data_27784 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27784 _Entry.Title ; Backbone 1H, 15N, 13C Chemical Shift Assignment of the Pfr 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 . . . . 27784 2 Linnea Isaksson . . . . 27784 3 Cecilia Persson . . . . 27784 4 Maxim Mayzel . . . . 27784 5 Ulrika Brath . . . . 27784 6 Lidija Vrhovac . . . . 27784 7 Janne Ihalainen . . . . 27784 8 Goran Karlsson . . . . 27784 9 Vladislav Orekhov . . . . 27784 10 Sebastian Westenhoff . . . . 27784 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27784 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 701 27784 '15N chemical shifts' 243 27784 '1H chemical shifts' 244 27784 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 3 . . 2023-01-24 2019-02-13 update author 'update assignments' 27784 2 . . 2022-04-04 2019-02-13 update BMRB 'update Polymer_type' 27784 1 . . 2019-12-10 2019-02-13 original author 'original release' 27784 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27783 'the Pr state of monomeric PAS-GAF-PHY' 27784 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27784 _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 . . . . 27784 1 2 Linnea Isaksson . . . . 27784 1 3 Cecilia Persson . . . . 27784 1 4 Maxim Mayzel . . . . 27784 1 5 Ulrika Brath . . . . 27784 1 6 Lidija Vrhovac . . . . 27784 1 7 Janne Ihalainen . . . . 27784 1 8 Goran Karlsson . . . . 27784 1 9 Vladislav Orekhov . . . . 27784 1 10 Sebastian Westenhoff . . . . 27784 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27784 _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 . . . 27784 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Phytochrome _Entity.Sf_category entity _Entity.Sf_framecode Phytochrome _Entity.Entry_ID 27784 _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 . 27784 1 2 . SER . 27784 1 3 . ARG . 27784 1 4 . ASP . 27784 1 5 . PRO . 27784 1 6 . LEU . 27784 1 7 . PRO . 27784 1 8 . PHE . 27784 1 9 . PHE . 27784 1 10 . PRO . 27784 1 11 . PRO . 27784 1 12 . LEU . 27784 1 13 . TYR . 27784 1 14 . LEU . 27784 1 15 . GLY . 27784 1 16 . GLY . 27784 1 17 . PRO . 27784 1 18 . GLU . 27784 1 19 . ILE . 27784 1 20 . THR . 27784 1 21 . THR . 27784 1 22 . GLU . 27784 1 23 . ASN . 27784 1 24 . CYS . 27784 1 25 . GLU . 27784 1 26 . ARG . 27784 1 27 . GLU . 27784 1 28 . PRO . 27784 1 29 . ILE . 27784 1 30 . HIS . 27784 1 31 . ILE . 27784 1 32 . PRO . 27784 1 33 . GLY . 27784 1 34 . SER . 27784 1 35 . ILE . 27784 1 36 . GLN . 27784 1 37 . PRO . 27784 1 38 . HIS . 27784 1 39 . GLY . 27784 1 40 . ALA . 27784 1 41 . LEU . 27784 1 42 . LEU . 27784 1 43 . THR . 27784 1 44 . ALA . 27784 1 45 . ASP . 27784 1 46 . GLY . 27784 1 47 . HIS . 27784 1 48 . SER . 27784 1 49 . GLY . 27784 1 50 . GLU . 27784 1 51 . VAL . 27784 1 52 . LEU . 27784 1 53 . GLN . 27784 1 54 . MET . 27784 1 55 . SER . 27784 1 56 . LEU . 27784 1 57 . ASN . 27784 1 58 . ALA . 27784 1 59 . ALA . 27784 1 60 . THR . 27784 1 61 . PHE . 27784 1 62 . LEU . 27784 1 63 . GLY . 27784 1 64 . GLN . 27784 1 65 . GLU . 27784 1 66 . PRO . 27784 1 67 . THR . 27784 1 68 . VAL . 27784 1 69 . LEU . 27784 1 70 . ARG . 27784 1 71 . GLY . 27784 1 72 . GLN . 27784 1 73 . THR . 27784 1 74 . LEU . 27784 1 75 . ALA . 27784 1 76 . ALA . 27784 1 77 . LEU . 27784 1 78 . LEU . 27784 1 79 . PRO . 27784 1 80 . GLU . 27784 1 81 . GLN . 27784 1 82 . TRP . 27784 1 83 . PRO . 27784 1 84 . ALA . 27784 1 85 . LEU . 27784 1 86 . GLN . 27784 1 87 . ALA . 27784 1 88 . ALA . 27784 1 89 . LEU . 27784 1 90 . PRO . 27784 1 91 . PRO . 27784 1 92 . GLY . 27784 1 93 . CYS . 27784 1 94 . PRO . 27784 1 95 . ASP . 27784 1 96 . ALA . 27784 1 97 . LEU . 27784 1 98 . GLN . 27784 1 99 . TYR . 27784 1 100 . ARG . 27784 1 101 . ALA . 27784 1 102 . THR . 27784 1 103 . LEU . 27784 1 104 . ASP . 27784 1 105 . TRP . 27784 1 106 . PRO . 27784 1 107 . ALA . 27784 1 108 . ALA . 27784 1 109 . GLY . 27784 1 110 . HIS . 27784 1 111 . LEU . 27784 1 112 . SER . 27784 1 113 . LEU . 27784 1 114 . THR . 27784 1 115 . VAL . 27784 1 116 . HIS . 27784 1 117 . ARG . 27784 1 118 . VAL . 27784 1 119 . GLY . 27784 1 120 . GLU . 27784 1 121 . LEU . 27784 1 122 . LEU . 27784 1 123 . ILE . 27784 1 124 . LEU . 27784 1 125 . GLU . 27784 1 126 . PHE . 27784 1 127 . GLU . 27784 1 128 . PRO . 27784 1 129 . THR . 27784 1 130 . GLU . 27784 1 131 . ALA . 27784 1 132 . TRP . 27784 1 133 . ASP . 27784 1 134 . SER . 27784 1 135 . THR . 27784 1 136 . GLY . 27784 1 137 . PRO . 27784 1 138 . HIS . 27784 1 139 . ALA . 27784 1 140 . LEU . 27784 1 141 . ARG . 27784 1 142 . ASN . 27784 1 143 . ALA . 27784 1 144 . MET . 27784 1 145 . SER . 27784 1 146 . ALA . 27784 1 147 . LEU . 27784 1 148 . GLU . 27784 1 149 . SER . 27784 1 150 . ALA . 27784 1 151 . PRO . 27784 1 152 . ASN . 27784 1 153 . LEU . 27784 1 154 . ARG . 27784 1 155 . ALA . 27784 1 156 . LEU . 27784 1 157 . ALA . 27784 1 158 . GLU . 27784 1 159 . VAL . 27784 1 160 . ALA . 27784 1 161 . THR . 27784 1 162 . GLN . 27784 1 163 . THR . 27784 1 164 . VAL . 27784 1 165 . ARG . 27784 1 166 . GLU . 27784 1 167 . LEU . 27784 1 168 . THR . 27784 1 169 . GLY . 27784 1 170 . PHE . 27784 1 171 . ASP . 27784 1 172 . ARG . 27784 1 173 . VAL . 27784 1 174 . MET . 27784 1 175 . LEU . 27784 1 176 . TYR . 27784 1 177 . LYS . 27784 1 178 . PHE . 27784 1 179 . ALA . 27784 1 180 . PRO . 27784 1 181 . ASP . 27784 1 182 . ALA . 27784 1 183 . THR . 27784 1 184 . GLY . 27784 1 185 . GLU . 27784 1 186 . VAL . 27784 1 187 . ILE . 27784 1 188 . ALA . 27784 1 189 . GLU . 27784 1 190 . ALA . 27784 1 191 . ARG . 27784 1 192 . ARG . 27784 1 193 . GLU . 27784 1 194 . GLY . 27784 1 195 . LEU . 27784 1 196 . HIS . 27784 1 197 . ALA . 27784 1 198 . PHE . 27784 1 199 . LEU . 27784 1 200 . GLY . 27784 1 201 . HIS . 27784 1 202 . ARG . 27784 1 203 . PHE . 27784 1 204 . PRO . 27784 1 205 . ALA . 27784 1 206 . SER . 27784 1 207 . ASP . 27784 1 208 . ILE . 27784 1 209 . PRO . 27784 1 210 . ALA . 27784 1 211 . GLN . 27784 1 212 . ALA . 27784 1 213 . ARG . 27784 1 214 . ALA . 27784 1 215 . LEU . 27784 1 216 . TYR . 27784 1 217 . THR . 27784 1 218 . ARG . 27784 1 219 . HIS . 27784 1 220 . LEU . 27784 1 221 . LEU . 27784 1 222 . ARG . 27784 1 223 . LEU . 27784 1 224 . THR . 27784 1 225 . ALA . 27784 1 226 . ASP . 27784 1 227 . THR . 27784 1 228 . ARG . 27784 1 229 . ALA . 27784 1 230 . ALA . 27784 1 231 . ALA . 27784 1 232 . VAL . 27784 1 233 . PRO . 27784 1 234 . LEU . 27784 1 235 . ASP . 27784 1 236 . PRO . 27784 1 237 . VAL . 27784 1 238 . LEU . 27784 1 239 . ASN . 27784 1 240 . PRO . 27784 1 241 . GLN . 27784 1 242 . THR . 27784 1 243 . ASN . 27784 1 244 . ALA . 27784 1 245 . PRO . 27784 1 246 . THR . 27784 1 247 . PRO . 27784 1 248 . LEU . 27784 1 249 . GLY . 27784 1 250 . GLY . 27784 1 251 . ALA . 27784 1 252 . VAL . 27784 1 253 . LEU . 27784 1 254 . ARG . 27784 1 255 . ALA . 27784 1 256 . THR . 27784 1 257 . SER . 27784 1 258 . PRO . 27784 1 259 . MET . 27784 1 260 . HIS . 27784 1 261 . MET . 27784 1 262 . GLN . 27784 1 263 . TYR . 27784 1 264 . LEU . 27784 1 265 . ARG . 27784 1 266 . ASN . 27784 1 267 . MET . 27784 1 268 . GLY . 27784 1 269 . VAL . 27784 1 270 . GLY . 27784 1 271 . SER . 27784 1 272 . SER . 27784 1 273 . LEU . 27784 1 274 . SER . 27784 1 275 . VAL . 27784 1 276 . SER . 27784 1 277 . VAL . 27784 1 278 . VAL . 27784 1 279 . VAL . 27784 1 280 . GLY . 27784 1 281 . GLY . 27784 1 282 . GLN . 27784 1 283 . LEU . 27784 1 284 . TRP . 27784 1 285 . GLY . 27784 1 286 . LEU . 27784 1 287 . ILE . 27784 1 288 . ALA . 27784 1 289 . CYS . 27784 1 290 . HIS . 27784 1 291 . HIS . 27784 1 292 . GLN . 27784 1 293 . THR . 27784 1 294 . PRO . 27784 1 295 . TYR . 27784 1 296 . VAL . 27784 1 297 . LEU . 27784 1 298 . PRO . 27784 1 299 . PRO . 27784 1 300 . ASP . 27784 1 301 . LEU . 27784 1 302 . ARG . 27784 1 303 . THR . 27784 1 304 . THR . 27784 1 305 . LEU . 27784 1 306 . GLU . 27784 1 307 . TYR . 27784 1 308 . LEU . 27784 1 309 . GLY . 27784 1 310 . ARG . 27784 1 311 . GLU . 27784 1 312 . LEU . 27784 1 313 . SER . 27784 1 314 . GLU . 27784 1 315 . GLN . 27784 1 316 . VAL . 27784 1 317 . GLN . 27784 1 318 . VAL . 27784 1 319 . LYS . 27784 1 320 . GLU . 27784 1 321 . ALA . 27784 1 322 . ALA . 27784 1 323 . ASP . 27784 1 324 . VAL . 27784 1 325 . ALA . 27784 1 326 . ALA . 27784 1 327 . PHE . 27784 1 328 . ARG . 27784 1 329 . GLN . 27784 1 330 . SER . 27784 1 331 . LEU . 27784 1 332 . ARG . 27784 1 333 . GLU . 27784 1 334 . HIS . 27784 1 335 . HIS . 27784 1 336 . ALA . 27784 1 337 . ARG . 27784 1 338 . VAL . 27784 1 339 . ALA . 27784 1 340 . LEU . 27784 1 341 . ALA . 27784 1 342 . ALA . 27784 1 343 . ALA . 27784 1 344 . HIS . 27784 1 345 . SER . 27784 1 346 . LEU . 27784 1 347 . SER . 27784 1 348 . PRO . 27784 1 349 . HIS . 27784 1 350 . ASP . 27784 1 351 . THR . 27784 1 352 . LEU . 27784 1 353 . SER . 27784 1 354 . ASP . 27784 1 355 . PRO . 27784 1 356 . ALA . 27784 1 357 . LEU . 27784 1 358 . ASP . 27784 1 359 . LEU . 27784 1 360 . LEU . 27784 1 361 . GLY . 27784 1 362 . LEU . 27784 1 363 . MET . 27784 1 364 . ARG . 27784 1 365 . ALA . 27784 1 366 . GLY . 27784 1 367 . GLY . 27784 1 368 . LEU . 27784 1 369 . ILE . 27784 1 370 . LEU . 27784 1 371 . ARG . 27784 1 372 . PHE . 27784 1 373 . GLU . 27784 1 374 . GLY . 27784 1 375 . ARG . 27784 1 376 . TRP . 27784 1 377 . GLN . 27784 1 378 . THR . 27784 1 379 . LEU . 27784 1 380 . GLY . 27784 1 381 . GLU . 27784 1 382 . VAL . 27784 1 383 . PRO . 27784 1 384 . PRO . 27784 1 385 . ALA . 27784 1 386 . PRO . 27784 1 387 . ALA . 27784 1 388 . VAL . 27784 1 389 . ASP . 27784 1 390 . ALA . 27784 1 391 . LEU . 27784 1 392 . LEU . 27784 1 393 . ALA . 27784 1 394 . TRP . 27784 1 395 . LEU . 27784 1 396 . GLU . 27784 1 397 . THR . 27784 1 398 . GLN . 27784 1 399 . PRO . 27784 1 400 . GLY . 27784 1 401 . ALA . 27784 1 402 . LEU . 27784 1 403 . VAL . 27784 1 404 . GLN . 27784 1 405 . THR . 27784 1 406 . ASP . 27784 1 407 . ALA . 27784 1 408 . LEU . 27784 1 409 . GLY . 27784 1 410 . GLN . 27784 1 411 . LEU . 27784 1 412 . TRP . 27784 1 413 . PRO . 27784 1 414 . ALA . 27784 1 415 . GLY . 27784 1 416 . ALA . 27784 1 417 . ASP . 27784 1 418 . LEU . 27784 1 419 . ALA . 27784 1 420 . PRO . 27784 1 421 . SER . 27784 1 422 . ALA . 27784 1 423 . ALA . 27784 1 424 . GLY . 27784 1 425 . LEU . 27784 1 426 . LEU . 27784 1 427 . ALA . 27784 1 428 . ILE . 27784 1 429 . SER . 27784 1 430 . VAL . 27784 1 431 . GLY . 27784 1 432 . GLU . 27784 1 433 . GLY . 27784 1 434 . TRP . 27784 1 435 . SER . 27784 1 436 . GLU . 27784 1 437 . CYS . 27784 1 438 . LEU . 27784 1 439 . VAL . 27784 1 440 . TRP . 27784 1 441 . LEU . 27784 1 442 . ARG . 27784 1 443 . PRO . 27784 1 444 . GLU . 27784 1 445 . LEU . 27784 1 446 . ARG . 27784 1 447 . LEU . 27784 1 448 . GLU . 27784 1 449 . VAL . 27784 1 450 . ALA . 27784 1 451 . TRP . 27784 1 452 . GLY . 27784 1 453 . GLY . 27784 1 454 . ALA . 27784 1 455 . THR . 27784 1 456 . PRO . 27784 1 457 . ASP . 27784 1 458 . GLN . 27784 1 459 . ALA . 27784 1 460 . LYS . 27784 1 461 . ASP . 27784 1 462 . ASP . 27784 1 463 . LEU . 27784 1 464 . GLY . 27784 1 465 . PRO . 27784 1 466 . ARG . 27784 1 467 . HIS . 27784 1 468 . SER . 27784 1 469 . PHE . 27784 1 470 . ASP . 27784 1 471 . THR . 27784 1 472 . TYR . 27784 1 473 . LEU . 27784 1 474 . GLU . 27784 1 475 . GLU . 27784 1 476 . LYS . 27784 1 477 . ARG . 27784 1 478 . GLY . 27784 1 479 . TYR . 27784 1 480 . ALA . 27784 1 481 . GLU . 27784 1 482 . PRO . 27784 1 483 . TRP . 27784 1 484 . HIS . 27784 1 485 . PRO . 27784 1 486 . GLY . 27784 1 487 . GLU . 27784 1 488 . ILE . 27784 1 489 . GLU . 27784 1 490 . GLU . 27784 1 491 . ALA . 27784 1 492 . GLN . 27784 1 493 . ASP . 27784 1 494 . LEU . 27784 1 495 . ARG . 27784 1 496 . ASP . 27784 1 497 . THR . 27784 1 498 . LEU . 27784 1 499 . THR . 27784 1 500 . GLY . 27784 1 501 . ALA . 27784 1 502 . LEU . 27784 1 503 . GLU . 27784 1 504 . HIS . 27784 1 505 . HIS . 27784 1 506 . HIS . 27784 1 507 . HIS . 27784 1 508 . HIS . 27784 1 509 . HIS . 27784 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 27784 1 . SER 2 2 27784 1 . ARG 3 3 27784 1 . ASP 4 4 27784 1 . PRO 5 5 27784 1 . LEU 6 6 27784 1 . PRO 7 7 27784 1 . PHE 8 8 27784 1 . PHE 9 9 27784 1 . PRO 10 10 27784 1 . PRO 11 11 27784 1 . LEU 12 12 27784 1 . TYR 13 13 27784 1 . LEU 14 14 27784 1 . GLY 15 15 27784 1 . GLY 16 16 27784 1 . PRO 17 17 27784 1 . GLU 18 18 27784 1 . ILE 19 19 27784 1 . THR 20 20 27784 1 . THR 21 21 27784 1 . GLU 22 22 27784 1 . ASN 23 23 27784 1 . CYS 24 24 27784 1 . GLU 25 25 27784 1 . ARG 26 26 27784 1 . GLU 27 27 27784 1 . PRO 28 28 27784 1 . ILE 29 29 27784 1 . HIS 30 30 27784 1 . ILE 31 31 27784 1 . PRO 32 32 27784 1 . GLY 33 33 27784 1 . SER 34 34 27784 1 . ILE 35 35 27784 1 . GLN 36 36 27784 1 . PRO 37 37 27784 1 . HIS 38 38 27784 1 . GLY 39 39 27784 1 . ALA 40 40 27784 1 . LEU 41 41 27784 1 . LEU 42 42 27784 1 . THR 43 43 27784 1 . ALA 44 44 27784 1 . ASP 45 45 27784 1 . GLY 46 46 27784 1 . HIS 47 47 27784 1 . SER 48 48 27784 1 . GLY 49 49 27784 1 . GLU 50 50 27784 1 . VAL 51 51 27784 1 . LEU 52 52 27784 1 . GLN 53 53 27784 1 . MET 54 54 27784 1 . SER 55 55 27784 1 . LEU 56 56 27784 1 . ASN 57 57 27784 1 . ALA 58 58 27784 1 . ALA 59 59 27784 1 . THR 60 60 27784 1 . PHE 61 61 27784 1 . LEU 62 62 27784 1 . GLY 63 63 27784 1 . GLN 64 64 27784 1 . GLU 65 65 27784 1 . PRO 66 66 27784 1 . THR 67 67 27784 1 . VAL 68 68 27784 1 . LEU 69 69 27784 1 . ARG 70 70 27784 1 . GLY 71 71 27784 1 . GLN 72 72 27784 1 . THR 73 73 27784 1 . LEU 74 74 27784 1 . ALA 75 75 27784 1 . ALA 76 76 27784 1 . LEU 77 77 27784 1 . LEU 78 78 27784 1 . PRO 79 79 27784 1 . GLU 80 80 27784 1 . GLN 81 81 27784 1 . TRP 82 82 27784 1 . PRO 83 83 27784 1 . ALA 84 84 27784 1 . LEU 85 85 27784 1 . GLN 86 86 27784 1 . ALA 87 87 27784 1 . ALA 88 88 27784 1 . LEU 89 89 27784 1 . PRO 90 90 27784 1 . PRO 91 91 27784 1 . GLY 92 92 27784 1 . CYS 93 93 27784 1 . PRO 94 94 27784 1 . ASP 95 95 27784 1 . ALA 96 96 27784 1 . LEU 97 97 27784 1 . GLN 98 98 27784 1 . TYR 99 99 27784 1 . ARG 100 100 27784 1 . ALA 101 101 27784 1 . THR 102 102 27784 1 . LEU 103 103 27784 1 . ASP 104 104 27784 1 . TRP 105 105 27784 1 . PRO 106 106 27784 1 . ALA 107 107 27784 1 . ALA 108 108 27784 1 . GLY 109 109 27784 1 . HIS 110 110 27784 1 . LEU 111 111 27784 1 . SER 112 112 27784 1 . LEU 113 113 27784 1 . THR 114 114 27784 1 . VAL 115 115 27784 1 . HIS 116 116 27784 1 . ARG 117 117 27784 1 . VAL 118 118 27784 1 . GLY 119 119 27784 1 . GLU 120 120 27784 1 . LEU 121 121 27784 1 . LEU 122 122 27784 1 . ILE 123 123 27784 1 . LEU 124 124 27784 1 . GLU 125 125 27784 1 . PHE 126 126 27784 1 . GLU 127 127 27784 1 . PRO 128 128 27784 1 . THR 129 129 27784 1 . GLU 130 130 27784 1 . ALA 131 131 27784 1 . TRP 132 132 27784 1 . ASP 133 133 27784 1 . SER 134 134 27784 1 . THR 135 135 27784 1 . GLY 136 136 27784 1 . PRO 137 137 27784 1 . HIS 138 138 27784 1 . ALA 139 139 27784 1 . LEU 140 140 27784 1 . ARG 141 141 27784 1 . ASN 142 142 27784 1 . ALA 143 143 27784 1 . MET 144 144 27784 1 . SER 145 145 27784 1 . ALA 146 146 27784 1 . LEU 147 147 27784 1 . GLU 148 148 27784 1 . SER 149 149 27784 1 . ALA 150 150 27784 1 . PRO 151 151 27784 1 . ASN 152 152 27784 1 . LEU 153 153 27784 1 . ARG 154 154 27784 1 . ALA 155 155 27784 1 . LEU 156 156 27784 1 . ALA 157 157 27784 1 . GLU 158 158 27784 1 . VAL 159 159 27784 1 . ALA 160 160 27784 1 . THR 161 161 27784 1 . GLN 162 162 27784 1 . THR 163 163 27784 1 . VAL 164 164 27784 1 . ARG 165 165 27784 1 . GLU 166 166 27784 1 . LEU 167 167 27784 1 . THR 168 168 27784 1 . GLY 169 169 27784 1 . PHE 170 170 27784 1 . ASP 171 171 27784 1 . ARG 172 172 27784 1 . VAL 173 173 27784 1 . MET 174 174 27784 1 . LEU 175 175 27784 1 . TYR 176 176 27784 1 . LYS 177 177 27784 1 . PHE 178 178 27784 1 . ALA 179 179 27784 1 . PRO 180 180 27784 1 . ASP 181 181 27784 1 . ALA 182 182 27784 1 . THR 183 183 27784 1 . GLY 184 184 27784 1 . GLU 185 185 27784 1 . VAL 186 186 27784 1 . ILE 187 187 27784 1 . ALA 188 188 27784 1 . GLU 189 189 27784 1 . ALA 190 190 27784 1 . ARG 191 191 27784 1 . ARG 192 192 27784 1 . GLU 193 193 27784 1 . GLY 194 194 27784 1 . LEU 195 195 27784 1 . HIS 196 196 27784 1 . ALA 197 197 27784 1 . PHE 198 198 27784 1 . LEU 199 199 27784 1 . GLY 200 200 27784 1 . HIS 201 201 27784 1 . ARG 202 202 27784 1 . PHE 203 203 27784 1 . PRO 204 204 27784 1 . ALA 205 205 27784 1 . SER 206 206 27784 1 . ASP 207 207 27784 1 . ILE 208 208 27784 1 . PRO 209 209 27784 1 . ALA 210 210 27784 1 . GLN 211 211 27784 1 . ALA 212 212 27784 1 . ARG 213 213 27784 1 . ALA 214 214 27784 1 . LEU 215 215 27784 1 . TYR 216 216 27784 1 . THR 217 217 27784 1 . ARG 218 218 27784 1 . HIS 219 219 27784 1 . LEU 220 220 27784 1 . LEU 221 221 27784 1 . ARG 222 222 27784 1 . LEU 223 223 27784 1 . THR 224 224 27784 1 . ALA 225 225 27784 1 . ASP 226 226 27784 1 . THR 227 227 27784 1 . ARG 228 228 27784 1 . ALA 229 229 27784 1 . ALA 230 230 27784 1 . ALA 231 231 27784 1 . VAL 232 232 27784 1 . PRO 233 233 27784 1 . LEU 234 234 27784 1 . ASP 235 235 27784 1 . PRO 236 236 27784 1 . VAL 237 237 27784 1 . LEU 238 238 27784 1 . ASN 239 239 27784 1 . PRO 240 240 27784 1 . GLN 241 241 27784 1 . THR 242 242 27784 1 . ASN 243 243 27784 1 . ALA 244 244 27784 1 . PRO 245 245 27784 1 . THR 246 246 27784 1 . PRO 247 247 27784 1 . LEU 248 248 27784 1 . GLY 249 249 27784 1 . GLY 250 250 27784 1 . ALA 251 251 27784 1 . VAL 252 252 27784 1 . LEU 253 253 27784 1 . ARG 254 254 27784 1 . ALA 255 255 27784 1 . THR 256 256 27784 1 . SER 257 257 27784 1 . PRO 258 258 27784 1 . MET 259 259 27784 1 . HIS 260 260 27784 1 . MET 261 261 27784 1 . GLN 262 262 27784 1 . TYR 263 263 27784 1 . LEU 264 264 27784 1 . ARG 265 265 27784 1 . ASN 266 266 27784 1 . MET 267 267 27784 1 . GLY 268 268 27784 1 . VAL 269 269 27784 1 . GLY 270 270 27784 1 . SER 271 271 27784 1 . SER 272 272 27784 1 . LEU 273 273 27784 1 . SER 274 274 27784 1 . VAL 275 275 27784 1 . SER 276 276 27784 1 . VAL 277 277 27784 1 . VAL 278 278 27784 1 . VAL 279 279 27784 1 . GLY 280 280 27784 1 . GLY 281 281 27784 1 . GLN 282 282 27784 1 . LEU 283 283 27784 1 . TRP 284 284 27784 1 . GLY 285 285 27784 1 . LEU 286 286 27784 1 . ILE 287 287 27784 1 . ALA 288 288 27784 1 . CYS 289 289 27784 1 . HIS 290 290 27784 1 . HIS 291 291 27784 1 . GLN 292 292 27784 1 . THR 293 293 27784 1 . PRO 294 294 27784 1 . TYR 295 295 27784 1 . VAL 296 296 27784 1 . LEU 297 297 27784 1 . PRO 298 298 27784 1 . PRO 299 299 27784 1 . ASP 300 300 27784 1 . LEU 301 301 27784 1 . ARG 302 302 27784 1 . THR 303 303 27784 1 . THR 304 304 27784 1 . LEU 305 305 27784 1 . GLU 306 306 27784 1 . TYR 307 307 27784 1 . LEU 308 308 27784 1 . GLY 309 309 27784 1 . ARG 310 310 27784 1 . GLU 311 311 27784 1 . LEU 312 312 27784 1 . SER 313 313 27784 1 . GLU 314 314 27784 1 . GLN 315 315 27784 1 . VAL 316 316 27784 1 . GLN 317 317 27784 1 . VAL 318 318 27784 1 . LYS 319 319 27784 1 . GLU 320 320 27784 1 . ALA 321 321 27784 1 . ALA 322 322 27784 1 . ASP 323 323 27784 1 . VAL 324 324 27784 1 . ALA 325 325 27784 1 . ALA 326 326 27784 1 . PHE 327 327 27784 1 . ARG 328 328 27784 1 . GLN 329 329 27784 1 . SER 330 330 27784 1 . LEU 331 331 27784 1 . ARG 332 332 27784 1 . GLU 333 333 27784 1 . HIS 334 334 27784 1 . HIS 335 335 27784 1 . ALA 336 336 27784 1 . ARG 337 337 27784 1 . VAL 338 338 27784 1 . ALA 339 339 27784 1 . LEU 340 340 27784 1 . ALA 341 341 27784 1 . ALA 342 342 27784 1 . ALA 343 343 27784 1 . HIS 344 344 27784 1 . SER 345 345 27784 1 . LEU 346 346 27784 1 . SER 347 347 27784 1 . PRO 348 348 27784 1 . HIS 349 349 27784 1 . ASP 350 350 27784 1 . THR 351 351 27784 1 . LEU 352 352 27784 1 . SER 353 353 27784 1 . ASP 354 354 27784 1 . PRO 355 355 27784 1 . ALA 356 356 27784 1 . LEU 357 357 27784 1 . ASP 358 358 27784 1 . LEU 359 359 27784 1 . LEU 360 360 27784 1 . GLY 361 361 27784 1 . LEU 362 362 27784 1 . MET 363 363 27784 1 . ARG 364 364 27784 1 . ALA 365 365 27784 1 . GLY 366 366 27784 1 . GLY 367 367 27784 1 . LEU 368 368 27784 1 . ILE 369 369 27784 1 . LEU 370 370 27784 1 . ARG 371 371 27784 1 . PHE 372 372 27784 1 . GLU 373 373 27784 1 . GLY 374 374 27784 1 . ARG 375 375 27784 1 . TRP 376 376 27784 1 . GLN 377 377 27784 1 . THR 378 378 27784 1 . LEU 379 379 27784 1 . GLY 380 380 27784 1 . GLU 381 381 27784 1 . VAL 382 382 27784 1 . PRO 383 383 27784 1 . PRO 384 384 27784 1 . ALA 385 385 27784 1 . PRO 386 386 27784 1 . ALA 387 387 27784 1 . VAL 388 388 27784 1 . ASP 389 389 27784 1 . ALA 390 390 27784 1 . LEU 391 391 27784 1 . LEU 392 392 27784 1 . ALA 393 393 27784 1 . TRP 394 394 27784 1 . LEU 395 395 27784 1 . GLU 396 396 27784 1 . THR 397 397 27784 1 . GLN 398 398 27784 1 . PRO 399 399 27784 1 . GLY 400 400 27784 1 . ALA 401 401 27784 1 . LEU 402 402 27784 1 . VAL 403 403 27784 1 . GLN 404 404 27784 1 . THR 405 405 27784 1 . ASP 406 406 27784 1 . ALA 407 407 27784 1 . LEU 408 408 27784 1 . GLY 409 409 27784 1 . GLN 410 410 27784 1 . LEU 411 411 27784 1 . TRP 412 412 27784 1 . PRO 413 413 27784 1 . ALA 414 414 27784 1 . GLY 415 415 27784 1 . ALA 416 416 27784 1 . ASP 417 417 27784 1 . LEU 418 418 27784 1 . ALA 419 419 27784 1 . PRO 420 420 27784 1 . SER 421 421 27784 1 . ALA 422 422 27784 1 . ALA 423 423 27784 1 . GLY 424 424 27784 1 . LEU 425 425 27784 1 . LEU 426 426 27784 1 . ALA 427 427 27784 1 . ILE 428 428 27784 1 . SER 429 429 27784 1 . VAL 430 430 27784 1 . GLY 431 431 27784 1 . GLU 432 432 27784 1 . GLY 433 433 27784 1 . TRP 434 434 27784 1 . SER 435 435 27784 1 . GLU 436 436 27784 1 . CYS 437 437 27784 1 . LEU 438 438 27784 1 . VAL 439 439 27784 1 . TRP 440 440 27784 1 . LEU 441 441 27784 1 . ARG 442 442 27784 1 . PRO 443 443 27784 1 . GLU 444 444 27784 1 . LEU 445 445 27784 1 . ARG 446 446 27784 1 . LEU 447 447 27784 1 . GLU 448 448 27784 1 . VAL 449 449 27784 1 . ALA 450 450 27784 1 . TRP 451 451 27784 1 . GLY 452 452 27784 1 . GLY 453 453 27784 1 . ALA 454 454 27784 1 . THR 455 455 27784 1 . PRO 456 456 27784 1 . ASP 457 457 27784 1 . GLN 458 458 27784 1 . ALA 459 459 27784 1 . LYS 460 460 27784 1 . ASP 461 461 27784 1 . ASP 462 462 27784 1 . LEU 463 463 27784 1 . GLY 464 464 27784 1 . PRO 465 465 27784 1 . ARG 466 466 27784 1 . HIS 467 467 27784 1 . SER 468 468 27784 1 . PHE 469 469 27784 1 . ASP 470 470 27784 1 . THR 471 471 27784 1 . TYR 472 472 27784 1 . LEU 473 473 27784 1 . GLU 474 474 27784 1 . GLU 475 475 27784 1 . LYS 476 476 27784 1 . ARG 477 477 27784 1 . GLY 478 478 27784 1 . TYR 479 479 27784 1 . ALA 480 480 27784 1 . GLU 481 481 27784 1 . PRO 482 482 27784 1 . TRP 483 483 27784 1 . HIS 484 484 27784 1 . PRO 485 485 27784 1 . GLY 486 486 27784 1 . GLU 487 487 27784 1 . ILE 488 488 27784 1 . GLU 489 489 27784 1 . GLU 490 490 27784 1 . ALA 491 491 27784 1 . GLN 492 492 27784 1 . ASP 493 493 27784 1 . LEU 494 494 27784 1 . ARG 495 495 27784 1 . ASP 496 496 27784 1 . THR 497 497 27784 1 . LEU 498 498 27784 1 . THR 499 499 27784 1 . GLY 500 500 27784 1 . ALA 501 501 27784 1 . LEU 502 502 27784 1 . GLU 503 503 27784 1 . HIS 504 504 27784 1 . HIS 505 505 27784 1 . HIS 506 506 27784 1 . HIS 507 507 27784 1 . HIS 508 508 27784 1 . HIS 509 509 27784 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 27784 _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 . . . . . . . . . . . . . 27784 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 27784 _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 . . . 27784 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Pfr_state _Sample.Sf_category sample _Sample.Sf_framecode Pfr_state _Sample.Entry_ID 27784 _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 . . . . 27784 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 27784 1 3 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 27784 1 4 azide 'natural abundance' . . . . . . 0.02 . . % . . . . 27784 1 5 'Complete EDTA free' 'natural abundance' . . . . . . 2 . . tablet/100mL . . . . 27784 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 27784 _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' 0.025 . M 27784 1 pH 6.9 . pH 27784 1 pressure 1 . atm 27784 1 temperature 273 . K 27784 1 stop_ save_ ############################ # Computer software used # ############################ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 27784 _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 . . 27784 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 27784 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 27784 _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 27784 _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 . . . 27784 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 27784 _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 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 2 '3D HNCA' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 4 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 5 '3D HN(CO)CACB' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 6 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 7 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 1 8 '3D 1H-15N NOESY TROSY' no . . . . . . . . . . . . 1 $Pfr_state isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27784 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 27784 _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 . . . . . 27784 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27784 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27784 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 27784 _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' . . . 27784 1 2 '3D HNCA' . . . 27784 1 3 '3D HNCACB' . . . 27784 1 4 '3D HN(CO)CA' . . . 27784 1 5 '3D HN(CO)CACB' . . . 27784 1 6 '3D HN(CA)CO' . . . 27784 1 7 '2D 1H-15N TROSY' . . . 27784 1 8 '3D 1H-15N NOESY TROSY' . . . 27784 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CCPN . . 27784 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 17 17 PRO C C 13 175.6614 . . 1 . . . . . 17 P CO . 27784 1 2 . 1 . 1 17 17 PRO CA C 13 61.7029 . . 1 . . . . . 17 P CA . 27784 1 3 . 1 . 1 17 17 PRO CB C 13 31.3049 . . 1 . . . . . 17 P CB . 27784 1 4 . 1 . 1 18 18 GLU N N 15 116.8126 . . 1 . . . . . 18 E N . 27784 1 5 . 1 . 1 18 18 GLU H H 1 7.7668 . . 1 . . . . . 18 E HN . 27784 1 6 . 1 . 1 18 18 GLU C C 13 176.9086 . . 1 . . . . . 18 E CO . 27784 1 7 . 1 . 1 18 18 GLU CA C 13 56.4258 . . 1 . . . . . 18 E CA . 27784 1 8 . 1 . 1 18 18 GLU CB C 13 29.1469 . . 1 . . . . . 18 E CB . 27784 1 9 . 1 . 1 19 19 ILE N N 15 126.6909 . . 1 . . . . . 19 I N . 27784 1 10 . 1 . 1 19 19 ILE H H 1 8.4717 . . 1 . . . . . 19 I HN . 27784 1 11 . 1 . 1 19 19 ILE C C 13 176.3222 . . 1 . . . . . 19 I CO . 27784 1 12 . 1 . 1 19 19 ILE CA C 13 58.2944 . . 1 . . . . . 19 I CA . 27784 1 13 . 1 . 1 19 19 ILE CB C 13 34.8650 . . 1 . . . . . 19 I CB . 27784 1 14 . 1 . 1 20 20 THR N N 15 120.7636 . . 1 . . . . . 20 T N . 27784 1 15 . 1 . 1 20 20 THR H H 1 9.5254 . . 1 . . . . . 20 T HN . 27784 1 16 . 1 . 1 20 20 THR C C 13 175.2420 . . 1 . . . . . 20 T CO . 27784 1 17 . 1 . 1 20 20 THR CA C 13 59.3803 . . 1 . . . . . 20 T CA . 27784 1 18 . 1 . 1 20 20 THR CB C 13 72.5904 . . 1 . . . . . 20 T CB . 27784 1 19 . 1 . 1 21 21 THR N N 15 109.2726 . . 1 . . . . . 21 T N . 27784 1 20 . 1 . 1 21 21 THR H H 1 8.4305 . . 1 . . . . . 21 T HN . 27784 1 21 . 1 . 1 21 21 THR C C 13 176.0596 . . 1 . . . . . 21 T CO . 27784 1 22 . 1 . 1 21 21 THR CA C 13 64.2843 . . 1 . . . . . 21 T CA . 27784 1 23 . 1 . 1 21 21 THR CB C 13 68.0952 . . 1 . . . . . 21 T CB . 27784 1 24 . 1 . 1 22 22 GLU N N 15 118.8019 . . 1 . . . . . 22 E N . 27784 1 25 . 1 . 1 22 22 GLU H H 1 8.0901 . . 1 . . . . . 22 E HN . 27784 1 26 . 1 . 1 22 22 GLU CA C 13 57.2120 . . 1 . . . . . 22 E CA . 27784 1 27 . 1 . 1 32 32 PRO C C 13 179.3289 . . 1 . . . . . 32 P CO . 27784 1 28 . 1 . 1 32 32 PRO CA C 13 65.0314 . . 1 . . . . . 32 P CA . 27784 1 29 . 1 . 1 33 33 GLY N N 15 109.8360 . . 1 . . . . . 33 G N . 27784 1 30 . 1 . 1 33 33 GLY H H 1 8.5676 . . 1 . . . . . 33 G HN . 27784 1 31 . 1 . 1 33 33 GLY C C 13 172.1679 . . 1 . . . . . 33 G CO . 27784 1 32 . 1 . 1 33 33 GLY CA C 13 46.4686 . . 1 . . . . . 33 G CA . 27784 1 33 . 1 . 1 34 34 SER N N 15 108.6518 . . 1 . . . . . 34 S N . 27784 1 34 . 1 . 1 34 34 SER H H 1 6.9943 . . 1 . . . . . 34 S HN . 27784 1 35 . 1 . 1 34 34 SER C C 13 172.8614 . . 1 . . . . . 34 S CO . 27784 1 36 . 1 . 1 34 34 SER CA C 13 56.1223 . . 1 . . . . . 34 S CA . 27784 1 37 . 1 . 1 34 34 SER CB C 13 65.1311 . . 1 . . . . . 34 S CB . 27784 1 38 . 1 . 1 35 35 ILE N N 15 110.7382 . . 1 . . . . . 35 I N . 27784 1 39 . 1 . 1 35 35 ILE H H 1 8.8290 . . 1 . . . . . 35 I HN . 27784 1 40 . 1 . 1 35 35 ILE CA C 13 58.3372 . . 1 . . . . . 35 I CA . 27784 1 41 . 1 . 1 36 36 GLN N N 15 122.5213 . . 1 . . . . . 36 Q N . 27784 1 42 . 1 . 1 36 36 GLN H H 1 8.9920 . . 1 . . . . . 36 Q HN . 27784 1 43 . 1 . 1 36 36 GLN CA C 13 53.7778 . . 1 . . . . . 36 Q CA . 27784 1 44 . 1 . 1 36 36 GLN CB C 13 29.1993 . . 1 . . . . . 36 Q CB . 27784 1 45 . 1 . 1 37 37 PRO C C 13 176.7881 . . 1 . . . . . 37 P CO . 27784 1 46 . 1 . 1 37 37 PRO CA C 13 64.2402 . . 1 . . . . . 37 P CA . 27784 1 47 . 1 . 1 38 38 HIS N N 15 117.9827 . . 1 . . . . . 38 H N . 27784 1 48 . 1 . 1 38 38 HIS H H 1 7.8673 . . 1 . . . . . 38 H HN . 27784 1 49 . 1 . 1 38 38 HIS C C 13 174.1242 . . 1 . . . . . 38 H CO . 27784 1 50 . 1 . 1 38 38 HIS CA C 13 57.4867 . . 1 . . . . . 38 H CA . 27784 1 51 . 1 . 1 38 38 HIS CB C 13 29.2582 . . 1 . . . . . 38 H CB . 27784 1 52 . 1 . 1 39 39 GLY N N 15 106.2029 . . 1 . . . . . 39 G N . 27784 1 53 . 1 . 1 39 39 GLY H H 1 6.6263 . . 1 . . . . . 39 G HN . 27784 1 54 . 1 . 1 39 39 GLY C C 13 169.3206 . . 1 . . . . . 39 G CO . 27784 1 55 . 1 . 1 39 39 GLY CA C 13 43.5876 . . 1 . . . . . 39 G CA . 27784 1 56 . 1 . 1 40 40 ALA N N 15 116.5617 . . 1 . . . . . 40 A N . 27784 1 57 . 1 . 1 40 40 ALA H H 1 8.1320 . . 1 . . . . . 40 A HN . 27784 1 58 . 1 . 1 40 40 ALA CA C 13 49.3290 . . 1 . . . . . 40 A CA . 27784 1 59 . 1 . 1 43 43 THR C C 13 173.9611 . . 1 . . . . . 43 T CO . 27784 1 60 . 1 . 1 44 44 ALA N N 15 123.6086 . . 1 . . . . . 44 A N . 27784 1 61 . 1 . 1 44 44 ALA H H 1 9.3968 . . 1 . . . . . 44 A HN . 27784 1 62 . 1 . 1 44 44 ALA C C 13 175.3960 . . 1 . . . . . 44 A CO . 27784 1 63 . 1 . 1 44 44 ALA CB C 13 23.1216 . . 1 . . . . . 44 A CB . 27784 1 64 . 1 . 1 45 45 ASP N N 15 122.7666 . . 1 . . . . . 45 D N . 27784 1 65 . 1 . 1 45 45 ASP H H 1 8.8298 . . 1 . . . . . 45 D HN . 27784 1 66 . 1 . 1 45 45 ASP C C 13 178.3734 . . 1 . . . . . 45 D CO . 27784 1 67 . 1 . 1 45 45 ASP CA C 13 55.4708 . . 1 . . . . . 45 D CA . 27784 1 68 . 1 . 1 45 45 ASP CB C 13 43.7182 . . 1 . . . . . 45 D CB . 27784 1 69 . 1 . 1 46 46 GLY N N 15 112.8256 . . 1 . . . . . 46 G N . 27784 1 70 . 1 . 1 46 46 GLY H H 1 8.8896 . . 1 . . . . . 46 G HN . 27784 1 71 . 1 . 1 46 46 GLY C C 13 173.2423 . . 1 . . . . . 46 G CO . 27784 1 72 . 1 . 1 46 46 GLY CA C 13 46.2539 . . 1 . . . . . 46 G CA . 27784 1 73 . 1 . 1 47 47 HIS N N 15 119.5029 . . 1 . . . . . 47 H N . 27784 1 74 . 1 . 1 47 47 HIS H H 1 9.0554 . . 1 . . . . . 47 H HN . 27784 1 75 . 1 . 1 47 47 HIS C C 13 176.7344 . . 1 . . . . . 47 H CO . 27784 1 76 . 1 . 1 47 47 HIS CA C 13 57.6160 . . 1 . . . . . 47 H CA . 27784 1 77 . 1 . 1 47 47 HIS CB C 13 30.8414 . . 1 . . . . . 47 H CB . 27784 1 78 . 1 . 1 48 48 SER N N 15 114.3290 . . 1 . . . . . 48 S N . 27784 1 79 . 1 . 1 48 48 SER H H 1 9.3707 . . 1 . . . . . 48 S HN . 27784 1 80 . 1 . 1 48 48 SER C C 13 177.1109 . . 1 . . . . . 48 S CO . 27784 1 81 . 1 . 1 48 48 SER CA C 13 58.3727 . . 1 . . . . . 48 S CA . 27784 1 82 . 1 . 1 48 48 SER CB C 13 64.6061 . . 1 . . . . . 48 S CB . 27784 1 83 . 1 . 1 49 49 GLY N N 15 111.5148 . . 1 . . . . . 49 G N . 27784 1 84 . 1 . 1 49 49 GLY H H 1 8.3994 . . 1 . . . . . 49 G HN . 27784 1 85 . 1 . 1 49 49 GLY C C 13 173.8235 . . 1 . . . . . 49 G CO . 27784 1 86 . 1 . 1 49 49 GLY CA C 13 46.1158 . . 1 . . . . . 49 G CA . 27784 1 87 . 1 . 1 50 50 GLU N N 15 121.7959 . . 1 . . . . . 50 E N . 27784 1 88 . 1 . 1 50 50 GLU H H 1 8.1107 . . 1 . . . . . 50 E HN . 27784 1 89 . 1 . 1 50 50 GLU C C 13 176.1355 . . 1 . . . . . 50 E CO . 27784 1 90 . 1 . 1 50 50 GLU CA C 13 57.0061 . . 1 . . . . . 50 E CA . 27784 1 91 . 1 . 1 50 50 GLU CB C 13 29.8777 . . 1 . . . . . 50 E CB . 27784 1 92 . 1 . 1 51 51 VAL N N 15 126.4851 . . 1 . . . . . 51 V N . 27784 1 93 . 1 . 1 51 51 VAL H H 1 8.7064 . . 1 . . . . . 51 V HN . 27784 1 94 . 1 . 1 51 51 VAL C C 13 176.1844 . . 1 . . . . . 51 V CO . 27784 1 95 . 1 . 1 51 51 VAL CA C 13 64.2127 . . 1 . . . . . 51 V CA . 27784 1 96 . 1 . 1 51 51 VAL CB C 13 30.8382 . . 1 . . . . . 51 V CB . 27784 1 97 . 1 . 1 52 52 LEU N N 15 129.5140 . . 1 . . . . . 52 L N . 27784 1 98 . 1 . 1 52 52 LEU H H 1 9.1898 . . 1 . . . . . 52 L HN . 27784 1 99 . 1 . 1 52 52 LEU C C 13 176.9358 . . 1 . . . . . 52 L CO . 27784 1 100 . 1 . 1 52 52 LEU CA C 13 55.4951 . . 1 . . . . . 52 L CA . 27784 1 101 . 1 . 1 53 53 GLN N N 15 114.4175 . . 1 . . . . . 53 Q N . 27784 1 102 . 1 . 1 53 53 GLN H H 1 7.6499 . . 1 . . . . . 53 Q HN . 27784 1 103 . 1 . 1 53 53 GLN C C 13 174.6406 . . 1 . . . . . 53 Q CO . 27784 1 104 . 1 . 1 53 53 GLN CA C 13 53.5437 . . 1 . . . . . 53 Q CA . 27784 1 105 . 1 . 1 54 54 MET N N 15 114.9369 . . 1 . . . . . 54 M N . 27784 1 106 . 1 . 1 54 54 MET H H 1 8.4015 . . 1 . . . . . 54 M HN . 27784 1 107 . 1 . 1 54 54 MET C C 13 175.7444 . . 1 . . . . . 54 M CO . 27784 1 108 . 1 . 1 54 54 MET CA C 13 53.5096 . . 1 . . . . . 54 M CA . 27784 1 109 . 1 . 1 55 55 SER N N 15 118.8498 . . 1 . . . . . 55 S N . 27784 1 110 . 1 . 1 55 55 SER H H 1 9.3890 . . 1 . . . . . 55 S HN . 27784 1 111 . 1 . 1 55 55 SER CA C 13 58.5287 . . 1 . . . . . 55 S CA . 27784 1 112 . 1 . 1 55 55 SER CB C 13 63.3423 . . 1 . . . . . 55 S CB . 27784 1 113 . 1 . 1 56 56 LEU N N 15 121.8797 . . 1 . . . . . 56 L N . 27784 1 114 . 1 . 1 56 56 LEU H H 1 8.4040 . . 1 . . . . . 56 L HN . 27784 1 115 . 1 . 1 56 56 LEU CA C 13 57.5896 . . 1 . . . . . 56 L CA . 27784 1 116 . 1 . 1 58 58 ALA N N 15 123.4910 . . 1 . . . . . 58 A N . 27784 1 117 . 1 . 1 58 58 ALA H H 1 7.9220 . . 1 . . . . . 58 A HN . 27784 1 118 . 1 . 1 58 58 ALA C C 13 178.4572 . . 1 . . . . . 58 A CO . 27784 1 119 . 1 . 1 58 58 ALA CA C 13 56.1490 . . 1 . . . . . 58 A CA . 27784 1 120 . 1 . 1 58 58 ALA CB C 13 17.9791 . . 1 . . . . . 58 A CB . 27784 1 121 . 1 . 1 59 59 ALA N N 15 119.0368 . . 1 . . . . . 59 A N . 27784 1 122 . 1 . 1 59 59 ALA H H 1 8.4780 . . 1 . . . . . 59 A HN . 27784 1 123 . 1 . 1 59 59 ALA C C 13 180.0220 . . 1 . . . . . 59 A CO . 27784 1 124 . 1 . 1 59 59 ALA CA C 13 55.4404 . . 1 . . . . . 59 A CA . 27784 1 125 . 1 . 1 59 59 ALA CB C 13 17.2633 . . 1 . . . . . 59 A CB . 27784 1 126 . 1 . 1 60 60 THR N N 15 113.0637 . . 1 . . . . . 60 T N . 27784 1 127 . 1 . 1 60 60 THR H H 1 7.9269 . . 1 . . . . . 60 T HN . 27784 1 128 . 1 . 1 60 60 THR C C 13 176.5515 . . 1 . . . . . 60 T CO . 27784 1 129 . 1 . 1 60 60 THR CA C 13 65.0642 . . 1 . . . . . 60 T CA . 27784 1 130 . 1 . 1 60 60 THR CB C 13 68.3059 . . 1 . . . . . 60 T CB . 27784 1 131 . 1 . 1 61 61 PHE N N 15 122.1447 . . 1 . . . . . 61 F N . 27784 1 132 . 1 . 1 61 61 PHE H H 1 8.0323 . . 1 . . . . . 61 F HN . 27784 1 133 . 1 . 1 61 61 PHE C C 13 176.3235 . . 1 . . . . . 61 F CO . 27784 1 134 . 1 . 1 61 61 PHE CA C 13 60.6265 . . 1 . . . . . 61 F CA . 27784 1 135 . 1 . 1 62 62 LEU N N 15 112.6426 . . 1 . . . . . 62 L N . 27784 1 136 . 1 . 1 62 62 LEU H H 1 8.1080 . . 1 . . . . . 62 L HN . 27784 1 137 . 1 . 1 62 62 LEU C C 13 178.3686 . . 1 . . . . . 62 L CO . 27784 1 138 . 1 . 1 62 62 LEU CA C 13 53.8849 . . 1 . . . . . 62 L CA . 27784 1 139 . 1 . 1 63 63 GLY N N 15 110.4634 . . 1 . . . . . 63 G N . 27784 1 140 . 1 . 1 63 63 GLY H H 1 7.8270 . . 1 . . . . . 63 G HN . 27784 1 141 . 1 . 1 63 63 GLY C C 13 174.2159 . . 1 . . . . . 63 G CO . 27784 1 142 . 1 . 1 63 63 GLY CA C 13 46.6369 . . 1 . . . . . 63 G CA . 27784 1 143 . 1 . 1 64 64 GLN N N 15 116.7931 . . 1 . . . . . 64 Q N . 27784 1 144 . 1 . 1 64 64 GLN H H 1 7.8494 . . 1 . . . . . 64 Q HN . 27784 1 145 . 1 . 1 64 64 GLN C C 13 174.3076 . . 1 . . . . . 64 Q CO . 27784 1 146 . 1 . 1 64 64 GLN CA C 13 53.0836 . . 1 . . . . . 64 Q CA . 27784 1 147 . 1 . 1 64 64 GLN CB C 13 32.2461 . . 1 . . . . . 64 Q CB . 27784 1 148 . 1 . 1 65 65 GLU N N 15 121.2286 . . 1 . . . . . 65 E N . 27784 1 149 . 1 . 1 65 65 GLU H H 1 8.4870 . . 1 . . . . . 65 E HN . 27784 1 150 . 1 . 1 65 65 GLU CA C 13 54.4612 . . 1 . . . . . 65 E CA . 27784 1 151 . 1 . 1 65 65 GLU CB C 13 28.9190 . . 1 . . . . . 65 E CB . 27784 1 152 . 1 . 1 67 67 THR N N 15 106.8803 . . 1 . . . . . 67 T N . 27784 1 153 . 1 . 1 67 67 THR H H 1 7.8260 . . 1 . . . . . 67 T HN . 27784 1 154 . 1 . 1 67 67 THR C C 13 176.2031 . . 1 . . . . . 67 T CO . 27784 1 155 . 1 . 1 67 67 THR CA C 13 64.1604 . . 1 . . . . . 67 T CA . 27784 1 156 . 1 . 1 67 67 THR CB C 13 68.2433 . . 1 . . . . . 67 T CB . 27784 1 157 . 1 . 1 68 68 VAL N N 15 121.0636 . . 1 . . . . . 68 V N . 27784 1 158 . 1 . 1 68 68 VAL H H 1 7.2459 . . 1 . . . . . 68 V HN . 27784 1 159 . 1 . 1 68 68 VAL C C 13 177.7019 . . 1 . . . . . 68 V CO . 27784 1 160 . 1 . 1 68 68 VAL CA C 13 63.7534 . . 1 . . . . . 68 V CA . 27784 1 161 . 1 . 1 68 68 VAL CB C 13 31.4589 . . 1 . . . . . 68 V CB . 27784 1 162 . 1 . 1 69 69 LEU N N 15 120.7709 . . 1 . . . . . 69 L N . 27784 1 163 . 1 . 1 69 69 LEU H H 1 7.6583 . . 1 . . . . . 69 L HN . 27784 1 164 . 1 . 1 69 69 LEU C C 13 177.3212 . . 1 . . . . . 69 L CO . 27784 1 165 . 1 . 1 69 69 LEU CA C 13 57.0975 . . 1 . . . . . 69 L CA . 27784 1 166 . 1 . 1 69 69 LEU CB C 13 42.3042 . . 1 . . . . . 69 L CB . 27784 1 167 . 1 . 1 70 70 ARG N N 15 114.7197 . . 1 . . . . . 70 R N . 27784 1 168 . 1 . 1 70 70 ARG H H 1 7.6485 . . 1 . . . . . 70 R HN . 27784 1 169 . 1 . 1 70 70 ARG C C 13 176.9800 . . 1 . . . . . 70 R CO . 27784 1 170 . 1 . 1 70 70 ARG CA C 13 57.9124 . . 1 . . . . . 70 R CA . 27784 1 171 . 1 . 1 70 70 ARG CB C 13 29.0690 . . 1 . . . . . 70 R CB . 27784 1 172 . 1 . 1 71 71 GLY N N 15 109.7769 . . 1 . . . . . 71 G N . 27784 1 173 . 1 . 1 71 71 GLY H H 1 7.9438 . . 1 . . . . . 71 G HN . 27784 1 174 . 1 . 1 71 71 GLY C C 13 174.6031 . . 1 . . . . . 71 G CO . 27784 1 175 . 1 . 1 71 71 GLY CA C 13 44.9449 . . 1 . . . . . 71 G CA . 27784 1 176 . 1 . 1 72 72 GLN N N 15 120.0211 . . 1 . . . . . 72 Q N . 27784 1 177 . 1 . 1 72 72 GLN H H 1 7.5663 . . 1 . . . . . 72 Q HN . 27784 1 178 . 1 . 1 72 72 GLN C C 13 175.6257 . . 1 . . . . . 72 Q CO . 27784 1 179 . 1 . 1 72 72 GLN CA C 13 55.0516 . . 1 . . . . . 72 Q CA . 27784 1 180 . 1 . 1 72 72 GLN CB C 13 29.7373 . . 1 . . . . . 72 Q CB . 27784 1 181 . 1 . 1 73 73 THR N N 15 109.9574 . . 1 . . . . . 73 T N . 27784 1 182 . 1 . 1 73 73 THR H H 1 8.0547 . . 1 . . . . . 73 T HN . 27784 1 183 . 1 . 1 73 73 THR C C 13 176.9740 . . 1 . . . . . 73 T CO . 27784 1 184 . 1 . 1 73 73 THR CA C 13 58.9920 . . 1 . . . . . 73 T CA . 27784 1 185 . 1 . 1 73 73 THR CB C 13 70.7607 . . 1 . . . . . 73 T CB . 27784 1 186 . 1 . 1 74 74 LEU N N 15 121.4036 . . 1 . . . . . 74 L N . 27784 1 187 . 1 . 1 74 74 LEU H H 1 8.6360 . . 1 . . . . . 74 L HN . 27784 1 188 . 1 . 1 74 74 LEU C C 13 177.4969 . . 1 . . . . . 74 L CO . 27784 1 189 . 1 . 1 74 74 LEU CA C 13 56.9517 . . 1 . . . . . 74 L CA . 27784 1 190 . 1 . 1 74 74 LEU CB C 13 40.7813 . . 1 . . . . . 74 L CB . 27784 1 191 . 1 . 1 75 75 ALA N N 15 118.5671 . . 1 . . . . . 75 A N . 27784 1 192 . 1 . 1 75 75 ALA H H 1 7.2045 . . 1 . . . . . 75 A HN . 27784 1 193 . 1 . 1 75 75 ALA C C 13 178.4164 . . 1 . . . . . 75 A CO . 27784 1 194 . 1 . 1 75 75 ALA CA C 13 54.3229 . . 1 . . . . . 75 A CA . 27784 1 195 . 1 . 1 75 75 ALA CB C 13 17.1657 . . 1 . . . . . 75 A CB . 27784 1 196 . 1 . 1 76 76 ALA N N 15 117.3754 . . 1 . . . . . 76 A N . 27784 1 197 . 1 . 1 76 76 ALA H H 1 7.0414 . . 1 . . . . . 76 A HN . 27784 1 198 . 1 . 1 76 76 ALA C C 13 179.3972 . . 1 . . . . . 76 A CO . 27784 1 199 . 1 . 1 76 76 ALA CA C 13 52.6706 . . 1 . . . . . 76 A CA . 27784 1 200 . 1 . 1 76 76 ALA CB C 13 18.7888 . . 1 . . . . . 76 A CB . 27784 1 201 . 1 . 1 77 77 LEU H H 1 7.8925 . . 1 . . . . . 77 L HN . 27784 1 202 . 1 . 1 77 77 LEU C C 13 176.8745 . . 1 . . . . . 77 L CO . 27784 1 203 . 1 . 1 77 77 LEU CA C 13 56.8410 . . 1 . . . . . 77 L CA . 27784 1 204 . 1 . 1 77 77 LEU CB C 13 43.9482 . . 1 . . . . . 77 L CB . 27784 1 205 . 1 . 1 78 78 LEU N N 15 116.3529 . . 1 . . . . . 78 L N . 27784 1 206 . 1 . 1 78 78 LEU H H 1 8.4130 . . 1 . . . . . 78 L HN . 27784 1 207 . 1 . 1 78 78 LEU CA C 13 51.2090 . . 1 . . . . . 78 L CA . 27784 1 208 . 1 . 1 78 78 LEU CB C 13 42.5207 . . 1 . . . . . 78 L CB . 27784 1 209 . 1 . 1 79 79 PRO C C 13 179.9698 . . 1 . . . . . 79 P CO . 27784 1 210 . 1 . 1 79 79 PRO CA C 13 65.7485 . . 1 . . . . . 79 P CA . 27784 1 211 . 1 . 1 79 79 PRO CB C 13 30.9075 . . 1 . . . . . 79 P CB . 27784 1 212 . 1 . 1 80 80 GLU N N 15 113.7066 . . 1 . . . . . 80 E N . 27784 1 213 . 1 . 1 80 80 GLU H H 1 8.5357 . . 1 . . . . . 80 E HN . 27784 1 214 . 1 . 1 80 80 GLU C C 13 178.3116 . . 1 . . . . . 80 E CO . 27784 1 215 . 1 . 1 80 80 GLU CA C 13 57.6806 . . 1 . . . . . 80 E CA . 27784 1 216 . 1 . 1 80 80 GLU CB C 13 28.8398 . . 1 . . . . . 80 E CB . 27784 1 217 . 1 . 1 81 81 GLN N N 15 116.6329 . . 1 . . . . . 81 Q N . 27784 1 218 . 1 . 1 81 81 GLN H H 1 7.5108 . . 1 . . . . . 81 Q HN . 27784 1 219 . 1 . 1 81 81 GLN C C 13 176.8808 . . 1 . . . . . 81 Q CO . 27784 1 220 . 1 . 1 81 81 GLN CA C 13 57.4100 . . 1 . . . . . 81 Q CA . 27784 1 221 . 1 . 1 81 81 GLN CB C 13 28.0852 . . 1 . . . . . 81 Q CB . 27784 1 222 . 1 . 1 82 82 TRP N N 15 120.5143 . . 1 . . . . . 82 W N . 27784 1 223 . 1 . 1 82 82 TRP H H 1 8.7637 . . 1 . . . . . 82 W HN . 27784 1 224 . 1 . 1 82 82 TRP C C 13 173.5526 . . 1 . . . . . 82 W CO . 27784 1 225 . 1 . 1 82 82 TRP CA C 13 61.2748 . . 1 . . . . . 82 W CA . 27784 1 226 . 1 . 1 82 82 TRP CB C 13 27.5533 . . 1 . . . . . 82 W CB . 27784 1 227 . 1 . 1 83 83 PRO C C 13 179.6092 . . 1 . . . . . 83 P CO . 27784 1 228 . 1 . 1 83 83 PRO CA C 13 65.3075 . . 1 . . . . . 83 P CA . 27784 1 229 . 1 . 1 84 84 ALA N N 15 120.4331 . . 1 . . . . . 84 A N . 27784 1 230 . 1 . 1 84 84 ALA H H 1 6.7456 . . 1 . . . . . 84 A HN . 27784 1 231 . 1 . 1 84 84 ALA C C 13 180.1639 . . 1 . . . . . 84 A CO . 27784 1 232 . 1 . 1 84 84 ALA CA C 13 54.1994 . . 1 . . . . . 84 A CA . 27784 1 233 . 1 . 1 84 84 ALA CB C 13 17.9139 . . 1 . . . . . 84 A CB . 27784 1 234 . 1 . 1 85 85 LEU N N 15 121.3082 . . 1 . . . . . 85 L N . 27784 1 235 . 1 . 1 85 85 LEU H H 1 8.3903 . . 1 . . . . . 85 L HN . 27784 1 236 . 1 . 1 85 85 LEU C C 13 177.9446 . . 1 . . . . . 85 L CO . 27784 1 237 . 1 . 1 85 85 LEU CA C 13 57.6875 . . 1 . . . . . 85 L CA . 27784 1 238 . 1 . 1 86 86 GLN N N 15 117.0188 . . 1 . . . . . 86 Q N . 27784 1 239 . 1 . 1 86 86 GLN H H 1 7.3514 . . 1 . . . . . 86 Q HN . 27784 1 240 . 1 . 1 86 86 GLN C C 13 178.0279 . . 1 . . . . . 86 Q CO . 27784 1 241 . 1 . 1 86 86 GLN CA C 13 58.3022 . . 1 . . . . . 86 Q CA . 27784 1 242 . 1 . 1 87 87 ALA N N 15 118.1611 . . 1 . . . . . 87 A N . 27784 1 243 . 1 . 1 87 87 ALA H H 1 6.9707 . . 1 . . . . . 87 A HN . 27784 1 244 . 1 . 1 87 87 ALA C C 13 179.0173 . . 1 . . . . . 87 A CO . 27784 1 245 . 1 . 1 87 87 ALA CA C 13 53.1515 . . 1 . . . . . 87 A CA . 27784 1 246 . 1 . 1 87 87 ALA CB C 13 17.8529 . . 1 . . . . . 87 A CB . 27784 1 247 . 1 . 1 88 88 ALA N N 15 118.9314 . . 1 . . . . . 88 A N . 27784 1 248 . 1 . 1 88 88 ALA H H 1 7.6728 . . 1 . . . . . 88 A HN . 27784 1 249 . 1 . 1 88 88 ALA C C 13 177.4758 . . 1 . . . . . 88 A CO . 27784 1 250 . 1 . 1 88 88 ALA CA C 13 53.4509 . . 1 . . . . . 88 A CA . 27784 1 251 . 1 . 1 89 89 LEU N N 15 115.5309 . . 1 . . . . . 89 L N . 27784 1 252 . 1 . 1 89 89 LEU H H 1 7.1010 . . 1 . . . . . 89 L HN . 27784 1 253 . 1 . 1 89 89 LEU C C 13 177.4954 . . 1 . . . . . 89 L CO . 27784 1 254 . 1 . 1 89 89 LEU CA C 13 50.6432 . . 1 . . . . . 89 L CA . 27784 1 255 . 1 . 1 94 94 PRO C C 13 178.2329 . . 1 . . . . . 94 P CO . 27784 1 256 . 1 . 1 94 94 PRO CA C 13 63.0773 . . 1 . . . . . 94 P CA . 27784 1 257 . 1 . 1 94 94 PRO CB C 13 31.5766 . . 1 . . . . . 94 P CB . 27784 1 258 . 1 . 1 95 95 ASP N N 15 123.1658 . . 1 . . . . . 95 D N . 27784 1 259 . 1 . 1 95 95 ASP H H 1 8.8326 . . 1 . . . . . 95 D HN . 27784 1 260 . 1 . 1 95 95 ASP C C 13 176.0586 . . 1 . . . . . 95 D CO . 27784 1 261 . 1 . 1 95 95 ASP CA C 13 55.6083 . . 1 . . . . . 95 D CA . 27784 1 262 . 1 . 1 95 95 ASP CB C 13 40.1596 . . 1 . . . . . 95 D CB . 27784 1 263 . 1 . 1 96 96 ALA N N 15 117.2261 . . 1 . . . . . 96 A N . 27784 1 264 . 1 . 1 96 96 ALA H H 1 7.0449 . . 1 . . . . . 96 A HN . 27784 1 265 . 1 . 1 96 96 ALA C C 13 177.7203 . . 1 . . . . . 96 A CO . 27784 1 266 . 1 . 1 96 96 ALA CA C 13 51.4428 . . 1 . . . . . 96 A CA . 27784 1 267 . 1 . 1 96 96 ALA CB C 13 18.7357 . . 1 . . . . . 96 A CB . 27784 1 268 . 1 . 1 97 97 LEU N N 15 121.3191 . . 1 . . . . . 97 L N . 27784 1 269 . 1 . 1 97 97 LEU H H 1 7.3752 . . 1 . . . . . 97 L HN . 27784 1 270 . 1 . 1 97 97 LEU C C 13 175.4697 . . 1 . . . . . 97 L CO . 27784 1 271 . 1 . 1 97 97 LEU CA C 13 55.1693 . . 1 . . . . . 97 L CA . 27784 1 272 . 1 . 1 97 97 LEU CB C 13 41.9012 . . 1 . . . . . 97 L CB . 27784 1 273 . 1 . 1 98 98 GLN N N 15 121.0180 . . 1 . . . . . 98 Q N . 27784 1 274 . 1 . 1 98 98 GLN H H 1 8.2712 . . 1 . . . . . 98 Q HN . 27784 1 275 . 1 . 1 98 98 GLN C C 13 176.6353 . . 1 . . . . . 98 Q CO . 27784 1 276 . 1 . 1 98 98 GLN CA C 13 53.5262 . . 1 . . . . . 98 Q CA . 27784 1 277 . 1 . 1 98 98 GLN CB C 13 31.4014 . . 1 . . . . . 98 Q CB . 27784 1 278 . 1 . 1 99 99 TYR N N 15 125.0260 . . 1 . . . . . 99 Y N . 27784 1 279 . 1 . 1 99 99 TYR H H 1 9.3452 . . 1 . . . . . 99 Y HN . 27784 1 280 . 1 . 1 99 99 TYR C C 13 173.9014 . . 1 . . . . . 99 Y CO . 27784 1 281 . 1 . 1 99 99 TYR CA C 13 56.9451 . . 1 . . . . . 99 Y CA . 27784 1 282 . 1 . 1 99 99 TYR CB C 13 40.2844 . . 1 . . . . . 99 Y CB . 27784 1 283 . 1 . 1 100 100 ARG N N 15 127.0450 . . 1 . . . . . 100 R N . 27784 1 284 . 1 . 1 100 100 ARG H H 1 7.7229 . . 1 . . . . . 100 R HN . 27784 1 285 . 1 . 1 100 100 ARG C C 13 174.6638 . . 1 . . . . . 100 R CO . 27784 1 286 . 1 . 1 100 100 ARG CA C 13 53.8190 . . 1 . . . . . 100 R CA . 27784 1 287 . 1 . 1 100 100 ARG CB C 13 32.8538 . . 1 . . . . . 100 R CB . 27784 1 288 . 1 . 1 101 101 ALA N N 15 123.3371 . . 1 . . . . . 101 A N . 27784 1 289 . 1 . 1 101 101 ALA H H 1 8.7432 . . 1 . . . . . 101 A HN . 27784 1 290 . 1 . 1 101 101 ALA C C 13 175.9024 . . 1 . . . . . 101 A CO . 27784 1 291 . 1 . 1 101 101 ALA CA C 13 50.9302 . . 1 . . . . . 101 A CA . 27784 1 292 . 1 . 1 101 101 ALA CB C 13 22.5376 . . 1 . . . . . 101 A CB . 27784 1 293 . 1 . 1 102 102 THR N N 15 114.9192 . . 1 . . . . . 102 T N . 27784 1 294 . 1 . 1 102 102 THR H H 1 8.3517 . . 1 . . . . . 102 T HN . 27784 1 295 . 1 . 1 102 102 THR C C 13 173.6882 . . 1 . . . . . 102 T CO . 27784 1 296 . 1 . 1 102 102 THR CA C 13 61.0447 . . 1 . . . . . 102 T CA . 27784 1 297 . 1 . 1 102 102 THR CB C 13 69.8130 . . 1 . . . . . 102 T CB . 27784 1 298 . 1 . 1 103 103 LEU N N 15 124.3807 . . 1 . . . . . 103 L N . 27784 1 299 . 1 . 1 103 103 LEU H H 1 9.2988 . . 1 . . . . . 103 L HN . 27784 1 300 . 1 . 1 103 103 LEU C C 13 175.3105 . . 1 . . . . . 103 L CO . 27784 1 301 . 1 . 1 103 103 LEU CA C 13 53.7078 . . 1 . . . . . 103 L CA . 27784 1 302 . 1 . 1 103 103 LEU CB C 13 43.5052 . . 1 . . . . . 103 L CB . 27784 1 303 . 1 . 1 104 104 ASP N N 15 123.0563 . . 1 . . . . . 104 D N . 27784 1 304 . 1 . 1 104 104 ASP H H 1 8.6921 . . 1 . . . . . 104 D HN . 27784 1 305 . 1 . 1 104 104 ASP C C 13 175.0325 . . 1 . . . . . 104 D CO . 27784 1 306 . 1 . 1 104 104 ASP CA C 13 53.5989 . . 1 . . . . . 104 D CA . 27784 1 307 . 1 . 1 104 104 ASP CB C 13 40.6462 . . 1 . . . . . 104 D CB . 27784 1 308 . 1 . 1 105 105 TRP N N 15 128.3629 . . 1 . . . . . 105 W N . 27784 1 309 . 1 . 1 105 105 TRP H H 1 8.4967 . . 1 . . . . . 105 W HN . 27784 1 310 . 1 . 1 105 105 TRP C C 13 175.0374 . . 1 . . . . . 105 W CO . 27784 1 311 . 1 . 1 105 105 TRP CA C 13 53.6759 . . 1 . . . . . 105 W CA . 27784 1 312 . 1 . 1 105 105 TRP CB C 13 31.6571 . . 1 . . . . . 105 W CB . 27784 1 313 . 1 . 1 106 106 PRO C C 13 177.6680 . . 1 . . . . . 106 P CO . 27784 1 314 . 1 . 1 107 107 ALA N N 15 119.6549 . . 1 . . . . . 107 A N . 27784 1 315 . 1 . 1 107 107 ALA H H 1 8.1005 . . 1 . . . . . 107 A HN . 27784 1 316 . 1 . 1 107 107 ALA C C 13 177.4982 . . 1 . . . . . 107 A CO . 27784 1 317 . 1 . 1 107 107 ALA CA C 13 54.1334 . . 1 . . . . . 107 A CA . 27784 1 318 . 1 . 1 107 107 ALA CB C 13 18.0626 . . 1 . . . . . 107 A CB . 27784 1 319 . 1 . 1 108 108 ALA N N 15 120.7287 . . 1 . . . . . 108 A N . 27784 1 320 . 1 . 1 108 108 ALA H H 1 8.2624 . . 1 . . . . . 108 A HN . 27784 1 321 . 1 . 1 108 108 ALA C C 13 177.2175 . . 1 . . . . . 108 A CO . 27784 1 322 . 1 . 1 108 108 ALA CA C 13 52.5619 . . 1 . . . . . 108 A CA . 27784 1 323 . 1 . 1 108 108 ALA CB C 13 20.9316 . . 1 . . . . . 108 A CB . 27784 1 324 . 1 . 1 109 109 GLY N N 15 108.1218 . . 1 . . . . . 109 G N . 27784 1 325 . 1 . 1 109 109 GLY H H 1 8.3762 . . 1 . . . . . 109 G HN . 27784 1 326 . 1 . 1 109 109 GLY C C 13 172.9983 . . 1 . . . . . 109 G CO . 27784 1 327 . 1 . 1 109 109 GLY CA C 13 44.6298 . . 1 . . . . . 109 G CA . 27784 1 328 . 1 . 1 110 110 HIS N N 15 121.3062 . . 1 . . . . . 110 H N . 27784 1 329 . 1 . 1 110 110 HIS H H 1 8.4023 . . 1 . . . . . 110 H HN . 27784 1 330 . 1 . 1 110 110 HIS C C 13 175.3550 . . 1 . . . . . 110 H CO . 27784 1 331 . 1 . 1 110 110 HIS CA C 13 55.9267 . . 1 . . . . . 110 H CA . 27784 1 332 . 1 . 1 110 110 HIS CB C 13 29.6730 . . 1 . . . . . 110 H CB . 27784 1 333 . 1 . 1 111 111 LEU N N 15 124.1609 . . 1 . . . . . 111 L N . 27784 1 334 . 1 . 1 111 111 LEU H H 1 9.2006 . . 1 . . . . . 111 L HN . 27784 1 335 . 1 . 1 111 111 LEU C C 13 176.2015 . . 1 . . . . . 111 L CO . 27784 1 336 . 1 . 1 111 111 LEU CA C 13 53.1259 . . 1 . . . . . 111 L CA . 27784 1 337 . 1 . 1 111 111 LEU CB C 13 45.5845 . . 1 . . . . . 111 L CB . 27784 1 338 . 1 . 1 112 112 SER N N 15 116.8066 . . 1 . . . . . 112 S N . 27784 1 339 . 1 . 1 112 112 SER H H 1 9.5088 . . 1 . . . . . 112 S HN . 27784 1 340 . 1 . 1 112 112 SER C C 13 173.1707 . . 1 . . . . . 112 S CO . 27784 1 341 . 1 . 1 112 112 SER CA C 13 57.0924 . . 1 . . . . . 112 S CA . 27784 1 342 . 1 . 1 112 112 SER CB C 13 63.4792 . . 1 . . . . . 112 S CB . 27784 1 343 . 1 . 1 113 113 LEU N N 15 131.1399 . . 1 . . . . . 113 L N . 27784 1 344 . 1 . 1 113 113 LEU H H 1 9.0580 . . 1 . . . . . 113 L HN . 27784 1 345 . 1 . 1 113 113 LEU CA C 13 52.9484 . . 1 . . . . . 113 L CA . 27784 1 346 . 1 . 1 113 113 LEU CB C 13 43.8970 . . 1 . . . . . 113 L CB . 27784 1 347 . 1 . 1 116 116 HIS C C 13 170.7267 . . 1 . . . . . 116 H CO . 27784 1 348 . 1 . 1 116 116 HIS CA C 13 55.4423 . . 1 . . . . . 116 H CA . 27784 1 349 . 1 . 1 116 116 HIS CB C 13 31.1995 . . 1 . . . . . 116 H CB . 27784 1 350 . 1 . 1 117 117 ARG N N 15 124.5802 . . 1 . . . . . 117 R N . 27784 1 351 . 1 . 1 117 117 ARG H H 1 10.4880 . . 1 . . . . . 117 R HN . 27784 1 352 . 1 . 1 117 117 ARG C C 13 175.9991 . . 1 . . . . . 117 R CO . 27784 1 353 . 1 . 1 117 117 ARG CA C 13 54.2756 . . 1 . . . . . 117 R CA . 27784 1 354 . 1 . 1 117 117 ARG CB C 13 33.6052 . . 1 . . . . . 117 R CB . 27784 1 355 . 1 . 1 118 118 VAL N N 15 125.5164 . . 1 . . . . . 118 V N . 27784 1 356 . 1 . 1 118 118 VAL H H 1 8.7973 . . 1 . . . . . 118 V HN . 27784 1 357 . 1 . 1 118 118 VAL C C 13 177.0302 . . 1 . . . . . 118 V CO . 27784 1 358 . 1 . 1 118 118 VAL CA C 13 60.0260 . . 1 . . . . . 118 V CA . 27784 1 359 . 1 . 1 118 118 VAL CB C 13 32.5632 . . 1 . . . . . 118 V CB . 27784 1 360 . 1 . 1 119 119 GLY N N 15 117.9729 . . 1 . . . . . 119 G N . 27784 1 361 . 1 . 1 119 119 GLY H H 1 9.0170 . . 1 . . . . . 119 G HN . 27784 1 362 . 1 . 1 119 119 GLY CA C 13 47.5316 . . 1 . . . . . 119 G CA . 27784 1 363 . 1 . 1 128 128 PRO C C 13 176.3489 . . 1 . . . . . 128 P CO . 27784 1 364 . 1 . 1 128 128 PRO CA C 13 63.1082 . . 1 . . . . . 128 P CA . 27784 1 365 . 1 . 1 128 128 PRO CB C 13 31.5045 . . 1 . . . . . 128 P CB . 27784 1 366 . 1 . 1 129 129 THR N N 15 114.6966 . . 1 . . . . . 129 T N . 27784 1 367 . 1 . 1 129 129 THR H H 1 8.1563 . . 1 . . . . . 129 T HN . 27784 1 368 . 1 . 1 129 129 THR C C 13 173.1274 . . 1 . . . . . 129 T CO . 27784 1 369 . 1 . 1 129 129 THR CA C 13 60.6738 . . 1 . . . . . 129 T CA . 27784 1 370 . 1 . 1 129 129 THR CB C 13 70.1970 . . 1 . . . . . 129 T CB . 27784 1 371 . 1 . 1 130 130 GLU N N 15 123.1762 . . 1 . . . . . 130 E N . 27784 1 372 . 1 . 1 130 130 GLU H H 1 7.9417 . . 1 . . . . . 130 E HN . 27784 1 373 . 1 . 1 130 130 GLU C C 13 175.7785 . . 1 . . . . . 130 E CO . 27784 1 374 . 1 . 1 130 130 GLU CA C 13 55.0765 . . 1 . . . . . 130 E CA . 27784 1 375 . 1 . 1 130 130 GLU CB C 13 30.9518 . . 1 . . . . . 130 E CB . 27784 1 376 . 1 . 1 131 131 ALA N N 15 124.7290 . . 1 . . . . . 131 A N . 27784 1 377 . 1 . 1 131 131 ALA H H 1 8.4122 . . 1 . . . . . 131 A HN . 27784 1 378 . 1 . 1 131 131 ALA C C 13 176.9575 . . 1 . . . . . 131 A CO . 27784 1 379 . 1 . 1 131 131 ALA CA C 13 52.2511 . . 1 . . . . . 131 A CA . 27784 1 380 . 1 . 1 131 131 ALA CB C 13 18.0444 . . 1 . . . . . 131 A CB . 27784 1 381 . 1 . 1 132 132 TRP N N 15 121.0289 . . 1 . . . . . 132 W N . 27784 1 382 . 1 . 1 132 132 TRP H H 1 7.9884 . . 1 . . . . . 132 W HN . 27784 1 383 . 1 . 1 132 132 TRP C C 13 175.6125 . . 1 . . . . . 132 W CO . 27784 1 384 . 1 . 1 142 142 ASN C C 13 177.7805 . . 1 . . . . . 142 N CO . 27784 1 385 . 1 . 1 142 142 ASN CA C 13 55.4230 . . 1 . . . . . 142 N CA . 27784 1 386 . 1 . 1 142 142 ASN CB C 13 37.3389 . . 1 . . . . . 142 N CB . 27784 1 387 . 1 . 1 143 143 ALA N N 15 124.1928 . . 1 . . . . . 143 A N . 27784 1 388 . 1 . 1 143 143 ALA H H 1 7.9925 . . 1 . . . . . 143 A HN . 27784 1 389 . 1 . 1 143 143 ALA C C 13 179.3059 . . 1 . . . . . 143 A CO . 27784 1 390 . 1 . 1 143 143 ALA CA C 13 54.4815 . . 1 . . . . . 143 A CA . 27784 1 391 . 1 . 1 143 143 ALA CB C 13 17.9519 . . 1 . . . . . 143 A CB . 27784 1 392 . 1 . 1 144 144 MET N N 15 116.0929 . . 1 . . . . . 144 M N . 27784 1 393 . 1 . 1 144 144 MET H H 1 8.4202 . . 1 . . . . . 144 M HN . 27784 1 394 . 1 . 1 144 144 MET C C 13 179.3871 . . 1 . . . . . 144 M CO . 27784 1 395 . 1 . 1 144 144 MET CA C 13 57.8729 . . 1 . . . . . 144 M CA . 27784 1 396 . 1 . 1 144 144 MET CB C 13 30.7347 . . 1 . . . . . 144 M CB . 27784 1 397 . 1 . 1 145 145 SER N N 15 115.0080 . . 1 . . . . . 145 S N . 27784 1 398 . 1 . 1 145 145 SER H H 1 7.9913 . . 1 . . . . . 145 S HN . 27784 1 399 . 1 . 1 145 145 SER C C 13 176.8854 . . 1 . . . . . 145 S CO . 27784 1 400 . 1 . 1 145 145 SER CA C 13 61.1178 . . 1 . . . . . 145 S CA . 27784 1 401 . 1 . 1 145 145 SER CB C 13 62.2378 . . 1 . . . . . 145 S CB . 27784 1 402 . 1 . 1 146 146 ALA N N 15 125.1456 . . 1 . . . . . 146 A N . 27784 1 403 . 1 . 1 146 146 ALA H H 1 7.7458 . . 1 . . . . . 146 A HN . 27784 1 404 . 1 . 1 146 146 ALA C C 13 180.1725 . . 1 . . . . . 146 A CO . 27784 1 405 . 1 . 1 146 146 ALA CA C 13 54.3965 . . 1 . . . . . 146 A CA . 27784 1 406 . 1 . 1 146 146 ALA CB C 13 17.3356 . . 1 . . . . . 146 A CB . 27784 1 407 . 1 . 1 147 147 LEU N N 15 117.4163 . . 1 . . . . . 147 L N . 27784 1 408 . 1 . 1 147 147 LEU H H 1 7.9537 . . 1 . . . . . 147 L HN . 27784 1 409 . 1 . 1 147 147 LEU C C 13 178.3676 . . 1 . . . . . 147 L CO . 27784 1 410 . 1 . 1 147 147 LEU CA C 13 57.7002 . . 1 . . . . . 147 L CA . 27784 1 411 . 1 . 1 147 147 LEU CB C 13 40.4731 . . 1 . . . . . 147 L CB . 27784 1 412 . 1 . 1 148 148 GLU N N 15 116.6492 . . 1 . . . . . 148 E N . 27784 1 413 . 1 . 1 148 148 GLU H H 1 7.8142 . . 1 . . . . . 148 E HN . 27784 1 414 . 1 . 1 148 148 GLU C C 13 179.1213 . . 1 . . . . . 148 E CO . 27784 1 415 . 1 . 1 148 148 GLU CA C 13 58.6624 . . 1 . . . . . 148 E CA . 27784 1 416 . 1 . 1 148 148 GLU CB C 13 28.9762 . . 1 . . . . . 148 E CB . 27784 1 417 . 1 . 1 149 149 SER N N 15 111.8029 . . 1 . . . . . 149 S N . 27784 1 418 . 1 . 1 149 149 SER H H 1 7.7547 . . 1 . . . . . 149 S HN . 27784 1 419 . 1 . 1 149 149 SER C C 13 174.3822 . . 1 . . . . . 149 S CO . 27784 1 420 . 1 . 1 149 149 SER CA C 13 58.7104 . . 1 . . . . . 149 S CA . 27784 1 421 . 1 . 1 149 149 SER CB C 13 63.3591 . . 1 . . . . . 149 S CB . 27784 1 422 . 1 . 1 150 150 ALA N N 15 127.4505 . . 1 . . . . . 150 A N . 27784 1 423 . 1 . 1 150 150 ALA H H 1 7.2229 . . 1 . . . . . 150 A HN . 27784 1 424 . 1 . 1 150 150 ALA C C 13 178.5632 . . 1 . . . . . 150 A CO . 27784 1 425 . 1 . 1 150 150 ALA CA C 13 50.1240 . . 1 . . . . . 150 A CA . 27784 1 426 . 1 . 1 150 150 ALA CB C 13 16.9022 . . 1 . . . . . 150 A CB . 27784 1 427 . 1 . 1 158 158 GLU C C 13 179.1465 . . 1 . . . . . 158 E CO . 27784 1 428 . 1 . 1 158 158 GLU CA C 13 59.6707 . . 1 . . . . . 158 E CA . 27784 1 429 . 1 . 1 158 158 GLU CB C 13 28.8697 . . 1 . . . . . 158 E CB . 27784 1 430 . 1 . 1 159 159 VAL N N 15 119.9814 . . 1 . . . . . 159 V N . 27784 1 431 . 1 . 1 159 159 VAL H H 1 8.5008 . . 1 . . . . . 159 V HN . 27784 1 432 . 1 . 1 159 159 VAL C C 13 180.0582 . . 1 . . . . . 159 V CO . 27784 1 433 . 1 . 1 159 159 VAL CA C 13 65.3754 . . 1 . . . . . 159 V CA . 27784 1 434 . 1 . 1 160 160 ALA N N 15 125.3190 . . 1 . . . . . 160 A N . 27784 1 435 . 1 . 1 160 160 ALA H H 1 9.1077 . . 1 . . . . . 160 A HN . 27784 1 436 . 1 . 1 160 160 ALA C C 13 179.2549 . . 1 . . . . . 160 A CO . 27784 1 437 . 1 . 1 160 160 ALA CA C 13 55.8827 . . 1 . . . . . 160 A CA . 27784 1 438 . 1 . 1 161 161 THR N N 15 106.9475 . . 1 . . . . . 161 T N . 27784 1 439 . 1 . 1 161 161 THR H H 1 7.9053 . . 1 . . . . . 161 T HN . 27784 1 440 . 1 . 1 161 161 THR C C 13 176.9290 . . 1 . . . . . 161 T CO . 27784 1 441 . 1 . 1 161 161 THR CA C 13 65.1460 . . 1 . . . . . 161 T CA . 27784 1 442 . 1 . 1 162 162 GLN N N 15 122.6176 . . 1 . . . . . 162 Q N . 27784 1 443 . 1 . 1 162 162 GLN H H 1 7.9066 . . 1 . . . . . 162 Q HN . 27784 1 444 . 1 . 1 162 162 GLN C C 13 178.7914 . . 1 . . . . . 162 Q CO . 27784 1 445 . 1 . 1 162 162 GLN CA C 13 58.9390 . . 1 . . . . . 162 Q CA . 27784 1 446 . 1 . 1 163 163 THR N N 15 116.7251 . . 1 . . . . . 163 T N . 27784 1 447 . 1 . 1 163 163 THR H H 1 8.6340 . . 1 . . . . . 163 T HN . 27784 1 448 . 1 . 1 163 163 THR CA C 13 66.5548 . . 1 . . . . . 163 T CA . 27784 1 449 . 1 . 1 164 164 VAL N N 15 120.2283 . . 1 . . . . . 164 V N . 27784 1 450 . 1 . 1 164 164 VAL H H 1 8.0905 . . 1 . . . . . 164 V HN . 27784 1 451 . 1 . 1 164 164 VAL C C 13 179.5403 . . 1 . . . . . 164 V CO . 27784 1 452 . 1 . 1 164 164 VAL CA C 13 66.9798 . . 1 . . . . . 164 V CA . 27784 1 453 . 1 . 1 164 164 VAL CB C 13 30.4102 . . 1 . . . . . 164 V CB . 27784 1 454 . 1 . 1 165 165 ARG N N 15 124.5069 . . 1 . . . . . 165 R N . 27784 1 455 . 1 . 1 165 165 ARG H H 1 8.5079 . . 1 . . . . . 165 R HN . 27784 1 456 . 1 . 1 165 165 ARG C C 13 177.9769 . . 1 . . . . . 165 R CO . 27784 1 457 . 1 . 1 165 165 ARG CA C 13 61.6881 . . 1 . . . . . 165 R CA . 27784 1 458 . 1 . 1 166 166 GLU N N 15 121.5651 . . 1 . . . . . 166 E N . 27784 1 459 . 1 . 1 166 166 GLU H H 1 8.4434 . . 1 . . . . . 166 E HN . 27784 1 460 . 1 . 1 166 166 GLU C C 13 179.1224 . . 1 . . . . . 166 E CO . 27784 1 461 . 1 . 1 166 166 GLU CA C 13 59.3015 . . 1 . . . . . 166 E CA . 27784 1 462 . 1 . 1 167 167 LEU N N 15 116.2713 . . 1 . . . . . 167 L N . 27784 1 463 . 1 . 1 167 167 LEU H H 1 8.050 . . 1 . . . . . 167 L HN . 27784 1 464 . 1 . 1 167 167 LEU CA C 13 57.0579 . . 1 . . . . . 167 L CA . 27784 1 465 . 1 . 1 217 217 THR C C 13 174.0207 . . 1 . . . . . 217 T CO . 27784 1 466 . 1 . 1 217 217 THR CA C 13 65.2616 . . 1 . . . . . 217 T CA . 27784 1 467 . 1 . 1 218 218 ARG N N 15 119.6645 . . 1 . . . . . 218 R N . 27784 1 468 . 1 . 1 218 218 ARG H H 1 7.1251 . . 1 . . . . . 218 R HN . 27784 1 469 . 1 . 1 218 218 ARG C C 13 175.0946 . . 1 . . . . . 218 R CO . 27784 1 470 . 1 . 1 218 218 ARG CA C 13 56.9473 . . 1 . . . . . 218 R CA . 27784 1 471 . 1 . 1 218 218 ARG CB C 13 31.8644 . . 1 . . . . . 218 R CB . 27784 1 472 . 1 . 1 219 219 HIS N N 15 119.6807 . . 1 . . . . . 219 H N . 27784 1 473 . 1 . 1 219 219 HIS H H 1 7.8767 . . 1 . . . . . 219 H HN . 27784 1 474 . 1 . 1 219 219 HIS C C 13 177.1404 . . 1 . . . . . 219 H CO . 27784 1 475 . 1 . 1 220 220 LEU N N 15 122.4713 . . 1 . . . . . 220 L N . 27784 1 476 . 1 . 1 220 220 LEU H H 1 8.5404 . . 1 . . . . . 220 L HN . 27784 1 477 . 1 . 1 220 220 LEU C C 13 175.1433 . . 1 . . . . . 220 L CO . 27784 1 478 . 1 . 1 220 220 LEU CA C 13 57.7288 . . 1 . . . . . 220 L CA . 27784 1 479 . 1 . 1 221 221 LEU N N 15 121.9569 . . 1 . . . . . 221 L N . 27784 1 480 . 1 . 1 221 221 LEU H H 1 7.9823 . . 1 . . . . . 221 L HN . 27784 1 481 . 1 . 1 221 221 LEU C C 13 174.8438 . . 1 . . . . . 221 L CO . 27784 1 482 . 1 . 1 221 221 LEU CA C 13 54.8382 . . 1 . . . . . 221 L CA . 27784 1 483 . 1 . 1 222 222 ARG N N 15 121.9369 . . 1 . . . . . 222 R N . 27784 1 484 . 1 . 1 222 222 ARG H H 1 8.3180 . . 1 . . . . . 222 R HN . 27784 1 485 . 1 . 1 222 222 ARG CA C 13 55.4802 . . 1 . . . . . 222 R CA . 27784 1 486 . 1 . 1 224 224 THR C C 13 174.3274 . . 1 . . . . . 224 T CO . 27784 1 487 . 1 . 1 224 224 THR CA C 13 62.5677 . . 1 . . . . . 224 T CA . 27784 1 488 . 1 . 1 225 225 ALA N N 15 129.0212 . . 1 . . . . . 225 A N . 27784 1 489 . 1 . 1 225 225 ALA H H 1 8.1114 . . 1 . . . . . 225 A HN . 27784 1 490 . 1 . 1 225 225 ALA C C 13 176.8037 . . 1 . . . . . 225 A CO . 27784 1 491 . 1 . 1 225 225 ALA CA C 13 54.7357 . . 1 . . . . . 225 A CA . 27784 1 492 . 1 . 1 226 226 ASP N N 15 112.7599 . . 1 . . . . . 226 D N . 27784 1 493 . 1 . 1 226 226 ASP H H 1 7.5138 . . 1 . . . . . 226 D HN . 27784 1 494 . 1 . 1 226 226 ASP C C 13 178.5998 . . 1 . . . . . 226 D CO . 27784 1 495 . 1 . 1 226 226 ASP CA C 13 52.8580 . . 1 . . . . . 226 D CA . 27784 1 496 . 1 . 1 226 226 ASP CB C 13 41.9165 . . 1 . . . . . 226 D CB . 27784 1 497 . 1 . 1 227 227 THR N N 15 117.0245 . . 1 . . . . . 227 T N . 27784 1 498 . 1 . 1 227 227 THR H H 1 8.5760 . . 1 . . . . . 227 T HN . 27784 1 499 . 1 . 1 227 227 THR C C 13 174.2450 . . 1 . . . . . 227 T CO . 27784 1 500 . 1 . 1 227 227 THR CA C 13 62.6050 . . 1 . . . . . 227 T CA . 27784 1 501 . 1 . 1 227 227 THR CB C 13 67.9170 . . 1 . . . . . 227 T CB . 27784 1 502 . 1 . 1 228 228 ARG N N 15 119.9312 . . 1 . . . . . 228 R N . 27784 1 503 . 1 . 1 228 228 ARG H H 1 8.7603 . . 1 . . . . . 228 R HN . 27784 1 504 . 1 . 1 228 228 ARG C C 13 176.3842 . . 1 . . . . . 228 R CO . 27784 1 505 . 1 . 1 228 228 ARG CA C 13 55.3825 . . 1 . . . . . 228 R CA . 27784 1 506 . 1 . 1 228 228 ARG CB C 13 29.8199 . . 1 . . . . . 228 R CB . 27784 1 507 . 1 . 1 229 229 ALA N N 15 123.6883 . . 1 . . . . . 229 A N . 27784 1 508 . 1 . 1 229 229 ALA H H 1 7.0185 . . 1 . . . . . 229 A HN . 27784 1 509 . 1 . 1 229 229 ALA C C 13 177.3544 . . 1 . . . . . 229 A CO . 27784 1 510 . 1 . 1 229 229 ALA CA C 13 51.6792 . . 1 . . . . . 229 A CA . 27784 1 511 . 1 . 1 229 229 ALA CB C 13 19.4226 . . 1 . . . . . 229 A CB . 27784 1 512 . 1 . 1 230 230 ALA N N 15 126.7628 . . 1 . . . . . 230 A N . 27784 1 513 . 1 . 1 230 230 ALA H H 1 8.3869 . . 1 . . . . . 230 A HN . 27784 1 514 . 1 . 1 230 230 ALA C C 13 176.7672 . . 1 . . . . . 230 A CO . 27784 1 515 . 1 . 1 230 230 ALA CA C 13 51.1968 . . 1 . . . . . 230 A CA . 27784 1 516 . 1 . 1 230 230 ALA CB C 13 18.4814 . . 1 . . . . . 230 A CB . 27784 1 517 . 1 . 1 231 231 ALA N N 15 123.9161 . . 1 . . . . . 231 A N . 27784 1 518 . 1 . 1 231 231 ALA H H 1 8.0998 . . 1 . . . . . 231 A HN . 27784 1 519 . 1 . 1 231 231 ALA C C 13 178.0049 . . 1 . . . . . 231 A CO . 27784 1 520 . 1 . 1 231 231 ALA CA C 13 51.5162 . . 1 . . . . . 231 A CA . 27784 1 521 . 1 . 1 231 231 ALA CB C 13 19.5683 . . 1 . . . . . 231 A CB . 27784 1 522 . 1 . 1 232 232 VAL N N 15 122.2078 . . 1 . . . . . 232 V N . 27784 1 523 . 1 . 1 232 232 VAL H H 1 9.4189 . . 1 . . . . . 232 V HN . 27784 1 524 . 1 . 1 232 232 VAL C C 13 174.3924 . . 1 . . . . . 232 V CO . 27784 1 525 . 1 . 1 232 232 VAL CA C 13 58.3943 . . 1 . . . . . 232 V CA . 27784 1 526 . 1 . 1 236 236 PRO C C 13 176.8485 . . 1 . . . . . 236 P CO . 27784 1 527 . 1 . 1 236 236 PRO CA C 13 63.4383 . . 1 . . . . . 236 P CA . 27784 1 528 . 1 . 1 236 236 PRO CB C 13 33.3776 . . 1 . . . . . 236 P CB . 27784 1 529 . 1 . 1 237 237 VAL N N 15 121.4637 . . 1 . . . . . 237 V N . 27784 1 530 . 1 . 1 237 237 VAL H H 1 8.4750 . . 1 . . . . . 237 V HN . 27784 1 531 . 1 . 1 237 237 VAL C C 13 175.7322 . . 1 . . . . . 237 V CO . 27784 1 532 . 1 . 1 237 237 VAL CA C 13 64.9266 . . 1 . . . . . 237 V CA . 27784 1 533 . 1 . 1 237 237 VAL CB C 13 31.1942 . . 1 . . . . . 237 V CB . 27784 1 534 . 1 . 1 238 238 LEU N N 15 119.2887 . . 1 . . . . . 238 L N . 27784 1 535 . 1 . 1 238 238 LEU H H 1 7.4763 . . 1 . . . . . 238 L HN . 27784 1 536 . 1 . 1 238 238 LEU C C 13 176.5922 . . 1 . . . . . 238 L CO . 27784 1 537 . 1 . 1 238 238 LEU CA C 13 52.3335 . . 1 . . . . . 238 L CA . 27784 1 538 . 1 . 1 238 238 LEU CB C 13 40.2655 . . 1 . . . . . 238 L CB . 27784 1 539 . 1 . 1 239 239 ASN N N 15 121.9600 . . 1 . . . . . 239 N N . 27784 1 540 . 1 . 1 239 239 ASN H H 1 8.0930 . . 1 . . . . . 239 N HN . 27784 1 541 . 1 . 1 239 239 ASN C C 13 175.7915 . . 1 . . . . . 239 N CO . 27784 1 542 . 1 . 1 239 239 ASN CA C 13 50.4928 . . 1 . . . . . 239 N CA . 27784 1 543 . 1 . 1 239 239 ASN CB C 13 38.2169 . . 1 . . . . . 239 N CB . 27784 1 544 . 1 . 1 240 240 PRO C C 13 178.0732 . . 1 . . . . . 240 P CO . 27784 1 545 . 1 . 1 240 240 PRO CA C 13 63.8275 . . 1 . . . . . 240 P CA . 27784 1 546 . 1 . 1 240 240 PRO CB C 13 31.4904 . . 1 . . . . . 240 P CB . 27784 1 547 . 1 . 1 241 241 GLN N N 15 114.0882 . . 1 . . . . . 241 Q N . 27784 1 548 . 1 . 1 241 241 GLN H H 1 7.9775 . . 1 . . . . . 241 Q HN . 27784 1 549 . 1 . 1 241 241 GLN C C 13 178.3483 . . 1 . . . . . 241 Q CO . 27784 1 550 . 1 . 1 241 241 GLN CA C 13 57.9448 . . 1 . . . . . 241 Q CA . 27784 1 551 . 1 . 1 241 241 GLN CB C 13 29.6917 . . 1 . . . . . 241 Q CB . 27784 1 552 . 1 . 1 242 242 THR N N 15 103.3755 . . 1 . . . . . 242 T N . 27784 1 553 . 1 . 1 242 242 THR H H 1 6.9606 . . 1 . . . . . 242 T HN . 27784 1 554 . 1 . 1 242 242 THR C C 13 175.9605 . . 1 . . . . . 242 T CO . 27784 1 555 . 1 . 1 242 242 THR CA C 13 59.9439 . . 1 . . . . . 242 T CA . 27784 1 556 . 1 . 1 242 242 THR CB C 13 70.8999 . . 1 . . . . . 242 T CB . 27784 1 557 . 1 . 1 243 243 ASN N N 15 120.3305 . . 1 . . . . . 243 N N . 27784 1 558 . 1 . 1 243 243 ASN H H 1 8.9792 . . 1 . . . . . 243 N HN . 27784 1 559 . 1 . 1 243 243 ASN C C 13 173.0113 . . 1 . . . . . 243 N CO . 27784 1 560 . 1 . 1 243 243 ASN CA C 13 54.3345 . . 1 . . . . . 243 N CA . 27784 1 561 . 1 . 1 243 243 ASN CB C 13 37.3971 . . 1 . . . . . 243 N CB . 27784 1 562 . 1 . 1 244 244 ALA N N 15 119.8201 . . 1 . . . . . 244 A N . 27784 1 563 . 1 . 1 244 244 ALA H H 1 7.8357 . . 1 . . . . . 244 A HN . 27784 1 564 . 1 . 1 244 244 ALA C C 13 174.2548 . . 1 . . . . . 244 A CO . 27784 1 565 . 1 . 1 244 244 ALA CA C 13 49.6773 . . 1 . . . . . 244 A CA . 27784 1 566 . 1 . 1 244 244 ALA CB C 13 18.7391 . . 1 . . . . . 244 A CB . 27784 1 567 . 1 . 1 250 250 GLY C C 13 173.6315 . . 1 . . . . . 250 G CO . 27784 1 568 . 1 . 1 250 250 GLY CA C 13 43.1004 . . 1 . . . . . 250 G CA . 27784 1 569 . 1 . 1 251 251 ALA N N 15 124.7012 . . 1 . . . . . 251 A N . 27784 1 570 . 1 . 1 251 251 ALA H H 1 7.5965 . . 1 . . . . . 251 A HN . 27784 1 571 . 1 . 1 251 251 ALA C C 13 178.8116 . . 1 . . . . . 251 A CO . 27784 1 572 . 1 . 1 251 251 ALA CA C 13 51.2214 . . 1 . . . . . 251 A CA . 27784 1 573 . 1 . 1 251 251 ALA CB C 13 17.7981 . . 1 . . . . . 251 A CB . 27784 1 574 . 1 . 1 252 252 VAL N N 15 135.3972 . . 1 . . . . . 252 V N . 27784 1 575 . 1 . 1 252 252 VAL H H 1 11.6396 . . 1 . . . . . 252 V HN . 27784 1 576 . 1 . 1 252 252 VAL CA C 13 64.7039 . . 1 . . . . . 252 V CA . 27784 1 577 . 1 . 1 253 253 LEU C C 13 177.5599 . . 1 . . . . . 253 L CO . 27784 1 578 . 1 . 1 253 253 LEU CA C 13 53.3726 . . 1 . . . . . 253 L CA . 27784 1 579 . 1 . 1 254 254 ARG N N 15 118.8713 . . 1 . . . . . 254 R N . 27784 1 580 . 1 . 1 254 254 ARG H H 1 7.2178 . . 1 . . . . . 254 R HN . 27784 1 581 . 1 . 1 254 254 ARG C C 13 177.2461 . . 1 . . . . . 254 R CO . 27784 1 582 . 1 . 1 254 254 ARG CA C 13 58.4791 . . 1 . . . . . 254 R CA . 27784 1 583 . 1 . 1 254 254 ARG CB C 13 29.0992 . . 1 . . . . . 254 R CB . 27784 1 584 . 1 . 1 255 255 ALA N N 15 130.9618 . . 1 . . . . . 255 A N . 27784 1 585 . 1 . 1 255 255 ALA H H 1 7.5243 . . 1 . . . . . 255 A HN . 27784 1 586 . 1 . 1 255 255 ALA C C 13 176.5198 . . 1 . . . . . 255 A CO . 27784 1 587 . 1 . 1 255 255 ALA CA C 13 53.6684 . . 1 . . . . . 255 A CA . 27784 1 588 . 1 . 1 255 255 ALA CB C 13 19.0280 . . 1 . . . . . 255 A CB . 27784 1 589 . 1 . 1 256 256 THR N N 15 122.2822 . . 1 . . . . . 256 T N . 27784 1 590 . 1 . 1 256 256 THR H H 1 8.7285 . . 1 . . . . . 256 T HN . 27784 1 591 . 1 . 1 256 256 THR C C 13 172.8299 . . 1 . . . . . 256 T CO . 27784 1 592 . 1 . 1 256 256 THR CA C 13 62.3815 . . 1 . . . . . 256 T CA . 27784 1 593 . 1 . 1 256 256 THR CB C 13 68.1389 . . 1 . . . . . 256 T CB . 27784 1 594 . 1 . 1 257 257 SER N N 15 123.0810 . . 1 . . . . . 257 S N . 27784 1 595 . 1 . 1 257 257 SER H H 1 9.1807 . . 1 . . . . . 257 S HN . 27784 1 596 . 1 . 1 257 257 SER CA C 13 55.6065 . . 1 . . . . . 257 S CA . 27784 1 597 . 1 . 1 257 257 SER CB C 13 65.4474 . . 1 . . . . . 257 S CB . 27784 1 598 . 1 . 1 299 299 PRO C C 13 178.8157 . . 1 . . . . . 299 P CO . 27784 1 599 . 1 . 1 299 299 PRO CA C 13 65.7263 . . 1 . . . . . 299 P CA . 27784 1 600 . 1 . 1 300 300 ASP N N 15 116.0444 . . 1 . . . . . 300 D N . 27784 1 601 . 1 . 1 300 300 ASP H H 1 8.9050 . . 1 . . . . . 300 D HN . 27784 1 602 . 1 . 1 300 300 ASP C C 13 178.8227 . . 1 . . . . . 300 D CO . 27784 1 603 . 1 . 1 300 300 ASP CA C 13 56.7405 . . 1 . . . . . 300 D CA . 27784 1 604 . 1 . 1 300 300 ASP CB C 13 39.6260 . . 1 . . . . . 300 D CB . 27784 1 605 . 1 . 1 301 301 LEU N N 15 121.2218 . . 1 . . . . . 301 L N . 27784 1 606 . 1 . 1 301 301 LEU H H 1 7.2632 . . 1 . . . . . 301 L HN . 27784 1 607 . 1 . 1 301 301 LEU C C 13 178.5776 . . 1 . . . . . 301 L CO . 27784 1 608 . 1 . 1 301 301 LEU CA C 13 56.1078 . . 1 . . . . . 301 L CA . 27784 1 609 . 1 . 1 301 301 LEU CB C 13 40.9674 . . 1 . . . . . 301 L CB . 27784 1 610 . 1 . 1 302 302 ARG N N 15 119.9368 . . 1 . . . . . 302 R N . 27784 1 611 . 1 . 1 302 302 ARG H H 1 7.7180 . . 1 . . . . . 302 R HN . 27784 1 612 . 1 . 1 302 302 ARG C C 13 177.7752 . . 1 . . . . . 302 R CO . 27784 1 613 . 1 . 1 302 302 ARG CA C 13 60.5408 . . 1 . . . . . 302 R CA . 27784 1 614 . 1 . 1 303 303 THR N N 15 113.8330 . . 1 . . . . . 303 T N . 27784 1 615 . 1 . 1 303 303 THR H H 1 7.8398 . . 1 . . . . . 303 T HN . 27784 1 616 . 1 . 1 303 303 THR C C 13 176.9656 . . 1 . . . . . 303 T CO . 27784 1 617 . 1 . 1 303 303 THR CA C 13 65.7576 . . 1 . . . . . 303 T CA . 27784 1 618 . 1 . 1 303 303 THR CB C 13 68.2088 . . 1 . . . . . 303 T CB . 27784 1 619 . 1 . 1 304 304 THR N N 15 119.7393 . . 1 . . . . . 304 T N . 27784 1 620 . 1 . 1 304 304 THR H H 1 7.5110 . . 1 . . . . . 304 T HN . 27784 1 621 . 1 . 1 304 304 THR CA C 13 67.2101 . . 1 . . . . . 304 T CA . 27784 1 622 . 1 . 1 304 304 THR CB C 13 68.1114 . . 1 . . . . . 304 T CB . 27784 1 623 . 1 . 1 305 305 LEU N N 15 120.6463 . . 1 . . . . . 305 L N . 27784 1 624 . 1 . 1 305 305 LEU H H 1 8.2720 . . 1 . . . . . 305 L HN . 27784 1 625 . 1 . 1 305 305 LEU C C 13 178.7266 . . 1 . . . . . 305 L CO . 27784 1 626 . 1 . 1 305 305 LEU CA C 13 57.6299 . . 1 . . . . . 305 L CA . 27784 1 627 . 1 . 1 305 305 LEU CB C 13 40.5823 . . 1 . . . . . 305 L CB . 27784 1 628 . 1 . 1 306 306 GLU N N 15 120.4311 . . 1 . . . . . 306 E N . 27784 1 629 . 1 . 1 306 306 GLU H H 1 8.2333 . . 1 . . . . . 306 E HN . 27784 1 630 . 1 . 1 306 306 GLU C C 13 178.6758 . . 1 . . . . . 306 E CO . 27784 1 631 . 1 . 1 306 306 GLU CA C 13 59.8848 . . 1 . . . . . 306 E CA . 27784 1 632 . 1 . 1 306 306 GLU CB C 13 28.5102 . . 1 . . . . . 306 E CB . 27784 1 633 . 1 . 1 307 307 TYR N N 15 119.3297 . . 1 . . . . . 307 Y N . 27784 1 634 . 1 . 1 307 307 TYR H H 1 7.8644 . . 1 . . . . . 307 Y HN . 27784 1 635 . 1 . 1 307 307 TYR C C 13 178.7192 . . 1 . . . . . 307 Y CO . 27784 1 636 . 1 . 1 307 307 TYR CA C 13 60.8703 . . 1 . . . . . 307 Y CA . 27784 1 637 . 1 . 1 308 308 LEU N N 15 120.2442 . . 1 . . . . . 308 L N . 27784 1 638 . 1 . 1 308 308 LEU H H 1 8.4327 . . 1 . . . . . 308 L HN . 27784 1 639 . 1 . 1 308 308 LEU C C 13 178.8799 . . 1 . . . . . 308 L CO . 27784 1 640 . 1 . 1 308 308 LEU CA C 13 58.0270 . . 1 . . . . . 308 L CA . 27784 1 641 . 1 . 1 309 309 GLY N N 15 107.2995 . . 1 . . . . . 309 G N . 27784 1 642 . 1 . 1 309 309 GLY H H 1 8.9329 . . 1 . . . . . 309 G HN . 27784 1 643 . 1 . 1 309 309 GLY C C 13 176.2575 . . 1 . . . . . 309 G CO . 27784 1 644 . 1 . 1 309 309 GLY CA C 13 47.0634 . . 1 . . . . . 309 G CA . 27784 1 645 . 1 . 1 310 310 ARG N N 15 123.1982 . . 1 . . . . . 310 R N . 27784 1 646 . 1 . 1 310 310 ARG H H 1 8.0898 . . 1 . . . . . 310 R HN . 27784 1 647 . 1 . 1 310 310 ARG C C 13 179.6036 . . 1 . . . . . 310 R CO . 27784 1 648 . 1 . 1 310 310 ARG CA C 13 59.6572 . . 1 . . . . . 310 R CA . 27784 1 649 . 1 . 1 311 311 GLU N N 15 121.0278 . . 1 . . . . . 311 E N . 27784 1 650 . 1 . 1 311 311 GLU H H 1 7.9850 . . 1 . . . . . 311 E HN . 27784 1 651 . 1 . 1 311 311 GLU CA C 13 58.2849 . . 1 . . . . . 311 E CA . 27784 1 652 . 1 . 1 337 337 ARG C C 13 179.6665 . . 1 . . . . . 337 R CO . 27784 1 653 . 1 . 1 337 337 ARG CA C 13 59.3155 . . 1 . . . . . 337 R CA . 27784 1 654 . 1 . 1 338 338 VAL N N 15 121.1859 . . 1 . . . . . 338 V N . 27784 1 655 . 1 . 1 338 338 VAL H H 1 7.8111 . . 1 . . . . . 338 V HN . 27784 1 656 . 1 . 1 338 338 VAL C C 13 177.1178 . . 1 . . . . . 338 V CO . 27784 1 657 . 1 . 1 338 338 VAL CA C 13 65.7809 . . 1 . . . . . 338 V CA . 27784 1 658 . 1 . 1 339 339 ALA N N 15 121.6429 . . 1 . . . . . 339 A N . 27784 1 659 . 1 . 1 339 339 ALA H H 1 8.8340 . . 1 . . . . . 339 A HN . 27784 1 660 . 1 . 1 339 339 ALA C C 13 180.2540 . . 1 . . . . . 339 A CO . 27784 1 661 . 1 . 1 339 339 ALA CA C 13 54.8927 . . 1 . . . . . 339 A CA . 27784 1 662 . 1 . 1 340 340 LEU N N 15 118.1061 . . 1 . . . . . 340 L N . 27784 1 663 . 1 . 1 340 340 LEU H H 1 7.7026 . . 1 . . . . . 340 L HN . 27784 1 664 . 1 . 1 340 340 LEU C C 13 179.2000 . . 1 . . . . . 340 L CO . 27784 1 665 . 1 . 1 340 340 LEU CA C 13 57.3649 . . 1 . . . . . 340 L CA . 27784 1 666 . 1 . 1 340 340 LEU CB C 13 41.2304 . . 1 . . . . . 340 L CB . 27784 1 667 . 1 . 1 341 341 ALA N N 15 120.9146 . . 1 . . . . . 341 A N . 27784 1 668 . 1 . 1 341 341 ALA H H 1 7.4034 . . 1 . . . . . 341 A HN . 27784 1 669 . 1 . 1 341 341 ALA C C 13 180.3995 . . 1 . . . . . 341 A CO . 27784 1 670 . 1 . 1 341 341 ALA CA C 13 54.1030 . . 1 . . . . . 341 A CA . 27784 1 671 . 1 . 1 342 342 ALA N N 15 118.2677 . . 1 . . . . . 342 A N . 27784 1 672 . 1 . 1 342 342 ALA H H 1 8.4322 . . 1 . . . . . 342 A HN . 27784 1 673 . 1 . 1 342 342 ALA C C 13 177.8984 . . 1 . . . . . 342 A CO . 27784 1 674 . 1 . 1 342 342 ALA CA C 13 53.4459 . . 1 . . . . . 342 A CA . 27784 1 675 . 1 . 1 342 342 ALA CB C 13 17.1760 . . 1 . . . . . 342 A CB . 27784 1 676 . 1 . 1 343 343 ALA N N 15 118.3164 . . 1 . . . . . 343 A N . 27784 1 677 . 1 . 1 343 343 ALA H H 1 7.3892 . . 1 . . . . . 343 A HN . 27784 1 678 . 1 . 1 343 343 ALA C C 13 178.1298 . . 1 . . . . . 343 A CO . 27784 1 679 . 1 . 1 343 343 ALA CA C 13 53.4370 . . 1 . . . . . 343 A CA . 27784 1 680 . 1 . 1 343 343 ALA CB C 13 17.6809 . . 1 . . . . . 343 A CB . 27784 1 681 . 1 . 1 344 344 HIS N N 15 115.1858 . . 1 . . . . . 344 H N . 27784 1 682 . 1 . 1 344 344 HIS H H 1 7.520 . . 1 . . . . . 344 H HN . 27784 1 683 . 1 . 1 344 344 HIS CA C 13 55.3467 . . 1 . . . . . 344 H CA . 27784 1 684 . 1 . 1 348 348 PRO C C 13 177.8818 . . 1 . . . . . 348 P CO . 27784 1 685 . 1 . 1 348 348 PRO CA C 13 64.7739 . . 1 . . . . . 348 P CA . 27784 1 686 . 1 . 1 349 349 HIS N N 15 114.2085 . . 1 . . . . . 349 H N . 27784 1 687 . 1 . 1 349 349 HIS H H 1 8.0516 . . 1 . . . . . 349 H HN . 27784 1 688 . 1 . 1 349 349 HIS C C 13 178.3758 . . 1 . . . . . 349 H CO . 27784 1 689 . 1 . 1 349 349 HIS CA C 13 60.1145 . . 1 . . . . . 349 H CA . 27784 1 690 . 1 . 1 349 349 HIS CB C 13 30.4822 . . 1 . . . . . 349 H CB . 27784 1 691 . 1 . 1 350 350 ASP N N 15 119.0801 . . 1 . . . . . 350 D N . 27784 1 692 . 1 . 1 350 350 ASP H H 1 7.5227 . . 1 . . . . . 350 D HN . 27784 1 693 . 1 . 1 350 350 ASP C C 13 177.8551 . . 1 . . . . . 350 D CO . 27784 1 694 . 1 . 1 350 350 ASP CA C 13 56.3664 . . 1 . . . . . 350 D CA . 27784 1 695 . 1 . 1 350 350 ASP CB C 13 40.7281 . . 1 . . . . . 350 D CB . 27784 1 696 . 1 . 1 351 351 THR N N 15 114.7738 . . 1 . . . . . 351 T N . 27784 1 697 . 1 . 1 351 351 THR H H 1 8.0438 . . 1 . . . . . 351 T HN . 27784 1 698 . 1 . 1 351 351 THR C C 13 176.3394 . . 1 . . . . . 351 T CO . 27784 1 699 . 1 . 1 351 351 THR CA C 13 65.5310 . . 1 . . . . . 351 T CA . 27784 1 700 . 1 . 1 351 351 THR CB C 13 68.9816 . . 1 . . . . . 351 T CB . 27784 1 701 . 1 . 1 352 352 LEU N N 15 115.5427 . . 1 . . . . . 352 L N . 27784 1 702 . 1 . 1 352 352 LEU H H 1 8.1073 . . 1 . . . . . 352 L HN . 27784 1 703 . 1 . 1 352 352 LEU C C 13 176.2330 . . 1 . . . . . 352 L CO . 27784 1 704 . 1 . 1 352 352 LEU CA C 13 56.2363 . . 1 . . . . . 352 L CA . 27784 1 705 . 1 . 1 352 352 LEU CB C 13 39.5939 . . 1 . . . . . 352 L CB . 27784 1 706 . 1 . 1 353 353 SER N N 15 109.5950 . . 1 . . . . . 353 S N . 27784 1 707 . 1 . 1 353 353 SER H H 1 7.1921 . . 1 . . . . . 353 S HN . 27784 1 708 . 1 . 1 353 353 SER C C 13 173.3065 . . 1 . . . . . 353 S CO . 27784 1 709 . 1 . 1 353 353 SER CA C 13 57.5532 . . 1 . . . . . 353 S CA . 27784 1 710 . 1 . 1 353 353 SER CB C 13 63.3497 . . 1 . . . . . 353 S CB . 27784 1 711 . 1 . 1 354 354 ASP N N 15 123.6209 . . 1 . . . . . 354 D N . 27784 1 712 . 1 . 1 354 354 ASP H H 1 6.8908 . . 1 . . . . . 354 D HN . 27784 1 713 . 1 . 1 354 354 ASP C C 13 177.2722 . . 1 . . . . . 354 D CO . 27784 1 714 . 1 . 1 354 354 ASP CA C 13 51.8890 . . 1 . . . . . 354 D CA . 27784 1 715 . 1 . 1 354 354 ASP CB C 13 42.1337 . . 1 . . . . . 354 D CB . 27784 1 716 . 1 . 1 355 355 PRO C C 13 179.4742 . . 1 . . . . . 355 P CO . 27784 1 717 . 1 . 1 355 355 PRO CA C 13 64.7064 . . 1 . . . . . 355 P CA . 27784 1 718 . 1 . 1 355 355 PRO CB C 13 31.3491 . . 1 . . . . . 355 P CB . 27784 1 719 . 1 . 1 356 356 ALA N N 15 120.8050 . . 1 . . . . . 356 A N . 27784 1 720 . 1 . 1 356 356 ALA H H 1 8.7023 . . 1 . . . . . 356 A HN . 27784 1 721 . 1 . 1 356 356 ALA C C 13 179.9654 . . 1 . . . . . 356 A CO . 27784 1 722 . 1 . 1 356 356 ALA CA C 13 53.8899 . . 1 . . . . . 356 A CA . 27784 1 723 . 1 . 1 356 356 ALA CB C 13 17.6496 . . 1 . . . . . 356 A CB . 27784 1 724 . 1 . 1 357 357 LEU N N 15 117.8086 . . 1 . . . . . 357 L N . 27784 1 725 . 1 . 1 357 357 LEU H H 1 7.6519 . . 1 . . . . . 357 L HN . 27784 1 726 . 1 . 1 357 357 LEU C C 13 177.4311 . . 1 . . . . . 357 L CO . 27784 1 727 . 1 . 1 357 357 LEU CA C 13 55.6656 . . 1 . . . . . 357 L CA . 27784 1 728 . 1 . 1 357 357 LEU CB C 13 41.5188 . . 1 . . . . . 357 L CB . 27784 1 729 . 1 . 1 358 358 ASP N N 15 114.8270 . . 1 . . . . . 358 D N . 27784 1 730 . 1 . 1 358 358 ASP H H 1 7.5278 . . 1 . . . . . 358 D HN . 27784 1 731 . 1 . 1 358 358 ASP C C 13 175.8122 . . 1 . . . . . 358 D CO . 27784 1 732 . 1 . 1 358 358 ASP CA C 13 54.3593 . . 1 . . . . . 358 D CA . 27784 1 733 . 1 . 1 358 358 ASP CB C 13 39.4208 . . 1 . . . . . 358 D CB . 27784 1 734 . 1 . 1 359 359 LEU N N 15 120.4062 . . 1 . . . . . 359 L N . 27784 1 735 . 1 . 1 359 359 LEU H H 1 8.4269 . . 1 . . . . . 359 L HN . 27784 1 736 . 1 . 1 359 359 LEU C C 13 180.8470 . . 1 . . . . . 359 L CO . 27784 1 737 . 1 . 1 359 359 LEU CA C 13 57.5188 . . 1 . . . . . 359 L CA . 27784 1 738 . 1 . 1 359 359 LEU CB C 13 41.2811 . . 1 . . . . . 359 L CB . 27784 1 739 . 1 . 1 360 360 LEU N N 15 119.9087 . . 1 . . . . . 360 L N . 27784 1 740 . 1 . 1 360 360 LEU H H 1 8.8926 . . 1 . . . . . 360 L HN . 27784 1 741 . 1 . 1 360 360 LEU C C 13 178.6189 . . 1 . . . . . 360 L CO . 27784 1 742 . 1 . 1 360 360 LEU CA C 13 58.8060 . . 1 . . . . . 360 L CA . 27784 1 743 . 1 . 1 361 361 GLY N N 15 109.0167 . . 1 . . . . . 361 G N . 27784 1 744 . 1 . 1 361 361 GLY H H 1 7.9393 . . 1 . . . . . 361 G HN . 27784 1 745 . 1 . 1 361 361 GLY C C 13 177.9501 . . 1 . . . . . 361 G CO . 27784 1 746 . 1 . 1 361 361 GLY CA C 13 46.7932 . . 1 . . . . . 361 G CA . 27784 1 747 . 1 . 1 362 362 LEU N N 15 123.5572 . . 1 . . . . . 362 L N . 27784 1 748 . 1 . 1 362 362 LEU H H 1 7.8939 . . 1 . . . . . 362 L HN . 27784 1 749 . 1 . 1 362 362 LEU C C 13 175.0951 . . 1 . . . . . 362 L CO . 27784 1 750 . 1 . 1 362 362 LEU CA C 13 57.8522 . . 1 . . . . . 362 L CA . 27784 1 751 . 1 . 1 363 363 MET N N 15 108.4068 . . 1 . . . . . 363 M N . 27784 1 752 . 1 . 1 363 363 MET H H 1 5.9789 . . 1 . . . . . 363 M HN . 27784 1 753 . 1 . 1 363 363 MET C C 13 175.2536 . . 1 . . . . . 363 M CO . 27784 1 754 . 1 . 1 363 363 MET CA C 13 51.6791 . . 1 . . . . . 363 M CA . 27784 1 755 . 1 . 1 364 364 ARG N N 15 119.4643 . . 1 . . . . . 364 R N . 27784 1 756 . 1 . 1 364 364 ARG H H 1 8.1035 . . 1 . . . . . 364 R HN . 27784 1 757 . 1 . 1 364 364 ARG C C 13 176.0228 . . 1 . . . . . 364 R CO . 27784 1 758 . 1 . 1 364 364 ARG CA C 13 56.7983 . . 1 . . . . . 364 R CA . 27784 1 759 . 1 . 1 365 365 ALA N N 15 121.2879 . . 1 . . . . . 365 A N . 27784 1 760 . 1 . 1 365 365 ALA H H 1 8.2092 . . 1 . . . . . 365 A HN . 27784 1 761 . 1 . 1 365 365 ALA C C 13 176.6976 . . 1 . . . . . 365 A CO . 27784 1 762 . 1 . 1 365 365 ALA CA C 13 51.0236 . . 1 . . . . . 365 A CA . 27784 1 763 . 1 . 1 365 365 ALA CB C 13 22.1832 . . 1 . . . . . 365 A CB . 27784 1 764 . 1 . 1 366 366 GLY N N 15 106.7445 . . 1 . . . . . 366 G N . 27784 1 765 . 1 . 1 366 366 GLY H H 1 9.2746 . . 1 . . . . . 366 G HN . 27784 1 766 . 1 . 1 366 366 GLY C C 13 175.2301 . . 1 . . . . . 366 G CO . 27784 1 767 . 1 . 1 366 366 GLY CA C 13 45.5269 . . 1 . . . . . 366 G CA . 27784 1 768 . 1 . 1 367 367 GLY N N 15 109.8381 . . 1 . . . . . 367 G N . 27784 1 769 . 1 . 1 367 367 GLY H H 1 8.2112 . . 1 . . . . . 367 G HN . 27784 1 770 . 1 . 1 367 367 GLY C C 13 170.8637 . . 1 . . . . . 367 G CO . 27784 1 771 . 1 . 1 367 367 GLY CA C 13 44.7246 . . 1 . . . . . 367 G CA . 27784 1 772 . 1 . 1 368 368 LEU N N 15 122.8369 . . 1 . . . . . 368 L N . 27784 1 773 . 1 . 1 368 368 LEU H H 1 8.6830 . . 1 . . . . . 368 L HN . 27784 1 774 . 1 . 1 368 368 LEU C C 13 174.5322 . . 1 . . . . . 368 L CO . 27784 1 775 . 1 . 1 368 368 LEU CA C 13 53.5314 . . 1 . . . . . 368 L CA . 27784 1 776 . 1 . 1 369 369 ILE N N 15 124.7884 . . 1 . . . . . 369 I N . 27784 1 777 . 1 . 1 369 369 ILE H H 1 9.3450 . . 1 . . . . . 369 I HN . 27784 1 778 . 1 . 1 369 369 ILE C C 13 174.3540 . . 1 . . . . . 369 I CO . 27784 1 779 . 1 . 1 369 369 ILE CA C 13 59.8322 . . 1 . . . . . 369 I CA . 27784 1 780 . 1 . 1 369 369 ILE CB C 13 39.8756 . . 1 . . . . . 369 I CB . 27784 1 781 . 1 . 1 370 370 LEU N N 15 125.5288 . . 1 . . . . . 370 L N . 27784 1 782 . 1 . 1 370 370 LEU H H 1 9.0054 . . 1 . . . . . 370 L HN . 27784 1 783 . 1 . 1 370 370 LEU C C 13 175.0583 . . 1 . . . . . 370 L CO . 27784 1 784 . 1 . 1 370 370 LEU CA C 13 53.7010 . . 1 . . . . . 370 L CA . 27784 1 785 . 1 . 1 370 370 LEU CB C 13 43.0985 . . 1 . . . . . 370 L CB . 27784 1 786 . 1 . 1 371 371 ARG N N 15 126.1067 . . 1 . . . . . 371 R N . 27784 1 787 . 1 . 1 371 371 ARG H H 1 8.4937 . . 1 . . . . . 371 R HN . 27784 1 788 . 1 . 1 371 371 ARG C C 13 172.9115 . . 1 . . . . . 371 R CO . 27784 1 789 . 1 . 1 371 371 ARG CA C 13 55.4378 . . 1 . . . . . 371 R CA . 27784 1 790 . 1 . 1 371 371 ARG CB C 13 32.6411 . . 1 . . . . . 371 R CB . 27784 1 791 . 1 . 1 372 372 PHE N N 15 119.2801 . . 1 . . . . . 372 F N . 27784 1 792 . 1 . 1 372 372 PHE H H 1 8.3650 . . 1 . . . . . 372 F HN . 27784 1 793 . 1 . 1 372 372 PHE C C 13 176.3150 . . 1 . . . . . 372 F CO . 27784 1 794 . 1 . 1 372 372 PHE CA C 13 56.9350 . . 1 . . . . . 372 F CA . 27784 1 795 . 1 . 1 372 372 PHE CB C 13 43.3767 . . 1 . . . . . 372 F CB . 27784 1 796 . 1 . 1 373 373 GLU N N 15 121.0592 . . 1 . . . . . 373 E N . 27784 1 797 . 1 . 1 373 373 GLU H H 1 10.3670 . . 1 . . . . . 373 E HN . 27784 1 798 . 1 . 1 373 373 GLU C C 13 176.6415 . . 1 . . . . . 373 E CO . 27784 1 799 . 1 . 1 373 373 GLU CA C 13 56.8752 . . 1 . . . . . 373 E CA . 27784 1 800 . 1 . 1 373 373 GLU CB C 13 27.4873 . . 1 . . . . . 373 E CB . 27784 1 801 . 1 . 1 374 374 GLY N N 15 105.0292 . . 1 . . . . . 374 G N . 27784 1 802 . 1 . 1 374 374 GLY H H 1 8.7829 . . 1 . . . . . 374 G HN . 27784 1 803 . 1 . 1 374 374 GLY C C 13 174.1774 . . 1 . . . . . 374 G CO . 27784 1 804 . 1 . 1 374 374 GLY CA C 13 45.5350 . . 1 . . . . . 374 G CA . 27784 1 805 . 1 . 1 375 375 ARG N N 15 119.8293 . . 1 . . . . . 375 R N . 27784 1 806 . 1 . 1 375 375 ARG H H 1 8.2714 . . 1 . . . . . 375 R HN . 27784 1 807 . 1 . 1 375 375 ARG C C 13 174.0640 . . 1 . . . . . 375 R CO . 27784 1 808 . 1 . 1 375 375 ARG CA C 13 54.2746 . . 1 . . . . . 375 R CA . 27784 1 809 . 1 . 1 375 375 ARG CB C 13 32.4431 . . 1 . . . . . 375 R CB . 27784 1 810 . 1 . 1 376 376 TRP N N 15 118.3225 . . 1 . . . . . 376 W N . 27784 1 811 . 1 . 1 376 376 TRP H H 1 8.2663 . . 1 . . . . . 376 W HN . 27784 1 812 . 1 . 1 376 376 TRP C C 13 175.8691 . . 1 . . . . . 376 W CO . 27784 1 813 . 1 . 1 376 376 TRP CA C 13 53.0835 . . 1 . . . . . 376 W CA . 27784 1 814 . 1 . 1 376 376 TRP CB C 13 33.3835 . . 1 . . . . . 376 W CB . 27784 1 815 . 1 . 1 377 377 GLN N N 15 118.7372 . . 1 . . . . . 377 Q N . 27784 1 816 . 1 . 1 377 377 GLN H H 1 9.4241 . . 1 . . . . . 377 Q HN . 27784 1 817 . 1 . 1 377 377 GLN C C 13 174.5350 . . 1 . . . . . 377 Q CO . 27784 1 818 . 1 . 1 377 377 GLN CA C 13 54.6336 . . 1 . . . . . 377 Q CA . 27784 1 819 . 1 . 1 377 377 GLN CB C 13 32.8542 . . 1 . . . . . 377 Q CB . 27784 1 820 . 1 . 1 378 378 THR N N 15 111.7938 . . 1 . . . . . 378 T N . 27784 1 821 . 1 . 1 378 378 THR H H 1 8.9043 . . 1 . . . . . 378 T HN . 27784 1 822 . 1 . 1 378 378 THR C C 13 173.9809 . . 1 . . . . . 378 T CO . 27784 1 823 . 1 . 1 378 378 THR CA C 13 59.4924 . . 1 . . . . . 378 T CA . 27784 1 824 . 1 . 1 378 378 THR CB C 13 71.6939 . . 1 . . . . . 378 T CB . 27784 1 825 . 1 . 1 379 379 LEU N N 15 120.5063 . . 1 . . . . . 379 L N . 27784 1 826 . 1 . 1 379 379 LEU H H 1 8.9766 . . 1 . . . . . 379 L HN . 27784 1 827 . 1 . 1 379 379 LEU C C 13 176.8675 . . 1 . . . . . 379 L CO . 27784 1 828 . 1 . 1 379 379 LEU CA C 13 54.2929 . . 1 . . . . . 379 L CA . 27784 1 829 . 1 . 1 379 379 LEU CB C 13 45.7736 . . 1 . . . . . 379 L CB . 27784 1 830 . 1 . 1 380 380 GLY N N 15 108.2331 . . 1 . . . . . 380 G N . 27784 1 831 . 1 . 1 380 380 GLY H H 1 8.7430 . . 1 . . . . . 380 G HN . 27784 1 832 . 1 . 1 380 380 GLY C C 13 174.1701 . . 1 . . . . . 380 G CO . 27784 1 833 . 1 . 1 380 380 GLY CA C 13 45.3342 . . 1 . . . . . 380 G CA . 27784 1 834 . 1 . 1 381 381 GLU N N 15 125.5378 . . 1 . . . . . 381 E N . 27784 1 835 . 1 . 1 381 381 GLU H H 1 8.9313 . . 1 . . . . . 381 E HN . 27784 1 836 . 1 . 1 381 381 GLU C C 13 174.7806 . . 1 . . . . . 381 E CO . 27784 1 837 . 1 . 1 381 381 GLU CA C 13 55.7533 . . 1 . . . . . 381 E CA . 27784 1 838 . 1 . 1 381 381 GLU CB C 13 29.1097 . . 1 . . . . . 381 E CB . 27784 1 839 . 1 . 1 382 382 VAL N N 15 117.6742 . . 1 . . . . . 382 V N . 27784 1 840 . 1 . 1 382 382 VAL H H 1 7.9434 . . 1 . . . . . 382 V HN . 27784 1 841 . 1 . 1 382 382 VAL C C 13 173.3620 . . 1 . . . . . 382 V CO . 27784 1 842 . 1 . 1 382 382 VAL CA C 13 57.6620 . . 1 . . . . . 382 V CA . 27784 1 843 . 1 . 1 382 382 VAL CB C 13 32.8182 . . 1 . . . . . 382 V CB . 27784 1 844 . 1 . 1 386 386 PRO C C 13 180.1656 . . 1 . . . . . 386 P CO . 27784 1 845 . 1 . 1 387 387 ALA N N 15 120.4686 . . 1 . . . . . 387 A N . 27784 1 846 . 1 . 1 387 387 ALA H H 1 7.4152 . . 1 . . . . . 387 A HN . 27784 1 847 . 1 . 1 387 387 ALA C C 13 179.2519 . . 1 . . . . . 387 A CO . 27784 1 848 . 1 . 1 387 387 ALA CA C 13 53.8555 . . 1 . . . . . 387 A CA . 27784 1 849 . 1 . 1 387 387 ALA CB C 13 18.6839 . . 1 . . . . . 387 A CB . 27784 1 850 . 1 . 1 388 388 VAL N N 15 121.1395 . . 1 . . . . . 388 V N . 27784 1 851 . 1 . 1 388 388 VAL H H 1 7.6677 . . 1 . . . . . 388 V HN . 27784 1 852 . 1 . 1 388 388 VAL CA C 13 67.0361 . . 1 . . . . . 388 V CA . 27784 1 853 . 1 . 1 389 389 ASP C C 13 179.6885 . . 1 . . . . . 389 D CO . 27784 1 854 . 1 . 1 390 390 ALA N N 15 122.6062 . . 1 . . . . . 390 A N . 27784 1 855 . 1 . 1 390 390 ALA H H 1 7.6641 . . 1 . . . . . 390 A HN . 27784 1 856 . 1 . 1 390 390 ALA C C 13 179.5457 . . 1 . . . . . 390 A CO . 27784 1 857 . 1 . 1 390 390 ALA CA C 13 54.8201 . . 1 . . . . . 390 A CA . 27784 1 858 . 1 . 1 391 391 LEU N N 15 124.3543 . . 1 . . . . . 391 L N . 27784 1 859 . 1 . 1 391 391 LEU H H 1 8.6008 . . 1 . . . . . 391 L HN . 27784 1 860 . 1 . 1 391 391 LEU C C 13 178.9803 . . 1 . . . . . 391 L CO . 27784 1 861 . 1 . 1 391 391 LEU CA C 13 58.0149 . . 1 . . . . . 391 L CA . 27784 1 862 . 1 . 1 391 391 LEU CB C 13 41.2032 . . 1 . . . . . 391 L CB . 27784 1 863 . 1 . 1 392 392 LEU N N 15 119.7389 . . 1 . . . . . 392 L N . 27784 1 864 . 1 . 1 392 392 LEU H H 1 8.3391 . . 1 . . . . . 392 L HN . 27784 1 865 . 1 . 1 392 392 LEU C C 13 178.2986 . . 1 . . . . . 392 L CO . 27784 1 866 . 1 . 1 392 392 LEU CA C 13 57.4929 . . 1 . . . . . 392 L CA . 27784 1 867 . 1 . 1 393 393 ALA N N 15 119.9959 . . 1 . . . . . 393 A N . 27784 1 868 . 1 . 1 393 393 ALA H H 1 7.5825 . . 1 . . . . . 393 A HN . 27784 1 869 . 1 . 1 393 393 ALA C C 13 180.5488 . . 1 . . . . . 393 A CO . 27784 1 870 . 1 . 1 393 393 ALA CA C 13 54.0842 . . 1 . . . . . 393 A CA . 27784 1 871 . 1 . 1 393 393 ALA CB C 13 17.0384 . . 1 . . . . . 393 A CB . 27784 1 872 . 1 . 1 394 394 TRP N N 15 120.4555 . . 1 . . . . . 394 W N . 27784 1 873 . 1 . 1 394 394 TRP H H 1 7.6852 . . 1 . . . . . 394 W HN . 27784 1 874 . 1 . 1 394 394 TRP C C 13 179.7725 . . 1 . . . . . 394 W CO . 27784 1 875 . 1 . 1 394 394 TRP CA C 13 60.7705 . . 1 . . . . . 394 W CA . 27784 1 876 . 1 . 1 394 394 TRP CB C 13 26.1010 . . 1 . . . . . 394 W CB . 27784 1 877 . 1 . 1 395 395 LEU N N 15 125.9813 . . 1 . . . . . 395 L N . 27784 1 878 . 1 . 1 395 395 LEU H H 1 8.5332 . . 1 . . . . . 395 L HN . 27784 1 879 . 1 . 1 395 395 LEU C C 13 176.6785 . . 1 . . . . . 395 L CO . 27784 1 880 . 1 . 1 395 395 LEU CA C 13 57.0604 . . 1 . . . . . 395 L CA . 27784 1 881 . 1 . 1 395 395 LEU CB C 13 40.2451 . . 1 . . . . . 395 L CB . 27784 1 882 . 1 . 1 396 396 GLU N N 15 110.9991 . . 1 . . . . . 396 E N . 27784 1 883 . 1 . 1 396 396 GLU H H 1 7.1101 . . 1 . . . . . 396 E HN . 27784 1 884 . 1 . 1 396 396 GLU C C 13 177.7612 . . 1 . . . . . 396 E CO . 27784 1 885 . 1 . 1 396 396 GLU CA C 13 57.4657 . . 1 . . . . . 396 E CA . 27784 1 886 . 1 . 1 396 396 GLU CB C 13 28.7725 . . 1 . . . . . 396 E CB . 27784 1 887 . 1 . 1 397 397 THR N N 15 108.9291 . . 1 . . . . . 397 T N . 27784 1 888 . 1 . 1 397 397 THR H H 1 7.3111 . . 1 . . . . . 397 T HN . 27784 1 889 . 1 . 1 397 397 THR C C 13 175.2566 . . 1 . . . . . 397 T CO . 27784 1 890 . 1 . 1 397 397 THR CA C 13 61.5828 . . 1 . . . . . 397 T CA . 27784 1 891 . 1 . 1 397 397 THR CB C 13 69.9129 . . 1 . . . . . 397 T CB . 27784 1 892 . 1 . 1 398 398 GLN N N 15 123.5455 . . 1 . . . . . 398 Q N . 27784 1 893 . 1 . 1 398 398 GLN H H 1 7.7424 . . 1 . . . . . 398 Q HN . 27784 1 894 . 1 . 1 398 398 GLN C C 13 174.7082 . . 1 . . . . . 398 Q CO . 27784 1 895 . 1 . 1 398 398 GLN CA C 13 52.2694 . . 1 . . . . . 398 Q CA . 27784 1 896 . 1 . 1 398 398 GLN CB C 13 26.2935 . . 1 . . . . . 398 Q CB . 27784 1 897 . 1 . 1 401 401 ALA C C 13 175.4695 . . 1 . . . . . 401 A CO . 27784 1 898 . 1 . 1 401 401 ALA CA C 13 50.9952 . . 1 . . . . . 401 A CA . 27784 1 899 . 1 . 1 401 401 ALA CB C 13 19.2872 . . 1 . . . . . 401 A CB . 27784 1 900 . 1 . 1 402 402 LEU N N 15 120.2329 . . 1 . . . . . 402 L N . 27784 1 901 . 1 . 1 402 402 LEU H H 1 7.4700 . . 1 . . . . . 402 L HN . 27784 1 902 . 1 . 1 402 402 LEU C C 13 176.4373 . . 1 . . . . . 402 L CO . 27784 1 903 . 1 . 1 402 402 LEU CA C 13 55.1421 . . 1 . . . . . 402 L CA . 27784 1 904 . 1 . 1 402 402 LEU CB C 13 44.3561 . . 1 . . . . . 402 L CB . 27784 1 905 . 1 . 1 403 403 VAL N N 15 129.1592 . . 1 . . . . . 403 V N . 27784 1 906 . 1 . 1 403 403 VAL H H 1 9.2664 . . 1 . . . . . 403 V HN . 27784 1 907 . 1 . 1 403 403 VAL C C 13 173.3480 . . 1 . . . . . 403 V CO . 27784 1 908 . 1 . 1 403 403 VAL CA C 13 61.1033 . . 1 . . . . . 403 V CA . 27784 1 909 . 1 . 1 403 403 VAL CB C 13 34.6823 . . 1 . . . . . 403 V CB . 27784 1 910 . 1 . 1 404 404 GLN N N 15 123.2751 . . 1 . . . . . 404 Q N . 27784 1 911 . 1 . 1 404 404 GLN H H 1 8.6681 . . 1 . . . . . 404 Q HN . 27784 1 912 . 1 . 1 404 404 GLN C C 13 173.9303 . . 1 . . . . . 404 Q CO . 27784 1 913 . 1 . 1 404 404 GLN CA C 13 52.9066 . . 1 . . . . . 404 Q CA . 27784 1 914 . 1 . 1 404 404 GLN CB C 13 29.6404 . . 1 . . . . . 404 Q CB . 27784 1 915 . 1 . 1 405 405 THR N N 15 116.0350 . . 1 . . . . . 405 T N . 27784 1 916 . 1 . 1 405 405 THR H H 1 9.2598 . . 1 . . . . . 405 T HN . 27784 1 917 . 1 . 1 405 405 THR C C 13 171.9237 . . 1 . . . . . 405 T CO . 27784 1 918 . 1 . 1 405 405 THR CA C 13 61.2978 . . 1 . . . . . 405 T CA . 27784 1 919 . 1 . 1 405 405 THR CB C 13 67.8747 . . 1 . . . . . 405 T CB . 27784 1 920 . 1 . 1 406 406 ASP N N 15 128.4224 . . 1 . . . . . 406 D N . 27784 1 921 . 1 . 1 406 406 ASP H H 1 8.8138 . . 1 . . . . . 406 D HN . 27784 1 922 . 1 . 1 406 406 ASP C C 13 173.3616 . . 1 . . . . . 406 D CO . 27784 1 923 . 1 . 1 406 406 ASP CA C 13 53.1642 . . 1 . . . . . 406 D CA . 27784 1 924 . 1 . 1 406 406 ASP CB C 13 40.1893 . . 1 . . . . . 406 D CB . 27784 1 925 . 1 . 1 407 407 ALA N N 15 124.2929 . . 1 . . . . . 407 A N . 27784 1 926 . 1 . 1 407 407 ALA H H 1 8.3989 . . 1 . . . . . 407 A HN . 27784 1 927 . 1 . 1 407 407 ALA C C 13 177.7403 . . 1 . . . . . 407 A CO . 27784 1 928 . 1 . 1 407 407 ALA CA C 13 50.8367 . . 1 . . . . . 407 A CA . 27784 1 929 . 1 . 1 407 407 ALA CB C 13 16.4917 . . 1 . . . . . 407 A CB . 27784 1 930 . 1 . 1 408 408 LEU N N 15 127.8032 . . 1 . . . . . 408 L N . 27784 1 931 . 1 . 1 408 408 LEU H H 1 9.8217 . . 1 . . . . . 408 L HN . 27784 1 932 . 1 . 1 408 408 LEU C C 13 178.4278 . . 1 . . . . . 408 L CO . 27784 1 933 . 1 . 1 408 408 LEU CA C 13 58.2369 . . 1 . . . . . 408 L CA . 27784 1 934 . 1 . 1 408 408 LEU CB C 13 40.9646 . . 1 . . . . . 408 L CB . 27784 1 935 . 1 . 1 409 409 GLY N N 15 104.2256 . . 1 . . . . . 409 G N . 27784 1 936 . 1 . 1 409 409 GLY H H 1 9.0088 . . 1 . . . . . 409 G HN . 27784 1 937 . 1 . 1 409 409 GLY C C 13 174.8444 . . 1 . . . . . 409 G CO . 27784 1 938 . 1 . 1 409 409 GLY CA C 13 45.0908 . . 1 . . . . . 409 G CA . 27784 1 939 . 1 . 1 410 410 GLN N N 15 116.4882 . . 1 . . . . . 410 Q N . 27784 1 940 . 1 . 1 410 410 GLN H H 1 7.7748 . . 1 . . . . . 410 Q HN . 27784 1 941 . 1 . 1 410 410 GLN C C 13 176.9832 . . 1 . . . . . 410 Q CO . 27784 1 942 . 1 . 1 410 410 GLN CA C 13 56.4621 . . 1 . . . . . 410 Q CA . 27784 1 943 . 1 . 1 410 410 GLN CB C 13 27.8190 . . 1 . . . . . 410 Q CB . 27784 1 944 . 1 . 1 411 411 LEU N N 15 119.8955 . . 1 . . . . . 411 L N . 27784 1 945 . 1 . 1 411 411 LEU H H 1 7.3119 . . 1 . . . . . 411 L HN . 27784 1 946 . 1 . 1 411 411 LEU C C 13 176.5592 . . 1 . . . . . 411 L CO . 27784 1 947 . 1 . 1 411 411 LEU CA C 13 55.7944 . . 1 . . . . . 411 L CA . 27784 1 948 . 1 . 1 412 412 TRP N N 15 121.2189 . . 1 . . . . . 412 W N . 27784 1 949 . 1 . 1 412 412 TRP H H 1 8.4221 . . 1 . . . . . 412 W HN . 27784 1 950 . 1 . 1 412 412 TRP CA C 13 54.4295 . . 1 . . . . . 412 W CA . 27784 1 951 . 1 . 1 413 413 PRO C C 13 179.2155 . . 1 . . . . . 413 P CO . 27784 1 952 . 1 . 1 413 413 PRO CA C 13 65.1930 . . 1 . . . . . 413 P CA . 27784 1 953 . 1 . 1 413 413 PRO CB C 13 30.7101 . . 1 . . . . . 413 P CB . 27784 1 954 . 1 . 1 414 414 ALA N N 15 118.1903 . . 1 . . . . . 414 A N . 27784 1 955 . 1 . 1 414 414 ALA H H 1 6.7039 . . 1 . . . . . 414 A HN . 27784 1 956 . 1 . 1 414 414 ALA C C 13 177.6054 . . 1 . . . . . 414 A CO . 27784 1 957 . 1 . 1 414 414 ALA CA C 13 52.6445 . . 1 . . . . . 414 A CA . 27784 1 958 . 1 . 1 414 414 ALA CB C 13 16.3644 . . 1 . . . . . 414 A CB . 27784 1 959 . 1 . 1 415 415 GLY N N 15 105.8904 . . 1 . . . . . 415 G N . 27784 1 960 . 1 . 1 415 415 GLY H H 1 7.1489 . . 1 . . . . . 415 G HN . 27784 1 961 . 1 . 1 415 415 GLY C C 13 175.9306 . . 1 . . . . . 415 G CO . 27784 1 962 . 1 . 1 415 415 GLY CA C 13 44.8394 . . 1 . . . . . 415 G CA . 27784 1 963 . 1 . 1 416 416 ALA N N 15 125.0139 . . 1 . . . . . 416 A N . 27784 1 964 . 1 . 1 416 416 ALA H H 1 7.4982 . . 1 . . . . . 416 A HN . 27784 1 965 . 1 . 1 416 416 ALA C C 13 179.2586 . . 1 . . . . . 416 A CO . 27784 1 966 . 1 . 1 416 416 ALA CA C 13 55.1459 . . 1 . . . . . 416 A CA . 27784 1 967 . 1 . 1 416 416 ALA CB C 13 17.4776 . . 1 . . . . . 416 A CB . 27784 1 968 . 1 . 1 417 417 ASP N N 15 114.8273 . . 1 . . . . . 417 D N . 27784 1 969 . 1 . 1 417 417 ASP H H 1 7.7586 . . 1 . . . . . 417 D HN . 27784 1 970 . 1 . 1 417 417 ASP C C 13 176.5225 . . 1 . . . . . 417 D CO . 27784 1 971 . 1 . 1 417 417 ASP CA C 13 54.9980 . . 1 . . . . . 417 D CA . 27784 1 972 . 1 . 1 417 417 ASP CB C 13 39.8532 . . 1 . . . . . 417 D CB . 27784 1 973 . 1 . 1 418 418 LEU N N 15 116.8856 . . 1 . . . . . 418 L N . 27784 1 974 . 1 . 1 418 418 LEU H H 1 7.4630 . . 1 . . . . . 418 L HN . 27784 1 975 . 1 . 1 418 418 LEU C C 13 176.3450 . . 1 . . . . . 418 L CO . 27784 1 976 . 1 . 1 418 418 LEU CA C 13 53.6378 . . 1 . . . . . 418 L CA . 27784 1 977 . 1 . 1 418 418 LEU CB C 13 40.6664 . . 1 . . . . . 418 L CB . 27784 1 978 . 1 . 1 419 419 ALA N N 15 123.2855 . . 1 . . . . . 419 A N . 27784 1 979 . 1 . 1 419 419 ALA H H 1 7.1850 . . 1 . . . . . 419 A HN . 27784 1 980 . 1 . 1 419 419 ALA C C 13 173.8370 . . 1 . . . . . 419 A CO . 27784 1 981 . 1 . 1 419 419 ALA CA C 13 54.6664 . . 1 . . . . . 419 A CA . 27784 1 982 . 1 . 1 419 419 ALA CB C 13 16.8119 . . 1 . . . . . 419 A CB . 27784 1 983 . 1 . 1 420 420 PRO C C 13 177.4536 . . 1 . . . . . 420 P CO . 27784 1 984 . 1 . 1 420 420 PRO CA C 13 66.2043 . . 1 . . . . . 420 P CA . 27784 1 985 . 1 . 1 420 420 PRO CB C 13 30.5151 . . 1 . . . . . 420 P CB . 27784 1 986 . 1 . 1 421 421 SER N N 15 106.6539 . . 1 . . . . . 421 S N . 27784 1 987 . 1 . 1 421 421 SER H H 1 7.5886 . . 1 . . . . . 421 S HN . 27784 1 988 . 1 . 1 421 421 SER C C 13 173.9047 . . 1 . . . . . 421 S CO . 27784 1 989 . 1 . 1 421 421 SER CA C 13 58.0993 . . 1 . . . . . 421 S CA . 27784 1 990 . 1 . 1 421 421 SER CB C 13 64.7996 . . 1 . . . . . 421 S CB . 27784 1 991 . 1 . 1 422 422 ALA N N 15 126.5213 . . 1 . . . . . 422 A N . 27784 1 992 . 1 . 1 422 422 ALA H H 1 8.2007 . . 1 . . . . . 422 A HN . 27784 1 993 . 1 . 1 422 422 ALA C C 13 174.2444 . . 1 . . . . . 422 A CO . 27784 1 994 . 1 . 1 422 422 ALA CA C 13 50.5871 . . 1 . . . . . 422 A CA . 27784 1 995 . 1 . 1 422 422 ALA CB C 13 18.3463 . . 1 . . . . . 422 A CB . 27784 1 996 . 1 . 1 423 423 ALA N N 15 123.8882 . . 1 . . . . . 423 A N . 27784 1 997 . 1 . 1 423 423 ALA H H 1 7.8660 . . 1 . . . . . 423 A HN . 27784 1 998 . 1 . 1 423 423 ALA C C 13 176.0342 . . 1 . . . . . 423 A CO . 27784 1 999 . 1 . 1 423 423 ALA CA C 13 53.8528 . . 1 . . . . . 423 A CA . 27784 1 1000 . 1 . 1 423 423 ALA CB C 13 18.6043 . . 1 . . . . . 423 A CB . 27784 1 1001 . 1 . 1 424 424 GLY N N 15 103.0105 . . 1 . . . . . 424 G N . 27784 1 1002 . 1 . 1 424 424 GLY H H 1 8.3978 . . 1 . . . . . 424 G HN . 27784 1 1003 . 1 . 1 424 424 GLY C C 13 173.2848 . . 1 . . . . . 424 G CO . 27784 1 1004 . 1 . 1 424 424 GLY CA C 13 43.3900 . . 1 . . . . . 424 G CA . 27784 1 1005 . 1 . 1 425 425 LEU N N 15 123.8887 . . 1 . . . . . 425 L N . 27784 1 1006 . 1 . 1 425 425 LEU H H 1 9.0212 . . 1 . . . . . 425 L HN . 27784 1 1007 . 1 . 1 425 425 LEU C C 13 173.4538 . . 1 . . . . . 425 L CO . 27784 1 1008 . 1 . 1 425 425 LEU CA C 13 54.7871 . . 1 . . . . . 425 L CA . 27784 1 1009 . 1 . 1 426 426 LEU N N 15 131.4030 . . 1 . . . . . 426 L N . 27784 1 1010 . 1 . 1 426 426 LEU H H 1 9.0882 . . 1 . . . . . 426 L HN . 27784 1 1011 . 1 . 1 426 426 LEU C C 13 173.8963 . . 1 . . . . . 426 L CO . 27784 1 1012 . 1 . 1 426 426 LEU CA C 13 54.5467 . . 1 . . . . . 426 L CA . 27784 1 1013 . 1 . 1 427 427 ALA N N 15 129.4445 . . 1 . . . . . 427 A N . 27784 1 1014 . 1 . 1 427 427 ALA H H 1 9.7442 . . 1 . . . . . 427 A HN . 27784 1 1015 . 1 . 1 427 427 ALA C C 13 176.3184 . . 1 . . . . . 427 A CO . 27784 1 1016 . 1 . 1 427 427 ALA CA C 13 49.5879 . . 1 . . . . . 427 A CA . 27784 1 1017 . 1 . 1 427 427 ALA CB C 13 25.1373 . . 1 . . . . . 427 A CB . 27784 1 1018 . 1 . 1 428 428 ILE N N 15 112.2480 . . 1 . . . . . 428 I N . 27784 1 1019 . 1 . 1 428 428 ILE H H 1 8.9291 . . 1 . . . . . 428 I HN . 27784 1 1020 . 1 . 1 428 428 ILE C C 13 174.5526 . . 1 . . . . . 428 I CO . 27784 1 1021 . 1 . 1 428 428 ILE CA C 13 58.1999 . . 1 . . . . . 428 I CA . 27784 1 1022 . 1 . 1 428 428 ILE CB C 13 41.5865 . . 1 . . . . . 428 I CB . 27784 1 1023 . 1 . 1 429 429 SER N N 15 118.2811 . . 1 . . . . . 429 S N . 27784 1 1024 . 1 . 1 429 429 SER H H 1 7.6830 . . 1 . . . . . 429 S HN . 27784 1 1025 . 1 . 1 429 429 SER CA C 13 55.8189 . . 1 . . . . . 429 S CA . 27784 1 1026 . 1 . 1 429 429 SER CB C 13 62.1685 . . 1 . . . . . 429 S CB . 27784 1 1027 . 1 . 1 434 434 TRP C C 13 175.4897 . . 1 . . . . . 434 W CO . 27784 1 1028 . 1 . 1 434 434 TRP CA C 13 58.3484 . . 1 . . . . . 434 W CA . 27784 1 1029 . 1 . 1 435 435 SER N N 15 116.7157 . . 1 . . . . . 435 S N . 27784 1 1030 . 1 . 1 435 435 SER H H 1 7.7980 . . 1 . . . . . 435 S HN . 27784 1 1031 . 1 . 1 435 435 SER C C 13 174.8337 . . 1 . . . . . 435 S CO . 27784 1 1032 . 1 . 1 435 435 SER CA C 13 61.6574 . . 1 . . . . . 435 S CA . 27784 1 1033 . 1 . 1 435 435 SER CB C 13 62.0897 . . 1 . . . . . 435 S CB . 27784 1 1034 . 1 . 1 436 436 GLU N N 15 119.4765 . . 1 . . . . . 436 E N . 27784 1 1035 . 1 . 1 436 436 GLU H H 1 7.6402 . . 1 . . . . . 436 E HN . 27784 1 1036 . 1 . 1 436 436 GLU C C 13 175.9101 . . 1 . . . . . 436 E CO . 27784 1 1037 . 1 . 1 436 436 GLU CA C 13 54.1602 . . 1 . . . . . 436 E CA . 27784 1 1038 . 1 . 1 436 436 GLU CB C 13 30.0693 . . 1 . . . . . 436 E CB . 27784 1 1039 . 1 . 1 437 437 CYS N N 15 116.8592 . . 1 . . . . . 437 C N . 27784 1 1040 . 1 . 1 437 437 CYS H H 1 8.8680 . . 1 . . . . . 437 C HN . 27784 1 1041 . 1 . 1 437 437 CYS C C 13 170.4326 . . 1 . . . . . 437 C CO . 27784 1 1042 . 1 . 1 437 437 CYS CA C 13 55.8815 . . 1 . . . . . 437 C CA . 27784 1 1043 . 1 . 1 438 438 LEU N N 15 118.0805 . . 1 . . . . . 438 L N . 27784 1 1044 . 1 . 1 438 438 LEU H H 1 8.0045 . . 1 . . . . . 438 L HN . 27784 1 1045 . 1 . 1 438 438 LEU C C 13 175.4776 . . 1 . . . . . 438 L CO . 27784 1 1046 . 1 . 1 438 438 LEU CA C 13 54.4105 . . 1 . . . . . 438 L CA . 27784 1 1047 . 1 . 1 438 438 LEU CB C 13 44.3034 . . 1 . . . . . 438 L CB . 27784 1 1048 . 1 . 1 439 439 VAL N N 15 119.7998 . . 1 . . . . . 439 V N . 27784 1 1049 . 1 . 1 439 439 VAL H H 1 8.5223 . . 1 . . . . . 439 V HN . 27784 1 1050 . 1 . 1 439 439 VAL C C 13 174.8292 . . 1 . . . . . 439 V CO . 27784 1 1051 . 1 . 1 439 439 VAL CA C 13 60.3996 . . 1 . . . . . 439 V CA . 27784 1 1052 . 1 . 1 440 440 TRP N N 15 128.5199 . . 1 . . . . . 440 W N . 27784 1 1053 . 1 . 1 440 440 TRP H H 1 10.1796 . . 1 . . . . . 440 W HN . 27784 1 1054 . 1 . 1 440 440 TRP C C 13 175.5491 . . 1 . . . . . 440 W CO . 27784 1 1055 . 1 . 1 440 440 TRP CA C 13 59.7568 . . 1 . . . . . 440 W CA . 27784 1 1056 . 1 . 1 441 441 LEU N N 15 120.0417 . . 1 . . . . . 441 L N . 27784 1 1057 . 1 . 1 441 441 LEU H H 1 9.0201 . . 1 . . . . . 441 L HN . 27784 1 1058 . 1 . 1 441 441 LEU C C 13 177.9632 . . 1 . . . . . 441 L CO . 27784 1 1059 . 1 . 1 441 441 LEU CA C 13 52.9301 . . 1 . . . . . 441 L CA . 27784 1 1060 . 1 . 1 442 442 ARG N N 15 121.0950 . . 1 . . . . . 442 R N . 27784 1 1061 . 1 . 1 442 442 ARG H H 1 9.1010 . . 1 . . . . . 442 R HN . 27784 1 1062 . 1 . 1 442 442 ARG CA C 13 53.0847 . . 1 . . . . . 442 R CA . 27784 1 1063 . 1 . 1 442 442 ARG CB C 13 34.3703 . . 1 . . . . . 442 R CB . 27784 1 1064 . 1 . 1 443 443 PRO C C 13 175.0607 . . 1 . . . . . 443 P CO . 27784 1 1065 . 1 . 1 443 443 PRO CA C 13 61.4588 . . 1 . . . . . 443 P CA . 27784 1 1066 . 1 . 1 444 444 GLU N N 15 118.1263 . . 1 . . . . . 444 E N . 27784 1 1067 . 1 . 1 444 444 GLU H H 1 7.5252 . . 1 . . . . . 444 E HN . 27784 1 1068 . 1 . 1 444 444 GLU C C 13 176.1692 . . 1 . . . . . 444 E CO . 27784 1 1069 . 1 . 1 444 444 GLU CA C 13 56.0163 . . 1 . . . . . 444 E CA . 27784 1 1070 . 1 . 1 444 444 GLU CB C 13 29.4323 . . 1 . . . . . 444 E CB . 27784 1 1071 . 1 . 1 445 445 LEU N N 15 125.9533 . . 1 . . . . . 445 L N . 27784 1 1072 . 1 . 1 445 445 LEU H H 1 9.1106 . . 1 . . . . . 445 L HN . 27784 1 1073 . 1 . 1 445 445 LEU C C 13 176.4969 . . 1 . . . . . 445 L CO . 27784 1 1074 . 1 . 1 445 445 LEU CA C 13 56.2528 . . 1 . . . . . 445 L CA . 27784 1 1075 . 1 . 1 445 445 LEU CB C 13 42.2656 . . 1 . . . . . 445 L CB . 27784 1 1076 . 1 . 1 446 446 ARG N N 15 125.0489 . . 1 . . . . . 446 R N . 27784 1 1077 . 1 . 1 446 446 ARG H H 1 8.1435 . . 1 . . . . . 446 R HN . 27784 1 1078 . 1 . 1 446 446 ARG C C 13 174.9292 . . 1 . . . . . 446 R CO . 27784 1 1079 . 1 . 1 446 446 ARG CA C 13 54.9394 . . 1 . . . . . 446 R CA . 27784 1 1080 . 1 . 1 446 446 ARG CB C 13 30.9278 . . 1 . . . . . 446 R CB . 27784 1 1081 . 1 . 1 447 447 LEU N N 15 124.0794 . . 1 . . . . . 447 L N . 27784 1 1082 . 1 . 1 447 447 LEU H H 1 8.0432 . . 1 . . . . . 447 L HN . 27784 1 1083 . 1 . 1 447 447 LEU C C 13 175.8121 . . 1 . . . . . 447 L CO . 27784 1 1084 . 1 . 1 447 447 LEU CA C 13 53.8574 . . 1 . . . . . 447 L CA . 27784 1 1085 . 1 . 1 447 447 LEU CB C 13 44.6841 . . 1 . . . . . 447 L CB . 27784 1 1086 . 1 . 1 448 448 GLU N N 15 121.3359 . . 1 . . . . . 448 E N . 27784 1 1087 . 1 . 1 448 448 GLU H H 1 8.3286 . . 1 . . . . . 448 E HN . 27784 1 1088 . 1 . 1 448 448 GLU C C 13 176.1277 . . 1 . . . . . 448 E CO . 27784 1 1089 . 1 . 1 448 448 GLU CA C 13 54.3010 . . 1 . . . . . 448 E CA . 27784 1 1090 . 1 . 1 448 448 GLU CB C 13 31.0712 . . 1 . . . . . 448 E CB . 27784 1 1091 . 1 . 1 449 449 VAL N N 15 116.8666 . . 1 . . . . . 449 V N . 27784 1 1092 . 1 . 1 449 449 VAL H H 1 8.0036 . . 1 . . . . . 449 V HN . 27784 1 1093 . 1 . 1 449 449 VAL C C 13 178.1331 . . 1 . . . . . 449 V CO . 27784 1 1094 . 1 . 1 449 449 VAL CA C 13 60.8952 . . 1 . . . . . 449 V CA . 27784 1 1095 . 1 . 1 449 449 VAL CB C 13 30.9216 . . 1 . . . . . 449 V CB . 27784 1 1096 . 1 . 1 450 450 ALA N N 15 126.7144 . . 1 . . . . . 450 A N . 27784 1 1097 . 1 . 1 450 450 ALA H H 1 8.0342 . . 1 . . . . . 450 A HN . 27784 1 1098 . 1 . 1 450 450 ALA CA C 13 53.8113 . . 1 . . . . . 450 A CA . 27784 1 1099 . 1 . 1 450 450 ALA CB C 13 19.0708 . . 1 . . . . . 450 A CB . 27784 1 1100 . 1 . 1 467 467 HIS C C 13 179.7855 . . 1 . . . . . 467 H CO . 27784 1 1101 . 1 . 1 467 467 HIS CA C 13 59.4251 . . 1 . . . . . 467 H CA . 27784 1 1102 . 1 . 1 468 468 SER N N 15 120.9760 . . 1 . . . . . 468 S N . 27784 1 1103 . 1 . 1 468 468 SER H H 1 9.6558 . . 1 . . . . . 468 S HN . 27784 1 1104 . 1 . 1 468 468 SER C C 13 175.7034 . . 1 . . . . . 468 S CO . 27784 1 1105 . 1 . 1 468 468 SER CA C 13 64.1197 . . 1 . . . . . 468 S CA . 27784 1 1106 . 1 . 1 468 468 SER CB C 13 62.3819 . . 1 . . . . . 468 S CB . 27784 1 1107 . 1 . 1 469 469 PHE N N 15 125.3697 . . 1 . . . . . 469 F N . 27784 1 1108 . 1 . 1 469 469 PHE H H 1 9.2756 . . 1 . . . . . 469 F HN . 27784 1 1109 . 1 . 1 469 469 PHE C C 13 177.3293 . . 1 . . . . . 469 F CO . 27784 1 1110 . 1 . 1 469 469 PHE CA C 13 61.3407 . . 1 . . . . . 469 F CA . 27784 1 1111 . 1 . 1 469 469 PHE CB C 13 38.8400 . . 1 . . . . . 469 F CB . 27784 1 1112 . 1 . 1 470 470 ASP N N 15 118.8958 . . 1 . . . . . 470 D N . 27784 1 1113 . 1 . 1 470 470 ASP H H 1 8.5896 . . 1 . . . . . 470 D HN . 27784 1 1114 . 1 . 1 470 470 ASP C C 13 179.8283 . . 1 . . . . . 470 D CO . 27784 1 1115 . 1 . 1 470 470 ASP CA C 13 57.4718 . . 1 . . . . . 470 D CA . 27784 1 1116 . 1 . 1 470 470 ASP CB C 13 39.7887 . . 1 . . . . . 470 D CB . 27784 1 1117 . 1 . 1 471 471 THR N N 15 117.4199 . . 1 . . . . . 471 T N . 27784 1 1118 . 1 . 1 471 471 THR H H 1 8.1822 . . 1 . . . . . 471 T HN . 27784 1 1119 . 1 . 1 471 471 THR C C 13 175.8136 . . 1 . . . . . 471 T CO . 27784 1 1120 . 1 . 1 471 471 THR CA C 13 66.6319 . . 1 . . . . . 471 T CA . 27784 1 1121 . 1 . 1 471 471 THR CB C 13 68.0401 . . 1 . . . . . 471 T CB . 27784 1 1122 . 1 . 1 472 472 TYR N N 15 124.3779 . . 1 . . . . . 472 Y N . 27784 1 1123 . 1 . 1 472 472 TYR H H 1 8.4456 . . 1 . . . . . 472 Y HN . 27784 1 1124 . 1 . 1 472 472 TYR C C 13 176.2697 . . 1 . . . . . 472 Y CO . 27784 1 1125 . 1 . 1 472 472 TYR CA C 13 62.3948 . . 1 . . . . . 472 Y CA . 27784 1 1126 . 1 . 1 472 472 TYR CB C 13 37.4260 . . 1 . . . . . 472 Y CB . 27784 1 1127 . 1 . 1 473 473 LEU N N 15 117.3422 . . 1 . . . . . 473 L N . 27784 1 1128 . 1 . 1 473 473 LEU H H 1 8.2852 . . 1 . . . . . 473 L HN . 27784 1 1129 . 1 . 1 473 473 LEU C C 13 180.5383 . . 1 . . . . . 473 L CO . 27784 1 1130 . 1 . 1 473 473 LEU CA C 13 57.2718 . . 1 . . . . . 473 L CA . 27784 1 1131 . 1 . 1 473 473 LEU CB C 13 40.5360 . . 1 . . . . . 473 L CB . 27784 1 1132 . 1 . 1 474 474 GLU N N 15 119.7346 . . 1 . . . . . 474 E N . 27784 1 1133 . 1 . 1 474 474 GLU H H 1 7.8128 . . 1 . . . . . 474 E HN . 27784 1 1134 . 1 . 1 474 474 GLU C C 13 179.8540 . . 1 . . . . . 474 E CO . 27784 1 1135 . 1 . 1 474 474 GLU CA C 13 58.9261 . . 1 . . . . . 474 E CA . 27784 1 1136 . 1 . 1 474 474 GLU CB C 13 28.7885 . . 1 . . . . . 474 E CB . 27784 1 1137 . 1 . 1 475 475 GLU N N 15 119.3389 . . 1 . . . . . 475 E N . 27784 1 1138 . 1 . 1 475 475 GLU H H 1 7.9945 . . 1 . . . . . 475 E HN . 27784 1 1139 . 1 . 1 475 475 GLU C C 13 178.6651 . . 1 . . . . . 475 E CO . 27784 1 1140 . 1 . 1 475 475 GLU CA C 13 58.3110 . . 1 . . . . . 475 E CA . 27784 1 1141 . 1 . 1 475 475 GLU CB C 13 28.6421 . . 1 . . . . . 475 E CB . 27784 1 1142 . 1 . 1 476 476 LYS N N 15 116.0498 . . 1 . . . . . 476 K N . 27784 1 1143 . 1 . 1 476 476 LYS H H 1 7.2976 . . 1 . . . . . 476 K HN . 27784 1 1144 . 1 . 1 476 476 LYS C C 13 176.3595 . . 1 . . . . . 476 K CO . 27784 1 1145 . 1 . 1 476 476 LYS CA C 13 52.7869 . . 1 . . . . . 476 K CA . 27784 1 1146 . 1 . 1 476 476 LYS CB C 13 29.2972 . . 1 . . . . . 476 K CB . 27784 1 1147 . 1 . 1 477 477 ARG N N 15 124.3931 . . 1 . . . . . 477 R N . 27784 1 1148 . 1 . 1 477 477 ARG H H 1 7.1060 . . 1 . . . . . 477 R HN . 27784 1 1149 . 1 . 1 477 477 ARG CA C 13 58.0815 . . 1 . . . . . 477 R CA . 27784 1 1150 . 1 . 1 477 477 ARG CB C 13 28.6459 . . 1 . . . . . 477 R CB . 27784 1 1151 . 1 . 1 493 493 ASP C C 13 180.1632 . . 1 . . . . . 493 D CO . 27784 1 1152 . 1 . 1 493 493 ASP CA C 13 57.1933 . . 1 . . . . . 493 D CA . 27784 1 1153 . 1 . 1 494 494 LEU N N 15 123.9518 . . 1 . . . . . 494 L N . 27784 1 1154 . 1 . 1 494 494 LEU H H 1 9.5130 . . 1 . . . . . 494 L HN . 27784 1 1155 . 1 . 1 494 494 LEU CA C 13 57.7131 . . 1 . . . . . 494 L CA . 27784 1 1156 . 1 . 1 495 495 ARG N N 15 121.0614 . . 1 . . . . . 495 R N . 27784 1 1157 . 1 . 1 495 495 ARG H H 1 8.4232 . . 1 . . . . . 495 R HN . 27784 1 1158 . 1 . 1 495 495 ARG C C 13 179.4122 . . 1 . . . . . 495 R CO . 27784 1 1159 . 1 . 1 495 495 ARG CA C 13 60.5761 . . 1 . . . . . 495 R CA . 27784 1 1160 . 1 . 1 495 495 ARG CB C 13 28.1433 . . 1 . . . . . 495 R CB . 27784 1 1161 . 1 . 1 496 496 ASP N N 15 122.2483 . . 1 . . . . . 496 D N . 27784 1 1162 . 1 . 1 496 496 ASP H H 1 8.0001 . . 1 . . . . . 496 D HN . 27784 1 1163 . 1 . 1 496 496 ASP C C 13 179.3106 . . 1 . . . . . 496 D CO . 27784 1 1164 . 1 . 1 496 496 ASP CA C 13 57.7176 . . 1 . . . . . 496 D CA . 27784 1 1165 . 1 . 1 496 496 ASP CB C 13 39.7113 . . 1 . . . . . 496 D CB . 27784 1 1166 . 1 . 1 497 497 THR N N 15 119.6645 . . 1 . . . . . 497 T N . 27784 1 1167 . 1 . 1 497 497 THR H H 1 8.4949 . . 1 . . . . . 497 T HN . 27784 1 1168 . 1 . 1 497 497 THR CA C 13 66.4070 . . 1 . . . . . 497 T CA . 27784 1 1169 . 1 . 1 497 497 THR CB C 13 68.3948 . . 1 . . . . . 497 T CB . 27784 1 1170 . 1 . 1 498 498 LEU N N 15 120.4937 . . 1 . . . . . 498 L N . 27784 1 1171 . 1 . 1 498 498 LEU H H 1 8.9770 . . 1 . . . . . 498 L HN . 27784 1 1172 . 1 . 1 498 498 LEU C C 13 178.3639 . . 1 . . . . . 498 L CO . 27784 1 1173 . 1 . 1 498 498 LEU CA C 13 57.4132 . . 1 . . . . . 498 L CA . 27784 1 1174 . 1 . 1 498 498 LEU CB C 13 40.9695 . . 1 . . . . . 498 L CB . 27784 1 1175 . 1 . 1 499 499 THR N N 15 115.1692 . . 1 . . . . . 499 T N . 27784 1 1176 . 1 . 1 499 499 THR H H 1 8.3697 . . 1 . . . . . 499 T HN . 27784 1 1177 . 1 . 1 499 499 THR C C 13 176.8802 . . 1 . . . . . 499 T CO . 27784 1 1178 . 1 . 1 499 499 THR CA C 13 66.6014 . . 1 . . . . . 499 T CA . 27784 1 1179 . 1 . 1 499 499 THR CB C 13 68.4651 . . 1 . . . . . 499 T CB . 27784 1 1180 . 1 . 1 500 500 GLY N N 15 107.2712 . . 1 . . . . . 500 G N . 27784 1 1181 . 1 . 1 500 500 GLY H H 1 7.7223 . . 1 . . . . . 500 G HN . 27784 1 1182 . 1 . 1 500 500 GLY C C 13 175.5237 . . 1 . . . . . 500 G CO . 27784 1 1183 . 1 . 1 500 500 GLY CA C 13 46.3616 . . 1 . . . . . 500 G CA . 27784 1 1184 . 1 . 1 501 501 ALA N N 15 122.9481 . . 1 . . . . . 501 A N . 27784 1 1185 . 1 . 1 501 501 ALA H H 1 7.8832 . . 1 . . . . . 501 A HN . 27784 1 1186 . 1 . 1 501 501 ALA C C 13 179.0158 . . 1 . . . . . 501 A CO . 27784 1 1187 . 1 . 1 501 501 ALA CA C 13 53.6791 . . 1 . . . . . 501 A CA . 27784 1 1188 . 1 . 1 501 501 ALA CB C 13 18.4893 . . 1 . . . . . 501 A CB . 27784 1 stop_ save_