data_50695 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50695 _Entry.Title ; 1H, 15N, 13C backbone resonance assignment of the monomer C-terminal domain of Enzyme I from Thermoanaerobacter tengcongensis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-01-06 _Entry.Accession_date 2021-01-06 _Entry.Last_release_date 2021-02-11 _Entry.Original_release_date 2021-02-11 _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 Trang Nguyen . . . . 50695 2 Vincenzo Venditti . . . . 50695 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50695 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 824 50695 '15N chemical shifts' 288 50695 '1H chemical shifts' 286 50695 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 1 . . 2021-05-27 . original BMRB . 50695 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27183 'C-terminal domain of Enzyme I from Thermoanaerobacter tengcongensis' 50695 BMRB 50694 'monomer C-terminal domain of Enzyme I from Thermoanaerobacter tengcongensis' 50695 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50695 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33975952 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structure elucidation of the elusive Enzyme I monomer reveals the molecular mechanisms linking oligomerization and enzymatic activity ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 118 _Citation.Journal_issue 20 _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 e2100298118 _Citation.Page_last e2100298118 _Citation.Year 2021 _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 Trang Nguyen . T. . . 50695 1 2 Rodolfo Ghirlando . . . . 50695 1 3 Julien Roche . . . . 50695 1 4 Vincenzo Venditti . . . . 50695 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Phosphotransferase system' 50695 1 'carbon metabolism' 50695 1 'enzyme regulation' 50695 1 'high-pressure; solution NMR' 50695 1 phosphoenolpyruvate 50695 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50695 _Assembly.ID 1 _Assembly.Name 3m-tEIC _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 'homodimer 3m-tEIC, chain 1' 1 $entity_1 . . yes native no no . . . 50695 1 2 'homodimer 3m-tEIC, chain 2' 1 $entity_1 . . yes native no no . . . 50695 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50695 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; SMAETPDGKKVMLAANIGTP KDVASALANGAEGVGLFRTE FLYMDRNSLPSEEEQFEAYK EVVEKMGGRPVTIRTLDIGG DKELPYLDMPKEMNPFLGYR AIRLCLDRPDIFKTQLRAIL RASAYGNVQIMYPMISSVEE VEKANSILEEVKAELDREGV KYDKEIKVGIMVEIPSAAVT ARILAKEVDFFSIGTNDLTQ YTLAVDRMNEHVKEYYQPFH PAILRLVKMVIDAAHKEGKF AAMCGEMAGDPLAAVILLGL GLDEFSMSATSIPEIKNIIR NVEYEKAKEIAEKALNMSEA EEIEKMMKDVIKDIG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'Sequence numbering starts at 259 Serine' _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 315 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation 'R400E, D440R, R559E' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _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 1 259 SER . 50695 1 2 260 MET . 50695 1 3 261 ALA . 50695 1 4 262 GLU . 50695 1 5 263 THR . 50695 1 6 264 PRO . 50695 1 7 265 ASP . 50695 1 8 266 GLY . 50695 1 9 267 LYS . 50695 1 10 268 LYS . 50695 1 11 269 VAL . 50695 1 12 270 MET . 50695 1 13 271 LEU . 50695 1 14 272 ALA . 50695 1 15 273 ALA . 50695 1 16 274 ASN . 50695 1 17 275 ILE . 50695 1 18 276 GLY . 50695 1 19 277 THR . 50695 1 20 278 PRO . 50695 1 21 279 LYS . 50695 1 22 280 ASP . 50695 1 23 281 VAL . 50695 1 24 282 ALA . 50695 1 25 283 SER . 50695 1 26 284 ALA . 50695 1 27 285 LEU . 50695 1 28 286 ALA . 50695 1 29 287 ASN . 50695 1 30 288 GLY . 50695 1 31 289 ALA . 50695 1 32 290 GLU . 50695 1 33 291 GLY . 50695 1 34 292 VAL . 50695 1 35 293 GLY . 50695 1 36 294 LEU . 50695 1 37 295 PHE . 50695 1 38 296 ARG . 50695 1 39 297 THR . 50695 1 40 298 GLU . 50695 1 41 299 PHE . 50695 1 42 300 LEU . 50695 1 43 301 TYR . 50695 1 44 302 MET . 50695 1 45 303 ASP . 50695 1 46 304 ARG . 50695 1 47 305 ASN . 50695 1 48 306 SER . 50695 1 49 307 LEU . 50695 1 50 308 PRO . 50695 1 51 309 SER . 50695 1 52 310 GLU . 50695 1 53 311 GLU . 50695 1 54 312 GLU . 50695 1 55 313 GLN . 50695 1 56 314 PHE . 50695 1 57 315 GLU . 50695 1 58 316 ALA . 50695 1 59 317 TYR . 50695 1 60 318 LYS . 50695 1 61 319 GLU . 50695 1 62 320 VAL . 50695 1 63 321 VAL . 50695 1 64 322 GLU . 50695 1 65 323 LYS . 50695 1 66 324 MET . 50695 1 67 325 GLY . 50695 1 68 326 GLY . 50695 1 69 327 ARG . 50695 1 70 328 PRO . 50695 1 71 329 VAL . 50695 1 72 330 THR . 50695 1 73 331 ILE . 50695 1 74 332 ARG . 50695 1 75 333 THR . 50695 1 76 334 LEU . 50695 1 77 335 ASP . 50695 1 78 336 ILE . 50695 1 79 337 GLY . 50695 1 80 338 GLY . 50695 1 81 339 ASP . 50695 1 82 340 LYS . 50695 1 83 341 GLU . 50695 1 84 342 LEU . 50695 1 85 343 PRO . 50695 1 86 344 TYR . 50695 1 87 345 LEU . 50695 1 88 346 ASP . 50695 1 89 347 MET . 50695 1 90 348 PRO . 50695 1 91 349 LYS . 50695 1 92 350 GLU . 50695 1 93 351 MET . 50695 1 94 352 ASN . 50695 1 95 353 PRO . 50695 1 96 354 PHE . 50695 1 97 355 LEU . 50695 1 98 356 GLY . 50695 1 99 357 TYR . 50695 1 100 358 ARG . 50695 1 101 359 ALA . 50695 1 102 360 ILE . 50695 1 103 361 ARG . 50695 1 104 362 LEU . 50695 1 105 363 CYS . 50695 1 106 364 LEU . 50695 1 107 365 ASP . 50695 1 108 366 ARG . 50695 1 109 367 PRO . 50695 1 110 368 ASP . 50695 1 111 369 ILE . 50695 1 112 370 PHE . 50695 1 113 371 LYS . 50695 1 114 372 THR . 50695 1 115 373 GLN . 50695 1 116 374 LEU . 50695 1 117 375 ARG . 50695 1 118 376 ALA . 50695 1 119 377 ILE . 50695 1 120 378 LEU . 50695 1 121 379 ARG . 50695 1 122 380 ALA . 50695 1 123 381 SER . 50695 1 124 382 ALA . 50695 1 125 383 TYR . 50695 1 126 384 GLY . 50695 1 127 385 ASN . 50695 1 128 386 VAL . 50695 1 129 387 GLN . 50695 1 130 388 ILE . 50695 1 131 389 MET . 50695 1 132 390 TYR . 50695 1 133 391 PRO . 50695 1 134 392 MET . 50695 1 135 393 ILE . 50695 1 136 394 SER . 50695 1 137 395 SER . 50695 1 138 396 VAL . 50695 1 139 397 GLU . 50695 1 140 398 GLU . 50695 1 141 399 VAL . 50695 1 142 400 GLU . 50695 1 143 401 LYS . 50695 1 144 402 ALA . 50695 1 145 403 ASN . 50695 1 146 404 SER . 50695 1 147 405 ILE . 50695 1 148 406 LEU . 50695 1 149 407 GLU . 50695 1 150 408 GLU . 50695 1 151 409 VAL . 50695 1 152 410 LYS . 50695 1 153 411 ALA . 50695 1 154 412 GLU . 50695 1 155 413 LEU . 50695 1 156 414 ASP . 50695 1 157 415 ARG . 50695 1 158 416 GLU . 50695 1 159 417 GLY . 50695 1 160 418 VAL . 50695 1 161 419 LYS . 50695 1 162 420 TYR . 50695 1 163 421 ASP . 50695 1 164 422 LYS . 50695 1 165 423 GLU . 50695 1 166 424 ILE . 50695 1 167 425 LYS . 50695 1 168 426 VAL . 50695 1 169 427 GLY . 50695 1 170 428 ILE . 50695 1 171 429 MET . 50695 1 172 430 VAL . 50695 1 173 431 GLU . 50695 1 174 432 ILE . 50695 1 175 433 PRO . 50695 1 176 434 SER . 50695 1 177 435 ALA . 50695 1 178 436 ALA . 50695 1 179 437 VAL . 50695 1 180 438 THR . 50695 1 181 439 ALA . 50695 1 182 440 ARG . 50695 1 183 441 ILE . 50695 1 184 442 LEU . 50695 1 185 443 ALA . 50695 1 186 444 LYS . 50695 1 187 445 GLU . 50695 1 188 446 VAL . 50695 1 189 447 ASP . 50695 1 190 448 PHE . 50695 1 191 449 PHE . 50695 1 192 450 SER . 50695 1 193 451 ILE . 50695 1 194 452 GLY . 50695 1 195 453 THR . 50695 1 196 454 ASN . 50695 1 197 455 ASP . 50695 1 198 456 LEU . 50695 1 199 457 THR . 50695 1 200 458 GLN . 50695 1 201 459 TYR . 50695 1 202 460 THR . 50695 1 203 461 LEU . 50695 1 204 462 ALA . 50695 1 205 463 VAL . 50695 1 206 464 ASP . 50695 1 207 465 ARG . 50695 1 208 466 MET . 50695 1 209 467 ASN . 50695 1 210 468 GLU . 50695 1 211 469 HIS . 50695 1 212 470 VAL . 50695 1 213 471 LYS . 50695 1 214 472 GLU . 50695 1 215 473 TYR . 50695 1 216 474 TYR . 50695 1 217 475 GLN . 50695 1 218 476 PRO . 50695 1 219 477 PHE . 50695 1 220 478 HIS . 50695 1 221 479 PRO . 50695 1 222 480 ALA . 50695 1 223 481 ILE . 50695 1 224 482 LEU . 50695 1 225 483 ARG . 50695 1 226 484 LEU . 50695 1 227 485 VAL . 50695 1 228 486 LYS . 50695 1 229 487 MET . 50695 1 230 488 VAL . 50695 1 231 489 ILE . 50695 1 232 490 ASP . 50695 1 233 491 ALA . 50695 1 234 492 ALA . 50695 1 235 493 HIS . 50695 1 236 494 LYS . 50695 1 237 495 GLU . 50695 1 238 496 GLY . 50695 1 239 497 LYS . 50695 1 240 498 PHE . 50695 1 241 499 ALA . 50695 1 242 500 ALA . 50695 1 243 501 MET . 50695 1 244 502 CYS . 50695 1 245 503 GLY . 50695 1 246 504 GLU . 50695 1 247 505 MET . 50695 1 248 506 ALA . 50695 1 249 507 GLY . 50695 1 250 508 ASP . 50695 1 251 509 PRO . 50695 1 252 510 LEU . 50695 1 253 511 ALA . 50695 1 254 512 ALA . 50695 1 255 513 VAL . 50695 1 256 514 ILE . 50695 1 257 515 LEU . 50695 1 258 516 LEU . 50695 1 259 517 GLY . 50695 1 260 518 LEU . 50695 1 261 519 GLY . 50695 1 262 520 LEU . 50695 1 263 521 ASP . 50695 1 264 522 GLU . 50695 1 265 523 PHE . 50695 1 266 524 SER . 50695 1 267 525 MET . 50695 1 268 526 SER . 50695 1 269 527 ALA . 50695 1 270 528 THR . 50695 1 271 529 SER . 50695 1 272 530 ILE . 50695 1 273 531 PRO . 50695 1 274 532 GLU . 50695 1 275 533 ILE . 50695 1 276 534 LYS . 50695 1 277 535 ASN . 50695 1 278 536 ILE . 50695 1 279 537 ILE . 50695 1 280 538 ARG . 50695 1 281 539 ASN . 50695 1 282 540 VAL . 50695 1 283 541 GLU . 50695 1 284 542 TYR . 50695 1 285 543 GLU . 50695 1 286 544 LYS . 50695 1 287 545 ALA . 50695 1 288 546 LYS . 50695 1 289 547 GLU . 50695 1 290 548 ILE . 50695 1 291 549 ALA . 50695 1 292 550 GLU . 50695 1 293 551 LYS . 50695 1 294 552 ALA . 50695 1 295 553 LEU . 50695 1 296 554 ASN . 50695 1 297 555 MET . 50695 1 298 556 SER . 50695 1 299 557 GLU . 50695 1 300 558 ALA . 50695 1 301 559 GLU . 50695 1 302 560 GLU . 50695 1 303 561 ILE . 50695 1 304 562 GLU . 50695 1 305 563 LYS . 50695 1 306 564 MET . 50695 1 307 565 MET . 50695 1 308 566 LYS . 50695 1 309 567 ASP . 50695 1 310 568 VAL . 50695 1 311 569 ILE . 50695 1 312 570 LYS . 50695 1 313 571 ASP . 50695 1 314 572 ILE . 50695 1 315 573 GLY . 50695 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 . SER 1 1 50695 1 . MET 2 2 50695 1 . ALA 3 3 50695 1 . GLU 4 4 50695 1 . THR 5 5 50695 1 . PRO 6 6 50695 1 . ASP 7 7 50695 1 . GLY 8 8 50695 1 . LYS 9 9 50695 1 . LYS 10 10 50695 1 . VAL 11 11 50695 1 . MET 12 12 50695 1 . LEU 13 13 50695 1 . ALA 14 14 50695 1 . ALA 15 15 50695 1 . ASN 16 16 50695 1 . ILE 17 17 50695 1 . GLY 18 18 50695 1 . THR 19 19 50695 1 . PRO 20 20 50695 1 . LYS 21 21 50695 1 . ASP 22 22 50695 1 . VAL 23 23 50695 1 . ALA 24 24 50695 1 . SER 25 25 50695 1 . ALA 26 26 50695 1 . LEU 27 27 50695 1 . ALA 28 28 50695 1 . ASN 29 29 50695 1 . GLY 30 30 50695 1 . ALA 31 31 50695 1 . GLU 32 32 50695 1 . GLY 33 33 50695 1 . VAL 34 34 50695 1 . GLY 35 35 50695 1 . LEU 36 36 50695 1 . PHE 37 37 50695 1 . ARG 38 38 50695 1 . THR 39 39 50695 1 . GLU 40 40 50695 1 . PHE 41 41 50695 1 . LEU 42 42 50695 1 . TYR 43 43 50695 1 . MET 44 44 50695 1 . ASP 45 45 50695 1 . ARG 46 46 50695 1 . ASN 47 47 50695 1 . SER 48 48 50695 1 . LEU 49 49 50695 1 . PRO 50 50 50695 1 . SER 51 51 50695 1 . GLU 52 52 50695 1 . GLU 53 53 50695 1 . GLU 54 54 50695 1 . GLN 55 55 50695 1 . PHE 56 56 50695 1 . GLU 57 57 50695 1 . ALA 58 58 50695 1 . TYR 59 59 50695 1 . LYS 60 60 50695 1 . GLU 61 61 50695 1 . VAL 62 62 50695 1 . VAL 63 63 50695 1 . GLU 64 64 50695 1 . LYS 65 65 50695 1 . MET 66 66 50695 1 . GLY 67 67 50695 1 . GLY 68 68 50695 1 . ARG 69 69 50695 1 . PRO 70 70 50695 1 . VAL 71 71 50695 1 . THR 72 72 50695 1 . ILE 73 73 50695 1 . ARG 74 74 50695 1 . THR 75 75 50695 1 . LEU 76 76 50695 1 . ASP 77 77 50695 1 . ILE 78 78 50695 1 . GLY 79 79 50695 1 . GLY 80 80 50695 1 . ASP 81 81 50695 1 . LYS 82 82 50695 1 . GLU 83 83 50695 1 . LEU 84 84 50695 1 . PRO 85 85 50695 1 . TYR 86 86 50695 1 . LEU 87 87 50695 1 . ASP 88 88 50695 1 . MET 89 89 50695 1 . PRO 90 90 50695 1 . LYS 91 91 50695 1 . GLU 92 92 50695 1 . MET 93 93 50695 1 . ASN 94 94 50695 1 . PRO 95 95 50695 1 . PHE 96 96 50695 1 . LEU 97 97 50695 1 . GLY 98 98 50695 1 . TYR 99 99 50695 1 . ARG 100 100 50695 1 . ALA 101 101 50695 1 . ILE 102 102 50695 1 . ARG 103 103 50695 1 . LEU 104 104 50695 1 . CYS 105 105 50695 1 . LEU 106 106 50695 1 . ASP 107 107 50695 1 . ARG 108 108 50695 1 . PRO 109 109 50695 1 . ASP 110 110 50695 1 . ILE 111 111 50695 1 . PHE 112 112 50695 1 . LYS 113 113 50695 1 . THR 114 114 50695 1 . GLN 115 115 50695 1 . LEU 116 116 50695 1 . ARG 117 117 50695 1 . ALA 118 118 50695 1 . ILE 119 119 50695 1 . LEU 120 120 50695 1 . ARG 121 121 50695 1 . ALA 122 122 50695 1 . SER 123 123 50695 1 . ALA 124 124 50695 1 . TYR 125 125 50695 1 . GLY 126 126 50695 1 . ASN 127 127 50695 1 . VAL 128 128 50695 1 . GLN 129 129 50695 1 . ILE 130 130 50695 1 . MET 131 131 50695 1 . TYR 132 132 50695 1 . PRO 133 133 50695 1 . MET 134 134 50695 1 . ILE 135 135 50695 1 . SER 136 136 50695 1 . SER 137 137 50695 1 . VAL 138 138 50695 1 . GLU 139 139 50695 1 . GLU 140 140 50695 1 . VAL 141 141 50695 1 . GLU 142 142 50695 1 . LYS 143 143 50695 1 . ALA 144 144 50695 1 . ASN 145 145 50695 1 . SER 146 146 50695 1 . ILE 147 147 50695 1 . LEU 148 148 50695 1 . GLU 149 149 50695 1 . GLU 150 150 50695 1 . VAL 151 151 50695 1 . LYS 152 152 50695 1 . ALA 153 153 50695 1 . GLU 154 154 50695 1 . LEU 155 155 50695 1 . ASP 156 156 50695 1 . ARG 157 157 50695 1 . GLU 158 158 50695 1 . GLY 159 159 50695 1 . VAL 160 160 50695 1 . LYS 161 161 50695 1 . TYR 162 162 50695 1 . ASP 163 163 50695 1 . LYS 164 164 50695 1 . GLU 165 165 50695 1 . ILE 166 166 50695 1 . LYS 167 167 50695 1 . VAL 168 168 50695 1 . GLY 169 169 50695 1 . ILE 170 170 50695 1 . MET 171 171 50695 1 . VAL 172 172 50695 1 . GLU 173 173 50695 1 . ILE 174 174 50695 1 . PRO 175 175 50695 1 . SER 176 176 50695 1 . ALA 177 177 50695 1 . ALA 178 178 50695 1 . VAL 179 179 50695 1 . THR 180 180 50695 1 . ALA 181 181 50695 1 . ARG 182 182 50695 1 . ILE 183 183 50695 1 . LEU 184 184 50695 1 . ALA 185 185 50695 1 . LYS 186 186 50695 1 . GLU 187 187 50695 1 . VAL 188 188 50695 1 . ASP 189 189 50695 1 . PHE 190 190 50695 1 . PHE 191 191 50695 1 . SER 192 192 50695 1 . ILE 193 193 50695 1 . GLY 194 194 50695 1 . THR 195 195 50695 1 . ASN 196 196 50695 1 . ASP 197 197 50695 1 . LEU 198 198 50695 1 . THR 199 199 50695 1 . GLN 200 200 50695 1 . TYR 201 201 50695 1 . THR 202 202 50695 1 . LEU 203 203 50695 1 . ALA 204 204 50695 1 . VAL 205 205 50695 1 . ASP 206 206 50695 1 . ARG 207 207 50695 1 . MET 208 208 50695 1 . ASN 209 209 50695 1 . GLU 210 210 50695 1 . HIS 211 211 50695 1 . VAL 212 212 50695 1 . LYS 213 213 50695 1 . GLU 214 214 50695 1 . TYR 215 215 50695 1 . TYR 216 216 50695 1 . GLN 217 217 50695 1 . PRO 218 218 50695 1 . PHE 219 219 50695 1 . HIS 220 220 50695 1 . PRO 221 221 50695 1 . ALA 222 222 50695 1 . ILE 223 223 50695 1 . LEU 224 224 50695 1 . ARG 225 225 50695 1 . LEU 226 226 50695 1 . VAL 227 227 50695 1 . LYS 228 228 50695 1 . MET 229 229 50695 1 . VAL 230 230 50695 1 . ILE 231 231 50695 1 . ASP 232 232 50695 1 . ALA 233 233 50695 1 . ALA 234 234 50695 1 . HIS 235 235 50695 1 . LYS 236 236 50695 1 . GLU 237 237 50695 1 . GLY 238 238 50695 1 . LYS 239 239 50695 1 . PHE 240 240 50695 1 . ALA 241 241 50695 1 . ALA 242 242 50695 1 . MET 243 243 50695 1 . CYS 244 244 50695 1 . GLY 245 245 50695 1 . GLU 246 246 50695 1 . MET 247 247 50695 1 . ALA 248 248 50695 1 . GLY 249 249 50695 1 . ASP 250 250 50695 1 . PRO 251 251 50695 1 . LEU 252 252 50695 1 . ALA 253 253 50695 1 . ALA 254 254 50695 1 . VAL 255 255 50695 1 . ILE 256 256 50695 1 . LEU 257 257 50695 1 . LEU 258 258 50695 1 . GLY 259 259 50695 1 . LEU 260 260 50695 1 . GLY 261 261 50695 1 . LEU 262 262 50695 1 . ASP 263 263 50695 1 . GLU 264 264 50695 1 . PHE 265 265 50695 1 . SER 266 266 50695 1 . MET 267 267 50695 1 . SER 268 268 50695 1 . ALA 269 269 50695 1 . THR 270 270 50695 1 . SER 271 271 50695 1 . ILE 272 272 50695 1 . PRO 273 273 50695 1 . GLU 274 274 50695 1 . ILE 275 275 50695 1 . LYS 276 276 50695 1 . ASN 277 277 50695 1 . ILE 278 278 50695 1 . ILE 279 279 50695 1 . ARG 280 280 50695 1 . ASN 281 281 50695 1 . VAL 282 282 50695 1 . GLU 283 283 50695 1 . TYR 284 284 50695 1 . GLU 285 285 50695 1 . LYS 286 286 50695 1 . ALA 287 287 50695 1 . LYS 288 288 50695 1 . GLU 289 289 50695 1 . ILE 290 290 50695 1 . ALA 291 291 50695 1 . GLU 292 292 50695 1 . LYS 293 293 50695 1 . ALA 294 294 50695 1 . LEU 295 295 50695 1 . ASN 296 296 50695 1 . MET 297 297 50695 1 . SER 298 298 50695 1 . GLU 299 299 50695 1 . ALA 300 300 50695 1 . GLU 301 301 50695 1 . GLU 302 302 50695 1 . ILE 303 303 50695 1 . GLU 304 304 50695 1 . LYS 305 305 50695 1 . MET 306 306 50695 1 . MET 307 307 50695 1 . LYS 308 308 50695 1 . ASP 309 309 50695 1 . VAL 310 310 50695 1 . ILE 311 311 50695 1 . LYS 312 312 50695 1 . ASP 313 313 50695 1 . ILE 314 314 50695 1 . GLY 315 315 50695 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50695 _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 $entity_1 . 274 organism . 'Thermus thermophilus' 'Thermus thermophilus' . . Bacteria . Thermus thermophilus . . . . . . . . . . . . . 50695 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50695 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pet21A . . . 50695 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50695 _Sample.ID 1 _Sample.Name 'sample 1' _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 3m-tEIC '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.75 . . mM . . . . 50695 1 2 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 50695 1 3 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 50695 1 4 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 50695 1 5 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 50695 1 6 MgCl2 'natural abundance' . . . . . . 4 . . mM . . . . 50695 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 50695 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'condition 1' _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 pH 7.4 . pH 50695 1 pressure 1 . bar 50695 1 temperature 313 . K 50695 1 stop_ save_ ############################ # Computer software used # ############################ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50695 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50695 1 'data analysis' . 50695 1 stop_ save_ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50695 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50695 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 50695 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 50695 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50695 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'spectrometer 1' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50695 _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 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50695 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50695 1 3 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50695 1 4 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50695 1 5 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50695 1 6 '3D HN(COCA)CB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50695 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50695 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name reference _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 TMS 'methyl carbons' . . . . ppm 0 internal indirect 1 . . . . . 50695 1 H 1 TMS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 50695 1 N 15 TMS nitrogen . . . . ppm 0 internal indirect 1 . . . . . 50695 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50695 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name dimer-3m-tEIC _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 $chem_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 '2D 1H-15N HSQC' . . . 50695 1 2 '3D HNCO' . . . 50695 1 3 '3D HNCA' . . . 50695 1 4 '3D HN(CO)CA' . . . 50695 1 5 '3D HNCACB' . . . 50695 1 6 '3D HN(COCA)CB' . . . 50695 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 3 $software_3 . . 50695 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 2 2 MET H H 1 9.460 0.00 . . . . . . . 260 MET H . 50695 1 2 . 1 . 1 2 2 MET C C 13 176.136 0.00 . . . . . . . 260 MET CO . 50695 1 3 . 1 . 1 2 2 MET CA C 13 54.797 0.00 . . . . . . . 260 MET CA . 50695 1 4 . 1 . 1 2 2 MET CB C 13 32.653 0.00 . . . . . . . 260 MET CB . 50695 1 5 . 1 . 1 2 2 MET N N 15 126.979 0.01 . . . . . . . 260 MET N . 50695 1 6 . 1 . 1 3 3 ALA H H 1 8.256 1.21 . . . . . . . 261 ALA H . 50695 1 7 . 1 . 1 3 3 ALA C C 13 172.876 0.00 . . . . . . . 261 ALA CO . 50695 1 8 . 1 . 1 3 3 ALA CA C 13 51.111 0.01 . . . . . . . 261 ALA CA . 50695 1 9 . 1 . 1 3 3 ALA CB C 13 17.184 0.06 . . . . . . . 261 ALA CB . 50695 1 10 . 1 . 1 3 3 ALA N N 15 125.025 1.96 . . . . . . . 261 ALA N . 50695 1 11 . 1 . 1 4 4 GLU H H 1 7.942 0.89 . . . . . . . 262 GLU H . 50695 1 12 . 1 . 1 4 4 GLU C C 13 175.836 0.00 . . . . . . . 262 GLU CO . 50695 1 13 . 1 . 1 4 4 GLU CA C 13 53.084 0.01 . . . . . . . 262 GLU CA . 50695 1 14 . 1 . 1 4 4 GLU CB C 13 32.769 0.06 . . . . . . . 262 GLU CB . 50695 1 15 . 1 . 1 4 4 GLU N N 15 123.072 0.00 . . . . . . . 262 GLU N . 50695 1 16 . 1 . 1 5 5 THR H H 1 8.837 0.00 . . . . . . . 263 THR H . 50695 1 17 . 1 . 1 5 5 THR CA C 13 60.645 0.00 . . . . . . . 263 THR CA . 50695 1 18 . 1 . 1 5 5 THR CB C 13 69.199 0.00 . . . . . . . 263 THR CB . 50695 1 19 . 1 . 1 5 5 THR N N 15 117.920 0.01 . . . . . . . 263 THR N . 50695 1 20 . 1 . 1 6 6 PRO C C 13 176.944 0.00 . . . . . . . 264 PRO CO . 50695 1 21 . 1 . 1 6 6 PRO CA C 13 64.798 0.00 . . . . . . . 264 PRO CA . 50695 1 22 . 1 . 1 6 6 PRO CB C 13 31.619 0.00 . . . . . . . 264 PRO CB . 50695 1 23 . 1 . 1 7 7 ASP H H 1 8.269 0.19 . . . . . . . 265 ASP H . 50695 1 24 . 1 . 1 7 7 ASP C C 13 176.990 0.00 . . . . . . . 265 ASP CO . 50695 1 25 . 1 . 1 7 7 ASP CA C 13 52.057 0.00 . . . . . . . 265 ASP CA . 50695 1 26 . 1 . 1 7 7 ASP CB C 13 38.512 0.05 . . . . . . . 265 ASP CB . 50695 1 27 . 1 . 1 7 7 ASP N N 15 109.651 0.25 . . . . . . . 265 ASP N . 50695 1 28 . 1 . 1 8 8 GLY H H 1 8.277 0.19 . . . . . . . 266 GLY H . 50695 1 29 . 1 . 1 8 8 GLY C C 13 174.044 0.00 . . . . . . . 266 GLY CO . 50695 1 30 . 1 . 1 8 8 GLY CA C 13 46.591 0.01 . . . . . . . 266 GLY CA . 50695 1 31 . 1 . 1 8 8 GLY N N 15 109.146 0.00 . . . . . . . 266 GLY N . 50695 1 32 . 1 . 1 9 9 LYS H H 1 8.461 0.01 . . . . . . . 267 LYS H . 50695 1 33 . 1 . 1 9 9 LYS C C 13 174.630 0.00 . . . . . . . 267 LYS CO . 50695 1 34 . 1 . 1 9 9 LYS CA C 13 54.727 0.00 . . . . . . . 267 LYS CA . 50695 1 35 . 1 . 1 9 9 LYS CB C 13 31.938 0.00 . . . . . . . 267 LYS CB . 50695 1 36 . 1 . 1 9 9 LYS N N 15 126.063 1.74 . . . . . . . 267 LYS N . 50695 1 37 . 1 . 1 10 10 LYS H H 1 8.279 0.17 . . . . . . . 268 LYS H . 50695 1 38 . 1 . 1 10 10 LYS C C 13 176.638 0.00 . . . . . . . 268 LYS CO . 50695 1 39 . 1 . 1 10 10 LYS CA C 13 55.083 0.04 . . . . . . . 268 LYS CA . 50695 1 40 . 1 . 1 10 10 LYS CB C 13 33.605 0.06 . . . . . . . 268 LYS CB . 50695 1 41 . 1 . 1 10 10 LYS N N 15 128.223 0.00 . . . . . . . 268 LYS N . 50695 1 42 . 1 . 1 11 11 VAL H H 1 8.044 0.07 . . . . . . . 269 VAL H . 50695 1 43 . 1 . 1 11 11 VAL C C 13 173.528 0.00 . . . . . . . 269 VAL CO . 50695 1 44 . 1 . 1 11 11 VAL CA C 13 59.448 0.00 . . . . . . . 269 VAL CA . 50695 1 45 . 1 . 1 11 11 VAL CB C 13 34.183 0.05 . . . . . . . 269 VAL CB . 50695 1 46 . 1 . 1 11 11 VAL N N 15 117.523 0.00 . . . . . . . 269 VAL N . 50695 1 47 . 1 . 1 12 12 MET H H 1 8.243 0.27 . . . . . . . 270 MET H . 50695 1 48 . 1 . 1 12 12 MET C C 13 174.806 0.00 . . . . . . . 270 MET CO . 50695 1 49 . 1 . 1 12 12 MET CA C 13 54.743 0.00 . . . . . . . 270 MET CA . 50695 1 50 . 1 . 1 12 12 MET CB C 13 34.477 0.01 . . . . . . . 270 MET CB . 50695 1 51 . 1 . 1 12 12 MET N N 15 122.581 0.00 . . . . . . . 270 MET N . 50695 1 52 . 1 . 1 13 13 LEU H H 1 8.983 0.47 . . . . . . . 271 LEU H . 50695 1 53 . 1 . 1 13 13 LEU C C 13 173.710 0.00 . . . . . . . 271 LEU CO . 50695 1 54 . 1 . 1 13 13 LEU CA C 13 53.544 0.00 . . . . . . . 271 LEU CA . 50695 1 55 . 1 . 1 13 13 LEU CB C 13 41.010 0.03 . . . . . . . 271 LEU CB . 50695 1 56 . 1 . 1 13 13 LEU N N 15 127.641 0.17 . . . . . . . 271 LEU N . 50695 1 57 . 1 . 1 14 14 ALA H H 1 8.839 0.62 . . . . . . . 272 ALA H . 50695 1 58 . 1 . 1 14 14 ALA C C 13 174.458 0.00 . . . . . . . 272 ALA CO . 50695 1 59 . 1 . 1 14 14 ALA CA C 13 49.573 0.00 . . . . . . . 272 ALA CA . 50695 1 60 . 1 . 1 14 14 ALA CB C 13 22.413 0.04 . . . . . . . 272 ALA CB . 50695 1 61 . 1 . 1 14 14 ALA N N 15 127.824 0.00 . . . . . . . 272 ALA N . 50695 1 62 . 1 . 1 15 15 ALA H H 1 7.820 0.40 . . . . . . . 273 ALA H . 50695 1 63 . 1 . 1 15 15 ALA C C 13 177.334 0.00 . . . . . . . 273 ALA CO . 50695 1 64 . 1 . 1 15 15 ALA CA C 13 49.055 0.04 . . . . . . . 273 ALA CA . 50695 1 65 . 1 . 1 15 15 ALA CB C 13 22.220 0.07 . . . . . . . 273 ALA CB . 50695 1 66 . 1 . 1 15 15 ALA N N 15 119.243 0.95 . . . . . . . 273 ALA N . 50695 1 67 . 1 . 1 16 16 ASN H H 1 8.497 1.08 . . . . . . . 274 ASN H . 50695 1 68 . 1 . 1 16 16 ASN C C 13 175.704 0.00 . . . . . . . 274 ASN CO . 50695 1 69 . 1 . 1 16 16 ASN CA C 13 50.319 0.00 . . . . . . . 274 ASN CA . 50695 1 70 . 1 . 1 16 16 ASN CB C 13 38.075 0.04 . . . . . . . 274 ASN CB . 50695 1 71 . 1 . 1 16 16 ASN N N 15 119.383 0.81 . . . . . . . 274 ASN N . 50695 1 72 . 1 . 1 17 17 ILE H H 1 9.446 0.13 . . . . . . . 275 ILE H . 50695 1 73 . 1 . 1 17 17 ILE C C 13 174.318 0.00 . . . . . . . 275 ILE CO . 50695 1 74 . 1 . 1 17 17 ILE CA C 13 59.067 0.01 . . . . . . . 275 ILE CA . 50695 1 75 . 1 . 1 17 17 ILE CB C 13 40.621 0.03 . . . . . . . 275 ILE CB . 50695 1 76 . 1 . 1 17 17 ILE N N 15 118.574 0.00 . . . . . . . 275 ILE N . 50695 1 77 . 1 . 1 18 18 GLY H H 1 8.392 0.92 . . . . . . . 276 GLY H . 50695 1 78 . 1 . 1 18 18 GLY C C 13 172.155 0.00 . . . . . . . 276 GLY CO . 50695 1 79 . 1 . 1 18 18 GLY CA C 13 44.756 0.01 . . . . . . . 276 GLY CA . 50695 1 80 . 1 . 1 18 18 GLY N N 15 110.247 0.80 . . . . . . . 276 GLY N . 50695 1 81 . 1 . 1 19 19 THR H H 1 7.470 0.00 . . . . . . . 277 THR H . 50695 1 82 . 1 . 1 19 19 THR CA C 13 58.363 0.00 . . . . . . . 277 THR CA . 50695 1 83 . 1 . 1 19 19 THR CB C 13 69.837 0.00 . . . . . . . 277 THR CB . 50695 1 84 . 1 . 1 19 19 THR N N 15 109.436 0.01 . . . . . . . 277 THR N . 50695 1 85 . 1 . 1 21 21 LYS H H 1 7.646 0.00 . . . . . . . 279 LYS H . 50695 1 86 . 1 . 1 21 21 LYS C C 13 177.939 0.00 . . . . . . . 279 LYS CO . 50695 1 87 . 1 . 1 21 21 LYS CA C 13 57.736 0.00 . . . . . . . 279 LYS CA . 50695 1 88 . 1 . 1 21 21 LYS CB C 13 30.656 0.00 . . . . . . . 279 LYS CB . 50695 1 89 . 1 . 1 21 21 LYS N N 15 118.478 0.00 . . . . . . . 279 LYS N . 50695 1 90 . 1 . 1 22 22 ASP H H 1 7.575 0.09 . . . . . . . 280 ASP H . 50695 1 91 . 1 . 1 22 22 ASP C C 13 177.459 0.00 . . . . . . . 280 ASP CO . 50695 1 92 . 1 . 1 22 22 ASP CA C 13 55.660 0.00 . . . . . . . 280 ASP CA . 50695 1 93 . 1 . 1 22 22 ASP CB C 13 41.394 0.00 . . . . . . . 280 ASP CB . 50695 1 94 . 1 . 1 22 22 ASP N N 15 119.124 0.80 . . . . . . . 280 ASP N . 50695 1 95 . 1 . 1 23 23 VAL H H 1 7.668 0.20 . . . . . . . 281 VAL H . 50695 1 96 . 1 . 1 23 23 VAL C C 13 176.462 0.00 . . . . . . . 281 VAL CO . 50695 1 97 . 1 . 1 23 23 VAL CA C 13 66.325 0.00 . . . . . . . 281 VAL CA . 50695 1 98 . 1 . 1 23 23 VAL CB C 13 30.575 0.04 . . . . . . . 281 VAL CB . 50695 1 99 . 1 . 1 23 23 VAL N N 15 121.188 1.11 . . . . . . . 281 VAL N . 50695 1 100 . 1 . 1 24 24 ALA H H 1 7.869 0.00 . . . . . . . 282 ALA H . 50695 1 101 . 1 . 1 24 24 ALA CA C 13 55.657 0.00 . . . . . . . 282 ALA CA . 50695 1 102 . 1 . 1 24 24 ALA CB C 13 17.086 0.00 . . . . . . . 282 ALA CB . 50695 1 103 . 1 . 1 24 24 ALA N N 15 122.298 0.01 . . . . . . . 282 ALA N . 50695 1 104 . 1 . 1 25 25 SER H H 1 7.522 0.00 . . . . . . . 283 SER H . 50695 1 105 . 1 . 1 25 25 SER C C 13 177.418 0.00 . . . . . . . 283 SER CO . 50695 1 106 . 1 . 1 25 25 SER CA C 13 60.297 0.00 . . . . . . . 283 SER CA . 50695 1 107 . 1 . 1 25 25 SER CB C 13 62.448 0.00 . . . . . . . 283 SER CB . 50695 1 108 . 1 . 1 25 25 SER N N 15 124.762 0.01 . . . . . . . 283 SER N . 50695 1 109 . 1 . 1 26 26 ALA H H 1 7.522 0.00 . . . . . . . 284 ALA H . 50695 1 110 . 1 . 1 26 26 ALA CA C 13 55.382 0.00 . . . . . . . 284 ALA CA . 50695 1 111 . 1 . 1 26 26 ALA CB C 13 16.063 0.00 . . . . . . . 284 ALA CB . 50695 1 112 . 1 . 1 26 26 ALA N N 15 124.761 0.01 . . . . . . . 284 ALA N . 50695 1 113 . 1 . 1 27 27 LEU H H 1 8.209 0.00 . . . . . . . 285 LEU H . 50695 1 114 . 1 . 1 27 27 LEU C C 13 181.373 0.00 . . . . . . . 285 LEU CO . 50695 1 115 . 1 . 1 27 27 LEU CA C 13 57.461 0.00 . . . . . . . 285 LEU CA . 50695 1 116 . 1 . 1 27 27 LEU CB C 13 40.291 0.00 . . . . . . . 285 LEU CB . 50695 1 117 . 1 . 1 27 27 LEU N N 15 122.919 0.01 . . . . . . . 285 LEU N . 50695 1 118 . 1 . 1 28 28 ALA H H 1 7.775 0.43 . . . . . . . 286 ALA H . 50695 1 119 . 1 . 1 28 28 ALA C C 13 178.889 0.00 . . . . . . . 286 ALA CO . 50695 1 120 . 1 . 1 28 28 ALA CA C 13 54.412 0.00 . . . . . . . 286 ALA CA . 50695 1 121 . 1 . 1 28 28 ALA CB C 13 17.642 0.01 . . . . . . . 286 ALA CB . 50695 1 122 . 1 . 1 28 28 ALA N N 15 122.942 0.00 . . . . . . . 286 ALA N . 50695 1 123 . 1 . 1 29 29 ASN H H 1 7.489 0.15 . . . . . . . 287 ASN H . 50695 1 124 . 1 . 1 29 29 ASN C C 13 174.495 0.00 . . . . . . . 287 ASN CO . 50695 1 125 . 1 . 1 29 29 ASN CA C 13 53.748 0.02 . . . . . . . 287 ASN CA . 50695 1 126 . 1 . 1 29 29 ASN CB C 13 40.770 0.05 . . . . . . . 287 ASN CB . 50695 1 127 . 1 . 1 29 29 ASN N N 15 113.912 0.00 . . . . . . . 287 ASN N . 50695 1 128 . 1 . 1 30 30 GLY H H 1 7.833 0.20 . . . . . . . 288 GLY H . 50695 1 129 . 1 . 1 30 30 GLY C C 13 175.080 0.00 . . . . . . . 288 GLY CO . 50695 1 130 . 1 . 1 30 30 GLY CA C 13 45.778 0.00 . . . . . . . 288 GLY CA . 50695 1 131 . 1 . 1 30 30 GLY N N 15 105.267 0.00 . . . . . . . 288 GLY N . 50695 1 132 . 1 . 1 31 31 ALA H H 1 8.475 0.45 . . . . . . . 289 ALA H . 50695 1 133 . 1 . 1 31 31 ALA C C 13 177.736 0.00 . . . . . . . 289 ALA CO . 50695 1 134 . 1 . 1 31 31 ALA CA C 13 53.328 0.00 . . . . . . . 289 ALA CA . 50695 1 135 . 1 . 1 31 31 ALA CB C 13 19.114 0.02 . . . . . . . 289 ALA CB . 50695 1 136 . 1 . 1 31 31 ALA N N 15 120.480 0.07 . . . . . . . 289 ALA N . 50695 1 137 . 1 . 1 32 32 GLU H H 1 8.211 0.71 . . . . . . . 290 GLU H . 50695 1 138 . 1 . 1 32 32 GLU C C 13 175.014 0.00 . . . . . . . 290 GLU CO . 50695 1 139 . 1 . 1 32 32 GLU CA C 13 55.703 0.00 . . . . . . . 290 GLU CA . 50695 1 140 . 1 . 1 32 32 GLU CB C 13 29.680 0.01 . . . . . . . 290 GLU CB . 50695 1 141 . 1 . 1 32 32 GLU N N 15 120.554 0.00 . . . . . . . 290 GLU N . 50695 1 142 . 1 . 1 33 33 GLY H H 1 8.480 0.98 . . . . . . . 291 GLY H . 50695 1 143 . 1 . 1 33 33 GLY C C 13 171.770 0.00 . . . . . . . 291 GLY CO . 50695 1 144 . 1 . 1 33 33 GLY CA C 13 44.156 0.00 . . . . . . . 291 GLY CA . 50695 1 145 . 1 . 1 33 33 GLY N N 15 101.453 0.00 . . . . . . . 291 GLY N . 50695 1 146 . 1 . 1 34 34 VAL H H 1 8.818 0.64 . . . . . . . 292 VAL H . 50695 1 147 . 1 . 1 34 34 VAL C C 13 175.779 0.00 . . . . . . . 292 VAL CO . 50695 1 148 . 1 . 1 34 34 VAL CA C 13 60.304 0.00 . . . . . . . 292 VAL CA . 50695 1 149 . 1 . 1 34 34 VAL CB C 13 33.679 0.01 . . . . . . . 292 VAL CB . 50695 1 150 . 1 . 1 34 34 VAL N N 15 121.615 2.25 . . . . . . . 292 VAL N . 50695 1 151 . 1 . 1 35 35 GLY H H 1 7.502 0.67 . . . . . . . 293 GLY H . 50695 1 152 . 1 . 1 35 35 GLY C C 13 173.372 0.00 . . . . . . . 293 GLY CO . 50695 1 153 . 1 . 1 35 35 GLY CA C 13 45.420 0.00 . . . . . . . 293 GLY CA . 50695 1 154 . 1 . 1 35 35 GLY N N 15 118.524 0.86 . . . . . . . 293 GLY N . 50695 1 155 . 1 . 1 36 36 LEU H H 1 7.714 0.89 . . . . . . . 294 LEU H . 50695 1 156 . 1 . 1 36 36 LEU C C 13 172.316 0.00 . . . . . . . 294 LEU CO . 50695 1 157 . 1 . 1 36 36 LEU CA C 13 56.119 0.01 . . . . . . . 294 LEU CA . 50695 1 158 . 1 . 1 36 36 LEU CB C 13 41.330 0.04 . . . . . . . 294 LEU CB . 50695 1 159 . 1 . 1 36 36 LEU N N 15 117.625 0.00 . . . . . . . 294 LEU N . 50695 1 160 . 1 . 1 37 37 PHE H H 1 8.510 0.09 . . . . . . . 295 PHE H . 50695 1 161 . 1 . 1 37 37 PHE C C 13 174.874 0.00 . . . . . . . 295 PHE CO . 50695 1 162 . 1 . 1 37 37 PHE CA C 13 52.555 0.00 . . . . . . . 295 PHE CA . 50695 1 163 . 1 . 1 37 37 PHE CB C 13 36.422 0.03 . . . . . . . 295 PHE CB . 50695 1 164 . 1 . 1 37 37 PHE N N 15 127.736 2.84 . . . . . . . 295 PHE N . 50695 1 165 . 1 . 1 38 38 ARG H H 1 8.419 0.00 . . . . . . . 296 ARG H . 50695 1 166 . 1 . 1 38 38 ARG CA C 13 56.405 0.00 . . . . . . . 296 ARG CA . 50695 1 167 . 1 . 1 38 38 ARG CB C 13 30.229 0.00 . . . . . . . 296 ARG CB . 50695 1 168 . 1 . 1 38 38 ARG N N 15 124.882 0.01 . . . . . . . 296 ARG N . 50695 1 169 . 1 . 1 39 39 THR H H 1 7.882 0.00 . . . . . . . 297 THR H . 50695 1 170 . 1 . 1 39 39 THR C C 13 175.493 0.00 . . . . . . . 297 THR CO . 50695 1 171 . 1 . 1 39 39 THR CA C 13 61.636 0.00 . . . . . . . 297 THR CA . 50695 1 172 . 1 . 1 39 39 THR CB C 13 68.946 0.00 . . . . . . . 297 THR CB . 50695 1 173 . 1 . 1 39 39 THR N N 15 120.199 0.01 . . . . . . . 297 THR N . 50695 1 174 . 1 . 1 40 40 GLU H H 1 8.608 0.73 . . . . . . . 298 GLU H . 50695 1 175 . 1 . 1 40 40 GLU C C 13 179.331 0.00 . . . . . . . 298 GLU CO . 50695 1 176 . 1 . 1 40 40 GLU CA C 13 61.906 0.02 . . . . . . . 298 GLU CA . 50695 1 177 . 1 . 1 40 40 GLU CB C 13 29.006 0.02 . . . . . . . 298 GLU CB . 50695 1 178 . 1 . 1 40 40 GLU N N 15 119.673 0.54 . . . . . . . 298 GLU N . 50695 1 179 . 1 . 1 41 41 PHE H H 1 7.892 1.44 . . . . . . . 299 PHE H . 50695 1 180 . 1 . 1 41 41 PHE C C 13 176.772 0.00 . . . . . . . 299 PHE CO . 50695 1 181 . 1 . 1 41 41 PHE CA C 13 59.475 0.00 . . . . . . . 299 PHE CA . 50695 1 182 . 1 . 1 41 41 PHE CB C 13 36.451 0.03 . . . . . . . 299 PHE CB . 50695 1 183 . 1 . 1 41 41 PHE N N 15 120.493 1.37 . . . . . . . 299 PHE N . 50695 1 184 . 1 . 1 42 42 LEU H H 1 6.451 0.00 . . . . . . . 300 LEU H . 50695 1 185 . 1 . 1 42 42 LEU CA C 13 56.077 0.00 . . . . . . . 300 LEU CA . 50695 1 186 . 1 . 1 42 42 LEU CB C 13 41.576 0.00 . . . . . . . 300 LEU CB . 50695 1 187 . 1 . 1 42 42 LEU N N 15 121.861 0.01 . . . . . . . 300 LEU N . 50695 1 188 . 1 . 1 43 43 TYR H H 1 7.153 0.00 . . . . . . . 301 TYR H . 50695 1 189 . 1 . 1 43 43 TYR C C 13 176.974 0.00 . . . . . . . 301 TYR CO . 50695 1 190 . 1 . 1 43 43 TYR CA C 13 58.621 0.00 . . . . . . . 301 TYR CA . 50695 1 191 . 1 . 1 43 43 TYR CB C 13 39.031 0.00 . . . . . . . 301 TYR CB . 50695 1 192 . 1 . 1 43 43 TYR N N 15 117.924 0.00 . . . . . . . 301 TYR N . 50695 1 193 . 1 . 1 44 44 MET H H 1 7.989 0.84 . . . . . . . 302 MET H . 50695 1 194 . 1 . 1 44 44 MET C C 13 175.565 0.00 . . . . . . . 302 MET CO . 50695 1 195 . 1 . 1 44 44 MET CA C 13 54.780 0.00 . . . . . . . 302 MET CA . 50695 1 196 . 1 . 1 44 44 MET CB C 13 33.534 0.01 . . . . . . . 302 MET CB . 50695 1 197 . 1 . 1 44 44 MET N N 15 117.661 0.25 . . . . . . . 302 MET N . 50695 1 198 . 1 . 1 45 45 ASP H H 1 8.155 0.67 . . . . . . . 303 ASP H . 50695 1 199 . 1 . 1 45 45 ASP C C 13 174.410 0.00 . . . . . . . 303 ASP CO . 50695 1 200 . 1 . 1 45 45 ASP CA C 13 55.048 0.09 . . . . . . . 303 ASP CA . 50695 1 201 . 1 . 1 45 45 ASP CB C 13 38.792 0.03 . . . . . . . 303 ASP CB . 50695 1 202 . 1 . 1 45 45 ASP N N 15 114.922 2.46 . . . . . . . 303 ASP N . 50695 1 203 . 1 . 1 46 46 ARG H H 1 7.486 0.00 . . . . . . . 304 ARG H . 50695 1 204 . 1 . 1 46 46 ARG CA C 13 54.258 0.00 . . . . . . . 304 ARG CA . 50695 1 205 . 1 . 1 46 46 ARG CB C 13 31.384 0.00 . . . . . . . 304 ARG CB . 50695 1 206 . 1 . 1 46 46 ARG N N 15 112.462 0.00 . . . . . . . 304 ARG N . 50695 1 207 . 1 . 1 47 47 ASN H H 1 6.932 0.00 . . . . . . . 305 ASN H . 50695 1 208 . 1 . 1 47 47 ASN C C 13 173.976 0.00 . . . . . . . 305 ASN CO . 50695 1 209 . 1 . 1 47 47 ASN CA C 13 52.648 0.00 . . . . . . . 305 ASN CA . 50695 1 210 . 1 . 1 47 47 ASN CB C 13 39.181 0.00 . . . . . . . 305 ASN CB . 50695 1 211 . 1 . 1 47 47 ASN N N 15 112.125 0.00 . . . . . . . 305 ASN N . 50695 1 212 . 1 . 1 48 48 SER H H 1 7.519 0.59 . . . . . . . 306 SER H . 50695 1 213 . 1 . 1 48 48 SER C C 13 171.836 0.00 . . . . . . . 306 SER CO . 50695 1 214 . 1 . 1 48 48 SER CA C 13 55.956 0.02 . . . . . . . 306 SER CA . 50695 1 215 . 1 . 1 48 48 SER CB C 13 64.827 0.02 . . . . . . . 306 SER CB . 50695 1 216 . 1 . 1 48 48 SER N N 15 112.106 0.00 . . . . . . . 306 SER N . 50695 1 217 . 1 . 1 49 49 LEU H H 1 8.105 0.00 . . . . . . . 307 LEU H . 50695 1 218 . 1 . 1 49 49 LEU CA C 13 53.186 0.00 . . . . . . . 307 LEU CA . 50695 1 219 . 1 . 1 49 49 LEU CB C 13 40.603 0.00 . . . . . . . 307 LEU CB . 50695 1 220 . 1 . 1 49 49 LEU N N 15 121.569 0.01 . . . . . . . 307 LEU N . 50695 1 221 . 1 . 1 50 50 PRO C C 13 177.565 0.00 . . . . . . . 308 PRO CO . 50695 1 222 . 1 . 1 50 50 PRO CA C 13 61.797 0.00 . . . . . . . 308 PRO CA . 50695 1 223 . 1 . 1 50 50 PRO CB C 13 29.824 0.00 . . . . . . . 308 PRO CB . 50695 1 224 . 1 . 1 50 50 PRO N N 15 122.435 0.01 . . . . . . . 308 PRO N . 50695 1 225 . 1 . 1 51 51 SER H H 1 8.958 0.08 . . . . . . . 309 SER H . 50695 1 226 . 1 . 1 51 51 SER C C 13 174.563 0.00 . . . . . . . 309 SER CO . 50695 1 227 . 1 . 1 51 51 SER CA C 13 57.104 0.00 . . . . . . . 309 SER CA . 50695 1 228 . 1 . 1 51 51 SER CB C 13 64.938 0.02 . . . . . . . 309 SER CB . 50695 1 229 . 1 . 1 51 51 SER N N 15 122.454 0.02 . . . . . . . 309 SER N . 50695 1 230 . 1 . 1 52 52 GLU H H 1 8.779 0.31 . . . . . . . 310 GLU H . 50695 1 231 . 1 . 1 52 52 GLU C C 13 178.418 0.00 . . . . . . . 310 GLU CO . 50695 1 232 . 1 . 1 52 52 GLU CA C 13 59.870 0.01 . . . . . . . 310 GLU CA . 50695 1 233 . 1 . 1 52 52 GLU CB C 13 29.893 0.00 . . . . . . . 310 GLU CB . 50695 1 234 . 1 . 1 52 52 GLU N N 15 120.487 2.42 . . . . . . . 310 GLU N . 50695 1 235 . 1 . 1 53 53 GLU H H 1 8.020 0.30 . . . . . . . 311 GLU H . 50695 1 236 . 1 . 1 53 53 GLU C C 13 178.346 0.00 . . . . . . . 311 GLU CO . 50695 1 237 . 1 . 1 53 53 GLU CA C 13 59.507 0.05 . . . . . . . 311 GLU CA . 50695 1 238 . 1 . 1 53 53 GLU CB C 13 28.429 0.00 . . . . . . . 311 GLU CB . 50695 1 239 . 1 . 1 53 53 GLU N N 15 119.009 1.22 . . . . . . . 311 GLU N . 50695 1 240 . 1 . 1 54 54 GLU H H 1 7.747 0.03 . . . . . . . 312 GLU H . 50695 1 241 . 1 . 1 54 54 GLU C C 13 179.819 0.00 . . . . . . . 312 GLU CO . 50695 1 242 . 1 . 1 54 54 GLU CA C 13 58.812 0.02 . . . . . . . 312 GLU CA . 50695 1 243 . 1 . 1 54 54 GLU CB C 13 28.902 0.02 . . . . . . . 312 GLU CB . 50695 1 244 . 1 . 1 54 54 GLU N N 15 118.435 1.59 . . . . . . . 312 GLU N . 50695 1 245 . 1 . 1 55 55 GLN H H 1 7.720 0.00 . . . . . . . 313 GLN H . 50695 1 246 . 1 . 1 55 55 GLN CA C 13 58.867 0.00 . . . . . . . 313 GLN CA . 50695 1 247 . 1 . 1 55 55 GLN CB C 13 28.746 0.00 . . . . . . . 313 GLN CB . 50695 1 248 . 1 . 1 55 55 GLN N N 15 116.843 0.01 . . . . . . . 313 GLN N . 50695 1 249 . 1 . 1 56 56 PHE H H 1 8.176 0.00 . . . . . . . 314 PHE H . 50695 1 250 . 1 . 1 56 56 PHE C C 13 175.853 0.00 . . . . . . . 314 PHE CO . 50695 1 251 . 1 . 1 56 56 PHE CA C 13 60.550 0.00 . . . . . . . 314 PHE CA . 50695 1 252 . 1 . 1 56 56 PHE CB C 13 38.626 0.00 . . . . . . . 314 PHE CB . 50695 1 253 . 1 . 1 56 56 PHE N N 15 116.959 0.01 . . . . . . . 314 PHE N . 50695 1 254 . 1 . 1 57 57 GLU H H 1 7.608 0.57 . . . . . . . 315 GLU H . 50695 1 255 . 1 . 1 57 57 GLU C C 13 179.433 0.00 . . . . . . . 315 GLU CO . 50695 1 256 . 1 . 1 57 57 GLU CA C 13 59.255 0.01 . . . . . . . 315 GLU CA . 50695 1 257 . 1 . 1 57 57 GLU CB C 13 28.462 0.02 . . . . . . . 315 GLU CB . 50695 1 258 . 1 . 1 57 57 GLU N N 15 119.539 2.57 . . . . . . . 315 GLU N . 50695 1 259 . 1 . 1 58 58 ALA H H 1 7.041 0.00 . . . . . . . 316 ALA H . 50695 1 260 . 1 . 1 58 58 ALA CA C 13 54.620 0.00 . . . . . . . 316 ALA CA . 50695 1 261 . 1 . 1 58 58 ALA CB C 13 18.222 0.00 . . . . . . . 316 ALA CB . 50695 1 262 . 1 . 1 58 58 ALA N N 15 122.102 0.00 . . . . . . . 316 ALA N . 50695 1 263 . 1 . 1 59 59 TYR H H 1 9.145 0.00 . . . . . . . 317 TYR H . 50695 1 264 . 1 . 1 59 59 TYR C C 13 178.354 0.00 . . . . . . . 317 TYR CO . 50695 1 265 . 1 . 1 59 59 TYR CA C 13 57.670 0.00 . . . . . . . 317 TYR CA . 50695 1 266 . 1 . 1 59 59 TYR CB C 13 36.337 0.00 . . . . . . . 317 TYR CB . 50695 1 267 . 1 . 1 59 59 TYR N N 15 119.232 0.00 . . . . . . . 317 TYR N . 50695 1 268 . 1 . 1 60 60 LYS H H 1 8.295 0.85 . . . . . . . 318 LYS H . 50695 1 269 . 1 . 1 60 60 LYS C C 13 176.945 0.00 . . . . . . . 318 LYS CO . 50695 1 270 . 1 . 1 60 60 LYS CA C 13 59.652 0.01 . . . . . . . 318 LYS CA . 50695 1 271 . 1 . 1 60 60 LYS CB C 13 30.983 0.03 . . . . . . . 318 LYS CB . 50695 1 272 . 1 . 1 60 60 LYS N N 15 118.627 0.60 . . . . . . . 318 LYS N . 50695 1 273 . 1 . 1 61 61 GLU H H 1 7.253 0.19 . . . . . . . 319 GLU H . 50695 1 274 . 1 . 1 61 61 GLU C C 13 178.589 0.00 . . . . . . . 319 GLU CO . 50695 1 275 . 1 . 1 61 61 GLU CA C 13 59.189 0.05 . . . . . . . 319 GLU CA . 50695 1 276 . 1 . 1 61 61 GLU CB C 13 28.349 0.11 . . . . . . . 319 GLU CB . 50695 1 277 . 1 . 1 61 61 GLU N N 15 117.251 0.78 . . . . . . . 319 GLU N . 50695 1 278 . 1 . 1 62 62 VAL H H 1 7.650 0.59 . . . . . . . 320 VAL H . 50695 1 279 . 1 . 1 62 62 VAL C C 13 177.086 0.00 . . . . . . . 320 VAL CO . 50695 1 280 . 1 . 1 62 62 VAL CA C 13 66.451 0.01 . . . . . . . 320 VAL CA . 50695 1 281 . 1 . 1 62 62 VAL CB C 13 30.762 0.21 . . . . . . . 320 VAL CB . 50695 1 282 . 1 . 1 62 62 VAL N N 15 117.092 0.64 . . . . . . . 320 VAL N . 50695 1 283 . 1 . 1 63 63 VAL H H 1 8.623 0.38 . . . . . . . 321 VAL H . 50695 1 284 . 1 . 1 63 63 VAL C C 13 179.368 0.00 . . . . . . . 321 VAL CO . 50695 1 285 . 1 . 1 63 63 VAL CA C 13 66.547 0.01 . . . . . . . 321 VAL CA . 50695 1 286 . 1 . 1 63 63 VAL CB C 13 31.149 0.02 . . . . . . . 321 VAL CB . 50695 1 287 . 1 . 1 63 63 VAL N N 15 118.724 1.00 . . . . . . . 321 VAL N . 50695 1 288 . 1 . 1 64 64 GLU H H 1 8.496 0.51 . . . . . . . 322 GLU H . 50695 1 289 . 1 . 1 64 64 GLU C C 13 180.719 0.00 . . . . . . . 322 GLU CO . 50695 1 290 . 1 . 1 64 64 GLU CA C 13 59.502 0.01 . . . . . . . 322 GLU CA . 50695 1 291 . 1 . 1 64 64 GLU CB C 13 29.130 0.15 . . . . . . . 322 GLU CB . 50695 1 292 . 1 . 1 64 64 GLU N N 15 120.256 0.53 . . . . . . . 322 GLU N . 50695 1 293 . 1 . 1 65 65 LYS H H 1 7.802 0.18 . . . . . . . 323 LYS H . 50695 1 294 . 1 . 1 65 65 LYS C C 13 178.364 0.00 . . . . . . . 323 LYS CO . 50695 1 295 . 1 . 1 65 65 LYS CA C 13 58.658 0.01 . . . . . . . 323 LYS CA . 50695 1 296 . 1 . 1 65 65 LYS CB C 13 32.079 0.08 . . . . . . . 323 LYS CB . 50695 1 297 . 1 . 1 65 65 LYS N N 15 117.568 3.23 . . . . . . . 323 LYS N . 50695 1 298 . 1 . 1 66 66 MET H H 1 7.777 0.16 . . . . . . . 324 MET H . 50695 1 299 . 1 . 1 66 66 MET C C 13 180.599 0.00 . . . . . . . 324 MET CO . 50695 1 300 . 1 . 1 66 66 MET CA C 13 54.159 0.01 . . . . . . . 324 MET CA . 50695 1 301 . 1 . 1 66 66 MET CB C 13 29.858 0.01 . . . . . . . 324 MET CB . 50695 1 302 . 1 . 1 66 66 MET N N 15 112.634 1.70 . . . . . . . 324 MET N . 50695 1 303 . 1 . 1 67 67 GLY H H 1 8.172 0.24 . . . . . . . 325 GLY H . 50695 1 304 . 1 . 1 67 67 GLY C C 13 175.082 0.00 . . . . . . . 325 GLY CO . 50695 1 305 . 1 . 1 67 67 GLY CA C 13 48.112 0.00 . . . . . . . 325 GLY CA . 50695 1 306 . 1 . 1 67 67 GLY N N 15 109.955 0.97 . . . . . . . 325 GLY N . 50695 1 307 . 1 . 1 68 68 GLY H H 1 8.073 0.58 . . . . . . . 326 GLY H . 50695 1 308 . 1 . 1 68 68 GLY C C 13 174.993 0.00 . . . . . . . 326 GLY CO . 50695 1 309 . 1 . 1 68 68 GLY CA C 13 44.730 0.00 . . . . . . . 326 GLY CA . 50695 1 310 . 1 . 1 68 68 GLY N N 15 108.972 0.00 . . . . . . . 326 GLY N . 50695 1 311 . 1 . 1 69 69 ARG H H 1 7.384 0.00 . . . . . . . 327 ARG H . 50695 1 312 . 1 . 1 69 69 ARG CA C 13 54.272 0.00 . . . . . . . 327 ARG CA . 50695 1 313 . 1 . 1 69 69 ARG CB C 13 28.639 0.00 . . . . . . . 327 ARG CB . 50695 1 314 . 1 . 1 69 69 ARG N N 15 122.802 0.00 . . . . . . . 327 ARG N . 50695 1 315 . 1 . 1 70 70 PRO C C 13 176.429 0.00 . . . . . . . 328 PRO CO . 50695 1 316 . 1 . 1 70 70 PRO CA C 13 62.803 0.00 . . . . . . . 328 PRO CA . 50695 1 317 . 1 . 1 70 70 PRO N N 15 123.216 0.01 . . . . . . . 328 PRO N . 50695 1 318 . 1 . 1 71 71 VAL H H 1 8.764 0.02 . . . . . . . 329 VAL H . 50695 1 319 . 1 . 1 71 71 VAL C C 13 173.981 0.00 . . . . . . . 329 VAL CO . 50695 1 320 . 1 . 1 71 71 VAL CA C 13 61.062 0.01 . . . . . . . 329 VAL CA . 50695 1 321 . 1 . 1 71 71 VAL CB C 13 32.997 0.02 . . . . . . . 329 VAL CB . 50695 1 322 . 1 . 1 71 71 VAL N N 15 124.731 1.48 . . . . . . . 329 VAL N . 50695 1 323 . 1 . 1 72 72 THR H H 1 8.903 0.15 . . . . . . . 330 THR H . 50695 1 324 . 1 . 1 72 72 THR C C 13 173.081 0.00 . . . . . . . 330 THR CO . 50695 1 325 . 1 . 1 72 72 THR CA C 13 61.361 0.07 . . . . . . . 330 THR CA . 50695 1 326 . 1 . 1 72 72 THR CB C 13 67.419 0.03 . . . . . . . 330 THR CB . 50695 1 327 . 1 . 1 72 72 THR N N 15 127.396 1.18 . . . . . . . 330 THR N . 50695 1 328 . 1 . 1 73 73 ILE H H 1 8.489 0.57 . . . . . . . 331 ILE H . 50695 1 329 . 1 . 1 73 73 ILE C C 13 174.048 0.00 . . . . . . . 331 ILE CO . 50695 1 330 . 1 . 1 73 73 ILE CA C 13 62.023 0.04 . . . . . . . 331 ILE CA . 50695 1 331 . 1 . 1 73 73 ILE CB C 13 37.709 0.04 . . . . . . . 331 ILE CB . 50695 1 332 . 1 . 1 73 73 ILE N N 15 128.945 0.37 . . . . . . . 331 ILE N . 50695 1 333 . 1 . 1 74 74 ARG H H 1 7.923 0.00 . . . . . . . 332 ARG H . 50695 1 334 . 1 . 1 74 74 ARG CA C 13 53.812 0.00 . . . . . . . 332 ARG CA . 50695 1 335 . 1 . 1 74 74 ARG CB C 13 31.745 0.00 . . . . . . . 332 ARG CB . 50695 1 336 . 1 . 1 74 74 ARG N N 15 129.305 0.01 . . . . . . . 332 ARG N . 50695 1 337 . 1 . 1 77 77 ASP H H 1 8.144 0.00 . . . . . . . 335 ASP H . 50695 1 338 . 1 . 1 77 77 ASP C C 13 178.792 0.00 . . . . . . . 335 ASP CO . 50695 1 339 . 1 . 1 77 77 ASP CA C 13 54.452 0.00 . . . . . . . 335 ASP CA . 50695 1 340 . 1 . 1 77 77 ASP CB C 13 36.241 0.00 . . . . . . . 335 ASP CB . 50695 1 341 . 1 . 1 77 77 ASP N N 15 118.930 0.00 . . . . . . . 335 ASP N . 50695 1 342 . 1 . 1 78 78 ILE H H 1 8.134 0.02 . . . . . . . 336 ILE H . 50695 1 343 . 1 . 1 78 78 ILE CA C 13 61.890 0.00 . . . . . . . 336 ILE CA . 50695 1 344 . 1 . 1 78 78 ILE CB C 13 36.200 0.00 . . . . . . . 336 ILE CB . 50695 1 345 . 1 . 1 78 78 ILE N N 15 118.902 0.05 . . . . . . . 336 ILE N . 50695 1 346 . 1 . 1 81 81 ASP H H 1 7.571 0.00 . . . . . . . 339 ASP H . 50695 1 347 . 1 . 1 81 81 ASP C C 13 175.995 0.00 . . . . . . . 339 ASP CO . 50695 1 348 . 1 . 1 81 81 ASP CA C 13 54.184 0.00 . . . . . . . 339 ASP CA . 50695 1 349 . 1 . 1 81 81 ASP CB C 13 39.619 0.00 . . . . . . . 339 ASP CB . 50695 1 350 . 1 . 1 81 81 ASP N N 15 119.414 0.01 . . . . . . . 339 ASP N . 50695 1 351 . 1 . 1 82 82 LYS H H 1 7.807 0.29 . . . . . . . 340 LYS H . 50695 1 352 . 1 . 1 82 82 LYS C C 13 175.356 0.00 . . . . . . . 340 LYS CO . 50695 1 353 . 1 . 1 82 82 LYS CA C 13 53.906 0.02 . . . . . . . 340 LYS CA . 50695 1 354 . 1 . 1 82 82 LYS CB C 13 31.804 0.00 . . . . . . . 340 LYS CB . 50695 1 355 . 1 . 1 82 82 LYS N N 15 119.864 0.54 . . . . . . . 340 LYS N . 50695 1 356 . 1 . 1 83 83 GLU H H 1 8.120 0.04 . . . . . . . 341 GLU H . 50695 1 357 . 1 . 1 83 83 GLU C C 13 175.707 0.00 . . . . . . . 341 GLU CO . 50695 1 358 . 1 . 1 83 83 GLU CA C 13 56.539 0.00 . . . . . . . 341 GLU CA . 50695 1 359 . 1 . 1 83 83 GLU CB C 13 28.620 0.01 . . . . . . . 341 GLU CB . 50695 1 360 . 1 . 1 83 83 GLU N N 15 122.892 2.37 . . . . . . . 341 GLU N . 50695 1 361 . 1 . 1 84 84 LEU H H 1 8.079 0.00 . . . . . . . 342 LEU H . 50695 1 362 . 1 . 1 84 84 LEU CA C 13 51.347 0.00 . . . . . . . 342 LEU CA . 50695 1 363 . 1 . 1 84 84 LEU CB C 13 41.235 0.00 . . . . . . . 342 LEU CB . 50695 1 364 . 1 . 1 84 84 LEU N N 15 125.253 0.05 . . . . . . . 342 LEU N . 50695 1 365 . 1 . 1 85 85 PRO C C 13 177.201 0.00 . . . . . . . 343 PRO CO . 50695 1 366 . 1 . 1 85 85 PRO CA C 13 65.005 0.00 . . . . . . . 343 PRO CA . 50695 1 367 . 1 . 1 85 85 PRO CB C 13 31.191 0.00 . . . . . . . 343 PRO CB . 50695 1 368 . 1 . 1 86 86 TYR H H 1 6.772 0.16 . . . . . . . 344 TYR H . 50695 1 369 . 1 . 1 86 86 TYR C C 13 175.034 0.00 . . . . . . . 344 TYR CO . 50695 1 370 . 1 . 1 86 86 TYR CA C 13 55.925 0.01 . . . . . . . 344 TYR CA . 50695 1 371 . 1 . 1 86 86 TYR CB C 13 36.703 0.00 . . . . . . . 344 TYR CB . 50695 1 372 . 1 . 1 86 86 TYR N N 15 110.783 0.00 . . . . . . . 344 TYR N . 50695 1 373 . 1 . 1 87 87 LEU H H 1 6.930 0.00 . . . . . . . 345 LEU H . 50695 1 374 . 1 . 1 87 87 LEU CA C 13 53.720 0.00 . . . . . . . 345 LEU CA . 50695 1 375 . 1 . 1 87 87 LEU CB C 13 43.740 0.00 . . . . . . . 345 LEU CB . 50695 1 376 . 1 . 1 87 87 LEU N N 15 123.411 0.01 . . . . . . . 345 LEU N . 50695 1 377 . 1 . 1 88 88 ASP H H 1 8.300 0.00 . . . . . . . 346 ASP H . 50695 1 378 . 1 . 1 88 88 ASP C C 13 175.427 0.00 . . . . . . . 346 ASP CO . 50695 1 379 . 1 . 1 88 88 ASP CA C 13 54.041 0.00 . . . . . . . 346 ASP CA . 50695 1 380 . 1 . 1 88 88 ASP CB C 13 39.196 0.00 . . . . . . . 346 ASP CB . 50695 1 381 . 1 . 1 88 88 ASP N N 15 122.161 0.00 . . . . . . . 346 ASP N . 50695 1 382 . 1 . 1 89 89 MET H H 1 8.300 0.00 . . . . . . . 347 MET H . 50695 1 383 . 1 . 1 89 89 MET CA C 13 52.582 0.00 . . . . . . . 347 MET CA . 50695 1 384 . 1 . 1 89 89 MET CB C 13 31.793 0.00 . . . . . . . 347 MET CB . 50695 1 385 . 1 . 1 89 89 MET N N 15 122.169 0.01 . . . . . . . 347 MET N . 50695 1 386 . 1 . 1 92 92 GLU H H 1 8.232 0.00 . . . . . . . 350 GLU H . 50695 1 387 . 1 . 1 92 92 GLU C C 13 176.804 0.00 . . . . . . . 350 GLU CO . 50695 1 388 . 1 . 1 92 92 GLU CA C 13 55.662 0.00 . . . . . . . 350 GLU CA . 50695 1 389 . 1 . 1 92 92 GLU CB C 13 30.610 0.00 . . . . . . . 350 GLU CB . 50695 1 390 . 1 . 1 92 92 GLU N N 15 123.763 0.00 . . . . . . . 350 GLU N . 50695 1 391 . 1 . 1 93 93 MET H H 1 8.232 0.00 . . . . . . . 351 MET H . 50695 1 392 . 1 . 1 93 93 MET CA C 13 54.478 0.00 . . . . . . . 351 MET CA . 50695 1 393 . 1 . 1 93 93 MET CB C 13 33.617 0.00 . . . . . . . 351 MET CB . 50695 1 394 . 1 . 1 93 93 MET N N 15 123.758 0.01 . . . . . . . 351 MET N . 50695 1 395 . 1 . 1 97 97 LEU H H 1 7.070 0.00 . . . . . . . 355 LEU H . 50695 1 396 . 1 . 1 97 97 LEU C C 13 176.217 0.00 . . . . . . . 355 LEU CO . 50695 1 397 . 1 . 1 97 97 LEU CA C 13 52.929 0.00 . . . . . . . 355 LEU CA . 50695 1 398 . 1 . 1 97 97 LEU CB C 13 42.128 0.00 . . . . . . . 355 LEU CB . 50695 1 399 . 1 . 1 98 98 GLY H H 1 7.068 0.00 . . . . . . . 356 GLY H . 50695 1 400 . 1 . 1 98 98 GLY C C 13 173.911 0.00 . . . . . . . 356 GLY CO . 50695 1 401 . 1 . 1 98 98 GLY CA C 13 45.216 0.00 . . . . . . . 356 GLY CA . 50695 1 402 . 1 . 1 98 98 GLY N N 15 106.457 0.00 . . . . . . . 356 GLY N . 50695 1 403 . 1 . 1 99 99 TYR H H 1 11.174 0.00 . . . . . . . 357 TYR H . 50695 1 404 . 1 . 1 99 99 TYR C C 13 172.212 0.00 . . . . . . . 357 TYR CO . 50695 1 405 . 1 . 1 99 99 TYR CA C 13 57.713 0.01 . . . . . . . 357 TYR CA . 50695 1 406 . 1 . 1 99 99 TYR CB C 13 36.863 0.06 . . . . . . . 357 TYR CB . 50695 1 407 . 1 . 1 99 99 TYR N N 15 131.238 0.00 . . . . . . . 357 TYR N . 50695 1 408 . 1 . 1 100 100 ARG H H 1 7.525 1.02 . . . . . . . 358 ARG H . 50695 1 409 . 1 . 1 100 100 ARG C C 13 175.147 0.00 . . . . . . . 358 ARG CO . 50695 1 410 . 1 . 1 100 100 ARG CA C 13 52.370 0.00 . . . . . . . 358 ARG CA . 50695 1 411 . 1 . 1 100 100 ARG CB C 13 32.275 0.00 . . . . . . . 358 ARG CB . 50695 1 412 . 1 . 1 100 100 ARG N N 15 121.118 1.78 . . . . . . . 358 ARG N . 50695 1 413 . 1 . 1 101 101 ALA H H 1 7.521 1.25 . . . . . . . 359 ALA H . 50695 1 414 . 1 . 1 101 101 ALA C C 13 177.796 0.00 . . . . . . . 359 ALA CO . 50695 1 415 . 1 . 1 101 101 ALA CA C 13 52.662 0.05 . . . . . . . 359 ALA CA . 50695 1 416 . 1 . 1 101 101 ALA CB C 13 17.709 0.01 . . . . . . . 359 ALA CB . 50695 1 417 . 1 . 1 101 101 ALA N N 15 122.552 0.71 . . . . . . . 359 ALA N . 50695 1 418 . 1 . 1 102 102 ILE H H 1 6.964 0.69 . . . . . . . 360 ILE H . 50695 1 419 . 1 . 1 102 102 ILE C C 13 174.644 0.00 . . . . . . . 360 ILE CO . 50695 1 420 . 1 . 1 102 102 ILE CA C 13 60.050 0.00 . . . . . . . 360 ILE CA . 50695 1 421 . 1 . 1 102 102 ILE CB C 13 38.164 0.03 . . . . . . . 360 ILE CB . 50695 1 422 . 1 . 1 102 102 ILE N N 15 120.546 1.30 . . . . . . . 360 ILE N . 50695 1 423 . 1 . 1 103 103 ARG H H 1 6.684 0.96 . . . . . . . 361 ARG H . 50695 1 424 . 1 . 1 103 103 ARG C C 13 178.966 0.00 . . . . . . . 361 ARG CO . 50695 1 425 . 1 . 1 103 103 ARG CA C 13 57.849 0.01 . . . . . . . 361 ARG CA . 50695 1 426 . 1 . 1 103 103 ARG CB C 13 28.206 0.08 . . . . . . . 361 ARG CB . 50695 1 427 . 1 . 1 103 103 ARG N N 15 120.330 1.09 . . . . . . . 361 ARG N . 50695 1 428 . 1 . 1 104 104 LEU H H 1 6.445 0.73 . . . . . . . 362 LEU H . 50695 1 429 . 1 . 1 104 104 LEU C C 13 177.510 0.00 . . . . . . . 362 LEU CO . 50695 1 430 . 1 . 1 104 104 LEU CA C 13 56.990 0.02 . . . . . . . 362 LEU CA . 50695 1 431 . 1 . 1 104 104 LEU CB C 13 40.816 0.00 . . . . . . . 362 LEU CB . 50695 1 432 . 1 . 1 104 104 LEU N N 15 118.622 2.82 . . . . . . . 362 LEU N . 50695 1 433 . 1 . 1 105 105 CYS H H 1 7.562 0.38 . . . . . . . 363 CYS H . 50695 1 434 . 1 . 1 105 105 CYS C C 13 174.561 0.00 . . . . . . . 363 CYS CO . 50695 1 435 . 1 . 1 105 105 CYS CA C 13 64.096 0.00 . . . . . . . 363 CYS CA . 50695 1 436 . 1 . 1 105 105 CYS CB C 13 25.403 0.03 . . . . . . . 363 CYS CB . 50695 1 437 . 1 . 1 105 105 CYS N N 15 114.841 0.95 . . . . . . . 363 CYS N . 50695 1 438 . 1 . 1 106 106 LEU H H 1 7.423 0.52 . . . . . . . 364 LEU H . 50695 1 439 . 1 . 1 106 106 LEU C C 13 178.067 0.00 . . . . . . . 364 LEU CO . 50695 1 440 . 1 . 1 106 106 LEU CA C 13 56.332 0.00 . . . . . . . 364 LEU CA . 50695 1 441 . 1 . 1 106 106 LEU CB C 13 40.067 0.01 . . . . . . . 364 LEU CB . 50695 1 442 . 1 . 1 106 106 LEU N N 15 115.449 1.56 . . . . . . . 364 LEU N . 50695 1 443 . 1 . 1 107 107 ASP H H 1 7.258 0.36 . . . . . . . 365 ASP H . 50695 1 444 . 1 . 1 107 107 ASP C C 13 175.512 0.00 . . . . . . . 365 ASP CO . 50695 1 445 . 1 . 1 107 107 ASP CA C 13 55.007 0.01 . . . . . . . 365 ASP CA . 50695 1 446 . 1 . 1 107 107 ASP CB C 13 42.946 0.01 . . . . . . . 365 ASP CB . 50695 1 447 . 1 . 1 107 107 ASP N N 15 117.258 0.26 . . . . . . . 365 ASP N . 50695 1 448 . 1 . 1 108 108 ARG H H 1 7.615 0.00 . . . . . . . 366 ARG H . 50695 1 449 . 1 . 1 108 108 ARG CA C 13 51.496 0.00 . . . . . . . 366 ARG CA . 50695 1 450 . 1 . 1 108 108 ARG CB C 13 28.128 0.00 . . . . . . . 366 ARG CB . 50695 1 451 . 1 . 1 108 108 ARG N N 15 117.508 0.00 . . . . . . . 366 ARG N . 50695 1 452 . 1 . 1 109 109 PRO H H 1 8.995 0.00 . . . . . . . 367 PRO H . 50695 1 453 . 1 . 1 109 109 PRO C C 13 177.846 0.00 . . . . . . . 367 PRO CO . 50695 1 454 . 1 . 1 109 109 PRO CA C 13 64.681 0.00 . . . . . . . 367 PRO CA . 50695 1 455 . 1 . 1 109 109 PRO CB C 13 30.739 0.00 . . . . . . . 367 PRO CB . 50695 1 456 . 1 . 1 110 110 ASP H H 1 8.328 0.67 . . . . . . . 368 ASP H . 50695 1 457 . 1 . 1 110 110 ASP C C 13 179.228 0.00 . . . . . . . 368 ASP CO . 50695 1 458 . 1 . 1 110 110 ASP CA C 13 56.865 0.03 . . . . . . . 368 ASP CA . 50695 1 459 . 1 . 1 110 110 ASP CB C 13 38.677 0.03 . . . . . . . 368 ASP CB . 50695 1 460 . 1 . 1 110 110 ASP N N 15 119.103 1.71 . . . . . . . 368 ASP N . 50695 1 461 . 1 . 1 111 111 ILE H H 1 7.628 0.03 . . . . . . . 369 ILE H . 50695 1 462 . 1 . 1 111 111 ILE C C 13 179.398 0.00 . . . . . . . 369 ILE CO . 50695 1 463 . 1 . 1 111 111 ILE CA C 13 64.730 0.00 . . . . . . . 369 ILE CA . 50695 1 464 . 1 . 1 111 111 ILE CB C 13 38.248 0.07 . . . . . . . 369 ILE CB . 50695 1 465 . 1 . 1 111 111 ILE N N 15 121.798 1.01 . . . . . . . 369 ILE N . 50695 1 466 . 1 . 1 112 112 PHE H H 1 8.563 0.97 . . . . . . . 370 PHE H . 50695 1 467 . 1 . 1 112 112 PHE C C 13 177.925 0.00 . . . . . . . 370 PHE CO . 50695 1 468 . 1 . 1 112 112 PHE CA C 13 56.387 0.00 . . . . . . . 370 PHE CA . 50695 1 469 . 1 . 1 112 112 PHE CB C 13 40.267 0.01 . . . . . . . 370 PHE CB . 50695 1 470 . 1 . 1 112 112 PHE N N 15 122.810 0.00 . . . . . . . 370 PHE N . 50695 1 471 . 1 . 1 113 113 LYS H H 1 8.445 1.09 . . . . . . . 371 LYS H . 50695 1 472 . 1 . 1 113 113 LYS C C 13 178.423 0.00 . . . . . . . 371 LYS CO . 50695 1 473 . 1 . 1 113 113 LYS CA C 13 60.917 0.00 . . . . . . . 371 LYS CA . 50695 1 474 . 1 . 1 113 113 LYS CB C 13 31.467 0.04 . . . . . . . 371 LYS CB . 50695 1 475 . 1 . 1 113 113 LYS N N 15 116.089 0.62 . . . . . . . 371 LYS N . 50695 1 476 . 1 . 1 114 114 THR H H 1 7.253 0.10 . . . . . . . 372 THR H . 50695 1 477 . 1 . 1 114 114 THR C C 13 175.031 0.00 . . . . . . . 372 THR CO . 50695 1 478 . 1 . 1 114 114 THR CA C 13 67.268 0.01 . . . . . . . 372 THR CA . 50695 1 479 . 1 . 1 114 114 THR CB C 13 68.369 0.03 . . . . . . . 372 THR CB . 50695 1 480 . 1 . 1 114 114 THR N N 15 117.803 2.35 . . . . . . . 372 THR N . 50695 1 481 . 1 . 1 115 115 GLN H H 1 7.929 0.78 . . . . . . . 373 GLN H . 50695 1 482 . 1 . 1 115 115 GLN C C 13 178.585 0.00 . . . . . . . 373 GLN CO . 50695 1 483 . 1 . 1 115 115 GLN CA C 13 59.111 0.01 . . . . . . . 373 GLN CA . 50695 1 484 . 1 . 1 115 115 GLN CB C 13 27.258 0.03 . . . . . . . 373 GLN CB . 50695 1 485 . 1 . 1 115 115 GLN N N 15 118.898 1.25 . . . . . . . 373 GLN N . 50695 1 486 . 1 . 1 116 116 LEU H H 1 8.762 0.06 . . . . . . . 374 LEU H . 50695 1 487 . 1 . 1 116 116 LEU C C 13 178.965 0.00 . . . . . . . 374 LEU CO . 50695 1 488 . 1 . 1 116 116 LEU CA C 13 57.793 0.01 . . . . . . . 374 LEU CA . 50695 1 489 . 1 . 1 116 116 LEU CB C 13 41.582 0.03 . . . . . . . 374 LEU CB . 50695 1 490 . 1 . 1 116 116 LEU N N 15 118.409 0.76 . . . . . . . 374 LEU N . 50695 1 491 . 1 . 1 117 117 ARG H H 1 8.176 0.52 . . . . . . . 375 ARG H . 50695 1 492 . 1 . 1 117 117 ARG C C 13 178.233 0.00 . . . . . . . 375 ARG CO . 50695 1 493 . 1 . 1 117 117 ARG CA C 13 60.469 0.00 . . . . . . . 375 ARG CA . 50695 1 494 . 1 . 1 117 117 ARG CB C 13 29.791 0.07 . . . . . . . 375 ARG CB . 50695 1 495 . 1 . 1 117 117 ARG N N 15 120.049 0.72 . . . . . . . 375 ARG N . 50695 1 496 . 1 . 1 118 118 ALA H H 1 8.204 0.46 . . . . . . . 376 ALA H . 50695 1 497 . 1 . 1 118 118 ALA C C 13 179.909 0.00 . . . . . . . 376 ALA CO . 50695 1 498 . 1 . 1 118 118 ALA CA C 13 55.968 0.01 . . . . . . . 376 ALA CA . 50695 1 499 . 1 . 1 118 118 ALA CB C 13 19.419 0.02 . . . . . . . 376 ALA CB . 50695 1 500 . 1 . 1 118 118 ALA N N 15 119.997 0.61 . . . . . . . 376 ALA N . 50695 1 501 . 1 . 1 119 119 ILE H H 1 8.756 0.10 . . . . . . . 377 ILE H . 50695 1 502 . 1 . 1 119 119 ILE C C 13 178.253 0.00 . . . . . . . 377 ILE CO . 50695 1 503 . 1 . 1 119 119 ILE CA C 13 66.365 0.00 . . . . . . . 377 ILE CA . 50695 1 504 . 1 . 1 119 119 ILE CB C 13 37.393 0.07 . . . . . . . 377 ILE CB . 50695 1 505 . 1 . 1 119 119 ILE N N 15 119.406 0.02 . . . . . . . 377 ILE N . 50695 1 506 . 1 . 1 120 120 LEU H H 1 8.871 0.02 . . . . . . . 378 LEU H . 50695 1 507 . 1 . 1 120 120 LEU C C 13 181.972 0.00 . . . . . . . 378 LEU CO . 50695 1 508 . 1 . 1 120 120 LEU CA C 13 57.736 0.01 . . . . . . . 378 LEU CA . 50695 1 509 . 1 . 1 120 120 LEU CB C 13 39.851 0.04 . . . . . . . 378 LEU CB . 50695 1 510 . 1 . 1 120 120 LEU N N 15 120.116 0.70 . . . . . . . 378 LEU N . 50695 1 511 . 1 . 1 121 121 ARG H H 1 8.642 0.25 . . . . . . . 379 ARG H . 50695 1 512 . 1 . 1 121 121 ARG C C 13 180.860 0.00 . . . . . . . 379 ARG CO . 50695 1 513 . 1 . 1 121 121 ARG CA C 13 59.954 0.00 . . . . . . . 379 ARG CA . 50695 1 514 . 1 . 1 121 121 ARG CB C 13 30.438 0.04 . . . . . . . 379 ARG CB . 50695 1 515 . 1 . 1 121 121 ARG N N 15 121.644 0.86 . . . . . . . 379 ARG N . 50695 1 516 . 1 . 1 122 122 ALA H H 1 8.374 0.02 . . . . . . . 380 ALA H . 50695 1 517 . 1 . 1 122 122 ALA C C 13 178.761 0.00 . . . . . . . 380 ALA CO . 50695 1 518 . 1 . 1 122 122 ALA CA C 13 55.323 0.00 . . . . . . . 380 ALA CA . 50695 1 519 . 1 . 1 122 122 ALA CB C 13 17.172 0.01 . . . . . . . 380 ALA CB . 50695 1 520 . 1 . 1 122 122 ALA N N 15 122.481 0.00 . . . . . . . 380 ALA N . 50695 1 521 . 1 . 1 123 123 SER H H 1 7.765 0.59 . . . . . . . 381 SER H . 50695 1 522 . 1 . 1 123 123 SER C C 13 173.816 0.00 . . . . . . . 381 SER CO . 50695 1 523 . 1 . 1 123 123 SER CA C 13 61.231 0.01 . . . . . . . 381 SER CA . 50695 1 524 . 1 . 1 123 123 SER CB C 13 62.551 0.07 . . . . . . . 381 SER CB . 50695 1 525 . 1 . 1 123 123 SER N N 15 115.647 0.00 . . . . . . . 381 SER N . 50695 1 526 . 1 . 1 124 124 ALA H H 1 7.671 0.50 . . . . . . . 382 ALA H . 50695 1 527 . 1 . 1 124 124 ALA C C 13 177.729 0.00 . . . . . . . 382 ALA CO . 50695 1 528 . 1 . 1 124 124 ALA CA C 13 52.752 0.00 . . . . . . . 382 ALA CA . 50695 1 529 . 1 . 1 124 124 ALA CB C 13 18.024 0.02 . . . . . . . 382 ALA CB . 50695 1 530 . 1 . 1 124 124 ALA N N 15 121.728 0.00 . . . . . . . 382 ALA N . 50695 1 531 . 1 . 1 125 125 TYR H H 1 7.664 0.51 . . . . . . . 383 TYR H . 50695 1 532 . 1 . 1 125 125 TYR C C 13 174.932 0.00 . . . . . . . 383 TYR CO . 50695 1 533 . 1 . 1 125 125 TYR CA C 13 58.272 0.01 . . . . . . . 383 TYR CA . 50695 1 534 . 1 . 1 125 125 TYR CB C 13 37.883 0.04 . . . . . . . 383 TYR CB . 50695 1 535 . 1 . 1 125 125 TYR N N 15 115.058 0.00 . . . . . . . 383 TYR N . 50695 1 536 . 1 . 1 126 126 GLY H H 1 7.770 0.61 . . . . . . . 384 GLY H . 50695 1 537 . 1 . 1 126 126 GLY C C 13 170.122 0.00 . . . . . . . 384 GLY CO . 50695 1 538 . 1 . 1 126 126 GLY CA C 13 45.877 0.00 . . . . . . . 384 GLY CA . 50695 1 539 . 1 . 1 126 126 GLY N N 15 107.643 0.00 . . . . . . . 384 GLY N . 50695 1 540 . 1 . 1 127 127 ASN H H 1 8.965 0.58 . . . . . . . 385 ASN H . 50695 1 541 . 1 . 1 127 127 ASN C C 13 172.778 0.00 . . . . . . . 385 ASN CO . 50695 1 542 . 1 . 1 127 127 ASN CA C 13 51.926 0.01 . . . . . . . 385 ASN CA . 50695 1 543 . 1 . 1 127 127 ASN CB C 13 38.603 0.05 . . . . . . . 385 ASN CB . 50695 1 544 . 1 . 1 127 127 ASN N N 15 125.083 1.35 . . . . . . . 385 ASN N . 50695 1 545 . 1 . 1 128 128 VAL H H 1 9.146 0.40 . . . . . . . 386 VAL H . 50695 1 546 . 1 . 1 128 128 VAL C C 13 174.438 0.00 . . . . . . . 386 VAL CO . 50695 1 547 . 1 . 1 128 128 VAL CA C 13 60.362 0.00 . . . . . . . 386 VAL CA . 50695 1 548 . 1 . 1 128 128 VAL CB C 13 34.068 0.00 . . . . . . . 386 VAL CB . 50695 1 549 . 1 . 1 128 128 VAL N N 15 124.630 1.79 . . . . . . . 386 VAL N . 50695 1 550 . 1 . 1 129 129 GLN H H 1 8.767 0.02 . . . . . . . 387 GLN H . 50695 1 551 . 1 . 1 129 129 GLN C C 13 174.397 0.00 . . . . . . . 387 GLN CO . 50695 1 552 . 1 . 1 129 129 GLN CA C 13 52.927 0.02 . . . . . . . 387 GLN CA . 50695 1 553 . 1 . 1 129 129 GLN CB C 13 30.916 0.03 . . . . . . . 387 GLN CB . 50695 1 554 . 1 . 1 129 129 GLN N N 15 122.749 0.10 . . . . . . . 387 GLN N . 50695 1 555 . 1 . 1 130 130 ILE H H 1 8.721 0.07 . . . . . . . 388 ILE H . 50695 1 556 . 1 . 1 130 130 ILE C C 13 173.767 0.00 . . . . . . . 388 ILE CO . 50695 1 557 . 1 . 1 130 130 ILE CA C 13 60.803 0.00 . . . . . . . 388 ILE CA . 50695 1 558 . 1 . 1 130 130 ILE CB C 13 39.873 0.00 . . . . . . . 388 ILE CB . 50695 1 559 . 1 . 1 130 130 ILE N N 15 123.720 1.08 . . . . . . . 388 ILE N . 50695 1 560 . 1 . 1 131 131 MET H H 1 8.655 0.00 . . . . . . . 389 MET H . 50695 1 561 . 1 . 1 131 131 MET CA C 13 52.807 0.00 . . . . . . . 389 MET CA . 50695 1 562 . 1 . 1 131 131 MET CB C 13 37.409 0.00 . . . . . . . 389 MET CB . 50695 1 563 . 1 . 1 131 131 MET N N 15 124.839 0.01 . . . . . . . 389 MET N . 50695 1 564 . 1 . 1 136 136 SER H H 1 7.707 0.00 . . . . . . . 394 SER H . 50695 1 565 . 1 . 1 136 136 SER C C 13 176.535 0.00 . . . . . . . 394 SER CO . 50695 1 566 . 1 . 1 136 136 SER CA C 13 57.588 0.00 . . . . . . . 394 SER CA . 50695 1 567 . 1 . 1 136 136 SER CB C 13 66.699 0.00 . . . . . . . 394 SER CB . 50695 1 568 . 1 . 1 136 136 SER N N 15 119.640 0.01 . . . . . . . 394 SER N . 50695 1 569 . 1 . 1 137 137 SER H H 1 8.149 0.44 . . . . . . . 395 SER H . 50695 1 570 . 1 . 1 137 137 SER C C 13 174.087 0.00 . . . . . . . 395 SER CO . 50695 1 571 . 1 . 1 137 137 SER CA C 13 57.525 0.01 . . . . . . . 395 SER CA . 50695 1 572 . 1 . 1 137 137 SER CB C 13 66.608 0.02 . . . . . . . 395 SER CB . 50695 1 573 . 1 . 1 137 137 SER N N 15 122.446 2.81 . . . . . . . 395 SER N . 50695 1 574 . 1 . 1 138 138 VAL H H 1 9.462 0.87 . . . . . . . 396 VAL H . 50695 1 575 . 1 . 1 138 138 VAL C C 13 176.158 0.00 . . . . . . . 396 VAL CO . 50695 1 576 . 1 . 1 138 138 VAL CA C 13 64.923 0.00 . . . . . . . 396 VAL CA . 50695 1 577 . 1 . 1 138 138 VAL CB C 13 31.394 0.03 . . . . . . . 396 VAL CB . 50695 1 578 . 1 . 1 138 138 VAL N N 15 124.852 0.41 . . . . . . . 396 VAL N . 50695 1 579 . 1 . 1 139 139 GLU H H 1 8.941 1.39 . . . . . . . 397 GLU H . 50695 1 580 . 1 . 1 139 139 GLU C C 13 180.045 0.00 . . . . . . . 397 GLU CO . 50695 1 581 . 1 . 1 139 139 GLU CA C 13 59.924 0.00 . . . . . . . 397 GLU CA . 50695 1 582 . 1 . 1 139 139 GLU CB C 13 28.173 0.06 . . . . . . . 397 GLU CB . 50695 1 583 . 1 . 1 139 139 GLU N N 15 124.432 0.00 . . . . . . . 397 GLU N . 50695 1 584 . 1 . 1 140 140 GLU H H 1 7.316 0.23 . . . . . . . 398 GLU H . 50695 1 585 . 1 . 1 140 140 GLU C C 13 178.852 0.00 . . . . . . . 398 GLU CO . 50695 1 586 . 1 . 1 140 140 GLU CA C 13 58.623 0.01 . . . . . . . 398 GLU CA . 50695 1 587 . 1 . 1 140 140 GLU CB C 13 29.986 0.10 . . . . . . . 398 GLU CB . 50695 1 588 . 1 . 1 140 140 GLU N N 15 117.963 0.48 . . . . . . . 398 GLU N . 50695 1 589 . 1 . 1 141 141 VAL H H 1 7.567 0.48 . . . . . . . 399 VAL H . 50695 1 590 . 1 . 1 141 141 VAL C C 13 177.593 0.00 . . . . . . . 399 VAL CO . 50695 1 591 . 1 . 1 141 141 VAL CA C 13 65.904 0.00 . . . . . . . 399 VAL CA . 50695 1 592 . 1 . 1 141 141 VAL CB C 13 30.511 0.05 . . . . . . . 399 VAL CB . 50695 1 593 . 1 . 1 141 141 VAL N N 15 118.898 0.45 . . . . . . . 399 VAL N . 50695 1 594 . 1 . 1 142 142 GLU H H 1 8.028 0.03 . . . . . . . 400 GLU H . 50695 1 595 . 1 . 1 142 142 GLU C C 13 180.272 0.00 . . . . . . . 400 GLU CO . 50695 1 596 . 1 . 1 142 142 GLU CA C 13 59.270 0.01 . . . . . . . 400 GLU CA . 50695 1 597 . 1 . 1 142 142 GLU CB C 13 28.485 0.00 . . . . . . . 400 GLU CB . 50695 1 598 . 1 . 1 142 142 GLU N N 15 119.746 0.48 . . . . . . . 400 GLU N . 50695 1 599 . 1 . 1 143 143 LYS H H 1 8.284 0.29 . . . . . . . 401 LYS H . 50695 1 600 . 1 . 1 143 143 LYS C C 13 179.823 0.00 . . . . . . . 401 LYS CO . 50695 1 601 . 1 . 1 143 143 LYS CA C 13 59.421 0.02 . . . . . . . 401 LYS CA . 50695 1 602 . 1 . 1 143 143 LYS CB C 13 32.232 0.08 . . . . . . . 401 LYS CB . 50695 1 603 . 1 . 1 143 143 LYS N N 15 122.183 1.92 . . . . . . . 401 LYS N . 50695 1 604 . 1 . 1 144 144 ALA H H 1 8.578 0.00 . . . . . . . 402 ALA H . 50695 1 605 . 1 . 1 144 144 ALA CA C 13 55.648 0.00 . . . . . . . 402 ALA CA . 50695 1 606 . 1 . 1 144 144 ALA CB C 13 16.963 0.00 . . . . . . . 402 ALA CB . 50695 1 607 . 1 . 1 144 144 ALA N N 15 124.093 0.02 . . . . . . . 402 ALA N . 50695 1 608 . 1 . 1 146 146 SER H H 1 7.506 0.00 . . . . . . . 404 SER H . 50695 1 609 . 1 . 1 146 146 SER C C 13 177.412 0.00 . . . . . . . 404 SER CO . 50695 1 610 . 1 . 1 146 146 SER CA C 13 61.887 0.00 . . . . . . . 404 SER CA . 50695 1 611 . 1 . 1 146 146 SER N N 15 125.500 0.01 . . . . . . . 404 SER N . 50695 1 612 . 1 . 1 147 147 ILE H H 1 7.505 0.00 . . . . . . . 405 ILE H . 50695 1 613 . 1 . 1 147 147 ILE CA C 13 64.685 0.00 . . . . . . . 405 ILE CA . 50695 1 614 . 1 . 1 147 147 ILE CB C 13 36.305 0.00 . . . . . . . 405 ILE CB . 50695 1 615 . 1 . 1 147 147 ILE N N 15 125.501 0.01 . . . . . . . 405 ILE N . 50695 1 616 . 1 . 1 148 148 LEU H H 1 8.542 0.00 . . . . . . . 406 LEU H . 50695 1 617 . 1 . 1 148 148 LEU C C 13 178.777 0.00 . . . . . . . 406 LEU CO . 50695 1 618 . 1 . 1 148 148 LEU CA C 13 58.346 0.00 . . . . . . . 406 LEU CA . 50695 1 619 . 1 . 1 148 148 LEU CB C 13 40.035 0.00 . . . . . . . 406 LEU CB . 50695 1 620 . 1 . 1 148 148 LEU N N 15 117.838 0.01 . . . . . . . 406 LEU N . 50695 1 621 . 1 . 1 149 149 GLU H H 1 8.124 0.42 . . . . . . . 407 GLU H . 50695 1 622 . 1 . 1 149 149 GLU C C 13 179.675 0.00 . . . . . . . 407 GLU CO . 50695 1 623 . 1 . 1 149 149 GLU CA C 13 59.003 0.01 . . . . . . . 407 GLU CA . 50695 1 624 . 1 . 1 149 149 GLU CB C 13 28.238 0.08 . . . . . . . 407 GLU CB . 50695 1 625 . 1 . 1 149 149 GLU N N 15 120.116 2.28 . . . . . . . 407 GLU N . 50695 1 626 . 1 . 1 150 150 GLU H H 1 7.907 0.20 . . . . . . . 408 GLU H . 50695 1 627 . 1 . 1 150 150 GLU C C 13 179.610 0.00 . . . . . . . 408 GLU CO . 50695 1 628 . 1 . 1 150 150 GLU CA C 13 59.347 0.03 . . . . . . . 408 GLU CA . 50695 1 629 . 1 . 1 150 150 GLU CB C 13 28.746 0.04 . . . . . . . 408 GLU CB . 50695 1 630 . 1 . 1 150 150 GLU N N 15 121.260 1.14 . . . . . . . 408 GLU N . 50695 1 631 . 1 . 1 151 151 VAL H H 1 8.232 0.12 . . . . . . . 409 VAL H . 50695 1 632 . 1 . 1 151 151 VAL C C 13 178.146 0.00 . . . . . . . 409 VAL CO . 50695 1 633 . 1 . 1 151 151 VAL CA C 13 65.877 0.00 . . . . . . . 409 VAL CA . 50695 1 634 . 1 . 1 151 151 VAL CB C 13 29.981 0.01 . . . . . . . 409 VAL CB . 50695 1 635 . 1 . 1 151 151 VAL N N 15 120.481 0.35 . . . . . . . 409 VAL N . 50695 1 636 . 1 . 1 152 152 LYS H H 1 7.973 0.38 . . . . . . . 410 LYS H . 50695 1 637 . 1 . 1 152 152 LYS C C 13 177.667 0.00 . . . . . . . 410 LYS CO . 50695 1 638 . 1 . 1 152 152 LYS CA C 13 60.323 0.00 . . . . . . . 410 LYS CA . 50695 1 639 . 1 . 1 152 152 LYS CB C 13 32.082 0.05 . . . . . . . 410 LYS CB . 50695 1 640 . 1 . 1 152 152 LYS N N 15 119.740 1.09 . . . . . . . 410 LYS N . 50695 1 641 . 1 . 1 153 153 ALA H H 1 7.702 0.11 . . . . . . . 411 ALA H . 50695 1 642 . 1 . 1 153 153 ALA C C 13 181.214 0.00 . . . . . . . 411 ALA CO . 50695 1 643 . 1 . 1 153 153 ALA CA C 13 54.532 0.02 . . . . . . . 411 ALA CA . 50695 1 644 . 1 . 1 153 153 ALA CB C 13 17.102 0.04 . . . . . . . 411 ALA CB . 50695 1 645 . 1 . 1 153 153 ALA N N 15 119.514 0.88 . . . . . . . 411 ALA N . 50695 1 646 . 1 . 1 154 154 GLU H H 1 7.993 0.18 . . . . . . . 412 GLU H . 50695 1 647 . 1 . 1 154 154 GLU C C 13 178.975 0.00 . . . . . . . 412 GLU CO . 50695 1 648 . 1 . 1 154 154 GLU CA C 13 59.292 0.00 . . . . . . . 412 GLU CA . 50695 1 649 . 1 . 1 154 154 GLU CB C 13 28.867 0.02 . . . . . . . 412 GLU CB . 50695 1 650 . 1 . 1 154 154 GLU N N 15 120.150 0.22 . . . . . . . 412 GLU N . 50695 1 651 . 1 . 1 155 155 LEU H H 1 8.516 0.35 . . . . . . . 413 LEU H . 50695 1 652 . 1 . 1 155 155 LEU C C 13 180.292 0.00 . . . . . . . 413 LEU CO . 50695 1 653 . 1 . 1 155 155 LEU CA C 13 58.101 0.01 . . . . . . . 413 LEU CA . 50695 1 654 . 1 . 1 155 155 LEU CB C 13 39.008 0.05 . . . . . . . 413 LEU CB . 50695 1 655 . 1 . 1 155 155 LEU N N 15 120.003 0.08 . . . . . . . 413 LEU N . 50695 1 656 . 1 . 1 156 156 ASP H H 1 8.419 0.44 . . . . . . . 414 ASP H . 50695 1 657 . 1 . 1 156 156 ASP C C 13 180.363 0.00 . . . . . . . 414 ASP CO . 50695 1 658 . 1 . 1 156 156 ASP CA C 13 57.404 0.10 . . . . . . . 414 ASP CA . 50695 1 659 . 1 . 1 156 156 ASP CB C 13 39.743 0.00 . . . . . . . 414 ASP CB . 50695 1 660 . 1 . 1 156 156 ASP N N 15 120.829 0.74 . . . . . . . 414 ASP N . 50695 1 661 . 1 . 1 157 157 ARG H H 1 7.952 0.02 . . . . . . . 415 ARG H . 50695 1 662 . 1 . 1 157 157 ARG C C 13 178.589 0.00 . . . . . . . 415 ARG CO . 50695 1 663 . 1 . 1 157 157 ARG CA C 13 59.011 0.01 . . . . . . . 415 ARG CA . 50695 1 664 . 1 . 1 157 157 ARG CB C 13 29.245 0.01 . . . . . . . 415 ARG CB . 50695 1 665 . 1 . 1 157 157 ARG N N 15 119.742 1.83 . . . . . . . 415 ARG N . 50695 1 666 . 1 . 1 158 158 GLU H H 1 7.941 0.02 . . . . . . . 416 GLU H . 50695 1 667 . 1 . 1 158 158 GLU C C 13 176.940 0.00 . . . . . . . 416 GLU CO . 50695 1 668 . 1 . 1 158 158 GLU CA C 13 56.398 0.01 . . . . . . . 416 GLU CA . 50695 1 669 . 1 . 1 158 158 GLU CB C 13 30.389 0.03 . . . . . . . 416 GLU CB . 50695 1 670 . 1 . 1 158 158 GLU N N 15 117.942 0.00 . . . . . . . 416 GLU N . 50695 1 671 . 1 . 1 159 159 GLY H H 1 8.034 0.08 . . . . . . . 417 GLY H . 50695 1 672 . 1 . 1 159 159 GLY C C 13 174.655 0.00 . . . . . . . 417 GLY CO . 50695 1 673 . 1 . 1 159 159 GLY CA C 13 45.900 0.01 . . . . . . . 417 GLY CA . 50695 1 674 . 1 . 1 159 159 GLY N N 15 109.868 0.00 . . . . . . . 417 GLY N . 50695 1 675 . 1 . 1 160 160 VAL H H 1 8.272 0.16 . . . . . . . 418 VAL H . 50695 1 676 . 1 . 1 160 160 VAL C C 13 175.657 0.00 . . . . . . . 418 VAL CO . 50695 1 677 . 1 . 1 160 160 VAL CA C 13 61.555 0.00 . . . . . . . 418 VAL CA . 50695 1 678 . 1 . 1 160 160 VAL CB C 13 32.168 0.02 . . . . . . . 418 VAL CB . 50695 1 679 . 1 . 1 160 160 VAL N N 15 125.737 2.22 . . . . . . . 418 VAL N . 50695 1 680 . 1 . 1 161 161 LYS H H 1 7.797 0.63 . . . . . . . 419 LYS H . 50695 1 681 . 1 . 1 161 161 LYS C C 13 174.958 0.00 . . . . . . . 419 LYS CO . 50695 1 682 . 1 . 1 161 161 LYS CA C 13 56.561 0.01 . . . . . . . 419 LYS CA . 50695 1 683 . 1 . 1 161 161 LYS CB C 13 32.157 0.02 . . . . . . . 419 LYS CB . 50695 1 684 . 1 . 1 161 161 LYS N N 15 127.929 0.00 . . . . . . . 419 LYS N . 50695 1 685 . 1 . 1 162 162 TYR H H 1 7.888 0.73 . . . . . . . 420 TYR H . 50695 1 686 . 1 . 1 162 162 TYR C C 13 173.075 0.00 . . . . . . . 420 TYR CO . 50695 1 687 . 1 . 1 162 162 TYR CA C 13 55.538 0.01 . . . . . . . 420 TYR CA . 50695 1 688 . 1 . 1 162 162 TYR CB C 13 40.887 0.02 . . . . . . . 420 TYR CB . 50695 1 689 . 1 . 1 162 162 TYR N N 15 115.243 0.00 . . . . . . . 420 TYR N . 50695 1 690 . 1 . 1 163 163 ASP H H 1 8.405 0.21 . . . . . . . 421 ASP H . 50695 1 691 . 1 . 1 163 163 ASP C C 13 176.222 0.00 . . . . . . . 421 ASP CO . 50695 1 692 . 1 . 1 163 163 ASP CA C 13 52.998 0.00 . . . . . . . 421 ASP CA . 50695 1 693 . 1 . 1 163 163 ASP CB C 13 40.322 0.10 . . . . . . . 421 ASP CB . 50695 1 694 . 1 . 1 163 163 ASP N N 15 120.556 0.00 . . . . . . . 421 ASP N . 50695 1 695 . 1 . 1 164 164 LYS H H 1 8.335 0.14 . . . . . . . 422 LYS H . 50695 1 696 . 1 . 1 164 164 LYS C C 13 178.106 0.00 . . . . . . . 422 LYS CO . 50695 1 697 . 1 . 1 164 164 LYS CA C 13 58.026 0.00 . . . . . . . 422 LYS CA . 50695 1 698 . 1 . 1 164 164 LYS CB C 13 31.550 0.05 . . . . . . . 422 LYS CB . 50695 1 699 . 1 . 1 164 164 LYS N N 15 126.887 0.00 . . . . . . . 422 LYS N . 50695 1 700 . 1 . 1 165 165 GLU H H 1 7.717 0.76 . . . . . . . 423 GLU H . 50695 1 701 . 1 . 1 165 165 GLU C C 13 175.950 0.00 . . . . . . . 423 GLU CO . 50695 1 702 . 1 . 1 165 165 GLU CA C 13 54.324 0.00 . . . . . . . 423 GLU CA . 50695 1 703 . 1 . 1 165 165 GLU CB C 13 28.181 0.01 . . . . . . . 423 GLU CB . 50695 1 704 . 1 . 1 165 165 GLU N N 15 120.312 1.50 . . . . . . . 423 GLU N . 50695 1 705 . 1 . 1 166 166 ILE H H 1 7.684 0.72 . . . . . . . 424 ILE H . 50695 1 706 . 1 . 1 166 166 ILE C C 13 174.815 0.00 . . . . . . . 424 ILE CO . 50695 1 707 . 1 . 1 166 166 ILE CA C 13 62.228 0.01 . . . . . . . 424 ILE CA . 50695 1 708 . 1 . 1 166 166 ILE CB C 13 38.498 0.02 . . . . . . . 424 ILE CB . 50695 1 709 . 1 . 1 166 166 ILE N N 15 121.782 0.00 . . . . . . . 424 ILE N . 50695 1 710 . 1 . 1 167 167 LYS H H 1 9.011 0.60 . . . . . . . 425 LYS H . 50695 1 711 . 1 . 1 167 167 LYS C C 13 175.866 0.00 . . . . . . . 425 LYS CO . 50695 1 712 . 1 . 1 167 167 LYS CA C 13 55.433 0.00 . . . . . . . 425 LYS CA . 50695 1 713 . 1 . 1 167 167 LYS CB C 13 33.712 0.01 . . . . . . . 425 LYS CB . 50695 1 714 . 1 . 1 167 167 LYS N N 15 125.275 2.44 . . . . . . . 425 LYS N . 50695 1 715 . 1 . 1 168 168 VAL H H 1 9.214 0.40 . . . . . . . 426 VAL H . 50695 1 716 . 1 . 1 168 168 VAL C C 13 175.350 0.00 . . . . . . . 426 VAL CO . 50695 1 717 . 1 . 1 168 168 VAL CA C 13 59.832 0.95 . . . . . . . 426 VAL CA . 50695 1 718 . 1 . 1 168 168 VAL CB C 13 33.731 0.05 . . . . . . . 426 VAL CB . 50695 1 719 . 1 . 1 168 168 VAL N N 15 120.783 2.05 . . . . . . . 426 VAL N . 50695 1 720 . 1 . 1 169 169 GLY H H 1 7.685 1.13 . . . . . . . 427 GLY H . 50695 1 721 . 1 . 1 169 169 GLY C C 13 171.995 0.00 . . . . . . . 427 GLY CO . 50695 1 722 . 1 . 1 169 169 GLY CA C 13 42.092 0.00 . . . . . . . 427 GLY CA . 50695 1 723 . 1 . 1 169 169 GLY N N 15 118.744 0.00 . . . . . . . 427 GLY N . 50695 1 724 . 1 . 1 170 170 ILE H H 1 6.550 0.00 . . . . . . . 428 ILE H . 50695 1 725 . 1 . 1 170 170 ILE C C 13 174.058 0.00 . . . . . . . 428 ILE CO . 50695 1 726 . 1 . 1 170 170 ILE CA C 13 57.779 0.00 . . . . . . . 428 ILE CA . 50695 1 727 . 1 . 1 170 170 ILE CB C 13 41.042 0.19 . . . . . . . 428 ILE CB . 50695 1 728 . 1 . 1 170 170 ILE N N 15 105.247 0.00 . . . . . . . 428 ILE N . 50695 1 729 . 1 . 1 171 171 MET H H 1 8.725 0.00 . . . . . . . 429 MET H . 50695 1 730 . 1 . 1 171 171 MET CA C 13 53.499 0.00 . . . . . . . 429 MET CA . 50695 1 731 . 1 . 1 171 171 MET CB C 13 34.435 0.00 . . . . . . . 429 MET CB . 50695 1 732 . 1 . 1 171 171 MET N N 15 124.239 0.01 . . . . . . . 429 MET N . 50695 1 733 . 1 . 1 172 172 VAL H H 1 8.267 0.00 . . . . . . . 430 VAL H . 50695 1 734 . 1 . 1 172 172 VAL C C 13 176.599 0.00 . . . . . . . 430 VAL CO . 50695 1 735 . 1 . 1 172 172 VAL CA C 13 65.555 0.00 . . . . . . . 430 VAL CA . 50695 1 736 . 1 . 1 172 172 VAL CB C 13 31.741 0.00 . . . . . . . 430 VAL CB . 50695 1 737 . 1 . 1 172 172 VAL N N 15 119.808 0.05 . . . . . . . 430 VAL N . 50695 1 738 . 1 . 1 173 173 GLU H H 1 8.266 0.00 . . . . . . . 431 GLU H . 50695 1 739 . 1 . 1 173 173 GLU CA C 13 63.158 0.00 . . . . . . . 431 GLU CA . 50695 1 740 . 1 . 1 173 173 GLU CB C 13 29.055 0.00 . . . . . . . 431 GLU CB . 50695 1 741 . 1 . 1 173 173 GLU N N 15 119.820 0.04 . . . . . . . 431 GLU N . 50695 1 742 . 1 . 1 175 175 PRO C C 13 178.032 0.00 . . . . . . . 433 PRO CO . 50695 1 743 . 1 . 1 175 175 PRO CA C 13 66.143 0.00 . . . . . . . 433 PRO CA . 50695 1 744 . 1 . 1 175 175 PRO CB C 13 30.476 0.00 . . . . . . . 433 PRO CB . 50695 1 745 . 1 . 1 176 176 SER H H 1 8.215 0.25 . . . . . . . 434 SER H . 50695 1 746 . 1 . 1 176 176 SER C C 13 176.354 0.00 . . . . . . . 434 SER CO . 50695 1 747 . 1 . 1 176 176 SER CA C 13 61.609 0.00 . . . . . . . 434 SER CA . 50695 1 748 . 1 . 1 176 176 SER CB C 13 60.322 0.14 . . . . . . . 434 SER CB . 50695 1 749 . 1 . 1 176 176 SER N N 15 110.857 0.00 . . . . . . . 434 SER N . 50695 1 750 . 1 . 1 177 177 ALA H H 1 7.357 0.55 . . . . . . . 435 ALA H . 50695 1 751 . 1 . 1 177 177 ALA C C 13 176.338 0.00 . . . . . . . 435 ALA CO . 50695 1 752 . 1 . 1 177 177 ALA CA C 13 53.637 0.04 . . . . . . . 435 ALA CA . 50695 1 753 . 1 . 1 177 177 ALA CB C 13 17.885 0.03 . . . . . . . 435 ALA CB . 50695 1 754 . 1 . 1 177 177 ALA N N 15 128.993 0.00 . . . . . . . 435 ALA N . 50695 1 755 . 1 . 1 178 178 ALA H H 1 7.354 0.55 . . . . . . . 436 ALA H . 50695 1 756 . 1 . 1 178 178 ALA C C 13 178.915 0.00 . . . . . . . 436 ALA CO . 50695 1 757 . 1 . 1 178 178 ALA CA C 13 53.407 0.06 . . . . . . . 436 ALA CA . 50695 1 758 . 1 . 1 178 178 ALA CB C 13 18.656 0.14 . . . . . . . 436 ALA CB . 50695 1 759 . 1 . 1 178 178 ALA N N 15 114.826 0.65 . . . . . . . 436 ALA N . 50695 1 760 . 1 . 1 179 179 VAL H H 1 7.721 0.18 . . . . . . . 437 VAL H . 50695 1 761 . 1 . 1 179 179 VAL C C 13 177.487 0.00 . . . . . . . 437 VAL CO . 50695 1 762 . 1 . 1 179 179 VAL CA C 13 64.986 0.00 . . . . . . . 437 VAL CA . 50695 1 763 . 1 . 1 179 179 VAL CB C 13 31.638 0.02 . . . . . . . 437 VAL CB . 50695 1 764 . 1 . 1 179 179 VAL N N 15 114.218 0.00 . . . . . . . 437 VAL N . 50695 1 765 . 1 . 1 180 180 THR H H 1 7.324 0.22 . . . . . . . 438 THR H . 50695 1 766 . 1 . 1 180 180 THR C C 13 174.356 0.00 . . . . . . . 438 THR CO . 50695 1 767 . 1 . 1 180 180 THR CA C 13 59.758 0.01 . . . . . . . 438 THR CA . 50695 1 768 . 1 . 1 180 180 THR CB C 13 67.557 0.06 . . . . . . . 438 THR CB . 50695 1 769 . 1 . 1 180 180 THR N N 15 106.479 0.00 . . . . . . . 438 THR N . 50695 1 770 . 1 . 1 181 181 ALA H H 1 7.937 0.83 . . . . . . . 439 ALA H . 50695 1 771 . 1 . 1 181 181 ALA C C 13 178.731 0.00 . . . . . . . 439 ALA CO . 50695 1 772 . 1 . 1 181 181 ALA CA C 13 56.066 0.02 . . . . . . . 439 ALA CA . 50695 1 773 . 1 . 1 181 181 ALA CB C 13 18.104 0.02 . . . . . . . 439 ALA CB . 50695 1 774 . 1 . 1 181 181 ALA N N 15 126.678 0.00 . . . . . . . 439 ALA N . 50695 1 775 . 1 . 1 182 182 ARG H H 1 8.095 0.68 . . . . . . . 440 ARG H . 50695 1 776 . 1 . 1 182 182 ARG C C 13 178.224 0.00 . . . . . . . 440 ARG CO . 50695 1 777 . 1 . 1 182 182 ARG CA C 13 59.158 0.00 . . . . . . . 440 ARG CA . 50695 1 778 . 1 . 1 182 182 ARG CB C 13 28.758 0.05 . . . . . . . 440 ARG CB . 50695 1 779 . 1 . 1 182 182 ARG N N 15 117.517 1.49 . . . . . . . 440 ARG N . 50695 1 780 . 1 . 1 183 183 ILE H H 1 7.506 0.11 . . . . . . . 441 ILE H . 50695 1 781 . 1 . 1 183 183 ILE C C 13 179.135 0.00 . . . . . . . 441 ILE CO . 50695 1 782 . 1 . 1 183 183 ILE CA C 13 63.977 0.00 . . . . . . . 441 ILE CA . 50695 1 783 . 1 . 1 183 183 ILE CB C 13 37.897 0.00 . . . . . . . 441 ILE CB . 50695 1 784 . 1 . 1 183 183 ILE N N 15 119.096 0.11 . . . . . . . 441 ILE N . 50695 1 785 . 1 . 1 184 184 LEU H H 1 8.402 0.62 . . . . . . . 442 LEU H . 50695 1 786 . 1 . 1 184 184 LEU C C 13 178.744 0.00 . . . . . . . 442 LEU CO . 50695 1 787 . 1 . 1 184 184 LEU CA C 13 57.800 0.00 . . . . . . . 442 LEU CA . 50695 1 788 . 1 . 1 184 184 LEU CB C 13 42.108 0.01 . . . . . . . 442 LEU CB . 50695 1 789 . 1 . 1 184 184 LEU N N 15 119.322 0.10 . . . . . . . 442 LEU N . 50695 1 790 . 1 . 1 185 185 ALA H H 1 7.942 0.97 . . . . . . . 443 ALA H . 50695 1 791 . 1 . 1 185 185 ALA C C 13 176.939 0.00 . . . . . . . 443 ALA CO . 50695 1 792 . 1 . 1 185 185 ALA CA C 13 54.094 0.01 . . . . . . . 443 ALA CA . 50695 1 793 . 1 . 1 185 185 ALA CB C 13 17.873 0.06 . . . . . . . 443 ALA CB . 50695 1 794 . 1 . 1 185 185 ALA N N 15 113.005 0.00 . . . . . . . 443 ALA N . 50695 1 795 . 1 . 1 186 186 LYS H H 1 7.316 0.34 . . . . . . . 444 LYS H . 50695 1 796 . 1 . 1 186 186 LYS C C 13 177.404 0.00 . . . . . . . 444 LYS CO . 50695 1 797 . 1 . 1 186 186 LYS CA C 13 57.540 0.01 . . . . . . . 444 LYS CA . 50695 1 798 . 1 . 1 186 186 LYS CB C 13 32.176 0.01 . . . . . . . 444 LYS CB . 50695 1 799 . 1 . 1 186 186 LYS N N 15 114.017 1.00 . . . . . . . 444 LYS N . 50695 1 800 . 1 . 1 187 187 GLU H H 1 7.359 0.30 . . . . . . . 445 GLU H . 50695 1 801 . 1 . 1 187 187 GLU C C 13 176.159 0.00 . . . . . . . 445 GLU CO . 50695 1 802 . 1 . 1 187 187 GLU CA C 13 55.094 0.00 . . . . . . . 445 GLU CA . 50695 1 803 . 1 . 1 187 187 GLU CB C 13 31.489 0.06 . . . . . . . 445 GLU CB . 50695 1 804 . 1 . 1 187 187 GLU N N 15 115.006 0.00 . . . . . . . 445 GLU N . 50695 1 805 . 1 . 1 188 188 VAL H H 1 7.943 0.88 . . . . . . . 446 VAL H . 50695 1 806 . 1 . 1 188 188 VAL C C 13 174.366 0.00 . . . . . . . 446 VAL CO . 50695 1 807 . 1 . 1 188 188 VAL CA C 13 58.386 0.01 . . . . . . . 446 VAL CA . 50695 1 808 . 1 . 1 188 188 VAL CB C 13 33.765 0.12 . . . . . . . 446 VAL CB . 50695 1 809 . 1 . 1 188 188 VAL N N 15 109.556 0.00 . . . . . . . 446 VAL N . 50695 1 810 . 1 . 1 189 189 ASP H H 1 7.828 1.00 . . . . . . . 447 ASP H . 50695 1 811 . 1 . 1 189 189 ASP C C 13 175.351 0.00 . . . . . . . 447 ASP CO . 50695 1 812 . 1 . 1 189 189 ASP CA C 13 56.289 0.01 . . . . . . . 447 ASP CA . 50695 1 813 . 1 . 1 189 189 ASP CB C 13 42.188 0.02 . . . . . . . 447 ASP CB . 50695 1 814 . 1 . 1 189 189 ASP N N 15 116.373 0.00 . . . . . . . 447 ASP N . 50695 1 815 . 1 . 1 190 190 PHE H H 1 7.284 0.46 . . . . . . . 448 PHE H . 50695 1 816 . 1 . 1 190 190 PHE C C 13 171.756 0.00 . . . . . . . 448 PHE CO . 50695 1 817 . 1 . 1 190 190 PHE CA C 13 56.051 0.01 . . . . . . . 448 PHE CA . 50695 1 818 . 1 . 1 190 190 PHE CB C 13 38.026 0.04 . . . . . . . 448 PHE CB . 50695 1 819 . 1 . 1 190 190 PHE N N 15 112.096 1.84 . . . . . . . 448 PHE N . 50695 1 820 . 1 . 1 191 191 PHE H H 1 8.377 0.64 . . . . . . . 449 PHE H . 50695 1 821 . 1 . 1 191 191 PHE C C 13 175.515 0.00 . . . . . . . 449 PHE CO . 50695 1 822 . 1 . 1 191 191 PHE CA C 13 54.661 0.00 . . . . . . . 449 PHE CA . 50695 1 823 . 1 . 1 191 191 PHE CB C 13 43.527 0.01 . . . . . . . 449 PHE CB . 50695 1 824 . 1 . 1 191 191 PHE N N 15 115.232 1.29 . . . . . . . 449 PHE N . 50695 1 825 . 1 . 1 192 192 SER H H 1 9.374 0.36 . . . . . . . 450 SER H . 50695 1 826 . 1 . 1 192 192 SER C C 13 175.585 0.00 . . . . . . . 450 SER CO . 50695 1 827 . 1 . 1 192 192 SER CA C 13 56.496 0.01 . . . . . . . 450 SER CA . 50695 1 828 . 1 . 1 192 192 SER CB C 13 63.391 0.02 . . . . . . . 450 SER CB . 50695 1 829 . 1 . 1 192 192 SER N N 15 116.503 0.00 . . . . . . . 450 SER N . 50695 1 830 . 1 . 1 193 193 ILE H H 1 9.386 0.35 . . . . . . . 451 ILE H . 50695 1 831 . 1 . 1 193 193 ILE C C 13 176.140 0.00 . . . . . . . 451 ILE CO . 50695 1 832 . 1 . 1 193 193 ILE CA C 13 62.701 0.00 . . . . . . . 451 ILE CA . 50695 1 833 . 1 . 1 193 193 ILE CB C 13 38.355 0.03 . . . . . . . 451 ILE CB . 50695 1 834 . 1 . 1 193 193 ILE N N 15 128.403 0.00 . . . . . . . 451 ILE N . 50695 1 835 . 1 . 1 194 194 GLY H H 1 8.061 0.98 . . . . . . . 452 GLY H . 50695 1 836 . 1 . 1 194 194 GLY C C 13 175.083 0.00 . . . . . . . 452 GLY CO . 50695 1 837 . 1 . 1 194 194 GLY CA C 13 47.380 0.00 . . . . . . . 452 GLY CA . 50695 1 838 . 1 . 1 194 194 GLY N N 15 121.213 0.00 . . . . . . . 452 GLY N . 50695 1 839 . 1 . 1 195 195 THR H H 1 7.081 0.00 . . . . . . . 453 THR H . 50695 1 840 . 1 . 1 195 195 THR CA C 13 65.710 0.00 . . . . . . . 453 THR CA . 50695 1 841 . 1 . 1 195 195 THR CB C 13 67.059 0.00 . . . . . . . 453 THR CB . 50695 1 842 . 1 . 1 195 195 THR N N 15 111.512 0.01 . . . . . . . 453 THR N . 50695 1 843 . 1 . 1 196 196 ASN H H 1 7.891 0.00 . . . . . . . 454 ASN H . 50695 1 844 . 1 . 1 196 196 ASN C C 13 175.534 0.00 . . . . . . . 454 ASN CO . 50695 1 845 . 1 . 1 196 196 ASN CA C 13 57.244 0.00 . . . . . . . 454 ASN CA . 50695 1 846 . 1 . 1 196 196 ASN N N 15 109.712 0.00 . . . . . . . 454 ASN N . 50695 1 847 . 1 . 1 197 197 ASP H H 1 7.893 0.00 . . . . . . . 455 ASP H . 50695 1 848 . 1 . 1 197 197 ASP CA C 13 50.333 0.00 . . . . . . . 455 ASP CA . 50695 1 849 . 1 . 1 197 197 ASP CB C 13 41.552 0.00 . . . . . . . 455 ASP CB . 50695 1 850 . 1 . 1 197 197 ASP N N 15 109.703 0.01 . . . . . . . 455 ASP N . 50695 1 851 . 1 . 1 200 200 GLN H H 1 6.690 0.00 . . . . . . . 458 GLN H . 50695 1 852 . 1 . 1 200 200 GLN C C 13 172.927 0.00 . . . . . . . 458 GLN CO . 50695 1 853 . 1 . 1 200 200 GLN CA C 13 54.246 0.00 . . . . . . . 458 GLN CA . 50695 1 854 . 1 . 1 200 200 GLN CB C 13 29.054 0.00 . . . . . . . 458 GLN CB . 50695 1 855 . 1 . 1 200 200 GLN N N 15 116.303 0.04 . . . . . . . 458 GLN N . 50695 1 856 . 1 . 1 201 201 TYR H H 1 6.688 0.00 . . . . . . . 459 TYR H . 50695 1 857 . 1 . 1 201 201 TYR CA C 13 56.651 0.00 . . . . . . . 459 TYR CA . 50695 1 858 . 1 . 1 201 201 TYR CB C 13 36.420 0.00 . . . . . . . 459 TYR CB . 50695 1 859 . 1 . 1 201 201 TYR N N 15 116.330 0.01 . . . . . . . 459 TYR N . 50695 1 860 . 1 . 1 202 202 THR H H 1 7.493 0.00 . . . . . . . 460 THR H . 50695 1 861 . 1 . 1 202 202 THR C C 13 173.933 0.00 . . . . . . . 460 THR CO . 50695 1 862 . 1 . 1 202 202 THR N N 15 117.799 0.00 . . . . . . . 460 THR N . 50695 1 863 . 1 . 1 203 203 LEU H H 1 7.378 0.11 . . . . . . . 461 LEU H . 50695 1 864 . 1 . 1 203 203 LEU C C 13 174.173 0.00 . . . . . . . 461 LEU CO . 50695 1 865 . 1 . 1 203 203 LEU CA C 13 54.253 0.02 . . . . . . . 461 LEU CA . 50695 1 866 . 1 . 1 203 203 LEU CB C 13 40.453 0.03 . . . . . . . 461 LEU CB . 50695 1 867 . 1 . 1 203 203 LEU N N 15 119.197 1.40 . . . . . . . 461 LEU N . 50695 1 868 . 1 . 1 204 204 ALA H H 1 8.275 1.01 . . . . . . . 462 ALA H . 50695 1 869 . 1 . 1 204 204 ALA C C 13 175.146 0.00 . . . . . . . 462 ALA CO . 50695 1 870 . 1 . 1 204 204 ALA CA C 13 52.055 0.00 . . . . . . . 462 ALA CA . 50695 1 871 . 1 . 1 204 204 ALA CB C 13 16.003 0.01 . . . . . . . 462 ALA CB . 50695 1 872 . 1 . 1 204 204 ALA N N 15 120.241 0.34 . . . . . . . 462 ALA N . 50695 1 873 . 1 . 1 205 205 VAL H H 1 8.388 0.90 . . . . . . . 463 VAL H . 50695 1 874 . 1 . 1 205 205 VAL C C 13 172.278 0.00 . . . . . . . 463 VAL CO . 50695 1 875 . 1 . 1 205 205 VAL CA C 13 59.636 0.02 . . . . . . . 463 VAL CA . 50695 1 876 . 1 . 1 205 205 VAL CB C 13 34.587 0.04 . . . . . . . 463 VAL CB . 50695 1 877 . 1 . 1 205 205 VAL N N 15 122.459 2.56 . . . . . . . 463 VAL N . 50695 1 878 . 1 . 1 206 206 ASP H H 1 8.152 0.66 . . . . . . . 464 ASP H . 50695 1 879 . 1 . 1 206 206 ASP C C 13 177.174 0.00 . . . . . . . 464 ASP CO . 50695 1 880 . 1 . 1 206 206 ASP CA C 13 51.601 0.00 . . . . . . . 464 ASP CA . 50695 1 881 . 1 . 1 206 206 ASP CB C 13 41.031 0.02 . . . . . . . 464 ASP CB . 50695 1 882 . 1 . 1 206 206 ASP N N 15 125.885 0.87 . . . . . . . 464 ASP N . 50695 1 883 . 1 . 1 207 207 ARG H H 1 8.583 0.23 . . . . . . . 465 ARG H . 50695 1 884 . 1 . 1 207 207 ARG C C 13 175.732 0.00 . . . . . . . 465 ARG CO . 50695 1 885 . 1 . 1 207 207 ARG CA C 13 57.460 0.01 . . . . . . . 465 ARG CA . 50695 1 886 . 1 . 1 207 207 ARG CB C 13 29.758 0.03 . . . . . . . 465 ARG CB . 50695 1 887 . 1 . 1 207 207 ARG N N 15 116.218 0.00 . . . . . . . 465 ARG N . 50695 1 888 . 1 . 1 208 208 MET H H 1 7.900 0.46 . . . . . . . 466 MET H . 50695 1 889 . 1 . 1 208 208 MET C C 13 175.968 0.00 . . . . . . . 466 MET CO . 50695 1 890 . 1 . 1 208 208 MET CA C 13 54.114 0.04 . . . . . . . 466 MET CA . 50695 1 891 . 1 . 1 208 208 MET CB C 13 30.284 0.04 . . . . . . . 466 MET CB . 50695 1 892 . 1 . 1 208 208 MET N N 15 118.599 2.39 . . . . . . . 466 MET N . 50695 1 893 . 1 . 1 209 209 ASN H H 1 8.242 0.80 . . . . . . . 467 ASN H . 50695 1 894 . 1 . 1 209 209 ASN C C 13 175.892 0.00 . . . . . . . 467 ASN CO . 50695 1 895 . 1 . 1 209 209 ASN CA C 13 51.728 0.00 . . . . . . . 467 ASN CA . 50695 1 896 . 1 . 1 209 209 ASN CB C 13 38.502 0.00 . . . . . . . 467 ASN CB . 50695 1 897 . 1 . 1 209 209 ASN N N 15 123.920 2.93 . . . . . . . 467 ASN N . 50695 1 898 . 1 . 1 210 210 GLU H H 1 8.708 0.33 . . . . . . . 468 GLU H . 50695 1 899 . 1 . 1 210 210 GLU C C 13 177.451 0.00 . . . . . . . 468 GLU CO . 50695 1 900 . 1 . 1 210 210 GLU CA C 13 58.544 0.00 . . . . . . . 468 GLU CA . 50695 1 901 . 1 . 1 210 210 GLU CB C 13 29.166 0.33 . . . . . . . 468 GLU CB . 50695 1 902 . 1 . 1 210 210 GLU N N 15 126.840 0.00 . . . . . . . 468 GLU N . 50695 1 903 . 1 . 1 211 211 HIS H H 1 7.972 0.50 . . . . . . . 469 HIS H . 50695 1 904 . 1 . 1 211 211 HIS C C 13 176.580 0.00 . . . . . . . 469 HIS CO . 50695 1 905 . 1 . 1 211 211 HIS CA C 13 57.960 0.03 . . . . . . . 469 HIS CA . 50695 1 906 . 1 . 1 211 211 HIS CB C 13 28.891 0.00 . . . . . . . 469 HIS CB . 50695 1 907 . 1 . 1 211 211 HIS N N 15 117.434 0.00 . . . . . . . 469 HIS N . 50695 1 908 . 1 . 1 212 212 VAL H H 1 7.274 0.09 . . . . . . . 470 VAL H . 50695 1 909 . 1 . 1 212 212 VAL C C 13 176.022 0.00 . . . . . . . 470 VAL CO . 50695 1 910 . 1 . 1 212 212 VAL CA C 13 59.797 0.00 . . . . . . . 470 VAL CA . 50695 1 911 . 1 . 1 212 212 VAL CB C 13 30.632 0.08 . . . . . . . 470 VAL CB . 50695 1 912 . 1 . 1 212 212 VAL N N 15 106.820 0.00 . . . . . . . 470 VAL N . 50695 1 913 . 1 . 1 213 213 LYS H H 1 8.226 1.04 . . . . . . . 471 LYS H . 50695 1 914 . 1 . 1 213 213 LYS C C 13 178.863 0.00 . . . . . . . 471 LYS CO . 50695 1 915 . 1 . 1 213 213 LYS CA C 13 59.719 0.01 . . . . . . . 471 LYS CA . 50695 1 916 . 1 . 1 213 213 LYS CB C 13 31.315 0.00 . . . . . . . 471 LYS CB . 50695 1 917 . 1 . 1 213 213 LYS N N 15 120.796 1.85 . . . . . . . 471 LYS N . 50695 1 918 . 1 . 1 214 214 GLU H H 1 8.755 0.51 . . . . . . . 472 GLU H . 50695 1 919 . 1 . 1 214 214 GLU C C 13 177.378 0.00 . . . . . . . 472 GLU CO . 50695 1 920 . 1 . 1 214 214 GLU CA C 13 57.959 0.00 . . . . . . . 472 GLU CA . 50695 1 921 . 1 . 1 214 214 GLU CB C 13 28.023 0.06 . . . . . . . 472 GLU CB . 50695 1 922 . 1 . 1 214 214 GLU N N 15 118.214 0.73 . . . . . . . 472 GLU N . 50695 1 923 . 1 . 1 215 215 TYR H H 1 7.939 0.30 . . . . . . . 473 TYR H . 50695 1 924 . 1 . 1 215 215 TYR C C 13 175.767 0.00 . . . . . . . 473 TYR CO . 50695 1 925 . 1 . 1 215 215 TYR CA C 13 59.392 0.00 . . . . . . . 473 TYR CA . 50695 1 926 . 1 . 1 215 215 TYR CB C 13 36.962 0.01 . . . . . . . 473 TYR CB . 50695 1 927 . 1 . 1 215 215 TYR N N 15 119.661 2.18 . . . . . . . 473 TYR N . 50695 1 928 . 1 . 1 216 216 TYR H H 1 6.619 1.01 . . . . . . . 474 TYR H . 50695 1 929 . 1 . 1 216 216 TYR C C 13 173.068 0.00 . . . . . . . 474 TYR CO . 50695 1 930 . 1 . 1 216 216 TYR CA C 13 59.216 0.03 . . . . . . . 474 TYR CA . 50695 1 931 . 1 . 1 216 216 TYR CB C 13 36.701 0.05 . . . . . . . 474 TYR CB . 50695 1 932 . 1 . 1 216 216 TYR N N 15 124.271 2.43 . . . . . . . 474 TYR N . 50695 1 933 . 1 . 1 217 217 GLN H H 1 5.604 0.00 . . . . . . . 475 GLN H . 50695 1 934 . 1 . 1 217 217 GLN CA C 13 51.880 0.00 . . . . . . . 475 GLN CA . 50695 1 935 . 1 . 1 217 217 GLN CB C 13 29.980 0.00 . . . . . . . 475 GLN CB . 50695 1 936 . 1 . 1 217 217 GLN N N 15 126.708 0.01 . . . . . . . 475 GLN N . 50695 1 937 . 1 . 1 218 218 PRO C C 13 174.794 0.00 . . . . . . . 476 PRO CO . 50695 1 938 . 1 . 1 218 218 PRO CA C 13 64.048 0.00 . . . . . . . 476 PRO CA . 50695 1 939 . 1 . 1 218 218 PRO CB C 13 31.675 0.00 . . . . . . . 476 PRO CB . 50695 1 940 . 1 . 1 219 219 PHE H H 1 7.741 0.22 . . . . . . . 477 PHE H . 50695 1 941 . 1 . 1 219 219 PHE C C 13 173.670 0.00 . . . . . . . 477 PHE CO . 50695 1 942 . 1 . 1 219 219 PHE CA C 13 56.460 0.00 . . . . . . . 477 PHE CA . 50695 1 943 . 1 . 1 219 219 PHE CB C 13 36.540 0.00 . . . . . . . 477 PHE CB . 50695 1 944 . 1 . 1 219 219 PHE N N 15 108.951 0.00 . . . . . . . 477 PHE N . 50695 1 945 . 1 . 1 220 220 HIS H H 1 7.524 0.00 . . . . . . . 478 HIS H . 50695 1 946 . 1 . 1 220 220 HIS CA C 13 56.356 0.00 . . . . . . . 478 HIS CA . 50695 1 947 . 1 . 1 220 220 HIS CB C 13 31.167 0.00 . . . . . . . 478 HIS CB . 50695 1 948 . 1 . 1 220 220 HIS N N 15 118.236 0.00 . . . . . . . 478 HIS N . 50695 1 949 . 1 . 1 221 221 PRO C C 13 179.232 0.00 . . . . . . . 479 PRO CO . 50695 1 950 . 1 . 1 221 221 PRO CA C 13 65.322 0.00 . . . . . . . 479 PRO CA . 50695 1 951 . 1 . 1 221 221 PRO CB C 13 31.911 0.00 . . . . . . . 479 PRO CB . 50695 1 952 . 1 . 1 221 221 PRO N N 15 121.729 0.02 . . . . . . . 479 PRO N . 50695 1 953 . 1 . 1 222 222 ALA H H 1 10.074 2.06 . . . . . . . 480 ALA H . 50695 1 954 . 1 . 1 222 222 ALA C C 13 179.840 0.00 . . . . . . . 480 ALA CO . 50695 1 955 . 1 . 1 222 222 ALA CA C 13 54.998 0.02 . . . . . . . 480 ALA CA . 50695 1 956 . 1 . 1 222 222 ALA CB C 13 19.512 0.03 . . . . . . . 480 ALA CB . 50695 1 957 . 1 . 1 222 222 ALA N N 15 119.206 2.53 . . . . . . . 480 ALA N . 50695 1 958 . 1 . 1 223 223 ILE H H 1 7.507 0.51 . . . . . . . 481 ILE H . 50695 1 959 . 1 . 1 223 223 ILE C C 13 178.266 0.00 . . . . . . . 481 ILE CO . 50695 1 960 . 1 . 1 223 223 ILE CA C 13 62.537 0.01 . . . . . . . 481 ILE CA . 50695 1 961 . 1 . 1 223 223 ILE CB C 13 34.400 0.13 . . . . . . . 481 ILE CB . 50695 1 962 . 1 . 1 223 223 ILE N N 15 116.775 0.12 . . . . . . . 481 ILE N . 50695 1 963 . 1 . 1 224 224 LEU H H 1 7.544 0.45 . . . . . . . 482 LEU H . 50695 1 964 . 1 . 1 224 224 LEU C C 13 178.239 0.00 . . . . . . . 482 LEU CO . 50695 1 965 . 1 . 1 224 224 LEU CA C 13 57.916 0.00 . . . . . . . 482 LEU CA . 50695 1 966 . 1 . 1 224 224 LEU CB C 13 40.025 0.09 . . . . . . . 482 LEU CB . 50695 1 967 . 1 . 1 224 224 LEU N N 15 116.635 0.19 . . . . . . . 482 LEU N . 50695 1 968 . 1 . 1 225 225 ARG H H 1 7.908 0.00 . . . . . . . 483 ARG H . 50695 1 969 . 1 . 1 225 225 ARG CA C 13 58.501 0.00 . . . . . . . 483 ARG CA . 50695 1 970 . 1 . 1 225 225 ARG CB C 13 28.084 0.00 . . . . . . . 483 ARG CB . 50695 1 971 . 1 . 1 225 225 ARG N N 15 116.463 0.01 . . . . . . . 483 ARG N . 50695 1 972 . 1 . 1 226 226 LEU H H 1 8.379 0.00 . . . . . . . 484 LEU H . 50695 1 973 . 1 . 1 226 226 LEU C C 13 178.726 0.00 . . . . . . . 484 LEU CO . 50695 1 974 . 1 . 1 226 226 LEU CA C 13 57.888 0.00 . . . . . . . 484 LEU CA . 50695 1 975 . 1 . 1 226 226 LEU CB C 13 40.413 0.00 . . . . . . . 484 LEU CB . 50695 1 976 . 1 . 1 226 226 LEU N N 15 119.087 0.03 . . . . . . . 484 LEU N . 50695 1 977 . 1 . 1 227 227 VAL H H 1 8.379 0.00 . . . . . . . 485 VAL H . 50695 1 978 . 1 . 1 227 227 VAL CA C 13 66.787 0.00 . . . . . . . 485 VAL CA . 50695 1 979 . 1 . 1 227 227 VAL CB C 13 30.161 0.00 . . . . . . . 485 VAL CB . 50695 1 980 . 1 . 1 227 227 VAL N N 15 119.076 0.00 . . . . . . . 485 VAL N . 50695 1 981 . 1 . 1 228 228 LYS H H 1 8.032 0.00 . . . . . . . 486 LYS H . 50695 1 982 . 1 . 1 228 228 LYS C C 13 177.131 0.00 . . . . . . . 486 LYS CO . 50695 1 983 . 1 . 1 228 228 LYS CA C 13 59.097 0.00 . . . . . . . 486 LYS CA . 50695 1 984 . 1 . 1 228 228 LYS CB C 13 31.303 0.00 . . . . . . . 486 LYS CB . 50695 1 985 . 1 . 1 228 228 LYS N N 15 117.022 0.01 . . . . . . . 486 LYS N . 50695 1 986 . 1 . 1 229 229 MET H H 1 8.031 0.00 . . . . . . . 487 MET H . 50695 1 987 . 1 . 1 229 229 MET CA C 13 59.291 0.00 . . . . . . . 487 MET CA . 50695 1 988 . 1 . 1 229 229 MET CB C 13 31.915 0.00 . . . . . . . 487 MET CB . 50695 1 989 . 1 . 1 229 229 MET N N 15 117.019 0.00 . . . . . . . 487 MET N . 50695 1 990 . 1 . 1 231 231 ILE H H 1 8.694 0.00 . . . . . . . 489 ILE H . 50695 1 991 . 1 . 1 231 231 ILE C C 13 177.435 0.00 . . . . . . . 489 ILE CO . 50695 1 992 . 1 . 1 231 231 ILE CA C 13 65.756 0.00 . . . . . . . 489 ILE CA . 50695 1 993 . 1 . 1 231 231 ILE CB C 13 37.466 0.00 . . . . . . . 489 ILE CB . 50695 1 994 . 1 . 1 231 231 ILE N N 15 118.202 0.01 . . . . . . . 489 ILE N . 50695 1 995 . 1 . 1 232 232 ASP H H 1 8.178 0.51 . . . . . . . 490 ASP H . 50695 1 996 . 1 . 1 232 232 ASP C C 13 179.365 0.00 . . . . . . . 490 ASP CO . 50695 1 997 . 1 . 1 232 232 ASP CA C 13 56.976 0.02 . . . . . . . 490 ASP CA . 50695 1 998 . 1 . 1 232 232 ASP CB C 13 39.103 0.16 . . . . . . . 490 ASP CB . 50695 1 999 . 1 . 1 232 232 ASP N N 15 120.189 1.99 . . . . . . . 490 ASP N . 50695 1 1000 . 1 . 1 233 233 ALA H H 1 7.881 0.22 . . . . . . . 491 ALA H . 50695 1 1001 . 1 . 1 233 233 ALA C C 13 179.540 0.00 . . . . . . . 491 ALA CO . 50695 1 1002 . 1 . 1 233 233 ALA CA C 13 54.524 0.01 . . . . . . . 491 ALA CA . 50695 1 1003 . 1 . 1 233 233 ALA CB C 13 18.418 0.07 . . . . . . . 491 ALA CB . 50695 1 1004 . 1 . 1 233 233 ALA N N 15 120.230 1.94 . . . . . . . 491 ALA N . 50695 1 1005 . 1 . 1 234 234 ALA H H 1 8.318 0.22 . . . . . . . 492 ALA H . 50695 1 1006 . 1 . 1 234 234 ALA C C 13 180.442 0.00 . . . . . . . 492 ALA CO . 50695 1 1007 . 1 . 1 234 234 ALA CA C 13 55.098 0.04 . . . . . . . 492 ALA CA . 50695 1 1008 . 1 . 1 234 234 ALA CB C 13 16.607 0.03 . . . . . . . 492 ALA CB . 50695 1 1009 . 1 . 1 234 234 ALA N N 15 117.396 0.90 . . . . . . . 492 ALA N . 50695 1 1010 . 1 . 1 235 235 HIS H H 1 8.486 0.05 . . . . . . . 493 HIS H . 50695 1 1011 . 1 . 1 235 235 HIS C C 13 179.127 0.00 . . . . . . . 493 HIS CO . 50695 1 1012 . 1 . 1 235 235 HIS CA C 13 56.570 0.01 . . . . . . . 493 HIS CA . 50695 1 1013 . 1 . 1 235 235 HIS CB C 13 27.846 0.09 . . . . . . . 493 HIS CB . 50695 1 1014 . 1 . 1 235 235 HIS N N 15 116.503 0.00 . . . . . . . 493 HIS N . 50695 1 1015 . 1 . 1 236 236 LYS H H 1 7.741 0.69 . . . . . . . 494 LYS H . 50695 1 1016 . 1 . 1 236 236 LYS C C 13 177.837 0.00 . . . . . . . 494 LYS CO . 50695 1 1017 . 1 . 1 236 236 LYS CA C 13 58.645 0.01 . . . . . . . 494 LYS CA . 50695 1 1018 . 1 . 1 236 236 LYS CB C 13 31.184 0.09 . . . . . . . 494 LYS CB . 50695 1 1019 . 1 . 1 236 236 LYS N N 15 123.507 0.00 . . . . . . . 494 LYS N . 50695 1 1020 . 1 . 1 237 237 GLU H H 1 7.489 0.44 . . . . . . . 495 GLU H . 50695 1 1021 . 1 . 1 237 237 GLU C C 13 176.360 0.00 . . . . . . . 495 GLU CO . 50695 1 1022 . 1 . 1 237 237 GLU CA C 13 54.085 0.02 . . . . . . . 495 GLU CA . 50695 1 1023 . 1 . 1 237 237 GLU CB C 13 29.591 0.06 . . . . . . . 495 GLU CB . 50695 1 1024 . 1 . 1 237 237 GLU N N 15 114.452 0.00 . . . . . . . 495 GLU N . 50695 1 1025 . 1 . 1 238 238 GLY H H 1 8.180 0.25 . . . . . . . 496 GLY H . 50695 1 1026 . 1 . 1 238 238 GLY C C 13 174.611 0.00 . . . . . . . 496 GLY CO . 50695 1 1027 . 1 . 1 238 238 GLY CA C 13 46.191 0.00 . . . . . . . 496 GLY CA . 50695 1 1028 . 1 . 1 238 238 GLY N N 15 108.815 0.00 . . . . . . . 496 GLY N . 50695 1 1029 . 1 . 1 239 239 LYS H H 1 7.794 0.63 . . . . . . . 497 LYS H . 50695 1 1030 . 1 . 1 239 239 LYS C C 13 174.928 0.00 . . . . . . . 497 LYS CO . 50695 1 1031 . 1 . 1 239 239 LYS CA C 13 53.235 0.00 . . . . . . . 497 LYS CA . 50695 1 1032 . 1 . 1 239 239 LYS CB C 13 32.034 0.07 . . . . . . . 497 LYS CB . 50695 1 1033 . 1 . 1 239 239 LYS N N 15 117.976 1.60 . . . . . . . 497 LYS N . 50695 1 1034 . 1 . 1 240 240 PHE H H 1 8.471 1.31 . . . . . . . 498 PHE H . 50695 1 1035 . 1 . 1 240 240 PHE C C 13 173.382 0.00 . . . . . . . 498 PHE CO . 50695 1 1036 . 1 . 1 240 240 PHE CA C 13 55.795 0.00 . . . . . . . 498 PHE CA . 50695 1 1037 . 1 . 1 240 240 PHE CB C 13 41.050 0.00 . . . . . . . 498 PHE CB . 50695 1 1038 . 1 . 1 240 240 PHE N N 15 116.380 0.00 . . . . . . . 498 PHE N . 50695 1 1039 . 1 . 1 241 241 ALA H H 1 9.522 0.26 . . . . . . . 499 ALA H . 50695 1 1040 . 1 . 1 241 241 ALA C C 13 173.944 0.00 . . . . . . . 499 ALA CO . 50695 1 1041 . 1 . 1 241 241 ALA CA C 13 50.112 0.01 . . . . . . . 499 ALA CA . 50695 1 1042 . 1 . 1 241 241 ALA CB C 13 21.898 0.02 . . . . . . . 499 ALA CB . 50695 1 1043 . 1 . 1 241 241 ALA N N 15 124.311 1.68 . . . . . . . 499 ALA N . 50695 1 1044 . 1 . 1 242 242 ALA H H 1 8.685 0.58 . . . . . . . 500 ALA H . 50695 1 1045 . 1 . 1 242 242 ALA C C 13 177.242 0.00 . . . . . . . 500 ALA CO . 50695 1 1046 . 1 . 1 242 242 ALA CA C 13 48.668 0.00 . . . . . . . 500 ALA CA . 50695 1 1047 . 1 . 1 242 242 ALA CB C 13 22.742 0.10 . . . . . . . 500 ALA CB . 50695 1 1048 . 1 . 1 242 242 ALA N N 15 126.001 0.00 . . . . . . . 500 ALA N . 50695 1 1049 . 1 . 1 243 243 MET H H 1 8.107 0.00 . . . . . . . 501 MET H . 50695 1 1050 . 1 . 1 243 243 MET CA C 13 55.542 0.00 . . . . . . . 501 MET CA . 50695 1 1051 . 1 . 1 243 243 MET CB C 13 36.106 0.00 . . . . . . . 501 MET CB . 50695 1 1052 . 1 . 1 243 243 MET N N 15 118.820 0.00 . . . . . . . 501 MET N . 50695 1 1053 . 1 . 1 244 244 CYS H H 1 7.323 0.00 . . . . . . . 502 CYS H . 50695 1 1054 . 1 . 1 244 244 CYS C C 13 175.676 0.00 . . . . . . . 502 CYS CO . 50695 1 1055 . 1 . 1 244 244 CYS CA C 13 55.458 0.00 . . . . . . . 502 CYS CA . 50695 1 1056 . 1 . 1 244 244 CYS CB C 13 29.119 0.00 . . . . . . . 502 CYS CB . 50695 1 1057 . 1 . 1 244 244 CYS N N 15 106.793 0.00 . . . . . . . 502 CYS N . 50695 1 1058 . 1 . 1 245 245 GLY H H 1 7.360 0.04 . . . . . . . 503 GLY H . 50695 1 1059 . 1 . 1 245 245 GLY C C 13 172.857 0.00 . . . . . . . 503 GLY CO . 50695 1 1060 . 1 . 1 245 245 GLY CA C 13 44.906 0.02 . . . . . . . 503 GLY CA . 50695 1 1061 . 1 . 1 245 245 GLY N N 15 106.762 0.00 . . . . . . . 503 GLY N . 50695 1 1062 . 1 . 1 246 246 GLU H H 1 7.400 0.00 . . . . . . . 504 GLU H . 50695 1 1063 . 1 . 1 246 246 GLU CA C 13 58.674 0.00 . . . . . . . 504 GLU CA . 50695 1 1064 . 1 . 1 246 246 GLU CB C 13 38.510 0.00 . . . . . . . 504 GLU CB . 50695 1 1065 . 1 . 1 246 246 GLU N N 15 124.794 0.01 . . . . . . . 504 GLU N . 50695 1 1066 . 1 . 1 247 247 MET H H 1 7.230 0.00 . . . . . . . 505 MET H . 50695 1 1067 . 1 . 1 247 247 MET C C 13 176.521 0.00 . . . . . . . 505 MET CO . 50695 1 1068 . 1 . 1 247 247 MET CA C 13 58.615 0.00 . . . . . . . 505 MET CA . 50695 1 1069 . 1 . 1 247 247 MET CB C 13 32.855 0.00 . . . . . . . 505 MET CB . 50695 1 1070 . 1 . 1 247 247 MET N N 15 116.236 0.00 . . . . . . . 505 MET N . 50695 1 1071 . 1 . 1 248 248 ALA H H 1 7.308 0.08 . . . . . . . 506 ALA H . 50695 1 1072 . 1 . 1 248 248 ALA C C 13 176.630 0.00 . . . . . . . 506 ALA CO . 50695 1 1073 . 1 . 1 248 248 ALA CA C 13 53.825 0.01 . . . . . . . 506 ALA CA . 50695 1 1074 . 1 . 1 248 248 ALA CB C 13 17.453 0.05 . . . . . . . 506 ALA CB . 50695 1 1075 . 1 . 1 248 248 ALA N N 15 116.220 0.00 . . . . . . . 506 ALA N . 50695 1 1076 . 1 . 1 249 249 GLY H H 1 7.433 0.05 . . . . . . . 507 GLY H . 50695 1 1077 . 1 . 1 249 249 GLY C C 13 172.977 0.00 . . . . . . . 507 GLY CO . 50695 1 1078 . 1 . 1 249 249 GLY CA C 13 44.849 0.00 . . . . . . . 507 GLY CA . 50695 1 1079 . 1 . 1 249 249 GLY N N 15 101.889 0.00 . . . . . . . 507 GLY N . 50695 1 1080 . 1 . 1 250 250 ASP H H 1 7.480 0.00 . . . . . . . 508 ASP H . 50695 1 1081 . 1 . 1 250 250 ASP CA C 13 50.416 0.00 . . . . . . . 508 ASP CA . 50695 1 1082 . 1 . 1 250 250 ASP CB C 13 42.265 0.00 . . . . . . . 508 ASP CB . 50695 1 1083 . 1 . 1 250 250 ASP N N 15 122.780 0.01 . . . . . . . 508 ASP N . 50695 1 1084 . 1 . 1 251 251 PRO C C 13 177.374 0.00 . . . . . . . 509 PRO CO . 50695 1 1085 . 1 . 1 251 251 PRO CA C 13 64.861 0.00 . . . . . . . 509 PRO CA . 50695 1 1086 . 1 . 1 251 251 PRO CB C 13 32.066 0.00 . . . . . . . 509 PRO CB . 50695 1 1087 . 1 . 1 252 252 LEU H H 1 8.144 0.30 . . . . . . . 510 LEU H . 50695 1 1088 . 1 . 1 252 252 LEU C C 13 178.787 0.00 . . . . . . . 510 LEU CO . 50695 1 1089 . 1 . 1 252 252 LEU CA C 13 57.148 0.00 . . . . . . . 510 LEU CA . 50695 1 1090 . 1 . 1 252 252 LEU CB C 13 40.992 0.00 . . . . . . . 510 LEU CB . 50695 1 1091 . 1 . 1 252 252 LEU N N 15 115.873 1.80 . . . . . . . 510 LEU N . 50695 1 1092 . 1 . 1 253 253 ALA H H 1 7.595 0.18 . . . . . . . 511 ALA H . 50695 1 1093 . 1 . 1 253 253 ALA C C 13 179.020 0.00 . . . . . . . 511 ALA CO . 50695 1 1094 . 1 . 1 253 253 ALA CA C 13 52.316 0.01 . . . . . . . 511 ALA CA . 50695 1 1095 . 1 . 1 253 253 ALA CB C 13 19.653 0.13 . . . . . . . 511 ALA CB . 50695 1 1096 . 1 . 1 253 253 ALA N N 15 120.203 2.12 . . . . . . . 511 ALA N . 50695 1 1097 . 1 . 1 254 254 ALA H H 1 8.262 0.85 . . . . . . . 512 ALA H . 50695 1 1098 . 1 . 1 254 254 ALA C C 13 178.892 0.00 . . . . . . . 512 ALA CO . 50695 1 1099 . 1 . 1 254 254 ALA CA C 13 56.812 0.01 . . . . . . . 512 ALA CA . 50695 1 1100 . 1 . 1 254 254 ALA CB C 13 18.697 0.05 . . . . . . . 512 ALA CB . 50695 1 1101 . 1 . 1 254 254 ALA N N 15 122.329 0.00 . . . . . . . 512 ALA N . 50695 1 1102 . 1 . 1 255 255 VAL H H 1 7.969 1.14 . . . . . . . 513 VAL H . 50695 1 1103 . 1 . 1 255 255 VAL C C 13 178.495 0.00 . . . . . . . 513 VAL CO . 50695 1 1104 . 1 . 1 255 255 VAL CA C 13 66.845 0.00 . . . . . . . 513 VAL CA . 50695 1 1105 . 1 . 1 255 255 VAL CB C 13 30.555 0.06 . . . . . . . 513 VAL CB . 50695 1 1106 . 1 . 1 255 255 VAL N N 15 116.217 1.19 . . . . . . . 513 VAL N . 50695 1 1107 . 1 . 1 256 256 ILE H H 1 7.505 0.68 . . . . . . . 514 ILE H . 50695 1 1108 . 1 . 1 256 256 ILE C C 13 177.119 0.00 . . . . . . . 514 ILE CO . 50695 1 1109 . 1 . 1 256 256 ILE CA C 13 65.162 0.00 . . . . . . . 514 ILE CA . 50695 1 1110 . 1 . 1 256 256 ILE CB C 13 37.607 0.00 . . . . . . . 514 ILE CB . 50695 1 1111 . 1 . 1 256 256 ILE N N 15 117.857 0.45 . . . . . . . 514 ILE N . 50695 1 1112 . 1 . 1 257 257 LEU H H 1 8.451 0.27 . . . . . . . 515 LEU H . 50695 1 1113 . 1 . 1 257 257 LEU C C 13 178.976 0.00 . . . . . . . 515 LEU CO . 50695 1 1114 . 1 . 1 257 257 LEU CA C 13 57.674 0.00 . . . . . . . 515 LEU CA . 50695 1 1115 . 1 . 1 257 257 LEU CB C 13 39.853 0.01 . . . . . . . 515 LEU CB . 50695 1 1116 . 1 . 1 257 257 LEU N N 15 119.014 0.72 . . . . . . . 515 LEU N . 50695 1 1117 . 1 . 1 258 258 LEU H H 1 8.491 0.23 . . . . . . . 516 LEU H . 50695 1 1118 . 1 . 1 258 258 LEU C C 13 180.431 0.00 . . . . . . . 516 LEU CO . 50695 1 1119 . 1 . 1 258 258 LEU CA C 13 57.811 0.03 . . . . . . . 516 LEU CA . 50695 1 1120 . 1 . 1 258 258 LEU CB C 13 42.239 0.07 . . . . . . . 516 LEU CB . 50695 1 1121 . 1 . 1 258 258 LEU N N 15 119.732 0.00 . . . . . . . 516 LEU N . 50695 1 1122 . 1 . 1 259 259 GLY H H 1 8.318 0.06 . . . . . . . 517 GLY H . 50695 1 1123 . 1 . 1 259 259 GLY C C 13 175.292 0.00 . . . . . . . 517 GLY CO . 50695 1 1124 . 1 . 1 259 259 GLY CA C 13 45.803 0.00 . . . . . . . 517 GLY CA . 50695 1 1125 . 1 . 1 259 259 GLY N N 15 106.590 0.00 . . . . . . . 517 GLY N . 50695 1 1126 . 1 . 1 260 260 LEU H H 1 8.118 0.26 . . . . . . . 518 LEU H . 50695 1 1127 . 1 . 1 260 260 LEU C C 13 177.100 0.00 . . . . . . . 518 LEU CO . 50695 1 1128 . 1 . 1 260 260 LEU CA C 13 55.055 0.02 . . . . . . . 518 LEU CA . 50695 1 1129 . 1 . 1 260 260 LEU CB C 13 42.170 0.01 . . . . . . . 518 LEU CB . 50695 1 1130 . 1 . 1 260 260 LEU N N 15 120.277 0.00 . . . . . . . 518 LEU N . 50695 1 1131 . 1 . 1 261 261 GLY H H 1 7.715 0.15 . . . . . . . 519 GLY H . 50695 1 1132 . 1 . 1 261 261 GLY C C 13 175.173 0.00 . . . . . . . 519 GLY CO . 50695 1 1133 . 1 . 1 261 261 GLY CA C 13 45.317 0.00 . . . . . . . 519 GLY CA . 50695 1 1134 . 1 . 1 261 261 GLY N N 15 105.076 0.00 . . . . . . . 519 GLY N . 50695 1 1135 . 1 . 1 262 262 LEU H H 1 7.697 0.12 . . . . . . . 520 LEU H . 50695 1 1136 . 1 . 1 262 262 LEU C C 13 175.712 0.00 . . . . . . . 520 LEU CO . 50695 1 1137 . 1 . 1 262 262 LEU CA C 13 56.521 0.00 . . . . . . . 520 LEU CA . 50695 1 1138 . 1 . 1 262 262 LEU CB C 13 41.892 0.03 . . . . . . . 520 LEU CB . 50695 1 1139 . 1 . 1 262 262 LEU N N 15 121.610 0.27 . . . . . . . 520 LEU N . 50695 1 1140 . 1 . 1 263 263 ASP H H 1 7.646 0.18 . . . . . . . 521 ASP H . 50695 1 1141 . 1 . 1 263 263 ASP C C 13 176.527 0.00 . . . . . . . 521 ASP CO . 50695 1 1142 . 1 . 1 263 263 ASP CA C 13 57.100 0.08 . . . . . . . 521 ASP CA . 50695 1 1143 . 1 . 1 263 263 ASP CB C 13 42.496 0.18 . . . . . . . 521 ASP CB . 50695 1 1144 . 1 . 1 263 263 ASP N N 15 120.181 1.17 . . . . . . . 521 ASP N . 50695 1 1145 . 1 . 1 264 264 GLU H H 1 8.373 0.91 . . . . . . . 522 GLU H . 50695 1 1146 . 1 . 1 264 264 GLU C C 13 173.189 0.00 . . . . . . . 522 GLU CO . 50695 1 1147 . 1 . 1 264 264 GLU CA C 13 54.186 0.02 . . . . . . . 522 GLU CA . 50695 1 1148 . 1 . 1 264 264 GLU CB C 13 31.359 0.03 . . . . . . . 522 GLU CB . 50695 1 1149 . 1 . 1 264 264 GLU N N 15 119.050 0.00 . . . . . . . 522 GLU N . 50695 1 1150 . 1 . 1 265 265 PHE H H 1 8.989 0.29 . . . . . . . 523 PHE H . 50695 1 1151 . 1 . 1 265 265 PHE C C 13 173.282 0.00 . . . . . . . 523 PHE CO . 50695 1 1152 . 1 . 1 265 265 PHE CA C 13 55.325 0.00 . . . . . . . 523 PHE CA . 50695 1 1153 . 1 . 1 265 265 PHE CB C 13 39.879 0.00 . . . . . . . 523 PHE CB . 50695 1 1154 . 1 . 1 265 265 PHE N N 15 128.982 0.00 . . . . . . . 523 PHE N . 50695 1 1155 . 1 . 1 266 266 SER H H 1 8.623 0.08 . . . . . . . 524 SER H . 50695 1 1156 . 1 . 1 266 266 SER C C 13 174.063 0.00 . . . . . . . 524 SER CO . 50695 1 1157 . 1 . 1 266 266 SER CA C 13 56.531 0.00 . . . . . . . 524 SER CA . 50695 1 1158 . 1 . 1 266 266 SER CB C 13 63.688 0.00 . . . . . . . 524 SER CB . 50695 1 1159 . 1 . 1 266 266 SER N N 15 121.272 2.27 . . . . . . . 524 SER N . 50695 1 1160 . 1 . 1 267 267 MET H H 1 8.686 0.14 . . . . . . . 525 MET H . 50695 1 1161 . 1 . 1 267 267 MET C C 13 175.403 0.00 . . . . . . . 525 MET CO . 50695 1 1162 . 1 . 1 267 267 MET CA C 13 53.848 0.03 . . . . . . . 525 MET CA . 50695 1 1163 . 1 . 1 267 267 MET CB C 13 37.209 0.08 . . . . . . . 525 MET CB . 50695 1 1164 . 1 . 1 267 267 MET N N 15 120.770 2.76 . . . . . . . 525 MET N . 50695 1 1165 . 1 . 1 268 268 SER H H 1 9.215 0.39 . . . . . . . 526 SER H . 50695 1 1166 . 1 . 1 268 268 SER C C 13 177.650 0.00 . . . . . . . 526 SER CO . 50695 1 1167 . 1 . 1 268 268 SER CA C 13 59.240 0.01 . . . . . . . 526 SER CA . 50695 1 1168 . 1 . 1 268 268 SER CB C 13 62.708 0.02 . . . . . . . 526 SER CB . 50695 1 1169 . 1 . 1 268 268 SER N N 15 118.014 0.00 . . . . . . . 526 SER N . 50695 1 1170 . 1 . 1 269 269 ALA H H 1 8.631 0.97 . . . . . . . 527 ALA H . 50695 1 1171 . 1 . 1 269 269 ALA C C 13 178.539 0.00 . . . . . . . 527 ALA CO . 50695 1 1172 . 1 . 1 269 269 ALA CA C 13 55.595 0.00 . . . . . . . 527 ALA CA . 50695 1 1173 . 1 . 1 269 269 ALA CB C 13 18.386 0.05 . . . . . . . 527 ALA CB . 50695 1 1174 . 1 . 1 269 269 ALA N N 15 129.869 0.00 . . . . . . . 527 ALA N . 50695 1 1175 . 1 . 1 270 270 THR H H 1 7.975 0.32 . . . . . . . 528 THR H . 50695 1 1176 . 1 . 1 270 270 THR C C 13 176.828 0.00 . . . . . . . 528 THR CO . 50695 1 1177 . 1 . 1 270 270 THR CA C 13 63.386 0.00 . . . . . . . 528 THR CA . 50695 1 1178 . 1 . 1 270 270 THR CB C 13 68.189 0.01 . . . . . . . 528 THR CB . 50695 1 1179 . 1 . 1 270 270 THR N N 15 103.300 0.00 . . . . . . . 528 THR N . 50695 1 1180 . 1 . 1 271 271 SER H H 1 7.916 0.37 . . . . . . . 529 SER H . 50695 1 1181 . 1 . 1 271 271 SER C C 13 173.813 0.00 . . . . . . . 529 SER CO . 50695 1 1182 . 1 . 1 271 271 SER CA C 13 60.782 0.00 . . . . . . . 529 SER CA . 50695 1 1183 . 1 . 1 271 271 SER CB C 13 63.817 0.00 . . . . . . . 529 SER CB . 50695 1 1184 . 1 . 1 271 271 SER N N 15 119.884 1.89 . . . . . . . 529 SER N . 50695 1 1185 . 1 . 1 272 272 ILE H H 1 7.542 0.00 . . . . . . . 530 ILE H . 50695 1 1186 . 1 . 1 272 272 ILE CA C 13 67.141 0.00 . . . . . . . 530 ILE CA . 50695 1 1187 . 1 . 1 272 272 ILE CB C 13 34.791 0.00 . . . . . . . 530 ILE CB . 50695 1 1188 . 1 . 1 272 272 ILE N N 15 121.772 0.01 . . . . . . . 530 ILE N . 50695 1 1189 . 1 . 1 273 273 PRO C C 13 179.518 0.00 . . . . . . . 531 PRO CO . 50695 1 1190 . 1 . 1 273 273 PRO CA C 13 65.897 0.00 . . . . . . . 531 PRO CA . 50695 1 1191 . 1 . 1 273 273 PRO CB C 13 30.192 0.00 . . . . . . . 531 PRO CB . 50695 1 1192 . 1 . 1 273 273 PRO N N 15 117.270 0.01 . . . . . . . 531 PRO N . 50695 1 1193 . 1 . 1 274 274 GLU H H 1 7.553 0.27 . . . . . . . 532 GLU H . 50695 1 1194 . 1 . 1 274 274 GLU C C 13 179.101 0.00 . . . . . . . 532 GLU CO . 50695 1 1195 . 1 . 1 274 274 GLU CA C 13 58.450 0.00 . . . . . . . 532 GLU CA . 50695 1 1196 . 1 . 1 274 274 GLU CB C 13 28.975 0.05 . . . . . . . 532 GLU CB . 50695 1 1197 . 1 . 1 274 274 GLU N N 15 118.591 1.32 . . . . . . . 532 GLU N . 50695 1 1198 . 1 . 1 275 275 ILE H H 1 8.321 0.50 . . . . . . . 533 ILE H . 50695 1 1199 . 1 . 1 275 275 ILE C C 13 178.536 0.00 . . . . . . . 533 ILE CO . 50695 1 1200 . 1 . 1 275 275 ILE CA C 13 61.335 0.01 . . . . . . . 533 ILE CA . 50695 1 1201 . 1 . 1 275 275 ILE CB C 13 33.706 0.01 . . . . . . . 533 ILE CB . 50695 1 1202 . 1 . 1 275 275 ILE N N 15 120.653 0.74 . . . . . . . 533 ILE N . 50695 1 1203 . 1 . 1 276 276 LYS H H 1 8.107 0.71 . . . . . . . 534 LYS H . 50695 1 1204 . 1 . 1 276 276 LYS C C 13 177.207 0.00 . . . . . . . 534 LYS CO . 50695 1 1205 . 1 . 1 276 276 LYS CA C 13 60.558 0.01 . . . . . . . 534 LYS CA . 50695 1 1206 . 1 . 1 276 276 LYS CB C 13 30.868 0.12 . . . . . . . 534 LYS CB . 50695 1 1207 . 1 . 1 276 276 LYS N N 15 121.404 0.00 . . . . . . . 534 LYS N . 50695 1 1208 . 1 . 1 277 277 ASN H H 1 7.373 0.02 . . . . . . . 535 ASN H . 50695 1 1209 . 1 . 1 277 277 ASN C C 13 176.886 0.00 . . . . . . . 535 ASN CO . 50695 1 1210 . 1 . 1 277 277 ASN CA C 13 56.096 0.00 . . . . . . . 535 ASN CA . 50695 1 1211 . 1 . 1 277 277 ASN CB C 13 38.437 0.04 . . . . . . . 535 ASN CB . 50695 1 1212 . 1 . 1 277 277 ASN N N 15 116.705 2.82 . . . . . . . 535 ASN N . 50695 1 1213 . 1 . 1 278 278 ILE H H 1 7.534 0.23 . . . . . . . 536 ILE H . 50695 1 1214 . 1 . 1 278 278 ILE C C 13 177.459 0.00 . . . . . . . 536 ILE CO . 50695 1 1215 . 1 . 1 278 278 ILE CA C 13 64.787 0.01 . . . . . . . 536 ILE CA . 50695 1 1216 . 1 . 1 278 278 ILE CB C 13 36.904 0.00 . . . . . . . 536 ILE CB . 50695 1 1217 . 1 . 1 278 278 ILE N N 15 118.999 0.65 . . . . . . . 536 ILE N . 50695 1 1218 . 1 . 1 279 279 ILE H H 1 7.774 0.04 . . . . . . . 537 ILE H . 50695 1 1219 . 1 . 1 279 279 ILE C C 13 176.356 0.00 . . . . . . . 537 ILE CO . 50695 1 1220 . 1 . 1 279 279 ILE CA C 13 63.778 0.01 . . . . . . . 537 ILE CA . 50695 1 1221 . 1 . 1 279 279 ILE CB C 13 36.031 0.12 . . . . . . . 537 ILE CB . 50695 1 1222 . 1 . 1 279 279 ILE N N 15 118.185 0.00 . . . . . . . 537 ILE N . 50695 1 1223 . 1 . 1 280 280 ARG H H 1 7.686 0.05 . . . . . . . 538 ARG H . 50695 1 1224 . 1 . 1 280 280 ARG C C 13 177.354 0.00 . . . . . . . 538 ARG CO . 50695 1 1225 . 1 . 1 280 280 ARG CA C 13 57.410 0.00 . . . . . . . 538 ARG CA . 50695 1 1226 . 1 . 1 280 280 ARG CB C 13 29.937 0.03 . . . . . . . 538 ARG CB . 50695 1 1227 . 1 . 1 280 280 ARG N N 15 113.576 2.63 . . . . . . . 538 ARG N . 50695 1 1228 . 1 . 1 281 281 ASN H H 1 7.570 0.07 . . . . . . . 539 ASN H . 50695 1 1229 . 1 . 1 281 281 ASN C C 13 173.889 0.00 . . . . . . . 539 ASN CO . 50695 1 1230 . 1 . 1 281 281 ASN CA C 13 53.367 0.01 . . . . . . . 539 ASN CA . 50695 1 1231 . 1 . 1 281 281 ASN CB C 13 41.606 0.05 . . . . . . . 539 ASN CB . 50695 1 1232 . 1 . 1 281 281 ASN N N 15 118.921 2.73 . . . . . . . 539 ASN N . 50695 1 1233 . 1 . 1 282 282 VAL H H 1 7.974 0.47 . . . . . . . 540 VAL H . 50695 1 1234 . 1 . 1 282 282 VAL C C 13 172.718 0.00 . . . . . . . 540 VAL CO . 50695 1 1235 . 1 . 1 282 282 VAL CA C 13 60.832 0.00 . . . . . . . 540 VAL CA . 50695 1 1236 . 1 . 1 282 282 VAL CB C 13 33.671 0.06 . . . . . . . 540 VAL CB . 50695 1 1237 . 1 . 1 282 282 VAL N N 15 122.023 0.37 . . . . . . . 540 VAL N . 50695 1 1238 . 1 . 1 283 283 GLU H H 1 8.446 0.00 . . . . . . . 541 GLU H . 50695 1 1239 . 1 . 1 283 283 GLU CA C 13 57.298 0.00 . . . . . . . 541 GLU CA . 50695 1 1240 . 1 . 1 283 283 GLU CB C 13 29.159 0.00 . . . . . . . 541 GLU CB . 50695 1 1241 . 1 . 1 283 283 GLU N N 15 122.389 0.01 . . . . . . . 541 GLU N . 50695 1 1242 . 1 . 1 284 284 TYR H H 1 8.462 0.00 . . . . . . . 542 TYR H . 50695 1 1243 . 1 . 1 284 284 TYR C C 13 177.811 0.00 . . . . . . . 542 TYR CO . 50695 1 1244 . 1 . 1 284 284 TYR CA C 13 59.738 0.00 . . . . . . . 542 TYR CA . 50695 1 1245 . 1 . 1 284 284 TYR CB C 13 37.388 0.00 . . . . . . . 542 TYR CB . 50695 1 1246 . 1 . 1 284 284 TYR N N 15 115.934 0.00 . . . . . . . 542 TYR N . 50695 1 1247 . 1 . 1 285 285 GLU H H 1 7.488 0.97 . . . . . . . 543 GLU H . 50695 1 1248 . 1 . 1 285 285 GLU C C 13 179.031 0.00 . . . . . . . 543 GLU CO . 50695 1 1249 . 1 . 1 285 285 GLU CA C 13 59.215 0.04 . . . . . . . 543 GLU CA . 50695 1 1250 . 1 . 1 285 285 GLU CB C 13 28.776 0.04 . . . . . . . 543 GLU CB . 50695 1 1251 . 1 . 1 285 285 GLU N N 15 116.963 1.03 . . . . . . . 543 GLU N . 50695 1 1252 . 1 . 1 286 286 LYS H H 1 7.588 1.07 . . . . . . . 544 LYS H . 50695 1 1253 . 1 . 1 286 286 LYS C C 13 178.407 0.00 . . . . . . . 544 LYS CO . 50695 1 1254 . 1 . 1 286 286 LYS CA C 13 57.435 0.01 . . . . . . . 544 LYS CA . 50695 1 1255 . 1 . 1 286 286 LYS CB C 13 31.053 0.00 . . . . . . . 544 LYS CB . 50695 1 1256 . 1 . 1 286 286 LYS N N 15 120.792 2.78 . . . . . . . 544 LYS N . 50695 1 1257 . 1 . 1 287 287 ALA H H 1 8.583 0.08 . . . . . . . 545 ALA H . 50695 1 1258 . 1 . 1 287 287 ALA C C 13 179.609 0.00 . . . . . . . 545 ALA CO . 50695 1 1259 . 1 . 1 287 287 ALA CA C 13 54.799 0.01 . . . . . . . 545 ALA CA . 50695 1 1260 . 1 . 1 287 287 ALA CB C 13 17.462 0.02 . . . . . . . 545 ALA CB . 50695 1 1261 . 1 . 1 287 287 ALA N N 15 120.994 2.59 . . . . . . . 545 ALA N . 50695 1 1262 . 1 . 1 288 288 LYS H H 1 7.747 0.76 . . . . . . . 546 LYS H . 50695 1 1263 . 1 . 1 288 288 LYS C C 13 178.707 0.00 . . . . . . . 546 LYS CO . 50695 1 1264 . 1 . 1 288 288 LYS CA C 13 59.943 0.01 . . . . . . . 546 LYS CA . 50695 1 1265 . 1 . 1 288 288 LYS CB C 13 31.622 0.03 . . . . . . . 546 LYS CB . 50695 1 1266 . 1 . 1 288 288 LYS N N 15 119.104 0.71 . . . . . . . 546 LYS N . 50695 1 1267 . 1 . 1 289 289 GLU H H 1 7.515 0.52 . . . . . . . 547 GLU H . 50695 1 1268 . 1 . 1 289 289 GLU C C 13 179.535 0.00 . . . . . . . 547 GLU CO . 50695 1 1269 . 1 . 1 289 289 GLU CA C 13 58.803 0.00 . . . . . . . 547 GLU CA . 50695 1 1270 . 1 . 1 289 289 GLU CB C 13 28.928 0.01 . . . . . . . 547 GLU CB . 50695 1 1271 . 1 . 1 289 289 GLU N N 15 120.870 1.06 . . . . . . . 547 GLU N . 50695 1 1272 . 1 . 1 290 290 ILE H H 1 8.417 0.38 . . . . . . . 548 ILE H . 50695 1 1273 . 1 . 1 290 290 ILE C C 13 177.566 0.00 . . . . . . . 548 ILE CO . 50695 1 1274 . 1 . 1 290 290 ILE CA C 13 64.138 0.00 . . . . . . . 548 ILE CA . 50695 1 1275 . 1 . 1 290 290 ILE CB C 13 36.688 0.04 . . . . . . . 548 ILE CB . 50695 1 1276 . 1 . 1 290 290 ILE N N 15 122.075 0.13 . . . . . . . 548 ILE N . 50695 1 1277 . 1 . 1 291 291 ALA H H 1 8.881 0.08 . . . . . . . 549 ALA H . 50695 1 1278 . 1 . 1 291 291 ALA C C 13 179.165 0.00 . . . . . . . 549 ALA CO . 50695 1 1279 . 1 . 1 291 291 ALA CA C 13 55.344 0.03 . . . . . . . 549 ALA CA . 50695 1 1280 . 1 . 1 291 291 ALA CB C 13 17.498 0.03 . . . . . . . 549 ALA CB . 50695 1 1281 . 1 . 1 291 291 ALA N N 15 122.215 0.00 . . . . . . . 549 ALA N . 50695 1 1282 . 1 . 1 292 292 GLU H H 1 8.352 0.61 . . . . . . . 550 GLU H . 50695 1 1283 . 1 . 1 292 292 GLU C C 13 179.220 0.00 . . . . . . . 550 GLU CO . 50695 1 1284 . 1 . 1 292 292 GLU CA C 13 59.113 0.00 . . . . . . . 550 GLU CA . 50695 1 1285 . 1 . 1 292 292 GLU CB C 13 28.608 0.21 . . . . . . . 550 GLU CB . 50695 1 1286 . 1 . 1 292 292 GLU N N 15 117.769 1.79 . . . . . . . 550 GLU N . 50695 1 1287 . 1 . 1 293 293 LYS H H 1 8.120 0.38 . . . . . . . 551 LYS H . 50695 1 1288 . 1 . 1 293 293 LYS C C 13 180.288 0.00 . . . . . . . 551 LYS CO . 50695 1 1289 . 1 . 1 293 293 LYS CA C 13 59.306 0.02 . . . . . . . 551 LYS CA . 50695 1 1290 . 1 . 1 293 293 LYS CB C 13 31.380 0.06 . . . . . . . 551 LYS CB . 50695 1 1291 . 1 . 1 293 293 LYS N N 15 120.893 1.36 . . . . . . . 551 LYS N . 50695 1 1292 . 1 . 1 294 294 ALA H H 1 8.221 0.28 . . . . . . . 552 ALA H . 50695 1 1293 . 1 . 1 294 294 ALA C C 13 179.486 0.00 . . . . . . . 552 ALA CO . 50695 1 1294 . 1 . 1 294 294 ALA CA C 13 54.724 0.01 . . . . . . . 552 ALA CA . 50695 1 1295 . 1 . 1 294 294 ALA CB C 13 17.107 0.03 . . . . . . . 552 ALA CB . 50695 1 1296 . 1 . 1 294 294 ALA N N 15 122.545 0.00 . . . . . . . 552 ALA N . 50695 1 1297 . 1 . 1 295 295 LEU H H 1 7.678 0.26 . . . . . . . 553 LEU H . 50695 1 1298 . 1 . 1 295 295 LEU C C 13 177.553 0.00 . . . . . . . 553 LEU CO . 50695 1 1299 . 1 . 1 295 295 LEU CA C 13 56.715 0.00 . . . . . . . 553 LEU CA . 50695 1 1300 . 1 . 1 295 295 LEU CB C 13 40.846 0.04 . . . . . . . 553 LEU CB . 50695 1 1301 . 1 . 1 295 295 LEU N N 15 116.232 0.08 . . . . . . . 553 LEU N . 50695 1 1302 . 1 . 1 296 296 ASN H H 1 7.361 0.05 . . . . . . . 554 ASN H . 50695 1 1303 . 1 . 1 296 296 ASN C C 13 175.343 0.00 . . . . . . . 554 ASN CO . 50695 1 1304 . 1 . 1 296 296 ASN CA C 13 52.844 0.02 . . . . . . . 554 ASN CA . 50695 1 1305 . 1 . 1 296 296 ASN CB C 13 39.924 0.04 . . . . . . . 554 ASN CB . 50695 1 1306 . 1 . 1 296 296 ASN N N 15 118.865 2.56 . . . . . . . 554 ASN N . 50695 1 1307 . 1 . 1 297 297 MET H H 1 7.963 0.66 . . . . . . . 555 MET H . 50695 1 1308 . 1 . 1 297 297 MET C C 13 175.960 0.00 . . . . . . . 555 MET CO . 50695 1 1309 . 1 . 1 297 297 MET CA C 13 56.504 0.00 . . . . . . . 555 MET CA . 50695 1 1310 . 1 . 1 297 297 MET CB C 13 32.977 0.06 . . . . . . . 555 MET CB . 50695 1 1311 . 1 . 1 297 297 MET N N 15 121.445 0.00 . . . . . . . 555 MET N . 50695 1 1312 . 1 . 1 298 298 SER H H 1 7.981 0.64 . . . . . . . 556 SER H . 50695 1 1313 . 1 . 1 298 298 SER C C 13 173.174 0.00 . . . . . . . 556 SER CO . 50695 1 1314 . 1 . 1 298 298 SER CA C 13 59.638 0.00 . . . . . . . 556 SER CA . 50695 1 1315 . 1 . 1 298 298 SER CB C 13 64.549 0.00 . . . . . . . 556 SER CB . 50695 1 1316 . 1 . 1 298 298 SER N N 15 115.350 1.67 . . . . . . . 556 SER N . 50695 1 1317 . 1 . 1 299 299 GLU H H 1 8.182 0.84 . . . . . . . 557 GLU H . 50695 1 1318 . 1 . 1 299 299 GLU C C 13 176.272 0.00 . . . . . . . 557 GLU CO . 50695 1 1319 . 1 . 1 299 299 GLU CA C 13 54.348 0.01 . . . . . . . 557 GLU CA . 50695 1 1320 . 1 . 1 299 299 GLU CB C 13 32.654 0.05 . . . . . . . 557 GLU CB . 50695 1 1321 . 1 . 1 299 299 GLU N N 15 117.014 0.00 . . . . . . . 557 GLU N . 50695 1 1322 . 1 . 1 300 300 ALA H H 1 8.997 0.03 . . . . . . . 558 ALA H . 50695 1 1323 . 1 . 1 300 300 ALA C C 13 179.606 0.00 . . . . . . . 558 ALA CO . 50695 1 1324 . 1 . 1 300 300 ALA CA C 13 55.153 0.01 . . . . . . . 558 ALA CA . 50695 1 1325 . 1 . 1 300 300 ALA CB C 13 18.004 0.04 . . . . . . . 558 ALA CB . 50695 1 1326 . 1 . 1 300 300 ALA N N 15 127.664 0.00 . . . . . . . 558 ALA N . 50695 1 1327 . 1 . 1 301 301 GLU H H 1 7.977 0.99 . . . . . . . 559 GLU H . 50695 1 1328 . 1 . 1 301 301 GLU C C 13 178.991 0.00 . . . . . . . 559 GLU CO . 50695 1 1329 . 1 . 1 301 301 GLU CA C 13 59.117 0.00 . . . . . . . 559 GLU CA . 50695 1 1330 . 1 . 1 301 301 GLU CB C 13 28.934 0.03 . . . . . . . 559 GLU CB . 50695 1 1331 . 1 . 1 301 301 GLU N N 15 116.597 0.42 . . . . . . . 559 GLU N . 50695 1 1332 . 1 . 1 302 302 GLU H H 1 7.210 0.22 . . . . . . . 560 GLU H . 50695 1 1333 . 1 . 1 302 302 GLU C C 13 179.414 0.00 . . . . . . . 560 GLU CO . 50695 1 1334 . 1 . 1 302 302 GLU CA C 13 58.183 0.03 . . . . . . . 560 GLU CA . 50695 1 1335 . 1 . 1 302 302 GLU CB C 13 29.123 0.06 . . . . . . . 560 GLU CB . 50695 1 1336 . 1 . 1 302 302 GLU N N 15 117.014 0.00 . . . . . . . 560 GLU N . 50695 1 1337 . 1 . 1 303 303 ILE H H 1 7.433 0.00 . . . . . . . 561 ILE H . 50695 1 1338 . 1 . 1 303 303 ILE CA C 13 65.576 0.00 . . . . . . . 561 ILE CA . 50695 1 1339 . 1 . 1 303 303 ILE CB C 13 37.519 0.00 . . . . . . . 561 ILE CB . 50695 1 1340 . 1 . 1 303 303 ILE N N 15 123.182 0.02 . . . . . . . 561 ILE N . 50695 1 1341 . 1 . 1 304 304 GLU H H 1 7.952 0.00 . . . . . . . 562 GLU H . 50695 1 1342 . 1 . 1 304 304 GLU C C 13 178.454 0.00 . . . . . . . 562 GLU CO . 50695 1 1343 . 1 . 1 304 304 GLU CA C 13 60.255 0.00 . . . . . . . 562 GLU CA . 50695 1 1344 . 1 . 1 304 304 GLU CB C 13 29.022 0.00 . . . . . . . 562 GLU CB . 50695 1 1345 . 1 . 1 304 304 GLU N N 15 117.729 0.02 . . . . . . . 562 GLU N . 50695 1 1346 . 1 . 1 305 305 LYS H H 1 7.789 0.17 . . . . . . . 563 LYS H . 50695 1 1347 . 1 . 1 305 305 LYS C C 13 179.295 0.00 . . . . . . . 563 LYS CO . 50695 1 1348 . 1 . 1 305 305 LYS CA C 13 59.797 0.03 . . . . . . . 563 LYS CA . 50695 1 1349 . 1 . 1 305 305 LYS CB C 13 31.591 0.03 . . . . . . . 563 LYS CB . 50695 1 1350 . 1 . 1 305 305 LYS N N 15 118.632 0.93 . . . . . . . 563 LYS N . 50695 1 1351 . 1 . 1 306 306 MET H H 1 7.849 0.28 . . . . . . . 564 MET H . 50695 1 1352 . 1 . 1 306 306 MET C C 13 178.811 0.00 . . . . . . . 564 MET CO . 50695 1 1353 . 1 . 1 306 306 MET CA C 13 58.590 0.02 . . . . . . . 564 MET CA . 50695 1 1354 . 1 . 1 306 306 MET CB C 13 31.545 0.00 . . . . . . . 564 MET CB . 50695 1 1355 . 1 . 1 306 306 MET N N 15 118.700 1.08 . . . . . . . 564 MET N . 50695 1 1356 . 1 . 1 307 307 MET H H 1 8.230 0.03 . . . . . . . 565 MET H . 50695 1 1357 . 1 . 1 307 307 MET C C 13 179.054 0.00 . . . . . . . 565 MET CO . 50695 1 1358 . 1 . 1 307 307 MET CA C 13 55.833 0.01 . . . . . . . 565 MET CA . 50695 1 1359 . 1 . 1 307 307 MET CB C 13 28.714 0.00 . . . . . . . 565 MET CB . 50695 1 1360 . 1 . 1 307 307 MET N N 15 119.605 1.83 . . . . . . . 565 MET N . 50695 1 1361 . 1 . 1 308 308 LYS H H 1 7.772 0.48 . . . . . . . 566 LYS H . 50695 1 1362 . 1 . 1 308 308 LYS C C 13 179.211 0.00 . . . . . . . 566 LYS CO . 50695 1 1363 . 1 . 1 308 308 LYS CA C 13 59.561 0.01 . . . . . . . 566 LYS CA . 50695 1 1364 . 1 . 1 308 308 LYS CB C 13 31.451 0.08 . . . . . . . 566 LYS CB . 50695 1 1365 . 1 . 1 308 308 LYS N N 15 120.023 1.08 . . . . . . . 566 LYS N . 50695 1 1366 . 1 . 1 309 309 ASP H H 1 7.651 0.36 . . . . . . . 567 ASP H . 50695 1 1367 . 1 . 1 309 309 ASP C C 13 178.463 0.00 . . . . . . . 567 ASP CO . 50695 1 1368 . 1 . 1 309 309 ASP CA C 13 56.722 0.01 . . . . . . . 567 ASP CA . 50695 1 1369 . 1 . 1 309 309 ASP CB C 13 40.330 0.12 . . . . . . . 567 ASP CB . 50695 1 1370 . 1 . 1 309 309 ASP N N 15 120.026 1.09 . . . . . . . 567 ASP N . 50695 1 1371 . 1 . 1 310 310 VAL H H 1 7.960 0.05 . . . . . . . 568 VAL H . 50695 1 1372 . 1 . 1 310 310 VAL C C 13 174.541 0.00 . . . . . . . 568 VAL CO . 50695 1 1373 . 1 . 1 310 310 VAL CA C 13 65.528 0.01 . . . . . . . 568 VAL CA . 50695 1 1374 . 1 . 1 310 310 VAL CB C 13 31.238 0.05 . . . . . . . 568 VAL CB . 50695 1 1375 . 1 . 1 310 310 VAL N N 15 121.124 0.00 . . . . . . . 568 VAL N . 50695 1 1376 . 1 . 1 311 311 ILE H H 1 7.653 0.26 . . . . . . . 569 ILE H . 50695 1 1377 . 1 . 1 311 311 ILE C C 13 178.318 0.00 . . . . . . . 569 ILE CO . 50695 1 1378 . 1 . 1 311 311 ILE CA C 13 61.916 0.01 . . . . . . . 569 ILE CA . 50695 1 1379 . 1 . 1 311 311 ILE CB C 13 36.809 0.04 . . . . . . . 569 ILE CB . 50695 1 1380 . 1 . 1 311 311 ILE N N 15 113.919 0.00 . . . . . . . 569 ILE N . 50695 1 1381 . 1 . 1 312 312 LYS H H 1 7.542 0.15 . . . . . . . 570 LYS H . 50695 1 1382 . 1 . 1 312 312 LYS C C 13 177.335 0.00 . . . . . . . 570 LYS CO . 50695 1 1383 . 1 . 1 312 312 LYS CA C 13 58.547 0.01 . . . . . . . 570 LYS CA . 50695 1 1384 . 1 . 1 312 312 LYS CB C 13 31.248 0.01 . . . . . . . 570 LYS CB . 50695 1 1385 . 1 . 1 312 312 LYS N N 15 120.031 2.14 . . . . . . . 570 LYS N . 50695 1 1386 . 1 . 1 313 313 ASP H H 1 7.575 0.11 . . . . . . . 571 ASP H . 50695 1 1387 . 1 . 1 313 313 ASP C C 13 176.553 0.00 . . . . . . . 571 ASP CO . 50695 1 1388 . 1 . 1 313 313 ASP CA C 13 54.674 0.01 . . . . . . . 571 ASP CA . 50695 1 1389 . 1 . 1 313 313 ASP CB C 13 40.959 0.08 . . . . . . . 571 ASP CB . 50695 1 1390 . 1 . 1 313 313 ASP N N 15 118.876 0.99 . . . . . . . 571 ASP N . 50695 1 1391 . 1 . 1 314 314 ILE H H 1 7.638 0.18 . . . . . . . 572 ILE H . 50695 1 1392 . 1 . 1 314 314 ILE C C 13 175.771 0.00 . . . . . . . 572 ILE CO . 50695 1 1393 . 1 . 1 314 314 ILE CA C 13 62.039 0.00 . . . . . . . 572 ILE CA . 50695 1 1394 . 1 . 1 314 314 ILE CB C 13 37.686 0.05 . . . . . . . 572 ILE CB . 50695 1 1395 . 1 . 1 314 314 ILE N N 15 118.868 0.98 . . . . . . . 572 ILE N . 50695 1 1396 . 1 . 1 315 315 GLY H H 1 7.815 0.00 . . . . . . . 573 GLY H . 50695 1 1397 . 1 . 1 315 315 GLY CA C 13 45.803 0.00 . . . . . . . 573 GLY CA . 50695 1 1398 . 1 . 1 315 315 GLY N N 15 117.883 0.01 . . . . . . . 573 GLY N . 50695 1 stop_ save_