . 1 . 1 109 109 GLY CA C 13 44.6198 . . 1 . . . . . 109 G CA . 27783 1 344 . 1 . 1 109 109 GLY N N 15 108.0981 . . 1 . . . . . 109 G N . 27783 1 345 . 1 . 1 110 110 HIS H H 1 8.3722 . . 1 . . . . . 110 H HN . 27783 1 346 . 1 . 1 110 110 HIS C C 13 175.3990 . . 1 . . . . . 110 H CO . 27783 1 347 . 1 . 1 110 110 HIS CA C 13 55.9582 . . 1 . . . . . 110 H CA . 27783 1 348 . 1 . 1 110 110 HIS CB C 13 29.6006 . . 1 . . . . . 110 H CB . 27783 1 349 . 1 . 1 110 110 HIS N N 15 120.8903 . . 1 . . . . . 110 H N . 27783 1 350 . 1 . 1 111 111 LEU H H 1 9.1444 . . 1 . . . . . 111 L HN . 27783 1 351 . 1 . 1 111 111 LEU C C 13 176.0922 . . 1 . . . . . 111 L CO . 27783 1 352 . 1 . 1 111 111 LEU CA C 13 53.0981 . . 1 . . . . . 111 L CA . 27783 1 353 . 1 . 1 111 111 LEU CB C 13 45.5661 . . 1 . . . . . 111 L CB . 27783 1 354 . 1 . 1 111 111 LEU N N 15 123.8129 . . 1 . . . . . 111 L N . 27783 1 355 . 1 . 1 112 112 SER H H 1 9.5034 . . 1 . . . . . 112 S HN . 27783 1 356 . 1 . 1 112 112 SER C C 13 173.0972 . . 1 . . . . . 112 S CO . 27783 1 357 . 1 . 1 112 112 SER CA C 13 57.4370 . . 1 . . . . . 112 S CA . 27783 1 358 . 1 . 1 112 112 SER CB C 13 63.3757 . . 1 . . . . . 112 S CB . 27783 1 359 . 1 . 1 112 112 SER N N 15 117.0412 . . 1 . . . . . 112 S N . 27783 1 360 . 1 . 1 113 113 LEU H H 1 9.0615 . . 1 . . . . . 113 L HN . 27783 1 361 . 1 . 1 113 113 LEU C C 13 175.3082 . . 1 . . . . . 113 L CO . 27783 1 362 . 1 . 1 113 113 LEU CA C 13 52.7464 . . 1 . . . . . 113 L CA . 27783 1 363 . 1 . 1 113 113 LEU CB C 13 43.8049 . . 1 . . . . . 113 L CB . 27783 1 364 . 1 . 1 113 113 LEU N N 15 131.1528 . . 1 . . . . . 113 L N . 27783 1 365 . 1 . 1 114 114 THR H H 1 8.9323 . . 1 . . . . . 114 T HN . 27783 1 366 . 1 . 1 114 114 THR C C 13 174.1604 . . 1 . . . . . 114 T CO . 27783 1 367 . 1 . 1 114 114 THR CA C 13 62.0025 . . 1 . . . . . 114 T CA . 27783 1 368 . 1 . 1 114 114 THR CB C 13 70.1649 . . 1 . . . . . 114 T CB . 27783 1 369 . 1 . 1 114 114 THR N N 15 123.8680 . . 1 . . . . . 114 T N . 27783 1 370 . 1 . 1 115 115 VAL H H 1 9.8357 . . 1 . . . . . 115 V HN . 27783 1 371 . 1 . 1 115 115 VAL C C 13 174.6173 . . 1 . . . . . 115 V CO . 27783 1 372 . 1 . 1 115 115 VAL CA C 13 59.4717 . . 1 . . . . . 115 V CA . 27783 1 373 . 1 . 1 115 115 VAL CB C 13 34.1251 . . 1 . . . . . 115 V CB . 27783 1 374 . 1 . 1 115 115 VAL N N 15 128.9804 . . 1 . . . . . 115 V N . 27783 1 375 . 1 . 1 116 116 HIS H H 1 8.6330 . . 1 . . . . . 116 H HN . 27783 1 376 . 1 . 1 116 116 HIS C C 13 170.8764 . . 1 . . . . . 116 H CO . 27783 1 377 . 1 . 1 116 116 HIS CA C 13 55.4161 . . 1 . . . . . 116 H CA . 27783 1 378 . 1 . 1 116 116 HIS CB C 13 31.1923 . . 1 . . . . . 116 H CB . 27783 1 379 . 1 . 1 116 116 HIS N N 15 122.2526 . . 1 . . . . . 116 H N . 27783 1 380 . 1 . 1 117 117 ARG H H 1 10.5061 . . 1 . . . . . 117 R HN . 27783 1 381 . 1 . 1 117 117 ARG C C 13 176.0245 . . 1 . . . . . 117 R CO . 27783 1 382 . 1 . 1 117 117 ARG CA C 13 54.3438 . . 1 . . . . . 117 R CA . 27783 1 383 . 1 . 1 117 117 ARG CB C 13 33.4730 . . 1 . . . . . 117 R CB . 27783 1 384 . 1 . 1 117 117 ARG N N 15 124.6584 . . 1 . . . . . 117 R N . 27783 1 385 . 1 . 1 118 118 VAL H H 1 8.8879 . . 1 . . . . . 118 V HN . 27783 1 386 . 1 . 1 118 118 VAL C C 13 177.2564 . . 1 . . . . . 118 V CO . 27783 1 387 . 1 . 1 118 118 VAL CA C 13 60.3487 . . 1 . . . . . 118 V CA . 27783 1 388 . 1 . 1 118 118 VAL CB C 13 32.7009 . . 1 . . . . . 118 V CB . 27783 1 389 . 1 . 1 118 118 VAL N N 15 125.9499 . . 1 . . . . . 118 V N . 27783 1 390 . 1 . 1 119 119 GLY H H 1 9.0567 . . 1 . . . . . 119 G HN . 27783 1 391 . 1 . 1 119 119 GLY C C 13 175.3985 . . 1 . . . . . 119 G CO . 27783 1 392 . 1 . 1 119 119 GLY CA C 13 47.5453 . . 1 . . . . . 119 G CA . 27783 1 393 . 1 . 1 119 119 GLY N N 15 117.8836 . . 1 . . . . . 119 G N . 27783 1 394 . 1 . 1 128 128 PRO C C 13 176.3615 . . 1 . . . . . 128 P CO . 27783 1 395 . 1 . 1 128 128 PRO CA C 13 63.0943 . . 1 . . . . . 128 P CA . 27783 1 396 . 1 . 1 128 128 PRO CB C 13 31.4330 . . 1 . . . . . 128 P CB . 27783 1 397 . 1 . 1 129 129 THR H H 1 8.1608 . . 1 . . . . . 129 T HN . 27783 1 398 . 1 . 1 129 129 THR C C 13 173.1472 . . 1 . . . . . 129 T CO . 27783 1 399 . 1 . 1 129 129 THR CA C 13 60.6346 . . 1 . . . . . 129 T CA . 27783 1 400 . 1 . 1 129 129 THR CB C 13 70.1854 . . 1 . . . . . 129 T CB . 27783 1 401 . 1 . 1 129 129 THR N N 15 114.6150 . . 1 . . . . . 129 T N . 27783 1 402 . 1 . 1 130 130 GLU H H 1 7.9430 . . 1 . . . . . 130 E HN . 27783 1 403 . 1 . 1 130 130 GLU C C 13 176.6213 . . 1 . . . . . 130 E CO . 27783 1 404 . 1 . 1 130 130 GLU CA C 13 55.0656 . . 1 . . . . . 130 E CA . 27783 1 405 . 1 . 1 130 130 GLU CB C 13 31.6702 . . 1 . . . . . 130 E CB . 27783 1 406 . 1 . 1 130 130 GLU N N 15 123.1571 . . 1 . . . . . 130 E N . 27783 1 407 . 1 . 1 131 131 ALA H H 1 8.4184 . . 1 . . . . . 131 A HN . 27783 1 408 . 1 . 1 131 131 ALA C C 13 176.9563 . . 1 . . . . . 131 A CO . 27783 1 409 . 1 . 1 131 131 ALA CA C 13 52.2511 . . 1 . . . . . 131 A CA . 27783 1 410 . 1 . 1 131 131 ALA CB C 13 18.0851 . . 1 . . . . . 131 A CB . 27783 1 411 . 1 . 1 131 131 ALA N N 15 124.6711 . . 1 . . . . . 131 A N . 27783 1 412 . 1 . 1 132 132 TRP H H 1 7.9890 . . 1 . . . . . 132 W HN . 27783 1 413 . 1 . 1 132 132 TRP C C 13 175.6384 . . 1 . . . . . 132 W CO . 27783 1 414 . 1 . 1 132 132 TRP CA C 13 56.1051 . . 1 . . . . . 132 W CA . 27783 1 415 . 1 . 1 132 132 TRP CB C 13 29.6180 . . 1 . . . . . 132 W CB . 27783 1 416 . 1 . 1 132 132 TRP N N 15 121.0337 . . 1 . . . . . 132 W N . 27783 1 417 . 1 . 1 142 142 ASN C C 13 177.7904 . . 1 . . . . . 142 N CO . 27783 1 418 . 1 . 1 142 142 ASN CA C 13 55.4634 . . 1 . . . . . 142 N CA . 27783 1 419 . 1 . 1 142 142 ASN CB C 13 37.3359 . . 1 . . . . . 142 N CB . 27783 1 420 . 1 . 1 143 143 ALA H H 1 8.0126 . . 1 . . . . . 143 A HN . 27783 1 421 . 1 . 1 143 143 ALA C C 13 179.2911 . . 1 . . . . . 143 A CO . 27783 1 422 . 1 . 1 143 143 ALA CA C 13 54.4973 . . 1 . . . . . 143 A CA . 27783 1 423 . 1 . 1 143 143 ALA CB C 13 17.9374 . . 1 . . . . . 143 A CB . 27783 1 424 . 1 . 1 143 143 ALA N N 15 124.1131 . . 1 . . . . . 143 A N . 27783 1 425 . 1 . 1 144 144 MET H H 1 8.4379 . . 1 . . . . . 144 M HN . 27783 1 426 . 1 . 1 144 144 MET C C 13 179.3141 . . 1 . . . . . 144 M CO . 27783 1 427 . 1 . 1 144 144 MET CA C 13 57.9995 . . 1 . . . . . 144 M CA . 27783 1 428 . 1 . 1 144 144 MET CB C 13 30.9632 . . 1 . . . . . 144 M CB . 27783 1 429 . 1 . 1 144 144 MET N N 15 116.0651 . . 1 . . . . . 144 M N . 27783 1 430 . 1 . 1 145 145 SER H H 1 8.0215 . . 1 . . . . . 145 S HN . 27783 1 431 . 1 . 1 145 145 SER C C 13 176.9046 . . 1 . . . . . 145 S CO . 27783 1 432 . 1 . 1 145 145 SER CA C 13 61.0760 . . 1 . . . . . 145 S CA . 27783 1 433 . 1 . 1 145 145 SER CB C 13 62.2898 . . 1 . . . . . 145 S CB . 27783 1 434 . 1 . 1 145 145 SER N N 15 114.9927 . . 1 . . . . . 145 S N . 27783 1 435 . 1 . 1 146 146 ALA H H 1 7.7527 . . 1 . . . . . 146 A HN . 27783 1 436 . 1 . 1 146 146 ALA C C 13 180.1996 . . 1 . . . . . 146 A CO . 27783 1 437 . 1 . 1 146 146 ALA CA C 13 54.4078 . . 1 . . . . . 146 A CA . 27783 1 438 . 1 . 1 146 146 ALA CB C 13 17.3021 . . 1 . . . . . 146 A CB . 27783 1 439 . 1 . 1 146 146 ALA N N 15 125.0627 . . 1 . . . . . 146 A N . 27783 1 440 . 1 . 1 147 147 LEU H H 1 7.9175 . . 1 . . . . . 147 L HN . 27783 1 441 . 1 . 1 147 147 LEU C C 13 178.4730 . . 1 . . . . . 147 L CO . 27783 1 442 . 1 . 1 147 147 LEU CA C 13 57.6990 . . 1 . . . . . 147 L CA . 27783 1 443 . 1 . 1 147 147 LEU CB C 13 40.5099 . . 1 . . . . . 147 L CB . 27783 1 444 . 1 . 1 147 147 LEU N N 15 117.3964 . . 1 . . . . . 147 L N . 27783 1 445 . 1 . 1 148 148 GLU H H 1 7.8710 . . 1 . . . . . 148 E HN . 27783 1 446 . 1 . 1 148 148 GLU C C 13 178.8178 . . 1 . . . . . 148 E CO . 27783 1 447 . 1 . 1 148 148 GLU CA C 13 58.6700 . . 1 . . . . . 148 E CA . 27783 1 448 . 1 . 1 148 148 GLU CB C 13 28.9188 . . 1 . . . . . 148 E CB . 27783 1 449 . 1 . 1 148 148 GLU N N 15 116.7227 . . 1 . . . . . 148 E N . 27783 1 450 . 1 . 1 149 149 SER H H 1 7.7332 . . 1 . . . . . 149 S HN . 27783 1 451 . 1 . 1 149 149 SER C C 13 174.4241 . . 1 . . . . . 149 S CO . 27783 1 452 . 1 . 1 149 149 SER CA C 13 58.7295 . . 1 . . . . . 149 S CA . 27783 1 453 . 1 . 1 149 149 SER CB C 13 63.3923 . . 1 . . . . . 149 S CB . 27783 1 454 . 1 . 1 149 149 SER N N 15 111.5962 . . 1 . . . . . 149 S N . 27783 1 455 . 1 . 1 150 150 ALA H H 1 7.2343 . . 1 . . . . . 150 A HN . 27783 1 456 . 1 . 1 150 150 ALA C C 13 178.5950 . . 1 . . . . . 150 A CO . 27783 1 457 . 1 . 1 150 150 ALA CA C 13 50.0696 . . 1 . . . . . 150 A CA . 27783 1 458 . 1 . 1 150 150 ALA CB C 13 16.8940 . . 1 . . . . . 150 A CB . 27783 1 459 . 1 . 1 150 150 ALA N N 15 127.3245 . . 1 . . . . . 150 A N . 27783 1 460 . 1 . 1 157 157 ALA C C 13 180.2022 . . 1 . . . . . 157 A CO . 27783 1 461 . 1 . 1 157 157 ALA CA C 13 54.9198 . . 1 . . . . . 157 A CA . 27783 1 462 . 1 . 1 157 157 ALA CB C 13 17.8386 . . 1 . . . . . 157 A CB . 27783 1 463 . 1 . 1 158 158 GLU H H 1 8.1467 . . 1 . . . . . 158 E HN . 27783 1 464 . 1 . 1 158 158 GLU C C 13 179.2210 . . 1 . . . . . 158 E CO . 27783 1 465 . 1 . 1 158 158 GLU CA C 13 59.6432 . . 1 . . . . . 158 E CA . 27783 1 466 . 1 . 1 158 158 GLU CB C 13 28.8560 . . 1 . . . . . 158 E CB . 27783 1 467 . 1 . 1 158 158 GLU N N 15 119.2546 . . 1 . . . . . 158 E N . 27783 1 468 . 1 . 1 159 159 VAL H H 1 8.6339 . . 1 . . . . . 159 V HN . 27783 1 469 . 1 . 1 159 159 VAL C C 13 180.0487 . . 1 . . . . . 159 V CO . 27783 1 470 . 1 . 1 159 159 VAL CA C 13 65.3668 . . 1 . . . . . 159 V CA . 27783 1 471 . 1 . 1 159 159 VAL CB C 13 30.9581 . . 1 . . . . . 159 V CB . 27783 1 472 . 1 . 1 159 159 VAL N N 15 119.8124 . . 1 . . . . . 159 V N . 27783 1 473 . 1 . 1 160 160 ALA H H 1 9.0280 . . 1 . . . . . 160 A HN . 27783 1 474 . 1 . 1 160 160 ALA C C 13 179.2326 . . 1 . . . . . 160 A CO . 27783 1 475 . 1 . 1 160 160 ALA CA C 13 55.8766 . . 1 . . . . . 160 A CA . 27783 1 476 . 1 . 1 160 160 ALA CB C 13 17.7476 . . 1 . . . . . 160 A CB . 27783 1 477 . 1 . 1 160 160 ALA N N 15 124.8617 . . 1 . . . . . 160 A N . 27783 1 478 . 1 . 1 161 161 THR H H 1 7.8610 . . 1 . . . . . 161 T HN . 27783 1 479 . 1 . 1 161 161 THR C C 13 176.8646 . . 1 . . . . . 161 T CO . 27783 1 480 . 1 . 1 161 161 THR CA C 13 65.2455 . . 1 . . . . . 161 T CA . 27783 1 481 . 1 . 1 161 161 THR CB C 13 67.9615 . . 1 . . . . . 161 T CB . 27783 1 482 . 1 . 1 161 161 THR N N 15 106.9928 . . 1 . . . . . 161 T N . 27783 1 483 . 1 . 1 162 162 GLN H H 1 7.9256 . . 1 . . . . . 162 Q HN . 27783 1 484 . 1 . 1 162 162 GLN C C 13 178.9342 . . 1 . . . . . 162 Q CO . 27783 1 485 . 1 . 1 162 162 GLN CA C 13 58.8851 . . 1 . . . . . 162 Q CA . 27783 1 486 . 1 . 1 162 162 GLN CB C 13 27.4584 . . 1 . . . . . 162 Q CB . 27783 1 487 . 1 . 1 162 162 GLN N N 15 122.5049 . . 1 . . . . . 162 Q N . 27783 1 488 . 1 . 1 163 163 THR H H 1 8.6676 . . 1 . . . . . 163 T HN . 27783 1 489 . 1 . 1 163 163 THR C C 13 176.7949 . . 1 . . . . . 163 T CO . 27783 1 490 . 1 . 1 163 163 THR CA C 13 66.5760 . . 1 . . . . . 163 T CA . 27783 1 491 . 1 . 1 163 163 THR CB C 13 68.2754 . . 1 . . . . . 163 T CB . 27783 1 492 . 1 . 1 163 163 THR N N 15 116.5083 . . 1 . . . . . 163 T N . 27783 1 493 . 1 . 1 164 164 VAL H H 1 8.2001 . . 1 . . . . . 164 V HN . 27783 1 494 . 1 . 1 164 164 VAL C C 13 179.8017 . . 1 . . . . . 164 V CO . 27783 1 495 . 1 . 1 164 164 VAL CA C 13 67.0765 . . 1 . . . . . 164 V CA . 27783 1 496 . 1 . 1 164 164 VAL CB C 13 30.3827 . . 1 . . . . . 164 V CB . 27783 1 497 . 1 . 1 164 164 VAL N N 15 120.2602 . . 1 . . . . . 164 V N . 27783 1 498 . 1 . 1 165 165 ARG H H 1 8.5265 . . 1 . . . . . 165 R HN . 27783 1 499 . 1 . 1 165 165 ARG C C 13 177.9515 . . 1 . . . . . 165 R CO . 27783 1 500 . 1 . 1 165 165 ARG CA C 13 61.7591 . . 1 . . . . . 165 R CA . 27783 1 501 . 1 . 1 165 165 ARG N N 15 124.5639 . . 1 . . . . . 165 R N . 27783 1 502 . 1 . 1 166 166 GLU H H 1 8.4372 . . 1 . . . . . 166 E HN . 27783 1 503 . 1 . 1 166 166 GLU C C 13 178.9593 . . 1 . . . . . 166 E CO . 27783 1 504 . 1 . 1 166 166 GLU CA C 13 59.3592 . . 1 . . . . . 166 E CA . 27783 1 505 . 1 . 1 166 166 GLU CB C 13 28.6347 . . 1 . . . . . 166 E CB . 27783 1 506 . 1 . 1 166 166 GLU N N 15 121.4511 . . 1 . . . . . 166 E N . 27783 1 507 . 1 . 1 167 167 LEU H H 1 8.0342 . . 1 . . . . . 167 L HN . 27783 1 508 . 1 . 1 167 167 LEU CA C 13 57.0331 . . 1 . . . . . 167 L CA . 27783 1 509 . 1 . 1 167 167 LEU CB C 13 43.0608 . . 1 . . . . . 167 L CB . 27783 1 510 . 1 . 1 167 167 LEU N N 15 116.2741 . . 1 . . . . . 167 L N . 27783 1 511 . 1 . 1 210 210 ALA C C 13 179.3171 . . 1 . . . . . 210 A CO . 27783 1 512 . 1 . 1 210 210 ALA CA C 13 56.1690 . . 1 . . . . . 210 A CA . 27783 1 513 . 1 . 1 211 211 GLN H H 1 9.5959 . . 1 . . . . . 211 Q HN . 27783 1 514 . 1 . 1 211 211 GLN C C 13 178.5104 . . 1 . . . . . 211 Q CO . 27783 1 515 . 1 . 1 211 211 GLN CA C 13 57.3283 . . 1 . . . . . 211 Q CA . 27783 1 516 . 1 . 1 211 211 GLN CB C 13 25.8303 . . 1 . . . . . 211 Q CB . 27783 1 517 . 1 . 1 211 211 GLN N N 15 121.6216 . . 1 . . . . . 211 Q N . 27783 1 518 . 1 . 1 212 212 ALA H H 1 7.2589 . . 1 . . . . . 212 A HN . 27783 1 519 . 1 . 1 212 212 ALA C C 13 176.0935 . . 1 . . . . . 212 A CO . 27783 1 520 . 1 . 1 212 212 ALA CA C 13 53.6154 . . 1 . . . . . 212 A CA . 27783 1 521 . 1 . 1 212 212 ALA CB C 13 16.1108 . . 1 . . . . . 212 A CB . 27783 1 522 . 1 . 1 212 212 ALA N N 15 127.2650 . . 1 . . . . . 212 A N . 27783 1 523 . 1 . 1 213 213 ARG H H 1 7.5688 . . 1 . . . . . 213 R HN . 27783 1 524 . 1 . 1 213 213 ARG C C 13 178.3400 . . 1 . . . . . 213 R CO . 27783 1 525 . 1 . 1 213 213 ARG CA C 13 60.5995 . . 1 . . . . . 213 R CA . 27783 1 526 . 1 . 1 213 213 ARG N N 15 114.2876 . . 1 . . . . . 213 R N . 27783 1 527 . 1 . 1 214 214 ALA H H 1 7.6215 . . 1 . . . . . 214 A HN . 27783 1 528 . 1 . 1 214 214 ALA C C 13 181.4661 . . 1 . . . . . 214 A CO . 27783 1 529 . 1 . 1 214 214 ALA CA C 13 54.8271 . . 1 . . . . . 214 A CA . 27783 1 530 . 1 . 1 214 214 ALA CB C 13 17.3430 . . 1 . . . . . 214 A CB . 27783 1 531 . 1 . 1 214 214 ALA N N 15 118.4425 . . 1 . . . . . 214 A N . 27783 1 532 . 1 . 1 215 215 LEU H H 1 7.4182 . . 1 . . . . . 215 L HN . 27783 1 533 . 1 . 1 215 215 LEU C C 13 179.3810 . . 1 . . . . . 215 L CO . 27783 1 534 . 1 . 1 215 215 LEU CA C 13 58.2342 . . 1 . . . . . 215 L CA . 27783 1 535 . 1 . 1 215 215 LEU CB C 13 40.5823 . . 1 . . . . . 215 L CB . 27783 1 536 . 1 . 1 215 215 LEU N N 15 123.6018 . . 1 . . . . . 215 L N . 27783 1 537 . 1 . 1 216 216 TYR H H 1 8.4990 . . 1 . . . . . 216 Y HN . 27783 1 538 . 1 . 1 216 216 TYR C C 13 177.1662 . . 1 . . . . . 216 Y CO . 27783 1 539 . 1 . 1 216 216 TYR CA C 13 54.2904 . . 1 . . . . . 216 Y CA . 27783 1 540 . 1 . 1 216 216 TYR CB C 13 35.1632 . . 1 . . . . . 216 Y CB . 27783 1 541 . 1 . 1 216 216 TYR N N 15 116.3870 . . 1 . . . . . 216 Y N . 27783 1 542 . 1 . 1 217 217 THR H H 1 7.6996 . . 1 . . . . . 217 T HN . 27783 1 543 . 1 . 1 217 217 THR C C 13 172.7473 . . 1 . . . . . 217 T CO . 27783 1 544 . 1 . 1 217 217 THR CA C 13 64.1827 . . 1 . . . . . 217 T CA . 27783 1 545 . 1 . 1 217 217 THR CB C 13 68.6880 . . 1 . . . . . 217 T CB . 27783 1 546 . 1 . 1 217 217 THR N N 15 114.2361 . . 1 . . . . . 217 T N . 27783 1 547 . 1 . 1 218 218 ARG H H 1 7.2457 . . 1 . . . . . 218 R HN . 27783 1 548 . 1 . 1 218 218 ARG C C 13 174.9098 . . 1 . . . . . 218 R CO . 27783 1 549 . 1 . 1 218 218 ARG CA C 13 56.3491 . . 1 . . . . . 218 R CA . 27783 1 550 . 1 . 1 218 218 ARG CB C 13 31.8265 . . 1 . . . . . 218 R CB . 27783 1 551 . 1 . 1 218 218 ARG N N 15 119.8620 . . 1 . . . . . 218 R N . 27783 1 552 . 1 . 1 219 219 HIS H H 1 7.8834 . . 1 . . . . . 219 H HN . 27783 1 553 . 1 . 1 219 219 HIS C C 13 177.1358 . . 1 . . . . . 219 H CO . 27783 1 554 . 1 . 1 219 219 HIS CA C 13 55.0586 . . 1 . . . . . 219 H CA . 27783 1 555 . 1 . 1 219 219 HIS CB C 13 30.2825 . . 1 . . . . . 219 H CB . 27783 1 556 . 1 . 1 219 219 HIS N N 15 119.5990 . . 1 . . . . . 219 H N . 27783 1 557 . 1 . 1 220 220 LEU H H 1 8.5484 . . 1 . . . . . 220 L HN . 27783 1 558 . 1 . 1 220 220 LEU C C 13 175.1395 . . 1 . . . . . 220 L CO . 27783 1 559 . 1 . 1 220 220 LEU CA C 13 57.7943 . . 1 . . . . . 220 L CA . 27783 1 560 . 1 . 1 220 220 LEU CB C 13 41.2032 . . 1 . . . . . 220 L CB . 27783 1 561 . 1 . 1 220 220 LEU N N 15 122.4113 . . 1 . . . . . 220 L N . 27783 1 562 . 1 . 1 221 221 LEU H H 1 7.9851 . . 1 . . . . . 221 L HN . 27783 1 563 . 1 . 1 221 221 LEU C C 13 174.8319 . . 1 . . . . . 221 L CO . 27783 1 564 . 1 . 1 221 221 LEU CA C 13 54.8912 . . 1 . . . . . 221 L CA . 27783 1 565 . 1 . 1 221 221 LEU CB C 13 44.7907 . . 1 . . . . . 221 L CB . 27783 1 566 . 1 . 1 221 221 LEU N N 15 121.8980 . . 1 . . . . . 221 L N . 27783 1 567 . 1 . 1 222 222 ARG H H 1 8.3421 . . 1 . . . . . 222 R HN . 27783 1 568 . 1 . 1 222 222 ARG C C 13 172.1119 . . 1 . . . . . 222 R CO . 27783 1 569 . 1 . 1 222 222 ARG CA C 13 55.4761 . . 1 . . . . . 222 R CA . 27783 1 570 . 1 . 1 222 222 ARG CB C 13 27.3619 . . 1 . . . . . 222 R CB . 27783 1 571 . 1 . 1 222 222 ARG N N 15 121.9033 . . 1 . . . . . 222 R N . 27783 1 572 . 1 . 1 223 223 LEU H H 1 9.3705 . . 1 . . . . . 223 L HN . 27783 1 573 . 1 . 1 223 223 LEU C C 13 175.1115 . . 1 . . . . . 223 L CO . 27783 1 574 . 1 . 1 223 223 LEU CA C 13 54.7062 . . 1 . . . . . 223 L CA . 27783 1 575 . 1 . 1 223 223 LEU CB C 13 44.5005 . . 1 . . . . . 223 L CB . 27783 1 576 . 1 . 1 223 223 LEU N N 15 118.9216 . . 1 . . . . . 223 L N . 27783 1 577 . 1 . 1 224 224 THR H H 1 9.1063 . . 1 . . . . . 224 T HN . 27783 1 578 . 1 . 1 224 224 THR C C 13 174.2216 . . 1 . . . . . 224 T CO . 27783 1 579 . 1 . 1 224 224 THR CA C 13 61.6595 . . 1 . . . . . 224 T CA . 27783 1 580 . 1 . 1 224 224 THR CB C 13 70.0539 . . 1 . . . . . 224 T CB . 27783 1 581 . 1 . 1 224 224 THR N N 15 116.5866 . . 1 . . . . . 224 T N . 27783 1 582 . 1 . 1 225 225 ALA H H 1 8.0486 . . 1 . . . . . 225 A HN . 27783 1 583 . 1 . 1 225 225 ALA C C 13 176.8068 . . 1 . . . . . 225 A CO . 27783 1 584 . 1 . 1 225 225 ALA CA C 13 54.8480 . . 1 . . . . . 225 A CA . 27783 1 585 . 1 . 1 225 225 ALA CB C 13 18.5654 . . 1 . . . . . 225 A CB . 27783 1 586 . 1 . 1 225 225 ALA N N 15 129.9950 . . 1 . . . . . 225 A N . 27783 1 587 . 1 . 1 226 226 ASP H H 1 8.0545 . . 1 . . . . . 226 D HN . 27783 1 588 . 1 . 1 226 226 ASP C C 13 178.3963 . . 1 . . . . . 226 D CO . 27783 1 589 . 1 . 1 226 226 ASP CA C 13 52.4594 . . 1 . . . . . 226 D CA . 27783 1 590 . 1 . 1 226 226 ASP CB C 13 42.1055 . . 1 . . . . . 226 D CB . 27783 1 591 . 1 . 1 226 226 ASP N N 15 114.1468 . . 1 . . . . . 226 D N . 27783 1 592 . 1 . 1 227 227 THR H H 1 8.4282 . . 1 . . . . . 227 T HN . 27783 1 593 . 1 . 1 227 227 THR C C 13 173.8415 . . 1 . . . . . 227 T CO . 27783 1 594 . 1 . 1 227 227 THR CA C 13 63.0010 . . 1 . . . . . 227 T CA . 27783 1 595 . 1 . 1 227 227 THR CB C 13 67.8965 . . 1 . . . . . 227 T CB . 27783 1 596 . 1 . 1 227 227 THR N N 15 115.8616 . . 1 . . . . . 227 T N . 27783 1 597 . 1 . 1 228 228 ARG H H 1 8.7466 . . 1 . . . . . 228 R HN . 27783 1 598 . 1 . 1 228 228 ARG C C 13 176.5814 . . 1 . . . . . 228 R CO . 27783 1 599 . 1 . 1 228 228 ARG CA C 13 55.3419 . . 1 . . . . . 228 R CA . 27783 1 600 . 1 . 1 228 228 ARG CB C 13 29.8502 . . 1 . . . . . 228 R CB . 27783 1 601 . 1 . 1 228 228 ARG N N 15 119.6486 . . 1 . . . . . 228 R N . 27783 1 602 . 1 . 1 229 229 ALA H H 1 7.2009 . . 1 . . . . . 229 A HN . 27783 1 603 . 1 . 1 229 229 ALA C C 13 177.5068 . . 1 . . . . . 229 A CO . 27783 1 604 . 1 . 1 229 229 ALA CA C 13 51.8716 . . 1 . . . . . 229 A CA . 27783 1 605 . 1 . 1 229 229 ALA CB C 13 19.0367 . . 1 . . . . . 229 A CB . 27783 1 606 . 1 . 1 229 229 ALA N N 15 123.8391 . . 1 . . . . . 229 A N . 27783 1 607 . 1 . 1 230 230 ALA H H 1 8.3725 . . 1 . . . . . 230 A HN . 27783 1 608 . 1 . 1 230 230 ALA C C 13 176.8621 . . 1 . . . . . 230 A CO . 27783 1 609 . 1 . 1 230 230 ALA CA C 13 51.1777 . . 1 . . . . . 230 A CA . 27783 1 610 . 1 . 1 230 230 ALA CB C 13 18.5894 . . 1 . . . . . 230 A CB . 27783 1 611 . 1 . 1 230 230 ALA N N 15 126.4729 . . 1 . . . . . 230 A N . 27783 1 612 . 1 . 1 231 231 ALA H H 1 8.1145 . . 1 . . . . . 231 A HN . 27783 1 613 . 1 . 1 231 231 ALA C C 13 177.7891 . . 1 . . . . . 231 A CO . 27783 1 614 . 1 . 1 231 231 ALA CA C 13 51.3716 . . 1 . . . . . 231 A CA . 27783 1 615 . 1 . 1 231 231 ALA CB C 13 19.4790 . . 1 . . . . . 231 A CB . 27783 1 616 . 1 . 1 231 231 ALA N N 15 123.5925 . . 1 . . . . . 231 A N . 27783 1 617 . 1 . 1 232 232 VAL H H 1 9.6495 . . 1 . . . . . 232 V HN . 27783 1 618 . 1 . 1 232 232 VAL C C 13 174.3320 . . 1 . . . . . 232 V CO . 27783 1 619 . 1 . 1 232 232 VAL CA C 13 58.6712 . . 1 . . . . . 232 V CA . 27783 1 620 . 1 . 1 232 232 VAL CB C 13 33.3193 . . 1 . . . . . 232 V CB . 27783 1 621 . 1 . 1 232 232 VAL N N 15 122.8877 . . 1 . . . . . 232 V N . 27783 1 622 . 1 . 1 236 236 PRO C C 13 176.8458 . . 1 . . . . . 236 P CO . 27783 1 623 . 1 . 1 236 236 PRO CA C 13 63.4225 . . 1 . . . . . 236 P CA . 27783 1 624 . 1 . 1 236 236 PRO CB C 13 33.2838 . . 1 . . . . . 236 P CB . 27783 1 625 . 1 . 1 237 237 VAL H H 1 8.4675 . . 1 . . . . . 237 V HN . 27783 1 626 . 1 . 1 237 237 VAL C C 13 175.8150 . . 1 . . . . . 237 V CO . 27783 1 627 . 1 . 1 237 237 VAL CA C 13 65.0155 . . 1 . . . . . 237 V CA . 27783 1 628 . 1 . 1 237 237 VAL CB C 13 31.2851 . . 1 . . . . . 237 V CB . 27783 1 629 . 1 . 1 237 237 VAL N N 15 121.3027 . . 1 . . . . . 237 V N . 27783 1 630 . 1 . 1 238 238 LEU H H 1 7.4941 . . 1 . . . . . 238 L HN . 27783 1 631 . 1 . 1 238 238 LEU C C 13 176.6237 . . 1 . . . . . 238 L CO . 27783 1 632 . 1 . 1 238 238 LEU CA C 13 52.3284 . . 1 . . . . . 238 L CA . 27783 1 633 . 1 . 1 238 238 LEU CB C 13 40.3126 . . 1 . . . . . 238 L CB . 27783 1 634 . 1 . 1 238 238 LEU N N 15 118.9355 . . 1 . . . . . 238 L N . 27783 1 635 . 1 . 1 239 239 ASN H H 1 8.1380 . . 1 . . . . . 239 N HN . 27783 1 636 . 1 . 1 239 239 ASN C C 13 175.8178 . . 1 . . . . . 239 N CO . 27783 1 637 . 1 . 1 239 239 ASN CA C 13 50.4906 . . 1 . . . . . 239 N CA . 27783 1 638 . 1 . 1 239 239 ASN CB C 13 38.1281 . . 1 . . . . . 239 N CB . 27783 1 639 . 1 . 1 239 239 ASN N N 15 122.0439 . . 1 . . . . . 239 N N . 27783 1 640 . 1 . 1 240 240 PRO C C 13 178.1077 . . 1 . . . . . 240 P CO . 27783 1 641 . 1 . 1 240 240 PRO CA C 13 63.8037 . . 1 . . . . . 240 P CA . 27783 1 642 . 1 . 1 240 240 PRO CB C 13 31.5636 . . 1 . . . . . 240 P CB . 27783 1 643 . 1 . 1 241 241 GLN H H 1 8.0569 . . 1 . . . . . 241 Q HN . 27783 1 644 . 1 . 1 241 241 GLN C C 13 178.4281 . . 1 . . . . . 241 Q CO . 27783 1 645 . 1 . 1 241 241 GLN CA C 13 57.9373 . . 1 . . . . . 241 Q CA . 27783 1 646 . 1 . 1 241 241 GLN CB C 13 29.7499 . . 1 . . . . . 241 Q CB . 27783 1 647 . 1 . 1 241 241 GLN N N 15 114.3650 . . 1 . . . . . 241 Q N . 27783 1 648 . 1 . 1 242 242 THR H H 1 6.9560 . . 1 . . . . . 242 T HN . 27783 1 649 . 1 . 1 242 242 THR C C 13 175.9607 . . 1 . . . . . 242 T CO . 27783 1 650 . 1 . 1 242 242 THR CA C 13 59.9513 . . 1 . . . . . 242 T CA . 27783 1 651 . 1 . 1 242 242 THR CB C 13 70.6321 . . 1 . . . . . 242 T CB . 27783 1 652 . 1 . 1 242 242 THR N N 15 103.2796 . . 1 . . . . . 242 T N . 27783 1 653 . 1 . 1 243 243 ASN H H 1 8.9796 . . 1 . . . . . 243 N HN . 27783 1 654 . 1 . 1 243 243 ASN C C 13 173.0309 . . 1 . . . . . 243 N CO . 27783 1 655 . 1 . 1 243 243 ASN CA C 13 54.3302 . . 1 . . . . . 243 N CA . 27783 1 656 . 1 . 1 243 243 ASN CB C 13 37.3770 . . 1 . . . . . 243 N CB . 27783 1 657 . 1 . 1 243 243 ASN N N 15 120.3366 . . 1 . . . . . 243 N N . 27783 1 658 . 1 . 1 244 244 ALA H H 1 7.8480 . . 1 . . . . . 244 A HN . 27783 1 659 . 1 . 1 244 244 ALA C C 13 174.3160 . . 1 . . . . . 244 A CO . 27783 1 660 . 1 . 1 244 244 ALA CA C 13 49.6546 . . 1 . . . . . 244 A CA . 27783 1 661 . 1 . 1 244 244 ALA CB C 13 18.7769 . . 1 . . . . . 244 A CB . 27783 1 662 . 1 . 1 244 244 ALA N N 15 119.7164 . . 1 . . . . . 244 A N . 27783 1 663 . 1 . 1 247 247 PRO C C 13 176.6895 . . 1 . . . . . 247 P CO . 27783 1 664 . 1 . 1 247 247 PRO CA C 13 63.3500 . . 1 . . . . . 247 P CA . 27783 1 665 . 1 . 1 247 247 PRO CB C 13 31.2995 . . 1 . . . . . 247 P CB . 27783 1 666 . 1 . 1 248 248 LEU H H 1 8.4998 . . 1 . . . . . 248 L HN . 27783 1 667 . 1 . 1 248 248 LEU C C 13 178.6567 . . 1 . . . . . 248 L CO . 27783 1 668 . 1 . 1 248 248 LEU CA C 13 53.4284 . . 1 . . . . . 248 L CA . 27783 1 669 . 1 . 1 248 248 LEU CB C 13 43.2525 . . 1 . . . . . 248 L CB . 27783 1 670 . 1 . 1 248 248 LEU N N 15 124.0763 . . 1 . . . . . 248 L N . 27783 1 671 . 1 . 1 249 249 GLY H H 1 8.7064 . . 1 . . . . . 249 G HN . 27783 1 672 . 1 . 1 249 249 GLY C C 13 172.6439 . . 1 . . . . . 249 G CO . 27783 1 673 . 1 . 1 249 249 GLY CA C 13 47.6169 . . 1 . . . . . 249 G CA . 27783 1 674 . 1 . 1 249 249 GLY N N 15 109.0906 . . 1 . . . . . 249 G N . 27783 1 675 . 1 . 1 250 250 GLY H H 1 8.5673 . . 1 . . . . . 250 G HN . 27783 1 676 . 1 . 1 250 250 GLY C C 13 172.9158 . . 1 . . . . . 250 G CO . 27783 1 677 . 1 . 1 250 250 GLY CA C 13 43.3053 . . 1 . . . . . 250 G CA . 27783 1 678 . 1 . 1 250 250 GLY N N 15 104.8573 . . 1 . . . . . 250 G N . 27783 1 679 . 1 . 1 251 251 ALA H H 1 7.6802 . . 1 . . . . . 251 A HN . 27783 1 680 . 1 . 1 251 251 ALA C C 13 178.1039 . . 1 . . . . . 251 A CO . 27783 1 681 . 1 . 1 251 251 ALA CA C 13 49.7215 . . 1 . . . . . 251 A CA . 27783 1 682 . 1 . 1 251 251 ALA CB C 13 18.3285 . . 1 . . . . . 251 A CB . 27783 1 683 . 1 . 1 251 251 ALA N N 15 124.3559 . . 1 . . . . . 251 A N . 27783 1 684 . 1 . 1 252 252 VAL H H 1 9.6882 . . 1 . . . . . 252 V HN . 27783 1 685 . 1 . 1 252 252 VAL C C 13 177.9048 . . 1 . . . . . 252 V CO . 27783 1 686 . 1 . 1 252 252 VAL CA C 13 64.6812 . . 1 . . . . . 252 V CA . 27783 1 687 . 1 . 1 252 252 VAL CB C 13 30.7702 . . 1 . . . . . 252 V CB . 27783 1 688 . 1 . 1 252 252 VAL N N 15 132.8416 . . 1 . . . . . 252 V N . 27783 1 689 . 1 . 1 253 253 LEU H H 1 9.2291 . . 1 . . . . . 253 L HN . 27783 1 690 . 1 . 1 253 253 LEU C C 13 177.0345 . . 1 . . . . . 253 L CO . 27783 1 691 . 1 . 1 253 253 LEU CA C 13 54.4714 . . 1 . . . . . 253 L CA . 27783 1 692 . 1 . 1 253 253 LEU CB C 13 41.4186 . . 1 . . . . . 253 L CB . 27783 1 693 . 1 . 1 253 253 LEU N N 15 117.1095 . . 1 . . . . . 253 L N . 27783 1 694 . 1 . 1 254 254 ARG H H 1 7.4840 . . 1 . . . . . 254 R HN . 27783 1 695 . 1 . 1 254 254 ARG C C 13 175.9692 . . 1 . . . . . 254 R CO . 27783 1 696 . 1 . 1 254 254 ARG CA C 13 57.6696 . . 1 . . . . . 254 R CA . 27783 1 697 . 1 . 1 254 254 ARG CB C 13 29.5815 . . 1 . . . . . 254 R CB . 27783 1 698 . 1 . 1 254 254 ARG N N 15 118.0396 . . 1 . . . . . 254 R N . 27783 1 699 . 1 . 1 255 255 ALA H H 1 7.6472 . . 1 . . . . . 255 A HN . 27783 1 700 . 1 . 1 255 255 ALA C C 13 176.9970 . . 1 . . . . . 255 A CO . 27783 1 701 . 1 . 1 255 255 ALA CA C 13 53.6992 . . 1 . . . . . 255 A CA . 27783 1 702 . 1 . 1 255 255 ALA CB C 13 18.4266 . . 1 . . . . . 255 A CB . 27783 1 703 . 1 . 1 255 255 ALA N N 15 128.6167 . . 1 . . . . . 255 A N . 27783 1 704 . 1 . 1 256 256 THR H H 1 8.2243 . . 1 . . . . . 256 T HN . 27783 1 705 . 1 . 1 256 256 THR C C 13 176.5365 . . 1 . . . . . 256 T CO . 27783 1 706 . 1 . 1 256 256 THR CA C 13 61.6645 . . 1 . . . . . 256 T CA . 27783 1 707 . 1 . 1 256 256 THR CB C 13 68.9197 . . 1 . . . . . 256 T CB . 27783 1 708 . 1 . 1 256 256 THR N N 15 123.4498 . . 1 . . . . . 256 T N . 27783 1 709 . 1 . 1 257 257 SER H H 1 8.4610 . . 1 . . . . . 257 S HN . 27783 1 710 . 1 . 1 257 257 SER CA C 13 56.2280 . . 1 . . . . . 257 S CA . 27783 1 711 . 1 . 1 257 257 SER CB C 13 64.5349 . . 1 . . . . . 257 S CB . 27783 1 712 . 1 . 1 257 257 SER N N 15 120.9593 . . 1 . . . . . 257 S N . 27783 1 713 . 1 . 1 299 299 PRO C C 13 178.5875 . . 1 . . . . . 299 P CO . 27783 1 714 . 1 . 1 299 299 PRO CA C 13 65.8733 . . 1 . . . . . 299 P CA . 27783 1 715 . 1 . 1 299 299 PRO CB C 13 31.4649 . . 1 . . . . . 299 P CB . 27783 1 716 . 1 . 1 300 300 ASP H H 1 8.8767 . . 1 . . . . . 300 D HN . 27783 1 717 . 1 . 1 300 300 ASP C C 13 178.9801 . . 1 . . . . . 300 D CO . 27783 1 718 . 1 . 1 300 300 ASP CA C 13 56.8268 . . 1 . . . . . 300 D CA . 27783 1 719 . 1 . 1 300 300 ASP CB C 13 39.5214 . . 1 . . . . . 300 D CB . 27783 1 720 . 1 . 1 300 300 ASP N N 15 115.6978 . . 1 . . . . . 300 D N . 27783 1 721 . 1 . 1 301 301 LEU H H 1 7.3516 . . 1 . . . . . 301 L HN . 27783 1 722 . 1 . 1 301 301 LEU C C 13 179.0024 . . 1 . . . . . 301 L CO . 27783 1 723 . 1 . 1 301 301 LEU CA C 13 56.3009 . . 1 . . . . . 301 L CA . 27783 1 724 . 1 . 1 301 301 LEU CB C 13 41.0828 . . 1 . . . . . 301 L CB . 27783 1 725 . 1 . 1 301 301 LEU N N 15 121.6064 . . 1 . . . . . 301 L N . 27783 1 726 . 1 . 1 302 302 ARG H H 1 7.8769 . . 1 . . . . . 302 R HN . 27783 1 727 . 1 . 1 302 302 ARG C C 13 178.1494 . . 1 . . . . . 302 R CO . 27783 1 728 . 1 . 1 302 302 ARG CA C 13 60.7255 . . 1 . . . . . 302 R CA . 27783 1 729 . 1 . 1 302 302 ARG CB C 13 28.9252 . . 1 . . . . . 302 R CB . 27783 1 730 . 1 . 1 302 302 ARG N N 15 120.0290 . . 1 . . . . . 302 R N . 27783 1 731 . 1 . 1 303 303 THR H H 1 8.0056 . . 1 . . . . . 303 T HN . 27783 1 732 . 1 . 1 303 303 THR C C 13 176.9753 . . 1 . . . . . 303 T CO . 27783 1 733 . 1 . 1 303 303 THR CA C 13 66.1293 . . 1 . . . . . 303 T CA . 27783 1 734 . 1 . 1 303 303 THR CB C 13 68.1175 . . 1 . . . . . 303 T CB . 27783 1 735 . 1 . 1 303 303 THR N N 15 114.8021 . . 1 . . . . . 303 T N . 27783 1 736 . 1 . 1 304 304 THR H H 1 7.5297 . . 1 . . . . . 304 T HN . 27783 1 737 . 1 . 1 304 304 THR C C 13 175.8205 . . 1 . . . . . 304 T CO . 27783 1 738 . 1 . 1 304 304 THR CA C 13 67.1691 . . 1 . . . . . 304 T CA . 27783 1 739 . 1 . 1 304 304 THR CB C 13 67.7744 . . 1 . . . . . 304 T CB . 27783 1 740 . 1 . 1 304 304 THR N N 15 119.9734 . . 1 . . . . . 304 T N . 27783 1 741 . 1 . 1 305 305 LEU H H 1 8.1312 . . 1 . . . . . 305 L HN . 27783 1 742 . 1 . 1 305 305 LEU C C 13 178.6546 . . 1 . . . . . 305 L CO . 27783 1 743 . 1 . 1 305 305 LEU CA C 13 57.8123 . . 1 . . . . . 305 L CA . 27783 1 744 . 1 . 1 305 305 LEU CB C 13 40.4325 . . 1 . . . . . 305 L CB . 27783 1 745 . 1 . 1 305 305 LEU N N 15 121.3277 . . 1 . . . . . 305 L N . 27783 1 746 . 1 . 1 306 306 GLU H H 1 8.2451 . . 1 . . . . . 306 E HN . 27783 1 747 . 1 . 1 306 306 GLU C C 13 179.5794 . . 1 . . . . . 306 E CO . 27783 1 748 . 1 . 1 306 306 GLU CA C 13 60.0802 . . 1 . . . . . 306 E CA . 27783 1 749 . 1 . 1 306 306 GLU CB C 13 28.9188 . . 1 . . . . . 306 E CB . 27783 1 750 . 1 . 1 306 306 GLU N N 15 120.3133 . . 1 . . . . . 306 E N . 27783 1 751 . 1 . 1 307 307 TYR H H 1 8.0516 . . 1 . . . . . 307 Y HN . 27783 1 752 . 1 . 1 307 307 TYR C C 13 178.6774 . . 1 . . . . . 307 Y CO . 27783 1 753 . 1 . 1 307 307 TYR CA C 13 60.7920 . . 1 . . . . . 307 Y CA . 27783 1 754 . 1 . 1 307 307 TYR CB C 13 37.0112 . . 1 . . . . . 307 Y CB . 27783 1 755 . 1 . 1 307 307 TYR N N 15 120.2279 . . 1 . . . . . 307 Y N . 27783 1 756 . 1 . 1 308 308 LEU H H 1 8.5647 . . 1 . . . . . 308 L HN . 27783 1 757 . 1 . 1 308 308 LEU C C 13 179.2000 . . 1 . . . . . 308 L CO . 27783 1 758 . 1 . 1 308 308 LEU CA C 13 58.0597 . . 1 . . . . . 308 L CA . 27783 1 759 . 1 . 1 308 308 LEU CB C 13 40.8087 . . 1 . . . . . 308 L CB . 27783 1 760 . 1 . 1 308 308 LEU N N 15 121.0277 . . 1 . . . . . 308 L N . 27783 1 761 . 1 . 1 309 309 GLY H H 1 8.8408 . . 1 . . . . . 309 G HN . 27783 1 762 . 1 . 1 309 309 GLY C C 13 176.1626 . . 1 . . . . . 309 G CO . 27783 1 763 . 1 . 1 309 309 GLY CA C 13 47.0999 . . 1 . . . . . 309 G CA . 27783 1 764 . 1 . 1 309 309 GLY N N 15 107.3744 . . 1 . . . . . 309 G N . 27783 1 765 . 1 . 1 310 310 ARG H H 1 7.9503 . . 1 . . . . . 310 R HN . 27783 1 766 . 1 . 1 310 310 ARG C C 13 179.7541 . . 1 . . . . . 310 R CO . 27783 1 767 . 1 . 1 310 310 ARG CA C 13 59.6012 . . 1 . . . . . 310 R CA . 27783 1 768 . 1 . 1 310 310 ARG CB C 13 29.0803 . . 1 . . . . . 310 R CB . 27783 1 769 . 1 . 1 310 310 ARG N N 15 123.3378 . . 1 . . . . . 310 R N . 27783 1 770 . 1 . 1 311 311 GLU H H 1 8.1505 . . 1 . . . . . 311 E HN . 27783 1 771 . 1 . 1 311 311 GLU C C 13 179.7423 . . 1 . . . . . 311 E CO . 27783 1 772 . 1 . 1 311 311 GLU CA C 13 58.3262 . . 1 . . . . . 311 E CA . 27783 1 773 . 1 . 1 311 311 GLU CB C 13 28.1988 . . 1 . . . . . 311 E CB . 27783 1 774 . 1 . 1 311 311 GLU N N 15 121.1271 . . 1 . . . . . 311 E N . 27783 1 775 . 1 . 1 312 312 LEU H H 1 9.2035 . . 1 . . . . . 312 L HN . 27783 1 776 . 1 . 1 312 312 LEU C C 13 176.0681 . . 1 . . . . . 312 L CO . 27783 1 777 . 1 . 1 312 312 LEU CA C 13 57.6796 . . 1 . . . . . 312 L CA . 27783 1 778 . 1 . 1 312 312 LEU CB C 13 40.6087 . . 1 . . . . . 312 L CB . 27783 1 779 . 1 . 1 312 312 LEU N N 15 120.7048 . . 1 . . . . . 312 L N . 27783 1 780 . 1 . 1 313 313 SER H H 1 8.0662 . . 1 . . . . . 313 S HN . 27783 1 781 . 1 . 1 313 313 SER C C 13 173.0621 . . 1 . . . . . 313 S CO . 27783 1 782 . 1 . 1 313 313 SER CA C 13 62.3564 . . 1 . . . . . 313 S CA . 27783 1 783 . 1 . 1 313 313 SER N N 15 114.7684 . . 1 . . . . . 313 S N . 27783 1 784 . 1 . 1 337 337 ARG C C 13 179.6995 . . 1 . . . . . 337 R CO . 27783 1 785 . 1 . 1 337 337 ARG CA C 13 59.3636 . . 1 . . . . . 337 R CA . 27783 1 786 . 1 . 1 337 337 ARG CB C 13 29.8018 . . 1 . . . . . 337 R CB . 27783 1 787 . 1 . 1 338 338 VAL H H 1 7.8850 . . 1 . . . . . 338 V HN . 27783 1 788 . 1 . 1 338 338 VAL CA C 13 65.8411 . . 1 . . . . . 338 V CA . 27783 1 789 . 1 . 1 338 338 VAL CB C 13 30.5458 . . 1 . . . . . 338 V CB . 27783 1 790 . 1 . 1 338 338 VAL N N 15 120.9158 . . 1 . . . . . 338 V N . 27783 1 791 . 1 . 1 339 339 ALA H H 1 8.7076 . . 1 . . . . . 339 A HN . 27783 1 792 . 1 . 1 339 339 ALA C C 13 180.2871 . . 1 . . . . . 339 A CO . 27783 1 793 . 1 . 1 339 339 ALA CA C 13 54.9935 . . 1 . . . . . 339 A CA . 27783 1 794 . 1 . 1 339 339 ALA CB C 13 17.4594 . . 1 . . . . . 339 A CB . 27783 1 795 . 1 . 1 339 339 ALA N N 15 121.7288 . . 1 . . . . . 339 A N . 27783 1 796 . 1 . 1 340 340 LEU H H 1 7.8196 . . 1 . . . . . 340 L HN . 27783 1 797 . 1 . 1 340 340 LEU C C 13 179.2419 . . 1 . . . . . 340 L CO . 27783 1 798 . 1 . 1 340 340 LEU CA C 13 57.3378 . . 1 . . . . . 340 L CA . 27783 1 799 . 1 . 1 340 340 LEU CB C 13 41.2473 . . 1 . . . . . 340 L CB . 27783 1 800 . 1 . 1 340 340 LEU N N 15 118.1137 . . 1 . . . . . 340 L N . 27783 1 801 . 1 . 1 341 341 ALA H H 1 7.4738 . . 1 . . . . . 341 A HN . 27783 1 802 . 1 . 1 341 341 ALA C C 13 180.4213 . . 1 . . . . . 341 A CO . 27783 1 803 . 1 . 1 341 341 ALA CA C 13 54.1419 . . 1 . . . . . 341 A CA . 27783 1 804 . 1 . 1 341 341 ALA CB C 13 18.4023 . . 1 . . . . . 341 A CB . 27783 1 805 . 1 . 1 341 341 ALA N N 15 120.9814 . . 1 . . . . . 341 A N . 27783 1 806 . 1 . 1 342 342 ALA H H 1 8.4229 . . 1 . . . . . 342 A HN . 27783 1 807 . 1 . 1 342 342 ALA C C 13 177.9199 . . 1 . . . . . 342 A CO . 27783 1 808 . 1 . 1 342 342 ALA CA C 13 53.4881 . . 1 . . . . . 342 A CA . 27783 1 809 . 1 . 1 342 342 ALA CB C 13 17.2990 . . 1 . . . . . 342 A CB . 27783 1 810 . 1 . 1 342 342 ALA N N 15 118.2307 . . 1 . . . . . 342 A N . 27783 1 811 . 1 . 1 343 343 ALA H H 1 7.4323 . . 1 . . . . . 343 A HN . 27783 1 812 . 1 . 1 343 343 ALA C C 13 178.1608 . . 1 . . . . . 343 A CO . 27783 1 813 . 1 . 1 343 343 ALA CA C 13 53.4052 . . 1 . . . . . 343 A CA . 27783 1 814 . 1 . 1 343 343 ALA CB C 13 17.7000 . . 1 . . . . . 343 A CB . 27783 1 815 . 1 . 1 343 343 ALA N N 15 118.0639 . . 1 . . . . . 343 A N . 27783 1 816 . 1 . 1 344 344 HIS H H 1 7.4951 . . 1 . . . . . 344 H HN . 27783 1 817 . 1 . 1 344 344 HIS C C 13 174.8889 . . 1 . . . . . 344 H CO . 27783 1 818 . 1 . 1 344 344 HIS CA C 13 55.3510 . . 1 . . . . . 344 H CA . 27783 1 819 . 1 . 1 344 344 HIS CB C 13 29.6352 . . 1 . . . . . 344 H CB . 27783 1 820 . 1 . 1 344 344 HIS N N 15 115.1440 . . 1 . . . . . 344 H N . 27783 1 821 . 1 . 1 348 348 PRO C C 13 177.8991 . . 1 . . . . . 348 P CO . 27783 1 822 . 1 . 1 348 348 PRO CA C 13 64.7862 . . 1 . . . . . 348 P CA . 27783 1 823 . 1 . 1 348 348 PRO CB C 13 29.9850 . . 1 . . . . . 348 P CB . 27783 1 824 . 1 . 1 349 349 HIS H H 1 8.0697 . . 1 . . . . . 349 H HN . 27783 1 825 . 1 . 1 349 349 HIS C C 13 178.3574 . . 1 . . . . . 349 H CO . 27783 1 826 . 1 . 1 349 349 HIS CA C 13 60.0764 . . 1 . . . . . 349 H CA . 27783 1 827 . 1 . 1 349 349 HIS CB C 13 30.4731 . . 1 . . . . . 349 H CB . 27783 1 828 . 1 . 1 349 349 HIS N N 15 114.1795 . . 1 . . . . . 349 H N . 27783 1 829 . 1 . 1 350 350 ASP H H 1 7.5362 . . 1 . . . . . 350 D HN . 27783 1 830 . 1 . 1 350 350 ASP C C 13 177.8049 . . 1 . . . . . 350 D CO . 27783 1 831 . 1 . 1 350 350 ASP CA C 13 56.3785 . . 1 . . . . . 350 D CA . 27783 1 832 . 1 . 1 350 350 ASP CB C 13 40.7561 . . 1 . . . . . 350 D CB . 27783 1 833 . 1 . 1 350 350 ASP N N 15 118.9724 . . 1 . . . . . 350 D N . 27783 1 834 . 1 . 1 351 351 THR H H 1 8.0284 . . 1 . . . . . 351 T HN . 27783 1 835 . 1 . 1 351 351 THR C C 13 176.3882 . . 1 . . . . . 351 T CO . 27783 1 836 . 1 . 1 351 351 THR CA C 13 65.4234 . . 1 . . . . . 351 T CA . 27783 1 837 . 1 . 1 351 351 THR CB C 13 69.0583 . . 1 . . . . . 351 T CB . 27783 1 838 . 1 . 1 351 351 THR N N 15 114.5644 . . 1 . . . . . 351 T N . 27783 1 839 . 1 . 1 352 352 LEU H H 1 8.1332 . . 1 . . . . . 352 L HN . 27783 1 840 . 1 . 1 352 352 LEU C C 13 176.1623 . . 1 . . . . . 352 L CO . 27783 1 841 . 1 . 1 352 352 LEU CA C 13 56.2260 . . 1 . . . . . 352 L CA . 27783 1 842 . 1 . 1 352 352 LEU CB C 13 39.6425 . . 1 . . . . . 352 L CB . 27783 1 843 . 1 . 1 352 352 LEU N N 15 115.6774 . . 1 . . . . . 352 L N . 27783 1 844 . 1 . 1 353 353 SER H H 1 7.1930 . . 1 . . . . . 353 S HN . 27783 1 845 . 1 . 1 353 353 SER C C 13 173.2825 . . 1 . . . . . 353 S CO . 27783 1 846 . 1 . 1 353 353 SER CA C 13 57.5197 . . 1 . . . . . 353 S CA . 27783 1 847 . 1 . 1 353 353 SER CB C 13 63.2990 . . 1 . . . . . 353 S CB . 27783 1 848 . 1 . 1 353 353 SER N N 15 109.5408 . . 1 . . . . . 353 S N . 27783 1 849 . 1 . 1 354 354 ASP H H 1 6.8869 . . 1 . . . . . 354 D HN . 27783 1 850 . 1 . 1 354 354 ASP C C 13 177.2446 . . 1 . . . . . 354 D CO . 27783 1 851 . 1 . 1 354 354 ASP CA C 13 51.8449 . . 1 . . . . . 354 D CA . 27783 1 852 . 1 . 1 354 354 ASP CB C 13 42.1307 . . 1 . . . . . 354 D CB . 27783 1 853 . 1 . 1 354 354 ASP N N 15 123.5096 . . 1 . . . . . 354 D N . 27783 1 854 . 1 . 1 355 355 PRO C C 13 179.4735 . . 1 . . . . . 355 P CO . 27783 1 855 . 1 . 1 355 355 PRO CA C 13 64.7064 . . 1 . . . . . 355 P CA . 27783 1 856 . 1 . 1 355 355 PRO CB C 13 31.3510 . . 1 . . . . . 355 P CB . 27783 1 857 . 1 . 1 356 356 ALA H H 1 8.7021 . . 1 . . . . . 356 A HN . 27783 1 858 . 1 . 1 356 356 ALA C C 13 179.9509 . . 1 . . . . . 356 A CO . 27783 1 859 . 1 . 1 356 356 ALA CA C 13 53.8484 . . 1 . . . . . 356 A CA . 27783 1 860 . 1 . 1 356 356 ALA CB C 13 17.6762 . . 1 . . . . . 356 A CB . 27783 1 861 . 1 . 1 356 356 ALA N N 15 120.8000 . . 1 . . . . . 356 A N . 27783 1 862 . 1 . 1 357 357 LEU H H 1 7.6593 . . 1 . . . . . 357 L HN . 27783 1 863 . 1 . 1 357 357 LEU C C 13 177.4427 . . 1 . . . . . 357 L CO . 27783 1 864 . 1 . 1 357 357 LEU CA C 13 55.6679 . . 1 . . . . . 357 L CA . 27783 1 865 . 1 . 1 357 357 LEU CB C 13 41.4410 . . 1 . . . . . 357 L CB . 27783 1 866 . 1 . 1 357 357 LEU N N 15 117.7689 . . 1 . . . . . 357 L N . 27783 1 867 . 1 . 1 358 358 ASP H H 1 7.5281 . . 1 . . . . . 358 D HN . 27783 1 868 . 1 . 1 358 358 ASP C C 13 175.9422 . . 1 . . . . . 358 D CO . 27783 1 869 . 1 . 1 358 358 ASP CA C 13 54.3760 . . 1 . . . . . 358 D CA . 27783 1 870 . 1 . 1 358 358 ASP CB C 13 39.4502 . . 1 . . . . . 358 D CB . 27783 1 871 . 1 . 1 358 358 ASP N N 15 114.8013 . . 1 . . . . . 358 D N . 27783 1 872 . 1 . 1 359 359 LEU H H 1 8.4029 . . 1 . . . . . 359 L HN . 27783 1 873 . 1 . 1 359 359 LEU C C 13 180.8508 . . 1 . . . . . 359 L CO . 27783 1 874 . 1 . 1 359 359 LEU CA C 13 57.5753 . . 1 . . . . . 359 L CA . 27783 1 875 . 1 . 1 359 359 LEU CB C 13 41.3929 . . 1 . . . . . 359 L CB . 27783 1 876 . 1 . 1 359 359 LEU N N 15 120.3473 . . 1 . . . . . 359 L N . 27783 1 877 . 1 . 1 360 360 LEU H H 1 8.8585 . . 1 . . . . . 360 L HN . 27783 1 878 . 1 . 1 360 360 LEU C C 13 178.6635 . . 1 . . . . . 360 L CO . 27783 1 879 . 1 . 1 360 360 LEU CA C 13 58.7354 . . 1 . . . . . 360 L CA . 27783 1 880 . 1 . 1 360 360 LEU CB C 13 41.4986 . . 1 . . . . . 360 L CB . 27783 1 881 . 1 . 1 360 360 LEU N N 15 119.8539 . . 1 . . . . . 360 L N . 27783 1 882 . 1 . 1 361 361 GLY H H 1 7.9935 . . 1 . . . . . 361 G HN . 27783 1 883 . 1 . 1 361 361 GLY C C 13 177.9501 . . 1 . . . . . 361 G CO . 27783 1 884 . 1 . 1 361 361 GLY CA C 13 46.8020 . . 1 . . . . . 361 G CA . 27783 1 885 . 1 . 1 361 361 GLY N N 15 109.0529 . . 1 . . . . . 361 G N . 27783 1 886 . 1 . 1 362 362 LEU H H 1 7.8945 . . 1 . . . . . 362 L HN . 27783 1 887 . 1 . 1 362 362 LEU C C 13 175.1583 . . 1 . . . . . 362 L CO . 27783 1 888 . 1 . 1 362 362 LEU CA C 13 57.8503 . . 1 . . . . . 362 L CA . 27783 1 889 . 1 . 1 362 362 LEU CB C 13 41.7130 . . 1 . . . . . 362 L CB . 27783 1 890 . 1 . 1 362 362 LEU N N 15 123.5515 . . 1 . . . . . 362 L N . 27783 1 891 . 1 . 1 363 363 MET H H 1 6.0234 . . 1 . . . . . 363 M HN . 27783 1 892 . 1 . 1 363 363 MET C C 13 175.2018 . . 1 . . . . . 363 M CO . 27783 1 893 . 1 . 1 363 363 MET CA C 13 51.6555 . . 1 . . . . . 363 M CA . 27783 1 894 . 1 . 1 363 363 MET CB C 13 32.7726 . . 1 . . . . . 363 M CB . 27783 1 895 . 1 . 1 363 363 MET N N 15 108.6170 . . 1 . . . . . 363 M N . 27783 1 896 . 1 . 1 364 364 ARG H H 1 8.0994 . . 1 . . . . . 364 R HN . 27783 1 897 . 1 . 1 364 364 ARG C C 13 175.9494 . . 1 . . . . . 364 R CO . 27783 1 898 . 1 . 1 364 364 ARG CA C 13 56.7874 . . 1 . . . . . 364 R CA . 27783 1 899 . 1 . 1 364 364 ARG CB C 13 27.4921 . . 1 . . . . . 364 R CB . 27783 1 900 . 1 . 1 364 364 ARG N N 15 119.3295 . . 1 . . . . . 364 R N . 27783 1 901 . 1 . 1 365 365 ALA H H 1 8.2739 . . 1 . . . . . 365 A HN . 27783 1 902 . 1 . 1 365 365 ALA C C 13 176.6444 . . 1 . . . . . 365 A CO . 27783 1 903 . 1 . 1 365 365 ALA CA C 13 50.9644 . . 1 . . . . . 365 A CA . 27783 1 904 . 1 . 1 365 365 ALA CB C 13 22.2325 . . 1 . . . . . 365 A CB . 27783 1 905 . 1 . 1 365 365 ALA N N 15 121.2577 . . 1 . . . . . 365 A N . 27783 1 906 . 1 . 1 366 366 GLY H H 1 9.2629 . . 1 . . . . . 366 G HN . 27783 1 907 . 1 . 1 366 366 GLY C C 13 175.2109 . . 1 . . . . . 366 G CO . 27783 1 908 . 1 . 1 366 366 GLY CA C 13 45.5051 . . 1 . . . . . 366 G CA . 27783 1 909 . 1 . 1 366 366 GLY N N 15 106.6257 . . 1 . . . . . 366 G N . 27783 1 910 . 1 . 1 367 367 GLY H H 1 8.1992 . . 1 . . . . . 367 G HN . 27783 1 911 . 1 . 1 367 367 GLY C C 13 170.8687 . . 1 . . . . . 367 G CO . 27783 1 912 . 1 . 1 367 367 GLY CA C 13 44.7225 . . 1 . . . . . 367 G CA . 27783 1 913 . 1 . 1 367 367 GLY N N 15 109.7469 . . 1 . . . . . 367 G N . 27783 1 914 . 1 . 1 368 368 LEU H H 1 8.7050 . . 1 . . . . . 368 L HN . 27783 1 915 . 1 . 1 368 368 LEU C C 13 174.4978 . . 1 . . . . . 368 L CO . 27783 1 916 . 1 . 1 368 368 LEU CA C 13 53.5190 . . 1 . . . . . 368 L CA . 27783 1 917 . 1 . 1 368 368 LEU CB C 13 46.3857 . . 1 . . . . . 368 L CB . 27783 1 918 . 1 . 1 368 368 LEU N N 15 122.8166 . . 1 . . . . . 368 L N . 27783 1 919 . 1 . 1 369 369 ILE H H 1 9.3549 . . 1 . . . . . 369 I HN . 27783 1 920 . 1 . 1 369 369 ILE C C 13 174.3672 . . 1 . . . . . 369 I CO . 27783 1 921 . 1 . 1 369 369 ILE CA C 13 59.8520 . . 1 . . . . . 369 I CA . 27783 1 922 . 1 . 1 369 369 ILE CB C 13 39.6775 . . 1 . . . . . 369 I CB . 27783 1 923 . 1 . 1 369 369 ILE N N 15 124.7085 . . 1 . . . . . 369 I N . 27783 1 924 . 1 . 1 370 370 LEU H H 1 9.0141 . . 1 . . . . . 370 L HN . 27783 1 925 . 1 . 1 370 370 LEU C C 13 175.2274 . . 1 . . . . . 370 L CO . 27783 1 926 . 1 . 1 370 370 LEU CA C 13 53.6853 . . 1 . . . . . 370 L CA . 27783 1 927 . 1 . 1 370 370 LEU CB C 13 43.1814 . . 1 . . . . . 370 L CB . 27783 1 928 . 1 . 1 370 370 LEU N N 15 125.4772 . . 1 . . . . . 370 L N . 27783 1 929 . 1 . 1 371 371 ARG H H 1 8.5017 . . 1 . . . . . 371 R HN . 27783 1 930 . 1 . 1 371 371 ARG C C 13 172.9127 . . 1 . . . . . 371 R CO . 27783 1 931 . 1 . 1 371 371 ARG CA C 13 55.4106 . . 1 . . . . . 371 R CA . 27783 1 932 . 1 . 1 371 371 ARG CB C 13 32.6088 . . 1 . . . . . 371 R CB . 27783 1 933 . 1 . 1 371 371 ARG N N 15 126.1885 . . 1 . . . . . 371 R N . 27783 1 934 . 1 . 1 372 372 PHE H H 1 8.3736 . . 1 . . . . . 372 F HN . 27783 1 935 . 1 . 1 372 372 PHE C C 13 176.2997 . . 1 . . . . . 372 F CO . 27783 1 936 . 1 . 1 372 372 PHE CA C 13 56.9091 . . 1 . . . . . 372 F CA . 27783 1 937 . 1 . 1 372 372 PHE CB C 13 43.3926 . . 1 . . . . . 372 F CB . 27783 1 938 . 1 . 1 372 372 PHE N N 15 119.2552 . . 1 . . . . . 372 F N . 27783 1 939 . 1 . 1 373 373 GLU H H 1 10.3697 . . 1 . . . . . 373 E HN . 27783 1 940 . 1 . 1 373 373 GLU C C 13 176.6415 . . 1 . . . . . 373 E CO . 27783 1 941 . 1 . 1 373 373 GLU CA C 13 56.8555 . . 1 . . . . . 373 E CA . 27783 1 942 . 1 . 1 373 373 GLU CB C 13 27.4731 . . 1 . . . . . 373 E CB . 27783 1 943 . 1 . 1 373 373 GLU N N 15 121.0473 . . 1 . . . . . 373 E N . 27783 1 944 . 1 . 1 374 374 GLY H H 1 8.7898 . . 1 . . . . . 374 G HN . 27783 1 945 . 1 . 1 374 374 GLY C C 13 174.1405 . . 1 . . . . . 374 G CO . 27783 1 946 . 1 . 1 374 374 GLY CA C 13 45.5235 . . 1 . . . . . 374 G CA . 27783 1 947 . 1 . 1 374 374 GLY N N 15 104.9671 . . 1 . . . . . 374 G N . 27783 1 948 . 1 . 1 375 375 ARG H H 1 8.2769 . . 1 . . . . . 375 R HN . 27783 1 949 . 1 . 1 375 375 ARG C C 13 174.0641 . . 1 . . . . . 375 R CO . 27783 1 950 . 1 . 1 375 375 ARG CA C 13 54.2623 . . 1 . . . . . 375 R CA . 27783 1 951 . 1 . 1 375 375 ARG CB C 13 32.4426 . . 1 . . . . . 375 R CB . 27783 1 952 . 1 . 1 375 375 ARG N N 15 119.7963 . . 1 . . . . . 375 R N . 27783 1 953 . 1 . 1 376 376 TRP H H 1 8.2670 . . 1 . . . . . 376 W HN . 27783 1 954 . 1 . 1 376 376 TRP C C 13 175.8734 . . 1 . . . . . 376 W CO . 27783 1 955 . 1 . 1 376 376 TRP CA C 13 53.0771 . . 1 . . . . . 376 W CA . 27783 1 956 . 1 . 1 376 376 TRP CB C 13 33.3835 . . 1 . . . . . 376 W CB . 27783 1 957 . 1 . 1 376 376 TRP N N 15 118.2866 . . 1 . . . . . 376 W N . 27783 1 958 . 1 . 1 377 377 GLN H H 1 9.4264 . . 1 . . . . . 377 Q HN . 27783 1 959 . 1 . 1 377 377 GLN C C 13 174.5430 . . 1 . . . . . 377 Q CO . 27783 1 960 . 1 . 1 377 377 GLN CA C 13 54.6540 . . 1 . . . . . 377 Q CA . 27783 1 961 . 1 . 1 377 377 GLN CB C 13 32.8585 . . 1 . . . . . 377 Q CB . 27783 1 962 . 1 . 1 377 377 GLN N N 15 118.6410 . . 1 . . . . . 377 Q N . 27783 1 963 . 1 . 1 378 378 THR H H 1 8.9084 . . 1 . . . . . 378 T HN . 27783 1 964 . 1 . 1 378 378 THR C C 13 173.9880 . . 1 . . . . . 378 T CO . 27783 1 965 . 1 . 1 378 378 THR CA C 13 59.4951 . . 1 . . . . . 378 T CA . 27783 1 966 . 1 . 1 378 378 THR CB C 13 71.6988 . . 1 . . . . . 378 T CB . 27783 1 967 . 1 . 1 378 378 THR N N 15 111.7453 . . 1 . . . . . 378 T N . 27783 1 968 . 1 . 1 379 379 LEU H H 1 8.9770 . . 1 . . . . . 379 L HN . 27783 1 969 . 1 . 1 379 379 LEU C C 13 176.8469 . . 1 . . . . . 379 L CO . 27783 1 970 . 1 . 1 379 379 LEU CA C 13 54.3187 . . 1 . . . . . 379 L CA . 27783 1 971 . 1 . 1 379 379 LEU CB C 13 45.8005 . . 1 . . . . . 379 L CB . 27783 1 972 . 1 . 1 379 379 LEU N N 15 120.4884 . . 1 . . . . . 379 L N . 27783 1 973 . 1 . 1 380 380 GLY H H 1 8.7484 . . 1 . . . . . 380 G HN . 27783 1 974 . 1 . 1 380 380 GLY C C 13 174.1648 . . 1 . . . . . 380 G CO . 27783 1 975 . 1 . 1 380 380 GLY CA C 13 45.3410 . . 1 . . . . . 380 G CA . 27783 1 976 . 1 . 1 380 380 GLY N N 15 108.1924 . . 1 . . . . . 380 G N . 27783 1 977 . 1 . 1 381 381 GLU H H 1 8.9297 . . 1 . . . . . 381 E HN . 27783 1 978 . 1 . 1 381 381 GLU C C 13 174.7899 . . 1 . . . . . 381 E CO . 27783 1 979 . 1 . 1 381 381 GLU CA C 13 55.7449 . . 1 . . . . . 381 E CA . 27783 1 980 . 1 . 1 381 381 GLU CB C 13 29.1199 . . 1 . . . . . 381 E CB . 27783 1 981 . 1 . 1 381 381 GLU N N 15 125.4154 . . 1 . . . . . 381 E N . 27783 1 982 . 1 . 1 382 382 VAL H H 1 7.9424 . . 1 . . . . . 382 V HN . 27783 1 983 . 1 . 1 382 382 VAL C C 13 173.3513 . . 1 . . . . . 382 V CO . 27783 1 984 . 1 . 1 382 382 VAL CA C 13 57.6160 . . 1 . . . . . 382 V CA . 27783 1 985 . 1 . 1 382 382 VAL CB C 13 32.9550 . . 1 . . . . . 382 V CB . 27783 1 986 . 1 . 1 382 382 VAL N N 15 117.6823 . . 1 . . . . . 382 V N . 27783 1 987 . 1 . 1 386 386 PRO C C 13 180.1801 . . 1 . . . . . 386 P CO . 27783 1 988 . 1 . 1 386 386 PRO CA C 13 65.5898 . . 1 . . . . . 386 P CA . 27783 1 989 . 1 . 1 386 386 PRO CB C 13 29.9282 . . 1 . . . . . 386 P CB . 27783 1 990 . 1 . 1 387 387 ALA H H 1 7.4229 . . 1 . . . . . 387 A HN . 27783 1 991 . 1 . 1 387 387 ALA C C 13 179.2355 . . 1 . . . . . 387 A CO . 27783 1 992 . 1 . 1 387 387 ALA CA C 13 53.8482 . . 1 . . . . . 387 A CA . 27783 1 993 . 1 . 1 387 387 ALA CB C 13 18.6702 . . 1 . . . . . 387 A CB . 27783 1 994 . 1 . 1 387 387 ALA N N 15 120.3390 . . 1 . . . . . 387 A N . 27783 1 995 . 1 . 1 388 388 VAL H H 1 7.7855 . . 1 . . . . . 388 V HN . 27783 1 996 . 1 . 1 388 388 VAL C C 13 178.0116 . . 1 . . . . . 388 V CO . 27783 1 997 . 1 . 1 388 388 VAL CA C 13 67.0007 . . 1 . . . . . 388 V CA . 27783 1 998 . 1 . 1 388 388 VAL CB C 13 29.8712 . . 1 . . . . . 388 V CB . 27783 1 999 . 1 . 1 388 388 VAL N N 15 121.0892 . . 1 . . . . . 388 V N . 27783 1 1000 . 1 . 1 389 389 ASP H H 1 8.1057 . . 1 . . . . . 389 D HN . 27783 1 1001 . 1 . 1 389 389 ASP C C 13 179.6757 . . 1 . . . . . 389 D CO . 27783 1 1002 . 1 . 1 389 389 ASP CA C 13 57.9247 . . 1 . . . . . 389 D CA . 27783 1 1003 . 1 . 1 389 389 ASP CB C 13 40.1695 . . 1 . . . . . 389 D CB . 27783 1 1004 . 1 . 1 389 389 ASP N N 15 117.9448 . . 1 . . . . . 389 D N . 27783 1 1005 . 1 . 1 390 390 ALA H H 1 7.6694 . . 1 . . . . . 390 A HN . 27783 1 1006 . 1 . 1 390 390 ALA C C 13 179.5729 . . 1 . . . . . 390 A CO . 27783 1 1007 . 1 . 1 390 390 ALA CA C 13 54.7981 . . 1 . . . . . 390 A CA . 27783 1 1008 . 1 . 1 390 390 ALA CB C 13 17.3755 . . 1 . . . . . 390 A CB . 27783 1 1009 . 1 . 1 390 390 ALA N N 15 122.5407 . . 1 . . . . . 390 A N . 27783 1 1010 . 1 . 1 391 391 LEU H H 1 8.6023 . . 1 . . . . . 391 L HN . 27783 1 1011 . 1 . 1 391 391 LEU C C 13 178.9940 . . 1 . . . . . 391 L CO . 27783 1 1012 . 1 . 1 391 391 LEU CA C 13 57.9660 . . 1 . . . . . 391 L CA . 27783 1 1013 . 1 . 1 391 391 LEU CB C 13 41.1567 . . 1 . . . . . 391 L CB . 27783 1 1014 . 1 . 1 391 391 LEU N N 15 124.2659 . . 1 . . . . . 391 L N . 27783 1 1015 . 1 . 1 392 392 LEU H H 1 8.3498 . . 1 . . . . . 392 L HN . 27783 1 1016 . 1 . 1 392 392 LEU C C 13 178.2661 . . 1 . . . . . 392 L CO . 27783 1 1017 . 1 . 1 392 392 LEU CA C 13 57.4593 . . 1 . . . . . 392 L CA . 27783 1 1018 . 1 . 1 392 392 LEU CB C 13 39.8860 . . 1 . . . . . 392 L CB . 27783 1 1019 . 1 . 1 392 392 LEU N N 15 119.5858 . . 1 . . . . . 392 L N . 27783 1 1020 . 1 . 1 393 393 ALA H H 1 7.6008 . . 1 . . . . . 393 A HN . 27783 1 1021 . 1 . 1 393 393 ALA C C 13 180.5505 . . 1 . . . . . 393 A CO . 27783 1 1022 . 1 . 1 393 393 ALA CA C 13 54.0963 . . 1 . . . . . 393 A CA . 27783 1 1023 . 1 . 1 393 393 ALA CB C 13 17.0290 . . 1 . . . . . 393 A CB . 27783 1 1024 . 1 . 1 393 393 ALA N N 15 119.9696 . . 1 . . . . . 393 A N . 27783 1 1025 . 1 . 1 394 394 TRP H H 1 7.6802 . . 1 . . . . . 394 W HN . 27783 1 1026 . 1 . 1 394 394 TRP C C 13 179.7764 . . 1 . . . . . 394 W CO . 27783 1 1027 . 1 . 1 394 394 TRP CA C 13 60.7550 . . 1 . . . . . 394 W CA . 27783 1 1028 . 1 . 1 394 394 TRP CB C 13 25.8729 . . 1 . . . . . 394 W CB . 27783 1 1029 . 1 . 1 394 394 TRP N N 15 120.4111 . . 1 . . . . . 394 W N . 27783 1 1030 . 1 . 1 395 395 LEU H H 1 8.5425 . . 1 . . . . . 395 L HN . 27783 1 1031 . 1 . 1 395 395 LEU C C 13 176.6654 . . 1 . . . . . 395 L CO . 27783 1 1032 . 1 . 1 395 395 LEU CA C 13 57.0580 . . 1 . . . . . 395 L CA . 27783 1 1033 . 1 . 1 395 395 LEU CB C 13 40.2158 . . 1 . . . . . 395 L CB . 27783 1 1034 . 1 . 1 395 395 LEU N N 15 125.9387 . . 1 . . . . . 395 L N . 27783 1 1035 . 1 . 1 396 396 GLU H H 1 7.1202 . . 1 . . . . . 396 E HN . 27783 1 1036 . 1 . 1 396 396 GLU C C 13 177.7421 . . 1 . . . . . 396 E CO . 27783 1 1037 . 1 . 1 396 396 GLU CA C 13 57.4692 . . 1 . . . . . 396 E CA . 27783 1 1038 . 1 . 1 396 396 GLU CB C 13 28.8156 . . 1 . . . . . 396 E CB . 27783 1 1039 . 1 . 1 396 396 GLU N N 15 110.9606 . . 1 . . . . . 396 E N . 27783 1 1040 . 1 . 1 397 397 THR H H 1 7.3143 . . 1 . . . . . 397 T HN . 27783 1 1041 . 1 . 1 397 397 THR C C 13 175.2249 . . 1 . . . . . 397 T CO . 27783 1 1042 . 1 . 1 397 397 THR CA C 13 61.5712 . . 1 . . . . . 397 T CA . 27783 1 1043 . 1 . 1 397 397 THR CB C 13 69.9244 . . 1 . . . . . 397 T CB . 27783 1 1044 . 1 . 1 397 397 THR N N 15 108.8857 . . 1 . . . . . 397 T N . 27783 1 1045 . 1 . 1 398 398 GLN H H 1 7.7505 . . 1 . . . . . 398 Q HN . 27783 1 1046 . 1 . 1 398 398 GLN C C 13 174.6655 . . 1 . . . . . 398 Q CO . 27783 1 1047 . 1 . 1 398 398 GLN CA C 13 52.2552 . . 1 . . . . . 398 Q CA . 27783 1 1048 . 1 . 1 398 398 GLN CB C 13 26.2935 . . 1 . . . . . 398 Q CB . 27783 1 1049 . 1 . 1 398 398 GLN N N 15 123.4424 . . 1 . . . . . 398 Q N . 27783 1 1050 . 1 . 1 401 401 ALA C C 13 175.5330 . . 1 . . . . . 401 A CO . 27783 1 1051 . 1 . 1 401 401 ALA CA C 13 51.0085 . . 1 . . . . . 401 A CA . 27783 1 1052 . 1 . 1 401 401 ALA CB C 13 19.2888 . . 1 . . . . . 401 A CB . 27783 1 1053 . 1 . 1 402 402 LEU H H 1 7.4821 . . 1 . . . . . 402 L HN . 27783 1 1054 . 1 . 1 402 402 LEU C C 13 176.4030 . . 1 . . . . . 402 L CO . 27783 1 1055 . 1 . 1 402 402 LEU CA C 13 55.1579 . . 1 . . . . . 402 L CA . 27783 1 1056 . 1 . 1 402 402 LEU CB C 13 44.4892 . . 1 . . . . . 402 L CB . 27783 1 1057 . 1 . 1 402 402 LEU N N 15 120.2452 . . 1 . . . . . 402 L N . 27783 1 1058 . 1 . 1 403 403 VAL H H 1 9.2617 . . 1 . . . . . 403 V HN . 27783 1 1059 . 1 . 1 403 403 VAL C C 13 173.3307 . . 1 . . . . . 403 V CO . 27783 1 1060 . 1 . 1 403 403 VAL CA C 13 61.0425 . . 1 . . . . . 403 V CA . 27783 1 1061 . 1 . 1 403 403 VAL CB C 13 34.6984 . . 1 . . . . . 403 V CB . 27783 1 1062 . 1 . 1 403 403 VAL N N 15 129.0365 . . 1 . . . . . 403 V N . 27783 1 1063 . 1 . 1 404 404 GLN H H 1 8.6768 . . 1 . . . . . 404 Q HN . 27783 1 1064 . 1 . 1 404 404 GLN C C 13 173.9281 . . 1 . . . . . 404 Q CO . 27783 1 1065 . 1 . 1 404 404 GLN CA C 13 52.8903 . . 1 . . . . . 404 Q CA . 27783 1 1066 . 1 . 1 404 404 GLN CB C 13 29.6938 . . 1 . . . . . 404 Q CB . 27783 1 1067 . 1 . 1 404 404 GLN N N 15 123.1957 . . 1 . . . . . 404 Q N . 27783 1 1068 . 1 . 1 405 405 THR H H 1 9.2601 . . 1 . . . . . 405 T HN . 27783 1 1069 . 1 . 1 405 405 THR C C 13 171.9067 . . 1 . . . . . 405 T CO . 27783 1 1070 . 1 . 1 405 405 THR CA C 13 61.2958 . . 1 . . . . . 405 T CA . 27783 1 1071 . 1 . 1 405 405 THR CB C 13 67.8378 . . 1 . . . . . 405 T CB . 27783 1 1072 . 1 . 1 405 405 THR N N 15 115.9117 . . 1 . . . . . 405 T N . 27783 1 1073 . 1 . 1 406 406 ASP H H 1 8.8118 . . 1 . . . . . 406 D HN . 27783 1 1074 . 1 . 1 406 406 ASP C C 13 173.4756 . . 1 . . . . . 406 D CO . 27783 1 1075 . 1 . 1 406 406 ASP CA C 13 53.1232 . . 1 . . . . . 406 D CA . 27783 1 1076 . 1 . 1 406 406 ASP CB C 13 40.2104 . . 1 . . . . . 406 D CB . 27783 1 1077 . 1 . 1 406 406 ASP N N 15 128.3566 . . 1 . . . . . 406 D N . 27783 1 1078 . 1 . 1 407 407 ALA H H 1 8.4948 . . 1 . . . . . 407 A HN . 27783 1 1079 . 1 . 1 407 407 ALA C C 13 177.8554 . . 1 . . . . . 407 A CO . 27783 1 1080 . 1 . 1 407 407 ALA CA C 13 50.8070 . . 1 . . . . . 407 A CA . 27783 1 1081 . 1 . 1 407 407 ALA CB C 13 16.9170 . . 1 . . . . . 407 A CB . 27783 1 1082 . 1 . 1 407 407 ALA N N 15 124.6528 . . 1 . . . . . 407 A N . 27783 1 1083 . 1 . 1 408 408 LEU H H 1 9.7507 . . 1 . . . . . 408 L HN . 27783 1 1084 . 1 . 1 408 408 LEU C C 13 178.3528 . . 1 . . . . . 408 L CO . 27783 1 1085 . 1 . 1 408 408 LEU CA C 13 58.2357 . . 1 . . . . . 408 L CA . 27783 1 1086 . 1 . 1 408 408 LEU CB C 13 40.8224 . . 1 . . . . . 408 L CB . 27783 1 1087 . 1 . 1 408 408 LEU N N 15 127.3843 . . 1 . . . . . 408 L N . 27783 1 1088 . 1 . 1 409 409 GLY H H 1 8.9955 . . 1 . . . . . 409 G HN . 27783 1 1089 . 1 . 1 409 409 GLY C C 13 174.8415 . . 1 . . . . . 409 G CO . 27783 1 1090 . 1 . 1 409 409 GLY CA C 13 45.1349 . . 1 . . . . . 409 G CA . 27783 1 1091 . 1 . 1 409 409 GLY N N 15 104.2436 . . 1 . . . . . 409 G N . 27783 1 1092 . 1 . 1 410 410 GLN H H 1 7.7631 . . 1 . . . . . 410 Q HN . 27783 1 1093 . 1 . 1 410 410 GLN C C 13 176.9757 . . 1 . . . . . 410 Q CO . 27783 1 1094 . 1 . 1 410 410 GLN CA C 13 56.4778 . . 1 . . . . . 410 Q CA . 27783 1 1095 . 1 . 1 410 410 GLN CB C 13 27.8172 . . 1 . . . . . 410 Q CB . 27783 1 1096 . 1 . 1 410 410 GLN N N 15 116.4510 . . 1 . . . . . 410 Q N . 27783 1 1097 . 1 . 1 411 411 LEU H H 1 7.3268 . . 1 . . . . . 411 L HN . 27783 1 1098 . 1 . 1 411 411 LEU C C 13 176.5407 . . 1 . . . . . 411 L CO . 27783 1 1099 . 1 . 1 411 411 LEU CA C 13 55.8146 . . 1 . . . . . 411 L CA . 27783 1 1100 . 1 . 1 411 411 LEU CB C 13 43.2286 . . 1 . . . . . 411 L CB . 27783 1 1101 . 1 . 1 411 411 LEU N N 15 119.9000 . . 1 . . . . . 411 L N . 27783 1 1102 . 1 . 1 412 412 TRP H H 1 8.5443 . . 1 . . . . . 412 W HN . 27783 1 1103 . 1 . 1 412 412 TRP C C 13 173.3272 . . 1 . . . . . 412 W CO . 27783 1 1104 . 1 . 1 412 412 TRP CA C 13 54.1972 . . 1 . . . . . 412 W CA . 27783 1 1105 . 1 . 1 412 412 TRP CB C 13 26.8273 . . 1 . . . . . 412 W CB . 27783 1 1106 . 1 . 1 412 412 TRP N N 15 121.1425 . . 1 . . . . . 412 W N . 27783 1 1107 . 1 . 1 413 413 PRO C C 13 179.1938 . . 1 . . . . . 413 P CO . 27783 1 1108 . 1 . 1 413 413 PRO CA C 13 65.1607 . . 1 . . . . . 413 P CA . 27783 1 1109 . 1 . 1 413 413 PRO CB C 13 30.6989 . . 1 . . . . . 413 P CB . 27783 1 1110 . 1 . 1 414 414 ALA H H 1 6.7037 . . 1 . . . . . 414 A HN . 27783 1 1111 . 1 . 1 414 414 ALA C C 13 177.6190 . . 1 . . . . . 414 A CO . 27783 1 1112 . 1 . 1 414 414 ALA CA C 13 52.6102 . . 1 . . . . . 414 A CA . 27783 1 1113 . 1 . 1 414 414 ALA CB C 13 16.3889 . . 1 . . . . . 414 A CB . 27783 1 1114 . 1 . 1 414 414 ALA N N 15 118.0692 . . 1 . . . . . 414 A N . 27783 1 1115 . 1 . 1 415 415 GLY H H 1 7.1529 . . 1 . . . . . 415 G HN . 27783 1 1116 . 1 . 1 415 415 GLY C C 13 175.8596 . . 1 . . . . . 415 G CO . 27783 1 1117 . 1 . 1 415 415 GLY CA C 13 44.9336 . . 1 . . . . . 415 G CA . 27783 1 1118 . 1 . 1 415 415 GLY N N 15 105.9433 . . 1 . . . . . 415 G N . 27783 1 1119 . 1 . 1 416 416 ALA H H 1 7.4976 . . 1 . . . . . 416 A HN . 27783 1 1120 . 1 . 1 416 416 ALA C C 13 179.2152 . . 1 . . . . . 416 A CO . 27783 1 1121 . 1 . 1 416 416 ALA CA C 13 55.0620 . . 1 . . . . . 416 A CA . 27783 1 1122 . 1 . 1 416 416 ALA CB C 13 17.4599 . . 1 . . . . . 416 A CB . 27783 1 1123 . 1 . 1 416 416 ALA N N 15 124.8977 . . 1 . . . . . 416 A N . 27783 1 1124 . 1 . 1 417 417 ASP H H 1 7.7337 . . 1 . . . . . 417 D HN . 27783 1 1125 . 1 . 1 417 417 ASP C C 13 176.5605 . . 1 . . . . . 417 D CO . 27783 1 1126 . 1 . 1 417 417 ASP CA C 13 54.9906 . . 1 . . . . . 417 D CA . 27783 1 1127 . 1 . 1 417 417 ASP CB C 13 39.9758 . . 1 . . . . . 417 D CB . 27783 1 1128 . 1 . 1 417 417 ASP N N 15 114.6993 . . 1 . . . . . 417 D N . 27783 1 1129 . 1 . 1 418 418 LEU H H 1 7.4911 . . 1 . . . . . 418 L HN . 27783 1 1130 . 1 . 1 418 418 LEU C C 13 176.3357 . . 1 . . . . . 418 L CO . 27783 1 1131 . 1 . 1 418 418 LEU CA C 13 53.8444 . . 1 . . . . . 418 L CA . 27783 1 1132 . 1 . 1 418 418 LEU CB C 13 40.7480 . . 1 . . . . . 418 L CB . 27783 1 1133 . 1 . 1 418 418 LEU N N 15 116.9593 . . 1 . . . . . 418 L N . 27783 1 1134 . 1 . 1 419 419 ALA H H 1 7.2581 . . 1 . . . . . 419 A HN . 27783 1 1135 . 1 . 1 419 419 ALA C C 13 173.8525 . . 1 . . . . . 419 A CO . 27783 1 1136 . 1 . 1 419 419 ALA CA C 13 54.1884 . . 1 . . . . . 419 A CA . 27783 1 1137 . 1 . 1 419 419 ALA CB C 13 16.9568 . . 1 . . . . . 419 A CB . 27783 1 1138 . 1 . 1 419 419 ALA N N 15 122.8988 . . 1 . . . . . 419 A N . 27783 1 1139 . 1 . 1 420 420 PRO C C 13 177.5060 . . 1 . . . . . 420 P CO . 27783 1 1140 . 1 . 1 420 420 PRO CA C 13 66.1094 . . 1 . . . . . 420 P CA . 27783 1 1141 . 1 . 1 420 420 PRO CB C 13 30.3869 . . 1 . . . . . 420 P CB . 27783 1 1142 . 1 . 1 421 421 SER H H 1 7.6144 . . 1 . . . . . 421 S HN . 27783 1 1143 . 1 . 1 421 421 SER C C 13 173.9976 . . 1 . . . . . 421 S CO . 27783 1 1144 . 1 . 1 421 421 SER CA C 13 58.0600 . . 1 . . . . . 421 S CA . 27783 1 1145 . 1 . 1 421 421 SER CB C 13 64.6792 . . 1 . . . . . 421 S CB . 27783 1 1146 . 1 . 1 421 421 SER N N 15 106.9667 . . 1 . . . . . 421 S N . 27783 1 1147 . 1 . 1 422 422 ALA H H 1 8.1575 . . 1 . . . . . 422 A HN . 27783 1 1148 . 1 . 1 422 422 ALA C C 13 174.3027 . . 1 . . . . . 422 A CO . 27783 1 1149 . 1 . 1 422 422 ALA CA C 13 50.6328 . . 1 . . . . . 422 A CA . 27783 1 1150 . 1 . 1 422 422 ALA CB C 13 18.3481 . . 1 . . . . . 422 A CB . 27783 1 1151 . 1 . 1 422 422 ALA N N 15 126.4495 . . 1 . . . . . 422 A N . 27783 1 1152 . 1 . 1 423 423 ALA H H 1 7.8270 . . 1 . . . . . 423 A HN . 27783 1 1153 . 1 . 1 423 423 ALA C C 13 176.0691 . . 1 . . . . . 423 A CO . 27783 1 1154 . 1 . 1 423 423 ALA CA C 13 53.7228 . . 1 . . . . . 423 A CA . 27783 1 1155 . 1 . 1 423 423 ALA CB C 13 18.6925 . . 1 . . . . . 423 A CB . 27783 1 1156 . 1 . 1 423 423 ALA N N 15 123.4527 . . 1 . . . . . 423 A N . 27783 1 1157 . 1 . 1 424 424 GLY H H 1 8.4044 . . 1 . . . . . 424 G HN . 27783 1 1158 . 1 . 1 424 424 GLY C C 13 173.1625 . . 1 . . . . . 424 G CO . 27783 1 1159 . 1 . 1 424 424 GLY CA C 13 43.4242 . . 1 . . . . . 424 G CA . 27783 1 1160 . 1 . 1 424 424 GLY N N 15 103.0319 . . 1 . . . . . 424 G N . 27783 1 1161 . 1 . 1 425 425 LEU H H 1 9.0348 . . 1 . . . . . 425 L HN . 27783 1 1162 . 1 . 1 425 425 LEU C C 13 173.5318 . . 1 . . . . . 425 L CO . 27783 1 1163 . 1 . 1 425 425 LEU CA C 13 54.7708 . . 1 . . . . . 425 L CA . 27783 1 1164 . 1 . 1 425 425 LEU CB C 13 45.8310 . . 1 . . . . . 425 L CB . 27783 1 1165 . 1 . 1 425 425 LEU N N 15 123.7081 . . 1 . . . . . 425 L N . 27783 1 1166 . 1 . 1 426 426 LEU H H 1 9.0961 . . 1 . . . . . 426 L HN . 27783 1 1167 . 1 . 1 426 426 LEU C C 13 173.9032 . . 1 . . . . . 426 L CO . 27783 1 1168 . 1 . 1 426 426 LEU CA C 13 54.5715 . . 1 . . . . . 426 L CA . 27783 1 1169 . 1 . 1 426 426 LEU CB C 13 41.7895 . . 1 . . . . . 426 L CB . 27783 1 1170 . 1 . 1 426 426 LEU N N 15 131.2846 . . 1 . . . . . 426 L N . 27783 1 1171 . 1 . 1 427 427 ALA H H 1 9.7472 . . 1 . . . . . 427 A HN . 27783 1 1172 . 1 . 1 427 427 ALA C C 13 176.3077 . . 1 . . . . . 427 A CO . 27783 1 1173 . 1 . 1 427 427 ALA CA C 13 49.5548 . . 1 . . . . . 427 A CA . 27783 1 1174 . 1 . 1 427 427 ALA CB C 13 25.1071 . . 1 . . . . . 427 A CB . 27783 1 1175 . 1 . 1 427 427 ALA N N 15 129.3745 . . 1 . . . . . 427 A N . 27783 1 1176 . 1 . 1 428 428 ILE H H 1 8.9347 . . 1 . . . . . 428 I HN . 27783 1 1177 . 1 . 1 428 428 ILE C C 13 174.3237 . . 1 . . . . . 428 I CO . 27783 1 1178 . 1 . 1 428 428 ILE CA C 13 58.2062 . . 1 . . . . . 428 I CA . 27783 1 1179 . 1 . 1 428 428 ILE CB C 13 41.5087 . . 1 . . . . . 428 I CB . 27783 1 1180 . 1 . 1 428 428 ILE N N 15 112.2087 . . 1 . . . . . 428 I N . 27783 1 1181 . 1 . 1 429 429 SER H H 1 7.7009 . . 1 . . . . . 429 S HN . 27783 1 1182 . 1 . 1 429 429 SER C C 13 175.0852 . . 1 . . . . . 429 S CO . 27783 1 1183 . 1 . 1 429 429 SER CA C 13 55.8230 . . 1 . . . . . 429 S CA . 27783 1 1184 . 1 . 1 429 429 SER CB C 13 62.1685 . . 1 . . . . . 429 S CB . 27783 1 1185 . 1 . 1 429 429 SER N N 15 118.2727 . . 1 . . . . . 429 S N . 27783 1 1186 . 1 . 1 434 434 TRP C C 13 175.4968 . . 1 . . . . . 434 W CO . 27783 1 1187 . 1 . 1 434 434 TRP CA C 13 58.3496 . . 1 . . . . . 434 W CA . 27783 1 1188 . 1 . 1 434 434 TRP CB C 13 26.2830 . . 1 . . . . . 434 W CB . 27783 1 1189 . 1 . 1 435 435 SER H H 1 7.8079 . . 1 . . . . . 435 S HN . 27783 1 1190 . 1 . 1 435 435 SER C C 13 174.8099 . . 1 . . . . . 435 S CO . 27783 1 1191 . 1 . 1 435 435 SER CA C 13 61.5634 . . 1 . . . . . 435 S CA . 27783 1 1192 . 1 . 1 435 435 SER CB C 13 62.2238 . . 1 . . . . . 435 S CB . 27783 1 1193 . 1 . 1 435 435 SER N N 15 116.6332 . . 1 . . . . . 435 S N . 27783 1 1194 . 1 . 1 436 436 GLU H H 1 7.6361 . . 1 . . . . . 436 E HN . 27783 1 1195 . 1 . 1 436 436 GLU C C 13 175.8851 . . 1 . . . . . 436 E CO . 27783 1 1196 . 1 . 1 436 436 GLU CA C 13 54.1360 . . 1 . . . . . 436 E CA . 27783 1 1197 . 1 . 1 436 436 GLU CB C 13 30.0819 . . 1 . . . . . 436 E CB . 27783 1 1198 . 1 . 1 436 436 GLU N N 15 119.4472 . . 1 . . . . . 436 E N . 27783 1 1199 . 1 . 1 437 437 CYS H H 1 8.8834 . . 1 . . . . . 437 C HN . 27783 1 1200 . 1 . 1 437 437 CYS C C 13 170.4302 . . 1 . . . . . 437 C CO . 27783 1 1201 . 1 . 1 437 437 CYS CA C 13 55.8592 . . 1 . . . . . 437 C CA . 27783 1 1202 . 1 . 1 437 437 CYS CB C 13 30.0808 . . 1 . . . . . 437 C CB . 27783 1 1203 . 1 . 1 437 437 CYS N N 15 116.8214 . . 1 . . . . . 437 C N . 27783 1 1204 . 1 . 1 438 438 LEU H H 1 8.0067 . . 1 . . . . . 438 L HN . 27783 1 1205 . 1 . 1 438 438 LEU C C 13 175.4827 . . 1 . . . . . 438 L CO . 27783 1 1206 . 1 . 1 438 438 LEU CA C 13 54.4172 . . 1 . . . . . 438 L CA . 27783 1 1207 . 1 . 1 438 438 LEU CB C 13 44.2901 . . 1 . . . . . 438 L CB . 27783 1 1208 . 1 . 1 438 438 LEU N N 15 118.0280 . . 1 . . . . . 438 L N . 27783 1 1209 . 1 . 1 439 439 VAL H H 1 8.5212 . . 1 . . . . . 439 V HN . 27783 1 1210 . 1 . 1 439 439 VAL C C 13 174.8459 . . 1 . . . . . 439 V CO . 27783 1 1211 . 1 . 1 439 439 VAL CA C 13 60.3582 . . 1 . . . . . 439 V CA . 27783 1 1212 . 1 . 1 439 439 VAL CB C 13 33.6723 . . 1 . . . . . 439 V CB . 27783 1 1213 . 1 . 1 439 439 VAL N N 15 119.7454 . . 1 . . . . . 439 V N . 27783 1 1214 . 1 . 1 440 440 TRP H H 1 10.1690 . . 1 . . . . . 440 W HN . 27783 1 1215 . 1 . 1 440 440 TRP C C 13 175.5753 . . 1 . . . . . 440 W CO . 27783 1 1216 . 1 . 1 440 440 TRP CA C 13 59.7198 . . 1 . . . . . 440 W CA . 27783 1 1217 . 1 . 1 440 440 TRP CB C 13 31.0607 . . 1 . . . . . 440 W CB . 27783 1 1218 . 1 . 1 440 440 TRP N N 15 128.4682 . . 1 . . . . . 440 W N . 27783 1 1219 . 1 . 1 441 441 LEU H H 1 9.0216 . . 1 . . . . . 441 L HN . 27783 1 1220 . 1 . 1 441 441 LEU C C 13 177.8951 . . 1 . . . . . 441 L CO . 27783 1 1221 . 1 . 1 441 441 LEU CA C 13 52.9729 . . 1 . . . . . 441 L CA . 27783 1 1222 . 1 . 1 441 441 LEU CB C 13 44.9028 . . 1 . . . . . 441 L CB . 27783 1 1223 . 1 . 1 441 441 LEU N N 15 120.0568 . . 1 . . . . . 441 L N . 27783 1 1224 . 1 . 1 442 442 ARG H H 1 9.0728 . . 1 . . . . . 442 R HN . 27783 1 1225 . 1 . 1 442 442 ARG C C 13 173.3244 . . 1 . . . . . 442 R CO . 27783 1 1226 . 1 . 1 442 442 ARG CA C 13 53.0731 . . 1 . . . . . 442 R CA . 27783 1 1227 . 1 . 1 442 442 ARG CB C 13 34.3567 . . 1 . . . . . 442 R CB . 27783 1 1228 . 1 . 1 442 442 ARG N N 15 121.1271 . . 1 . . . . . 442 R N . 27783 1 1229 . 1 . 1 444 444 GLU C C 13 176.2054 . . 1 . . . . . 444 E CO . 27783 1 1230 . 1 . 1 445 445 LEU H H 1 9.1145 . . 1 . . . . . 445 L HN . 27783 1 1231 . 1 . 1 445 445 LEU C C 13 176.4913 . . 1 . . . . . 445 L CO . 27783 1 1232 . 1 . 1 445 445 LEU CA C 13 56.2939 . . 1 . . . . . 445 L CA . 27783 1 1233 . 1 . 1 445 445 LEU N N 15 125.8832 . . 1 . . . . . 445 L N . 27783 1 1234 . 1 . 1 446 446 ARG H H 1 8.1394 . . 1 . . . . . 446 R HN . 27783 1 1235 . 1 . 1 446 446 ARG C C 13 174.9579 . . 1 . . . . . 446 R CO . 27783 1 1236 . 1 . 1 446 446 ARG CA C 13 54.9462 . . 1 . . . . . 446 R CA . 27783 1 1237 . 1 . 1 446 446 ARG CB C 13 30.9662 . . 1 . . . . . 446 R CB . 27783 1 1238 . 1 . 1 446 446 ARG N N 15 125.0129 . . 1 . . . . . 446 R N . 27783 1 1239 . 1 . 1 447 447 LEU H H 1 8.0456 . . 1 . . . . . 447 L HN . 27783 1 1240 . 1 . 1 447 447 LEU C C 13 175.8544 . . 1 . . . . . 447 L CO . 27783 1 1241 . 1 . 1 447 447 LEU CA C 13 53.8453 . . 1 . . . . . 447 L CA . 27783 1 1242 . 1 . 1 447 447 LEU CB C 13 44.6735 . . 1 . . . . . 447 L CB . 27783 1 1243 . 1 . 1 447 447 LEU N N 15 123.9895 . . 1 . . . . . 447 L N . 27783 1 1244 . 1 . 1 448 448 GLU H H 1 8.3331 . . 1 . . . . . 448 E HN . 27783 1 1245 . 1 . 1 448 448 GLU C C 13 176.1295 . . 1 . . . . . 448 E CO . 27783 1 1246 . 1 . 1 448 448 GLU CA C 13 54.2967 . . 1 . . . . . 448 E CA . 27783 1 1247 . 1 . 1 448 448 GLU CB C 13 31.0851 . . 1 . . . . . 448 E CB . 27783 1 1248 . 1 . 1 448 448 GLU N N 15 121.0864 . . 1 . . . . . 448 E N . 27783 1 1249 . 1 . 1 449 449 VAL H H 1 8.0063 . . 1 . . . . . 449 V HN . 27783 1 1250 . 1 . 1 449 449 VAL C C 13 175.4202 . . 1 . . . . . 449 V CO . 27783 1 1251 . 1 . 1 449 449 VAL CA C 13 60.9138 . . 1 . . . . . 449 V CA . 27783 1 1252 . 1 . 1 449 449 VAL CB C 13 30.9495 . . 1 . . . . . 449 V CB . 27783 1 1253 . 1 . 1 449 449 VAL N N 15 116.7794 . . 1 . . . . . 449 V N . 27783 1 1254 . 1 . 1 450 450 ALA H H 1 8.1515 . . 1 . . . . . 450 A HN . 27783 1 1255 . 1 . 1 450 450 ALA CA C 13 53.7482 . . 1 . . . . . 450 A CA . 27783 1 1256 . 1 . 1 450 450 ALA CB C 13 19.1129 . . 1 . . . . . 450 A CB . 27783 1 1257 . 1 . 1 450 450 ALA N N 15 126.6051 . . 1 . . . . . 450 A N . 27783 1 1258 . 1 . 1 494 494 LEU CA C 13 57.6672 . . 1 . . . . . 494 L CA . 27783 1 1259 . 1 . 1 494 494 LEU CB C 13 40.4081 . . 1 . . . . . 494 L CB . 27783 1 1260 . 1 . 1 495 495 ARG H H 1 8.5990 . . 1 . . . . . 495 R HN . 27783 1 1261 . 1 . 1 495 495 ARG C C 13 179.3889 . . 1 . . . . . 495 R CO . 27783 1 1262 . 1 . 1 495 495 ARG CA C 13 60.5216 . . 1 . . . . . 495 R CA . 27783 1 1263 . 1 . 1 495 495 ARG CB C 13 28.1682 . . 1 . . . . . 495 R CB . 27783 1 1264 . 1 . 1 495 495 ARG N N 15 120.9078 . . 1 . . . . . 495 R N . 27783 1 1265 . 1 . 1 496 496 ASP H H 1 8.0306 . . 1 . . . . . 496 D HN . 27783 1 1266 . 1 . 1 496 496 ASP C C 13 179.3041 . . 1 . . . . . 496 D CO . 27783 1 1267 . 1 . 1 496 496 ASP CA C 13 57.6842 . . 1 . . . . . 496 D CA . 27783 1 1268 . 1 . 1 496 496 ASP CB C 13 39.6773 . . 1 . . . . . 496 D CB . 27783 1 1269 . 1 . 1 496 496 ASP N N 15 122.2734 . . 1 . . . . . 496 D N . 27783 1 1270 . 1 . 1 497 497 THR H H 1 8.5994 . . 1 . . . . . 497 T HN . 27783 1 1271 . 1 . 1 497 497 THR C C 13 177.1298 . . 1 . . . . . 497 T CO . 27783 1 1272 . 1 . 1 497 497 THR CA C 13 66.3888 . . 1 . . . . . 497 T CA . 27783 1 1273 . 1 . 1 497 497 THR CB C 13 68.3733 . . 1 . . . . . 497 T CB . 27783 1 1274 . 1 . 1 497 497 THR N N 15 119.6603 . . 1 . . . . . 497 T N . 27783 1 1275 . 1 . 1 498 498 LEU H H 1 8.9513 . . 1 . . . . . 498 L HN . 27783 1 1276 . 1 . 1 498 498 LEU C C 13 178.3817 . . 1 . . . . . 498 L CO . 27783 1 1277 . 1 . 1 498 498 LEU CA C 13 57.4795 . . 1 . . . . . 498 L CA . 27783 1 1278 . 1 . 1 498 498 LEU CB C 13 41.0367 . . 1 . . . . . 498 L CB . 27783 1 1279 . 1 . 1 498 498 LEU N N 15 120.6742 . . 1 . . . . . 498 L N . 27783 1 1280 . 1 . 1 499 499 THR H H 1 8.4090 . . 1 . . . . . 499 T HN . 27783 1 1281 . 1 . 1 499 499 THR C C 13 176.9035 . . 1 . . . . . 499 T CO . 27783 1 1282 . 1 . 1 499 499 THR CA C 13 66.5791 . . 1 . . . . . 499 T CA . 27783 1 1283 . 1 . 1 499 499 THR CB C 13 68.5041 . . 1 . . . . . 499 T CB . 27783 1 1284 . 1 . 1 499 499 THR N N 15 115.0551 . . 1 . . . . . 499 T N . 27783 1 1285 . 1 . 1 500 500 GLY H H 1 7.7445 . . 1 . . . . . 500 G HN . 27783 1 1286 . 1 . 1 500 500 GLY C C 13 175.5309 . . 1 . . . . . 500 G CO . 27783 1 1287 . 1 . 1 500 500 GLY CA C 13 46.3783 . . 1 . . . . . 500 G CA . 27783 1 1288 . 1 . 1 500 500 GLY N N 15 107.2073 . . 1 . . . . . 500 G N . 27783 1 1289 . 1 . 1 501 501 ALA H H 1 7.8706 . . 1 . . . . . 501 A HN . 27783 1 1290 . 1 . 1 501 501 ALA C C 13 179.0394 . . 1 . . . . . 501 A CO . 27783 1 1291 . 1 . 1 501 501 ALA CA C 13 53.6878 . . 1 . . . . . 501 A CA . 27783 1 1292 . 1 . 1 501 501 ALA CB C 13 18.5192 . . 1 . . . . . 501 A CB . 27783 1 1293 . 1 . 1 501 501 ALA N N 15 122.9512 . . 1 . . . . . 501 A N . 27783 1 stop_ save_