data_18428 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18428 _Entry.Title ; N0N1 domains of Neisseria meningitidis Pilus assembly protein PilQ ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-04-27 _Entry.Accession_date 2012-04-27 _Entry.Last_release_date 2013-01-03 _Entry.Original_release_date 2013-01-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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.Entry_ID 1 Marie Phelan . M. . 18428 2 Jamie-Lee Berry . . . 18428 3 jeremy Derrick . P. . 18428 4 Lu-Yun Lian . . . 18428 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18428 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Lian Group' 'NMR Centre for Structural Biology, Biological Sciences, University of Liverpool, Crown Street, Liverpool, L69 7ZB, UK' 18428 2 . 'Derrick Group' 'Michael Smith Building, Oxford Road, University of Manchester, Manchester, M13 9PT' 18428 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18428 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 721 18428 '15N chemical shifts' 209 18428 '1H chemical shifts' 965 18428 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 . . 2013-01-03 2012-04-27 original author . 18428 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18428 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23028322 _Citation.Full_citation . _Citation.Title 'Structure and assembly of a trans-periplasmic channel for type IV pili in Neisseria meningitidis.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'PLoS Pathog.' _Citation.Journal_name_full 'PLoS pathogens' _Citation.Journal_volume 8 _Citation.Journal_issue 9 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2012 _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.Entry_ID _Citation_author.Citation_ID 1 Jamie-Lee Berry . . . 18428 1 2 Marie Phelan . M. . 18428 1 3 Richard Collins . F. . 18428 1 4 Tomas Adomavicius . . . 18428 1 5 Tone Tnjum . . . 18428 1 6 Stefan Frye . A. . 18428 1 7 Louise Bird . . . 18428 1 8 Ray Owens . . . 18428 1 9 Robert Ford . C. . 18428 1 10 Lu-Yun Lian . . . 18428 1 11 Jeremy Derrick . P. . 18428 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Neisseria meningitidis.' 18428 1 PilQ 18428 1 secretion 18428 1 T2SS 18428 1 'Type iv pilus' 18428 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18428 _Assembly.ID 1 _Assembly.Name PilQ _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 26149.8016 _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 PilQ_N0N1 1 $PilQ_N0N1 A . yes native no no . . . 18428 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PilQ_N0N1 _Entity.Sf_category entity _Entity.Sf_framecode PilQ_N0N1 _Entity.Entry_ID 18428 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PilQ_N0N1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSSHHHHHHSSGLVPRGSH MASMTGGQQMGRGSFTGRKI SLDFQDVEIRTILQILAKES GMNIVASDSVNGKMTLSLKD VPWDQALDLVMQARNLDMRQ QGNIVNIAPRDELLAKDKAF LQAEKDIADLGALYSQNFQL KYKNVEEFRSILRLDNADTT GNRNTLVSGRGSVLIDPATN TLIVTDTRSVIEKFRKLIDE LDVPAQQVMIEARIVEAADG FSRDLGVKFGATGKKKL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'M309 - L545' _Entity.Polymer_author_seq_details ; M309-S342 = non-native purification tag F343-L545 PilQ N0N1 domains ; _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 237 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'Domains N0N1' _Entity.Mutation ; natural variant L428F ; _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 26149.8016 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UniProt Q70M91 . Q70M91 . . . . . . . . . . . . . . 18428 1 2 no EMBL CAM09716 . "pilus secretin [Neisseria meningitidis FAM18]" . . . . . 85.23 589 100.00 100.00 2.57e-137 . . . . 18428 1 3 no EMBL CKK77493 . "type IV pilus secretin PilQ [Neisseria meningitidis]" . . . . . 86.08 434 99.51 100.00 4.30e-140 . . . . 18428 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'secretion channel' 18428 1 'type IV pilus secretin' 18428 1 stop_ 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 1 309 MET . 18428 1 2 310 GLY . 18428 1 3 311 SER . 18428 1 4 312 SER . 18428 1 5 313 HIS . 18428 1 6 314 HIS . 18428 1 7 315 HIS . 18428 1 8 316 HIS . 18428 1 9 317 HIS . 18428 1 10 318 HIS . 18428 1 11 319 SER . 18428 1 12 320 SER . 18428 1 13 321 GLY . 18428 1 14 322 LEU . 18428 1 15 323 VAL . 18428 1 16 324 PRO . 18428 1 17 325 ARG . 18428 1 18 326 GLY . 18428 1 19 327 SER . 18428 1 20 328 HIS . 18428 1 21 329 MET . 18428 1 22 330 ALA . 18428 1 23 331 SER . 18428 1 24 332 MET . 18428 1 25 333 THR . 18428 1 26 334 GLY . 18428 1 27 335 GLY . 18428 1 28 336 GLN . 18428 1 29 337 GLN . 18428 1 30 338 MET . 18428 1 31 339 GLY . 18428 1 32 340 ARG . 18428 1 33 341 GLY . 18428 1 34 342 SER . 18428 1 35 343 PHE . 18428 1 36 344 THR . 18428 1 37 345 GLY . 18428 1 38 346 ARG . 18428 1 39 347 LYS . 18428 1 40 348 ILE . 18428 1 41 349 SER . 18428 1 42 350 LEU . 18428 1 43 351 ASP . 18428 1 44 352 PHE . 18428 1 45 353 GLN . 18428 1 46 354 ASP . 18428 1 47 355 VAL . 18428 1 48 356 GLU . 18428 1 49 357 ILE . 18428 1 50 358 ARG . 18428 1 51 359 THR . 18428 1 52 360 ILE . 18428 1 53 361 LEU . 18428 1 54 362 GLN . 18428 1 55 363 ILE . 18428 1 56 364 LEU . 18428 1 57 365 ALA . 18428 1 58 366 LYS . 18428 1 59 367 GLU . 18428 1 60 368 SER . 18428 1 61 369 GLY . 18428 1 62 370 MET . 18428 1 63 371 ASN . 18428 1 64 372 ILE . 18428 1 65 373 VAL . 18428 1 66 374 ALA . 18428 1 67 375 SER . 18428 1 68 376 ASP . 18428 1 69 377 SER . 18428 1 70 378 VAL . 18428 1 71 379 ASN . 18428 1 72 380 GLY . 18428 1 73 381 LYS . 18428 1 74 382 MET . 18428 1 75 383 THR . 18428 1 76 384 LEU . 18428 1 77 385 SER . 18428 1 78 386 LEU . 18428 1 79 387 LYS . 18428 1 80 388 ASP . 18428 1 81 389 VAL . 18428 1 82 390 PRO . 18428 1 83 391 TRP . 18428 1 84 392 ASP . 18428 1 85 393 GLN . 18428 1 86 394 ALA . 18428 1 87 395 LEU . 18428 1 88 396 ASP . 18428 1 89 397 LEU . 18428 1 90 398 VAL . 18428 1 91 399 MET . 18428 1 92 400 GLN . 18428 1 93 401 ALA . 18428 1 94 402 ARG . 18428 1 95 403 ASN . 18428 1 96 404 LEU . 18428 1 97 405 ASP . 18428 1 98 406 MET . 18428 1 99 407 ARG . 18428 1 100 408 GLN . 18428 1 101 409 GLN . 18428 1 102 410 GLY . 18428 1 103 411 ASN . 18428 1 104 412 ILE . 18428 1 105 413 VAL . 18428 1 106 414 ASN . 18428 1 107 415 ILE . 18428 1 108 416 ALA . 18428 1 109 417 PRO . 18428 1 110 418 ARG . 18428 1 111 419 ASP . 18428 1 112 420 GLU . 18428 1 113 421 LEU . 18428 1 114 422 LEU . 18428 1 115 423 ALA . 18428 1 116 424 LYS . 18428 1 117 425 ASP . 18428 1 118 426 LYS . 18428 1 119 427 ALA . 18428 1 120 428 PHE . 18428 1 121 429 LEU . 18428 1 122 430 GLN . 18428 1 123 431 ALA . 18428 1 124 432 GLU . 18428 1 125 433 LYS . 18428 1 126 434 ASP . 18428 1 127 435 ILE . 18428 1 128 436 ALA . 18428 1 129 437 ASP . 18428 1 130 438 LEU . 18428 1 131 439 GLY . 18428 1 132 440 ALA . 18428 1 133 441 LEU . 18428 1 134 442 TYR . 18428 1 135 443 SER . 18428 1 136 444 GLN . 18428 1 137 445 ASN . 18428 1 138 446 PHE . 18428 1 139 447 GLN . 18428 1 140 448 LEU . 18428 1 141 449 LYS . 18428 1 142 450 TYR . 18428 1 143 451 LYS . 18428 1 144 452 ASN . 18428 1 145 453 VAL . 18428 1 146 454 GLU . 18428 1 147 455 GLU . 18428 1 148 456 PHE . 18428 1 149 457 ARG . 18428 1 150 458 SER . 18428 1 151 459 ILE . 18428 1 152 460 LEU . 18428 1 153 461 ARG . 18428 1 154 462 LEU . 18428 1 155 463 ASP . 18428 1 156 464 ASN . 18428 1 157 465 ALA . 18428 1 158 466 ASP . 18428 1 159 467 THR . 18428 1 160 468 THR . 18428 1 161 469 GLY . 18428 1 162 470 ASN . 18428 1 163 471 ARG . 18428 1 164 472 ASN . 18428 1 165 473 THR . 18428 1 166 474 LEU . 18428 1 167 475 VAL . 18428 1 168 476 SER . 18428 1 169 477 GLY . 18428 1 170 478 ARG . 18428 1 171 479 GLY . 18428 1 172 480 SER . 18428 1 173 481 VAL . 18428 1 174 482 LEU . 18428 1 175 483 ILE . 18428 1 176 484 ASP . 18428 1 177 485 PRO . 18428 1 178 486 ALA . 18428 1 179 487 THR . 18428 1 180 488 ASN . 18428 1 181 489 THR . 18428 1 182 490 LEU . 18428 1 183 491 ILE . 18428 1 184 492 VAL . 18428 1 185 493 THR . 18428 1 186 494 ASP . 18428 1 187 495 THR . 18428 1 188 496 ARG . 18428 1 189 497 SER . 18428 1 190 498 VAL . 18428 1 191 499 ILE . 18428 1 192 500 GLU . 18428 1 193 501 LYS . 18428 1 194 502 PHE . 18428 1 195 503 ARG . 18428 1 196 504 LYS . 18428 1 197 505 LEU . 18428 1 198 506 ILE . 18428 1 199 507 ASP . 18428 1 200 508 GLU . 18428 1 201 509 LEU . 18428 1 202 510 ASP . 18428 1 203 511 VAL . 18428 1 204 512 PRO . 18428 1 205 513 ALA . 18428 1 206 514 GLN . 18428 1 207 515 GLN . 18428 1 208 516 VAL . 18428 1 209 517 MET . 18428 1 210 518 ILE . 18428 1 211 519 GLU . 18428 1 212 520 ALA . 18428 1 213 521 ARG . 18428 1 214 522 ILE . 18428 1 215 523 VAL . 18428 1 216 524 GLU . 18428 1 217 525 ALA . 18428 1 218 526 ALA . 18428 1 219 527 ASP . 18428 1 220 528 GLY . 18428 1 221 529 PHE . 18428 1 222 530 SER . 18428 1 223 531 ARG . 18428 1 224 532 ASP . 18428 1 225 533 LEU . 18428 1 226 534 GLY . 18428 1 227 535 VAL . 18428 1 228 536 LYS . 18428 1 229 537 PHE . 18428 1 230 538 GLY . 18428 1 231 539 ALA . 18428 1 232 540 THR . 18428 1 233 541 GLY . 18428 1 234 542 LYS . 18428 1 235 543 LYS . 18428 1 236 544 LYS . 18428 1 237 545 LEU . 18428 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 18428 1 . GLY 2 2 18428 1 . SER 3 3 18428 1 . SER 4 4 18428 1 . HIS 5 5 18428 1 . HIS 6 6 18428 1 . HIS 7 7 18428 1 . HIS 8 8 18428 1 . HIS 9 9 18428 1 . HIS 10 10 18428 1 . SER 11 11 18428 1 . SER 12 12 18428 1 . GLY 13 13 18428 1 . LEU 14 14 18428 1 . VAL 15 15 18428 1 . PRO 16 16 18428 1 . ARG 17 17 18428 1 . GLY 18 18 18428 1 . SER 19 19 18428 1 . HIS 20 20 18428 1 . MET 21 21 18428 1 . ALA 22 22 18428 1 . SER 23 23 18428 1 . MET 24 24 18428 1 . THR 25 25 18428 1 . GLY 26 26 18428 1 . GLY 27 27 18428 1 . GLN 28 28 18428 1 . GLN 29 29 18428 1 . MET 30 30 18428 1 . GLY 31 31 18428 1 . ARG 32 32 18428 1 . GLY 33 33 18428 1 . SER 34 34 18428 1 . PHE 35 35 18428 1 . THR 36 36 18428 1 . GLY 37 37 18428 1 . ARG 38 38 18428 1 . LYS 39 39 18428 1 . ILE 40 40 18428 1 . SER 41 41 18428 1 . LEU 42 42 18428 1 . ASP 43 43 18428 1 . PHE 44 44 18428 1 . GLN 45 45 18428 1 . ASP 46 46 18428 1 . VAL 47 47 18428 1 . GLU 48 48 18428 1 . ILE 49 49 18428 1 . ARG 50 50 18428 1 . THR 51 51 18428 1 . ILE 52 52 18428 1 . LEU 53 53 18428 1 . GLN 54 54 18428 1 . ILE 55 55 18428 1 . LEU 56 56 18428 1 . ALA 57 57 18428 1 . LYS 58 58 18428 1 . GLU 59 59 18428 1 . SER 60 60 18428 1 . GLY 61 61 18428 1 . MET 62 62 18428 1 . ASN 63 63 18428 1 . ILE 64 64 18428 1 . VAL 65 65 18428 1 . ALA 66 66 18428 1 . SER 67 67 18428 1 . ASP 68 68 18428 1 . SER 69 69 18428 1 . VAL 70 70 18428 1 . ASN 71 71 18428 1 . GLY 72 72 18428 1 . LYS 73 73 18428 1 . MET 74 74 18428 1 . THR 75 75 18428 1 . LEU 76 76 18428 1 . SER 77 77 18428 1 . LEU 78 78 18428 1 . LYS 79 79 18428 1 . ASP 80 80 18428 1 . VAL 81 81 18428 1 . PRO 82 82 18428 1 . TRP 83 83 18428 1 . ASP 84 84 18428 1 . GLN 85 85 18428 1 . ALA 86 86 18428 1 . LEU 87 87 18428 1 . ASP 88 88 18428 1 . LEU 89 89 18428 1 . VAL 90 90 18428 1 . MET 91 91 18428 1 . GLN 92 92 18428 1 . ALA 93 93 18428 1 . ARG 94 94 18428 1 . ASN 95 95 18428 1 . LEU 96 96 18428 1 . ASP 97 97 18428 1 . MET 98 98 18428 1 . ARG 99 99 18428 1 . GLN 100 100 18428 1 . GLN 101 101 18428 1 . GLY 102 102 18428 1 . ASN 103 103 18428 1 . ILE 104 104 18428 1 . VAL 105 105 18428 1 . ASN 106 106 18428 1 . ILE 107 107 18428 1 . ALA 108 108 18428 1 . PRO 109 109 18428 1 . ARG 110 110 18428 1 . ASP 111 111 18428 1 . GLU 112 112 18428 1 . LEU 113 113 18428 1 . LEU 114 114 18428 1 . ALA 115 115 18428 1 . LYS 116 116 18428 1 . ASP 117 117 18428 1 . LYS 118 118 18428 1 . ALA 119 119 18428 1 . PHE 120 120 18428 1 . LEU 121 121 18428 1 . GLN 122 122 18428 1 . ALA 123 123 18428 1 . GLU 124 124 18428 1 . LYS 125 125 18428 1 . ASP 126 126 18428 1 . ILE 127 127 18428 1 . ALA 128 128 18428 1 . ASP 129 129 18428 1 . LEU 130 130 18428 1 . GLY 131 131 18428 1 . ALA 132 132 18428 1 . LEU 133 133 18428 1 . TYR 134 134 18428 1 . SER 135 135 18428 1 . GLN 136 136 18428 1 . ASN 137 137 18428 1 . PHE 138 138 18428 1 . GLN 139 139 18428 1 . LEU 140 140 18428 1 . LYS 141 141 18428 1 . TYR 142 142 18428 1 . LYS 143 143 18428 1 . ASN 144 144 18428 1 . VAL 145 145 18428 1 . GLU 146 146 18428 1 . GLU 147 147 18428 1 . PHE 148 148 18428 1 . ARG 149 149 18428 1 . SER 150 150 18428 1 . ILE 151 151 18428 1 . LEU 152 152 18428 1 . ARG 153 153 18428 1 . LEU 154 154 18428 1 . ASP 155 155 18428 1 . ASN 156 156 18428 1 . ALA 157 157 18428 1 . ASP 158 158 18428 1 . THR 159 159 18428 1 . THR 160 160 18428 1 . GLY 161 161 18428 1 . ASN 162 162 18428 1 . ARG 163 163 18428 1 . ASN 164 164 18428 1 . THR 165 165 18428 1 . LEU 166 166 18428 1 . VAL 167 167 18428 1 . SER 168 168 18428 1 . GLY 169 169 18428 1 . ARG 170 170 18428 1 . GLY 171 171 18428 1 . SER 172 172 18428 1 . VAL 173 173 18428 1 . LEU 174 174 18428 1 . ILE 175 175 18428 1 . ASP 176 176 18428 1 . PRO 177 177 18428 1 . ALA 178 178 18428 1 . THR 179 179 18428 1 . ASN 180 180 18428 1 . THR 181 181 18428 1 . LEU 182 182 18428 1 . ILE 183 183 18428 1 . VAL 184 184 18428 1 . THR 185 185 18428 1 . ASP 186 186 18428 1 . THR 187 187 18428 1 . ARG 188 188 18428 1 . SER 189 189 18428 1 . VAL 190 190 18428 1 . ILE 191 191 18428 1 . GLU 192 192 18428 1 . LYS 193 193 18428 1 . PHE 194 194 18428 1 . ARG 195 195 18428 1 . LYS 196 196 18428 1 . LEU 197 197 18428 1 . ILE 198 198 18428 1 . ASP 199 199 18428 1 . GLU 200 200 18428 1 . LEU 201 201 18428 1 . ASP 202 202 18428 1 . VAL 203 203 18428 1 . PRO 204 204 18428 1 . ALA 205 205 18428 1 . GLN 206 206 18428 1 . GLN 207 207 18428 1 . VAL 208 208 18428 1 . MET 209 209 18428 1 . ILE 210 210 18428 1 . GLU 211 211 18428 1 . ALA 212 212 18428 1 . ARG 213 213 18428 1 . ILE 214 214 18428 1 . VAL 215 215 18428 1 . GLU 216 216 18428 1 . ALA 217 217 18428 1 . ALA 218 218 18428 1 . ASP 219 219 18428 1 . GLY 220 220 18428 1 . PHE 221 221 18428 1 . SER 222 222 18428 1 . ARG 223 223 18428 1 . ASP 224 224 18428 1 . LEU 225 225 18428 1 . GLY 226 226 18428 1 . VAL 227 227 18428 1 . LYS 228 228 18428 1 . PHE 229 229 18428 1 . GLY 230 230 18428 1 . ALA 231 231 18428 1 . THR 232 232 18428 1 . GLY 233 233 18428 1 . LYS 234 234 18428 1 . LYS 235 235 18428 1 . LYS 236 236 18428 1 . LEU 237 237 18428 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 18428 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PilQ_N0N1 . 487 organism . 'Neisseria meningitidis' 'Neisseria meningitidis' . . Bacteria . Neisseria meningitidis . . . . . . . . . . . . . . . . . . . . . 18428 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 18428 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PilQ_N0N1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET28a . . . 'non-native purification tag 308-342' . . 18428 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18428 _Sample.ID 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 PilQ_N0N1 '[U-98% 13C; U-98% 15N]' . . 1 $PilQ_N0N1 . . 600 . . uM 100 . . . 18428 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM 1 . . . 18428 1 3 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM 1 . . . 18428 1 4 'sodium azide' 'natural abundance' . . . . . . 0.2 . . % 0.02 . . . 18428 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18428 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18428 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 18428 _Sample_condition_list.ID 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 'ionic strength' 100 . mM 18428 1 pH 6.8 . pH 18428 1 pressure 1 . atm 18428 1 temperature 298 . K 18428 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 18428 _Software.ID 1 _Software.Name ANALYSIS _Software.Version 2.1 _Software.Details 'The CCPN NMR assignment and data analysis application' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk 18428 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18428 1 'data analysis' 18428 1 'peak picking' 18428 1 stop_ save_ save_Topspin _Software.Sf_category software _Software.Sf_framecode Topspin _Software.Entry_ID 18428 _Software.ID 2 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 18428 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Processing and acquisition' 18428 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18428 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'equipped with TCI cryporobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18428 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'equipped with TCI cryporobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18428 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 'equipped with TCI cryporobe' . . 18428 1 2 spectrometer_2 Bruker Avance . 800 'equipped with TCI cryporobe' . . 18428 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 18428 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_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.Entry_ID _Experiment.Experiment_list_ID 1 'CBCACONH (H[N[co[{CA|ca[C]}]]])' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 3 'HNCACO (H[N[ca[CO]]])' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 5 '2D 1H-15N HSQC/HMQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 6 '2D 1H-13C HSQC/HMQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 7 '2D 1H-13C HSQC/HMQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 8 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 9 'hbhaconh (H[N[co[{ca[H]|ca[c[H]]}]]])' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 10 'hbhanh (H[N[{ca[H]|ca[c[H]}]])' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 11 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18428 1 12 '2D 1H-13C HSQC/HMQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 13 'Cb_Hd (hbCBcgcdHD)' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 14 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 15 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 16 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18428 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18428 _Chem_shift_reference.ID 1 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18428 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18428 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18428 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 18428 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 'CBCACONH (H[N[co[{CA|ca[C]}]]])' 1 $sample_1 isotropic 18428 1 2 '3D HNCACB' 1 $sample_1 isotropic 18428 1 3 'HNCACO (H[N[ca[CO]]])' 1 $sample_1 isotropic 18428 1 4 '3D HNCO' 1 $sample_1 isotropic 18428 1 5 '2D 1H-15N HSQC/HMQC' 1 $sample_1 isotropic 18428 1 6 '2D 1H-13C HSQC/HMQC' 1 $sample_1 isotropic 18428 1 8 '3D HNCA' 1 $sample_1 isotropic 18428 1 9 'hbhaconh (H[N[co[{ca[H]|ca[c[H]]}]]])' 1 $sample_1 isotropic 18428 1 10 'hbhanh (H[N[{ca[H]|ca[c[H]}]])' 1 $sample_1 isotropic 18428 1 11 '3D HCCH-TOCSY' 1 $sample_1 isotropic 18428 1 13 'Cb_Hd (hbCBcgcdHD)' 1 $sample_1 isotropic 18428 1 15 '2D 1H-13C HSQC aliphatic' 1 $sample_1 isotropic 18428 1 16 '2D 1H-13C HSQC aromatic' 1 $sample_1 isotropic 18428 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 GLY H H 1 8.519 0.001 . 1 . 310 . . 2 GLY H . 18428 1 2 . 1 1 2 2 GLY N N 15 110.636 0.007 . 1 . 310 . . 2 GLY N . 18428 1 3 . 1 1 3 3 SER H H 1 8.252 0.003 . 1 . 311 . . 3 SER H . 18428 1 4 . 1 1 3 3 SER N N 15 115.597 0.013 . 1 . 311 . . 3 SER N . 18428 1 5 . 1 1 10 10 HIS C C 13 174.168 0.005 . 1 . 318 . . 10 HIS C . 18428 1 6 . 1 1 11 11 SER H H 1 8.165 0.004 . 1 . 319 . . 11 SER H . 18428 1 7 . 1 1 11 11 SER HA H 1 4.387 0.001 . 1 . 319 . . 11 SER HA . 18428 1 8 . 1 1 11 11 SER HB2 H 1 3.759 0.001 . 2 . 319 . . 11 SER HB2 . 18428 1 9 . 1 1 11 11 SER HB3 H 1 3.801 0.001 . 2 . 319 . . 11 SER HB3 . 18428 1 10 . 1 1 11 11 SER C C 13 174.623 0.001 . 1 . 319 . . 11 SER C . 18428 1 11 . 1 1 11 11 SER CA C 13 58.461 0.065 . 1 . 319 . . 11 SER CA . 18428 1 12 . 1 1 11 11 SER CB C 13 63.846 0.046 . 1 . 319 . . 11 SER CB . 18428 1 13 . 1 1 11 11 SER N N 15 115.524 0.023 . 1 . 319 . . 11 SER N . 18428 1 14 . 1 1 12 12 SER H H 1 8.410 0.004 . 1 . 320 . . 12 SER H . 18428 1 15 . 1 1 12 12 SER HA H 1 4.375 0.001 . 1 . 320 . . 12 SER HA . 18428 1 16 . 1 1 12 12 SER HB2 H 1 3.824 0.001 . 2 . 320 . . 12 SER HB2 . 18428 1 17 . 1 1 12 12 SER C C 13 174.858 0.035 . 1 . 320 . . 12 SER C . 18428 1 18 . 1 1 12 12 SER CA C 13 58.628 0.001 . 1 . 320 . . 12 SER CA . 18428 1 19 . 1 1 12 12 SER CB C 13 63.854 0.009 . 1 . 320 . . 12 SER CB . 18428 1 20 . 1 1 12 12 SER N N 15 118.000 0.027 . 1 . 320 . . 12 SER N . 18428 1 21 . 1 1 13 13 GLY H H 1 8.319 0.001 . 1 . 321 . . 13 GLY H . 18428 1 22 . 1 1 13 13 GLY HA2 H 1 3.877 0.001 . 2 . 321 . . 13 GLY HA2 . 18428 1 23 . 1 1 13 13 GLY C C 13 173.742 0.013 . 1 . 321 . . 13 GLY C . 18428 1 24 . 1 1 13 13 GLY CA C 13 45.193 0.022 . 1 . 321 . . 13 GLY CA . 18428 1 25 . 1 1 13 13 GLY N N 15 110.405 0.014 . 1 . 321 . . 13 GLY N . 18428 1 26 . 1 1 14 14 LEU H H 1 7.976 0.001 . 1 . 322 . . 14 LEU H . 18428 1 27 . 1 1 14 14 LEU HA H 1 4.282 0.001 . 1 . 322 . . 14 LEU HA . 18428 1 28 . 1 1 14 14 LEU HB2 H 1 1.464 0.001 . 2 . 322 . . 14 LEU HB2 . 18428 1 29 . 1 1 14 14 LEU HB3 H 1 1.513 0.001 . 2 . 322 . . 14 LEU HB3 . 18428 1 30 . 1 1 14 14 LEU C C 13 176.996 0.005 . 1 . 322 . . 14 LEU C . 18428 1 31 . 1 1 14 14 LEU CA C 13 55.017 0.001 . 1 . 322 . . 14 LEU CA . 18428 1 32 . 1 1 14 14 LEU CB C 13 42.342 0.002 . 1 . 322 . . 14 LEU CB . 18428 1 33 . 1 1 14 14 LEU N N 15 121.412 0.009 . 1 . 322 . . 14 LEU N . 18428 1 34 . 1 1 15 15 VAL H H 1 8.029 0.001 . 1 . 323 . . 15 VAL H . 18428 1 35 . 1 1 15 15 VAL HA H 1 4.348 0.001 . 1 . 323 . . 15 VAL HA . 18428 1 36 . 1 1 15 15 VAL HB H 1 1.968 0.001 . 1 . 323 . . 15 VAL HB . 18428 1 37 . 1 1 15 15 VAL C C 13 174.290 0.001 . 1 . 323 . . 15 VAL C . 18428 1 38 . 1 1 15 15 VAL CA C 13 59.699 0.001 . 1 . 323 . . 15 VAL CA . 18428 1 39 . 1 1 15 15 VAL CB C 13 32.500 0.001 . 1 . 323 . . 15 VAL CB . 18428 1 40 . 1 1 15 15 VAL N N 15 122.359 0.015 . 1 . 323 . . 15 VAL N . 18428 1 41 . 1 1 20 20 HIS HA H 1 4.540 0.001 . 1 . 328 . . 20 HIS HA . 18428 1 42 . 1 1 20 20 HIS HB2 H 1 3.030 0.001 . 2 . 328 . . 20 HIS HB2 . 18428 1 43 . 1 1 20 20 HIS HB3 H 1 3.062 0.001 . 2 . 328 . . 20 HIS HB3 . 18428 1 44 . 1 1 20 20 HIS C C 13 175.327 0.001 . 1 . 328 . . 20 HIS C . 18428 1 45 . 1 1 20 20 HIS CA C 13 56.383 0.001 . 1 . 328 . . 20 HIS CA . 18428 1 46 . 1 1 20 20 HIS CB C 13 30.289 0.001 . 1 . 328 . . 20 HIS CB . 18428 1 47 . 1 1 21 21 MET H H 1 8.145 0.004 . 1 . 329 . . 21 MET H . 18428 1 48 . 1 1 21 21 MET HA H 1 4.331 0.001 . 1 . 329 . . 21 MET HA . 18428 1 49 . 1 1 21 21 MET HB2 H 1 1.971 0.001 . 2 . 329 . . 21 MET HB2 . 18428 1 50 . 1 1 21 21 MET C C 13 176.008 0.021 . 1 . 329 . . 21 MET C . 18428 1 51 . 1 1 21 21 MET CA C 13 55.598 0.023 . 1 . 329 . . 21 MET CA . 18428 1 52 . 1 1 21 21 MET CB C 13 32.690 0.009 . 1 . 329 . . 21 MET CB . 18428 1 53 . 1 1 21 21 MET N N 15 121.192 0.015 . 1 . 329 . . 21 MET N . 18428 1 54 . 1 1 22 22 ALA H H 1 8.233 0.002 . 1 . 330 . . 22 ALA H . 18428 1 55 . 1 1 22 22 ALA HA H 1 4.225 0.001 . 1 . 330 . . 22 ALA HA . 18428 1 56 . 1 1 22 22 ALA HB1 H 1 1.319 0.001 . 1 . 330 . . 22 ALA HB1 . 18428 1 57 . 1 1 22 22 ALA HB2 H 1 1.319 0.001 . 1 . 330 . . 22 ALA HB2 . 18428 1 58 . 1 1 22 22 ALA HB3 H 1 1.319 0.001 . 1 . 330 . . 22 ALA HB3 . 18428 1 59 . 1 1 22 22 ALA C C 13 177.715 0.009 . 1 . 330 . . 22 ALA C . 18428 1 60 . 1 1 22 22 ALA CA C 13 52.777 0.01 . 1 . 330 . . 22 ALA CA . 18428 1 61 . 1 1 22 22 ALA CB C 13 19.106 0.05 . 1 . 330 . . 22 ALA CB . 18428 1 62 . 1 1 22 22 ALA N N 15 124.758 0.015 . 1 . 330 . . 22 ALA N . 18428 1 63 . 1 1 23 23 SER H H 1 8.128 0.001 . 1 . 331 . . 23 SER H . 18428 1 64 . 1 1 23 23 SER HA H 1 4.363 0.001 . 1 . 331 . . 23 SER HA . 18428 1 65 . 1 1 23 23 SER HB2 H 1 3.776 0.001 . 2 . 331 . . 23 SER HB2 . 18428 1 66 . 1 1 23 23 SER HB3 H 1 3.821 0.001 . 2 . 331 . . 23 SER HB3 . 18428 1 67 . 1 1 23 23 SER C C 13 174.769 0.005 . 1 . 331 . . 23 SER C . 18428 1 68 . 1 1 23 23 SER CA C 13 58.372 0.003 . 1 . 331 . . 23 SER CA . 18428 1 69 . 1 1 23 23 SER CB C 13 63.741 0.009 . 1 . 331 . . 23 SER CB . 18428 1 70 . 1 1 23 23 SER N N 15 114.166 0.007 . 1 . 331 . . 23 SER N . 18428 1 71 . 1 1 24 24 MET H H 1 8.298 0.001 . 1 . 332 . . 24 MET H . 18428 1 72 . 1 1 24 24 MET HA H 1 4.505 0.001 . 1 . 332 . . 24 MET HA . 18428 1 73 . 1 1 24 24 MET HB2 H 1 1.965 0.001 . 2 . 332 . . 24 MET HB2 . 18428 1 74 . 1 1 24 24 MET HB3 H 1 2.071 0.001 . 2 . 332 . . 24 MET HB3 . 18428 1 75 . 1 1 24 24 MET C C 13 176.467 0.007 . 1 . 332 . . 24 MET C . 18428 1 76 . 1 1 24 24 MET CA C 13 55.668 0.009 . 1 . 332 . . 24 MET CA . 18428 1 77 . 1 1 24 24 MET CB C 13 32.827 0.001 . 1 . 332 . . 24 MET CB . 18428 1 78 . 1 1 24 24 MET N N 15 122.027 0.009 . 1 . 332 . . 24 MET N . 18428 1 79 . 1 1 25 25 THR H H 1 8.058 0.002 . 1 . 333 . . 25 THR H . 18428 1 80 . 1 1 25 25 THR HA H 1 4.312 0.001 . 1 . 333 . . 25 THR HA . 18428 1 81 . 1 1 25 25 THR HB H 1 4.194 0.001 . 1 . 333 . . 25 THR HB . 18428 1 82 . 1 1 25 25 THR C C 13 175.145 0.008 . 1 . 333 . . 25 THR C . 18428 1 83 . 1 1 25 25 THR CA C 13 61.876 0.005 . 1 . 333 . . 25 THR CA . 18428 1 84 . 1 1 25 25 THR CB C 13 69.749 0.009 . 1 . 333 . . 25 THR CB . 18428 1 85 . 1 1 25 25 THR N N 15 113.810 0.008 . 1 . 333 . . 25 THR N . 18428 1 86 . 1 1 26 26 GLY H H 1 8.338 0.002 . 1 . 334 . . 26 GLY H . 18428 1 87 . 1 1 26 26 GLY HA2 H 1 3.927 0.001 . 2 . 334 . . 26 GLY HA2 . 18428 1 88 . 1 1 26 26 GLY C C 13 174.693 0.006 . 1 . 334 . . 26 GLY C . 18428 1 89 . 1 1 26 26 GLY CA C 13 45.470 0.008 . 1 . 334 . . 26 GLY CA . 18428 1 90 . 1 1 26 26 GLY N N 15 111.077 0.007 . 1 . 334 . . 26 GLY N . 18428 1 91 . 1 1 27 27 GLY H H 1 8.240 0.002 . 1 . 335 . . 27 GLY H . 18428 1 92 . 1 1 27 27 GLY HA2 H 1 3.889 0.001 . 2 . 335 . . 27 GLY HA2 . 18428 1 93 . 1 1 27 27 GLY C C 13 174.228 0.006 . 1 . 335 . . 27 GLY C . 18428 1 94 . 1 1 27 27 GLY CA C 13 45.249 0.001 . 1 . 335 . . 27 GLY CA . 18428 1 95 . 1 1 27 27 GLY N N 15 108.503 0.008 . 1 . 335 . . 27 GLY N . 18428 1 96 . 1 1 28 28 GLN H H 1 8.224 0.002 . 1 . 336 . . 28 GLN H . 18428 1 97 . 1 1 28 28 GLN HA H 1 4.246 0.001 . 1 . 336 . . 28 GLN HA . 18428 1 98 . 1 1 28 28 GLN HB2 H 1 1.909 0.001 . 2 . 336 . . 28 GLN HB2 . 18428 1 99 . 1 1 28 28 GLN HB3 H 1 2.023 0.001 . 2 . 336 . . 28 GLN HB3 . 18428 1 100 . 1 1 28 28 GLN C C 13 175.976 0.014 . 1 . 336 . . 28 GLN C . 18428 1 101 . 1 1 28 28 GLN CA C 13 55.938 0.011 . 1 . 336 . . 28 GLN CA . 18428 1 102 . 1 1 28 28 GLN CB C 13 29.341 0.005 . 1 . 336 . . 28 GLN CB . 18428 1 103 . 1 1 28 28 GLN N N 15 119.621 0.025 . 1 . 336 . . 28 GLN N . 18428 1 104 . 1 1 29 29 GLN H H 1 8.420 0.001 . 1 . 337 . . 29 GLN H . 18428 1 105 . 1 1 29 29 GLN HA H 1 4.251 0.001 . 1 . 337 . . 29 GLN HA . 18428 1 106 . 1 1 29 29 GLN HB2 H 1 1.897 0.001 . 2 . 337 . . 29 GLN HB2 . 18428 1 107 . 1 1 29 29 GLN HB3 H 1 2.021 0.001 . 2 . 337 . . 29 GLN HB3 . 18428 1 108 . 1 1 29 29 GLN C C 13 175.958 0.001 . 1 . 337 . . 29 GLN C . 18428 1 109 . 1 1 29 29 GLN CA C 13 55.897 0.009 . 1 . 337 . . 29 GLN CA . 18428 1 110 . 1 1 29 29 GLN CB C 13 29.218 0.023 . 1 . 337 . . 29 GLN CB . 18428 1 111 . 1 1 29 29 GLN N N 15 121.219 0.015 . 1 . 337 . . 29 GLN N . 18428 1 112 . 1 1 30 30 MET H H 1 8.378 0.002 . 1 . 338 . . 30 MET H . 18428 1 113 . 1 1 30 30 MET HA H 1 4.393 0.001 . 1 . 338 . . 30 MET HA . 18428 1 114 . 1 1 30 30 MET HB2 H 1 1.928 0.001 . 2 . 338 . . 30 MET HB2 . 18428 1 115 . 1 1 30 30 MET HB3 H 1 2.020 0.001 . 2 . 338 . . 30 MET HB3 . 18428 1 116 . 1 1 30 30 MET C C 13 176.640 0.006 . 1 . 338 . . 30 MET C . 18428 1 117 . 1 1 30 30 MET CA C 13 55.584 0.028 . 1 . 338 . . 30 MET CA . 18428 1 118 . 1 1 30 30 MET CB C 13 32.730 0.01 . 1 . 338 . . 30 MET CB . 18428 1 119 . 1 1 30 30 MET N N 15 121.498 0.008 . 1 . 338 . . 30 MET N . 18428 1 120 . 1 1 31 31 GLY H H 1 8.417 0.003 . 1 . 339 . . 31 GLY H . 18428 1 121 . 1 1 31 31 GLY HA2 H 1 3.874 0.001 . 2 . 339 . . 31 GLY HA2 . 18428 1 122 . 1 1 31 31 GLY C C 13 174.060 0.008 . 1 . 339 . . 31 GLY C . 18428 1 123 . 1 1 31 31 GLY CA C 13 45.297 0.018 . 1 . 339 . . 31 GLY CA . 18428 1 124 . 1 1 31 31 GLY N N 15 110.000 0.026 . 1 . 339 . . 31 GLY N . 18428 1 125 . 1 1 32 32 ARG H H 1 8.173 0.002 . 1 . 340 . . 32 ARG H . 18428 1 126 . 1 1 32 32 ARG HA H 1 4.238 0.001 . 1 . 340 . . 32 ARG HA . 18428 1 127 . 1 1 32 32 ARG HB2 H 1 1.662 0.001 . 2 . 340 . . 32 ARG HB2 . 18428 1 128 . 1 1 32 32 ARG HB3 H 1 1.794 0.001 . 2 . 340 . . 32 ARG HB3 . 18428 1 129 . 1 1 32 32 ARG C C 13 176.635 0.004 . 1 . 340 . . 32 ARG C . 18428 1 130 . 1 1 32 32 ARG CA C 13 56.021 0.0 . 1 . 340 . . 32 ARG CA . 18428 1 131 . 1 1 32 32 ARG CB C 13 30.516 0.019 . 1 . 340 . . 32 ARG CB . 18428 1 132 . 1 1 32 32 ARG N N 15 120.239 0.014 . 1 . 340 . . 32 ARG N . 18428 1 133 . 1 1 33 33 GLY H H 1 8.245 0.01 . 1 . 341 . . 33 GLY H . 18428 1 134 . 1 1 33 33 GLY HA2 H 1 3.729 0.001 . 2 . 341 . . 33 GLY HA2 . 18428 1 135 . 1 1 33 33 GLY C C 13 173.390 0.002 . 1 . 341 . . 33 GLY C . 18428 1 136 . 1 1 33 33 GLY CA C 13 44.962 0.001 . 1 . 341 . . 33 GLY CA . 18428 1 137 . 1 1 33 33 GLY N N 15 109.503 0.04 . 1 . 341 . . 33 GLY N . 18428 1 138 . 1 1 34 34 SER H H 1 7.751 0.001 . 1 . 342 . . 34 SER H . 18428 1 139 . 1 1 34 34 SER HA H 1 4.170 0.001 . 1 . 342 . . 34 SER HA . 18428 1 140 . 1 1 34 34 SER HB2 H 1 3.484 0.001 . 2 . 342 . . 34 SER HB2 . 18428 1 141 . 1 1 34 34 SER HB3 H 1 3.548 0.001 . 2 . 342 . . 34 SER HB3 . 18428 1 142 . 1 1 34 34 SER C C 13 173.370 0.001 . 1 . 342 . . 34 SER C . 18428 1 143 . 1 1 34 34 SER CA C 13 57.649 0.001 . 1 . 342 . . 34 SER CA . 18428 1 144 . 1 1 34 34 SER CB C 13 63.667 0.002 . 1 . 342 . . 34 SER CB . 18428 1 145 . 1 1 34 34 SER N N 15 115.120 0.012 . 1 . 342 . . 34 SER N . 18428 1 146 . 1 1 35 35 PHE H H 1 8.086 0.003 . 1 . 343 . . 35 PHE H . 18428 1 147 . 1 1 35 35 PHE HA H 1 4.675 0.001 . 1 . 343 . . 35 PHE HA . 18428 1 148 . 1 1 35 35 PHE HB2 H 1 3.095 0.001 . 2 . 343 . . 35 PHE HB2 . 18428 1 149 . 1 1 35 35 PHE C C 13 176.620 0.011 . 1 . 343 . . 35 PHE C . 18428 1 150 . 1 1 35 35 PHE CA C 13 57.696 0.016 . 1 . 343 . . 35 PHE CA . 18428 1 151 . 1 1 35 35 PHE CB C 13 38.943 0.002 . 1 . 343 . . 35 PHE CB . 18428 1 152 . 1 1 35 35 PHE N N 15 122.405 0.036 . 1 . 343 . . 35 PHE N . 18428 1 153 . 1 1 36 36 THR H H 1 9.080 0.006 . 1 . 344 . . 36 THR H . 18428 1 154 . 1 1 36 36 THR HA H 1 4.438 0.014 . 1 . 344 . . 36 THR HA . 18428 1 155 . 1 1 36 36 THR HB H 1 4.344 0.005 . 1 . 344 . . 36 THR HB . 18428 1 156 . 1 1 36 36 THR HG21 H 1 0.989 0.001 . 1 . 344 . . 36 THR HG21 . 18428 1 157 . 1 1 36 36 THR HG22 H 1 0.989 0.001 . 1 . 344 . . 36 THR HG22 . 18428 1 158 . 1 1 36 36 THR HG23 H 1 0.989 0.001 . 1 . 344 . . 36 THR HG23 . 18428 1 159 . 1 1 36 36 THR C C 13 175.102 0.033 . 1 . 344 . . 36 THR C . 18428 1 160 . 1 1 36 36 THR CA C 13 61.064 0.044 . 1 . 344 . . 36 THR CA . 18428 1 161 . 1 1 36 36 THR CB C 13 70.408 0.037 . 1 . 344 . . 36 THR CB . 18428 1 162 . 1 1 36 36 THR CG2 C 13 21.280 0.001 . 1 . 344 . . 36 THR CG2 . 18428 1 163 . 1 1 36 36 THR N N 15 115.024 0.042 . 1 . 344 . . 36 THR N . 18428 1 164 . 1 1 37 37 GLY H H 1 9.218 0.007 . 1 . 345 . . 37 GLY H . 18428 1 165 . 1 1 37 37 GLY HA2 H 1 3.731 0.001 . 2 . 345 . . 37 GLY HA2 . 18428 1 166 . 1 1 37 37 GLY C C 13 172.865 0.012 . 1 . 345 . . 37 GLY C . 18428 1 167 . 1 1 37 37 GLY CA C 13 45.082 0.01 . 1 . 345 . . 37 GLY CA . 18428 1 168 . 1 1 37 37 GLY N N 15 114.519 0.054 . 1 . 345 . . 37 GLY N . 18428 1 169 . 1 1 38 38 ARG H H 1 8.256 0.003 . 1 . 346 . . 38 ARG H . 18428 1 170 . 1 1 38 38 ARG HA H 1 3.751 0.001 . 1 . 346 . . 38 ARG HA . 18428 1 171 . 1 1 38 38 ARG HB2 H 1 1.866 0.001 . 2 . 346 . . 38 ARG HB2 . 18428 1 172 . 1 1 38 38 ARG HB3 H 1 1.936 0.001 . 2 . 346 . . 38 ARG HB3 . 18428 1 173 . 1 1 38 38 ARG C C 13 175.742 0.005 . 1 . 346 . . 38 ARG C . 18428 1 174 . 1 1 38 38 ARG CA C 13 57.094 0.04 . 1 . 346 . . 38 ARG CA . 18428 1 175 . 1 1 38 38 ARG CB C 13 30.942 0.036 . 1 . 346 . . 38 ARG CB . 18428 1 176 . 1 1 38 38 ARG N N 15 121.168 0.042 . 1 . 346 . . 38 ARG N . 18428 1 177 . 1 1 39 39 LYS H H 1 8.335 0.007 . 1 . 347 . . 39 LYS H . 18428 1 178 . 1 1 39 39 LYS HA H 1 4.111 0.001 . 1 . 347 . . 39 LYS HA . 18428 1 179 . 1 1 39 39 LYS HB2 H 1 1.597 0.001 . 2 . 347 . . 39 LYS HB2 . 18428 1 180 . 1 1 39 39 LYS C C 13 176.491 0.001 . 1 . 347 . . 39 LYS C . 18428 1 181 . 1 1 39 39 LYS CA C 13 56.753 0.079 . 1 . 347 . . 39 LYS CA . 18428 1 182 . 1 1 39 39 LYS CB C 13 33.486 0.001 . 1 . 347 . . 39 LYS CB . 18428 1 183 . 1 1 39 39 LYS N N 15 123.709 0.03 . 1 . 347 . . 39 LYS N . 18428 1 184 . 1 1 40 40 ILE H H 1 8.738 0.002 . 1 . 348 . . 40 ILE H . 18428 1 185 . 1 1 40 40 ILE HA H 1 4.648 0.011 . 1 . 348 . . 40 ILE HA . 18428 1 186 . 1 1 40 40 ILE HB H 1 1.859 0.005 . 1 . 348 . . 40 ILE HB . 18428 1 187 . 1 1 40 40 ILE HG12 H 1 1.307 0.004 . 2 . 348 . . 40 ILE HG12 . 18428 1 188 . 1 1 40 40 ILE HG13 H 1 1.186 0.006 . 2 . 348 . . 40 ILE HG13 . 18428 1 189 . 1 1 40 40 ILE HG21 H 1 0.863 0.006 . 1 . 348 . . 40 ILE HG21 . 18428 1 190 . 1 1 40 40 ILE HG22 H 1 0.863 0.006 . 1 . 348 . . 40 ILE HG22 . 18428 1 191 . 1 1 40 40 ILE HG23 H 1 0.863 0.006 . 1 . 348 . . 40 ILE HG23 . 18428 1 192 . 1 1 40 40 ILE HD11 H 1 0.745 0.003 . 1 . 348 . . 40 ILE HD11 . 18428 1 193 . 1 1 40 40 ILE HD12 H 1 0.745 0.003 . 1 . 348 . . 40 ILE HD12 . 18428 1 194 . 1 1 40 40 ILE HD13 H 1 0.745 0.003 . 1 . 348 . . 40 ILE HD13 . 18428 1 195 . 1 1 40 40 ILE C C 13 174.608 0.013 . 1 . 348 . . 40 ILE C . 18428 1 196 . 1 1 40 40 ILE CA C 13 59.220 0.092 . 1 . 348 . . 40 ILE CA . 18428 1 197 . 1 1 40 40 ILE CB C 13 42.536 0.043 . 1 . 348 . . 40 ILE CB . 18428 1 198 . 1 1 40 40 ILE CG1 C 13 25.619 0.081 . 1 . 348 . . 40 ILE CG1 . 18428 1 199 . 1 1 40 40 ILE CG2 C 13 18.388 0.044 . 1 . 348 . . 40 ILE CG2 . 18428 1 200 . 1 1 40 40 ILE CD1 C 13 14.669 0.026 . 1 . 348 . . 40 ILE CD1 . 18428 1 201 . 1 1 40 40 ILE N N 15 117.743 0.029 . 1 . 348 . . 40 ILE N . 18428 1 202 . 1 1 41 41 SER H H 1 8.125 0.002 . 1 . 349 . . 41 SER H . 18428 1 203 . 1 1 41 41 SER HA H 1 3.805 0.001 . 1 . 349 . . 41 SER HA . 18428 1 204 . 1 1 41 41 SER HB2 H 1 3.603 0.001 . 2 . 349 . . 41 SER HB2 . 18428 1 205 . 1 1 41 41 SER C C 13 172.722 0.028 . 1 . 349 . . 41 SER C . 18428 1 206 . 1 1 41 41 SER CA C 13 57.386 0.067 . 1 . 349 . . 41 SER CA . 18428 1 207 . 1 1 41 41 SER CB C 13 65.464 0.015 . 1 . 349 . . 41 SER CB . 18428 1 208 . 1 1 41 41 SER N N 15 115.558 0.042 . 1 . 349 . . 41 SER N . 18428 1 209 . 1 1 42 42 LEU H H 1 8.510 0.008 . 1 . 350 . . 42 LEU H . 18428 1 210 . 1 1 42 42 LEU HA H 1 4.356 0.009 . 1 . 350 . . 42 LEU HA . 18428 1 211 . 1 1 42 42 LEU HB2 H 1 1.226 0.012 . 2 . 350 . . 42 LEU HB2 . 18428 1 212 . 1 1 42 42 LEU HB3 H 1 1.143 0.005 . 2 . 350 . . 42 LEU HB3 . 18428 1 213 . 1 1 42 42 LEU HG H 1 1.390 0.009 . 1 . 350 . . 42 LEU HG . 18428 1 214 . 1 1 42 42 LEU HD11 H 1 0.851 0.002 . 2 . 350 . . 42 LEU HD11 . 18428 1 215 . 1 1 42 42 LEU HD12 H 1 0.851 0.002 . 2 . 350 . . 42 LEU HD12 . 18428 1 216 . 1 1 42 42 LEU HD13 H 1 0.851 0.002 . 2 . 350 . . 42 LEU HD13 . 18428 1 217 . 1 1 42 42 LEU HD21 H 1 0.765 0.003 . 2 . 350 . . 42 LEU HD21 . 18428 1 218 . 1 1 42 42 LEU HD22 H 1 0.765 0.003 . 2 . 350 . . 42 LEU HD22 . 18428 1 219 . 1 1 42 42 LEU HD23 H 1 0.765 0.003 . 2 . 350 . . 42 LEU HD23 . 18428 1 220 . 1 1 42 42 LEU C C 13 173.941 0.062 . 1 . 350 . . 42 LEU C . 18428 1 221 . 1 1 42 42 LEU CA C 13 53.722 0.044 . 1 . 350 . . 42 LEU CA . 18428 1 222 . 1 1 42 42 LEU CB C 13 46.683 0.053 . 1 . 350 . . 42 LEU CB . 18428 1 223 . 1 1 42 42 LEU CG C 13 26.738 0.001 . 1 . 350 . . 42 LEU CG . 18428 1 224 . 1 1 42 42 LEU CD1 C 13 24.067 0.022 . 2 . 350 . . 42 LEU CD1 . 18428 1 225 . 1 1 42 42 LEU CD2 C 13 26.559 0.029 . 2 . 350 . . 42 LEU CD2 . 18428 1 226 . 1 1 42 42 LEU N N 15 122.968 0.053 . 1 . 350 . . 42 LEU N . 18428 1 227 . 1 1 43 43 ASP H H 1 7.975 0.004 . 1 . 351 . . 43 ASP H . 18428 1 228 . 1 1 43 43 ASP HA H 1 4.975 0.006 . 1 . 351 . . 43 ASP HA . 18428 1 229 . 1 1 43 43 ASP HB2 H 1 2.997 0.001 . 2 . 351 . . 43 ASP HB2 . 18428 1 230 . 1 1 43 43 ASP HB3 H 1 2.256 0.001 . 2 . 351 . . 43 ASP HB3 . 18428 1 231 . 1 1 43 43 ASP C C 13 173.760 0.006 . 1 . 351 . . 43 ASP C . 18428 1 232 . 1 1 43 43 ASP CA C 13 53.512 0.001 . 1 . 351 . . 43 ASP CA . 18428 1 233 . 1 1 43 43 ASP CB C 13 42.778 0.046 . 1 . 351 . . 43 ASP CB . 18428 1 234 . 1 1 43 43 ASP N N 15 121.978 0.042 . 1 . 351 . . 43 ASP N . 18428 1 235 . 1 1 44 44 PHE H H 1 8.709 0.003 . 1 . 352 . . 44 PHE H . 18428 1 236 . 1 1 44 44 PHE HA H 1 4.903 0.001 . 1 . 352 . . 44 PHE HA . 18428 1 237 . 1 1 44 44 PHE HB2 H 1 2.865 0.001 . 2 . 352 . . 44 PHE HB2 . 18428 1 238 . 1 1 44 44 PHE HB3 H 1 2.923 0.001 . 2 . 352 . . 44 PHE HB3 . 18428 1 239 . 1 1 44 44 PHE C C 13 174.982 0.027 . 1 . 352 . . 44 PHE C . 18428 1 240 . 1 1 44 44 PHE CA C 13 55.897 0.056 . 1 . 352 . . 44 PHE CA . 18428 1 241 . 1 1 44 44 PHE CB C 13 41.676 0.021 . 1 . 352 . . 44 PHE CB . 18428 1 242 . 1 1 44 44 PHE N N 15 121.130 0.051 . 1 . 352 . . 44 PHE N . 18428 1 243 . 1 1 45 45 GLN H H 1 8.962 0.003 . 1 . 353 . . 45 GLN H . 18428 1 244 . 1 1 45 45 GLN HA H 1 4.278 0.001 . 1 . 353 . . 45 GLN HA . 18428 1 245 . 1 1 45 45 GLN HB2 H 1 1.965 0.001 . 2 . 353 . . 45 GLN HB2 . 18428 1 246 . 1 1 45 45 GLN HB3 H 1 1.859 0.001 . 2 . 353 . . 45 GLN HB3 . 18428 1 247 . 1 1 45 45 GLN C C 13 173.344 0.005 . 1 . 353 . . 45 GLN C . 18428 1 248 . 1 1 45 45 GLN CA C 13 54.607 0.02 . 1 . 353 . . 45 GLN CA . 18428 1 249 . 1 1 45 45 GLN CB C 13 28.907 0.02 . 1 . 353 . . 45 GLN CB . 18428 1 250 . 1 1 45 45 GLN N N 15 124.720 0.04 . 1 . 353 . . 45 GLN N . 18428 1 251 . 1 1 46 46 ASP H H 1 8.406 0.005 . 1 . 354 . . 46 ASP H . 18428 1 252 . 1 1 46 46 ASP HA H 1 3.773 0.001 . 1 . 354 . . 46 ASP HA . 18428 1 253 . 1 1 46 46 ASP HB2 H 1 2.266 0.001 . 2 . 354 . . 46 ASP HB2 . 18428 1 254 . 1 1 46 46 ASP HB3 H 1 2.872 0.001 . 2 . 354 . . 46 ASP HB3 . 18428 1 255 . 1 1 46 46 ASP C C 13 173.491 0.001 . 1 . 354 . . 46 ASP C . 18428 1 256 . 1 1 46 46 ASP CA C 13 55.243 0.001 . 1 . 354 . . 46 ASP CA . 18428 1 257 . 1 1 46 46 ASP CB C 13 40.180 0.034 . 1 . 354 . . 46 ASP CB . 18428 1 258 . 1 1 46 46 ASP N N 15 126.546 0.046 . 1 . 354 . . 46 ASP N . 18428 1 259 . 1 1 47 47 VAL H H 1 7.989 0.003 . 1 . 355 . . 47 VAL H . 18428 1 260 . 1 1 47 47 VAL HA H 1 4.243 0.008 . 1 . 355 . . 47 VAL HA . 18428 1 261 . 1 1 47 47 VAL HB H 1 1.534 0.011 . 1 . 355 . . 47 VAL HB . 18428 1 262 . 1 1 47 47 VAL HG11 H 1 0.986 0.001 . 2 . 355 . . 47 VAL HG11 . 18428 1 263 . 1 1 47 47 VAL HG12 H 1 0.986 0.001 . 2 . 355 . . 47 VAL HG12 . 18428 1 264 . 1 1 47 47 VAL HG13 H 1 0.986 0.001 . 2 . 355 . . 47 VAL HG13 . 18428 1 265 . 1 1 47 47 VAL HG21 H 1 0.938 0.002 . 2 . 355 . . 47 VAL HG21 . 18428 1 266 . 1 1 47 47 VAL HG22 H 1 0.938 0.002 . 2 . 355 . . 47 VAL HG22 . 18428 1 267 . 1 1 47 47 VAL HG23 H 1 0.938 0.002 . 2 . 355 . . 47 VAL HG23 . 18428 1 268 . 1 1 47 47 VAL C C 13 175.252 0.016 . 1 . 355 . . 47 VAL C . 18428 1 269 . 1 1 47 47 VAL CA C 13 60.762 0.041 . 1 . 355 . . 47 VAL CA . 18428 1 270 . 1 1 47 47 VAL CB C 13 34.719 0.126 . 1 . 355 . . 47 VAL CB . 18428 1 271 . 1 1 47 47 VAL CG1 C 13 22.828 0.014 . 2 . 355 . . 47 VAL CG1 . 18428 1 272 . 1 1 47 47 VAL CG2 C 13 21.497 0.017 . 2 . 355 . . 47 VAL CG2 . 18428 1 273 . 1 1 47 47 VAL N N 15 118.271 0.013 . 1 . 355 . . 47 VAL N . 18428 1 274 . 1 1 48 48 GLU H H 1 8.531 0.004 . 1 . 356 . . 48 GLU H . 18428 1 275 . 1 1 48 48 GLU HA H 1 4.321 0.007 . 1 . 356 . . 48 GLU HA . 18428 1 276 . 1 1 48 48 GLU HB2 H 1 1.906 0.001 . 2 . 356 . . 48 GLU HB2 . 18428 1 277 . 1 1 48 48 GLU HG2 H 1 2.385 0.001 . 2 . 356 . . 48 GLU HG2 . 18428 1 278 . 1 1 48 48 GLU HG3 H 1 2.329 0.014 . 2 . 356 . . 48 GLU HG3 . 18428 1 279 . 1 1 48 48 GLU C C 13 178.149 0.004 . 1 . 356 . . 48 GLU C . 18428 1 280 . 1 1 48 48 GLU CA C 13 57.336 0.039 . 1 . 356 . . 48 GLU CA . 18428 1 281 . 1 1 48 48 GLU CB C 13 29.457 0.027 . 1 . 356 . . 48 GLU CB . 18428 1 282 . 1 1 48 48 GLU CG C 13 37.085 0.001 . 1 . 356 . . 48 GLU CG . 18428 1 283 . 1 1 48 48 GLU N N 15 124.894 0.031 . 1 . 356 . . 48 GLU N . 18428 1 284 . 1 1 49 49 ILE H H 1 8.814 0.007 . 1 . 357 . . 49 ILE H . 18428 1 285 . 1 1 49 49 ILE HA H 1 3.363 0.01 . 1 . 357 . . 49 ILE HA . 18428 1 286 . 1 1 49 49 ILE HB H 1 1.434 0.014 . 1 . 357 . . 49 ILE HB . 18428 1 287 . 1 1 49 49 ILE HG12 H 1 0.878 0.008 . 2 . 357 . . 49 ILE HG12 . 18428 1 288 . 1 1 49 49 ILE HG13 H 1 1.234 0.01 . 2 . 357 . . 49 ILE HG13 . 18428 1 289 . 1 1 49 49 ILE HG21 H 1 0.513 0.007 . 1 . 357 . . 49 ILE HG21 . 18428 1 290 . 1 1 49 49 ILE HG22 H 1 0.513 0.007 . 1 . 357 . . 49 ILE HG22 . 18428 1 291 . 1 1 49 49 ILE HG23 H 1 0.513 0.007 . 1 . 357 . . 49 ILE HG23 . 18428 1 292 . 1 1 49 49 ILE HD11 H 1 0.585 0.025 . 1 . 357 . . 49 ILE HD11 . 18428 1 293 . 1 1 49 49 ILE HD12 H 1 0.585 0.025 . 1 . 357 . . 49 ILE HD12 . 18428 1 294 . 1 1 49 49 ILE HD13 H 1 0.585 0.025 . 1 . 357 . . 49 ILE HD13 . 18428 1 295 . 1 1 49 49 ILE C C 13 177.469 0.031 . 1 . 357 . . 49 ILE C . 18428 1 296 . 1 1 49 49 ILE CA C 13 64.231 0.098 . 1 . 357 . . 49 ILE CA . 18428 1 297 . 1 1 49 49 ILE CB C 13 37.120 0.044 . 1 . 357 . . 49 ILE CB . 18428 1 298 . 1 1 49 49 ILE CG1 C 13 29.321 0.028 . 1 . 357 . . 49 ILE CG1 . 18428 1 299 . 1 1 49 49 ILE CG2 C 13 17.127 0.037 . 1 . 357 . . 49 ILE CG2 . 18428 1 300 . 1 1 49 49 ILE CD1 C 13 13.018 0.02 . 1 . 357 . . 49 ILE CD1 . 18428 1 301 . 1 1 49 49 ILE N N 15 125.892 0.059 . 1 . 357 . . 49 ILE N . 18428 1 302 . 1 1 50 50 ARG H H 1 8.949 0.005 . 1 . 358 . . 50 ARG H . 18428 1 303 . 1 1 50 50 ARG HA H 1 3.600 0.001 . 1 . 358 . . 50 ARG HA . 18428 1 304 . 1 1 50 50 ARG HB2 H 1 2.244 0.001 . 2 . 358 . . 50 ARG HB2 . 18428 1 305 . 1 1 50 50 ARG C C 13 178.405 0.002 . 1 . 358 . . 50 ARG C . 18428 1 306 . 1 1 50 50 ARG CA C 13 60.713 0.022 . 1 . 358 . . 50 ARG CA . 18428 1 307 . 1 1 50 50 ARG CB C 13 29.810 0.001 . 1 . 358 . . 50 ARG CB . 18428 1 308 . 1 1 50 50 ARG N N 15 117.873 0.04 . 1 . 358 . . 50 ARG N . 18428 1 309 . 1 1 51 51 THR H H 1 6.984 0.004 . 1 . 359 . . 51 THR H . 18428 1 310 . 1 1 51 51 THR HA H 1 3.905 0.006 . 1 . 359 . . 51 THR HA . 18428 1 311 . 1 1 51 51 THR HB H 1 4.236 0.007 . 1 . 359 . . 51 THR HB . 18428 1 312 . 1 1 51 51 THR HG21 H 1 1.105 0.004 . 1 . 359 . . 51 THR HG21 . 18428 1 313 . 1 1 51 51 THR HG22 H 1 1.105 0.004 . 1 . 359 . . 51 THR HG22 . 18428 1 314 . 1 1 51 51 THR HG23 H 1 1.105 0.004 . 1 . 359 . . 51 THR HG23 . 18428 1 315 . 1 1 51 51 THR C C 13 175.504 0.005 . 1 . 359 . . 51 THR C . 18428 1 316 . 1 1 51 51 THR CA C 13 66.075 0.07 . 1 . 359 . . 51 THR CA . 18428 1 317 . 1 1 51 51 THR CB C 13 68.132 0.035 . 1 . 359 . . 51 THR CB . 18428 1 318 . 1 1 51 51 THR CG2 C 13 21.894 0.001 . 1 . 359 . . 51 THR CG2 . 18428 1 319 . 1 1 51 51 THR N N 15 116.773 0.046 . 1 . 359 . . 51 THR N . 18428 1 320 . 1 1 52 52 ILE H H 1 7.457 0.006 . 1 . 360 . . 52 ILE H . 18428 1 321 . 1 1 52 52 ILE HA H 1 2.988 0.001 . 1 . 360 . . 52 ILE HA . 18428 1 322 . 1 1 52 52 ILE HB H 1 1.690 0.005 . 1 . 360 . . 52 ILE HB . 18428 1 323 . 1 1 52 52 ILE HG21 H 1 0.418 0.0 . 1 . 360 . . 52 ILE HG21 . 18428 1 324 . 1 1 52 52 ILE HG22 H 1 0.418 0.0 . 1 . 360 . . 52 ILE HG22 . 18428 1 325 . 1 1 52 52 ILE HG23 H 1 0.418 0.0 . 1 . 360 . . 52 ILE HG23 . 18428 1 326 . 1 1 52 52 ILE HD11 H 1 0.386 0.006 . 1 . 360 . . 52 ILE HD11 . 18428 1 327 . 1 1 52 52 ILE HD12 H 1 0.386 0.006 . 1 . 360 . . 52 ILE HD12 . 18428 1 328 . 1 1 52 52 ILE HD13 H 1 0.386 0.006 . 1 . 360 . . 52 ILE HD13 . 18428 1 329 . 1 1 52 52 ILE C C 13 177.848 0.001 . 1 . 360 . . 52 ILE C . 18428 1 330 . 1 1 52 52 ILE CA C 13 65.923 0.001 . 1 . 360 . . 52 ILE CA . 18428 1 331 . 1 1 52 52 ILE CB C 13 37.285 0.132 . 1 . 360 . . 52 ILE CB . 18428 1 332 . 1 1 52 52 ILE CG2 C 13 15.967 0.001 . 1 . 360 . . 52 ILE CG2 . 18428 1 333 . 1 1 52 52 ILE CD1 C 13 14.167 0.001 . 1 . 360 . . 52 ILE CD1 . 18428 1 334 . 1 1 52 52 ILE N N 15 122.355 0.035 . 1 . 360 . . 52 ILE N . 18428 1 335 . 1 1 53 53 LEU H H 1 8.248 0.005 . 1 . 361 . . 53 LEU H . 18428 1 336 . 1 1 53 53 LEU HA H 1 3.780 0.013 . 1 . 361 . . 53 LEU HA . 18428 1 337 . 1 1 53 53 LEU HB2 H 1 1.125 0.017 . 2 . 361 . . 53 LEU HB2 . 18428 1 338 . 1 1 53 53 LEU HB3 H 1 1.839 0.015 . 2 . 361 . . 53 LEU HB3 . 18428 1 339 . 1 1 53 53 LEU HG H 1 1.717 0.001 . 1 . 361 . . 53 LEU HG . 18428 1 340 . 1 1 53 53 LEU HD11 H 1 0.580 0.005 . 2 . 361 . . 53 LEU HD11 . 18428 1 341 . 1 1 53 53 LEU HD12 H 1 0.580 0.005 . 2 . 361 . . 53 LEU HD12 . 18428 1 342 . 1 1 53 53 LEU HD13 H 1 0.580 0.005 . 2 . 361 . . 53 LEU HD13 . 18428 1 343 . 1 1 53 53 LEU HD21 H 1 0.593 0.004 . 2 . 361 . . 53 LEU HD21 . 18428 1 344 . 1 1 53 53 LEU HD22 H 1 0.593 0.004 . 2 . 361 . . 53 LEU HD22 . 18428 1 345 . 1 1 53 53 LEU HD23 H 1 0.593 0.004 . 2 . 361 . . 53 LEU HD23 . 18428 1 346 . 1 1 53 53 LEU C C 13 178.112 0.017 . 1 . 361 . . 53 LEU C . 18428 1 347 . 1 1 53 53 LEU CA C 13 57.977 0.003 . 1 . 361 . . 53 LEU CA . 18428 1 348 . 1 1 53 53 LEU CB C 13 40.931 0.073 . 1 . 361 . . 53 LEU CB . 18428 1 349 . 1 1 53 53 LEU CG C 13 26.364 0.001 . 1 . 361 . . 53 LEU CG . 18428 1 350 . 1 1 53 53 LEU CD1 C 13 22.202 0.066 . 2 . 361 . . 53 LEU CD1 . 18428 1 351 . 1 1 53 53 LEU CD2 C 13 26.356 0.039 . 2 . 361 . . 53 LEU CD2 . 18428 1 352 . 1 1 53 53 LEU N N 15 116.048 0.053 . 1 . 361 . . 53 LEU N . 18428 1 353 . 1 1 54 54 GLN H H 1 7.437 0.003 . 1 . 362 . . 54 GLN H . 18428 1 354 . 1 1 54 54 GLN HA H 1 4.092 0.001 . 1 . 362 . . 54 GLN HA . 18428 1 355 . 1 1 54 54 GLN HB2 H 1 2.154 0.001 . 2 . 362 . . 54 GLN HB2 . 18428 1 356 . 1 1 54 54 GLN HB3 H 1 2.257 0.001 . 2 . 362 . . 54 GLN HB3 . 18428 1 357 . 1 1 54 54 GLN C C 13 179.309 0.011 . 1 . 362 . . 54 GLN C . 18428 1 358 . 1 1 54 54 GLN CA C 13 58.599 0.069 . 1 . 362 . . 54 GLN CA . 18428 1 359 . 1 1 54 54 GLN CB C 13 28.097 0.011 . 1 . 362 . . 54 GLN CB . 18428 1 360 . 1 1 54 54 GLN N N 15 118.211 0.035 . 1 . 362 . . 54 GLN N . 18428 1 361 . 1 1 55 55 ILE H H 1 8.039 0.003 . 1 . 363 . . 55 ILE H . 18428 1 362 . 1 1 55 55 ILE HA H 1 3.789 0.01 . 1 . 363 . . 55 ILE HA . 18428 1 363 . 1 1 55 55 ILE HB H 1 2.098 0.009 . 1 . 363 . . 55 ILE HB . 18428 1 364 . 1 1 55 55 ILE HG12 H 1 1.761 0.004 . 2 . 363 . . 55 ILE HG12 . 18428 1 365 . 1 1 55 55 ILE HG13 H 1 1.310 0.008 . 2 . 363 . . 55 ILE HG13 . 18428 1 366 . 1 1 55 55 ILE HG21 H 1 1.038 0.003 . 1 . 363 . . 55 ILE HG21 . 18428 1 367 . 1 1 55 55 ILE HG22 H 1 1.038 0.003 . 1 . 363 . . 55 ILE HG22 . 18428 1 368 . 1 1 55 55 ILE HG23 H 1 1.038 0.003 . 1 . 363 . . 55 ILE HG23 . 18428 1 369 . 1 1 55 55 ILE HD11 H 1 0.888 0.008 . 1 . 363 . . 55 ILE HD11 . 18428 1 370 . 1 1 55 55 ILE HD12 H 1 0.888 0.008 . 1 . 363 . . 55 ILE HD12 . 18428 1 371 . 1 1 55 55 ILE HD13 H 1 0.888 0.008 . 1 . 363 . . 55 ILE HD13 . 18428 1 372 . 1 1 55 55 ILE C C 13 178.646 0.022 . 1 . 363 . . 55 ILE C . 18428 1 373 . 1 1 55 55 ILE CA C 13 64.685 0.08 . 1 . 363 . . 55 ILE CA . 18428 1 374 . 1 1 55 55 ILE CB C 13 37.416 0.037 . 1 . 363 . . 55 ILE CB . 18428 1 375 . 1 1 55 55 ILE CG1 C 13 29.123 0.036 . 1 . 363 . . 55 ILE CG1 . 18428 1 376 . 1 1 55 55 ILE CG2 C 13 17.500 0.027 . 1 . 363 . . 55 ILE CG2 . 18428 1 377 . 1 1 55 55 ILE CD1 C 13 13.148 0.024 . 1 . 363 . . 55 ILE CD1 . 18428 1 378 . 1 1 55 55 ILE N N 15 122.975 0.038 . 1 . 363 . . 55 ILE N . 18428 1 379 . 1 1 56 56 LEU H H 1 8.413 0.005 . 1 . 364 . . 56 LEU H . 18428 1 380 . 1 1 56 56 LEU HA H 1 3.896 0.016 . 1 . 364 . . 56 LEU HA . 18428 1 381 . 1 1 56 56 LEU HB2 H 1 1.875 0.012 . 2 . 364 . . 56 LEU HB2 . 18428 1 382 . 1 1 56 56 LEU HB3 H 1 1.246 0.017 . 2 . 364 . . 56 LEU HB3 . 18428 1 383 . 1 1 56 56 LEU HD11 H 1 0.706 0.012 . 2 . 364 . . 56 LEU HD11 . 18428 1 384 . 1 1 56 56 LEU HD12 H 1 0.706 0.012 . 2 . 364 . . 56 LEU HD12 . 18428 1 385 . 1 1 56 56 LEU HD13 H 1 0.706 0.012 . 2 . 364 . . 56 LEU HD13 . 18428 1 386 . 1 1 56 56 LEU C C 13 179.867 0.02 . 1 . 364 . . 56 LEU C . 18428 1 387 . 1 1 56 56 LEU CA C 13 58.078 0.001 . 1 . 364 . . 56 LEU CA . 18428 1 388 . 1 1 56 56 LEU CB C 13 41.268 0.166 . 1 . 364 . . 56 LEU CB . 18428 1 389 . 1 1 56 56 LEU CD1 C 13 26.054 0.084 . 2 . 364 . . 56 LEU CD1 . 18428 1 390 . 1 1 56 56 LEU N N 15 119.381 0.03 . 1 . 364 . . 56 LEU N . 18428 1 391 . 1 1 57 57 ALA H H 1 8.565 0.004 . 1 . 365 . . 57 ALA H . 18428 1 392 . 1 1 57 57 ALA HA H 1 3.753 0.001 . 1 . 365 . . 57 ALA HA . 18428 1 393 . 1 1 57 57 ALA HB1 H 1 1.594 0.001 . 1 . 365 . . 57 ALA HB1 . 18428 1 394 . 1 1 57 57 ALA HB2 H 1 1.594 0.001 . 1 . 365 . . 57 ALA HB2 . 18428 1 395 . 1 1 57 57 ALA HB3 H 1 1.594 0.001 . 1 . 365 . . 57 ALA HB3 . 18428 1 396 . 1 1 57 57 ALA C C 13 179.056 0.01 . 1 . 365 . . 57 ALA C . 18428 1 397 . 1 1 57 57 ALA CA C 13 55.485 0.045 . 1 . 365 . . 57 ALA CA . 18428 1 398 . 1 1 57 57 ALA CB C 13 18.489 0.047 . 1 . 365 . . 57 ALA CB . 18428 1 399 . 1 1 57 57 ALA N N 15 124.496 0.032 . 1 . 365 . . 57 ALA N . 18428 1 400 . 1 1 58 58 LYS H H 1 7.631 0.003 . 1 . 366 . . 58 LYS H . 18428 1 401 . 1 1 58 58 LYS HA H 1 3.913 0.001 . 1 . 366 . . 58 LYS HA . 18428 1 402 . 1 1 58 58 LYS HB2 H 1 1.962 0.001 . 2 . 366 . . 58 LYS HB2 . 18428 1 403 . 1 1 58 58 LYS C C 13 179.688 0.01 . 1 . 366 . . 58 LYS C . 18428 1 404 . 1 1 58 58 LYS CA C 13 59.123 0.073 . 1 . 366 . . 58 LYS CA . 18428 1 405 . 1 1 58 58 LYS CB C 13 31.832 0.003 . 1 . 366 . . 58 LYS CB . 18428 1 406 . 1 1 58 58 LYS N N 15 119.204 0.016 . 1 . 366 . . 58 LYS N . 18428 1 407 . 1 1 59 59 GLU H H 1 8.119 0.004 . 1 . 367 . . 59 GLU H . 18428 1 408 . 1 1 59 59 GLU HA H 1 4.027 0.001 . 1 . 367 . . 59 GLU HA . 18428 1 409 . 1 1 59 59 GLU HB2 H 1 1.924 0.001 . 2 . 367 . . 59 GLU HB2 . 18428 1 410 . 1 1 59 59 GLU C C 13 177.632 0.006 . 1 . 367 . . 59 GLU C . 18428 1 411 . 1 1 59 59 GLU CA C 13 57.542 0.017 . 1 . 367 . . 59 GLU CA . 18428 1 412 . 1 1 59 59 GLU CB C 13 29.546 0.021 . 1 . 367 . . 59 GLU CB . 18428 1 413 . 1 1 59 59 GLU N N 15 115.824 0.039 . 1 . 367 . . 59 GLU N . 18428 1 414 . 1 1 60 60 SER H H 1 7.585 0.003 . 1 . 368 . . 60 SER H . 18428 1 415 . 1 1 60 60 SER HA H 1 3.040 0.009 . 1 . 368 . . 60 SER HA . 18428 1 416 . 1 1 60 60 SER HB2 H 1 2.273 0.007 . 2 . 368 . . 60 SER HB2 . 18428 1 417 . 1 1 60 60 SER HB3 H 1 2.090 0.005 . 2 . 368 . . 60 SER HB3 . 18428 1 418 . 1 1 60 60 SER C C 13 175.454 0.021 . 1 . 368 . . 60 SER C . 18428 1 419 . 1 1 60 60 SER CA C 13 59.482 0.058 . 1 . 368 . . 60 SER CA . 18428 1 420 . 1 1 60 60 SER CB C 13 64.219 0.104 . 1 . 368 . . 60 SER CB . 18428 1 421 . 1 1 60 60 SER N N 15 111.000 0.04 . 1 . 368 . . 60 SER N . 18428 1 422 . 1 1 61 61 GLY H H 1 7.631 0.005 . 1 . 369 . . 61 GLY H . 18428 1 423 . 1 1 61 61 GLY HA2 H 1 2.917 0.001 . 2 . 369 . . 61 GLY HA2 . 18428 1 424 . 1 1 61 61 GLY HA3 H 1 3.060 0.001 . 2 . 369 . . 61 GLY HA3 . 18428 1 425 . 1 1 61 61 GLY C C 13 173.823 0.003 . 1 . 369 . . 61 GLY C . 18428 1 426 . 1 1 61 61 GLY CA C 13 45.785 0.062 . 1 . 369 . . 61 GLY CA . 18428 1 427 . 1 1 61 61 GLY N N 15 110.893 0.037 . 1 . 369 . . 61 GLY N . 18428 1 428 . 1 1 62 62 MET H H 1 7.868 0.006 . 1 . 370 . . 62 MET H . 18428 1 429 . 1 1 62 62 MET HA H 1 4.431 0.007 . 1 . 370 . . 62 MET HA . 18428 1 430 . 1 1 62 62 MET HB2 H 1 1.563 0.015 . 2 . 370 . . 62 MET HB2 . 18428 1 431 . 1 1 62 62 MET HG2 H 1 2.114 0.005 . 2 . 370 . . 62 MET HG2 . 18428 1 432 . 1 1 62 62 MET HG3 H 1 1.958 0.001 . 2 . 370 . . 62 MET HG3 . 18428 1 433 . 1 1 62 62 MET C C 13 174.903 0.005 . 1 . 370 . . 62 MET C . 18428 1 434 . 1 1 62 62 MET CA C 13 53.937 0.025 . 1 . 370 . . 62 MET CA . 18428 1 435 . 1 1 62 62 MET CB C 13 34.056 0.028 . 1 . 370 . . 62 MET CB . 18428 1 436 . 1 1 62 62 MET CG C 13 32.090 0.022 . 1 . 370 . . 62 MET CG . 18428 1 437 . 1 1 62 62 MET N N 15 119.364 0.048 . 1 . 370 . . 62 MET N . 18428 1 438 . 1 1 63 63 ASN H H 1 8.492 0.004 . 1 . 371 . . 63 ASN H . 18428 1 439 . 1 1 63 63 ASN HA H 1 4.689 0.001 . 1 . 371 . . 63 ASN HA . 18428 1 440 . 1 1 63 63 ASN HB2 H 1 2.808 0.001 . 2 . 371 . . 63 ASN HB2 . 18428 1 441 . 1 1 63 63 ASN HB3 H 1 2.682 0.001 . 2 . 371 . . 63 ASN HB3 . 18428 1 442 . 1 1 63 63 ASN C C 13 173.762 0.006 . 1 . 371 . . 63 ASN C . 18428 1 443 . 1 1 63 63 ASN CA C 13 51.918 0.049 . 1 . 371 . . 63 ASN CA . 18428 1 444 . 1 1 63 63 ASN CB C 13 37.984 0.015 . 1 . 371 . . 63 ASN CB . 18428 1 445 . 1 1 63 63 ASN N N 15 120.484 0.034 . 1 . 371 . . 63 ASN N . 18428 1 446 . 1 1 64 64 ILE H H 1 7.444 0.002 . 1 . 372 . . 64 ILE H . 18428 1 447 . 1 1 64 64 ILE HA H 1 4.677 0.003 . 1 . 372 . . 64 ILE HA . 18428 1 448 . 1 1 64 64 ILE HB H 1 1.512 0.012 . 1 . 372 . . 64 ILE HB . 18428 1 449 . 1 1 64 64 ILE HG13 H 1 1.382 0.001 . 2 . 372 . . 64 ILE HG13 . 18428 1 450 . 1 1 64 64 ILE HG21 H 1 0.669 0.001 . 1 . 372 . . 64 ILE HG21 . 18428 1 451 . 1 1 64 64 ILE HG22 H 1 0.669 0.001 . 1 . 372 . . 64 ILE HG22 . 18428 1 452 . 1 1 64 64 ILE HG23 H 1 0.669 0.001 . 1 . 372 . . 64 ILE HG23 . 18428 1 453 . 1 1 64 64 ILE HD11 H 1 0.659 0.001 . 1 . 372 . . 64 ILE HD11 . 18428 1 454 . 1 1 64 64 ILE HD12 H 1 0.659 0.001 . 1 . 372 . . 64 ILE HD12 . 18428 1 455 . 1 1 64 64 ILE HD13 H 1 0.659 0.001 . 1 . 372 . . 64 ILE HD13 . 18428 1 456 . 1 1 64 64 ILE C C 13 175.277 0.015 . 1 . 372 . . 64 ILE C . 18428 1 457 . 1 1 64 64 ILE CA C 13 60.896 0.088 . 1 . 372 . . 64 ILE CA . 18428 1 458 . 1 1 64 64 ILE CB C 13 38.921 0.116 . 1 . 372 . . 64 ILE CB . 18428 1 459 . 1 1 64 64 ILE CG2 C 13 17.648 0.001 . 1 . 372 . . 64 ILE CG2 . 18428 1 460 . 1 1 64 64 ILE CD1 C 13 12.440 0.028 . 1 . 372 . . 64 ILE CD1 . 18428 1 461 . 1 1 64 64 ILE N N 15 123.085 0.018 . 1 . 372 . . 64 ILE N . 18428 1 462 . 1 1 65 65 VAL H H 1 9.014 0.01 . 1 . 373 . . 65 VAL H . 18428 1 463 . 1 1 65 65 VAL HA H 1 4.132 0.005 . 1 . 373 . . 65 VAL HA . 18428 1 464 . 1 1 65 65 VAL HB H 1 1.878 0.007 . 1 . 373 . . 65 VAL HB . 18428 1 465 . 1 1 65 65 VAL HG11 H 1 0.740 0.001 . 2 . 373 . . 65 VAL HG11 . 18428 1 466 . 1 1 65 65 VAL HG12 H 1 0.740 0.001 . 2 . 373 . . 65 VAL HG12 . 18428 1 467 . 1 1 65 65 VAL HG13 H 1 0.740 0.001 . 2 . 373 . . 65 VAL HG13 . 18428 1 468 . 1 1 65 65 VAL HG21 H 1 0.746 0.007 . 2 . 373 . . 65 VAL HG21 . 18428 1 469 . 1 1 65 65 VAL HG22 H 1 0.746 0.007 . 2 . 373 . . 65 VAL HG22 . 18428 1 470 . 1 1 65 65 VAL HG23 H 1 0.746 0.007 . 2 . 373 . . 65 VAL HG23 . 18428 1 471 . 1 1 65 65 VAL C C 13 174.600 0.008 . 1 . 373 . . 65 VAL C . 18428 1 472 . 1 1 65 65 VAL CA C 13 61.192 0.058 . 1 . 373 . . 65 VAL CA . 18428 1 473 . 1 1 65 65 VAL CB C 13 33.649 0.053 . 1 . 373 . . 65 VAL CB . 18428 1 474 . 1 1 65 65 VAL CG1 C 13 20.645 0.001 . 2 . 373 . . 65 VAL CG1 . 18428 1 475 . 1 1 65 65 VAL CG2 C 13 20.780 0.001 . 2 . 373 . . 65 VAL CG2 . 18428 1 476 . 1 1 65 65 VAL N N 15 129.924 0.03 . 1 . 373 . . 65 VAL N . 18428 1 477 . 1 1 66 66 ALA H H 1 8.831 0.003 . 1 . 374 . . 66 ALA H . 18428 1 478 . 1 1 66 66 ALA HA H 1 5.081 0.001 . 1 . 374 . . 66 ALA HA . 18428 1 479 . 1 1 66 66 ALA HB1 H 1 1.158 0.001 . 1 . 374 . . 66 ALA HB1 . 18428 1 480 . 1 1 66 66 ALA HB2 H 1 1.158 0.001 . 1 . 374 . . 66 ALA HB2 . 18428 1 481 . 1 1 66 66 ALA HB3 H 1 1.158 0.001 . 1 . 374 . . 66 ALA HB3 . 18428 1 482 . 1 1 66 66 ALA C C 13 177.503 0.016 . 1 . 374 . . 66 ALA C . 18428 1 483 . 1 1 66 66 ALA CA C 13 49.849 0.04 . 1 . 374 . . 66 ALA CA . 18428 1 484 . 1 1 66 66 ALA CB C 13 19.441 0.013 . 1 . 374 . . 66 ALA CB . 18428 1 485 . 1 1 66 66 ALA N N 15 130.046 0.017 . 1 . 374 . . 66 ALA N . 18428 1 486 . 1 1 67 67 SER H H 1 8.420 0.005 . 1 . 375 . . 67 SER H . 18428 1 487 . 1 1 67 67 SER HA H 1 4.284 0.001 . 1 . 375 . . 67 SER HA . 18428 1 488 . 1 1 67 67 SER HB2 H 1 3.879 0.001 . 2 . 375 . . 67 SER HB2 . 18428 1 489 . 1 1 67 67 SER C C 13 175.596 0.023 . 1 . 375 . . 67 SER C . 18428 1 490 . 1 1 67 67 SER CA C 13 58.072 0.001 . 1 . 375 . . 67 SER CA . 18428 1 491 . 1 1 67 67 SER CB C 13 63.932 0.053 . 1 . 375 . . 67 SER CB . 18428 1 492 . 1 1 67 67 SER N N 15 118.824 0.052 . 1 . 375 . . 67 SER N . 18428 1 493 . 1 1 68 68 ASP H H 1 8.945 0.005 . 1 . 376 . . 68 ASP H . 18428 1 494 . 1 1 68 68 ASP HA H 1 4.320 0.001 . 1 . 376 . . 68 ASP HA . 18428 1 495 . 1 1 68 68 ASP HB2 H 1 2.641 0.001 . 2 . 376 . . 68 ASP HB2 . 18428 1 496 . 1 1 68 68 ASP C C 13 176.300 0.035 . 1 . 376 . . 68 ASP C . 18428 1 497 . 1 1 68 68 ASP CA C 13 56.942 0.05 . 1 . 376 . . 68 ASP CA . 18428 1 498 . 1 1 68 68 ASP CB C 13 40.088 0.008 . 1 . 376 . . 68 ASP CB . 18428 1 499 . 1 1 68 68 ASP N N 15 124.104 0.039 . 1 . 376 . . 68 ASP N . 18428 1 500 . 1 1 69 69 SER H H 1 7.861 0.004 . 1 . 377 . . 69 SER H . 18428 1 501 . 1 1 69 69 SER HA H 1 3.812 0.001 . 1 . 377 . . 69 SER HA . 18428 1 502 . 1 1 69 69 SER HB2 H 1 4.208 0.001 . 2 . 377 . . 69 SER HB2 . 18428 1 503 . 1 1 69 69 SER C C 13 174.809 0.05 . 1 . 377 . . 69 SER C . 18428 1 504 . 1 1 69 69 SER CA C 13 58.013 0.015 . 1 . 377 . . 69 SER CA . 18428 1 505 . 1 1 69 69 SER CB C 13 62.900 0.015 . 1 . 377 . . 69 SER CB . 18428 1 506 . 1 1 69 69 SER N N 15 111.066 0.037 . 1 . 377 . . 69 SER N . 18428 1 507 . 1 1 70 70 VAL H H 1 7.495 0.002 . 1 . 378 . . 70 VAL H . 18428 1 508 . 1 1 70 70 VAL HA H 1 3.748 0.011 . 1 . 378 . . 70 VAL HA . 18428 1 509 . 1 1 70 70 VAL HB H 1 2.122 0.013 . 1 . 378 . . 70 VAL HB . 18428 1 510 . 1 1 70 70 VAL HG11 H 1 0.919 0.003 . 2 . 378 . . 70 VAL HG11 . 18428 1 511 . 1 1 70 70 VAL HG12 H 1 0.919 0.003 . 2 . 378 . . 70 VAL HG12 . 18428 1 512 . 1 1 70 70 VAL HG13 H 1 0.919 0.003 . 2 . 378 . . 70 VAL HG13 . 18428 1 513 . 1 1 70 70 VAL HG21 H 1 0.659 0.001 . 2 . 378 . . 70 VAL HG21 . 18428 1 514 . 1 1 70 70 VAL HG22 H 1 0.659 0.001 . 2 . 378 . . 70 VAL HG22 . 18428 1 515 . 1 1 70 70 VAL HG23 H 1 0.659 0.001 . 2 . 378 . . 70 VAL HG23 . 18428 1 516 . 1 1 70 70 VAL C C 13 173.665 0.004 . 1 . 378 . . 70 VAL C . 18428 1 517 . 1 1 70 70 VAL CA C 13 63.685 0.074 . 1 . 378 . . 70 VAL CA . 18428 1 518 . 1 1 70 70 VAL CB C 13 30.403 0.109 . 1 . 378 . . 70 VAL CB . 18428 1 519 . 1 1 70 70 VAL CG1 C 13 22.898 0.016 . 2 . 378 . . 70 VAL CG1 . 18428 1 520 . 1 1 70 70 VAL CG2 C 13 21.306 0.01 . 2 . 378 . . 70 VAL CG2 . 18428 1 521 . 1 1 70 70 VAL N N 15 123.261 0.021 . 1 . 378 . . 70 VAL N . 18428 1 522 . 1 1 71 71 ASN H H 1 7.939 0.004 . 1 . 379 . . 71 ASN H . 18428 1 523 . 1 1 71 71 ASN HA H 1 4.982 0.001 . 1 . 379 . . 71 ASN HA . 18428 1 524 . 1 1 71 71 ASN HB2 H 1 2.814 0.001 . 2 . 379 . . 71 ASN HB2 . 18428 1 525 . 1 1 71 71 ASN HB3 H 1 2.746 0.001 . 2 . 379 . . 71 ASN HB3 . 18428 1 526 . 1 1 71 71 ASN C C 13 173.970 0.019 . 1 . 379 . . 71 ASN C . 18428 1 527 . 1 1 71 71 ASN CA C 13 52.282 0.015 . 1 . 379 . . 71 ASN CA . 18428 1 528 . 1 1 71 71 ASN CB C 13 41.273 0.018 . 1 . 379 . . 71 ASN CB . 18428 1 529 . 1 1 71 71 ASN N N 15 124.967 0.036 . 1 . 379 . . 71 ASN N . 18428 1 530 . 1 1 72 72 GLY H H 1 8.613 0.002 . 1 . 380 . . 72 GLY H . 18428 1 531 . 1 1 72 72 GLY HA2 H 1 3.787 0.001 . 2 . 380 . . 72 GLY HA2 . 18428 1 532 . 1 1 72 72 GLY C C 13 173.313 0.018 . 1 . 380 . . 72 GLY C . 18428 1 533 . 1 1 72 72 GLY CA C 13 43.936 0.004 . 1 . 380 . . 72 GLY CA . 18428 1 534 . 1 1 72 72 GLY N N 15 107.475 0.034 . 1 . 380 . . 72 GLY N . 18428 1 535 . 1 1 73 73 LYS H H 1 8.286 0.005 . 1 . 381 . . 73 LYS H . 18428 1 536 . 1 1 73 73 LYS HA H 1 4.862 0.001 . 1 . 381 . . 73 LYS HA . 18428 1 537 . 1 1 73 73 LYS HB2 H 1 1.449 0.001 . 2 . 381 . . 73 LYS HB2 . 18428 1 538 . 1 1 73 73 LYS C C 13 175.622 0.012 . 1 . 381 . . 73 LYS C . 18428 1 539 . 1 1 73 73 LYS CA C 13 55.195 0.021 . 1 . 381 . . 73 LYS CA . 18428 1 540 . 1 1 73 73 LYS CB C 13 36.749 0.001 . 1 . 381 . . 73 LYS CB . 18428 1 541 . 1 1 73 73 LYS N N 15 118.298 0.023 . 1 . 381 . . 73 LYS N . 18428 1 542 . 1 1 74 74 MET H H 1 8.775 0.003 . 1 . 382 . . 74 MET H . 18428 1 543 . 1 1 74 74 MET HA H 1 4.643 0.009 . 1 . 382 . . 74 MET HA . 18428 1 544 . 1 1 74 74 MET HB2 H 1 1.860 0.007 . 2 . 382 . . 74 MET HB2 . 18428 1 545 . 1 1 74 74 MET HB3 H 1 1.732 0.071 . 2 . 382 . . 74 MET HB3 . 18428 1 546 . 1 1 74 74 MET HG2 H 1 2.158 0.01 . 2 . 382 . . 74 MET HG2 . 18428 1 547 . 1 1 74 74 MET C C 13 173.080 0.003 . 1 . 382 . . 74 MET C . 18428 1 548 . 1 1 74 74 MET CA C 13 55.340 0.012 . 1 . 382 . . 74 MET CA . 18428 1 549 . 1 1 74 74 MET CB C 13 37.309 0.002 . 1 . 382 . . 74 MET CB . 18428 1 550 . 1 1 74 74 MET CG C 13 31.445 0.027 . 1 . 382 . . 74 MET CG . 18428 1 551 . 1 1 74 74 MET N N 15 117.634 0.044 . 1 . 382 . . 74 MET N . 18428 1 552 . 1 1 75 75 THR H H 1 8.218 0.004 . 1 . 383 . . 75 THR H . 18428 1 553 . 1 1 75 75 THR HA H 1 4.795 0.014 . 1 . 383 . . 75 THR HA . 18428 1 554 . 1 1 75 75 THR HB H 1 3.924 0.002 . 1 . 383 . . 75 THR HB . 18428 1 555 . 1 1 75 75 THR HG21 H 1 1.301 0.003 . 1 . 383 . . 75 THR HG21 . 18428 1 556 . 1 1 75 75 THR HG22 H 1 1.301 0.003 . 1 . 383 . . 75 THR HG22 . 18428 1 557 . 1 1 75 75 THR HG23 H 1 1.301 0.003 . 1 . 383 . . 75 THR HG23 . 18428 1 558 . 1 1 75 75 THR C C 13 173.108 0.001 . 1 . 383 . . 75 THR C . 18428 1 559 . 1 1 75 75 THR CA C 13 61.518 0.069 . 1 . 383 . . 75 THR CA . 18428 1 560 . 1 1 75 75 THR CB C 13 71.157 0.001 . 1 . 383 . . 75 THR CB . 18428 1 561 . 1 1 75 75 THR CG2 C 13 21.374 0.001 . 1 . 383 . . 75 THR CG2 . 18428 1 562 . 1 1 75 75 THR N N 15 119.442 0.043 . 1 . 383 . . 75 THR N . 18428 1 563 . 1 1 76 76 LEU H H 1 8.867 0.003 . 1 . 384 . . 76 LEU H . 18428 1 564 . 1 1 76 76 LEU HA H 1 4.596 0.007 . 1 . 384 . . 76 LEU HA . 18428 1 565 . 1 1 76 76 LEU HB2 H 1 1.408 0.009 . 2 . 384 . . 76 LEU HB2 . 18428 1 566 . 1 1 76 76 LEU HB3 H 1 1.630 0.007 . 2 . 384 . . 76 LEU HB3 . 18428 1 567 . 1 1 76 76 LEU HD11 H 1 0.796 0.022 . 2 . 384 . . 76 LEU HD11 . 18428 1 568 . 1 1 76 76 LEU HD12 H 1 0.796 0.022 . 2 . 384 . . 76 LEU HD12 . 18428 1 569 . 1 1 76 76 LEU HD13 H 1 0.796 0.022 . 2 . 384 . . 76 LEU HD13 . 18428 1 570 . 1 1 76 76 LEU HD21 H 1 0.849 0.002 . 2 . 384 . . 76 LEU HD21 . 18428 1 571 . 1 1 76 76 LEU HD22 H 1 0.849 0.002 . 2 . 384 . . 76 LEU HD22 . 18428 1 572 . 1 1 76 76 LEU HD23 H 1 0.849 0.002 . 2 . 384 . . 76 LEU HD23 . 18428 1 573 . 1 1 76 76 LEU C C 13 173.536 0.029 . 1 . 384 . . 76 LEU C . 18428 1 574 . 1 1 76 76 LEU CA C 13 54.658 0.042 . 1 . 384 . . 76 LEU CA . 18428 1 575 . 1 1 76 76 LEU CB C 13 46.620 0.057 . 1 . 384 . . 76 LEU CB . 18428 1 576 . 1 1 76 76 LEU CD1 C 13 26.293 0.103 . 2 . 384 . . 76 LEU CD1 . 18428 1 577 . 1 1 76 76 LEU N N 15 127.585 0.052 . 1 . 384 . . 76 LEU N . 18428 1 578 . 1 1 77 77 SER H H 1 8.591 0.004 . 1 . 385 . . 77 SER H . 18428 1 579 . 1 1 77 77 SER HA H 1 3.589 0.001 . 1 . 385 . . 77 SER HA . 18428 1 580 . 1 1 77 77 SER HB2 H 1 3.653 0.001 . 2 . 385 . . 77 SER HB2 . 18428 1 581 . 1 1 77 77 SER C C 13 173.393 0.003 . 1 . 385 . . 77 SER C . 18428 1 582 . 1 1 77 77 SER CA C 13 56.778 0.016 . 1 . 385 . . 77 SER CA . 18428 1 583 . 1 1 77 77 SER CB C 13 63.542 0.072 . 1 . 385 . . 77 SER CB . 18428 1 584 . 1 1 77 77 SER N N 15 120.822 0.036 . 1 . 385 . . 77 SER N . 18428 1 585 . 1 1 78 78 LEU H H 1 8.786 0.003 . 1 . 386 . . 78 LEU H . 18428 1 586 . 1 1 78 78 LEU HA H 1 4.668 0.001 . 1 . 386 . . 78 LEU HA . 18428 1 587 . 1 1 78 78 LEU HB2 H 1 1.255 0.001 . 2 . 386 . . 78 LEU HB2 . 18428 1 588 . 1 1 78 78 LEU C C 13 175.346 0.01 . 1 . 386 . . 78 LEU C . 18428 1 589 . 1 1 78 78 LEU CA C 13 53.184 0.012 . 1 . 386 . . 78 LEU CA . 18428 1 590 . 1 1 78 78 LEU CB C 13 45.302 0.012 . 1 . 386 . . 78 LEU CB . 18428 1 591 . 1 1 78 78 LEU N N 15 125.799 0.053 . 1 . 386 . . 78 LEU N . 18428 1 592 . 1 1 79 79 LYS H H 1 8.644 0.003 . 1 . 387 . . 79 LYS H . 18428 1 593 . 1 1 79 79 LYS HA H 1 4.540 0.001 . 1 . 387 . . 79 LYS HA . 18428 1 594 . 1 1 79 79 LYS HB2 H 1 1.528 0.001 . 2 . 387 . . 79 LYS HB2 . 18428 1 595 . 1 1 79 79 LYS HB3 H 1 1.626 0.001 . 2 . 387 . . 79 LYS HB3 . 18428 1 596 . 1 1 79 79 LYS C C 13 173.730 0.004 . 1 . 387 . . 79 LYS C . 18428 1 597 . 1 1 79 79 LYS CA C 13 54.640 0.036 . 1 . 387 . . 79 LYS CA . 18428 1 598 . 1 1 79 79 LYS CB C 13 33.777 0.012 . 1 . 387 . . 79 LYS CB . 18428 1 599 . 1 1 79 79 LYS N N 15 125.020 0.037 . 1 . 387 . . 79 LYS N . 18428 1 600 . 1 1 80 80 ASP H H 1 8.374 0.006 . 1 . 388 . . 80 ASP H . 18428 1 601 . 1 1 80 80 ASP HA H 1 3.806 0.001 . 1 . 388 . . 80 ASP HA . 18428 1 602 . 1 1 80 80 ASP C C 13 173.808 0.022 . 1 . 388 . . 80 ASP C . 18428 1 603 . 1 1 80 80 ASP CA C 13 55.193 0.007 . 1 . 388 . . 80 ASP CA . 18428 1 604 . 1 1 80 80 ASP CB C 13 39.722 0.036 . 1 . 388 . . 80 ASP CB . 18428 1 605 . 1 1 80 80 ASP N N 15 126.432 0.033 . 1 . 388 . . 80 ASP N . 18428 1 606 . 1 1 81 81 VAL H H 1 8.641 0.003 . 1 . 389 . . 81 VAL H . 18428 1 607 . 1 1 81 81 VAL HA H 1 4.664 0.006 . 1 . 389 . . 81 VAL HA . 18428 1 608 . 1 1 81 81 VAL HB H 1 1.713 0.007 . 1 . 389 . . 81 VAL HB . 18428 1 609 . 1 1 81 81 VAL HG11 H 1 0.790 0.004 . 2 . 389 . . 81 VAL HG11 . 18428 1 610 . 1 1 81 81 VAL HG12 H 1 0.790 0.004 . 2 . 389 . . 81 VAL HG12 . 18428 1 611 . 1 1 81 81 VAL HG13 H 1 0.790 0.004 . 2 . 389 . . 81 VAL HG13 . 18428 1 612 . 1 1 81 81 VAL CA C 13 57.963 0.025 . 1 . 389 . . 81 VAL CA . 18428 1 613 . 1 1 81 81 VAL CB C 13 34.731 0.085 . 1 . 389 . . 81 VAL CB . 18428 1 614 . 1 1 81 81 VAL CG1 C 13 23.420 0.034 . 2 . 389 . . 81 VAL CG1 . 18428 1 615 . 1 1 81 81 VAL N N 15 117.041 0.03 . 1 . 389 . . 81 VAL N . 18428 1 616 . 1 1 82 82 PRO HA H 1 4.161 0.002 . 1 . 390 . . 82 PRO HA . 18428 1 617 . 1 1 82 82 PRO HB2 H 1 3.132 0.001 . 2 . 390 . . 82 PRO HB2 . 18428 1 618 . 1 1 82 82 PRO C C 13 180.371 0.001 . 1 . 390 . . 82 PRO C . 18428 1 619 . 1 1 82 82 PRO CA C 13 63.481 0.001 . 1 . 390 . . 82 PRO CA . 18428 1 620 . 1 1 82 82 PRO CB C 13 33.544 0.001 . 1 . 390 . . 82 PRO CB . 18428 1 621 . 1 1 83 83 TRP H H 1 8.600 0.007 . 1 . 391 . . 83 TRP H . 18428 1 622 . 1 1 83 83 TRP HA H 1 3.954 0.001 . 1 . 391 . . 83 TRP HA . 18428 1 623 . 1 1 83 83 TRP HD1 H 1 7.623 0.001 . 1 . 391 . . 83 TRP HD1 . 18428 1 624 . 1 1 83 83 TRP HE1 H 1 10.343 0.003 . 1 . 391 . . 83 TRP HE1 . 18428 1 625 . 1 1 83 83 TRP HE3 H 1 7.151 0.001 . 1 . 391 . . 83 TRP HE3 . 18428 1 626 . 1 1 83 83 TRP HZ2 H 1 7.457 0.001 . 1 . 391 . . 83 TRP HZ2 . 18428 1 627 . 1 1 83 83 TRP HZ3 H 1 7.119 0.001 . 1 . 391 . . 83 TRP HZ3 . 18428 1 628 . 1 1 83 83 TRP HH2 H 1 7.135 0.001 . 1 . 391 . . 83 TRP HH2 . 18428 1 629 . 1 1 83 83 TRP C C 13 175.879 0.022 . 1 . 391 . . 83 TRP C . 18428 1 630 . 1 1 83 83 TRP CA C 13 60.633 0.011 . 1 . 391 . . 83 TRP CA . 18428 1 631 . 1 1 83 83 TRP CB C 13 28.343 0.001 . 1 . 391 . . 83 TRP CB . 18428 1 632 . 1 1 83 83 TRP CD1 C 13 127.258 0.001 . 1 . 391 . . 83 TRP CD1 . 18428 1 633 . 1 1 83 83 TRP CE3 C 13 120.118 0.001 . 1 . 391 . . 83 TRP CE3 . 18428 1 634 . 1 1 83 83 TRP CZ2 C 13 114.950 0.001 . 1 . 391 . . 83 TRP CZ2 . 18428 1 635 . 1 1 83 83 TRP CZ3 C 13 123.820 0.001 . 1 . 391 . . 83 TRP CZ3 . 18428 1 636 . 1 1 83 83 TRP CH2 C 13 124.799 0.001 . 1 . 391 . . 83 TRP CH2 . 18428 1 637 . 1 1 83 83 TRP N N 15 123.714 0.051 . 1 . 391 . . 83 TRP N . 18428 1 638 . 1 1 83 83 TRP NE1 N 15 129.397 0.006 . 1 . 391 . . 83 TRP NE1 . 18428 1 639 . 1 1 84 84 ASP H H 1 8.669 0.003 . 1 . 392 . . 84 ASP H . 18428 1 640 . 1 1 84 84 ASP HA H 1 3.557 0.001 . 1 . 392 . . 84 ASP HA . 18428 1 641 . 1 1 84 84 ASP HB2 H 1 2.105 0.001 . 2 . 392 . . 84 ASP HB2 . 18428 1 642 . 1 1 84 84 ASP C C 13 178.245 0.009 . 1 . 392 . . 84 ASP C . 18428 1 643 . 1 1 84 84 ASP CA C 13 55.627 0.001 . 1 . 392 . . 84 ASP CA . 18428 1 644 . 1 1 84 84 ASP CB C 13 35.436 0.037 . 1 . 392 . . 84 ASP CB . 18428 1 645 . 1 1 84 84 ASP N N 15 118.410 0.021 . 1 . 392 . . 84 ASP N . 18428 1 646 . 1 1 85 85 GLN H H 1 6.848 0.011 . 1 . 393 . . 85 GLN H . 18428 1 647 . 1 1 85 85 GLN HA H 1 4.687 0.001 . 1 . 393 . . 85 GLN HA . 18428 1 648 . 1 1 85 85 GLN HB2 H 1 2.757 0.001 . 2 . 393 . . 85 GLN HB2 . 18428 1 649 . 1 1 85 85 GLN C C 13 177.562 0.025 . 1 . 393 . . 85 GLN C . 18428 1 650 . 1 1 85 85 GLN CA C 13 57.770 0.043 . 1 . 393 . . 85 GLN CA . 18428 1 651 . 1 1 85 85 GLN CB C 13 27.490 0.001 . 1 . 393 . . 85 GLN CB . 18428 1 652 . 1 1 85 85 GLN N N 15 124.237 0.054 . 1 . 393 . . 85 GLN N . 18428 1 653 . 1 1 86 86 ALA H H 1 7.728 0.004 . 1 . 394 . . 86 ALA H . 18428 1 654 . 1 1 86 86 ALA HA H 1 3.727 0.001 . 1 . 394 . . 86 ALA HA . 18428 1 655 . 1 1 86 86 ALA HB1 H 1 1.307 0.001 . 1 . 394 . . 86 ALA HB1 . 18428 1 656 . 1 1 86 86 ALA HB2 H 1 1.307 0.001 . 1 . 394 . . 86 ALA HB2 . 18428 1 657 . 1 1 86 86 ALA HB3 H 1 1.307 0.001 . 1 . 394 . . 86 ALA HB3 . 18428 1 658 . 1 1 86 86 ALA C C 13 178.156 0.008 . 1 . 394 . . 86 ALA C . 18428 1 659 . 1 1 86 86 ALA CA C 13 55.083 0.035 . 1 . 394 . . 86 ALA CA . 18428 1 660 . 1 1 86 86 ALA CB C 13 18.159 0.024 . 1 . 394 . . 86 ALA CB . 18428 1 661 . 1 1 86 86 ALA N N 15 121.783 0.028 . 1 . 394 . . 86 ALA N . 18428 1 662 . 1 1 87 87 LEU H H 1 8.204 0.003 . 1 . 395 . . 87 LEU H . 18428 1 663 . 1 1 87 87 LEU HA H 1 3.742 0.006 . 1 . 395 . . 87 LEU HA . 18428 1 664 . 1 1 87 87 LEU HB2 H 1 1.906 0.008 . 2 . 395 . . 87 LEU HB2 . 18428 1 665 . 1 1 87 87 LEU HB3 H 1 1.454 0.001 . 2 . 395 . . 87 LEU HB3 . 18428 1 666 . 1 1 87 87 LEU HD11 H 1 0.967 0.002 . 2 . 395 . . 87 LEU HD11 . 18428 1 667 . 1 1 87 87 LEU HD12 H 1 0.967 0.002 . 2 . 395 . . 87 LEU HD12 . 18428 1 668 . 1 1 87 87 LEU HD13 H 1 0.967 0.002 . 2 . 395 . . 87 LEU HD13 . 18428 1 669 . 1 1 87 87 LEU C C 13 177.637 0.009 . 1 . 395 . . 87 LEU C . 18428 1 670 . 1 1 87 87 LEU CA C 13 57.918 0.04 . 1 . 395 . . 87 LEU CA . 18428 1 671 . 1 1 87 87 LEU CB C 13 41.637 0.06 . 1 . 395 . . 87 LEU CB . 18428 1 672 . 1 1 87 87 LEU CD1 C 13 26.034 0.001 . 2 . 395 . . 87 LEU CD1 . 18428 1 673 . 1 1 87 87 LEU N N 15 116.188 0.049 . 1 . 395 . . 87 LEU N . 18428 1 674 . 1 1 88 88 ASP H H 1 7.211 0.004 . 1 . 396 . . 88 ASP H . 18428 1 675 . 1 1 88 88 ASP HA H 1 4.240 0.001 . 1 . 396 . . 88 ASP HA . 18428 1 676 . 1 1 88 88 ASP HB2 H 1 2.598 0.001 . 2 . 396 . . 88 ASP HB2 . 18428 1 677 . 1 1 88 88 ASP C C 13 177.670 0.001 . 1 . 396 . . 88 ASP C . 18428 1 678 . 1 1 88 88 ASP CA C 13 58.373 0.008 . 1 . 396 . . 88 ASP CA . 18428 1 679 . 1 1 88 88 ASP CB C 13 42.709 0.026 . 1 . 396 . . 88 ASP CB . 18428 1 680 . 1 1 88 88 ASP N N 15 118.772 0.038 . 1 . 396 . . 88 ASP N . 18428 1 681 . 1 1 89 89 LEU H H 1 7.925 0.005 . 1 . 397 . . 89 LEU H . 18428 1 682 . 1 1 89 89 LEU HA H 1 3.908 0.008 . 1 . 397 . . 89 LEU HA . 18428 1 683 . 1 1 89 89 LEU HB2 H 1 1.431 0.006 . 2 . 397 . . 89 LEU HB2 . 18428 1 684 . 1 1 89 89 LEU HB3 H 1 1.880 0.011 . 2 . 397 . . 89 LEU HB3 . 18428 1 685 . 1 1 89 89 LEU HG H 1 1.723 0.006 . 1 . 397 . . 89 LEU HG . 18428 1 686 . 1 1 89 89 LEU HD11 H 1 0.784 0.006 . 2 . 397 . . 89 LEU HD11 . 18428 1 687 . 1 1 89 89 LEU HD12 H 1 0.784 0.006 . 2 . 397 . . 89 LEU HD12 . 18428 1 688 . 1 1 89 89 LEU HD13 H 1 0.784 0.006 . 2 . 397 . . 89 LEU HD13 . 18428 1 689 . 1 1 89 89 LEU C C 13 180.336 0.022 . 1 . 397 . . 89 LEU C . 18428 1 690 . 1 1 89 89 LEU CA C 13 58.452 0.045 . 1 . 397 . . 89 LEU CA . 18428 1 691 . 1 1 89 89 LEU CB C 13 41.725 0.057 . 1 . 397 . . 89 LEU CB . 18428 1 692 . 1 1 89 89 LEU CG C 13 26.836 0.017 . 1 . 397 . . 89 LEU CG . 18428 1 693 . 1 1 89 89 LEU CD1 C 13 25.677 0.096 . 2 . 397 . . 89 LEU CD1 . 18428 1 694 . 1 1 89 89 LEU N N 15 119.119 0.037 . 1 . 397 . . 89 LEU N . 18428 1 695 . 1 1 90 90 VAL H H 1 7.793 0.002 . 1 . 398 . . 90 VAL H . 18428 1 696 . 1 1 90 90 VAL HA H 1 3.302 0.015 . 1 . 398 . . 90 VAL HA . 18428 1 697 . 1 1 90 90 VAL HB H 1 2.050 0.013 . 1 . 398 . . 90 VAL HB . 18428 1 698 . 1 1 90 90 VAL HG11 H 1 0.630 0.002 . 2 . 398 . . 90 VAL HG11 . 18428 1 699 . 1 1 90 90 VAL HG12 H 1 0.630 0.002 . 2 . 398 . . 90 VAL HG12 . 18428 1 700 . 1 1 90 90 VAL HG13 H 1 0.630 0.002 . 2 . 398 . . 90 VAL HG13 . 18428 1 701 . 1 1 90 90 VAL HG21 H 1 0.856 0.002 . 2 . 398 . . 90 VAL HG21 . 18428 1 702 . 1 1 90 90 VAL HG22 H 1 0.856 0.002 . 2 . 398 . . 90 VAL HG22 . 18428 1 703 . 1 1 90 90 VAL HG23 H 1 0.856 0.002 . 2 . 398 . . 90 VAL HG23 . 18428 1 704 . 1 1 90 90 VAL C C 13 177.087 0.01 . 1 . 398 . . 90 VAL C . 18428 1 705 . 1 1 90 90 VAL CA C 13 66.717 0.063 . 1 . 398 . . 90 VAL CA . 18428 1 706 . 1 1 90 90 VAL CB C 13 31.603 0.078 . 1 . 398 . . 90 VAL CB . 18428 1 707 . 1 1 90 90 VAL CG1 C 13 20.858 0.033 . 2 . 398 . . 90 VAL CG1 . 18428 1 708 . 1 1 90 90 VAL CG2 C 13 22.620 0.054 . 2 . 398 . . 90 VAL CG2 . 18428 1 709 . 1 1 90 90 VAL N N 15 120.139 0.051 . 1 . 398 . . 90 VAL N . 18428 1 710 . 1 1 91 91 MET H H 1 8.281 0.004 . 1 . 399 . . 91 MET H . 18428 1 711 . 1 1 91 91 MET HA H 1 3.727 0.001 . 1 . 399 . . 91 MET HA . 18428 1 712 . 1 1 91 91 MET C C 13 179.353 0.061 . 1 . 399 . . 91 MET C . 18428 1 713 . 1 1 91 91 MET CA C 13 60.119 0.07 . 1 . 399 . . 91 MET CA . 18428 1 714 . 1 1 91 91 MET CB C 13 32.036 0.001 . 1 . 399 . . 91 MET CB . 18428 1 715 . 1 1 91 91 MET N N 15 116.137 0.042 . 1 . 399 . . 91 MET N . 18428 1 716 . 1 1 92 92 GLN H H 1 8.644 0.001 . 1 . 400 . . 92 GLN H . 18428 1 717 . 1 1 92 92 GLN HA H 1 4.114 0.001 . 1 . 400 . . 92 GLN HA . 18428 1 718 . 1 1 92 92 GLN HB2 H 1 2.003 0.001 . 2 . 400 . . 92 GLN HB2 . 18428 1 719 . 1 1 92 92 GLN C C 13 179.263 0.001 . 1 . 400 . . 92 GLN C . 18428 1 720 . 1 1 92 92 GLN CA C 13 58.668 0.023 . 1 . 400 . . 92 GLN CA . 18428 1 721 . 1 1 92 92 GLN CB C 13 28.735 0.057 . 1 . 400 . . 92 GLN CB . 18428 1 722 . 1 1 92 92 GLN N N 15 117.351 0.05 . 1 . 400 . . 92 GLN N . 18428 1 723 . 1 1 93 93 ALA H H 1 7.807 0.003 . 1 . 401 . . 93 ALA H . 18428 1 724 . 1 1 93 93 ALA HA H 1 4.119 0.001 . 1 . 401 . . 93 ALA HA . 18428 1 725 . 1 1 93 93 ALA HB1 H 1 1.472 0.001 . 1 . 401 . . 93 ALA HB1 . 18428 1 726 . 1 1 93 93 ALA HB2 H 1 1.472 0.001 . 1 . 401 . . 93 ALA HB2 . 18428 1 727 . 1 1 93 93 ALA HB3 H 1 1.472 0.001 . 1 . 401 . . 93 ALA HB3 . 18428 1 728 . 1 1 93 93 ALA C C 13 179.293 0.009 . 1 . 401 . . 93 ALA C . 18428 1 729 . 1 1 93 93 ALA CA C 13 54.404 0.034 . 1 . 401 . . 93 ALA CA . 18428 1 730 . 1 1 93 93 ALA CB C 13 18.648 0.07 . 1 . 401 . . 93 ALA CB . 18428 1 731 . 1 1 93 93 ALA N N 15 120.193 0.03 . 1 . 401 . . 93 ALA N . 18428 1 732 . 1 1 94 94 ARG H H 1 7.230 0.003 . 1 . 402 . . 94 ARG H . 18428 1 733 . 1 1 94 94 ARG HA H 1 4.592 0.001 . 1 . 402 . . 94 ARG HA . 18428 1 734 . 1 1 94 94 ARG C C 13 174.529 0.034 . 1 . 402 . . 94 ARG C . 18428 1 735 . 1 1 94 94 ARG CA C 13 51.906 0.023 . 1 . 402 . . 94 ARG CA . 18428 1 736 . 1 1 94 94 ARG CB C 13 29.376 0.001 . 1 . 402 . . 94 ARG CB . 18428 1 737 . 1 1 94 94 ARG N N 15 112.326 0.026 . 1 . 402 . . 94 ARG N . 18428 1 738 . 1 1 95 95 ASN H H 1 7.688 0.003 . 1 . 403 . . 95 ASN H . 18428 1 739 . 1 1 95 95 ASN HA H 1 4.440 0.001 . 1 . 403 . . 95 ASN HA . 18428 1 740 . 1 1 95 95 ASN HB2 H 1 3.139 0.001 . 2 . 403 . . 95 ASN HB2 . 18428 1 741 . 1 1 95 95 ASN HB3 H 1 2.660 0.001 . 2 . 403 . . 95 ASN HB3 . 18428 1 742 . 1 1 95 95 ASN C C 13 174.327 0.004 . 1 . 403 . . 95 ASN C . 18428 1 743 . 1 1 95 95 ASN CA C 13 54.432 0.035 . 1 . 403 . . 95 ASN CA . 18428 1 744 . 1 1 95 95 ASN CB C 13 36.904 0.046 . 1 . 403 . . 95 ASN CB . 18428 1 745 . 1 1 95 95 ASN N N 15 118.202 0.035 . 1 . 403 . . 95 ASN N . 18428 1 746 . 1 1 96 96 LEU H H 1 8.588 0.004 . 1 . 404 . . 96 LEU H . 18428 1 747 . 1 1 96 96 LEU HA H 1 4.712 0.001 . 1 . 404 . . 96 LEU HA . 18428 1 748 . 1 1 96 96 LEU HB2 H 1 1.704 0.001 . 2 . 404 . . 96 LEU HB2 . 18428 1 749 . 1 1 96 96 LEU HB3 H 1 2.165 0.001 . 2 . 404 . . 96 LEU HB3 . 18428 1 750 . 1 1 96 96 LEU C C 13 174.458 0.033 . 1 . 404 . . 96 LEU C . 18428 1 751 . 1 1 96 96 LEU CA C 13 52.953 0.043 . 1 . 404 . . 96 LEU CA . 18428 1 752 . 1 1 96 96 LEU CB C 13 44.111 0.001 . 1 . 404 . . 96 LEU CB . 18428 1 753 . 1 1 96 96 LEU N N 15 116.842 0.023 . 1 . 404 . . 96 LEU N . 18428 1 754 . 1 1 97 97 ASP H H 1 8.788 0.004 . 1 . 405 . . 97 ASP H . 18428 1 755 . 1 1 97 97 ASP HA H 1 4.888 0.001 . 1 . 405 . . 97 ASP HA . 18428 1 756 . 1 1 97 97 ASP HB2 H 1 2.386 0.001 . 2 . 405 . . 97 ASP HB2 . 18428 1 757 . 1 1 97 97 ASP HB3 H 1 2.478 0.001 . 2 . 405 . . 97 ASP HB3 . 18428 1 758 . 1 1 97 97 ASP C C 13 172.954 0.04 . 1 . 405 . . 97 ASP C . 18428 1 759 . 1 1 97 97 ASP CA C 13 52.320 0.035 . 1 . 405 . . 97 ASP CA . 18428 1 760 . 1 1 97 97 ASP CB C 13 45.199 0.046 . 1 . 405 . . 97 ASP CB . 18428 1 761 . 1 1 97 97 ASP N N 15 119.318 0.027 . 1 . 405 . . 97 ASP N . 18428 1 762 . 1 1 98 98 MET H H 1 8.714 0.004 . 1 . 406 . . 98 MET H . 18428 1 763 . 1 1 98 98 MET HA H 1 5.695 0.001 . 1 . 406 . . 98 MET HA . 18428 1 764 . 1 1 98 98 MET HB2 H 1 1.828 0.001 . 2 . 406 . . 98 MET HB2 . 18428 1 765 . 1 1 98 98 MET HB3 H 1 1.970 0.001 . 2 . 406 . . 98 MET HB3 . 18428 1 766 . 1 1 98 98 MET C C 13 175.928 0.012 . 1 . 406 . . 98 MET C . 18428 1 767 . 1 1 98 98 MET CA C 13 53.232 0.046 . 1 . 406 . . 98 MET CA . 18428 1 768 . 1 1 98 98 MET CB C 13 37.376 0.034 . 1 . 406 . . 98 MET CB . 18428 1 769 . 1 1 98 98 MET N N 15 115.778 0.038 . 1 . 406 . . 98 MET N . 18428 1 770 . 1 1 99 99 ARG H H 1 8.707 0.005 . 1 . 407 . . 99 ARG H . 18428 1 771 . 1 1 99 99 ARG HA H 1 4.557 0.001 . 1 . 407 . . 99 ARG HA . 18428 1 772 . 1 1 99 99 ARG HB2 H 1 1.662 0.001 . 2 . 407 . . 99 ARG HB2 . 18428 1 773 . 1 1 99 99 ARG C C 13 174.712 0.027 . 1 . 407 . . 99 ARG C . 18428 1 774 . 1 1 99 99 ARG CA C 13 54.360 0.036 . 1 . 407 . . 99 ARG CA . 18428 1 775 . 1 1 99 99 ARG CB C 13 33.376 0.001 . 1 . 407 . . 99 ARG CB . 18428 1 776 . 1 1 99 99 ARG N N 15 121.447 0.041 . 1 . 407 . . 99 ARG N . 18428 1 777 . 1 1 100 100 GLN H H 1 9.008 0.003 . 1 . 408 . . 100 GLN H . 18428 1 778 . 1 1 100 100 GLN HA H 1 4.982 0.001 . 1 . 408 . . 100 GLN HA . 18428 1 779 . 1 1 100 100 GLN HB2 H 1 1.864 0.001 . 2 . 408 . . 100 GLN HB2 . 18428 1 780 . 1 1 100 100 GLN HB3 H 1 1.961 0.001 . 2 . 408 . . 100 GLN HB3 . 18428 1 781 . 1 1 100 100 GLN C C 13 175.059 0.01 . 1 . 408 . . 100 GLN C . 18428 1 782 . 1 1 100 100 GLN CA C 13 55.031 0.056 . 1 . 408 . . 100 GLN CA . 18428 1 783 . 1 1 100 100 GLN CB C 13 29.898 0.022 . 1 . 408 . . 100 GLN CB . 18428 1 784 . 1 1 100 100 GLN N N 15 125.780 0.025 . 1 . 408 . . 100 GLN N . 18428 1 785 . 1 1 101 101 GLN H H 1 8.843 0.002 . 1 . 409 . . 101 GLN H . 18428 1 786 . 1 1 101 101 GLN HA H 1 4.485 0.001 . 1 . 409 . . 101 GLN HA . 18428 1 787 . 1 1 101 101 GLN HB2 H 1 1.828 0.001 . 2 . 409 . . 101 GLN HB2 . 18428 1 788 . 1 1 101 101 GLN HB3 H 1 1.933 0.001 . 2 . 409 . . 101 GLN HB3 . 18428 1 789 . 1 1 101 101 GLN C C 13 175.690 0.009 . 1 . 409 . . 101 GLN C . 18428 1 790 . 1 1 101 101 GLN CA C 13 54.748 0.068 . 1 . 409 . . 101 GLN CA . 18428 1 791 . 1 1 101 101 GLN CB C 13 30.261 0.01 . 1 . 409 . . 101 GLN CB . 18428 1 792 . 1 1 101 101 GLN N N 15 127.631 0.022 . 1 . 409 . . 101 GLN N . 18428 1 793 . 1 1 102 102 GLY H H 1 9.047 0.007 . 1 . 410 . . 102 GLY H . 18428 1 794 . 1 1 102 102 GLY HA2 H 1 3.600 0.001 . 2 . 410 . . 102 GLY HA2 . 18428 1 795 . 1 1 102 102 GLY HA3 H 1 3.923 0.001 . 2 . 410 . . 102 GLY HA3 . 18428 1 796 . 1 1 102 102 GLY C C 13 174.350 0.006 . 1 . 410 . . 102 GLY C . 18428 1 797 . 1 1 102 102 GLY CA C 13 47.237 0.052 . 1 . 410 . . 102 GLY CA . 18428 1 798 . 1 1 102 102 GLY N N 15 117.047 0.039 . 1 . 410 . . 102 GLY N . 18428 1 799 . 1 1 103 103 ASN H H 1 8.758 0.005 . 1 . 411 . . 103 ASN H . 18428 1 800 . 1 1 103 103 ASN HA H 1 4.735 0.001 . 1 . 411 . . 103 ASN HA . 18428 1 801 . 1 1 103 103 ASN HB2 H 1 2.839 0.001 . 2 . 411 . . 103 ASN HB2 . 18428 1 802 . 1 1 103 103 ASN HB3 H 1 2.798 0.001 . 2 . 411 . . 103 ASN HB3 . 18428 1 803 . 1 1 103 103 ASN C C 13 173.911 0.012 . 1 . 411 . . 103 ASN C . 18428 1 804 . 1 1 103 103 ASN CA C 13 53.010 0.014 . 1 . 411 . . 103 ASN CA . 18428 1 805 . 1 1 103 103 ASN CB C 13 38.514 0.011 . 1 . 411 . . 103 ASN CB . 18428 1 806 . 1 1 103 103 ASN N N 15 124.994 0.05 . 1 . 411 . . 103 ASN N . 18428 1 807 . 1 1 104 104 ILE H H 1 7.880 0.002 . 1 . 412 . . 104 ILE H . 18428 1 808 . 1 1 104 104 ILE HA H 1 4.495 0.009 . 1 . 412 . . 104 ILE HA . 18428 1 809 . 1 1 104 104 ILE HB H 1 1.966 0.01 . 1 . 412 . . 104 ILE HB . 18428 1 810 . 1 1 104 104 ILE HG12 H 1 1.049 0.005 . 2 . 412 . . 104 ILE HG12 . 18428 1 811 . 1 1 104 104 ILE HG13 H 1 1.555 0.014 . 2 . 412 . . 104 ILE HG13 . 18428 1 812 . 1 1 104 104 ILE HG21 H 1 0.733 0.003 . 1 . 412 . . 104 ILE HG21 . 18428 1 813 . 1 1 104 104 ILE HG22 H 1 0.733 0.003 . 1 . 412 . . 104 ILE HG22 . 18428 1 814 . 1 1 104 104 ILE HG23 H 1 0.733 0.003 . 1 . 412 . . 104 ILE HG23 . 18428 1 815 . 1 1 104 104 ILE HD11 H 1 0.789 0.003 . 1 . 412 . . 104 ILE HD11 . 18428 1 816 . 1 1 104 104 ILE HD12 H 1 0.789 0.003 . 1 . 412 . . 104 ILE HD12 . 18428 1 817 . 1 1 104 104 ILE HD13 H 1 0.789 0.003 . 1 . 412 . . 104 ILE HD13 . 18428 1 818 . 1 1 104 104 ILE C C 13 174.766 0.009 . 1 . 412 . . 104 ILE C . 18428 1 819 . 1 1 104 104 ILE CA C 13 60.575 0.079 . 1 . 412 . . 104 ILE CA . 18428 1 820 . 1 1 104 104 ILE CB C 13 39.644 0.076 . 1 . 412 . . 104 ILE CB . 18428 1 821 . 1 1 104 104 ILE CG1 C 13 27.915 0.041 . 1 . 412 . . 104 ILE CG1 . 18428 1 822 . 1 1 104 104 ILE CG2 C 13 17.593 0.022 . 1 . 412 . . 104 ILE CG2 . 18428 1 823 . 1 1 104 104 ILE CD1 C 13 13.080 0.029 . 1 . 412 . . 104 ILE CD1 . 18428 1 824 . 1 1 104 104 ILE N N 15 120.101 0.022 . 1 . 412 . . 104 ILE N . 18428 1 825 . 1 1 105 105 VAL H H 1 8.549 0.004 . 1 . 413 . . 105 VAL H . 18428 1 826 . 1 1 105 105 VAL HA H 1 4.255 0.014 . 1 . 413 . . 105 VAL HA . 18428 1 827 . 1 1 105 105 VAL HB H 1 1.881 0.002 . 1 . 413 . . 105 VAL HB . 18428 1 828 . 1 1 105 105 VAL HG11 H 1 0.778 0.004 . 2 . 413 . . 105 VAL HG11 . 18428 1 829 . 1 1 105 105 VAL HG12 H 1 0.778 0.004 . 2 . 413 . . 105 VAL HG12 . 18428 1 830 . 1 1 105 105 VAL HG13 H 1 0.778 0.004 . 2 . 413 . . 105 VAL HG13 . 18428 1 831 . 1 1 105 105 VAL C C 13 173.992 0.017 . 1 . 413 . . 105 VAL C . 18428 1 832 . 1 1 105 105 VAL CA C 13 61.314 0.075 . 1 . 413 . . 105 VAL CA . 18428 1 833 . 1 1 105 105 VAL CB C 13 32.991 0.001 . 1 . 413 . . 105 VAL CB . 18428 1 834 . 1 1 105 105 VAL CG1 C 13 20.920 0.001 . 2 . 413 . . 105 VAL CG1 . 18428 1 835 . 1 1 105 105 VAL N N 15 127.009 0.033 . 1 . 413 . . 105 VAL N . 18428 1 836 . 1 1 106 106 ASN H H 1 8.715 0.005 . 1 . 414 . . 106 ASN H . 18428 1 837 . 1 1 106 106 ASN HA H 1 5.324 0.001 . 1 . 414 . . 106 ASN HA . 18428 1 838 . 1 1 106 106 ASN HB2 H 1 2.530 0.001 . 2 . 414 . . 106 ASN HB2 . 18428 1 839 . 1 1 106 106 ASN C C 13 174.493 0.024 . 1 . 414 . . 106 ASN C . 18428 1 840 . 1 1 106 106 ASN CA C 13 52.907 0.014 . 1 . 414 . . 106 ASN CA . 18428 1 841 . 1 1 106 106 ASN CB C 13 40.922 0.02 . 1 . 414 . . 106 ASN CB . 18428 1 842 . 1 1 106 106 ASN N N 15 126.133 0.028 . 1 . 414 . . 106 ASN N . 18428 1 843 . 1 1 107 107 ILE H H 1 8.528 0.004 . 1 . 415 . . 107 ILE H . 18428 1 844 . 1 1 107 107 ILE HA H 1 5.031 0.014 . 1 . 415 . . 107 ILE HA . 18428 1 845 . 1 1 107 107 ILE HB H 1 1.507 0.009 . 1 . 415 . . 107 ILE HB . 18428 1 846 . 1 1 107 107 ILE HG12 H 1 1.177 0.004 . 2 . 415 . . 107 ILE HG12 . 18428 1 847 . 1 1 107 107 ILE HG13 H 1 1.353 0.014 . 2 . 415 . . 107 ILE HG13 . 18428 1 848 . 1 1 107 107 ILE HG21 H 1 0.757 0.004 . 1 . 415 . . 107 ILE HG21 . 18428 1 849 . 1 1 107 107 ILE HG22 H 1 0.757 0.004 . 1 . 415 . . 107 ILE HG22 . 18428 1 850 . 1 1 107 107 ILE HG23 H 1 0.757 0.004 . 1 . 415 . . 107 ILE HG23 . 18428 1 851 . 1 1 107 107 ILE HD11 H 1 0.712 0.001 . 1 . 415 . . 107 ILE HD11 . 18428 1 852 . 1 1 107 107 ILE HD12 H 1 0.712 0.001 . 1 . 415 . . 107 ILE HD12 . 18428 1 853 . 1 1 107 107 ILE HD13 H 1 0.712 0.001 . 1 . 415 . . 107 ILE HD13 . 18428 1 854 . 1 1 107 107 ILE C C 13 173.805 0.025 . 1 . 415 . . 107 ILE C . 18428 1 855 . 1 1 107 107 ILE CA C 13 59.041 0.082 . 1 . 415 . . 107 ILE CA . 18428 1 856 . 1 1 107 107 ILE CB C 13 39.582 0.088 . 1 . 415 . . 107 ILE CB . 18428 1 857 . 1 1 107 107 ILE CG1 C 13 27.801 0.06 . 1 . 415 . . 107 ILE CG1 . 18428 1 858 . 1 1 107 107 ILE CG2 C 13 18.664 0.06 . 1 . 415 . . 107 ILE CG2 . 18428 1 859 . 1 1 107 107 ILE CD1 C 13 13.650 0.016 . 1 . 415 . . 107 ILE CD1 . 18428 1 860 . 1 1 107 107 ILE N N 15 123.227 0.058 . 1 . 415 . . 107 ILE N . 18428 1 861 . 1 1 108 108 ALA H H 1 8.399 0.003 . 1 . 416 . . 108 ALA H . 18428 1 862 . 1 1 108 108 ALA HA H 1 4.573 0.001 . 1 . 416 . . 108 ALA HA . 18428 1 863 . 1 1 108 108 ALA HB1 H 1 1.248 0.001 . 1 . 416 . . 108 ALA HB1 . 18428 1 864 . 1 1 108 108 ALA HB2 H 1 1.248 0.001 . 1 . 416 . . 108 ALA HB2 . 18428 1 865 . 1 1 108 108 ALA HB3 H 1 1.248 0.001 . 1 . 416 . . 108 ALA HB3 . 18428 1 866 . 1 1 108 108 ALA C C 13 172.793 0.005 . 1 . 416 . . 108 ALA C . 18428 1 867 . 1 1 108 108 ALA CA C 13 50.126 0.001 . 1 . 416 . . 108 ALA CA . 18428 1 868 . 1 1 108 108 ALA CB C 13 20.356 0.001 . 1 . 416 . . 108 ALA CB . 18428 1 869 . 1 1 108 108 ALA N N 15 128.526 0.043 . 1 . 416 . . 108 ALA N . 18428 1 870 . 1 1 109 109 PRO HA H 1 4.446 0.001 . 1 . 417 . . 109 PRO HA . 18428 1 871 . 1 1 109 109 PRO HB2 H 1 2.557 0.001 . 2 . 417 . . 109 PRO HB2 . 18428 1 872 . 1 1 109 109 PRO C C 13 177.145 0.001 . 1 . 417 . . 109 PRO C . 18428 1 873 . 1 1 109 109 PRO CA C 13 63.661 0.001 . 1 . 417 . . 109 PRO CA . 18428 1 874 . 1 1 109 109 PRO CB C 13 32.307 0.001 . 1 . 417 . . 109 PRO CB . 18428 1 875 . 1 1 110 110 ARG H H 1 8.659 0.002 . 1 . 418 . . 110 ARG H . 18428 1 876 . 1 1 110 110 ARG HA H 1 3.757 0.001 . 1 . 418 . . 110 ARG HA . 18428 1 877 . 1 1 110 110 ARG HB2 H 1 1.632 0.001 . 2 . 418 . . 110 ARG HB2 . 18428 1 878 . 1 1 110 110 ARG C C 13 177.663 0.007 . 1 . 418 . . 110 ARG C . 18428 1 879 . 1 1 110 110 ARG CA C 13 60.006 0.001 . 1 . 418 . . 110 ARG CA . 18428 1 880 . 1 1 110 110 ARG CB C 13 30.309 0.058 . 1 . 418 . . 110 ARG CB . 18428 1 881 . 1 1 110 110 ARG N N 15 124.465 0.047 . 1 . 418 . . 110 ARG N . 18428 1 882 . 1 1 111 111 ASP H H 1 8.803 0.003 . 1 . 419 . . 111 ASP H . 18428 1 883 . 1 1 111 111 ASP HA H 1 4.321 0.001 . 1 . 419 . . 111 ASP HA . 18428 1 884 . 1 1 111 111 ASP HB2 H 1 2.627 0.001 . 2 . 419 . . 111 ASP HB2 . 18428 1 885 . 1 1 111 111 ASP HB3 H 1 2.539 0.001 . 2 . 419 . . 111 ASP HB3 . 18428 1 886 . 1 1 111 111 ASP C C 13 177.925 0.009 . 1 . 419 . . 111 ASP C . 18428 1 887 . 1 1 111 111 ASP CA C 13 56.359 0.03 . 1 . 419 . . 111 ASP CA . 18428 1 888 . 1 1 111 111 ASP CB C 13 39.871 0.028 . 1 . 419 . . 111 ASP CB . 18428 1 889 . 1 1 111 111 ASP N N 15 116.980 0.026 . 1 . 419 . . 111 ASP N . 18428 1 890 . 1 1 112 112 GLU H H 1 7.459 0.004 . 1 . 420 . . 112 GLU H . 18428 1 891 . 1 1 112 112 GLU HA H 1 4.064 0.001 . 1 . 420 . . 112 GLU HA . 18428 1 892 . 1 1 112 112 GLU HB2 H 1 1.988 0.001 . 2 . 420 . . 112 GLU HB2 . 18428 1 893 . 1 1 112 112 GLU C C 13 178.175 0.034 . 1 . 420 . . 112 GLU C . 18428 1 894 . 1 1 112 112 GLU CA C 13 58.192 0.034 . 1 . 420 . . 112 GLU CA . 18428 1 895 . 1 1 112 112 GLU CB C 13 30.233 0.001 . 1 . 420 . . 112 GLU CB . 18428 1 896 . 1 1 112 112 GLU N N 15 120.974 0.032 . 1 . 420 . . 112 GLU N . 18428 1 897 . 1 1 113 113 LEU H H 1 7.542 0.003 . 1 . 421 . . 113 LEU H . 18428 1 898 . 1 1 113 113 LEU HA H 1 4.028 0.004 . 1 . 421 . . 113 LEU HA . 18428 1 899 . 1 1 113 113 LEU HB2 H 1 1.642 0.006 . 2 . 421 . . 113 LEU HB2 . 18428 1 900 . 1 1 113 113 LEU HB3 H 1 1.336 0.002 . 2 . 421 . . 113 LEU HB3 . 18428 1 901 . 1 1 113 113 LEU HD11 H 1 0.664 0.013 . 2 . 421 . . 113 LEU HD11 . 18428 1 902 . 1 1 113 113 LEU HD12 H 1 0.664 0.013 . 2 . 421 . . 113 LEU HD12 . 18428 1 903 . 1 1 113 113 LEU HD13 H 1 0.664 0.013 . 2 . 421 . . 113 LEU HD13 . 18428 1 904 . 1 1 113 113 LEU C C 13 178.341 0.055 . 1 . 421 . . 113 LEU C . 18428 1 905 . 1 1 113 113 LEU CA C 13 56.678 0.015 . 1 . 421 . . 113 LEU CA . 18428 1 906 . 1 1 113 113 LEU CB C 13 41.275 0.049 . 1 . 421 . . 113 LEU CB . 18428 1 907 . 1 1 113 113 LEU CD1 C 13 25.783 0.1 . 2 . 421 . . 113 LEU CD1 . 18428 1 908 . 1 1 113 113 LEU N N 15 119.470 0.018 . 1 . 421 . . 113 LEU N . 18428 1 909 . 1 1 114 114 LEU H H 1 7.854 0.001 . 1 . 422 . . 114 LEU H . 18428 1 910 . 1 1 114 114 LEU HA H 1 4.113 0.0 . 1 . 422 . . 114 LEU HA . 18428 1 911 . 1 1 114 114 LEU HB2 H 1 1.483 0.001 . 2 . 422 . . 114 LEU HB2 . 18428 1 912 . 1 1 114 114 LEU HB3 H 1 1.629 0.002 . 2 . 422 . . 114 LEU HB3 . 18428 1 913 . 1 1 114 114 LEU HD11 H 1 0.847 0.009 . 2 . 422 . . 114 LEU HD11 . 18428 1 914 . 1 1 114 114 LEU HD12 H 1 0.847 0.009 . 2 . 422 . . 114 LEU HD12 . 18428 1 915 . 1 1 114 114 LEU HD13 H 1 0.847 0.009 . 2 . 422 . . 114 LEU HD13 . 18428 1 916 . 1 1 114 114 LEU C C 13 178.490 0.023 . 1 . 422 . . 114 LEU C . 18428 1 917 . 1 1 114 114 LEU CA C 13 56.668 0.001 . 1 . 422 . . 114 LEU CA . 18428 1 918 . 1 1 114 114 LEU CB C 13 41.824 0.001 . 1 . 422 . . 114 LEU CB . 18428 1 919 . 1 1 114 114 LEU CD1 C 13 24.910 0.053 . 2 . 422 . . 114 LEU CD1 . 18428 1 920 . 1 1 114 114 LEU N N 15 120.027 0.044 . 1 . 422 . . 114 LEU N . 18428 1 921 . 1 1 115 115 ALA H H 1 7.614 0.003 . 1 . 423 . . 115 ALA H . 18428 1 922 . 1 1 115 115 ALA HA H 1 4.085 0.001 . 1 . 423 . . 115 ALA HA . 18428 1 923 . 1 1 115 115 ALA HB1 H 1 1.380 0.001 . 1 . 423 . . 115 ALA HB1 . 18428 1 924 . 1 1 115 115 ALA HB2 H 1 1.380 0.001 . 1 . 423 . . 115 ALA HB2 . 18428 1 925 . 1 1 115 115 ALA HB3 H 1 1.380 0.001 . 1 . 423 . . 115 ALA HB3 . 18428 1 926 . 1 1 115 115 ALA C C 13 179.456 0.008 . 1 . 423 . . 115 ALA C . 18428 1 927 . 1 1 115 115 ALA CA C 13 53.956 0.012 . 1 . 423 . . 115 ALA CA . 18428 1 928 . 1 1 115 115 ALA CB C 13 18.193 0.002 . 1 . 423 . . 115 ALA CB . 18428 1 929 . 1 1 115 115 ALA N N 15 121.532 0.024 . 1 . 423 . . 115 ALA N . 18428 1 930 . 1 1 116 116 LYS H H 1 7.792 0.002 . 1 . 424 . . 116 LYS H . 18428 1 931 . 1 1 116 116 LYS HA H 1 4.088 0.001 . 1 . 424 . . 116 LYS HA . 18428 1 932 . 1 1 116 116 LYS HB2 H 1 1.807 0.001 . 2 . 424 . . 116 LYS HB2 . 18428 1 933 . 1 1 116 116 LYS C C 13 177.612 0.049 . 1 . 424 . . 116 LYS C . 18428 1 934 . 1 1 116 116 LYS CA C 13 57.841 0.015 . 1 . 424 . . 116 LYS CA . 18428 1 935 . 1 1 116 116 LYS CB C 13 32.499 0.015 . 1 . 424 . . 116 LYS CB . 18428 1 936 . 1 1 116 116 LYS N N 15 119.347 0.024 . 1 . 424 . . 116 LYS N . 18428 1 937 . 1 1 117 117 ASP H H 1 8.015 0.002 . 1 . 425 . . 117 ASP H . 18428 1 938 . 1 1 117 117 ASP HA H 1 4.450 0.001 . 1 . 425 . . 117 ASP HA . 18428 1 939 . 1 1 117 117 ASP HB2 H 1 2.650 0.001 . 2 . 425 . . 117 ASP HB2 . 18428 1 940 . 1 1 117 117 ASP C C 13 177.504 0.001 . 1 . 425 . . 117 ASP C . 18428 1 941 . 1 1 117 117 ASP CA C 13 55.782 0.021 . 1 . 425 . . 117 ASP CA . 18428 1 942 . 1 1 117 117 ASP CB C 13 40.698 0.052 . 1 . 425 . . 117 ASP CB . 18428 1 943 . 1 1 117 117 ASP N N 15 120.397 0.024 . 1 . 425 . . 117 ASP N . 18428 1 944 . 1 1 118 118 LYS H H 1 7.888 0.002 . 1 . 426 . . 118 LYS H . 18428 1 945 . 1 1 118 118 LYS HA H 1 4.073 0.001 . 1 . 426 . . 118 LYS HA . 18428 1 946 . 1 1 118 118 LYS HB2 H 1 1.767 0.001 . 2 . 426 . . 118 LYS HB2 . 18428 1 947 . 1 1 118 118 LYS C C 13 177.376 0.01 . 1 . 426 . . 118 LYS C . 18428 1 948 . 1 1 118 118 LYS CA C 13 57.656 0.004 . 1 . 426 . . 118 LYS CA . 18428 1 949 . 1 1 118 118 LYS CB C 13 32.445 0.004 . 1 . 426 . . 118 LYS CB . 18428 1 950 . 1 1 118 118 LYS N N 15 119.885 0.035 . 1 . 426 . . 118 LYS N . 18428 1 951 . 1 1 119 119 ALA H H 1 7.929 0.002 . 1 . 427 . . 119 ALA H . 18428 1 952 . 1 1 119 119 ALA HA H 1 4.128 0.001 . 1 . 427 . . 119 ALA HA . 18428 1 953 . 1 1 119 119 ALA HB1 H 1 1.289 0.001 . 1 . 427 . . 119 ALA HB1 . 18428 1 954 . 1 1 119 119 ALA HB2 H 1 1.289 0.001 . 1 . 427 . . 119 ALA HB2 . 18428 1 955 . 1 1 119 119 ALA HB3 H 1 1.289 0.001 . 1 . 427 . . 119 ALA HB3 . 18428 1 956 . 1 1 119 119 ALA C C 13 178.603 0.009 . 1 . 427 . . 119 ALA C . 18428 1 957 . 1 1 119 119 ALA CA C 13 53.556 0.001 . 1 . 427 . . 119 ALA CA . 18428 1 958 . 1 1 119 119 ALA CB C 13 18.512 0.039 . 1 . 427 . . 119 ALA CB . 18428 1 959 . 1 1 119 119 ALA N N 15 122.674 0.012 . 1 . 427 . . 119 ALA N . 18428 1 960 . 1 1 120 120 PHE H H 1 7.944 0.002 . 1 . 428 . . 120 PHE H . 18428 1 961 . 1 1 120 120 PHE HA H 1 4.435 0.005 . 1 . 428 . . 120 PHE HA . 18428 1 962 . 1 1 120 120 PHE HB2 H 1 3.078 0.019 . 2 . 428 . . 120 PHE HB2 . 18428 1 963 . 1 1 120 120 PHE HB3 H 1 3.121 0.018 . 2 . 428 . . 120 PHE HB3 . 18428 1 964 . 1 1 120 120 PHE C C 13 176.331 0.006 . 1 . 428 . . 120 PHE C . 18428 1 965 . 1 1 120 120 PHE CA C 13 58.710 0.039 . 1 . 428 . . 120 PHE CA . 18428 1 966 . 1 1 120 120 PHE CB C 13 39.040 0.012 . 1 . 428 . . 120 PHE CB . 18428 1 967 . 1 1 120 120 PHE N N 15 118.697 0.009 . 1 . 428 . . 120 PHE N . 18428 1 968 . 1 1 121 121 LEU H H 1 7.872 0.002 . 1 . 429 . . 121 LEU H . 18428 1 969 . 1 1 121 121 LEU HA H 1 4.135 0.003 . 1 . 429 . . 121 LEU HA . 18428 1 970 . 1 1 121 121 LEU HB2 H 1 1.491 0.003 . 2 . 429 . . 121 LEU HB2 . 18428 1 971 . 1 1 121 121 LEU HB3 H 1 1.630 0.007 . 2 . 429 . . 121 LEU HB3 . 18428 1 972 . 1 1 121 121 LEU HD21 H 1 0.850 0.001 . 2 . 429 . . 121 LEU HD21 . 18428 1 973 . 1 1 121 121 LEU HD22 H 1 0.850 0.001 . 2 . 429 . . 121 LEU HD22 . 18428 1 974 . 1 1 121 121 LEU HD23 H 1 0.850 0.001 . 2 . 429 . . 121 LEU HD23 . 18428 1 975 . 1 1 121 121 LEU C C 13 177.796 0.005 . 1 . 429 . . 121 LEU C . 18428 1 976 . 1 1 121 121 LEU CA C 13 55.850 0.011 . 1 . 429 . . 121 LEU CA . 18428 1 977 . 1 1 121 121 LEU CB C 13 42.051 0.029 . 1 . 429 . . 121 LEU CB . 18428 1 978 . 1 1 121 121 LEU CD2 C 13 24.843 0.001 . 2 . 429 . . 121 LEU CD2 . 18428 1 979 . 1 1 121 121 LEU N N 15 121.714 0.011 . 1 . 429 . . 121 LEU N . 18428 1 980 . 1 1 122 122 GLN H H 1 8.054 0.002 . 1 . 430 . . 122 GLN H . 18428 1 981 . 1 1 122 122 GLN HA H 1 4.106 0.001 . 1 . 430 . . 122 GLN HA . 18428 1 982 . 1 1 122 122 GLN HB2 H 1 1.976 0.001 . 2 . 430 . . 122 GLN HB2 . 18428 1 983 . 1 1 122 122 GLN HB3 H 1 2.028 0.001 . 2 . 430 . . 122 GLN HB3 . 18428 1 984 . 1 1 122 122 GLN C C 13 176.013 0.005 . 1 . 430 . . 122 GLN C . 18428 1 985 . 1 1 122 122 GLN CA C 13 56.427 0.045 . 1 . 430 . . 122 GLN CA . 18428 1 986 . 1 1 122 122 GLN CB C 13 28.987 0.019 . 1 . 430 . . 122 GLN CB . 18428 1 987 . 1 1 122 122 GLN N N 15 120.089 0.033 . 1 . 430 . . 122 GLN N . 18428 1 988 . 1 1 123 123 ALA H H 1 8.046 0.002 . 1 . 431 . . 123 ALA H . 18428 1 989 . 1 1 123 123 ALA HA H 1 4.191 0.001 . 1 . 431 . . 123 ALA HA . 18428 1 990 . 1 1 123 123 ALA HB1 H 1 1.336 0.001 . 1 . 431 . . 123 ALA HB1 . 18428 1 991 . 1 1 123 123 ALA HB2 H 1 1.336 0.001 . 1 . 431 . . 123 ALA HB2 . 18428 1 992 . 1 1 123 123 ALA HB3 H 1 1.336 0.001 . 1 . 431 . . 123 ALA HB3 . 18428 1 993 . 1 1 123 123 ALA C C 13 178.343 0.006 . 1 . 431 . . 123 ALA C . 18428 1 994 . 1 1 123 123 ALA CA C 13 53.175 0.059 . 1 . 431 . . 123 ALA CA . 18428 1 995 . 1 1 123 123 ALA CB C 13 18.884 0.02 . 1 . 431 . . 123 ALA CB . 18428 1 996 . 1 1 123 123 ALA N N 15 123.904 0.01 . 1 . 431 . . 123 ALA N . 18428 1 997 . 1 1 124 124 GLU H H 1 8.141 0.002 . 1 . 432 . . 124 GLU H . 18428 1 998 . 1 1 124 124 GLU HA H 1 4.081 0.001 . 1 . 432 . . 124 GLU HA . 18428 1 999 . 1 1 124 124 GLU HB2 H 1 1.881 0.001 . 2 . 432 . . 124 GLU HB2 . 18428 1 1000 . 1 1 124 124 GLU HB3 H 1 1.964 0.001 . 2 . 432 . . 124 GLU HB3 . 18428 1 1001 . 1 1 124 124 GLU C C 13 177.167 0.006 . 1 . 432 . . 124 GLU C . 18428 1 1002 . 1 1 124 124 GLU CA C 13 57.279 0.001 . 1 . 432 . . 124 GLU CA . 18428 1 1003 . 1 1 124 124 GLU CB C 13 29.889 0.019 . 1 . 432 . . 124 GLU CB . 18428 1 1004 . 1 1 124 124 GLU N N 15 119.285 0.039 . 1 . 432 . . 124 GLU N . 18428 1 1005 . 1 1 125 125 LYS H H 1 8.039 0.003 . 1 . 433 . . 125 LYS H . 18428 1 1006 . 1 1 125 125 LYS HA H 1 4.161 0.001 . 1 . 433 . . 125 LYS HA . 18428 1 1007 . 1 1 125 125 LYS C C 13 176.619 0.008 . 1 . 433 . . 125 LYS C . 18428 1 1008 . 1 1 125 125 LYS CA C 13 56.983 0.073 . 1 . 433 . . 125 LYS CA . 18428 1 1009 . 1 1 125 125 LYS CB C 13 32.831 0.006 . 1 . 433 . . 125 LYS CB . 18428 1 1010 . 1 1 125 125 LYS N N 15 121.054 0.013 . 1 . 433 . . 125 LYS N . 18428 1 1011 . 1 1 126 126 ASP H H 1 8.231 0.002 . 1 . 434 . . 126 ASP H . 18428 1 1012 . 1 1 126 126 ASP HA H 1 4.504 0.001 . 1 . 434 . . 126 ASP HA . 18428 1 1013 . 1 1 126 126 ASP HB2 H 1 2.569 0.001 . 2 . 434 . . 126 ASP HB2 . 18428 1 1014 . 1 1 126 126 ASP HB3 H 1 2.659 0.001 . 2 . 434 . . 126 ASP HB3 . 18428 1 1015 . 1 1 126 126 ASP C C 13 176.799 0.001 . 1 . 434 . . 126 ASP C . 18428 1 1016 . 1 1 126 126 ASP CA C 13 54.917 0.029 . 1 . 434 . . 126 ASP CA . 18428 1 1017 . 1 1 126 126 ASP CB C 13 40.938 0.005 . 1 . 434 . . 126 ASP CB . 18428 1 1018 . 1 1 126 126 ASP N N 15 120.668 0.007 . 1 . 434 . . 126 ASP N . 18428 1 1019 . 1 1 127 127 ILE H H 1 7.844 0.002 . 1 . 435 . . 127 ILE H . 18428 1 1020 . 1 1 127 127 ILE HA H 1 4.023 0.007 . 1 . 435 . . 127 ILE HA . 18428 1 1021 . 1 1 127 127 ILE HB H 1 1.857 0.005 . 1 . 435 . . 127 ILE HB . 18428 1 1022 . 1 1 127 127 ILE HG12 H 1 1.132 0.003 . 2 . 435 . . 127 ILE HG12 . 18428 1 1023 . 1 1 127 127 ILE HG13 H 1 1.426 0.004 . 2 . 435 . . 127 ILE HG13 . 18428 1 1024 . 1 1 127 127 ILE HG21 H 1 0.858 0.0 . 1 . 435 . . 127 ILE HG21 . 18428 1 1025 . 1 1 127 127 ILE HG22 H 1 0.858 0.0 . 1 . 435 . . 127 ILE HG22 . 18428 1 1026 . 1 1 127 127 ILE HG23 H 1 0.858 0.0 . 1 . 435 . . 127 ILE HG23 . 18428 1 1027 . 1 1 127 127 ILE HD11 H 1 0.797 0.0 . 1 . 435 . . 127 ILE HD11 . 18428 1 1028 . 1 1 127 127 ILE HD12 H 1 0.797 0.0 . 1 . 435 . . 127 ILE HD12 . 18428 1 1029 . 1 1 127 127 ILE HD13 H 1 0.797 0.0 . 1 . 435 . . 127 ILE HD13 . 18428 1 1030 . 1 1 127 127 ILE C C 13 176.600 0.011 . 1 . 435 . . 127 ILE C . 18428 1 1031 . 1 1 127 127 ILE CA C 13 61.783 0.057 . 1 . 435 . . 127 ILE CA . 18428 1 1032 . 1 1 127 127 ILE CB C 13 38.418 0.058 . 1 . 435 . . 127 ILE CB . 18428 1 1033 . 1 1 127 127 ILE CG1 C 13 27.560 0.029 . 1 . 435 . . 127 ILE CG1 . 18428 1 1034 . 1 1 127 127 ILE CG2 C 13 17.527 0.001 . 1 . 435 . . 127 ILE CG2 . 18428 1 1035 . 1 1 127 127 ILE CD1 C 13 13.155 0.001 . 1 . 435 . . 127 ILE CD1 . 18428 1 1036 . 1 1 127 127 ILE N N 15 120.256 0.015 . 1 . 435 . . 127 ILE N . 18428 1 1037 . 1 1 128 128 ALA H H 1 8.148 0.001 . 1 . 436 . . 128 ALA H . 18428 1 1038 . 1 1 128 128 ALA HA H 1 4.198 0.001 . 1 . 436 . . 128 ALA HA . 18428 1 1039 . 1 1 128 128 ALA HB1 H 1 1.316 0.001 . 1 . 436 . . 128 ALA HB1 . 18428 1 1040 . 1 1 128 128 ALA HB2 H 1 1.316 0.001 . 1 . 436 . . 128 ALA HB2 . 18428 1 1041 . 1 1 128 128 ALA HB3 H 1 1.316 0.001 . 1 . 436 . . 128 ALA HB3 . 18428 1 1042 . 1 1 128 128 ALA C C 13 177.831 0.019 . 1 . 436 . . 128 ALA C . 18428 1 1043 . 1 1 128 128 ALA CA C 13 53.101 0.027 . 1 . 436 . . 128 ALA CA . 18428 1 1044 . 1 1 128 128 ALA CB C 13 18.970 0.002 . 1 . 436 . . 128 ALA CB . 18428 1 1045 . 1 1 128 128 ALA N N 15 126.370 0.012 . 1 . 436 . . 128 ALA N . 18428 1 1046 . 1 1 129 129 ASP H H 1 8.145 0.002 . 1 . 437 . . 129 ASP H . 18428 1 1047 . 1 1 129 129 ASP HA H 1 4.507 0.001 . 1 . 437 . . 129 ASP HA . 18428 1 1048 . 1 1 129 129 ASP HB2 H 1 2.961 0.001 . 2 . 437 . . 129 ASP HB2 . 18428 1 1049 . 1 1 129 129 ASP HB3 H 1 3.102 0.001 . 2 . 437 . . 129 ASP HB3 . 18428 1 1050 . 1 1 129 129 ASP C C 13 176.769 0.012 . 1 . 437 . . 129 ASP C . 18428 1 1051 . 1 1 129 129 ASP CA C 13 54.427 0.001 . 1 . 437 . . 129 ASP CA . 18428 1 1052 . 1 1 129 129 ASP CB C 13 41.137 0.001 . 1 . 437 . . 129 ASP CB . 18428 1 1053 . 1 1 129 129 ASP N N 15 118.739 0.01 . 1 . 437 . . 129 ASP N . 18428 1 1054 . 1 1 130 130 LEU H H 1 8.127 0.004 . 1 . 438 . . 130 LEU H . 18428 1 1055 . 1 1 130 130 LEU HA H 1 4.269 0.001 . 1 . 438 . . 130 LEU HA . 18428 1 1056 . 1 1 130 130 LEU HB2 H 1 1.584 0.001 . 2 . 438 . . 130 LEU HB2 . 18428 1 1057 . 1 1 130 130 LEU HB3 H 1 1.677 0.001 . 2 . 438 . . 130 LEU HB3 . 18428 1 1058 . 1 1 130 130 LEU C C 13 178.201 0.021 . 1 . 438 . . 130 LEU C . 18428 1 1059 . 1 1 130 130 LEU CA C 13 55.635 0.001 . 1 . 438 . . 130 LEU CA . 18428 1 1060 . 1 1 130 130 LEU CB C 13 41.854 0.001 . 1 . 438 . . 130 LEU CB . 18428 1 1061 . 1 1 130 130 LEU N N 15 122.599 0.041 . 1 . 438 . . 130 LEU N . 18428 1 1062 . 1 1 131 131 GLY H H 1 8.320 0.002 . 1 . 439 . . 131 GLY H . 18428 1 1063 . 1 1 131 131 GLY HA2 H 1 3.901 0.001 . 2 . 439 . . 131 GLY HA2 . 18428 1 1064 . 1 1 131 131 GLY C C 13 173.419 0.01 . 1 . 439 . . 131 GLY C . 18428 1 1065 . 1 1 131 131 GLY CA C 13 44.991 0.032 . 1 . 439 . . 131 GLY CA . 18428 1 1066 . 1 1 131 131 GLY N N 15 108.192 0.046 . 1 . 439 . . 131 GLY N . 18428 1 1067 . 1 1 132 132 ALA H H 1 7.806 0.003 . 1 . 440 . . 132 ALA H . 18428 1 1068 . 1 1 132 132 ALA HA H 1 4.110 0.001 . 1 . 440 . . 132 ALA HA . 18428 1 1069 . 1 1 132 132 ALA HB1 H 1 1.225 0.001 . 1 . 440 . . 132 ALA HB1 . 18428 1 1070 . 1 1 132 132 ALA HB2 H 1 1.225 0.001 . 1 . 440 . . 132 ALA HB2 . 18428 1 1071 . 1 1 132 132 ALA HB3 H 1 1.225 0.001 . 1 . 440 . . 132 ALA HB3 . 18428 1 1072 . 1 1 132 132 ALA C C 13 176.331 0.063 . 1 . 440 . . 132 ALA C . 18428 1 1073 . 1 1 132 132 ALA CA C 13 52.174 0.004 . 1 . 440 . . 132 ALA CA . 18428 1 1074 . 1 1 132 132 ALA CB C 13 19.302 0.029 . 1 . 440 . . 132 ALA CB . 18428 1 1075 . 1 1 132 132 ALA N N 15 123.037 0.022 . 1 . 440 . . 132 ALA N . 18428 1 1076 . 1 1 133 133 LEU H H 1 7.894 0.004 . 1 . 441 . . 133 LEU H . 18428 1 1077 . 1 1 133 133 LEU HA H 1 4.407 0.001 . 1 . 441 . . 133 LEU HA . 18428 1 1078 . 1 1 133 133 LEU C C 13 176.180 0.001 . 1 . 441 . . 133 LEU C . 18428 1 1079 . 1 1 133 133 LEU CA C 13 53.594 0.022 . 1 . 441 . . 133 LEU CA . 18428 1 1080 . 1 1 133 133 LEU CB C 13 39.285 0.001 . 1 . 441 . . 133 LEU CB . 18428 1 1081 . 1 1 133 133 LEU N N 15 118.176 0.04 . 1 . 441 . . 133 LEU N . 18428 1 1082 . 1 1 134 134 TYR H H 1 8.909 0.007 . 1 . 442 . . 134 TYR H . 18428 1 1083 . 1 1 134 134 TYR C C 13 176.250 0.001 . 1 . 442 . . 134 TYR C . 18428 1 1084 . 1 1 134 134 TYR CA C 13 56.763 0.001 . 1 . 442 . . 134 TYR CA . 18428 1 1085 . 1 1 134 134 TYR CB C 13 35.266 0.001 . 1 . 442 . . 134 TYR CB . 18428 1 1086 . 1 1 134 134 TYR N N 15 122.623 0.043 . 1 . 442 . . 134 TYR N . 18428 1 1087 . 1 1 138 138 PHE C C 13 173.539 0.001 . 1 . 446 . . 138 PHE C . 18428 1 1088 . 1 1 138 138 PHE CA C 13 57.148 0.001 . 1 . 446 . . 138 PHE CA . 18428 1 1089 . 1 1 138 138 PHE CB C 13 40.790 0.001 . 1 . 446 . . 138 PHE CB . 18428 1 1090 . 1 1 139 139 GLN H H 1 8.822 0.004 . 1 . 447 . . 139 GLN H . 18428 1 1091 . 1 1 139 139 GLN HA H 1 4.662 0.001 . 1 . 447 . . 139 GLN HA . 18428 1 1092 . 1 1 139 139 GLN C C 13 175.451 0.013 . 1 . 447 . . 139 GLN C . 18428 1 1093 . 1 1 139 139 GLN CA C 13 55.183 0.023 . 1 . 447 . . 139 GLN CA . 18428 1 1094 . 1 1 139 139 GLN CB C 13 29.419 0.002 . 1 . 447 . . 139 GLN CB . 18428 1 1095 . 1 1 139 139 GLN N N 15 125.578 0.05 . 1 . 447 . . 139 GLN N . 18428 1 1096 . 1 1 140 140 LEU H H 1 8.206 0.006 . 1 . 448 . . 140 LEU H . 18428 1 1097 . 1 1 140 140 LEU HA H 1 4.438 0.008 . 1 . 448 . . 140 LEU HA . 18428 1 1098 . 1 1 140 140 LEU HB2 H 1 1.730 0.008 . 2 . 448 . . 140 LEU HB2 . 18428 1 1099 . 1 1 140 140 LEU HB3 H 1 1.528 0.001 . 2 . 448 . . 140 LEU HB3 . 18428 1 1100 . 1 1 140 140 LEU HG H 1 1.467 0.002 . 1 . 448 . . 140 LEU HG . 18428 1 1101 . 1 1 140 140 LEU HD11 H 1 0.508 0.002 . 2 . 448 . . 140 LEU HD11 . 18428 1 1102 . 1 1 140 140 LEU HD12 H 1 0.508 0.002 . 2 . 448 . . 140 LEU HD12 . 18428 1 1103 . 1 1 140 140 LEU HD13 H 1 0.508 0.002 . 2 . 448 . . 140 LEU HD13 . 18428 1 1104 . 1 1 140 140 LEU C C 13 177.413 0.017 . 1 . 448 . . 140 LEU C . 18428 1 1105 . 1 1 140 140 LEU CA C 13 55.195 0.02 . 1 . 448 . . 140 LEU CA . 18428 1 1106 . 1 1 140 140 LEU CB C 13 41.173 0.074 . 1 . 448 . . 140 LEU CB . 18428 1 1107 . 1 1 140 140 LEU CG C 13 28.567 0.038 . 1 . 448 . . 140 LEU CG . 18428 1 1108 . 1 1 140 140 LEU CD1 C 13 24.288 0.022 . 2 . 448 . . 140 LEU CD1 . 18428 1 1109 . 1 1 140 140 LEU N N 15 129.761 0.034 . 1 . 448 . . 140 LEU N . 18428 1 1110 . 1 1 141 141 LYS H H 1 11.381 0.006 . 1 . 449 . . 141 LYS H . 18428 1 1111 . 1 1 141 141 LYS HA H 1 3.995 0.001 . 1 . 449 . . 141 LYS HA . 18428 1 1112 . 1 1 141 141 LYS C C 13 177.397 0.001 . 1 . 449 . . 141 LYS C . 18428 1 1113 . 1 1 141 141 LYS CA C 13 57.769 0.053 . 1 . 449 . . 141 LYS CA . 18428 1 1114 . 1 1 141 141 LYS CB C 13 34.436 0.001 . 1 . 449 . . 141 LYS CB . 18428 1 1115 . 1 1 141 141 LYS N N 15 127.345 0.048 . 1 . 449 . . 141 LYS N . 18428 1 1116 . 1 1 142 142 TYR H H 1 10.401 0.005 . 1 . 450 . . 142 TYR H . 18428 1 1117 . 1 1 142 142 TYR HA H 1 4.516 0.001 . 1 . 450 . . 142 TYR HA . 18428 1 1118 . 1 1 142 142 TYR C C 13 176.398 0.001 . 1 . 450 . . 142 TYR C . 18428 1 1119 . 1 1 142 142 TYR CA C 13 58.623 0.001 . 1 . 450 . . 142 TYR CA . 18428 1 1120 . 1 1 142 142 TYR N N 15 119.966 0.04 . 1 . 450 . . 142 TYR N . 18428 1 1121 . 1 1 143 143 LYS H H 1 7.798 0.014 . 1 . 451 . . 143 LYS H . 18428 1 1122 . 1 1 143 143 LYS HA H 1 4.446 0.001 . 1 . 451 . . 143 LYS HA . 18428 1 1123 . 1 1 143 143 LYS HB2 H 1 1.702 0.001 . 2 . 451 . . 143 LYS HB2 . 18428 1 1124 . 1 1 143 143 LYS C C 13 174.657 0.021 . 1 . 451 . . 143 LYS C . 18428 1 1125 . 1 1 143 143 LYS CA C 13 54.013 0.011 . 1 . 451 . . 143 LYS CA . 18428 1 1126 . 1 1 143 143 LYS CB C 13 34.733 0.047 . 1 . 451 . . 143 LYS CB . 18428 1 1127 . 1 1 143 143 LYS N N 15 120.339 0.05 . 1 . 451 . . 143 LYS N . 18428 1 1128 . 1 1 144 144 ASN H H 1 8.759 0.003 . 1 . 452 . . 144 ASN H . 18428 1 1129 . 1 1 144 144 ASN HA H 1 4.856 0.001 . 1 . 452 . . 144 ASN HA . 18428 1 1130 . 1 1 144 144 ASN HB2 H 1 2.873 0.001 . 2 . 452 . . 144 ASN HB2 . 18428 1 1131 . 1 1 144 144 ASN C C 13 177.813 0.006 . 1 . 452 . . 144 ASN C . 18428 1 1132 . 1 1 144 144 ASN CA C 13 52.877 0.012 . 1 . 452 . . 144 ASN CA . 18428 1 1133 . 1 1 144 144 ASN CB C 13 39.815 0.065 . 1 . 452 . . 144 ASN CB . 18428 1 1134 . 1 1 144 144 ASN N N 15 121.256 0.05 . 1 . 452 . . 144 ASN N . 18428 1 1135 . 1 1 145 145 VAL H H 1 9.060 0.005 . 1 . 453 . . 145 VAL H . 18428 1 1136 . 1 1 145 145 VAL HA H 1 3.808 0.01 . 1 . 453 . . 145 VAL HA . 18428 1 1137 . 1 1 145 145 VAL HB H 1 1.876 0.004 . 1 . 453 . . 145 VAL HB . 18428 1 1138 . 1 1 145 145 VAL HG11 H 1 0.837 0.002 . 2 . 453 . . 145 VAL HG11 . 18428 1 1139 . 1 1 145 145 VAL HG12 H 1 0.837 0.002 . 2 . 453 . . 145 VAL HG12 . 18428 1 1140 . 1 1 145 145 VAL HG13 H 1 0.837 0.002 . 2 . 453 . . 145 VAL HG13 . 18428 1 1141 . 1 1 145 145 VAL HG21 H 1 0.916 0.005 . 2 . 453 . . 145 VAL HG21 . 18428 1 1142 . 1 1 145 145 VAL HG22 H 1 0.916 0.005 . 2 . 453 . . 145 VAL HG22 . 18428 1 1143 . 1 1 145 145 VAL HG23 H 1 0.916 0.005 . 2 . 453 . . 145 VAL HG23 . 18428 1 1144 . 1 1 145 145 VAL C C 13 176.579 0.006 . 1 . 453 . . 145 VAL C . 18428 1 1145 . 1 1 145 145 VAL CA C 13 65.095 0.038 . 1 . 453 . . 145 VAL CA . 18428 1 1146 . 1 1 145 145 VAL CB C 13 31.378 0.026 . 1 . 453 . . 145 VAL CB . 18428 1 1147 . 1 1 145 145 VAL CG1 C 13 21.578 0.001 . 2 . 453 . . 145 VAL CG1 . 18428 1 1148 . 1 1 145 145 VAL CG2 C 13 20.424 0.019 . 2 . 453 . . 145 VAL CG2 . 18428 1 1149 . 1 1 145 145 VAL N N 15 123.726 0.052 . 1 . 453 . . 145 VAL N . 18428 1 1150 . 1 1 146 146 GLU H H 1 8.681 0.004 . 1 . 454 . . 146 GLU H . 18428 1 1151 . 1 1 146 146 GLU HA H 1 3.413 0.001 . 1 . 454 . . 146 GLU HA . 18428 1 1152 . 1 1 146 146 GLU HB2 H 1 1.978 0.001 . 2 . 454 . . 146 GLU HB2 . 18428 1 1153 . 1 1 146 146 GLU C C 13 179.558 0.009 . 1 . 454 . . 146 GLU C . 18428 1 1154 . 1 1 146 146 GLU CA C 13 59.389 0.017 . 1 . 454 . . 146 GLU CA . 18428 1 1155 . 1 1 146 146 GLU CB C 13 29.000 0.001 . 1 . 454 . . 146 GLU CB . 18428 1 1156 . 1 1 146 146 GLU N N 15 120.943 0.033 . 1 . 454 . . 146 GLU N . 18428 1 1157 . 1 1 147 147 GLU H H 1 8.019 0.006 . 1 . 455 . . 147 GLU H . 18428 1 1158 . 1 1 147 147 GLU HA H 1 4.087 0.001 . 1 . 455 . . 147 GLU HA . 18428 1 1159 . 1 1 147 147 GLU HB2 H 1 2.005 0.001 . 2 . 455 . . 147 GLU HB2 . 18428 1 1160 . 1 1 147 147 GLU HB3 H 1 2.088 0.001 . 2 . 455 . . 147 GLU HB3 . 18428 1 1161 . 1 1 147 147 GLU C C 13 178.658 0.012 . 1 . 455 . . 147 GLU C . 18428 1 1162 . 1 1 147 147 GLU CA C 13 58.811 0.001 . 1 . 455 . . 147 GLU CA . 18428 1 1163 . 1 1 147 147 GLU CB C 13 29.447 0.018 . 1 . 455 . . 147 GLU CB . 18428 1 1164 . 1 1 147 147 GLU N N 15 118.901 0.05 . 1 . 455 . . 147 GLU N . 18428 1 1165 . 1 1 148 148 PHE H H 1 8.192 0.002 . 1 . 456 . . 148 PHE H . 18428 1 1166 . 1 1 148 148 PHE HA H 1 4.070 0.008 . 1 . 456 . . 148 PHE HA . 18428 1 1167 . 1 1 148 148 PHE HB2 H 1 2.950 0.002 . 2 . 456 . . 148 PHE HB2 . 18428 1 1168 . 1 1 148 148 PHE HB3 H 1 3.080 0.001 . 2 . 456 . . 148 PHE HB3 . 18428 1 1169 . 1 1 148 148 PHE C C 13 176.546 0.009 . 1 . 456 . . 148 PHE C . 18428 1 1170 . 1 1 148 148 PHE CA C 13 60.648 0.065 . 1 . 456 . . 148 PHE CA . 18428 1 1171 . 1 1 148 148 PHE CB C 13 38.814 0.025 . 1 . 456 . . 148 PHE CB . 18428 1 1172 . 1 1 148 148 PHE N N 15 116.980 0.024 . 1 . 456 . . 148 PHE N . 18428 1 1173 . 1 1 149 149 ARG H H 1 7.872 0.004 . 1 . 457 . . 149 ARG H . 18428 1 1174 . 1 1 149 149 ARG HA H 1 3.753 0.001 . 1 . 457 . . 149 ARG HA . 18428 1 1175 . 1 1 149 149 ARG HB2 H 1 1.885 0.001 . 2 . 457 . . 149 ARG HB2 . 18428 1 1176 . 1 1 149 149 ARG C C 13 178.012 0.011 . 1 . 457 . . 149 ARG C . 18428 1 1177 . 1 1 149 149 ARG CA C 13 60.556 0.015 . 1 . 457 . . 149 ARG CA . 18428 1 1178 . 1 1 149 149 ARG CB C 13 29.630 0.058 . 1 . 457 . . 149 ARG CB . 18428 1 1179 . 1 1 149 149 ARG N N 15 119.279 0.056 . 1 . 457 . . 149 ARG N . 18428 1 1180 . 1 1 150 150 SER H H 1 7.698 0.004 . 1 . 458 . . 150 SER H . 18428 1 1181 . 1 1 150 150 SER HA H 1 4.272 0.001 . 1 . 458 . . 150 SER HA . 18428 1 1182 . 1 1 150 150 SER HB2 H 1 3.877 0.001 . 2 . 458 . . 150 SER HB2 . 18428 1 1183 . 1 1 150 150 SER C C 13 177.099 0.001 . 1 . 458 . . 150 SER C . 18428 1 1184 . 1 1 150 150 SER CA C 13 60.720 0.065 . 1 . 458 . . 150 SER CA . 18428 1 1185 . 1 1 150 150 SER CB C 13 62.740 0.051 . 1 . 458 . . 150 SER CB . 18428 1 1186 . 1 1 150 150 SER N N 15 112.012 0.021 . 1 . 458 . . 150 SER N . 18428 1 1187 . 1 1 151 151 ILE H H 1 7.488 0.002 . 1 . 459 . . 151 ILE H . 18428 1 1188 . 1 1 151 151 ILE HA H 1 3.774 0.008 . 1 . 459 . . 151 ILE HA . 18428 1 1189 . 1 1 151 151 ILE HB H 1 1.577 0.012 . 1 . 459 . . 151 ILE HB . 18428 1 1190 . 1 1 151 151 ILE HG12 H 1 0.994 0.002 . 2 . 459 . . 151 ILE HG12 . 18428 1 1191 . 1 1 151 151 ILE HG13 H 1 1.471 0.01 . 2 . 459 . . 151 ILE HG13 . 18428 1 1192 . 1 1 151 151 ILE HG21 H 1 0.718 0.004 . 1 . 459 . . 151 ILE HG21 . 18428 1 1193 . 1 1 151 151 ILE HG22 H 1 0.718 0.004 . 1 . 459 . . 151 ILE HG22 . 18428 1 1194 . 1 1 151 151 ILE HG23 H 1 0.718 0.004 . 1 . 459 . . 151 ILE HG23 . 18428 1 1195 . 1 1 151 151 ILE HD11 H 1 0.391 0.002 . 1 . 459 . . 151 ILE HD11 . 18428 1 1196 . 1 1 151 151 ILE HD12 H 1 0.391 0.002 . 1 . 459 . . 151 ILE HD12 . 18428 1 1197 . 1 1 151 151 ILE HD13 H 1 0.391 0.002 . 1 . 459 . . 151 ILE HD13 . 18428 1 1198 . 1 1 151 151 ILE C C 13 177.001 0.018 . 1 . 459 . . 151 ILE C . 18428 1 1199 . 1 1 151 151 ILE CA C 13 64.060 0.045 . 1 . 459 . . 151 ILE CA . 18428 1 1200 . 1 1 151 151 ILE CB C 13 38.608 0.092 . 1 . 459 . . 151 ILE CB . 18428 1 1201 . 1 1 151 151 ILE CG1 C 13 28.276 0.038 . 1 . 459 . . 151 ILE CG1 . 18428 1 1202 . 1 1 151 151 ILE CG2 C 13 16.977 0.036 . 1 . 459 . . 151 ILE CG2 . 18428 1 1203 . 1 1 151 151 ILE CD1 C 13 13.136 0.02 . 1 . 459 . . 151 ILE CD1 . 18428 1 1204 . 1 1 151 151 ILE N N 15 121.300 0.039 . 1 . 459 . . 151 ILE N . 18428 1 1205 . 1 1 152 152 LEU H H 1 7.559 0.006 . 1 . 460 . . 152 LEU H . 18428 1 1206 . 1 1 152 152 LEU HA H 1 4.164 0.001 . 1 . 460 . . 152 LEU HA . 18428 1 1207 . 1 1 152 152 LEU HB2 H 1 1.580 0.001 . 2 . 460 . . 152 LEU HB2 . 18428 1 1208 . 1 1 152 152 LEU HB3 H 1 1.672 0.001 . 2 . 460 . . 152 LEU HB3 . 18428 1 1209 . 1 1 152 152 LEU C C 13 175.776 0.001 . 1 . 460 . . 152 LEU C . 18428 1 1210 . 1 1 152 152 LEU CA C 13 54.699 0.006 . 1 . 460 . . 152 LEU CA . 18428 1 1211 . 1 1 152 152 LEU CB C 13 41.550 0.012 . 1 . 460 . . 152 LEU CB . 18428 1 1212 . 1 1 152 152 LEU N N 15 116.449 0.074 . 1 . 460 . . 152 LEU N . 18428 1 1213 . 1 1 153 153 ARG H H 1 7.562 0.004 . 1 . 461 . . 153 ARG H . 18428 1 1214 . 1 1 153 153 ARG HA H 1 4.089 0.001 . 1 . 461 . . 153 ARG HA . 18428 1 1215 . 1 1 153 153 ARG HB2 H 1 1.892 0.001 . 2 . 461 . . 153 ARG HB2 . 18428 1 1216 . 1 1 153 153 ARG C C 13 176.354 0.009 . 1 . 461 . . 153 ARG C . 18428 1 1217 . 1 1 153 153 ARG CA C 13 56.554 0.008 . 1 . 461 . . 153 ARG CA . 18428 1 1218 . 1 1 153 153 ARG CB C 13 27.979 0.001 . 1 . 461 . . 153 ARG CB . 18428 1 1219 . 1 1 153 153 ARG N N 15 116.352 0.045 . 1 . 461 . . 153 ARG N . 18428 1 1220 . 1 1 154 154 LEU H H 1 8.062 0.004 . 1 . 462 . . 154 LEU H . 18428 1 1221 . 1 1 154 154 LEU HA H 1 4.245 0.001 . 1 . 462 . . 154 LEU HA . 18428 1 1222 . 1 1 154 154 LEU HB2 H 1 1.575 0.001 . 2 . 462 . . 154 LEU HB2 . 18428 1 1223 . 1 1 154 154 LEU C C 13 177.302 0.009 . 1 . 462 . . 154 LEU C . 18428 1 1224 . 1 1 154 154 LEU CA C 13 55.371 0.031 . 1 . 462 . . 154 LEU CA . 18428 1 1225 . 1 1 154 154 LEU CB C 13 41.881 0.018 . 1 . 462 . . 154 LEU CB . 18428 1 1226 . 1 1 154 154 LEU N N 15 118.915 0.021 . 1 . 462 . . 154 LEU N . 18428 1 1227 . 1 1 155 155 ASP H H 1 8.309 0.001 . 1 . 463 . . 155 ASP H . 18428 1 1228 . 1 1 155 155 ASP HA H 1 4.508 0.001 . 1 . 463 . . 155 ASP HA . 18428 1 1229 . 1 1 155 155 ASP HB2 H 1 2.583 0.001 . 2 . 463 . . 155 ASP HB2 . 18428 1 1230 . 1 1 155 155 ASP C C 13 175.886 0.005 . 1 . 463 . . 155 ASP C . 18428 1 1231 . 1 1 155 155 ASP CA C 13 54.105 0.006 . 1 . 463 . . 155 ASP CA . 18428 1 1232 . 1 1 155 155 ASP CB C 13 41.035 0.007 . 1 . 463 . . 155 ASP CB . 18428 1 1233 . 1 1 155 155 ASP N N 15 118.822 0.009 . 1 . 463 . . 155 ASP N . 18428 1 1234 . 1 1 156 156 ASN H H 1 8.085 0.001 . 1 . 464 . . 156 ASN H . 18428 1 1235 . 1 1 156 156 ASN HA H 1 4.587 0.001 . 1 . 464 . . 156 ASN HA . 18428 1 1236 . 1 1 156 156 ASN HB2 H 1 2.678 0.001 . 2 . 464 . . 156 ASN HB2 . 18428 1 1237 . 1 1 156 156 ASN HB3 H 1 2.779 0.001 . 2 . 464 . . 156 ASN HB3 . 18428 1 1238 . 1 1 156 156 ASN C C 13 174.957 0.004 . 1 . 464 . . 156 ASN C . 18428 1 1239 . 1 1 156 156 ASN CA C 13 53.479 0.017 . 1 . 464 . . 156 ASN CA . 18428 1 1240 . 1 1 156 156 ASN CB C 13 38.890 0.018 . 1 . 464 . . 156 ASN CB . 18428 1 1241 . 1 1 156 156 ASN N N 15 118.574 0.01 . 1 . 464 . . 156 ASN N . 18428 1 1242 . 1 1 157 157 ALA H H 1 8.226 0.003 . 1 . 465 . . 157 ALA H . 18428 1 1243 . 1 1 157 157 ALA HA H 1 4.245 0.001 . 1 . 465 . . 157 ALA HA . 18428 1 1244 . 1 1 157 157 ALA HB1 H 1 1.331 0.001 . 1 . 465 . . 157 ALA HB1 . 18428 1 1245 . 1 1 157 157 ALA HB2 H 1 1.331 0.001 . 1 . 465 . . 157 ALA HB2 . 18428 1 1246 . 1 1 157 157 ALA HB3 H 1 1.331 0.001 . 1 . 465 . . 157 ALA HB3 . 18428 1 1247 . 1 1 157 157 ALA C C 13 177.458 0.029 . 1 . 465 . . 157 ALA C . 18428 1 1248 . 1 1 157 157 ALA CA C 13 52.822 0.001 . 1 . 465 . . 157 ALA CA . 18428 1 1249 . 1 1 157 157 ALA CB C 13 19.098 0.001 . 1 . 465 . . 157 ALA CB . 18428 1 1250 . 1 1 157 157 ALA N N 15 123.737 0.039 . 1 . 465 . . 157 ALA N . 18428 1 1251 . 1 1 158 158 ASP H H 1 8.147 0.004 . 1 . 466 . . 158 ASP H . 18428 1 1252 . 1 1 158 158 ASP HA H 1 4.612 0.001 . 1 . 466 . . 158 ASP HA . 18428 1 1253 . 1 1 158 158 ASP HB2 H 1 2.656 0.001 . 2 . 466 . . 158 ASP HB2 . 18428 1 1254 . 1 1 158 158 ASP HB3 H 1 2.716 0.001 . 2 . 466 . . 158 ASP HB3 . 18428 1 1255 . 1 1 158 158 ASP C C 13 176.925 0.005 . 1 . 466 . . 158 ASP C . 18428 1 1256 . 1 1 158 158 ASP CA C 13 54.205 0.001 . 1 . 466 . . 158 ASP CA . 18428 1 1257 . 1 1 158 158 ASP CB C 13 41.130 0.001 . 1 . 466 . . 158 ASP CB . 18428 1 1258 . 1 1 158 158 ASP N N 15 118.751 0.016 . 1 . 466 . . 158 ASP N . 18428 1 1259 . 1 1 159 159 THR H H 1 8.120 0.007 . 1 . 467 . . 159 THR H . 18428 1 1260 . 1 1 159 159 THR HA H 1 4.329 0.001 . 1 . 467 . . 159 THR HA . 18428 1 1261 . 1 1 159 159 THR HB H 1 4.335 0.002 . 1 . 467 . . 159 THR HB . 18428 1 1262 . 1 1 159 159 THR HG21 H 1 1.161 0.011 . 1 . 467 . . 159 THR HG21 . 18428 1 1263 . 1 1 159 159 THR HG22 H 1 1.161 0.011 . 1 . 467 . . 159 THR HG22 . 18428 1 1264 . 1 1 159 159 THR HG23 H 1 1.161 0.011 . 1 . 467 . . 159 THR HG23 . 18428 1 1265 . 1 1 159 159 THR C C 13 175.398 0.022 . 1 . 467 . . 159 THR C . 18428 1 1266 . 1 1 159 159 THR CA C 13 62.165 0.026 . 1 . 467 . . 159 THR CA . 18428 1 1267 . 1 1 159 159 THR CB C 13 69.460 0.178 . 1 . 467 . . 159 THR CB . 18428 1 1268 . 1 1 159 159 THR CG2 C 13 21.500 0.016 . 1 . 467 . . 159 THR CG2 . 18428 1 1269 . 1 1 159 159 THR N N 15 113.704 0.031 . 1 . 467 . . 159 THR N . 18428 1 1270 . 1 1 160 160 THR H H 1 8.154 0.002 . 1 . 468 . . 160 THR H . 18428 1 1271 . 1 1 160 160 THR HA H 1 4.262 0.001 . 1 . 468 . . 160 THR HA . 18428 1 1272 . 1 1 160 160 THR HB H 1 4.197 0.007 . 1 . 468 . . 160 THR HB . 18428 1 1273 . 1 1 160 160 THR HG21 H 1 1.178 0.001 . 1 . 468 . . 160 THR HG21 . 18428 1 1274 . 1 1 160 160 THR HG22 H 1 1.178 0.001 . 1 . 468 . . 160 THR HG22 . 18428 1 1275 . 1 1 160 160 THR HG23 H 1 1.178 0.001 . 1 . 468 . . 160 THR HG23 . 18428 1 1276 . 1 1 160 160 THR C C 13 175.432 0.001 . 1 . 468 . . 160 THR C . 18428 1 1277 . 1 1 160 160 THR CA C 13 62.514 0.043 . 1 . 468 . . 160 THR CA . 18428 1 1278 . 1 1 160 160 THR CB C 13 69.785 0.009 . 1 . 468 . . 160 THR CB . 18428 1 1279 . 1 1 160 160 THR CG2 C 13 24.683 0.001 . 1 . 468 . . 160 THR CG2 . 18428 1 1280 . 1 1 160 160 THR N N 15 114.474 0.026 . 1 . 468 . . 160 THR N . 18428 1 1281 . 1 1 161 161 GLY H H 1 8.273 0.002 . 1 . 469 . . 161 GLY H . 18428 1 1282 . 1 1 161 161 GLY HA2 H 1 3.845 0.001 . 2 . 469 . . 161 GLY HA2 . 18428 1 1283 . 1 1 161 161 GLY HA3 H 1 3.941 0.001 . 2 . 469 . . 161 GLY HA3 . 18428 1 1284 . 1 1 161 161 GLY C C 13 173.918 0.011 . 1 . 469 . . 161 GLY C . 18428 1 1285 . 1 1 161 161 GLY CA C 13 45.420 0.014 . 1 . 469 . . 161 GLY CA . 18428 1 1286 . 1 1 161 161 GLY N N 15 110.504 0.092 . 1 . 469 . . 161 GLY N . 18428 1 1287 . 1 1 162 162 ASN H H 1 8.202 0.002 . 1 . 470 . . 162 ASN H . 18428 1 1288 . 1 1 162 162 ASN HA H 1 4.624 0.001 . 1 . 470 . . 162 ASN HA . 18428 1 1289 . 1 1 162 162 ASN HB2 H 1 2.674 0.001 . 2 . 470 . . 162 ASN HB2 . 18428 1 1290 . 1 1 162 162 ASN HB3 H 1 2.750 0.001 . 2 . 470 . . 162 ASN HB3 . 18428 1 1291 . 1 1 162 162 ASN C C 13 175.201 0.006 . 1 . 470 . . 162 ASN C . 18428 1 1292 . 1 1 162 162 ASN CA C 13 53.220 0.013 . 1 . 470 . . 162 ASN CA . 18428 1 1293 . 1 1 162 162 ASN CB C 13 38.782 0.007 . 1 . 470 . . 162 ASN CB . 18428 1 1294 . 1 1 162 162 ASN N N 15 118.666 0.009 . 1 . 470 . . 162 ASN N . 18428 1 1295 . 1 1 163 163 ARG H H 1 8.298 0.002 . 1 . 471 . . 163 ARG H . 18428 1 1296 . 1 1 163 163 ARG HA H 1 4.254 0.001 . 1 . 471 . . 163 ARG HA . 18428 1 1297 . 1 1 163 163 ARG HB2 H 1 1.693 0.001 . 2 . 471 . . 163 ARG HB2 . 18428 1 1298 . 1 1 163 163 ARG HB3 H 1 1.787 0.001 . 2 . 471 . . 163 ARG HB3 . 18428 1 1299 . 1 1 163 163 ARG C C 13 175.914 0.004 . 1 . 471 . . 163 ARG C . 18428 1 1300 . 1 1 163 163 ARG CA C 13 56.223 0.006 . 1 . 471 . . 163 ARG CA . 18428 1 1301 . 1 1 163 163 ARG CB C 13 30.555 0.02 . 1 . 471 . . 163 ARG CB . 18428 1 1302 . 1 1 163 163 ARG N N 15 120.988 0.016 . 1 . 471 . . 163 ARG N . 18428 1 1303 . 1 1 164 164 ASN H H 1 8.403 0.002 . 1 . 472 . . 164 ASN H . 18428 1 1304 . 1 1 164 164 ASN HA H 1 4.309 0.001 . 1 . 472 . . 164 ASN HA . 18428 1 1305 . 1 1 164 164 ASN HB2 H 1 2.702 0.001 . 2 . 472 . . 164 ASN HB2 . 18428 1 1306 . 1 1 164 164 ASN HB3 H 1 2.815 0.001 . 2 . 472 . . 164 ASN HB3 . 18428 1 1307 . 1 1 164 164 ASN C C 13 175.099 0.009 . 1 . 472 . . 164 ASN C . 18428 1 1308 . 1 1 164 164 ASN CA C 13 53.257 0.0 . 1 . 472 . . 164 ASN CA . 18428 1 1309 . 1 1 164 164 ASN CB C 13 38.924 0.016 . 1 . 472 . . 164 ASN CB . 18428 1 1310 . 1 1 164 164 ASN N N 15 119.458 0.017 . 1 . 472 . . 164 ASN N . 18428 1 1311 . 1 1 165 165 THR H H 1 8.034 0.002 . 1 . 473 . . 165 THR H . 18428 1 1312 . 1 1 165 165 THR HA H 1 4.300 0.001 . 1 . 473 . . 165 THR HA . 18428 1 1313 . 1 1 165 165 THR HB H 1 4.226 0.001 . 1 . 473 . . 165 THR HB . 18428 1 1314 . 1 1 165 165 THR C C 13 174.303 0.003 . 1 . 473 . . 165 THR C . 18428 1 1315 . 1 1 165 165 THR CA C 13 61.650 0.037 . 1 . 473 . . 165 THR CA . 18428 1 1316 . 1 1 165 165 THR CB C 13 69.465 0.067 . 1 . 473 . . 165 THR CB . 18428 1 1317 . 1 1 165 165 THR N N 15 113.895 0.01 . 1 . 473 . . 165 THR N . 18428 1 1318 . 1 1 166 166 LEU H H 1 8.359 0.003 . 1 . 474 . . 166 LEU H . 18428 1 1319 . 1 1 166 166 LEU HA H 1 4.125 0.01 . 1 . 474 . . 166 LEU HA . 18428 1 1320 . 1 1 166 166 LEU HB2 H 1 1.516 0.004 . 2 . 474 . . 166 LEU HB2 . 18428 1 1321 . 1 1 166 166 LEU HD11 H 1 0.839 0.0 . 2 . 474 . . 166 LEU HD11 . 18428 1 1322 . 1 1 166 166 LEU HD12 H 1 0.839 0.0 . 2 . 474 . . 166 LEU HD12 . 18428 1 1323 . 1 1 166 166 LEU HD13 H 1 0.839 0.0 . 2 . 474 . . 166 LEU HD13 . 18428 1 1324 . 1 1 166 166 LEU C C 13 176.663 0.029 . 1 . 474 . . 166 LEU C . 18428 1 1325 . 1 1 166 166 LEU CA C 13 56.655 0.012 . 1 . 474 . . 166 LEU CA . 18428 1 1326 . 1 1 166 166 LEU CB C 13 43.296 0.03 . 1 . 474 . . 166 LEU CB . 18428 1 1327 . 1 1 166 166 LEU CD1 C 13 24.680 0.001 . 2 . 474 . . 166 LEU CD1 . 18428 1 1328 . 1 1 166 166 LEU N N 15 123.530 0.019 . 1 . 474 . . 166 LEU N . 18428 1 1329 . 1 1 167 167 VAL H H 1 7.374 0.005 . 1 . 475 . . 167 VAL H . 18428 1 1330 . 1 1 167 167 VAL HA H 1 4.339 0.001 . 1 . 475 . . 167 VAL HA . 18428 1 1331 . 1 1 167 167 VAL C C 13 178.730 0.001 . 1 . 475 . . 167 VAL C . 18428 1 1332 . 1 1 167 167 VAL CA C 13 61.120 0.001 . 1 . 475 . . 167 VAL CA . 18428 1 1333 . 1 1 167 167 VAL N N 15 113.029 0.057 . 1 . 475 . . 167 VAL N . 18428 1 1334 . 1 1 169 169 GLY HA2 H 1 4.338 0.001 . 2 . 477 . . 169 GLY HA2 . 18428 1 1335 . 1 1 169 169 GLY C C 13 174.591 0.001 . 1 . 477 . . 169 GLY C . 18428 1 1336 . 1 1 169 169 GLY CA C 13 46.314 0.001 . 1 . 477 . . 169 GLY CA . 18428 1 1337 . 1 1 170 170 ARG H H 1 8.017 0.004 . 1 . 478 . . 170 ARG H . 18428 1 1338 . 1 1 170 170 ARG HA H 1 4.408 0.001 . 1 . 478 . . 170 ARG HA . 18428 1 1339 . 1 1 170 170 ARG C C 13 176.259 0.011 . 1 . 478 . . 170 ARG C . 18428 1 1340 . 1 1 170 170 ARG CA C 13 55.748 0.02 . 1 . 478 . . 170 ARG CA . 18428 1 1341 . 1 1 170 170 ARG CB C 13 32.031 0.001 . 1 . 478 . . 170 ARG CB . 18428 1 1342 . 1 1 170 170 ARG N N 15 118.100 0.038 . 1 . 478 . . 170 ARG N . 18428 1 1343 . 1 1 171 171 GLY H H 1 7.935 0.007 . 1 . 479 . . 171 GLY H . 18428 1 1344 . 1 1 171 171 GLY HA2 H 1 4.426 0.001 . 2 . 479 . . 171 GLY HA2 . 18428 1 1345 . 1 1 171 171 GLY C C 13 173.597 0.001 . 1 . 479 . . 171 GLY C . 18428 1 1346 . 1 1 171 171 GLY CA C 13 44.604 0.028 . 1 . 479 . . 171 GLY CA . 18428 1 1347 . 1 1 171 171 GLY N N 15 108.859 0.037 . 1 . 479 . . 171 GLY N . 18428 1 1348 . 1 1 172 172 SER H H 1 8.945 0.004 . 1 . 480 . . 172 SER H . 18428 1 1349 . 1 1 172 172 SER HA H 1 4.702 0.001 . 1 . 480 . . 172 SER HA . 18428 1 1350 . 1 1 172 172 SER C C 13 172.662 0.015 . 1 . 480 . . 172 SER C . 18428 1 1351 . 1 1 172 172 SER CA C 13 57.685 0.001 . 1 . 480 . . 172 SER CA . 18428 1 1352 . 1 1 172 172 SER CB C 13 65.887 0.006 . 1 . 480 . . 172 SER CB . 18428 1 1353 . 1 1 172 172 SER N N 15 113.239 0.054 . 1 . 480 . . 172 SER N . 18428 1 1354 . 1 1 173 173 VAL H H 1 8.360 0.008 . 1 . 481 . . 173 VAL H . 18428 1 1355 . 1 1 173 173 VAL HA H 1 4.771 0.008 . 1 . 481 . . 173 VAL HA . 18428 1 1356 . 1 1 173 173 VAL HB H 1 1.880 0.013 . 1 . 481 . . 173 VAL HB . 18428 1 1357 . 1 1 173 173 VAL HG11 H 1 0.698 0.003 . 2 . 481 . . 173 VAL HG11 . 18428 1 1358 . 1 1 173 173 VAL HG12 H 1 0.698 0.003 . 2 . 481 . . 173 VAL HG12 . 18428 1 1359 . 1 1 173 173 VAL HG13 H 1 0.698 0.003 . 2 . 481 . . 173 VAL HG13 . 18428 1 1360 . 1 1 173 173 VAL HG21 H 1 0.827 0.01 . 2 . 481 . . 173 VAL HG21 . 18428 1 1361 . 1 1 173 173 VAL HG22 H 1 0.827 0.01 . 2 . 481 . . 173 VAL HG22 . 18428 1 1362 . 1 1 173 173 VAL HG23 H 1 0.827 0.01 . 2 . 481 . . 173 VAL HG23 . 18428 1 1363 . 1 1 173 173 VAL C C 13 173.940 0.028 . 1 . 481 . . 173 VAL C . 18428 1 1364 . 1 1 173 173 VAL CA C 13 60.948 0.061 . 1 . 481 . . 173 VAL CA . 18428 1 1365 . 1 1 173 173 VAL CB C 13 34.489 0.031 . 1 . 481 . . 173 VAL CB . 18428 1 1366 . 1 1 173 173 VAL CG1 C 13 21.694 0.019 . 2 . 481 . . 173 VAL CG1 . 18428 1 1367 . 1 1 173 173 VAL CG2 C 13 21.983 0.084 . 2 . 481 . . 173 VAL CG2 . 18428 1 1368 . 1 1 173 173 VAL N N 15 119.997 0.049 . 1 . 481 . . 173 VAL N . 18428 1 1369 . 1 1 174 174 LEU H H 1 8.872 0.006 . 1 . 482 . . 174 LEU H . 18428 1 1370 . 1 1 174 174 LEU HA H 1 4.719 0.011 . 1 . 482 . . 174 LEU HA . 18428 1 1371 . 1 1 174 174 LEU HB2 H 1 1.546 0.001 . 2 . 482 . . 174 LEU HB2 . 18428 1 1372 . 1 1 174 174 LEU HB3 H 1 1.489 0.001 . 2 . 482 . . 174 LEU HB3 . 18428 1 1373 . 1 1 174 174 LEU HD11 H 1 0.806 0.0 . 2 . 482 . . 174 LEU HD11 . 18428 1 1374 . 1 1 174 174 LEU HD12 H 1 0.806 0.0 . 2 . 482 . . 174 LEU HD12 . 18428 1 1375 . 1 1 174 174 LEU HD13 H 1 0.806 0.0 . 2 . 482 . . 174 LEU HD13 . 18428 1 1376 . 1 1 174 174 LEU C C 13 175.292 0.001 . 1 . 482 . . 174 LEU C . 18428 1 1377 . 1 1 174 174 LEU CA C 13 53.348 0.088 . 1 . 482 . . 174 LEU CA . 18428 1 1378 . 1 1 174 174 LEU CB C 13 45.090 0.026 . 1 . 482 . . 174 LEU CB . 18428 1 1379 . 1 1 174 174 LEU N N 15 128.392 0.044 . 1 . 482 . . 174 LEU N . 18428 1 1380 . 1 1 177 177 PRO HA H 1 4.199 0.001 . 1 . 485 . . 177 PRO HA . 18428 1 1381 . 1 1 177 177 PRO C C 13 178.497 0.001 . 1 . 485 . . 177 PRO C . 18428 1 1382 . 1 1 177 177 PRO CA C 13 64.286 0.001 . 1 . 485 . . 177 PRO CA . 18428 1 1383 . 1 1 177 177 PRO CB C 13 32.255 0.001 . 1 . 485 . . 177 PRO CB . 18428 1 1384 . 1 1 178 178 ALA H H 1 8.023 0.003 . 1 . 486 . . 178 ALA H . 18428 1 1385 . 1 1 178 178 ALA HA H 1 4.135 0.001 . 1 . 486 . . 178 ALA HA . 18428 1 1386 . 1 1 178 178 ALA C C 13 179.371 0.007 . 1 . 486 . . 178 ALA C . 18428 1 1387 . 1 1 178 178 ALA CA C 13 55.160 0.03 . 1 . 486 . . 178 ALA CA . 18428 1 1388 . 1 1 178 178 ALA CB C 13 18.454 0.027 . 1 . 486 . . 178 ALA CB . 18428 1 1389 . 1 1 178 178 ALA N N 15 119.588 0.046 . 1 . 486 . . 178 ALA N . 18428 1 1390 . 1 1 179 179 THR H H 1 6.876 0.004 . 1 . 487 . . 179 THR H . 18428 1 1391 . 1 1 179 179 THR HA H 1 4.432 0.009 . 1 . 487 . . 179 THR HA . 18428 1 1392 . 1 1 179 179 THR HB H 1 4.342 0.005 . 1 . 487 . . 179 THR HB . 18428 1 1393 . 1 1 179 179 THR HG21 H 1 1.075 0.003 . 1 . 487 . . 179 THR HG21 . 18428 1 1394 . 1 1 179 179 THR HG22 H 1 1.075 0.003 . 1 . 487 . . 179 THR HG22 . 18428 1 1395 . 1 1 179 179 THR HG23 H 1 1.075 0.003 . 1 . 487 . . 179 THR HG23 . 18428 1 1396 . 1 1 179 179 THR C C 13 175.175 0.013 . 1 . 487 . . 179 THR C . 18428 1 1397 . 1 1 179 179 THR CA C 13 60.370 0.037 . 1 . 487 . . 179 THR CA . 18428 1 1398 . 1 1 179 179 THR CB C 13 70.103 0.121 . 1 . 487 . . 179 THR CB . 18428 1 1399 . 1 1 179 179 THR CG2 C 13 20.707 0.001 . 1 . 487 . . 179 THR CG2 . 18428 1 1400 . 1 1 179 179 THR N N 15 103.060 0.048 . 1 . 487 . . 179 THR N . 18428 1 1401 . 1 1 180 180 ASN H H 1 7.980 0.004 . 1 . 488 . . 180 ASN H . 18428 1 1402 . 1 1 180 180 ASN C C 13 172.875 0.012 . 1 . 488 . . 180 ASN C . 18428 1 1403 . 1 1 180 180 ASN CA C 13 54.577 0.011 . 1 . 488 . . 180 ASN CA . 18428 1 1404 . 1 1 180 180 ASN CB C 13 39.280 0.001 . 1 . 488 . . 180 ASN CB . 18428 1 1405 . 1 1 180 180 ASN N N 15 124.915 0.04 . 1 . 488 . . 180 ASN N . 18428 1 1406 . 1 1 181 181 THR H H 1 7.637 0.009 . 1 . 489 . . 181 THR H . 18428 1 1407 . 1 1 181 181 THR HA H 1 5.128 0.014 . 1 . 489 . . 181 THR HA . 18428 1 1408 . 1 1 181 181 THR HB H 1 3.758 0.002 . 1 . 489 . . 181 THR HB . 18428 1 1409 . 1 1 181 181 THR C C 13 172.426 0.009 . 1 . 489 . . 181 THR C . 18428 1 1410 . 1 1 181 181 THR CA C 13 61.682 0.054 . 1 . 489 . . 181 THR CA . 18428 1 1411 . 1 1 181 181 THR CB C 13 72.078 0.125 . 1 . 489 . . 181 THR CB . 18428 1 1412 . 1 1 181 181 THR N N 15 111.062 0.035 . 1 . 489 . . 181 THR N . 18428 1 1413 . 1 1 182 182 LEU H H 1 8.787 0.003 . 1 . 490 . . 182 LEU H . 18428 1 1414 . 1 1 182 182 LEU HA H 1 4.912 0.005 . 1 . 490 . . 182 LEU HA . 18428 1 1415 . 1 1 182 182 LEU HB2 H 1 1.435 0.001 . 2 . 490 . . 182 LEU HB2 . 18428 1 1416 . 1 1 182 182 LEU HB3 H 1 1.354 0.011 . 2 . 490 . . 182 LEU HB3 . 18428 1 1417 . 1 1 182 182 LEU HD11 H 1 0.450 0.002 . 2 . 490 . . 182 LEU HD11 . 18428 1 1418 . 1 1 182 182 LEU HD12 H 1 0.450 0.002 . 2 . 490 . . 182 LEU HD12 . 18428 1 1419 . 1 1 182 182 LEU HD13 H 1 0.450 0.002 . 2 . 490 . . 182 LEU HD13 . 18428 1 1420 . 1 1 182 182 LEU C C 13 174.740 0.079 . 1 . 490 . . 182 LEU C . 18428 1 1421 . 1 1 182 182 LEU CA C 13 53.357 0.026 . 1 . 490 . . 182 LEU CA . 18428 1 1422 . 1 1 182 182 LEU CB C 13 45.475 0.044 . 1 . 490 . . 182 LEU CB . 18428 1 1423 . 1 1 182 182 LEU CD1 C 13 25.844 0.031 . 2 . 490 . . 182 LEU CD1 . 18428 1 1424 . 1 1 182 182 LEU N N 15 126.223 0.045 . 1 . 490 . . 182 LEU N . 18428 1 1425 . 1 1 183 183 ILE H H 1 9.202 0.007 . 1 . 491 . . 183 ILE H . 18428 1 1426 . 1 1 183 183 ILE HA H 1 4.671 0.015 . 1 . 491 . . 183 ILE HA . 18428 1 1427 . 1 1 183 183 ILE HB H 1 1.678 0.003 . 1 . 491 . . 183 ILE HB . 18428 1 1428 . 1 1 183 183 ILE HG12 H 1 1.283 0.004 . 2 . 491 . . 183 ILE HG12 . 18428 1 1429 . 1 1 183 183 ILE HG13 H 1 0.867 0.004 . 2 . 491 . . 183 ILE HG13 . 18428 1 1430 . 1 1 183 183 ILE HG21 H 1 0.598 0.002 . 1 . 491 . . 183 ILE HG21 . 18428 1 1431 . 1 1 183 183 ILE HG22 H 1 0.598 0.002 . 1 . 491 . . 183 ILE HG22 . 18428 1 1432 . 1 1 183 183 ILE HG23 H 1 0.598 0.002 . 1 . 491 . . 183 ILE HG23 . 18428 1 1433 . 1 1 183 183 ILE HD11 H 1 0.690 0.002 . 1 . 491 . . 183 ILE HD11 . 18428 1 1434 . 1 1 183 183 ILE HD12 H 1 0.690 0.002 . 1 . 491 . . 183 ILE HD12 . 18428 1 1435 . 1 1 183 183 ILE HD13 H 1 0.690 0.002 . 1 . 491 . . 183 ILE HD13 . 18428 1 1436 . 1 1 183 183 ILE C C 13 176.030 0.039 . 1 . 491 . . 183 ILE C . 18428 1 1437 . 1 1 183 183 ILE CA C 13 61.217 0.053 . 1 . 491 . . 183 ILE CA . 18428 1 1438 . 1 1 183 183 ILE CB C 13 39.316 0.026 . 1 . 491 . . 183 ILE CB . 18428 1 1439 . 1 1 183 183 ILE CG1 C 13 27.885 0.001 . 1 . 491 . . 183 ILE CG1 . 18428 1 1440 . 1 1 183 183 ILE CG2 C 13 17.352 0.023 . 1 . 491 . . 183 ILE CG2 . 18428 1 1441 . 1 1 183 183 ILE CD1 C 13 14.437 0.018 . 1 . 491 . . 183 ILE CD1 . 18428 1 1442 . 1 1 183 183 ILE N N 15 125.710 0.049 . 1 . 491 . . 183 ILE N . 18428 1 1443 . 1 1 184 184 VAL H H 1 8.621 0.005 . 1 . 492 . . 184 VAL H . 18428 1 1444 . 1 1 184 184 VAL HA H 1 4.381 0.005 . 1 . 492 . . 184 VAL HA . 18428 1 1445 . 1 1 184 184 VAL HB H 1 1.775 0.002 . 1 . 492 . . 184 VAL HB . 18428 1 1446 . 1 1 184 184 VAL HG11 H 1 0.236 0.001 . 2 . 492 . . 184 VAL HG11 . 18428 1 1447 . 1 1 184 184 VAL HG12 H 1 0.236 0.001 . 2 . 492 . . 184 VAL HG12 . 18428 1 1448 . 1 1 184 184 VAL HG13 H 1 0.236 0.001 . 2 . 492 . . 184 VAL HG13 . 18428 1 1449 . 1 1 184 184 VAL HG21 H 1 0.542 0.002 . 2 . 492 . . 184 VAL HG21 . 18428 1 1450 . 1 1 184 184 VAL HG22 H 1 0.542 0.002 . 2 . 492 . . 184 VAL HG22 . 18428 1 1451 . 1 1 184 184 VAL HG23 H 1 0.542 0.002 . 2 . 492 . . 184 VAL HG23 . 18428 1 1452 . 1 1 184 184 VAL C C 13 174.071 0.018 . 1 . 492 . . 184 VAL C . 18428 1 1453 . 1 1 184 184 VAL CA C 13 61.297 0.094 . 1 . 492 . . 184 VAL CA . 18428 1 1454 . 1 1 184 184 VAL CB C 13 33.957 0.024 . 1 . 492 . . 184 VAL CB . 18428 1 1455 . 1 1 184 184 VAL CG1 C 13 20.573 0.015 . 2 . 492 . . 184 VAL CG1 . 18428 1 1456 . 1 1 184 184 VAL CG2 C 13 21.203 0.045 . 2 . 492 . . 184 VAL CG2 . 18428 1 1457 . 1 1 184 184 VAL N N 15 130.107 0.019 . 1 . 492 . . 184 VAL N . 18428 1 1458 . 1 1 185 185 THR H H 1 8.685 0.003 . 1 . 493 . . 185 THR H . 18428 1 1459 . 1 1 185 185 THR HA H 1 5.537 0.008 . 1 . 493 . . 185 THR HA . 18428 1 1460 . 1 1 185 185 THR HB H 1 3.976 0.003 . 1 . 493 . . 185 THR HB . 18428 1 1461 . 1 1 185 185 THR C C 13 173.578 0.001 . 1 . 493 . . 185 THR C . 18428 1 1462 . 1 1 185 185 THR CA C 13 60.817 0.073 . 1 . 493 . . 185 THR CA . 18428 1 1463 . 1 1 185 185 THR CB C 13 69.551 0.002 . 1 . 493 . . 185 THR CB . 18428 1 1464 . 1 1 185 185 THR N N 15 124.689 0.045 . 1 . 493 . . 185 THR N . 18428 1 1465 . 1 1 186 186 ASP H H 1 9.081 0.005 . 1 . 494 . . 186 ASP H . 18428 1 1466 . 1 1 186 186 ASP HA H 1 4.531 0.001 . 1 . 494 . . 186 ASP HA . 18428 1 1467 . 1 1 186 186 ASP C C 13 174.989 0.041 . 1 . 494 . . 186 ASP C . 18428 1 1468 . 1 1 186 186 ASP CA C 13 53.870 0.06 . 1 . 494 . . 186 ASP CA . 18428 1 1469 . 1 1 186 186 ASP CB C 13 43.576 0.064 . 1 . 494 . . 186 ASP CB . 18428 1 1470 . 1 1 186 186 ASP N N 15 124.389 0.023 . 1 . 494 . . 186 ASP N . 18428 1 1471 . 1 1 187 187 THR H H 1 10.511 0.003 . 1 . 495 . . 187 THR H . 18428 1 1472 . 1 1 187 187 THR HA H 1 4.719 0.001 . 1 . 495 . . 187 THR HA . 18428 1 1473 . 1 1 187 187 THR C C 13 175.621 0.0 . 1 . 495 . . 187 THR C . 18428 1 1474 . 1 1 187 187 THR CA C 13 61.488 0.001 . 1 . 495 . . 187 THR CA . 18428 1 1475 . 1 1 187 187 THR CB C 13 68.838 0.001 . 1 . 495 . . 187 THR CB . 18428 1 1476 . 1 1 187 187 THR N N 15 112.513 0.055 . 1 . 495 . . 187 THR N . 18428 1 1477 . 1 1 188 188 ARG H H 1 9.307 0.003 . 1 . 496 . . 188 ARG H . 18428 1 1478 . 1 1 188 188 ARG C C 13 178.814 0.001 . 1 . 496 . . 188 ARG C . 18428 1 1479 . 1 1 188 188 ARG CA C 13 59.839 0.001 . 1 . 496 . . 188 ARG CA . 18428 1 1480 . 1 1 188 188 ARG CB C 13 29.252 0.001 . 1 . 496 . . 188 ARG CB . 18428 1 1481 . 1 1 188 188 ARG N N 15 120.017 0.055 . 1 . 496 . . 188 ARG N . 18428 1 1482 . 1 1 189 189 SER H H 1 8.427 0.002 . 1 . 497 . . 189 SER H . 18428 1 1483 . 1 1 189 189 SER HA H 1 4.135 0.001 . 1 . 497 . . 189 SER HA . 18428 1 1484 . 1 1 189 189 SER HB2 H 1 3.857 0.001 . 2 . 497 . . 189 SER HB2 . 18428 1 1485 . 1 1 189 189 SER C C 13 177.328 0.001 . 1 . 497 . . 189 SER C . 18428 1 1486 . 1 1 189 189 SER CA C 13 61.381 0.039 . 1 . 497 . . 189 SER CA . 18428 1 1487 . 1 1 189 189 SER CB C 13 62.406 0.002 . 1 . 497 . . 189 SER CB . 18428 1 1488 . 1 1 189 189 SER N N 15 112.302 0.032 . 1 . 497 . . 189 SER N . 18428 1 1489 . 1 1 190 190 VAL H H 1 7.401 0.002 . 1 . 498 . . 190 VAL H . 18428 1 1490 . 1 1 190 190 VAL HA H 1 3.626 0.009 . 1 . 498 . . 190 VAL HA . 18428 1 1491 . 1 1 190 190 VAL HB H 1 2.218 0.006 . 1 . 498 . . 190 VAL HB . 18428 1 1492 . 1 1 190 190 VAL HG11 H 1 1.050 0.003 . 2 . 498 . . 190 VAL HG11 . 18428 1 1493 . 1 1 190 190 VAL HG12 H 1 1.050 0.003 . 2 . 498 . . 190 VAL HG12 . 18428 1 1494 . 1 1 190 190 VAL HG13 H 1 1.050 0.003 . 2 . 498 . . 190 VAL HG13 . 18428 1 1495 . 1 1 190 190 VAL HG21 H 1 1.151 0.007 . 2 . 498 . . 190 VAL HG21 . 18428 1 1496 . 1 1 190 190 VAL HG22 H 1 1.151 0.007 . 2 . 498 . . 190 VAL HG22 . 18428 1 1497 . 1 1 190 190 VAL HG23 H 1 1.151 0.007 . 2 . 498 . . 190 VAL HG23 . 18428 1 1498 . 1 1 190 190 VAL C C 13 178.602 0.017 . 1 . 498 . . 190 VAL C . 18428 1 1499 . 1 1 190 190 VAL CA C 13 67.017 0.023 . 1 . 498 . . 190 VAL CA . 18428 1 1500 . 1 1 190 190 VAL CB C 13 31.949 0.111 . 1 . 498 . . 190 VAL CB . 18428 1 1501 . 1 1 190 190 VAL CG1 C 13 23.236 0.045 . 2 . 498 . . 190 VAL CG1 . 18428 1 1502 . 1 1 190 190 VAL CG2 C 13 21.534 0.051 . 2 . 498 . . 190 VAL CG2 . 18428 1 1503 . 1 1 190 190 VAL N N 15 124.355 0.03 . 1 . 498 . . 190 VAL N . 18428 1 1504 . 1 1 191 191 ILE H H 1 8.503 0.005 . 1 . 499 . . 191 ILE H . 18428 1 1505 . 1 1 191 191 ILE HA H 1 3.619 0.008 . 1 . 499 . . 191 ILE HA . 18428 1 1506 . 1 1 191 191 ILE HB H 1 2.012 0.007 . 1 . 499 . . 191 ILE HB . 18428 1 1507 . 1 1 191 191 ILE HG12 H 1 1.008 0.004 . 2 . 499 . . 191 ILE HG12 . 18428 1 1508 . 1 1 191 191 ILE HG13 H 1 1.533 0.009 . 2 . 499 . . 191 ILE HG13 . 18428 1 1509 . 1 1 191 191 ILE HG21 H 1 0.935 0.003 . 1 . 499 . . 191 ILE HG21 . 18428 1 1510 . 1 1 191 191 ILE HG22 H 1 0.935 0.003 . 1 . 499 . . 191 ILE HG22 . 18428 1 1511 . 1 1 191 191 ILE HG23 H 1 0.935 0.003 . 1 . 499 . . 191 ILE HG23 . 18428 1 1512 . 1 1 191 191 ILE HD11 H 1 0.709 0.005 . 1 . 499 . . 191 ILE HD11 . 18428 1 1513 . 1 1 191 191 ILE HD12 H 1 0.709 0.005 . 1 . 499 . . 191 ILE HD12 . 18428 1 1514 . 1 1 191 191 ILE HD13 H 1 0.709 0.005 . 1 . 499 . . 191 ILE HD13 . 18428 1 1515 . 1 1 191 191 ILE C C 13 178.228 0.001 . 1 . 499 . . 191 ILE C . 18428 1 1516 . 1 1 191 191 ILE CA C 13 66.389 0.018 . 1 . 499 . . 191 ILE CA . 18428 1 1517 . 1 1 191 191 ILE CB C 13 37.008 0.12 . 1 . 499 . . 191 ILE CB . 18428 1 1518 . 1 1 191 191 ILE CG1 C 13 30.625 0.052 . 1 . 499 . . 191 ILE CG1 . 18428 1 1519 . 1 1 191 191 ILE CG2 C 13 18.351 0.01 . 1 . 499 . . 191 ILE CG2 . 18428 1 1520 . 1 1 191 191 ILE CD1 C 13 12.800 0.078 . 1 . 499 . . 191 ILE CD1 . 18428 1 1521 . 1 1 191 191 ILE N N 15 121.593 0.035 . 1 . 499 . . 191 ILE N . 18428 1 1522 . 1 1 192 192 GLU H H 1 8.208 0.008 . 1 . 500 . . 192 GLU H . 18428 1 1523 . 1 1 192 192 GLU C C 13 179.181 0.03 . 1 . 500 . . 192 GLU C . 18428 1 1524 . 1 1 192 192 GLU CA C 13 58.961 0.037 . 1 . 500 . . 192 GLU CA . 18428 1 1525 . 1 1 192 192 GLU CB C 13 28.969 0.001 . 1 . 500 . . 192 GLU CB . 18428 1 1526 . 1 1 192 192 GLU N N 15 118.012 0.039 . 1 . 500 . . 192 GLU N . 18428 1 1527 . 1 1 193 193 LYS H H 1 7.612 0.002 . 1 . 501 . . 193 LYS H . 18428 1 1528 . 1 1 193 193 LYS HA H 1 3.995 0.001 . 1 . 501 . . 193 LYS HA . 18428 1 1529 . 1 1 193 193 LYS C C 13 180.128 0.02 . 1 . 501 . . 193 LYS C . 18428 1 1530 . 1 1 193 193 LYS CA C 13 59.822 0.002 . 1 . 501 . . 193 LYS CA . 18428 1 1531 . 1 1 193 193 LYS CB C 13 32.299 0.001 . 1 . 501 . . 193 LYS CB . 18428 1 1532 . 1 1 193 193 LYS N N 15 120.634 0.034 . 1 . 501 . . 193 LYS N . 18428 1 1533 . 1 1 194 194 PHE H H 1 8.562 0.008 . 1 . 502 . . 194 PHE H . 18428 1 1534 . 1 1 194 194 PHE HA H 1 3.762 0.002 . 1 . 502 . . 194 PHE HA . 18428 1 1535 . 1 1 194 194 PHE HB2 H 1 3.193 0.001 . 2 . 502 . . 194 PHE HB2 . 18428 1 1536 . 1 1 194 194 PHE C C 13 177.151 0.022 . 1 . 502 . . 194 PHE C . 18428 1 1537 . 1 1 194 194 PHE CA C 13 62.758 0.0 . 1 . 502 . . 194 PHE CA . 18428 1 1538 . 1 1 194 194 PHE CB C 13 39.214 0.001 . 1 . 502 . . 194 PHE CB . 18428 1 1539 . 1 1 194 194 PHE N N 15 120.357 0.047 . 1 . 502 . . 194 PHE N . 18428 1 1540 . 1 1 195 195 ARG H H 1 8.648 0.004 . 1 . 503 . . 195 ARG H . 18428 1 1541 . 1 1 195 195 ARG HA H 1 3.657 0.001 . 1 . 503 . . 195 ARG HA . 18428 1 1542 . 1 1 195 195 ARG HB2 H 1 2.029 0.001 . 2 . 503 . . 195 ARG HB2 . 18428 1 1543 . 1 1 195 195 ARG C C 13 178.118 0.014 . 1 . 503 . . 195 ARG C . 18428 1 1544 . 1 1 195 195 ARG CA C 13 60.185 0.001 . 1 . 503 . . 195 ARG CA . 18428 1 1545 . 1 1 195 195 ARG CB C 13 29.888 0.001 . 1 . 503 . . 195 ARG CB . 18428 1 1546 . 1 1 195 195 ARG N N 15 119.466 0.046 . 1 . 503 . . 195 ARG N . 18428 1 1547 . 1 1 196 196 LYS H H 1 7.457 0.007 . 1 . 504 . . 196 LYS H . 18428 1 1548 . 1 1 196 196 LYS HA H 1 4.004 0.001 . 1 . 504 . . 196 LYS HA . 18428 1 1549 . 1 1 196 196 LYS HB2 H 1 1.816 0.001 . 2 . 504 . . 196 LYS HB2 . 18428 1 1550 . 1 1 196 196 LYS C C 13 178.722 0.029 . 1 . 504 . . 196 LYS C . 18428 1 1551 . 1 1 196 196 LYS CA C 13 59.109 0.019 . 1 . 504 . . 196 LYS CA . 18428 1 1552 . 1 1 196 196 LYS CB C 13 32.453 0.032 . 1 . 504 . . 196 LYS CB . 18428 1 1553 . 1 1 196 196 LYS N N 15 117.270 0.046 . 1 . 504 . . 196 LYS N . 18428 1 1554 . 1 1 197 197 LEU H H 1 7.605 0.013 . 1 . 505 . . 197 LEU H . 18428 1 1555 . 1 1 197 197 LEU HA H 1 4.045 0.001 . 1 . 505 . . 197 LEU HA . 18428 1 1556 . 1 1 197 197 LEU HB2 H 1 1.506 0.001 . 2 . 505 . . 197 LEU HB2 . 18428 1 1557 . 1 1 197 197 LEU HB3 H 1 1.544 0.001 . 2 . 505 . . 197 LEU HB3 . 18428 1 1558 . 1 1 197 197 LEU C C 13 178.794 0.006 . 1 . 505 . . 197 LEU C . 18428 1 1559 . 1 1 197 197 LEU CA C 13 57.733 0.001 . 1 . 505 . . 197 LEU CA . 18428 1 1560 . 1 1 197 197 LEU CB C 13 42.270 0.041 . 1 . 505 . . 197 LEU CB . 18428 1 1561 . 1 1 197 197 LEU N N 15 120.660 0.03 . 1 . 505 . . 197 LEU N . 18428 1 1562 . 1 1 198 198 ILE H H 1 8.572 0.009 . 1 . 506 . . 198 ILE H . 18428 1 1563 . 1 1 198 198 ILE HA H 1 3.426 0.01 . 1 . 506 . . 198 ILE HA . 18428 1 1564 . 1 1 198 198 ILE HB H 1 1.689 0.005 . 1 . 506 . . 198 ILE HB . 18428 1 1565 . 1 1 198 198 ILE HG12 H 1 1.250 0.006 . 2 . 506 . . 198 ILE HG12 . 18428 1 1566 . 1 1 198 198 ILE HG13 H 1 0.709 0.002 . 2 . 506 . . 198 ILE HG13 . 18428 1 1567 . 1 1 198 198 ILE HG21 H 1 0.853 0.003 . 1 . 506 . . 198 ILE HG21 . 18428 1 1568 . 1 1 198 198 ILE HG22 H 1 0.853 0.003 . 1 . 506 . . 198 ILE HG22 . 18428 1 1569 . 1 1 198 198 ILE HG23 H 1 0.853 0.003 . 1 . 506 . . 198 ILE HG23 . 18428 1 1570 . 1 1 198 198 ILE HD11 H 1 0.041 0.003 . 1 . 506 . . 198 ILE HD11 . 18428 1 1571 . 1 1 198 198 ILE HD12 H 1 0.041 0.003 . 1 . 506 . . 198 ILE HD12 . 18428 1 1572 . 1 1 198 198 ILE HD13 H 1 0.041 0.003 . 1 . 506 . . 198 ILE HD13 . 18428 1 1573 . 1 1 198 198 ILE C C 13 177.635 0.012 . 1 . 506 . . 198 ILE C . 18428 1 1574 . 1 1 198 198 ILE CA C 13 65.371 0.039 . 1 . 506 . . 198 ILE CA . 18428 1 1575 . 1 1 198 198 ILE CB C 13 36.704 0.001 . 1 . 506 . . 198 ILE CB . 18428 1 1576 . 1 1 198 198 ILE CG1 C 13 30.142 0.015 . 1 . 506 . . 198 ILE CG1 . 18428 1 1577 . 1 1 198 198 ILE CG2 C 13 18.230 0.001 . 1 . 506 . . 198 ILE CG2 . 18428 1 1578 . 1 1 198 198 ILE CD1 C 13 12.506 0.07 . 1 . 506 . . 198 ILE CD1 . 18428 1 1579 . 1 1 198 198 ILE N N 15 119.753 0.047 . 1 . 506 . . 198 ILE N . 18428 1 1580 . 1 1 199 199 ASP H H 1 8.025 0.008 . 1 . 507 . . 199 ASP H . 18428 1 1581 . 1 1 199 199 ASP HA H 1 4.404 0.001 . 1 . 507 . . 199 ASP HA . 18428 1 1582 . 1 1 199 199 ASP HB2 H 1 2.579 0.001 . 2 . 507 . . 199 ASP HB2 . 18428 1 1583 . 1 1 199 199 ASP HB3 H 1 2.809 0.001 . 2 . 507 . . 199 ASP HB3 . 18428 1 1584 . 1 1 199 199 ASP C C 13 178.562 0.004 . 1 . 507 . . 199 ASP C . 18428 1 1585 . 1 1 199 199 ASP CA C 13 57.080 0.053 . 1 . 507 . . 199 ASP CA . 18428 1 1586 . 1 1 199 199 ASP CB C 13 40.333 0.012 . 1 . 507 . . 199 ASP CB . 18428 1 1587 . 1 1 199 199 ASP N N 15 119.030 0.029 . 1 . 507 . . 199 ASP N . 18428 1 1588 . 1 1 200 200 GLU H H 1 7.402 0.001 . 1 . 508 . . 200 GLU H . 18428 1 1589 . 1 1 200 200 GLU HA H 1 4.017 0.001 . 1 . 508 . . 200 GLU HA . 18428 1 1590 . 1 1 200 200 GLU HB2 H 1 1.992 0.001 . 2 . 508 . . 200 GLU HB2 . 18428 1 1591 . 1 1 200 200 GLU HB3 H 1 2.097 0.001 . 2 . 508 . . 200 GLU HB3 . 18428 1 1592 . 1 1 200 200 GLU C C 13 177.654 0.004 . 1 . 508 . . 200 GLU C . 18428 1 1593 . 1 1 200 200 GLU CA C 13 58.194 0.011 . 1 . 508 . . 200 GLU CA . 18428 1 1594 . 1 1 200 200 GLU CB C 13 30.142 0.077 . 1 . 508 . . 200 GLU CB . 18428 1 1595 . 1 1 200 200 GLU N N 15 116.057 0.016 . 1 . 508 . . 200 GLU N . 18428 1 1596 . 1 1 201 201 LEU H H 1 8.005 0.004 . 1 . 509 . . 201 LEU H . 18428 1 1597 . 1 1 201 201 LEU HA H 1 4.403 0.008 . 1 . 509 . . 201 LEU HA . 18428 1 1598 . 1 1 201 201 LEU HB2 H 1 1.756 0.001 . 2 . 509 . . 201 LEU HB2 . 18428 1 1599 . 1 1 201 201 LEU HB3 H 1 1.337 0.001 . 2 . 509 . . 201 LEU HB3 . 18428 1 1600 . 1 1 201 201 LEU HG H 1 1.790 0.007 . 1 . 509 . . 201 LEU HG . 18428 1 1601 . 1 1 201 201 LEU HD11 H 1 0.706 0.007 . 2 . 509 . . 201 LEU HD11 . 18428 1 1602 . 1 1 201 201 LEU HD12 H 1 0.706 0.007 . 2 . 509 . . 201 LEU HD12 . 18428 1 1603 . 1 1 201 201 LEU HD13 H 1 0.706 0.007 . 2 . 509 . . 201 LEU HD13 . 18428 1 1604 . 1 1 201 201 LEU HD21 H 1 0.660 0.004 . 2 . 509 . . 201 LEU HD21 . 18428 1 1605 . 1 1 201 201 LEU HD22 H 1 0.660 0.004 . 2 . 509 . . 201 LEU HD22 . 18428 1 1606 . 1 1 201 201 LEU HD23 H 1 0.660 0.004 . 2 . 509 . . 201 LEU HD23 . 18428 1 1607 . 1 1 201 201 LEU C C 13 178.545 0.001 . 1 . 509 . . 201 LEU C . 18428 1 1608 . 1 1 201 201 LEU CA C 13 55.890 0.071 . 1 . 509 . . 201 LEU CA . 18428 1 1609 . 1 1 201 201 LEU CB C 13 44.396 0.012 . 1 . 509 . . 201 LEU CB . 18428 1 1610 . 1 1 201 201 LEU CG C 13 26.644 0.001 . 1 . 509 . . 201 LEU CG . 18428 1 1611 . 1 1 201 201 LEU CD1 C 13 22.758 0.02 . 2 . 509 . . 201 LEU CD1 . 18428 1 1612 . 1 1 201 201 LEU CD2 C 13 25.600 0.008 . 2 . 509 . . 201 LEU CD2 . 18428 1 1613 . 1 1 201 201 LEU N N 15 115.802 0.036 . 1 . 509 . . 201 LEU N . 18428 1 1614 . 1 1 202 202 ASP H H 1 8.995 0.006 . 1 . 510 . . 202 ASP H . 18428 1 1615 . 1 1 202 202 ASP HA H 1 5.025 0.001 . 1 . 510 . . 202 ASP HA . 18428 1 1616 . 1 1 202 202 ASP HB2 H 1 2.172 0.001 . 2 . 510 . . 202 ASP HB2 . 18428 1 1617 . 1 1 202 202 ASP C C 13 174.219 0.004 . 1 . 510 . . 202 ASP C . 18428 1 1618 . 1 1 202 202 ASP CA C 13 53.832 0.025 . 1 . 510 . . 202 ASP CA . 18428 1 1619 . 1 1 202 202 ASP CB C 13 39.806 0.001 . 1 . 510 . . 202 ASP CB . 18428 1 1620 . 1 1 202 202 ASP N N 15 122.148 0.051 . 1 . 510 . . 202 ASP N . 18428 1 1621 . 1 1 203 203 VAL H H 1 7.498 0.003 . 1 . 511 . . 203 VAL H . 18428 1 1622 . 1 1 203 203 VAL HA H 1 4.525 0.008 . 1 . 511 . . 203 VAL HA . 18428 1 1623 . 1 1 203 203 VAL HB H 1 1.986 0.009 . 1 . 511 . . 203 VAL HB . 18428 1 1624 . 1 1 203 203 VAL HG11 H 1 0.776 0.003 . 2 . 511 . . 203 VAL HG11 . 18428 1 1625 . 1 1 203 203 VAL HG12 H 1 0.776 0.003 . 2 . 511 . . 203 VAL HG12 . 18428 1 1626 . 1 1 203 203 VAL HG13 H 1 0.776 0.003 . 2 . 511 . . 203 VAL HG13 . 18428 1 1627 . 1 1 203 203 VAL HG21 H 1 0.639 0.005 . 2 . 511 . . 203 VAL HG21 . 18428 1 1628 . 1 1 203 203 VAL HG22 H 1 0.639 0.005 . 2 . 511 . . 203 VAL HG22 . 18428 1 1629 . 1 1 203 203 VAL HG23 H 1 0.639 0.005 . 2 . 511 . . 203 VAL HG23 . 18428 1 1630 . 1 1 203 203 VAL C C 13 172.613 0.001 . 1 . 511 . . 203 VAL C . 18428 1 1631 . 1 1 203 203 VAL CA C 13 57.408 0.051 . 1 . 511 . . 203 VAL CA . 18428 1 1632 . 1 1 203 203 VAL CB C 13 33.170 0.132 . 1 . 511 . . 203 VAL CB . 18428 1 1633 . 1 1 203 203 VAL CG1 C 13 21.809 0.008 . 2 . 511 . . 203 VAL CG1 . 18428 1 1634 . 1 1 203 203 VAL CG2 C 13 17.845 0.004 . 2 . 511 . . 203 VAL CG2 . 18428 1 1635 . 1 1 203 203 VAL N N 15 115.863 0.025 . 1 . 511 . . 203 VAL N . 18428 1 1636 . 1 1 204 204 PRO HA H 1 3.822 0.001 . 1 . 512 . . 204 PRO HA . 18428 1 1637 . 1 1 204 204 PRO HB2 H 1 1.576 0.001 . 2 . 512 . . 204 PRO HB2 . 18428 1 1638 . 1 1 204 204 PRO HB3 H 1 1.736 0.001 . 2 . 512 . . 204 PRO HB3 . 18428 1 1639 . 1 1 204 204 PRO C C 13 176.590 0.001 . 1 . 512 . . 204 PRO C . 18428 1 1640 . 1 1 204 204 PRO CA C 13 62.248 0.001 . 1 . 512 . . 204 PRO CA . 18428 1 1641 . 1 1 204 204 PRO CB C 13 31.572 0.001 . 1 . 512 . . 204 PRO CB . 18428 1 1642 . 1 1 205 205 ALA H H 1 8.111 0.005 . 1 . 513 . . 205 ALA H . 18428 1 1643 . 1 1 205 205 ALA HA H 1 4.159 0.001 . 1 . 513 . . 205 ALA HA . 18428 1 1644 . 1 1 205 205 ALA HB1 H 1 1.314 0.001 . 1 . 513 . . 205 ALA HB1 . 18428 1 1645 . 1 1 205 205 ALA HB2 H 1 1.314 0.001 . 1 . 513 . . 205 ALA HB2 . 18428 1 1646 . 1 1 205 205 ALA HB3 H 1 1.314 0.001 . 1 . 513 . . 205 ALA HB3 . 18428 1 1647 . 1 1 205 205 ALA C C 13 177.734 0.008 . 1 . 513 . . 205 ALA C . 18428 1 1648 . 1 1 205 205 ALA CA C 13 52.437 0.001 . 1 . 513 . . 205 ALA CA . 18428 1 1649 . 1 1 205 205 ALA CB C 13 19.088 0.001 . 1 . 513 . . 205 ALA CB . 18428 1 1650 . 1 1 205 205 ALA N N 15 123.451 0.056 . 1 . 513 . . 205 ALA N . 18428 1 1651 . 1 1 206 206 GLN H H 1 8.238 0.002 . 1 . 514 . . 206 GLN H . 18428 1 1652 . 1 1 206 206 GLN HA H 1 4.190 0.001 . 1 . 514 . . 206 GLN HA . 18428 1 1653 . 1 1 206 206 GLN HB2 H 1 1.881 0.001 . 2 . 514 . . 206 GLN HB2 . 18428 1 1654 . 1 1 206 206 GLN C C 13 175.831 0.007 . 1 . 514 . . 206 GLN C . 18428 1 1655 . 1 1 206 206 GLN CA C 13 55.767 0.031 . 1 . 514 . . 206 GLN CA . 18428 1 1656 . 1 1 206 206 GLN CB C 13 29.381 0.023 . 1 . 514 . . 206 GLN CB . 18428 1 1657 . 1 1 206 206 GLN N N 15 119.210 0.015 . 1 . 514 . . 206 GLN N . 18428 1 1658 . 1 1 207 207 GLN H H 1 8.338 0.003 . 1 . 515 . . 207 GLN H . 18428 1 1659 . 1 1 207 207 GLN HA H 1 4.242 0.001 . 1 . 515 . . 207 GLN HA . 18428 1 1660 . 1 1 207 207 GLN HB2 H 1 1.986 0.001 . 2 . 515 . . 207 GLN HB2 . 18428 1 1661 . 1 1 207 207 GLN C C 13 175.735 0.009 . 1 . 515 . . 207 GLN C . 18428 1 1662 . 1 1 207 207 GLN CA C 13 55.905 0.017 . 1 . 515 . . 207 GLN CA . 18428 1 1663 . 1 1 207 207 GLN CB C 13 29.400 0.001 . 1 . 515 . . 207 GLN CB . 18428 1 1664 . 1 1 207 207 GLN N N 15 121.703 0.017 . 1 . 515 . . 207 GLN N . 18428 1 1665 . 1 1 208 208 VAL H H 1 8.099 0.003 . 1 . 516 . . 208 VAL H . 18428 1 1666 . 1 1 208 208 VAL HA H 1 4.000 0.008 . 1 . 516 . . 208 VAL HA . 18428 1 1667 . 1 1 208 208 VAL HB H 1 1.971 0.002 . 1 . 516 . . 208 VAL HB . 18428 1 1668 . 1 1 208 208 VAL HG11 H 1 0.850 0.001 . 2 . 516 . . 208 VAL HG11 . 18428 1 1669 . 1 1 208 208 VAL HG12 H 1 0.850 0.001 . 2 . 516 . . 208 VAL HG12 . 18428 1 1670 . 1 1 208 208 VAL HG13 H 1 0.850 0.001 . 2 . 516 . . 208 VAL HG13 . 18428 1 1671 . 1 1 208 208 VAL C C 13 175.844 0.001 . 1 . 516 . . 208 VAL C . 18428 1 1672 . 1 1 208 208 VAL CA C 13 62.339 0.077 . 1 . 516 . . 208 VAL CA . 18428 1 1673 . 1 1 208 208 VAL CB C 13 32.597 0.044 . 1 . 516 . . 208 VAL CB . 18428 1 1674 . 1 1 208 208 VAL CG1 C 13 20.920 0.001 . 2 . 516 . . 208 VAL CG1 . 18428 1 1675 . 1 1 208 208 VAL N N 15 121.643 0.009 . 1 . 516 . . 208 VAL N . 18428 1 1676 . 1 1 212 212 ALA HA H 1 4.204 0.001 . 1 . 520 . . 212 ALA HA . 18428 1 1677 . 1 1 212 212 ALA HB1 H 1 1.293 0.001 . 1 . 520 . . 212 ALA HB1 . 18428 1 1678 . 1 1 212 212 ALA HB2 H 1 1.293 0.001 . 1 . 520 . . 212 ALA HB2 . 18428 1 1679 . 1 1 212 212 ALA HB3 H 1 1.293 0.001 . 1 . 520 . . 212 ALA HB3 . 18428 1 1680 . 1 1 212 212 ALA C C 13 177.461 0.001 . 1 . 520 . . 212 ALA C . 18428 1 1681 . 1 1 212 212 ALA CA C 13 52.543 0.001 . 1 . 520 . . 212 ALA CA . 18428 1 1682 . 1 1 212 212 ALA CB C 13 19.064 0.001 . 1 . 520 . . 212 ALA CB . 18428 1 1683 . 1 1 213 213 ARG H H 1 8.125 0.003 . 1 . 521 . . 213 ARG H . 18428 1 1684 . 1 1 213 213 ARG HA H 1 4.442 0.001 . 1 . 521 . . 213 ARG HA . 18428 1 1685 . 1 1 213 213 ARG HB2 H 1 1.919 0.001 . 2 . 521 . . 213 ARG HB2 . 18428 1 1686 . 1 1 213 213 ARG HB3 H 1 1.973 0.001 . 2 . 521 . . 213 ARG HB3 . 18428 1 1687 . 1 1 213 213 ARG C C 13 176.174 0.006 . 1 . 521 . . 213 ARG C . 18428 1 1688 . 1 1 213 213 ARG CA C 13 56.011 0.036 . 1 . 521 . . 213 ARG CA . 18428 1 1689 . 1 1 213 213 ARG CB C 13 30.719 0.009 . 1 . 521 . . 213 ARG CB . 18428 1 1690 . 1 1 213 213 ARG N N 15 120.090 0.017 . 1 . 521 . . 213 ARG N . 18428 1 1691 . 1 1 214 214 ILE H H 1 8.107 0.001 . 1 . 522 . . 214 ILE H . 18428 1 1692 . 1 1 214 214 ILE HA H 1 4.061 0.002 . 1 . 522 . . 214 ILE HA . 18428 1 1693 . 1 1 214 214 ILE HB H 1 1.783 0.003 . 1 . 522 . . 214 ILE HB . 18428 1 1694 . 1 1 214 214 ILE HG12 H 1 1.408 0.003 . 2 . 522 . . 214 ILE HG12 . 18428 1 1695 . 1 1 214 214 ILE HG13 H 1 1.106 0.003 . 2 . 522 . . 214 ILE HG13 . 18428 1 1696 . 1 1 214 214 ILE HG21 H 1 0.808 0.015 . 1 . 522 . . 214 ILE HG21 . 18428 1 1697 . 1 1 214 214 ILE HG22 H 1 0.808 0.015 . 1 . 522 . . 214 ILE HG22 . 18428 1 1698 . 1 1 214 214 ILE HG23 H 1 0.808 0.015 . 1 . 522 . . 214 ILE HG23 . 18428 1 1699 . 1 1 214 214 ILE HD11 H 1 0.778 0.017 . 1 . 522 . . 214 ILE HD11 . 18428 1 1700 . 1 1 214 214 ILE HD12 H 1 0.778 0.017 . 1 . 522 . . 214 ILE HD12 . 18428 1 1701 . 1 1 214 214 ILE HD13 H 1 0.778 0.017 . 1 . 522 . . 214 ILE HD13 . 18428 1 1702 . 1 1 214 214 ILE C C 13 176.213 0.045 . 1 . 522 . . 214 ILE C . 18428 1 1703 . 1 1 214 214 ILE CA C 13 61.259 0.009 . 1 . 522 . . 214 ILE CA . 18428 1 1704 . 1 1 214 214 ILE CB C 13 38.404 0.107 . 1 . 522 . . 214 ILE CB . 18428 1 1705 . 1 1 214 214 ILE CG1 C 13 27.310 0.06 . 1 . 522 . . 214 ILE CG1 . 18428 1 1706 . 1 1 214 214 ILE CG2 C 13 17.404 0.014 . 1 . 522 . . 214 ILE CG2 . 18428 1 1707 . 1 1 214 214 ILE CD1 C 13 12.673 0.031 . 1 . 522 . . 214 ILE CD1 . 18428 1 1708 . 1 1 214 214 ILE N N 15 122.743 0.029 . 1 . 522 . . 214 ILE N . 18428 1 1709 . 1 1 215 215 VAL H H 1 8.113 0.002 . 1 . 523 . . 215 VAL H . 18428 1 1710 . 1 1 215 215 VAL HA H 1 3.994 0.001 . 1 . 523 . . 215 VAL HA . 18428 1 1711 . 1 1 215 215 VAL HB H 1 1.963 0.001 . 1 . 523 . . 215 VAL HB . 18428 1 1712 . 1 1 215 215 VAL HG11 H 1 0.852 0.001 . 2 . 523 . . 215 VAL HG11 . 18428 1 1713 . 1 1 215 215 VAL HG12 H 1 0.852 0.001 . 2 . 523 . . 215 VAL HG12 . 18428 1 1714 . 1 1 215 215 VAL HG13 H 1 0.852 0.001 . 2 . 523 . . 215 VAL HG13 . 18428 1 1715 . 1 1 215 215 VAL C C 13 176.009 0.035 . 1 . 523 . . 215 VAL C . 18428 1 1716 . 1 1 215 215 VAL CA C 13 62.431 0.009 . 1 . 523 . . 215 VAL CA . 18428 1 1717 . 1 1 215 215 VAL CB C 13 32.586 0.029 . 1 . 523 . . 215 VAL CB . 18428 1 1718 . 1 1 215 215 VAL CG1 C 13 20.754 0.001 . 2 . 523 . . 215 VAL CG1 . 18428 1 1719 . 1 1 215 215 VAL N N 15 124.437 0.022 . 1 . 523 . . 215 VAL N . 18428 1 1720 . 1 1 216 216 GLU H H 1 8.359 0.002 . 1 . 524 . . 216 GLU H . 18428 1 1721 . 1 1 216 216 GLU HA H 1 4.149 0.001 . 1 . 524 . . 216 GLU HA . 18428 1 1722 . 1 1 216 216 GLU HB2 H 1 1.845 0.001 . 2 . 524 . . 216 GLU HB2 . 18428 1 1723 . 1 1 216 216 GLU HB3 H 1 1.947 0.001 . 2 . 524 . . 216 GLU HB3 . 18428 1 1724 . 1 1 216 216 GLU C C 13 176.034 0.035 . 1 . 524 . . 216 GLU C . 18428 1 1725 . 1 1 216 216 GLU CA C 13 56.553 0.038 . 1 . 524 . . 216 GLU CA . 18428 1 1726 . 1 1 216 216 GLU CB C 13 30.226 0.014 . 1 . 524 . . 216 GLU CB . 18428 1 1727 . 1 1 216 216 GLU N N 15 124.563 0.028 . 1 . 524 . . 216 GLU N . 18428 1 1728 . 1 1 217 217 ALA H H 1 8.205 0.002 . 1 . 525 . . 217 ALA H . 18428 1 1729 . 1 1 217 217 ALA HA H 1 4.203 0.001 . 1 . 525 . . 217 ALA HA . 18428 1 1730 . 1 1 217 217 ALA HB1 H 1 1.301 0.001 . 1 . 525 . . 217 ALA HB1 . 18428 1 1731 . 1 1 217 217 ALA HB2 H 1 1.301 0.001 . 1 . 525 . . 217 ALA HB2 . 18428 1 1732 . 1 1 217 217 ALA HB3 H 1 1.301 0.001 . 1 . 525 . . 217 ALA HB3 . 18428 1 1733 . 1 1 217 217 ALA C C 13 177.539 0.023 . 1 . 525 . . 217 ALA C . 18428 1 1734 . 1 1 217 217 ALA CA C 13 52.451 0.023 . 1 . 525 . . 217 ALA CA . 18428 1 1735 . 1 1 217 217 ALA CB C 13 19.144 0.069 . 1 . 525 . . 217 ALA CB . 18428 1 1736 . 1 1 217 217 ALA N N 15 125.038 0.01 . 1 . 525 . . 217 ALA N . 18428 1 1737 . 1 1 218 218 ALA H H 1 8.232 0.003 . 1 . 526 . . 218 ALA H . 18428 1 1738 . 1 1 218 218 ALA HA H 1 4.180 0.001 . 1 . 526 . . 218 ALA HA . 18428 1 1739 . 1 1 218 218 ALA C C 13 177.573 0.005 . 1 . 526 . . 218 ALA C . 18428 1 1740 . 1 1 218 218 ALA CA C 13 52.671 0.055 . 1 . 526 . . 218 ALA CA . 18428 1 1741 . 1 1 218 218 ALA CB C 13 19.071 0.018 . 1 . 526 . . 218 ALA CB . 18428 1 1742 . 1 1 218 218 ALA N N 15 123.322 0.028 . 1 . 526 . . 218 ALA N . 18428 1 1743 . 1 1 219 219 ASP H H 1 8.140 0.001 . 1 . 527 . . 219 ASP H . 18428 1 1744 . 1 1 219 219 ASP HA H 1 4.468 0.001 . 1 . 527 . . 219 ASP HA . 18428 1 1745 . 1 1 219 219 ASP HB2 H 1 2.591 0.001 . 2 . 527 . . 219 ASP HB2 . 18428 1 1746 . 1 1 219 219 ASP C C 13 176.830 0.001 . 1 . 527 . . 219 ASP C . 18428 1 1747 . 1 1 219 219 ASP CA C 13 54.351 0.012 . 1 . 527 . . 219 ASP CA . 18428 1 1748 . 1 1 219 219 ASP CB C 13 41.077 0.006 . 1 . 527 . . 219 ASP CB . 18428 1 1749 . 1 1 219 219 ASP N N 15 118.735 0.005 . 1 . 527 . . 219 ASP N . 18428 1 1750 . 1 1 220 220 GLY H H 1 8.145 0.002 . 1 . 528 . . 220 GLY H . 18428 1 1751 . 1 1 220 220 GLY HA2 H 1 3.782 0.001 . 2 . 528 . . 220 GLY HA2 . 18428 1 1752 . 1 1 220 220 GLY C C 13 174.192 0.009 . 1 . 528 . . 220 GLY C . 18428 1 1753 . 1 1 220 220 GLY CA C 13 45.528 0.003 . 1 . 528 . . 220 GLY CA . 18428 1 1754 . 1 1 220 220 GLY N N 15 108.486 0.011 . 1 . 528 . . 220 GLY N . 18428 1 1755 . 1 1 221 221 PHE H H 1 8.011 0.001 . 1 . 529 . . 221 PHE H . 18428 1 1756 . 1 1 221 221 PHE HA H 1 4.544 0.001 . 1 . 529 . . 221 PHE HA . 18428 1 1757 . 1 1 221 221 PHE HB2 H 1 2.972 0.001 . 2 . 529 . . 221 PHE HB2 . 18428 1 1758 . 1 1 221 221 PHE HB3 H 1 3.078 0.001 . 2 . 529 . . 221 PHE HB3 . 18428 1 1759 . 1 1 221 221 PHE C C 13 175.933 0.006 . 1 . 529 . . 221 PHE C . 18428 1 1760 . 1 1 221 221 PHE CA C 13 57.992 0.005 . 1 . 529 . . 221 PHE CA . 18428 1 1761 . 1 1 221 221 PHE CB C 13 39.445 0.008 . 1 . 529 . . 221 PHE CB . 18428 1 1762 . 1 1 221 221 PHE N N 15 119.761 0.011 . 1 . 529 . . 221 PHE N . 18428 1 1763 . 1 1 222 222 SER H H 1 8.156 0.002 . 1 . 530 . . 222 SER H . 18428 1 1764 . 1 1 222 222 SER HA H 1 4.306 0.001 . 1 . 530 . . 222 SER HA . 18428 1 1765 . 1 1 222 222 SER HB2 H 1 3.774 0.001 . 2 . 530 . . 222 SER HB2 . 18428 1 1766 . 1 1 222 222 SER HB3 H 1 3.734 0.001 . 2 . 530 . . 222 SER HB3 . 18428 1 1767 . 1 1 222 222 SER C C 13 174.558 0.009 . 1 . 530 . . 222 SER C . 18428 1 1768 . 1 1 222 222 SER CA C 13 58.358 0.042 . 1 . 530 . . 222 SER CA . 18428 1 1769 . 1 1 222 222 SER CB C 13 63.651 0.014 . 1 . 530 . . 222 SER CB . 18428 1 1770 . 1 1 222 222 SER N N 15 116.984 0.02 . 1 . 530 . . 222 SER N . 18428 1 1771 . 1 1 223 223 ARG H H 1 8.227 0.003 . 1 . 531 . . 223 ARG H . 18428 1 1772 . 1 1 223 223 ARG HA H 1 4.208 0.001 . 1 . 531 . . 223 ARG HA . 18428 1 1773 . 1 1 223 223 ARG HB2 H 1 1.681 0.001 . 2 . 531 . . 223 ARG HB2 . 18428 1 1774 . 1 1 223 223 ARG HB3 H 1 1.780 0.001 . 2 . 531 . . 223 ARG HB3 . 18428 1 1775 . 1 1 223 223 ARG C C 13 175.938 0.01 . 1 . 531 . . 223 ARG C . 18428 1 1776 . 1 1 223 223 ARG CA C 13 56.421 0.007 . 1 . 531 . . 223 ARG CA . 18428 1 1777 . 1 1 223 223 ARG CB C 13 30.638 0.006 . 1 . 531 . . 223 ARG CB . 18428 1 1778 . 1 1 223 223 ARG N N 15 122.979 0.02 . 1 . 531 . . 223 ARG N . 18428 1 1779 . 1 1 224 224 ASP H H 1 8.208 0.003 . 1 . 532 . . 224 ASP H . 18428 1 1780 . 1 1 224 224 ASP HA H 1 4.243 0.001 . 1 . 532 . . 224 ASP HA . 18428 1 1781 . 1 1 224 224 ASP HB2 H 1 2.509 0.001 . 2 . 532 . . 224 ASP HB2 . 18428 1 1782 . 1 1 224 224 ASP HB3 H 1 2.643 0.001 . 2 . 532 . . 224 ASP HB3 . 18428 1 1783 . 1 1 224 224 ASP C C 13 176.342 0.02 . 1 . 532 . . 224 ASP C . 18428 1 1784 . 1 1 224 224 ASP CA C 13 54.397 0.006 . 1 . 532 . . 224 ASP CA . 18428 1 1785 . 1 1 224 224 ASP CB C 13 41.018 0.016 . 1 . 532 . . 224 ASP CB . 18428 1 1786 . 1 1 224 224 ASP N N 15 120.562 0.019 . 1 . 532 . . 224 ASP N . 18428 1 1787 . 1 1 225 225 LEU H H 1 8.129 0.007 . 1 . 533 . . 225 LEU H . 18428 1 1788 . 1 1 225 225 LEU HA H 1 4.212 0.006 . 1 . 533 . . 225 LEU HA . 18428 1 1789 . 1 1 225 225 LEU HB2 H 1 1.526 0.001 . 2 . 533 . . 225 LEU HB2 . 18428 1 1790 . 1 1 225 225 LEU HB3 H 1 1.596 0.001 . 2 . 533 . . 225 LEU HB3 . 18428 1 1791 . 1 1 225 225 LEU HD11 H 1 0.760 0.001 . 2 . 533 . . 225 LEU HD11 . 18428 1 1792 . 1 1 225 225 LEU HD12 H 1 0.760 0.001 . 2 . 533 . . 225 LEU HD12 . 18428 1 1793 . 1 1 225 225 LEU HD13 H 1 0.760 0.001 . 2 . 533 . . 225 LEU HD13 . 18428 1 1794 . 1 1 225 225 LEU HD21 H 1 0.825 0.001 . 2 . 533 . . 225 LEU HD21 . 18428 1 1795 . 1 1 225 225 LEU HD22 H 1 0.825 0.001 . 2 . 533 . . 225 LEU HD22 . 18428 1 1796 . 1 1 225 225 LEU HD23 H 1 0.825 0.001 . 2 . 533 . . 225 LEU HD23 . 18428 1 1797 . 1 1 225 225 LEU C C 13 178.030 0.004 . 1 . 533 . . 225 LEU C . 18428 1 1798 . 1 1 225 225 LEU CA C 13 55.528 0.019 . 1 . 533 . . 225 LEU CA . 18428 1 1799 . 1 1 225 225 LEU CB C 13 42.018 0.012 . 1 . 533 . . 225 LEU CB . 18428 1 1800 . 1 1 225 225 LEU CD1 C 13 23.157 0.001 . 2 . 533 . . 225 LEU CD1 . 18428 1 1801 . 1 1 225 225 LEU CD2 C 13 24.914 0.001 . 2 . 533 . . 225 LEU CD2 . 18428 1 1802 . 1 1 225 225 LEU N N 15 122.690 0.019 . 1 . 533 . . 225 LEU N . 18428 1 1803 . 1 1 226 226 GLY H H 1 8.346 0.002 . 1 . 534 . . 226 GLY H . 18428 1 1804 . 1 1 226 226 GLY HA2 H 1 3.851 0.001 . 2 . 534 . . 226 GLY HA2 . 18428 1 1805 . 1 1 226 226 GLY C C 13 174.321 0.005 . 1 . 534 . . 226 GLY C . 18428 1 1806 . 1 1 226 226 GLY CA C 13 45.503 0.001 . 1 . 534 . . 226 GLY CA . 18428 1 1807 . 1 1 226 226 GLY N N 15 108.639 0.008 . 1 . 534 . . 226 GLY N . 18428 1 1808 . 1 1 227 227 VAL H H 1 7.732 0.002 . 1 . 535 . . 227 VAL H . 18428 1 1809 . 1 1 227 227 VAL HA H 1 3.971 0.001 . 1 . 535 . . 227 VAL HA . 18428 1 1810 . 1 1 227 227 VAL HB H 1 1.942 0.001 . 1 . 535 . . 227 VAL HB . 18428 1 1811 . 1 1 227 227 VAL HG11 H 1 0.774 0.001 . 2 . 535 . . 227 VAL HG11 . 18428 1 1812 . 1 1 227 227 VAL HG12 H 1 0.774 0.001 . 2 . 535 . . 227 VAL HG12 . 18428 1 1813 . 1 1 227 227 VAL HG13 H 1 0.774 0.001 . 2 . 535 . . 227 VAL HG13 . 18428 1 1814 . 1 1 227 227 VAL HG21 H 1 0.827 0.001 . 2 . 535 . . 227 VAL HG21 . 18428 1 1815 . 1 1 227 227 VAL HG22 H 1 0.827 0.001 . 2 . 535 . . 227 VAL HG22 . 18428 1 1816 . 1 1 227 227 VAL HG23 H 1 0.827 0.001 . 2 . 535 . . 227 VAL HG23 . 18428 1 1817 . 1 1 227 227 VAL C C 13 176.195 0.011 . 1 . 535 . . 227 VAL C . 18428 1 1818 . 1 1 227 227 VAL CA C 13 62.432 0.0 . 1 . 535 . . 227 VAL CA . 18428 1 1819 . 1 1 227 227 VAL CB C 13 32.455 0.014 . 1 . 535 . . 227 VAL CB . 18428 1 1820 . 1 1 227 227 VAL CG1 C 13 21.401 0.001 . 2 . 535 . . 227 VAL CG1 . 18428 1 1821 . 1 1 227 227 VAL CG2 C 13 20.342 0.001 . 2 . 535 . . 227 VAL CG2 . 18428 1 1822 . 1 1 227 227 VAL N N 15 118.979 0.011 . 1 . 535 . . 227 VAL N . 18428 1 1823 . 1 1 228 228 LYS H H 1 8.196 0.002 . 1 . 536 . . 228 LYS H . 18428 1 1824 . 1 1 228 228 LYS HA H 1 4.178 0.001 . 1 . 536 . . 228 LYS HA . 18428 1 1825 . 1 1 228 228 LYS HB2 H 1 1.584 0.001 . 2 . 536 . . 228 LYS HB2 . 18428 1 1826 . 1 1 228 228 LYS HB3 H 1 1.286 0.001 . 2 . 536 . . 228 LYS HB3 . 18428 1 1827 . 1 1 228 228 LYS C C 13 176.225 0.001 . 1 . 536 . . 228 LYS C . 18428 1 1828 . 1 1 228 228 LYS CA C 13 56.208 0.015 . 1 . 536 . . 228 LYS CA . 18428 1 1829 . 1 1 228 228 LYS CB C 13 32.882 0.038 . 1 . 536 . . 228 LYS CB . 18428 1 1830 . 1 1 228 228 LYS N N 15 124.155 0.009 . 1 . 536 . . 228 LYS N . 18428 1 1831 . 1 1 229 229 PHE H H 1 8.155 0.003 . 1 . 537 . . 229 PHE H . 18428 1 1832 . 1 1 229 229 PHE HA H 1 4.528 0.001 . 1 . 537 . . 229 PHE HA . 18428 1 1833 . 1 1 229 229 PHE HB2 H 1 2.926 0.001 . 2 . 537 . . 229 PHE HB2 . 18428 1 1834 . 1 1 229 229 PHE HB3 H 1 3.074 0.001 . 2 . 537 . . 229 PHE HB3 . 18428 1 1835 . 1 1 229 229 PHE C C 13 176.250 0.015 . 1 . 537 . . 229 PHE C . 18428 1 1836 . 1 1 229 229 PHE CA C 13 57.855 0.001 . 1 . 537 . . 229 PHE CA . 18428 1 1837 . 1 1 229 229 PHE CB C 13 39.522 0.011 . 1 . 537 . . 229 PHE CB . 18428 1 1838 . 1 1 229 229 PHE N N 15 120.821 0.021 . 1 . 537 . . 229 PHE N . 18428 1 1839 . 1 1 230 230 GLY H H 1 8.221 0.002 . 1 . 538 . . 230 GLY H . 18428 1 1840 . 1 1 230 230 GLY HA2 H 1 3.825 0.001 . 2 . 538 . . 230 GLY HA2 . 18428 1 1841 . 1 1 230 230 GLY C C 13 173.859 0.007 . 1 . 538 . . 230 GLY C . 18428 1 1842 . 1 1 230 230 GLY CA C 13 45.182 0.013 . 1 . 538 . . 230 GLY CA . 18428 1 1843 . 1 1 230 230 GLY N N 15 110.395 0.015 . 1 . 538 . . 230 GLY N . 18428 1 1844 . 1 1 231 231 ALA H H 1 8.113 0.002 . 1 . 539 . . 231 ALA H . 18428 1 1845 . 1 1 231 231 ALA HA H 1 4.316 0.001 . 1 . 539 . . 231 ALA HA . 18428 1 1846 . 1 1 231 231 ALA HB1 H 1 1.335 0.001 . 1 . 539 . . 231 ALA HB1 . 18428 1 1847 . 1 1 231 231 ALA HB2 H 1 1.335 0.001 . 1 . 539 . . 231 ALA HB2 . 18428 1 1848 . 1 1 231 231 ALA HB3 H 1 1.335 0.001 . 1 . 539 . . 231 ALA HB3 . 18428 1 1849 . 1 1 231 231 ALA C C 13 178.146 0.003 . 1 . 539 . . 231 ALA C . 18428 1 1850 . 1 1 231 231 ALA CA C 13 52.598 0.013 . 1 . 539 . . 231 ALA CA . 18428 1 1851 . 1 1 231 231 ALA CB C 13 19.215 0.052 . 1 . 539 . . 231 ALA CB . 18428 1 1852 . 1 1 231 231 ALA N N 15 123.695 0.034 . 1 . 539 . . 231 ALA N . 18428 1 1853 . 1 1 232 232 THR H H 1 8.092 0.003 . 1 . 540 . . 232 THR H . 18428 1 1854 . 1 1 232 232 THR HA H 1 4.278 0.001 . 1 . 540 . . 232 THR HA . 18428 1 1855 . 1 1 232 232 THR HB H 1 4.170 0.001 . 1 . 540 . . 232 THR HB . 18428 1 1856 . 1 1 232 232 THR C C 13 175.201 0.023 . 1 . 540 . . 232 THR C . 18428 1 1857 . 1 1 232 232 THR CA C 13 61.925 0.021 . 1 . 540 . . 232 THR CA . 18428 1 1858 . 1 1 232 232 THR CB C 13 69.781 0.014 . 1 . 540 . . 232 THR CB . 18428 1 1859 . 1 1 232 232 THR N N 15 112.274 0.006 . 1 . 540 . . 232 THR N . 18428 1 1860 . 1 1 233 233 GLY H H 1 8.271 0.002 . 1 . 541 . . 233 GLY H . 18428 1 1861 . 1 1 233 233 GLY HA2 H 1 3.879 0.001 . 2 . 541 . . 233 GLY HA2 . 18428 1 1862 . 1 1 233 233 GLY C C 13 173.869 0.008 . 1 . 541 . . 233 GLY C . 18428 1 1863 . 1 1 233 233 GLY CA C 13 45.248 0.009 . 1 . 541 . . 233 GLY CA . 18428 1 1864 . 1 1 233 233 GLY N N 15 110.823 0.034 . 1 . 541 . . 233 GLY N . 18428 1 1865 . 1 1 234 234 LYS H H 1 8.057 0.002 . 1 . 542 . . 234 LYS H . 18428 1 1866 . 1 1 234 234 LYS HA H 1 4.216 0.001 . 1 . 542 . . 234 LYS HA . 18428 1 1867 . 1 1 234 234 LYS HB2 H 1 1.625 0.001 . 2 . 542 . . 234 LYS HB2 . 18428 1 1868 . 1 1 234 234 LYS HB3 H 1 1.731 0.001 . 2 . 542 . . 234 LYS HB3 . 18428 1 1869 . 1 1 234 234 LYS C C 13 176.436 0.022 . 1 . 542 . . 234 LYS C . 18428 1 1870 . 1 1 234 234 LYS CA C 13 56.062 0.0 . 1 . 542 . . 234 LYS CA . 18428 1 1871 . 1 1 234 234 LYS CB C 13 33.063 0.031 . 1 . 542 . . 234 LYS CB . 18428 1 1872 . 1 1 234 234 LYS N N 15 120.863 0.023 . 1 . 542 . . 234 LYS N . 18428 1 1873 . 1 1 235 235 LYS H H 1 8.249 0.003 . 1 . 543 . . 235 LYS H . 18428 1 1874 . 1 1 235 235 LYS HA H 1 4.196 0.001 . 1 . 543 . . 235 LYS HA . 18428 1 1875 . 1 1 235 235 LYS HB2 H 1 1.705 0.001 . 2 . 543 . . 235 LYS HB2 . 18428 1 1876 . 1 1 235 235 LYS HB3 H 1 1.660 0.001 . 2 . 543 . . 235 LYS HB3 . 18428 1 1877 . 1 1 235 235 LYS C C 13 176.044 0.015 . 1 . 543 . . 235 LYS C . 18428 1 1878 . 1 1 235 235 LYS CA C 13 56.221 0.012 . 1 . 543 . . 235 LYS CA . 18428 1 1879 . 1 1 235 235 LYS CB C 13 33.057 0.068 . 1 . 543 . . 235 LYS CB . 18428 1 1880 . 1 1 235 235 LYS N N 15 123.088 0.01 . 1 . 543 . . 235 LYS N . 18428 1 1881 . 1 1 236 236 LYS H H 1 8.271 0.002 . 1 . 544 . . 236 LYS H . 18428 1 1882 . 1 1 236 236 LYS HA H 1 4.224 0.001 . 1 . 544 . . 236 LYS HA . 18428 1 1883 . 1 1 236 236 LYS HB2 H 1 1.647 0.001 . 2 . 544 . . 236 LYS HB2 . 18428 1 1884 . 1 1 236 236 LYS HB3 H 1 1.756 0.001 . 2 . 544 . . 236 LYS HB3 . 18428 1 1885 . 1 1 236 236 LYS C C 13 175.238 0.005 . 1 . 544 . . 236 LYS C . 18428 1 1886 . 1 1 236 236 LYS CA C 13 56.232 0.001 . 1 . 544 . . 236 LYS CA . 18428 1 1887 . 1 1 236 236 LYS CB C 13 32.960 0.001 . 1 . 544 . . 236 LYS CB . 18428 1 1888 . 1 1 236 236 LYS N N 15 124.126 0.005 . 1 . 544 . . 236 LYS N . 18428 1 1889 . 1 1 237 237 LEU H H 1 7.850 0.002 . 1 . 545 . . 237 LEU H . 18428 1 1890 . 1 1 237 237 LEU HA H 1 4.102 0.001 . 1 . 545 . . 237 LEU HA . 18428 1 1891 . 1 1 237 237 LEU HB2 H 1 1.496 0.001 . 2 . 545 . . 237 LEU HB2 . 18428 1 1892 . 1 1 237 237 LEU C C 13 170.290 0.01 . 1 . 545 . . 237 LEU C . 18428 1 1893 . 1 1 237 237 LEU CA C 13 56.573 0.001 . 1 . 545 . . 237 LEU CA . 18428 1 1894 . 1 1 237 237 LEU CB C 13 43.259 0.001 . 1 . 545 . . 237 LEU CB . 18428 1 1895 . 1 1 237 237 LEU N N 15 130.031 0.007 . 1 . 545 . . 237 LEU N . 18428 1 stop_ save_