data_34050 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34050 _Entry.Title ; Structure of a Spumaretrovirus Gag central domain reveals an ancient retroviral capsid ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-10-07 _Entry.Accession_date 2016-10-07 _Entry.Last_release_date 2016-10-24 _Entry.Original_release_date 2016-10-24 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _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.ORCID _Entry_author.Entry_ID 1 I. Taylor I. A. . . 34050 2 G. Nicastro G. . . . 34050 3 N. Ball N. . . . 34050 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'FOAMY VIRUS' . 34050 GAG . 34050 'VIRAL PROTEIN' . 34050 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34050 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 183 34050 '1H chemical shifts' 1143 34050 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 . . 2016-10-24 . original BMRB . 34050 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5M1H 'BMRB Entry Tracking System' 34050 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34050 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1371/journal.ppat.1003376 _Citation.PubMed_ID 23675305 _Citation.Full_citation . _Citation.Title ; A unique spumavirus Gag N-terminal domain with functional properties of orthoretroviral matrix and capsid. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'PLoS Pathog.' _Citation.Journal_name_full . _Citation.Journal_volume 9 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1553-7374 _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 e1003376 _Citation.Page_last e1003376 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 D. Goldstone D. C. . . 34050 1 2 T. Flower T. G. . . 34050 1 3 N. Ball N. J. . . 34050 1 4 M. Sanz-Ramos M. . . . 34050 1 5 M. Yap M. W. . . 34050 1 6 R. Ogrodowicz R. W. . . 34050 1 7 N. Stanke N. . . . 34050 1 8 J. Reh J. . . . 34050 1 9 D. Lindemann D. . . . 34050 1 10 J. Stoye J. P. . . 34050 1 11 I. Taylor I. A. . . 34050 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34050 _Assembly.ID 1 _Assembly.Name 'Gag protein' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 entity_1 1 $entity_1 A A yes . . . . . . 34050 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34050 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; PIGTVIPIQHIRSVTGEPPR NPREIPIWLGRNAPAIDGVF PVTTPDLRCRIINAILGGNI GLSLTPGDCLTWDSAVATLF IRTHGTFPMHQLGNVIKGIV DQEGVATAYTLGMMLSGQNY QLVSGIIRGYLPGQAVVTAL QQRLDQEIDDQTRAETFIQH LNAVYEILGLNARGQSIRLE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 180 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19604.459 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID Pr71Gag na 34050 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 1 300 PRO . 34050 1 2 301 ILE . 34050 1 3 302 GLY . 34050 1 4 303 THR . 34050 1 5 304 VAL . 34050 1 6 305 ILE . 34050 1 7 306 PRO . 34050 1 8 307 ILE . 34050 1 9 308 GLN . 34050 1 10 309 HIS . 34050 1 11 310 ILE . 34050 1 12 311 ARG . 34050 1 13 312 SER . 34050 1 14 313 VAL . 34050 1 15 314 THR . 34050 1 16 315 GLY . 34050 1 17 316 GLU . 34050 1 18 317 PRO . 34050 1 19 318 PRO . 34050 1 20 319 ARG . 34050 1 21 320 ASN . 34050 1 22 321 PRO . 34050 1 23 322 ARG . 34050 1 24 323 GLU . 34050 1 25 324 ILE . 34050 1 26 325 PRO . 34050 1 27 326 ILE . 34050 1 28 327 TRP . 34050 1 29 328 LEU . 34050 1 30 329 GLY . 34050 1 31 330 ARG . 34050 1 32 331 ASN . 34050 1 33 332 ALA . 34050 1 34 333 PRO . 34050 1 35 334 ALA . 34050 1 36 335 ILE . 34050 1 37 336 ASP . 34050 1 38 337 GLY . 34050 1 39 338 VAL . 34050 1 40 339 PHE . 34050 1 41 340 PRO . 34050 1 42 341 VAL . 34050 1 43 342 THR . 34050 1 44 343 THR . 34050 1 45 344 PRO . 34050 1 46 345 ASP . 34050 1 47 346 LEU . 34050 1 48 347 ARG . 34050 1 49 348 CYS . 34050 1 50 349 ARG . 34050 1 51 350 ILE . 34050 1 52 351 ILE . 34050 1 53 352 ASN . 34050 1 54 353 ALA . 34050 1 55 354 ILE . 34050 1 56 355 LEU . 34050 1 57 356 GLY . 34050 1 58 357 GLY . 34050 1 59 358 ASN . 34050 1 60 359 ILE . 34050 1 61 360 GLY . 34050 1 62 361 LEU . 34050 1 63 362 SER . 34050 1 64 363 LEU . 34050 1 65 364 THR . 34050 1 66 365 PRO . 34050 1 67 366 GLY . 34050 1 68 367 ASP . 34050 1 69 368 CYS . 34050 1 70 369 LEU . 34050 1 71 370 THR . 34050 1 72 371 TRP . 34050 1 73 372 ASP . 34050 1 74 373 SER . 34050 1 75 374 ALA . 34050 1 76 375 VAL . 34050 1 77 376 ALA . 34050 1 78 377 THR . 34050 1 79 378 LEU . 34050 1 80 379 PHE . 34050 1 81 380 ILE . 34050 1 82 381 ARG . 34050 1 83 382 THR . 34050 1 84 383 HIS . 34050 1 85 384 GLY . 34050 1 86 385 THR . 34050 1 87 386 PHE . 34050 1 88 387 PRO . 34050 1 89 388 MET . 34050 1 90 389 HIS . 34050 1 91 390 GLN . 34050 1 92 391 LEU . 34050 1 93 392 GLY . 34050 1 94 393 ASN . 34050 1 95 394 VAL . 34050 1 96 395 ILE . 34050 1 97 396 LYS . 34050 1 98 397 GLY . 34050 1 99 398 ILE . 34050 1 100 399 VAL . 34050 1 101 400 ASP . 34050 1 102 401 GLN . 34050 1 103 402 GLU . 34050 1 104 403 GLY . 34050 1 105 404 VAL . 34050 1 106 405 ALA . 34050 1 107 406 THR . 34050 1 108 407 ALA . 34050 1 109 408 TYR . 34050 1 110 409 THR . 34050 1 111 410 LEU . 34050 1 112 411 GLY . 34050 1 113 412 MET . 34050 1 114 413 MET . 34050 1 115 414 LEU . 34050 1 116 415 SER . 34050 1 117 416 GLY . 34050 1 118 417 GLN . 34050 1 119 418 ASN . 34050 1 120 419 TYR . 34050 1 121 420 GLN . 34050 1 122 421 LEU . 34050 1 123 422 VAL . 34050 1 124 423 SER . 34050 1 125 424 GLY . 34050 1 126 425 ILE . 34050 1 127 426 ILE . 34050 1 128 427 ARG . 34050 1 129 428 GLY . 34050 1 130 429 TYR . 34050 1 131 430 LEU . 34050 1 132 431 PRO . 34050 1 133 432 GLY . 34050 1 134 433 GLN . 34050 1 135 434 ALA . 34050 1 136 435 VAL . 34050 1 137 436 VAL . 34050 1 138 437 THR . 34050 1 139 438 ALA . 34050 1 140 439 LEU . 34050 1 141 440 GLN . 34050 1 142 441 GLN . 34050 1 143 442 ARG . 34050 1 144 443 LEU . 34050 1 145 444 ASP . 34050 1 146 445 GLN . 34050 1 147 446 GLU . 34050 1 148 447 ILE . 34050 1 149 448 ASP . 34050 1 150 449 ASP . 34050 1 151 450 GLN . 34050 1 152 451 THR . 34050 1 153 452 ARG . 34050 1 154 453 ALA . 34050 1 155 454 GLU . 34050 1 156 455 THR . 34050 1 157 456 PHE . 34050 1 158 457 ILE . 34050 1 159 458 GLN . 34050 1 160 459 HIS . 34050 1 161 460 LEU . 34050 1 162 461 ASN . 34050 1 163 462 ALA . 34050 1 164 463 VAL . 34050 1 165 464 TYR . 34050 1 166 465 GLU . 34050 1 167 466 ILE . 34050 1 168 467 LEU . 34050 1 169 468 GLY . 34050 1 170 469 LEU . 34050 1 171 470 ASN . 34050 1 172 471 ALA . 34050 1 173 472 ARG . 34050 1 174 473 GLY . 34050 1 175 474 GLN . 34050 1 176 475 SER . 34050 1 177 476 ILE . 34050 1 178 477 ARG . 34050 1 179 478 LEU . 34050 1 180 479 GLU . 34050 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 . PRO 1 1 34050 1 . ILE 2 2 34050 1 . GLY 3 3 34050 1 . THR 4 4 34050 1 . VAL 5 5 34050 1 . ILE 6 6 34050 1 . PRO 7 7 34050 1 . ILE 8 8 34050 1 . GLN 9 9 34050 1 . HIS 10 10 34050 1 . ILE 11 11 34050 1 . ARG 12 12 34050 1 . SER 13 13 34050 1 . VAL 14 14 34050 1 . THR 15 15 34050 1 . GLY 16 16 34050 1 . GLU 17 17 34050 1 . PRO 18 18 34050 1 . PRO 19 19 34050 1 . ARG 20 20 34050 1 . ASN 21 21 34050 1 . PRO 22 22 34050 1 . ARG 23 23 34050 1 . GLU 24 24 34050 1 . ILE 25 25 34050 1 . PRO 26 26 34050 1 . ILE 27 27 34050 1 . TRP 28 28 34050 1 . LEU 29 29 34050 1 . GLY 30 30 34050 1 . ARG 31 31 34050 1 . ASN 32 32 34050 1 . ALA 33 33 34050 1 . PRO 34 34 34050 1 . ALA 35 35 34050 1 . ILE 36 36 34050 1 . ASP 37 37 34050 1 . GLY 38 38 34050 1 . VAL 39 39 34050 1 . PHE 40 40 34050 1 . PRO 41 41 34050 1 . VAL 42 42 34050 1 . THR 43 43 34050 1 . THR 44 44 34050 1 . PRO 45 45 34050 1 . ASP 46 46 34050 1 . LEU 47 47 34050 1 . ARG 48 48 34050 1 . CYS 49 49 34050 1 . ARG 50 50 34050 1 . ILE 51 51 34050 1 . ILE 52 52 34050 1 . ASN 53 53 34050 1 . ALA 54 54 34050 1 . ILE 55 55 34050 1 . LEU 56 56 34050 1 . GLY 57 57 34050 1 . GLY 58 58 34050 1 . ASN 59 59 34050 1 . ILE 60 60 34050 1 . GLY 61 61 34050 1 . LEU 62 62 34050 1 . SER 63 63 34050 1 . LEU 64 64 34050 1 . THR 65 65 34050 1 . PRO 66 66 34050 1 . GLY 67 67 34050 1 . ASP 68 68 34050 1 . CYS 69 69 34050 1 . LEU 70 70 34050 1 . THR 71 71 34050 1 . TRP 72 72 34050 1 . ASP 73 73 34050 1 . SER 74 74 34050 1 . ALA 75 75 34050 1 . VAL 76 76 34050 1 . ALA 77 77 34050 1 . THR 78 78 34050 1 . LEU 79 79 34050 1 . PHE 80 80 34050 1 . ILE 81 81 34050 1 . ARG 82 82 34050 1 . THR 83 83 34050 1 . HIS 84 84 34050 1 . GLY 85 85 34050 1 . THR 86 86 34050 1 . PHE 87 87 34050 1 . PRO 88 88 34050 1 . MET 89 89 34050 1 . HIS 90 90 34050 1 . GLN 91 91 34050 1 . LEU 92 92 34050 1 . GLY 93 93 34050 1 . ASN 94 94 34050 1 . VAL 95 95 34050 1 . ILE 96 96 34050 1 . LYS 97 97 34050 1 . GLY 98 98 34050 1 . ILE 99 99 34050 1 . VAL 100 100 34050 1 . ASP 101 101 34050 1 . GLN 102 102 34050 1 . GLU 103 103 34050 1 . GLY 104 104 34050 1 . VAL 105 105 34050 1 . ALA 106 106 34050 1 . THR 107 107 34050 1 . ALA 108 108 34050 1 . TYR 109 109 34050 1 . THR 110 110 34050 1 . LEU 111 111 34050 1 . GLY 112 112 34050 1 . MET 113 113 34050 1 . MET 114 114 34050 1 . LEU 115 115 34050 1 . SER 116 116 34050 1 . GLY 117 117 34050 1 . GLN 118 118 34050 1 . ASN 119 119 34050 1 . TYR 120 120 34050 1 . GLN 121 121 34050 1 . LEU 122 122 34050 1 . VAL 123 123 34050 1 . SER 124 124 34050 1 . GLY 125 125 34050 1 . ILE 126 126 34050 1 . ILE 127 127 34050 1 . ARG 128 128 34050 1 . GLY 129 129 34050 1 . TYR 130 130 34050 1 . LEU 131 131 34050 1 . PRO 132 132 34050 1 . GLY 133 133 34050 1 . GLN 134 134 34050 1 . ALA 135 135 34050 1 . VAL 136 136 34050 1 . VAL 137 137 34050 1 . THR 138 138 34050 1 . ALA 139 139 34050 1 . LEU 140 140 34050 1 . GLN 141 141 34050 1 . GLN 142 142 34050 1 . ARG 143 143 34050 1 . LEU 144 144 34050 1 . ASP 145 145 34050 1 . GLN 146 146 34050 1 . GLU 147 147 34050 1 . ILE 148 148 34050 1 . ASP 149 149 34050 1 . ASP 150 150 34050 1 . GLN 151 151 34050 1 . THR 152 152 34050 1 . ARG 153 153 34050 1 . ALA 154 154 34050 1 . GLU 155 155 34050 1 . THR 156 156 34050 1 . PHE 157 157 34050 1 . ILE 158 158 34050 1 . GLN 159 159 34050 1 . HIS 160 160 34050 1 . LEU 161 161 34050 1 . ASN 162 162 34050 1 . ALA 163 163 34050 1 . VAL 164 164 34050 1 . TYR 165 165 34050 1 . GLU 166 166 34050 1 . ILE 167 167 34050 1 . LEU 168 168 34050 1 . GLY 169 169 34050 1 . LEU 170 170 34050 1 . ASN 171 171 34050 1 . ALA 172 172 34050 1 . ARG 173 173 34050 1 . GLY 174 174 34050 1 . GLN 175 175 34050 1 . SER 176 176 34050 1 . ILE 177 177 34050 1 . ARG 178 178 34050 1 . LEU 179 179 34050 1 . GLU 180 180 34050 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 34050 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 11963 organism . 'Human spumaretrovirus' SFVcpz(hu) . . Viruses . Human spumaretrovirus . . . . . . . . . . . gag . 34050 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 34050 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 . . . 'Rosetta 2' . Plasmid . . PET47B . . . 34050 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34050 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.3 mM [U-13C; U-15N] protein, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.3 . . mM . . . . 34050 1 2 NaCl 'natural abundance' . . . . . . 20 . . mM . . . . 34050 1 3 Tris 'natural abundance' . . . . . . 20 . . mM . . . . 34050 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 34050 _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' 40 . mM 34050 1 pH 7.0 . pH 34050 1 pressure 1 . Pa 34050 1 temperature 298 . K 34050 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34050 _Software.ID 1 _Software.Name ARIA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 34050 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 34050 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34050 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 34050 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 34050 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34050 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34050 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 34050 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_4 _NMR_spectrometer.Entry_ID 34050 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 6 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 34050 _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 NMR_spectrometer_1 Bruker Avance . 950 . . . 34050 1 2 NMR_spectrometer_2 Bruker Avance . 800 . . . 34050 1 3 NMR_spectrometer_3 Bruker Avance . 700 . . . 34050 1 4 NMR_spectrometer_4 Bruker Avance . 6 . . . 34050 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 34050 _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 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34050 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34050 1 3 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34050 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34050 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 water protons . . . . ppm 4.78 internal direct 1.0 . . . . . 34050 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34050 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-13C NOESY' . . . 34050 1 2 '3D 1H-15N NOESY' . . . 34050 1 3 '3D 1H-13C NOESY aromatic' . . . 34050 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 ILE HA H 1 4.185 0.000 . . . . . A 301 ILE HA . 34050 1 2 . 1 1 3 3 GLY H H 1 8.507 0.000 . . . . . A 302 GLY H . 34050 1 3 . 1 1 3 3 GLY HA2 H 1 3.940 0.000 . . . . . A 302 GLY HA2 . 34050 1 4 . 1 1 3 3 GLY HA3 H 1 4.031 0.006 . . . . . A 302 GLY HA3 . 34050 1 5 . 1 1 3 3 GLY N N 15 113.107 0.000 . . . . . A 302 GLY N . 34050 1 6 . 1 1 4 4 THR H H 1 8.102 0.001 . . . . . A 303 THR H . 34050 1 7 . 1 1 4 4 THR HA H 1 4.272 0.000 . . . . . A 303 THR HA . 34050 1 8 . 1 1 4 4 THR HB H 1 4.079 0.000 . . . . . A 303 THR HB . 34050 1 9 . 1 1 4 4 THR HG21 H 1 1.229 0.000 . . . . . A 303 THR HG21 . 34050 1 10 . 1 1 4 4 THR HG22 H 1 1.229 0.000 . . . . . A 303 THR HG22 . 34050 1 11 . 1 1 4 4 THR HG23 H 1 1.229 0.000 . . . . . A 303 THR HG23 . 34050 1 12 . 1 1 4 4 THR N N 15 115.638 0.000 . . . . . A 303 THR N . 34050 1 13 . 1 1 5 5 VAL H H 1 8.307 0.001 . . . . . A 304 VAL H . 34050 1 14 . 1 1 5 5 VAL HA H 1 4.039 0.000 . . . . . A 304 VAL HA . 34050 1 15 . 1 1 5 5 VAL HB H 1 1.984 0.000 . . . . . A 304 VAL HB . 34050 1 16 . 1 1 5 5 VAL HG11 H 1 0.928 0.000 . . . . . A 304 VAL HG11 . 34050 1 17 . 1 1 5 5 VAL HG12 H 1 0.928 0.000 . . . . . A 304 VAL HG12 . 34050 1 18 . 1 1 5 5 VAL HG13 H 1 0.928 0.000 . . . . . A 304 VAL HG13 . 34050 1 19 . 1 1 5 5 VAL HG21 H 1 0.843 0.000 . . . . . A 304 VAL HG21 . 34050 1 20 . 1 1 5 5 VAL HG22 H 1 0.843 0.000 . . . . . A 304 VAL HG22 . 34050 1 21 . 1 1 5 5 VAL HG23 H 1 0.843 0.000 . . . . . A 304 VAL HG23 . 34050 1 22 . 1 1 5 5 VAL N N 15 125.199 0.000 . . . . . A 304 VAL N . 34050 1 23 . 1 1 6 6 ILE H H 1 8.351 0.001 . . . . . A 305 ILE H . 34050 1 24 . 1 1 6 6 ILE HA H 1 3.871 0.000 . . . . . A 305 ILE HA . 34050 1 25 . 1 1 6 6 ILE HB H 1 1.587 0.000 . . . . . A 305 ILE HB . 34050 1 26 . 1 1 6 6 ILE HG12 H 1 1.503 0.000 . . . . . A 305 ILE HG12 . 34050 1 27 . 1 1 6 6 ILE HG13 H 1 0.918 0.000 . . . . . A 305 ILE HG13 . 34050 1 28 . 1 1 6 6 ILE HG21 H 1 0.448 0.001 . . . . . A 305 ILE HG21 . 34050 1 29 . 1 1 6 6 ILE HG22 H 1 0.448 0.001 . . . . . A 305 ILE HG22 . 34050 1 30 . 1 1 6 6 ILE HG23 H 1 0.448 0.001 . . . . . A 305 ILE HG23 . 34050 1 31 . 1 1 6 6 ILE HD11 H 1 0.709 0.000 . . . . . A 305 ILE HD11 . 34050 1 32 . 1 1 6 6 ILE HD12 H 1 0.709 0.000 . . . . . A 305 ILE HD12 . 34050 1 33 . 1 1 6 6 ILE HD13 H 1 0.709 0.000 . . . . . A 305 ILE HD13 . 34050 1 34 . 1 1 6 6 ILE N N 15 126.043 0.000 . . . . . A 305 ILE N . 34050 1 35 . 1 1 7 7 PRO HB2 H 1 2.368 0.000 . . . . . A 306 PRO HB2 . 34050 1 36 . 1 1 7 7 PRO HB3 H 1 1.875 0.000 . . . . . A 306 PRO HB3 . 34050 1 37 . 1 1 7 7 PRO HD2 H 1 3.404 0.000 . . . . . A 306 PRO HD2 . 34050 1 38 . 1 1 7 7 PRO HD3 H 1 2.505 0.000 . . . . . A 306 PRO HD3 . 34050 1 39 . 1 1 8 8 ILE H H 1 8.196 0.001 . . . . . A 307 ILE H . 34050 1 40 . 1 1 8 8 ILE HA H 1 3.725 0.003 . . . . . A 307 ILE HA . 34050 1 41 . 1 1 8 8 ILE HB H 1 1.736 0.000 . . . . . A 307 ILE HB . 34050 1 42 . 1 1 8 8 ILE HG12 H 1 1.355 0.000 . . . . . A 307 ILE HG12 . 34050 1 43 . 1 1 8 8 ILE HG13 H 1 1.291 0.000 . . . . . A 307 ILE HG13 . 34050 1 44 . 1 1 8 8 ILE HG21 H 1 0.905 0.000 . . . . . A 307 ILE HG21 . 34050 1 45 . 1 1 8 8 ILE HG22 H 1 0.905 0.000 . . . . . A 307 ILE HG22 . 34050 1 46 . 1 1 8 8 ILE HG23 H 1 0.905 0.000 . . . . . A 307 ILE HG23 . 34050 1 47 . 1 1 8 8 ILE HD11 H 1 0.808 0.000 . . . . . A 307 ILE HD11 . 34050 1 48 . 1 1 8 8 ILE HD12 H 1 0.808 0.000 . . . . . A 307 ILE HD12 . 34050 1 49 . 1 1 8 8 ILE HD13 H 1 0.808 0.000 . . . . . A 307 ILE HD13 . 34050 1 50 . 1 1 8 8 ILE N N 15 124.918 0.000 . . . . . A 307 ILE N . 34050 1 51 . 1 1 9 9 GLN H H 1 8.667 0.002 . . . . . A 308 GLN H . 34050 1 52 . 1 1 9 9 GLN HA H 1 4.047 0.001 . . . . . A 308 GLN HA . 34050 1 53 . 1 1 9 9 GLN HB2 H 1 2.078 0.000 . . . . . A 308 GLN HB2 . 34050 1 54 . 1 1 9 9 GLN HB3 H 1 2.015 0.007 . . . . . A 308 GLN HB3 . 34050 1 55 . 1 1 9 9 GLN HG2 H 1 2.410 0.004 . . . . . A 308 GLN HG2 . 34050 1 56 . 1 1 9 9 GLN HG3 H 1 2.351 0.005 . . . . . A 308 GLN HG3 . 34050 1 57 . 1 1 9 9 GLN HE21 H 1 7.498 0.002 . . . . . A 308 GLN HE21 . 34050 1 58 . 1 1 9 9 GLN HE22 H 1 6.895 0.001 . . . . . A 308 GLN HE22 . 34050 1 59 . 1 1 9 9 GLN N N 15 120.981 0.000 . . . . . A 308 GLN N . 34050 1 60 . 1 1 9 9 GLN NE2 N 15 112.263 0.000 . . . . . A 308 GLN NE2 . 34050 1 61 . 1 1 10 10 HIS H H 1 7.895 0.002 . . . . . A 309 HIS H . 34050 1 62 . 1 1 10 10 HIS HA H 1 4.547 0.000 . . . . . A 309 HIS HA . 34050 1 63 . 1 1 10 10 HIS HB2 H 1 3.233 0.003 . . . . . A 309 HIS HB2 . 34050 1 64 . 1 1 10 10 HIS HB3 H 1 3.175 0.000 . . . . . A 309 HIS HB3 . 34050 1 65 . 1 1 10 10 HIS N N 15 120.700 0.000 . . . . . A 309 HIS N . 34050 1 66 . 1 1 11 11 ILE H H 1 8.141 0.002 . . . . . A 310 ILE H . 34050 1 67 . 1 1 11 11 ILE HA H 1 3.461 0.000 . . . . . A 310 ILE HA . 34050 1 68 . 1 1 11 11 ILE HB H 1 1.876 0.000 . . . . . A 310 ILE HB . 34050 1 69 . 1 1 11 11 ILE HG12 H 1 1.786 0.000 . . . . . A 310 ILE HG12 . 34050 1 70 . 1 1 11 11 ILE HG13 H 1 0.904 0.000 . . . . . A 310 ILE HG13 . 34050 1 71 . 1 1 11 11 ILE HG21 H 1 0.828 0.000 . . . . . A 310 ILE HG21 . 34050 1 72 . 1 1 11 11 ILE HG22 H 1 0.828 0.000 . . . . . A 310 ILE HG22 . 34050 1 73 . 1 1 11 11 ILE HG23 H 1 0.828 0.000 . . . . . A 310 ILE HG23 . 34050 1 74 . 1 1 11 11 ILE HD11 H 1 0.654 0.000 . . . . . A 310 ILE HD11 . 34050 1 75 . 1 1 11 11 ILE HD12 H 1 0.654 0.000 . . . . . A 310 ILE HD12 . 34050 1 76 . 1 1 11 11 ILE HD13 H 1 0.654 0.000 . . . . . A 310 ILE HD13 . 34050 1 77 . 1 1 11 11 ILE N N 15 119.294 0.000 . . . . . A 310 ILE N . 34050 1 78 . 1 1 12 12 ARG H H 1 8.621 0.002 . . . . . A 311 ARG H . 34050 1 79 . 1 1 12 12 ARG HA H 1 4.341 0.000 . . . . . A 311 ARG HA . 34050 1 80 . 1 1 12 12 ARG HB2 H 1 1.879 0.000 . . . . . A 311 ARG HB2 . 34050 1 81 . 1 1 12 12 ARG HB3 H 1 1.829 0.000 . . . . . A 311 ARG HB3 . 34050 1 82 . 1 1 12 12 ARG HG2 H 1 1.750 0.000 . . . . . A 311 ARG HG2 . 34050 1 83 . 1 1 12 12 ARG HG3 H 1 1.618 0.000 . . . . . A 311 ARG HG3 . 34050 1 84 . 1 1 12 12 ARG HD2 H 1 3.142 0.000 . . . . . A 311 ARG HD2 . 34050 1 85 . 1 1 12 12 ARG HD3 H 1 3.142 0.000 . . . . . A 311 ARG HD3 . 34050 1 86 . 1 1 12 12 ARG N N 15 118.731 0.000 . . . . . A 311 ARG N . 34050 1 87 . 1 1 13 13 SER H H 1 7.932 0.000 . . . . . A 312 SER H . 34050 1 88 . 1 1 13 13 SER HA H 1 4.244 0.000 . . . . . A 312 SER HA . 34050 1 89 . 1 1 13 13 SER HB2 H 1 4.052 0.000 . . . . . A 312 SER HB2 . 34050 1 90 . 1 1 13 13 SER HB3 H 1 4.052 0.000 . . . . . A 312 SER HB3 . 34050 1 91 . 1 1 13 13 SER N N 15 115.919 0.000 . . . . . A 312 SER N . 34050 1 92 . 1 1 14 14 VAL H H 1 7.512 0.002 . . . . . A 313 VAL H . 34050 1 93 . 1 1 14 14 VAL HA H 1 4.068 0.000 . . . . . A 313 VAL HA . 34050 1 94 . 1 1 14 14 VAL HB H 1 2.165 0.000 . . . . . A 313 VAL HB . 34050 1 95 . 1 1 14 14 VAL HG11 H 1 0.890 0.000 . . . . . A 313 VAL HG11 . 34050 1 96 . 1 1 14 14 VAL HG12 H 1 0.890 0.000 . . . . . A 313 VAL HG12 . 34050 1 97 . 1 1 14 14 VAL HG13 H 1 0.890 0.000 . . . . . A 313 VAL HG13 . 34050 1 98 . 1 1 14 14 VAL HG21 H 1 0.818 0.000 . . . . . A 313 VAL HG21 . 34050 1 99 . 1 1 14 14 VAL HG22 H 1 0.818 0.000 . . . . . A 313 VAL HG22 . 34050 1 100 . 1 1 14 14 VAL HG23 H 1 0.818 0.000 . . . . . A 313 VAL HG23 . 34050 1 101 . 1 1 14 14 VAL N N 15 119.013 0.000 . . . . . A 313 VAL N . 34050 1 102 . 1 1 15 15 THR H H 1 8.264 0.001 . . . . . A 314 THR H . 34050 1 103 . 1 1 15 15 THR HA H 1 3.956 0.000 . . . . . A 314 THR HA . 34050 1 104 . 1 1 15 15 THR HB H 1 4.070 0.000 . . . . . A 314 THR HB . 34050 1 105 . 1 1 15 15 THR HG21 H 1 0.811 0.000 . . . . . A 314 THR HG21 . 34050 1 106 . 1 1 15 15 THR HG22 H 1 0.811 0.000 . . . . . A 314 THR HG22 . 34050 1 107 . 1 1 15 15 THR HG23 H 1 0.811 0.000 . . . . . A 314 THR HG23 . 34050 1 108 . 1 1 15 15 THR N N 15 110.013 0.000 . . . . . A 314 THR N . 34050 1 109 . 1 1 16 16 GLY H H 1 8.070 0.001 . . . . . A 315 GLY H . 34050 1 110 . 1 1 16 16 GLY HA2 H 1 3.959 0.000 . . . . . A 315 GLY HA2 . 34050 1 111 . 1 1 16 16 GLY HA3 H 1 4.353 0.000 . . . . . A 315 GLY HA3 . 34050 1 112 . 1 1 16 16 GLY N N 15 110.013 0.000 . . . . . A 315 GLY N . 34050 1 113 . 1 1 17 17 GLU H H 1 8.549 0.001 . . . . . A 316 GLU H . 34050 1 114 . 1 1 17 17 GLU HA H 1 4.409 0.000 . . . . . A 316 GLU HA . 34050 1 115 . 1 1 17 17 GLU HB2 H 1 1.878 0.000 . . . . . A 316 GLU HB2 . 34050 1 116 . 1 1 17 17 GLU HB3 H 1 1.754 0.000 . . . . . A 316 GLU HB3 . 34050 1 117 . 1 1 17 17 GLU HG2 H 1 2.299 0.000 . . . . . A 316 GLU HG2 . 34050 1 118 . 1 1 17 17 GLU HG3 H 1 2.228 0.000 . . . . . A 316 GLU HG3 . 34050 1 119 . 1 1 17 17 GLU N N 15 119.294 0.000 . . . . . A 316 GLU N . 34050 1 120 . 1 1 18 18 PRO HD2 H 1 3.547 0.000 . . . . . A 317 PRO HD2 . 34050 1 121 . 1 1 18 18 PRO HD3 H 1 3.547 0.000 . . . . . A 317 PRO HD3 . 34050 1 122 . 1 1 19 19 PRO HD2 H 1 2.247 0.000 . . . . . A 318 PRO HD2 . 34050 1 123 . 1 1 20 20 ARG H H 1 8.009 0.000 . . . . . A 319 ARG H . 34050 1 124 . 1 1 20 20 ARG HA H 1 3.949 0.000 . . . . . A 319 ARG HA . 34050 1 125 . 1 1 20 20 ARG HB2 H 1 1.756 0.000 . . . . . A 319 ARG HB2 . 34050 1 126 . 1 1 20 20 ARG HB3 H 1 1.650 0.000 . . . . . A 319 ARG HB3 . 34050 1 127 . 1 1 20 20 ARG HG2 H 1 1.617 0.000 . . . . . A 319 ARG HG2 . 34050 1 128 . 1 1 20 20 ARG HD2 H 1 3.104 0.000 . . . . . A 319 ARG HD2 . 34050 1 129 . 1 1 20 20 ARG HD3 H 1 3.104 0.000 . . . . . A 319 ARG HD3 . 34050 1 130 . 1 1 20 20 ARG N N 15 118.450 0.000 . . . . . A 319 ARG N . 34050 1 131 . 1 1 21 21 ASN H H 1 7.595 0.001 . . . . . A 320 ASN H . 34050 1 132 . 1 1 21 21 ASN HB2 H 1 2.898 0.005 . . . . . A 320 ASN HB2 . 34050 1 133 . 1 1 21 21 ASN HB3 H 1 2.746 0.002 . . . . . A 320 ASN HB3 . 34050 1 134 . 1 1 21 21 ASN HD21 H 1 7.802 0.002 . . . . . A 320 ASN HD21 . 34050 1 135 . 1 1 21 21 ASN HD22 H 1 6.964 0.003 . . . . . A 320 ASN HD22 . 34050 1 136 . 1 1 21 21 ASN N N 15 118.169 0.000 . . . . . A 320 ASN N . 34050 1 137 . 1 1 21 21 ASN ND2 N 15 112.544 0.000 . . . . . A 320 ASN ND2 . 34050 1 138 . 1 1 22 22 PRO HA H 1 4.068 0.000 . . . . . A 321 PRO HA . 34050 1 139 . 1 1 22 22 PRO HB2 H 1 2.268 0.000 . . . . . A 321 PRO HB2 . 34050 1 140 . 1 1 22 22 PRO HB3 H 1 1.990 0.000 . . . . . A 321 PRO HB3 . 34050 1 141 . 1 1 22 22 PRO HG2 H 1 2.081 0.000 . . . . . A 321 PRO HG2 . 34050 1 142 . 1 1 22 22 PRO HD2 H 1 4.205 0.000 . . . . . A 321 PRO HD2 . 34050 1 143 . 1 1 22 22 PRO HD3 H 1 3.881 0.000 . . . . . A 321 PRO HD3 . 34050 1 144 . 1 1 23 23 ARG H H 1 7.648 0.001 . . . . . A 322 ARG H . 34050 1 145 . 1 1 23 23 ARG HA H 1 3.760 0.000 . . . . . A 322 ARG HA . 34050 1 146 . 1 1 23 23 ARG HB2 H 1 1.742 0.000 . . . . . A 322 ARG HB2 . 34050 1 147 . 1 1 23 23 ARG HB3 H 1 1.545 0.000 . . . . . A 322 ARG HB3 . 34050 1 148 . 1 1 23 23 ARG HG2 H 1 1.489 0.000 . . . . . A 322 ARG HG2 . 34050 1 149 . 1 1 23 23 ARG HG3 H 1 0.760 0.000 . . . . . A 322 ARG HG3 . 34050 1 150 . 1 1 23 23 ARG HD2 H 1 2.990 0.000 . . . . . A 322 ARG HD2 . 34050 1 151 . 1 1 23 23 ARG HD3 H 1 2.818 0.000 . . . . . A 322 ARG HD3 . 34050 1 152 . 1 1 23 23 ARG N N 15 112.263 0.000 . . . . . A 322 ARG N . 34050 1 153 . 1 1 24 24 GLU H H 1 7.896 0.002 . . . . . A 323 GLU H . 34050 1 154 . 1 1 24 24 GLU HA H 1 4.362 0.000 . . . . . A 323 GLU HA . 34050 1 155 . 1 1 24 24 GLU HB2 H 1 2.240 0.000 . . . . . A 323 GLU HB2 . 34050 1 156 . 1 1 24 24 GLU HB3 H 1 2.009 0.002 . . . . . A 323 GLU HB3 . 34050 1 157 . 1 1 24 24 GLU HG2 H 1 2.318 0.000 . . . . . A 323 GLU HG2 . 34050 1 158 . 1 1 24 24 GLU HG3 H 1 2.244 0.000 . . . . . A 323 GLU HG3 . 34050 1 159 . 1 1 24 24 GLU N N 15 116.200 0.000 . . . . . A 323 GLU N . 34050 1 160 . 1 1 25 25 ILE H H 1 7.620 0.001 . . . . . A 324 ILE H . 34050 1 161 . 1 1 25 25 ILE HA H 1 3.774 0.000 . . . . . A 324 ILE HA . 34050 1 162 . 1 1 25 25 ILE HG21 H 1 0.978 0.000 . . . . . A 324 ILE HG21 . 34050 1 163 . 1 1 25 25 ILE HG22 H 1 0.978 0.000 . . . . . A 324 ILE HG22 . 34050 1 164 . 1 1 25 25 ILE HG23 H 1 0.978 0.000 . . . . . A 324 ILE HG23 . 34050 1 165 . 1 1 25 25 ILE HD11 H 1 0.797 0.000 . . . . . A 324 ILE HD11 . 34050 1 166 . 1 1 25 25 ILE HD12 H 1 0.797 0.000 . . . . . A 324 ILE HD12 . 34050 1 167 . 1 1 25 25 ILE HD13 H 1 0.797 0.000 . . . . . A 324 ILE HD13 . 34050 1 168 . 1 1 25 25 ILE N N 15 120.419 0.000 . . . . . A 324 ILE N . 34050 1 169 . 1 1 26 26 PRO HD2 H 1 3.905 0.000 . . . . . A 325 PRO HD2 . 34050 1 170 . 1 1 26 26 PRO HD3 H 1 3.815 0.000 . . . . . A 325 PRO HD3 . 34050 1 171 . 1 1 27 27 ILE H H 1 7.238 0.002 . . . . . A 326 ILE H . 34050 1 172 . 1 1 27 27 ILE HA H 1 3.757 0.000 . . . . . A 326 ILE HA . 34050 1 173 . 1 1 27 27 ILE HB H 1 1.963 0.003 . . . . . A 326 ILE HB . 34050 1 174 . 1 1 27 27 ILE HG12 H 1 1.571 0.000 . . . . . A 326 ILE HG12 . 34050 1 175 . 1 1 27 27 ILE HG13 H 1 1.303 0.000 . . . . . A 326 ILE HG13 . 34050 1 176 . 1 1 27 27 ILE HG21 H 1 0.965 0.002 . . . . . A 326 ILE HG21 . 34050 1 177 . 1 1 27 27 ILE HG22 H 1 0.965 0.002 . . . . . A 326 ILE HG22 . 34050 1 178 . 1 1 27 27 ILE HG23 H 1 0.965 0.002 . . . . . A 326 ILE HG23 . 34050 1 179 . 1 1 27 27 ILE N N 15 114.794 0.000 . . . . . A 326 ILE N . 34050 1 180 . 1 1 28 28 TRP H H 1 7.880 0.001 . . . . . A 327 TRP H . 34050 1 181 . 1 1 28 28 TRP HA H 1 4.080 0.000 . . . . . A 327 TRP HA . 34050 1 182 . 1 1 28 28 TRP HB2 H 1 3.472 0.000 . . . . . A 327 TRP HB2 . 34050 1 183 . 1 1 28 28 TRP HB3 H 1 3.328 0.000 . . . . . A 327 TRP HB3 . 34050 1 184 . 1 1 28 28 TRP HD1 H 1 7.310 0.000 . . . . . A 327 TRP HD1 . 34050 1 185 . 1 1 28 28 TRP HE3 H 1 7.452 0.003 . . . . . A 327 TRP HE3 . 34050 1 186 . 1 1 28 28 TRP N N 15 122.106 0.000 . . . . . A 327 TRP N . 34050 1 187 . 1 1 29 29 LEU H H 1 9.144 0.001 . . . . . A 328 LEU H . 34050 1 188 . 1 1 29 29 LEU HA H 1 3.534 0.000 . . . . . A 328 LEU HA . 34050 1 189 . 1 1 29 29 LEU HB2 H 1 1.974 0.000 . . . . . A 328 LEU HB2 . 34050 1 190 . 1 1 29 29 LEU HB3 H 1 1.594 0.000 . . . . . A 328 LEU HB3 . 34050 1 191 . 1 1 29 29 LEU HG H 1 1.547 0.000 . . . . . A 328 LEU HG . 34050 1 192 . 1 1 29 29 LEU HD11 H 1 0.978 0.000 . . . . . A 328 LEU HD11 . 34050 1 193 . 1 1 29 29 LEU HD12 H 1 0.978 0.000 . . . . . A 328 LEU HD12 . 34050 1 194 . 1 1 29 29 LEU HD13 H 1 0.978 0.000 . . . . . A 328 LEU HD13 . 34050 1 195 . 1 1 29 29 LEU HD21 H 1 0.844 0.000 . . . . . A 328 LEU HD21 . 34050 1 196 . 1 1 29 29 LEU HD22 H 1 0.844 0.000 . . . . . A 328 LEU HD22 . 34050 1 197 . 1 1 29 29 LEU HD23 H 1 0.844 0.000 . . . . . A 328 LEU HD23 . 34050 1 198 . 1 1 29 29 LEU N N 15 120.700 0.000 . . . . . A 328 LEU N . 34050 1 199 . 1 1 30 30 GLY H H 1 8.196 0.000 . . . . . A 329 GLY H . 34050 1 200 . 1 1 30 30 GLY HA2 H 1 3.474 0.000 . . . . . A 329 GLY HA2 . 34050 1 201 . 1 1 30 30 GLY HA3 H 1 3.724 0.000 . . . . . A 329 GLY HA3 . 34050 1 202 . 1 1 30 30 GLY N N 15 104.952 0.000 . . . . . A 329 GLY N . 34050 1 203 . 1 1 31 31 ARG H H 1 8.065 0.001 . . . . . A 330 ARG H . 34050 1 204 . 1 1 31 31 ARG HA H 1 3.923 0.000 . . . . . A 330 ARG HA . 34050 1 205 . 1 1 31 31 ARG HB2 H 1 1.718 0.000 . . . . . A 330 ARG HB2 . 34050 1 206 . 1 1 31 31 ARG HB3 H 1 1.664 0.000 . . . . . A 330 ARG HB3 . 34050 1 207 . 1 1 31 31 ARG HG3 H 1 1.529 0.000 . . . . . A 330 ARG HG3 . 34050 1 208 . 1 1 31 31 ARG HD2 H 1 3.069 0.000 . . . . . A 330 ARG HD2 . 34050 1 209 . 1 1 31 31 ARG HD3 H 1 3.069 0.000 . . . . . A 330 ARG HD3 . 34050 1 210 . 1 1 31 31 ARG N N 15 118.169 0.000 . . . . . A 330 ARG N . 34050 1 211 . 1 1 32 32 ASN H H 1 7.192 0.001 . . . . . A 331 ASN H . 34050 1 212 . 1 1 32 32 ASN HA H 1 4.333 0.004 . . . . . A 331 ASN HA . 34050 1 213 . 1 1 32 32 ASN HB2 H 1 1.874 0.002 . . . . . A 331 ASN HB2 . 34050 1 214 . 1 1 32 32 ASN HB3 H 1 1.629 0.007 . . . . . A 331 ASN HB3 . 34050 1 215 . 1 1 32 32 ASN HD21 H 1 5.872 0.001 . . . . . A 331 ASN HD21 . 34050 1 216 . 1 1 32 32 ASN HD22 H 1 5.380 0.001 . . . . . A 331 ASN HD22 . 34050 1 217 . 1 1 32 32 ASN N N 15 114.513 0.000 . . . . . A 331 ASN N . 34050 1 218 . 1 1 32 32 ASN ND2 N 15 111.138 0.000 . . . . . A 331 ASN ND2 . 34050 1 219 . 1 1 33 33 ALA H H 1 7.373 0.001 . . . . . A 332 ALA H . 34050 1 220 . 1 1 33 33 ALA HA H 1 2.826 0.005 . . . . . A 332 ALA HA . 34050 1 221 . 1 1 33 33 ALA HB1 H 1 0.130 0.001 . . . . . A 332 ALA HB1 . 34050 1 222 . 1 1 33 33 ALA HB2 H 1 0.130 0.001 . . . . . A 332 ALA HB2 . 34050 1 223 . 1 1 33 33 ALA HB3 H 1 0.130 0.001 . . . . . A 332 ALA HB3 . 34050 1 224 . 1 1 33 33 ALA N N 15 125.199 0.000 . . . . . A 332 ALA N . 34050 1 225 . 1 1 34 34 PRO HA H 1 4.205 0.000 . . . . . A 333 PRO HA . 34050 1 226 . 1 1 34 34 PRO HB2 H 1 2.180 0.000 . . . . . A 333 PRO HB2 . 34050 1 227 . 1 1 34 34 PRO HB3 H 1 1.661 0.000 . . . . . A 333 PRO HB3 . 34050 1 228 . 1 1 34 34 PRO HG2 H 1 1.874 0.000 . . . . . A 333 PRO HG2 . 34050 1 229 . 1 1 34 34 PRO HG3 H 1 1.773 0.000 . . . . . A 333 PRO HG3 . 34050 1 230 . 1 1 34 34 PRO HD2 H 1 3.294 0.001 . . . . . A 333 PRO HD2 . 34050 1 231 . 1 1 34 34 PRO HD3 H 1 3.294 0.001 . . . . . A 333 PRO HD3 . 34050 1 232 . 1 1 35 35 ALA H H 1 6.962 0.002 . . . . . A 334 ALA H . 34050 1 233 . 1 1 35 35 ALA HA H 1 4.012 0.002 . . . . . A 334 ALA HA . 34050 1 234 . 1 1 35 35 ALA HB1 H 1 1.266 0.000 . . . . . A 334 ALA HB1 . 34050 1 235 . 1 1 35 35 ALA HB2 H 1 1.266 0.000 . . . . . A 334 ALA HB2 . 34050 1 236 . 1 1 35 35 ALA HB3 H 1 1.266 0.000 . . . . . A 334 ALA HB3 . 34050 1 237 . 1 1 35 35 ALA N N 15 120.419 0.000 . . . . . A 334 ALA N . 34050 1 238 . 1 1 36 36 ILE H H 1 7.728 0.002 . . . . . A 335 ILE H . 34050 1 239 . 1 1 36 36 ILE HA H 1 3.327 0.001 . . . . . A 335 ILE HA . 34050 1 240 . 1 1 36 36 ILE HB H 1 1.856 0.000 . . . . . A 335 ILE HB . 34050 1 241 . 1 1 36 36 ILE HG12 H 1 1.510 0.000 . . . . . A 335 ILE HG12 . 34050 1 242 . 1 1 36 36 ILE HG13 H 1 0.485 0.000 . . . . . A 335 ILE HG13 . 34050 1 243 . 1 1 36 36 ILE HG21 H 1 1.128 0.000 . . . . . A 335 ILE HG21 . 34050 1 244 . 1 1 36 36 ILE HG22 H 1 1.128 0.000 . . . . . A 335 ILE HG22 . 34050 1 245 . 1 1 36 36 ILE HG23 H 1 1.128 0.000 . . . . . A 335 ILE HG23 . 34050 1 246 . 1 1 36 36 ILE HD11 H 1 0.387 0.004 . . . . . A 335 ILE HD11 . 34050 1 247 . 1 1 36 36 ILE HD12 H 1 0.387 0.004 . . . . . A 335 ILE HD12 . 34050 1 248 . 1 1 36 36 ILE HD13 H 1 0.387 0.004 . . . . . A 335 ILE HD13 . 34050 1 249 . 1 1 36 36 ILE N N 15 119.294 0.000 . . . . . A 335 ILE N . 34050 1 250 . 1 1 37 37 ASP H H 1 8.021 0.002 . . . . . A 336 ASP H . 34050 1 251 . 1 1 37 37 ASP HB2 H 1 2.607 0.000 . . . . . A 336 ASP HB2 . 34050 1 252 . 1 1 37 37 ASP HB3 H 1 2.607 0.000 . . . . . A 336 ASP HB3 . 34050 1 253 . 1 1 37 37 ASP N N 15 118.450 0.000 . . . . . A 336 ASP N . 34050 1 254 . 1 1 38 38 GLY H H 1 7.553 0.002 . . . . . A 337 GLY H . 34050 1 255 . 1 1 38 38 GLY HA2 H 1 3.733 0.000 . . . . . A 337 GLY HA2 . 34050 1 256 . 1 1 38 38 GLY HA3 H 1 3.884 0.001 . . . . . A 337 GLY HA3 . 34050 1 257 . 1 1 38 38 GLY N N 15 103.264 0.000 . . . . . A 337 GLY N . 34050 1 258 . 1 1 39 39 VAL H H 1 7.474 0.002 . . . . . A 338 VAL H . 34050 1 259 . 1 1 39 39 VAL HA H 1 4.137 0.000 . . . . . A 338 VAL HA . 34050 1 260 . 1 1 39 39 VAL HB H 1 2.100 0.001 . . . . . A 338 VAL HB . 34050 1 261 . 1 1 39 39 VAL HG11 H 1 0.747 0.002 . . . . . A 338 VAL HG11 . 34050 1 262 . 1 1 39 39 VAL HG12 H 1 0.747 0.002 . . . . . A 338 VAL HG12 . 34050 1 263 . 1 1 39 39 VAL HG13 H 1 0.747 0.002 . . . . . A 338 VAL HG13 . 34050 1 264 . 1 1 39 39 VAL HG21 H 1 0.892 0.004 . . . . . A 338 VAL HG21 . 34050 1 265 . 1 1 39 39 VAL HG22 H 1 0.892 0.004 . . . . . A 338 VAL HG22 . 34050 1 266 . 1 1 39 39 VAL HG23 H 1 0.892 0.004 . . . . . A 338 VAL HG23 . 34050 1 267 . 1 1 39 39 VAL N N 15 117.325 0.000 . . . . . A 338 VAL N . 34050 1 268 . 1 1 40 40 PHE H H 1 8.337 0.002 . . . . . A 339 PHE H . 34050 1 269 . 1 1 40 40 PHE HB2 H 1 2.914 0.000 . . . . . A 339 PHE HB2 . 34050 1 270 . 1 1 40 40 PHE HB3 H 1 2.764 0.000 . . . . . A 339 PHE HB3 . 34050 1 271 . 1 1 40 40 PHE HD1 H 1 7.256 0.000 . . . . . A 339 PHE HD1 . 34050 1 272 . 1 1 40 40 PHE HD2 H 1 7.256 0.000 . . . . . A 339 PHE HD2 . 34050 1 273 . 1 1 40 40 PHE N N 15 122.950 0.000 . . . . . A 339 PHE N . 34050 1 274 . 1 1 41 41 PRO HA H 1 4.398 0.000 . . . . . A 340 PRO HA . 34050 1 275 . 1 1 41 41 PRO HB2 H 1 2.072 0.000 . . . . . A 340 PRO HB2 . 34050 1 276 . 1 1 41 41 PRO HB3 H 1 1.738 0.000 . . . . . A 340 PRO HB3 . 34050 1 277 . 1 1 41 41 PRO HG2 H 1 1.856 0.000 . . . . . A 340 PRO HG2 . 34050 1 278 . 1 1 41 41 PRO HD2 H 1 3.443 0.000 . . . . . A 340 PRO HD2 . 34050 1 279 . 1 1 41 41 PRO HD3 H 1 3.100 0.000 . . . . . A 340 PRO HD3 . 34050 1 280 . 1 1 42 42 VAL H H 1 8.606 0.001 . . . . . A 341 VAL H . 34050 1 281 . 1 1 42 42 VAL HA H 1 3.943 0.004 . . . . . A 341 VAL HA . 34050 1 282 . 1 1 42 42 VAL HB H 1 2.352 0.000 . . . . . A 341 VAL HB . 34050 1 283 . 1 1 42 42 VAL HG11 H 1 1.168 0.000 . . . . . A 341 VAL HG11 . 34050 1 284 . 1 1 42 42 VAL HG12 H 1 1.168 0.000 . . . . . A 341 VAL HG12 . 34050 1 285 . 1 1 42 42 VAL HG13 H 1 1.168 0.000 . . . . . A 341 VAL HG13 . 34050 1 286 . 1 1 42 42 VAL HG21 H 1 0.608 0.000 . . . . . A 341 VAL HG21 . 34050 1 287 . 1 1 42 42 VAL HG22 H 1 0.608 0.000 . . . . . A 341 VAL HG22 . 34050 1 288 . 1 1 42 42 VAL HG23 H 1 0.608 0.000 . . . . . A 341 VAL HG23 . 34050 1 289 . 1 1 42 42 VAL N N 15 125.762 0.000 . . . . . A 341 VAL N . 34050 1 290 . 1 1 43 43 THR H H 1 7.499 0.000 . . . . . A 342 THR H . 34050 1 291 . 1 1 43 43 THR HA H 1 4.329 0.000 . . . . . A 342 THR HA . 34050 1 292 . 1 1 43 43 THR HG21 H 1 1.056 0.000 . . . . . A 342 THR HG21 . 34050 1 293 . 1 1 43 43 THR HG22 H 1 1.056 0.000 . . . . . A 342 THR HG22 . 34050 1 294 . 1 1 43 43 THR HG23 H 1 1.056 0.000 . . . . . A 342 THR HG23 . 34050 1 295 . 1 1 43 43 THR N N 15 113.669 0.000 . . . . . A 342 THR N . 34050 1 296 . 1 1 44 44 THR H H 1 7.014 0.007 . . . . . A 343 THR H . 34050 1 297 . 1 1 44 44 THR HG21 H 1 1.203 0.000 . . . . . A 343 THR HG21 . 34050 1 298 . 1 1 44 44 THR HG22 H 1 1.203 0.000 . . . . . A 343 THR HG22 . 34050 1 299 . 1 1 44 44 THR HG23 H 1 1.203 0.000 . . . . . A 343 THR HG23 . 34050 1 300 . 1 1 44 44 THR N N 15 109.732 0.000 . . . . . A 343 THR N . 34050 1 301 . 1 1 45 45 PRO HB2 H 1 2.127 0.000 . . . . . A 344 PRO HB2 . 34050 1 302 . 1 1 45 45 PRO HB3 H 1 1.745 0.000 . . . . . A 344 PRO HB3 . 34050 1 303 . 1 1 45 45 PRO HG3 H 1 1.876 0.000 . . . . . A 344 PRO HG3 . 34050 1 304 . 1 1 45 45 PRO HD2 H 1 3.946 0.002 . . . . . A 344 PRO HD2 . 34050 1 305 . 1 1 45 45 PRO HD3 H 1 3.812 0.000 . . . . . A 344 PRO HD3 . 34050 1 306 . 1 1 46 46 ASP H H 1 7.918 0.001 . . . . . A 345 ASP H . 34050 1 307 . 1 1 46 46 ASP HA H 1 4.070 0.002 . . . . . A 345 ASP HA . 34050 1 308 . 1 1 46 46 ASP HB2 H 1 2.587 0.002 . . . . . A 345 ASP HB2 . 34050 1 309 . 1 1 46 46 ASP HB3 H 1 2.463 0.001 . . . . . A 345 ASP HB3 . 34050 1 310 . 1 1 46 46 ASP N N 15 115.357 0.000 . . . . . A 345 ASP N . 34050 1 311 . 1 1 47 47 LEU H H 1 7.667 0.002 . . . . . A 346 LEU H . 34050 1 312 . 1 1 47 47 LEU HA H 1 3.965 0.002 . . . . . A 346 LEU HA . 34050 1 313 . 1 1 47 47 LEU HB2 H 1 1.819 0.003 . . . . . A 346 LEU HB2 . 34050 1 314 . 1 1 47 47 LEU HB3 H 1 1.433 0.005 . . . . . A 346 LEU HB3 . 34050 1 315 . 1 1 47 47 LEU HG H 1 1.699 0.007 . . . . . A 346 LEU HG . 34050 1 316 . 1 1 47 47 LEU HD11 H 1 1.081 0.001 . . . . . A 346 LEU HD11 . 34050 1 317 . 1 1 47 47 LEU HD12 H 1 1.081 0.001 . . . . . A 346 LEU HD12 . 34050 1 318 . 1 1 47 47 LEU HD13 H 1 1.081 0.001 . . . . . A 346 LEU HD13 . 34050 1 319 . 1 1 47 47 LEU HD21 H 1 0.962 0.000 . . . . . A 346 LEU HD21 . 34050 1 320 . 1 1 47 47 LEU HD22 H 1 0.962 0.000 . . . . . A 346 LEU HD22 . 34050 1 321 . 1 1 47 47 LEU HD23 H 1 0.962 0.000 . . . . . A 346 LEU HD23 . 34050 1 322 . 1 1 47 47 LEU N N 15 119.856 0.000 . . . . . A 346 LEU N . 34050 1 323 . 1 1 48 48 ARG H H 1 7.901 0.002 . . . . . A 347 ARG H . 34050 1 324 . 1 1 48 48 ARG HA H 1 3.276 0.003 . . . . . A 347 ARG HA . 34050 1 325 . 1 1 48 48 ARG HB3 H 1 1.246 0.005 . . . . . A 347 ARG HB3 . 34050 1 326 . 1 1 48 48 ARG N N 15 119.013 0.000 . . . . . A 347 ARG N . 34050 1 327 . 1 1 49 49 CYS H H 1 8.203 0.002 . . . . . A 348 CYS H . 34050 1 328 . 1 1 49 49 CYS HA H 1 3.962 0.000 . . . . . A 348 CYS HA . 34050 1 329 . 1 1 49 49 CYS HB2 H 1 2.922 0.000 . . . . . A 348 CYS HB2 . 34050 1 330 . 1 1 49 49 CYS HB3 H 1 2.588 0.000 . . . . . A 348 CYS HB3 . 34050 1 331 . 1 1 49 49 CYS N N 15 117.325 0.000 . . . . . A 348 CYS N . 34050 1 332 . 1 1 50 50 ARG H H 1 7.900 0.001 . . . . . A 349 ARG H . 34050 1 333 . 1 1 50 50 ARG HA H 1 3.974 0.000 . . . . . A 349 ARG HA . 34050 1 334 . 1 1 50 50 ARG HB2 H 1 1.821 0.000 . . . . . A 349 ARG HB2 . 34050 1 335 . 1 1 50 50 ARG HB3 H 1 1.821 0.000 . . . . . A 349 ARG HB3 . 34050 1 336 . 1 1 50 50 ARG HG2 H 1 1.909 0.000 . . . . . A 349 ARG HG2 . 34050 1 337 . 1 1 50 50 ARG HG3 H 1 1.643 0.000 . . . . . A 349 ARG HG3 . 34050 1 338 . 1 1 50 50 ARG HD2 H 1 3.112 0.000 . . . . . A 349 ARG HD2 . 34050 1 339 . 1 1 50 50 ARG HD3 H 1 3.112 0.000 . . . . . A 349 ARG HD3 . 34050 1 340 . 1 1 50 50 ARG N N 15 118.169 0.000 . . . . . A 349 ARG N . 34050 1 341 . 1 1 51 51 ILE H H 1 8.250 0.001 . . . . . A 350 ILE H . 34050 1 342 . 1 1 51 51 ILE HA H 1 3.523 0.000 . . . . . A 350 ILE HA . 34050 1 343 . 1 1 51 51 ILE HB H 1 2.013 0.000 . . . . . A 350 ILE HB . 34050 1 344 . 1 1 51 51 ILE HG12 H 1 1.906 0.000 . . . . . A 350 ILE HG12 . 34050 1 345 . 1 1 51 51 ILE HG13 H 1 0.732 0.000 . . . . . A 350 ILE HG13 . 34050 1 346 . 1 1 51 51 ILE HG21 H 1 0.992 0.000 . . . . . A 350 ILE HG21 . 34050 1 347 . 1 1 51 51 ILE HG22 H 1 0.992 0.000 . . . . . A 350 ILE HG22 . 34050 1 348 . 1 1 51 51 ILE HG23 H 1 0.992 0.000 . . . . . A 350 ILE HG23 . 34050 1 349 . 1 1 51 51 ILE HD11 H 1 0.869 0.000 . . . . . A 350 ILE HD11 . 34050 1 350 . 1 1 51 51 ILE HD12 H 1 0.869 0.000 . . . . . A 350 ILE HD12 . 34050 1 351 . 1 1 51 51 ILE HD13 H 1 0.869 0.000 . . . . . A 350 ILE HD13 . 34050 1 352 . 1 1 51 51 ILE N N 15 119.294 0.000 . . . . . A 350 ILE N . 34050 1 353 . 1 1 52 52 ILE H H 1 8.378 0.002 . . . . . A 351 ILE H . 34050 1 354 . 1 1 52 52 ILE HA H 1 3.485 0.000 . . . . . A 351 ILE HA . 34050 1 355 . 1 1 52 52 ILE HB H 1 1.776 0.000 . . . . . A 351 ILE HB . 34050 1 356 . 1 1 52 52 ILE HG21 H 1 0.983 0.000 . . . . . A 351 ILE HG21 . 34050 1 357 . 1 1 52 52 ILE HG22 H 1 0.983 0.000 . . . . . A 351 ILE HG22 . 34050 1 358 . 1 1 52 52 ILE HG23 H 1 0.983 0.000 . . . . . A 351 ILE HG23 . 34050 1 359 . 1 1 52 52 ILE HD11 H 1 0.875 0.000 . . . . . A 351 ILE HD11 . 34050 1 360 . 1 1 52 52 ILE HD12 H 1 0.875 0.000 . . . . . A 351 ILE HD12 . 34050 1 361 . 1 1 52 52 ILE HD13 H 1 0.875 0.000 . . . . . A 351 ILE HD13 . 34050 1 362 . 1 1 52 52 ILE N N 15 119.575 0.000 . . . . . A 351 ILE N . 34050 1 363 . 1 1 53 53 ASN H H 1 8.679 0.002 . . . . . A 352 ASN H . 34050 1 364 . 1 1 53 53 ASN HA H 1 4.434 0.000 . . . . . A 352 ASN HA . 34050 1 365 . 1 1 53 53 ASN HB2 H 1 2.797 0.004 . . . . . A 352 ASN HB2 . 34050 1 366 . 1 1 53 53 ASN HB3 H 1 2.797 0.004 . . . . . A 352 ASN HB3 . 34050 1 367 . 1 1 53 53 ASN HD21 H 1 7.336 0.001 . . . . . A 352 ASN HD21 . 34050 1 368 . 1 1 53 53 ASN HD22 H 1 7.111 0.001 . . . . . A 352 ASN HD22 . 34050 1 369 . 1 1 53 53 ASN N N 15 116.200 0.000 . . . . . A 352 ASN N . 34050 1 370 . 1 1 53 53 ASN ND2 N 15 109.732 0.000 . . . . . A 352 ASN ND2 . 34050 1 371 . 1 1 54 54 ALA H H 1 7.751 0.001 . . . . . A 353 ALA H . 34050 1 372 . 1 1 54 54 ALA HA H 1 4.259 0.002 . . . . . A 353 ALA HA . 34050 1 373 . 1 1 54 54 ALA HB1 H 1 1.525 0.002 . . . . . A 353 ALA HB1 . 34050 1 374 . 1 1 54 54 ALA HB2 H 1 1.525 0.002 . . . . . A 353 ALA HB2 . 34050 1 375 . 1 1 54 54 ALA HB3 H 1 1.525 0.002 . . . . . A 353 ALA HB3 . 34050 1 376 . 1 1 54 54 ALA N N 15 121.262 0.000 . . . . . A 353 ALA N . 34050 1 377 . 1 1 55 55 ILE H H 1 8.378 0.001 . . . . . A 354 ILE H . 34050 1 378 . 1 1 55 55 ILE HA H 1 4.000 0.000 . . . . . A 354 ILE HA . 34050 1 379 . 1 1 55 55 ILE HB H 1 2.165 0.000 . . . . . A 354 ILE HB . 34050 1 380 . 1 1 55 55 ILE HG12 H 1 1.780 0.002 . . . . . A 354 ILE HG12 . 34050 1 381 . 1 1 55 55 ILE HG13 H 1 1.546 0.000 . . . . . A 354 ILE HG13 . 34050 1 382 . 1 1 55 55 ILE HG21 H 1 1.067 0.000 . . . . . A 354 ILE HG21 . 34050 1 383 . 1 1 55 55 ILE HG22 H 1 1.067 0.000 . . . . . A 354 ILE HG22 . 34050 1 384 . 1 1 55 55 ILE HG23 H 1 1.067 0.000 . . . . . A 354 ILE HG23 . 34050 1 385 . 1 1 55 55 ILE HD11 H 1 0.835 0.000 . . . . . A 354 ILE HD11 . 34050 1 386 . 1 1 55 55 ILE HD12 H 1 0.835 0.000 . . . . . A 354 ILE HD12 . 34050 1 387 . 1 1 55 55 ILE HD13 H 1 0.835 0.000 . . . . . A 354 ILE HD13 . 34050 1 388 . 1 1 55 55 ILE N N 15 118.169 0.000 . . . . . A 354 ILE N . 34050 1 389 . 1 1 56 56 LEU H H 1 8.292 0.001 . . . . . A 355 LEU H . 34050 1 390 . 1 1 56 56 LEU HA H 1 4.326 0.000 . . . . . A 355 LEU HA . 34050 1 391 . 1 1 56 56 LEU HB2 H 1 2.035 0.000 . . . . . A 355 LEU HB2 . 34050 1 392 . 1 1 56 56 LEU HB3 H 1 1.538 0.000 . . . . . A 355 LEU HB3 . 34050 1 393 . 1 1 56 56 LEU HG H 1 0.937 0.000 . . . . . A 355 LEU HG . 34050 1 394 . 1 1 56 56 LEU HD11 H 1 0.832 0.000 . . . . . A 355 LEU HD11 . 34050 1 395 . 1 1 56 56 LEU HD12 H 1 0.832 0.000 . . . . . A 355 LEU HD12 . 34050 1 396 . 1 1 56 56 LEU HD13 H 1 0.832 0.000 . . . . . A 355 LEU HD13 . 34050 1 397 . 1 1 56 56 LEU N N 15 117.888 0.000 . . . . . A 355 LEU N . 34050 1 398 . 1 1 57 57 GLY H H 1 7.504 0.001 . . . . . A 356 GLY H . 34050 1 399 . 1 1 57 57 GLY HA2 H 1 3.849 0.000 . . . . . A 356 GLY HA2 . 34050 1 400 . 1 1 57 57 GLY HA3 H 1 3.966 0.000 . . . . . A 356 GLY HA3 . 34050 1 401 . 1 1 57 57 GLY N N 15 106.920 0.000 . . . . . A 356 GLY N . 34050 1 402 . 1 1 58 58 GLY H H 1 8.539 0.002 . . . . . A 357 GLY H . 34050 1 403 . 1 1 58 58 GLY HA2 H 1 3.819 0.000 . . . . . A 357 GLY HA2 . 34050 1 404 . 1 1 58 58 GLY HA3 H 1 3.928 0.000 . . . . . A 357 GLY HA3 . 34050 1 405 . 1 1 58 58 GLY N N 15 108.889 0.000 . . . . . A 357 GLY N . 34050 1 406 . 1 1 59 59 ASN H H 1 7.892 0.001 . . . . . A 358 ASN H . 34050 1 407 . 1 1 59 59 ASN HB2 H 1 2.705 0.000 . . . . . A 358 ASN HB2 . 34050 1 408 . 1 1 59 59 ASN HB3 H 1 2.631 0.000 . . . . . A 358 ASN HB3 . 34050 1 409 . 1 1 59 59 ASN HD21 H 1 7.511 0.003 . . . . . A 358 ASN HD21 . 34050 1 410 . 1 1 59 59 ASN HD22 H 1 6.959 0.002 . . . . . A 358 ASN HD22 . 34050 1 411 . 1 1 59 59 ASN N N 15 119.013 0.000 . . . . . A 358 ASN N . 34050 1 412 . 1 1 59 59 ASN ND2 N 15 112.544 0.000 . . . . . A 358 ASN ND2 . 34050 1 413 . 1 1 60 60 ILE H H 1 8.284 0.001 . . . . . A 359 ILE H . 34050 1 414 . 1 1 60 60 ILE HA H 1 4.047 0.000 . . . . . A 359 ILE HA . 34050 1 415 . 1 1 60 60 ILE HB H 1 1.883 0.000 . . . . . A 359 ILE HB . 34050 1 416 . 1 1 60 60 ILE HG12 H 1 1.445 0.000 . . . . . A 359 ILE HG12 . 34050 1 417 . 1 1 60 60 ILE HG13 H 1 1.202 0.000 . . . . . A 359 ILE HG13 . 34050 1 418 . 1 1 60 60 ILE HG21 H 1 0.900 0.000 . . . . . A 359 ILE HG21 . 34050 1 419 . 1 1 60 60 ILE HG22 H 1 0.900 0.000 . . . . . A 359 ILE HG22 . 34050 1 420 . 1 1 60 60 ILE HG23 H 1 0.900 0.000 . . . . . A 359 ILE HG23 . 34050 1 421 . 1 1 60 60 ILE HD11 H 1 0.831 0.000 . . . . . A 359 ILE HD11 . 34050 1 422 . 1 1 60 60 ILE HD12 H 1 0.831 0.000 . . . . . A 359 ILE HD12 . 34050 1 423 . 1 1 60 60 ILE HD13 H 1 0.831 0.000 . . . . . A 359 ILE HD13 . 34050 1 424 . 1 1 60 60 ILE N N 15 121.544 0.000 . . . . . A 359 ILE N . 34050 1 425 . 1 1 61 61 GLY H H 1 8.422 0.002 . . . . . A 360 GLY H . 34050 1 426 . 1 1 61 61 GLY HA2 H 1 3.844 0.000 . . . . . A 360 GLY HA2 . 34050 1 427 . 1 1 61 61 GLY HA3 H 1 3.940 0.000 . . . . . A 360 GLY HA3 . 34050 1 428 . 1 1 61 61 GLY N N 15 110.857 0.000 . . . . . A 360 GLY N . 34050 1 429 . 1 1 62 62 LEU H H 1 7.601 0.001 . . . . . A 361 LEU H . 34050 1 430 . 1 1 62 62 LEU HA H 1 4.358 0.000 . . . . . A 361 LEU HA . 34050 1 431 . 1 1 62 62 LEU HB2 H 1 1.612 0.000 . . . . . A 361 LEU HB2 . 34050 1 432 . 1 1 62 62 LEU HB3 H 1 1.468 0.000 . . . . . A 361 LEU HB3 . 34050 1 433 . 1 1 62 62 LEU HG H 1 1.480 0.000 . . . . . A 361 LEU HG . 34050 1 434 . 1 1 62 62 LEU HD11 H 1 0.819 0.000 . . . . . A 361 LEU HD11 . 34050 1 435 . 1 1 62 62 LEU HD12 H 1 0.819 0.000 . . . . . A 361 LEU HD12 . 34050 1 436 . 1 1 62 62 LEU HD13 H 1 0.819 0.000 . . . . . A 361 LEU HD13 . 34050 1 437 . 1 1 62 62 LEU HD21 H 1 0.697 0.000 . . . . . A 361 LEU HD21 . 34050 1 438 . 1 1 62 62 LEU HD22 H 1 0.697 0.000 . . . . . A 361 LEU HD22 . 34050 1 439 . 1 1 62 62 LEU HD23 H 1 0.697 0.000 . . . . . A 361 LEU HD23 . 34050 1 440 . 1 1 62 62 LEU N N 15 119.294 0.000 . . . . . A 361 LEU N . 34050 1 441 . 1 1 63 63 SER H H 1 7.507 0.001 . . . . . A 362 SER H . 34050 1 442 . 1 1 63 63 SER HA H 1 4.160 0.000 . . . . . A 362 SER HA . 34050 1 443 . 1 1 63 63 SER HB2 H 1 3.753 0.000 . . . . . A 362 SER HB2 . 34050 1 444 . 1 1 63 63 SER HB3 H 1 3.709 0.000 . . . . . A 362 SER HB3 . 34050 1 445 . 1 1 63 63 SER N N 15 113.669 0.000 . . . . . A 362 SER N . 34050 1 446 . 1 1 64 64 LEU H H 1 9.101 0.003 . . . . . A 363 LEU H . 34050 1 447 . 1 1 64 64 LEU HB2 H 1 1.638 0.000 . . . . . A 363 LEU HB2 . 34050 1 448 . 1 1 64 64 LEU HB3 H 1 1.503 0.000 . . . . . A 363 LEU HB3 . 34050 1 449 . 1 1 64 64 LEU HG H 1 0.904 0.000 . . . . . A 363 LEU HG . 34050 1 450 . 1 1 64 64 LEU HD11 H 1 1.804 0.000 . . . . . A 363 LEU HD11 . 34050 1 451 . 1 1 64 64 LEU HD12 H 1 1.804 0.000 . . . . . A 363 LEU HD12 . 34050 1 452 . 1 1 64 64 LEU HD13 H 1 1.804 0.000 . . . . . A 363 LEU HD13 . 34050 1 453 . 1 1 64 64 LEU HD21 H 1 0.808 0.000 . . . . . A 363 LEU HD21 . 34050 1 454 . 1 1 64 64 LEU HD22 H 1 0.808 0.000 . . . . . A 363 LEU HD22 . 34050 1 455 . 1 1 64 64 LEU HD23 H 1 0.808 0.000 . . . . . A 363 LEU HD23 . 34050 1 456 . 1 1 64 64 LEU N N 15 124.918 0.000 . . . . . A 363 LEU N . 34050 1 457 . 1 1 65 65 THR H H 1 9.065 0.001 . . . . . A 364 THR H . 34050 1 458 . 1 1 65 65 THR HB H 1 4.392 0.000 . . . . . A 364 THR HB . 34050 1 459 . 1 1 65 65 THR HG21 H 1 1.163 0.002 . . . . . A 364 THR HG21 . 34050 1 460 . 1 1 65 65 THR HG22 H 1 1.163 0.002 . . . . . A 364 THR HG22 . 34050 1 461 . 1 1 65 65 THR HG23 H 1 1.163 0.002 . . . . . A 364 THR HG23 . 34050 1 462 . 1 1 65 65 THR N N 15 112.826 0.000 . . . . . A 364 THR N . 34050 1 463 . 1 1 66 66 PRO HA H 1 3.777 0.000 . . . . . A 365 PRO HA . 34050 1 464 . 1 1 66 66 PRO HB2 H 1 1.922 0.000 . . . . . A 365 PRO HB2 . 34050 1 465 . 1 1 67 67 GLY H H 1 8.234 0.002 . . . . . A 366 GLY H . 34050 1 466 . 1 1 67 67 GLY HA2 H 1 3.736 0.000 . . . . . A 366 GLY HA2 . 34050 1 467 . 1 1 67 67 GLY HA3 H 1 3.736 0.000 . . . . . A 366 GLY HA3 . 34050 1 468 . 1 1 67 67 GLY N N 15 103.264 0.000 . . . . . A 366 GLY N . 34050 1 469 . 1 1 68 68 ASP H H 1 7.742 0.002 . . . . . A 367 ASP H . 34050 1 470 . 1 1 68 68 ASP HB2 H 1 3.074 0.000 . . . . . A 367 ASP HB2 . 34050 1 471 . 1 1 68 68 ASP HB3 H 1 2.960 0.000 . . . . . A 367 ASP HB3 . 34050 1 472 . 1 1 68 68 ASP N N 15 117.888 0.000 . . . . . A 367 ASP N . 34050 1 473 . 1 1 69 69 CYS H H 1 7.566 0.002 . . . . . A 368 CYS H . 34050 1 474 . 1 1 69 69 CYS HA H 1 4.321 0.000 . . . . . A 368 CYS HA . 34050 1 475 . 1 1 69 69 CYS HB2 H 1 2.910 0.000 . . . . . A 368 CYS HB2 . 34050 1 476 . 1 1 69 69 CYS HB3 H 1 2.584 0.000 . . . . . A 368 CYS HB3 . 34050 1 477 . 1 1 69 69 CYS N N 15 113.951 0.000 . . . . . A 368 CYS N . 34050 1 478 . 1 1 70 70 LEU H H 1 7.398 0.001 . . . . . A 369 LEU H . 34050 1 479 . 1 1 70 70 LEU HA H 1 3.722 0.011 . . . . . A 369 LEU HA . 34050 1 480 . 1 1 70 70 LEU HB2 H 1 1.719 0.001 . . . . . A 369 LEU HB2 . 34050 1 481 . 1 1 70 70 LEU HB3 H 1 1.490 0.002 . . . . . A 369 LEU HB3 . 34050 1 482 . 1 1 70 70 LEU HD11 H 1 0.913 0.005 . . . . . A 369 LEU HD11 . 34050 1 483 . 1 1 70 70 LEU HD12 H 1 0.913 0.005 . . . . . A 369 LEU HD12 . 34050 1 484 . 1 1 70 70 LEU HD13 H 1 0.913 0.005 . . . . . A 369 LEU HD13 . 34050 1 485 . 1 1 70 70 LEU HD21 H 1 0.847 0.006 . . . . . A 369 LEU HD21 . 34050 1 486 . 1 1 70 70 LEU HD22 H 1 0.847 0.006 . . . . . A 369 LEU HD22 . 34050 1 487 . 1 1 70 70 LEU HD23 H 1 0.847 0.006 . . . . . A 369 LEU HD23 . 34050 1 488 . 1 1 70 70 LEU N N 15 122.106 0.000 . . . . . A 369 LEU N . 34050 1 489 . 1 1 71 71 THR H H 1 8.051 0.001 . . . . . A 370 THR H . 34050 1 490 . 1 1 71 71 THR HA H 1 4.298 0.000 . . . . . A 370 THR HA . 34050 1 491 . 1 1 71 71 THR HG1 H 1 5.725 0.004 . . . . . A 370 THR HG1 . 34050 1 492 . 1 1 71 71 THR HG21 H 1 1.106 0.000 . . . . . A 370 THR HG21 . 34050 1 493 . 1 1 71 71 THR HG22 H 1 1.106 0.000 . . . . . A 370 THR HG22 . 34050 1 494 . 1 1 71 71 THR HG23 H 1 1.106 0.000 . . . . . A 370 THR HG23 . 34050 1 495 . 1 1 71 71 THR N N 15 104.108 0.000 . . . . . A 370 THR N . 34050 1 496 . 1 1 72 72 TRP H H 1 9.049 0.001 . . . . . A 371 TRP H . 34050 1 497 . 1 1 72 72 TRP HB2 H 1 3.233 0.000 . . . . . A 371 TRP HB2 . 34050 1 498 . 1 1 72 72 TRP HB3 H 1 3.071 0.000 . . . . . A 371 TRP HB3 . 34050 1 499 . 1 1 72 72 TRP HD1 H 1 7.492 0.000 . . . . . A 371 TRP HD1 . 34050 1 500 . 1 1 72 72 TRP N N 15 120.137 0.000 . . . . . A 371 TRP N . 34050 1 501 . 1 1 73 73 ASP H H 1 8.305 0.001 . . . . . A 372 ASP H . 34050 1 502 . 1 1 73 73 ASP HA H 1 4.302 0.000 . . . . . A 372 ASP HA . 34050 1 503 . 1 1 73 73 ASP HB2 H 1 2.731 0.003 . . . . . A 372 ASP HB2 . 34050 1 504 . 1 1 73 73 ASP HB3 H 1 2.679 0.002 . . . . . A 372 ASP HB3 . 34050 1 505 . 1 1 73 73 ASP N N 15 115.919 0.000 . . . . . A 372 ASP N . 34050 1 506 . 1 1 74 74 SER H H 1 8.770 0.002 . . . . . A 373 SER H . 34050 1 507 . 1 1 74 74 SER HA H 1 4.302 0.002 . . . . . A 373 SER HA . 34050 1 508 . 1 1 74 74 SER HB2 H 1 4.049 0.000 . . . . . A 373 SER HB2 . 34050 1 509 . 1 1 74 74 SER HB3 H 1 3.693 0.004 . . . . . A 373 SER HB3 . 34050 1 510 . 1 1 74 74 SER N N 15 117.044 0.000 . . . . . A 373 SER N . 34050 1 511 . 1 1 75 75 ALA H H 1 7.784 0.001 . . . . . A 374 ALA H . 34050 1 512 . 1 1 75 75 ALA HA H 1 4.145 0.001 . . . . . A 374 ALA HA . 34050 1 513 . 1 1 75 75 ALA HB1 H 1 1.485 0.002 . . . . . A 374 ALA HB1 . 34050 1 514 . 1 1 75 75 ALA HB2 H 1 1.485 0.002 . . . . . A 374 ALA HB2 . 34050 1 515 . 1 1 75 75 ALA HB3 H 1 1.485 0.002 . . . . . A 374 ALA HB3 . 34050 1 516 . 1 1 75 75 ALA N N 15 131.105 0.000 . . . . . A 374 ALA N . 34050 1 517 . 1 1 76 76 VAL H H 1 8.613 0.002 . . . . . A 375 VAL H . 34050 1 518 . 1 1 76 76 VAL HA H 1 3.483 0.000 . . . . . A 375 VAL HA . 34050 1 519 . 1 1 76 76 VAL HB H 1 2.289 0.002 . . . . . A 375 VAL HB . 34050 1 520 . 1 1 76 76 VAL HG11 H 1 1.167 0.001 . . . . . A 375 VAL HG11 . 34050 1 521 . 1 1 76 76 VAL HG12 H 1 1.167 0.001 . . . . . A 375 VAL HG12 . 34050 1 522 . 1 1 76 76 VAL HG13 H 1 1.167 0.001 . . . . . A 375 VAL HG13 . 34050 1 523 . 1 1 76 76 VAL HG21 H 1 0.917 0.000 . . . . . A 375 VAL HG21 . 34050 1 524 . 1 1 76 76 VAL HG22 H 1 0.917 0.000 . . . . . A 375 VAL HG22 . 34050 1 525 . 1 1 76 76 VAL HG23 H 1 0.917 0.000 . . . . . A 375 VAL HG23 . 34050 1 526 . 1 1 76 76 VAL N N 15 119.013 0.000 . . . . . A 375 VAL N . 34050 1 527 . 1 1 77 77 ALA H H 1 8.618 0.002 . . . . . A 376 ALA H . 34050 1 528 . 1 1 77 77 ALA HA H 1 4.138 0.004 . . . . . A 376 ALA HA . 34050 1 529 . 1 1 77 77 ALA HB1 H 1 1.391 0.000 . . . . . A 376 ALA HB1 . 34050 1 530 . 1 1 77 77 ALA HB2 H 1 1.391 0.000 . . . . . A 376 ALA HB2 . 34050 1 531 . 1 1 77 77 ALA HB3 H 1 1.391 0.000 . . . . . A 376 ALA HB3 . 34050 1 532 . 1 1 77 77 ALA N N 15 122.106 0.000 . . . . . A 376 ALA N . 34050 1 533 . 1 1 78 78 THR H H 1 8.292 0.001 . . . . . A 377 THR H . 34050 1 534 . 1 1 78 78 THR HA H 1 3.892 0.000 . . . . . A 377 THR HA . 34050 1 535 . 1 1 78 78 THR HB H 1 4.383 0.000 . . . . . A 377 THR HB . 34050 1 536 . 1 1 78 78 THR HG21 H 1 1.142 0.000 . . . . . A 377 THR HG21 . 34050 1 537 . 1 1 78 78 THR HG22 H 1 1.142 0.000 . . . . . A 377 THR HG22 . 34050 1 538 . 1 1 78 78 THR HG23 H 1 1.142 0.000 . . . . . A 377 THR HG23 . 34050 1 539 . 1 1 78 78 THR N N 15 115.075 0.000 . . . . . A 377 THR N . 34050 1 540 . 1 1 79 79 LEU H H 1 8.365 0.000 . . . . . A 378 LEU H . 34050 1 541 . 1 1 79 79 LEU HA H 1 4.022 0.000 . . . . . A 378 LEU HA . 34050 1 542 . 1 1 79 79 LEU HB2 H 1 2.138 0.007 . . . . . A 378 LEU HB2 . 34050 1 543 . 1 1 79 79 LEU HB3 H 1 1.205 0.008 . . . . . A 378 LEU HB3 . 34050 1 544 . 1 1 79 79 LEU HD21 H 1 0.875 0.000 . . . . . A 378 LEU HD21 . 34050 1 545 . 1 1 79 79 LEU HD22 H 1 0.875 0.000 . . . . . A 378 LEU HD22 . 34050 1 546 . 1 1 79 79 LEU HD23 H 1 0.875 0.000 . . . . . A 378 LEU HD23 . 34050 1 547 . 1 1 79 79 LEU N N 15 120.981 0.000 . . . . . A 378 LEU N . 34050 1 548 . 1 1 80 80 PHE H H 1 9.210 0.002 . . . . . A 379 PHE H . 34050 1 549 . 1 1 80 80 PHE HA H 1 4.006 0.000 . . . . . A 379 PHE HA . 34050 1 550 . 1 1 80 80 PHE HB2 H 1 3.551 0.013 . . . . . A 379 PHE HB2 . 34050 1 551 . 1 1 80 80 PHE HB3 H 1 3.115 0.001 . . . . . A 379 PHE HB3 . 34050 1 552 . 1 1 80 80 PHE HD1 H 1 6.892 0.000 . . . . . A 379 PHE HD1 . 34050 1 553 . 1 1 80 80 PHE HD2 H 1 6.892 0.000 . . . . . A 379 PHE HD2 . 34050 1 554 . 1 1 80 80 PHE N N 15 123.793 0.000 . . . . . A 379 PHE N . 34050 1 555 . 1 1 81 81 ILE H H 1 8.327 0.001 . . . . . A 380 ILE H . 34050 1 556 . 1 1 81 81 ILE HA H 1 3.806 0.000 . . . . . A 380 ILE HA . 34050 1 557 . 1 1 81 81 ILE HB H 1 2.118 0.000 . . . . . A 380 ILE HB . 34050 1 558 . 1 1 81 81 ILE HG12 H 1 1.816 0.000 . . . . . A 380 ILE HG12 . 34050 1 559 . 1 1 81 81 ILE HG13 H 1 1.366 0.000 . . . . . A 380 ILE HG13 . 34050 1 560 . 1 1 81 81 ILE HG21 H 1 0.967 0.000 . . . . . A 380 ILE HG21 . 34050 1 561 . 1 1 81 81 ILE HG22 H 1 0.967 0.000 . . . . . A 380 ILE HG22 . 34050 1 562 . 1 1 81 81 ILE HG23 H 1 0.967 0.000 . . . . . A 380 ILE HG23 . 34050 1 563 . 1 1 81 81 ILE HD11 H 1 0.937 0.000 . . . . . A 380 ILE HD11 . 34050 1 564 . 1 1 81 81 ILE HD12 H 1 0.937 0.000 . . . . . A 380 ILE HD12 . 34050 1 565 . 1 1 81 81 ILE HD13 H 1 0.937 0.000 . . . . . A 380 ILE HD13 . 34050 1 566 . 1 1 81 81 ILE N N 15 120.700 0.000 . . . . . A 380 ILE N . 34050 1 567 . 1 1 82 82 ARG H H 1 8.272 0.003 . . . . . A 381 ARG H . 34050 1 568 . 1 1 82 82 ARG HA H 1 4.121 0.000 . . . . . A 381 ARG HA . 34050 1 569 . 1 1 82 82 ARG HB2 H 1 1.995 0.000 . . . . . A 381 ARG HB2 . 34050 1 570 . 1 1 82 82 ARG HB3 H 1 1.941 0.000 . . . . . A 381 ARG HB3 . 34050 1 571 . 1 1 82 82 ARG HG2 H 1 1.835 0.000 . . . . . A 381 ARG HG2 . 34050 1 572 . 1 1 82 82 ARG HG3 H 1 1.768 0.000 . . . . . A 381 ARG HG3 . 34050 1 573 . 1 1 82 82 ARG N N 15 118.169 0.000 . . . . . A 381 ARG N . 34050 1 574 . 1 1 83 83 THR H H 1 7.655 0.004 . . . . . A 382 THR H . 34050 1 575 . 1 1 83 83 THR HA H 1 4.298 0.000 . . . . . A 382 THR HA . 34050 1 576 . 1 1 83 83 THR HB H 1 3.841 0.000 . . . . . A 382 THR HB . 34050 1 577 . 1 1 83 83 THR HG21 H 1 1.226 0.000 . . . . . A 382 THR HG21 . 34050 1 578 . 1 1 83 83 THR HG22 H 1 1.226 0.000 . . . . . A 382 THR HG22 . 34050 1 579 . 1 1 83 83 THR HG23 H 1 1.226 0.000 . . . . . A 382 THR HG23 . 34050 1 580 . 1 1 83 83 THR N N 15 104.952 0.000 . . . . . A 382 THR N . 34050 1 581 . 1 1 84 84 HIS HA H 1 4.407 0.000 . . . . . A 383 HIS HA . 34050 1 582 . 1 1 84 84 HIS HB3 H 1 3.008 0.000 . . . . . A 383 HIS HB3 . 34050 1 583 . 1 1 85 85 GLY H H 1 8.005 0.001 . . . . . A 384 GLY H . 34050 1 584 . 1 1 85 85 GLY HA2 H 1 3.854 0.000 . . . . . A 384 GLY HA2 . 34050 1 585 . 1 1 85 85 GLY HA3 H 1 4.236 0.000 . . . . . A 384 GLY HA3 . 34050 1 586 . 1 1 85 85 GLY N N 15 108.889 0.000 . . . . . A 384 GLY N . 34050 1 587 . 1 1 86 86 THR H H 1 7.674 0.001 . . . . . A 385 THR H . 34050 1 588 . 1 1 86 86 THR HA H 1 4.238 0.000 . . . . . A 385 THR HA . 34050 1 589 . 1 1 86 86 THR HB H 1 4.049 0.000 . . . . . A 385 THR HB . 34050 1 590 . 1 1 86 86 THR HG21 H 1 1.054 0.000 . . . . . A 385 THR HG21 . 34050 1 591 . 1 1 86 86 THR HG22 H 1 1.054 0.000 . . . . . A 385 THR HG22 . 34050 1 592 . 1 1 86 86 THR HG23 H 1 1.054 0.000 . . . . . A 385 THR HG23 . 34050 1 593 . 1 1 86 86 THR N N 15 111.420 0.000 . . . . . A 385 THR N . 34050 1 594 . 1 1 87 87 PHE H H 1 8.184 0.003 . . . . . A 386 PHE H . 34050 1 595 . 1 1 87 87 PHE HB2 H 1 2.980 0.000 . . . . . A 386 PHE HB2 . 34050 1 596 . 1 1 87 87 PHE HB3 H 1 2.897 0.000 . . . . . A 386 PHE HB3 . 34050 1 597 . 1 1 87 87 PHE HD1 H 1 7.132 0.000 . . . . . A 386 PHE HD1 . 34050 1 598 . 1 1 87 87 PHE HD2 H 1 7.132 0.000 . . . . . A 386 PHE HD2 . 34050 1 599 . 1 1 87 87 PHE N N 15 120.700 0.000 . . . . . A 386 PHE N . 34050 1 600 . 1 1 89 89 MET H H 1 8.610 0.003 . . . . . A 388 MET H . 34050 1 601 . 1 1 89 89 MET HA H 1 4.269 0.000 . . . . . A 388 MET HA . 34050 1 602 . 1 1 89 89 MET HB2 H 1 2.146 0.000 . . . . . A 388 MET HB2 . 34050 1 603 . 1 1 89 89 MET HB3 H 1 2.019 0.000 . . . . . A 388 MET HB3 . 34050 1 604 . 1 1 89 89 MET HG2 H 1 2.757 0.000 . . . . . A 388 MET HG2 . 34050 1 605 . 1 1 89 89 MET HG3 H 1 2.591 0.000 . . . . . A 388 MET HG3 . 34050 1 606 . 1 1 89 89 MET N N 15 120.700 0.000 . . . . . A 388 MET N . 34050 1 607 . 1 1 90 90 HIS HA H 1 4.539 0.000 . . . . . A 389 HIS HA . 34050 1 608 . 1 1 91 91 GLN H H 1 7.673 0.003 . . . . . A 390 GLN H . 34050 1 609 . 1 1 91 91 GLN HA H 1 4.542 0.000 . . . . . A 390 GLN HA . 34050 1 610 . 1 1 91 91 GLN HB3 H 1 1.622 0.000 . . . . . A 390 GLN HB3 . 34050 1 611 . 1 1 91 91 GLN HG2 H 1 2.079 0.000 . . . . . A 390 GLN HG2 . 34050 1 612 . 1 1 91 91 GLN HG3 H 1 1.817 0.000 . . . . . A 390 GLN HG3 . 34050 1 613 . 1 1 91 91 GLN N N 15 118.169 0.000 . . . . . A 390 GLN N . 34050 1 614 . 1 1 92 92 LEU H H 1 7.740 0.001 . . . . . A 391 LEU H . 34050 1 615 . 1 1 92 92 LEU HA H 1 3.873 0.001 . . . . . A 391 LEU HA . 34050 1 616 . 1 1 92 92 LEU HB2 H 1 1.726 0.000 . . . . . A 391 LEU HB2 . 34050 1 617 . 1 1 92 92 LEU HB3 H 1 1.726 0.000 . . . . . A 391 LEU HB3 . 34050 1 618 . 1 1 92 92 LEU HG H 1 0.715 0.000 . . . . . A 391 LEU HG . 34050 1 619 . 1 1 92 92 LEU HD21 H 1 0.676 0.000 . . . . . A 391 LEU HD21 . 34050 1 620 . 1 1 92 92 LEU HD22 H 1 0.676 0.000 . . . . . A 391 LEU HD22 . 34050 1 621 . 1 1 92 92 LEU HD23 H 1 0.676 0.000 . . . . . A 391 LEU HD23 . 34050 1 622 . 1 1 92 92 LEU N N 15 121.262 0.000 . . . . . A 391 LEU N . 34050 1 623 . 1 1 93 93 GLY H H 1 8.817 0.001 . . . . . A 392 GLY H . 34050 1 624 . 1 1 93 93 GLY HA2 H 1 3.658 0.000 . . . . . A 392 GLY HA2 . 34050 1 625 . 1 1 93 93 GLY HA3 H 1 4.047 0.001 . . . . . A 392 GLY HA3 . 34050 1 626 . 1 1 93 93 GLY N N 15 106.639 0.000 . . . . . A 392 GLY N . 34050 1 627 . 1 1 94 94 ASN H H 1 7.896 0.001 . . . . . A 393 ASN H . 34050 1 628 . 1 1 94 94 ASN HA H 1 4.442 0.002 . . . . . A 393 ASN HA . 34050 1 629 . 1 1 94 94 ASN HB2 H 1 2.878 0.005 . . . . . A 393 ASN HB2 . 34050 1 630 . 1 1 94 94 ASN HB3 H 1 2.812 0.002 . . . . . A 393 ASN HB3 . 34050 1 631 . 1 1 94 94 ASN HD21 H 1 7.708 0.002 . . . . . A 393 ASN HD21 . 34050 1 632 . 1 1 94 94 ASN HD22 H 1 6.940 0.002 . . . . . A 393 ASN HD22 . 34050 1 633 . 1 1 94 94 ASN N N 15 120.137 0.000 . . . . . A 393 ASN N . 34050 1 634 . 1 1 94 94 ASN ND2 N 15 112.685 0.141 . . . . . A 393 ASN ND2 . 34050 1 635 . 1 1 95 95 VAL H H 1 7.723 0.002 . . . . . A 394 VAL H . 34050 1 636 . 1 1 95 95 VAL HA H 1 3.643 0.002 . . . . . A 394 VAL HA . 34050 1 637 . 1 1 95 95 VAL HB H 1 2.030 0.000 . . . . . A 394 VAL HB . 34050 1 638 . 1 1 95 95 VAL HG11 H 1 0.841 0.000 . . . . . A 394 VAL HG11 . 34050 1 639 . 1 1 95 95 VAL HG12 H 1 0.841 0.000 . . . . . A 394 VAL HG12 . 34050 1 640 . 1 1 95 95 VAL HG13 H 1 0.841 0.000 . . . . . A 394 VAL HG13 . 34050 1 641 . 1 1 95 95 VAL HG21 H 1 0.599 0.000 . . . . . A 394 VAL HG21 . 34050 1 642 . 1 1 95 95 VAL HG22 H 1 0.599 0.000 . . . . . A 394 VAL HG22 . 34050 1 643 . 1 1 95 95 VAL HG23 H 1 0.599 0.000 . . . . . A 394 VAL HG23 . 34050 1 644 . 1 1 95 95 VAL N N 15 121.262 0.000 . . . . . A 394 VAL N . 34050 1 645 . 1 1 96 96 ILE H H 1 8.441 0.001 . . . . . A 395 ILE H . 34050 1 646 . 1 1 96 96 ILE HA H 1 3.405 0.005 . . . . . A 395 ILE HA . 34050 1 647 . 1 1 96 96 ILE HB H 1 1.960 0.002 . . . . . A 395 ILE HB . 34050 1 648 . 1 1 96 96 ILE HG12 H 1 1.621 0.000 . . . . . A 395 ILE HG12 . 34050 1 649 . 1 1 96 96 ILE HG13 H 1 0.941 0.000 . . . . . A 395 ILE HG13 . 34050 1 650 . 1 1 96 96 ILE HG21 H 1 0.733 0.000 . . . . . A 395 ILE HG21 . 34050 1 651 . 1 1 96 96 ILE HG22 H 1 0.733 0.000 . . . . . A 395 ILE HG22 . 34050 1 652 . 1 1 96 96 ILE HG23 H 1 0.733 0.000 . . . . . A 395 ILE HG23 . 34050 1 653 . 1 1 96 96 ILE HD11 H 1 0.682 0.000 . . . . . A 395 ILE HD11 . 34050 1 654 . 1 1 96 96 ILE HD12 H 1 0.682 0.000 . . . . . A 395 ILE HD12 . 34050 1 655 . 1 1 96 96 ILE HD13 H 1 0.682 0.000 . . . . . A 395 ILE HD13 . 34050 1 656 . 1 1 96 96 ILE N N 15 119.013 0.000 . . . . . A 395 ILE N . 34050 1 657 . 1 1 97 97 LYS H H 1 8.157 0.002 . . . . . A 396 LYS H . 34050 1 658 . 1 1 97 97 LYS HA H 1 3.155 0.005 . . . . . A 396 LYS HA . 34050 1 659 . 1 1 97 97 LYS HB2 H 1 1.723 0.000 . . . . . A 396 LYS HB2 . 34050 1 660 . 1 1 97 97 LYS HB3 H 1 1.723 0.000 . . . . . A 396 LYS HB3 . 34050 1 661 . 1 1 97 97 LYS HG2 H 1 1.069 0.000 . . . . . A 396 LYS HG2 . 34050 1 662 . 1 1 97 97 LYS HG3 H 1 1.069 0.000 . . . . . A 396 LYS HG3 . 34050 1 663 . 1 1 97 97 LYS HD2 H 1 1.576 0.000 . . . . . A 396 LYS HD2 . 34050 1 664 . 1 1 97 97 LYS HE3 H 1 2.839 0.002 . . . . . A 396 LYS HE3 . 34050 1 665 . 1 1 97 97 LYS N N 15 121.262 0.000 . . . . . A 396 LYS N . 34050 1 666 . 1 1 98 98 GLY H H 1 7.398 0.002 . . . . . A 397 GLY H . 34050 1 667 . 1 1 98 98 GLY HA2 H 1 3.858 0.000 . . . . . A 397 GLY HA2 . 34050 1 668 . 1 1 98 98 GLY HA3 H 1 3.933 0.000 . . . . . A 397 GLY HA3 . 34050 1 669 . 1 1 98 98 GLY N N 15 102.702 0.000 . . . . . A 397 GLY N . 34050 1 670 . 1 1 99 99 ILE H H 1 7.457 0.002 . . . . . A 398 ILE H . 34050 1 671 . 1 1 99 99 ILE HA H 1 3.794 0.008 . . . . . A 398 ILE HA . 34050 1 672 . 1 1 99 99 ILE HB H 1 1.765 0.000 . . . . . A 398 ILE HB . 34050 1 673 . 1 1 99 99 ILE HG12 H 1 1.670 0.000 . . . . . A 398 ILE HG12 . 34050 1 674 . 1 1 99 99 ILE HG13 H 1 1.103 0.000 . . . . . A 398 ILE HG13 . 34050 1 675 . 1 1 99 99 ILE HG21 H 1 0.733 0.000 . . . . . A 398 ILE HG21 . 34050 1 676 . 1 1 99 99 ILE HG22 H 1 0.733 0.000 . . . . . A 398 ILE HG22 . 34050 1 677 . 1 1 99 99 ILE HG23 H 1 0.733 0.000 . . . . . A 398 ILE HG23 . 34050 1 678 . 1 1 99 99 ILE HD11 H 1 0.620 0.000 . . . . . A 398 ILE HD11 . 34050 1 679 . 1 1 99 99 ILE HD12 H 1 0.620 0.000 . . . . . A 398 ILE HD12 . 34050 1 680 . 1 1 99 99 ILE HD13 H 1 0.620 0.000 . . . . . A 398 ILE HD13 . 34050 1 681 . 1 1 99 99 ILE N N 15 120.419 0.000 . . . . . A 398 ILE N . 34050 1 682 . 1 1 100 100 VAL H H 1 8.690 0.003 . . . . . A 399 VAL H . 34050 1 683 . 1 1 100 100 VAL HA H 1 3.109 0.000 . . . . . A 399 VAL HA . 34050 1 684 . 1 1 100 100 VAL HB H 1 2.028 0.003 . . . . . A 399 VAL HB . 34050 1 685 . 1 1 100 100 VAL HG11 H 1 0.713 0.000 . . . . . A 399 VAL HG11 . 34050 1 686 . 1 1 100 100 VAL HG12 H 1 0.713 0.000 . . . . . A 399 VAL HG12 . 34050 1 687 . 1 1 100 100 VAL HG13 H 1 0.713 0.000 . . . . . A 399 VAL HG13 . 34050 1 688 . 1 1 100 100 VAL HG21 H 1 0.838 0.000 . . . . . A 399 VAL HG21 . 34050 1 689 . 1 1 100 100 VAL HG22 H 1 0.838 0.000 . . . . . A 399 VAL HG22 . 34050 1 690 . 1 1 100 100 VAL HG23 H 1 0.838 0.000 . . . . . A 399 VAL HG23 . 34050 1 691 . 1 1 100 100 VAL N N 15 122.950 0.000 . . . . . A 399 VAL N . 34050 1 692 . 1 1 101 101 ASP H H 1 7.935 0.001 . . . . . A 400 ASP H . 34050 1 693 . 1 1 101 101 ASP HA H 1 4.279 0.003 . . . . . A 400 ASP HA . 34050 1 694 . 1 1 101 101 ASP HB2 H 1 2.714 0.000 . . . . . A 400 ASP HB2 . 34050 1 695 . 1 1 101 101 ASP HB3 H 1 2.621 0.001 . . . . . A 400 ASP HB3 . 34050 1 696 . 1 1 101 101 ASP N N 15 117.606 0.000 . . . . . A 400 ASP N . 34050 1 697 . 1 1 102 102 GLN H H 1 7.436 0.002 . . . . . A 401 GLN H . 34050 1 698 . 1 1 102 102 GLN HA H 1 4.298 0.003 . . . . . A 401 GLN HA . 34050 1 699 . 1 1 102 102 GLN HB2 H 1 2.148 0.000 . . . . . A 401 GLN HB2 . 34050 1 700 . 1 1 102 102 GLN HB3 H 1 2.061 0.000 . . . . . A 401 GLN HB3 . 34050 1 701 . 1 1 102 102 GLN HG2 H 1 2.423 0.003 . . . . . A 401 GLN HG2 . 34050 1 702 . 1 1 102 102 GLN HG3 H 1 2.423 0.003 . . . . . A 401 GLN HG3 . 34050 1 703 . 1 1 102 102 GLN HE21 H 1 7.870 0.002 . . . . . A 401 GLN HE21 . 34050 1 704 . 1 1 102 102 GLN HE22 H 1 6.843 0.010 . . . . . A 401 GLN HE22 . 34050 1 705 . 1 1 102 102 GLN N N 15 115.919 0.000 . . . . . A 401 GLN N . 34050 1 706 . 1 1 102 102 GLN NE2 N 15 112.544 0.000 . . . . . A 401 GLN NE2 . 34050 1 707 . 1 1 103 103 GLU H H 1 8.888 0.001 . . . . . A 402 GLU H . 34050 1 708 . 1 1 103 103 GLU HB2 H 1 2.185 0.085 . . . . . A 402 GLU HB2 . 34050 1 709 . 1 1 103 103 GLU HB3 H 1 1.787 0.000 . . . . . A 402 GLU HB3 . 34050 1 710 . 1 1 103 103 GLU HG2 H 1 2.234 0.048 . . . . . A 402 GLU HG2 . 34050 1 711 . 1 1 103 103 GLU HG3 H 1 2.141 0.041 . . . . . A 402 GLU HG3 . 34050 1 712 . 1 1 103 103 GLU N N 15 114.513 0.000 . . . . . A 402 GLU N . 34050 1 713 . 1 1 104 104 GLY H H 1 8.161 0.001 . . . . . A 403 GLY H . 34050 1 714 . 1 1 104 104 GLY HA2 H 1 4.070 0.002 . . . . . A 403 GLY HA2 . 34050 1 715 . 1 1 104 104 GLY HA3 H 1 4.070 0.002 . . . . . A 403 GLY HA3 . 34050 1 716 . 1 1 104 104 GLY N N 15 110.013 0.000 . . . . . A 403 GLY N . 34050 1 717 . 1 1 105 105 VAL H H 1 8.570 0.002 . . . . . A 404 VAL H . 34050 1 718 . 1 1 105 105 VAL HA H 1 3.517 0.001 . . . . . A 404 VAL HA . 34050 1 719 . 1 1 105 105 VAL HB H 1 2.092 0.000 . . . . . A 404 VAL HB . 34050 1 720 . 1 1 105 105 VAL HG11 H 1 1.132 0.002 . . . . . A 404 VAL HG11 . 34050 1 721 . 1 1 105 105 VAL HG12 H 1 1.132 0.002 . . . . . A 404 VAL HG12 . 34050 1 722 . 1 1 105 105 VAL HG13 H 1 1.132 0.002 . . . . . A 404 VAL HG13 . 34050 1 723 . 1 1 105 105 VAL HG21 H 1 0.968 0.000 . . . . . A 404 VAL HG21 . 34050 1 724 . 1 1 105 105 VAL HG22 H 1 0.968 0.000 . . . . . A 404 VAL HG22 . 34050 1 725 . 1 1 105 105 VAL HG23 H 1 0.968 0.000 . . . . . A 404 VAL HG23 . 34050 1 726 . 1 1 105 105 VAL N N 15 117.044 0.000 . . . . . A 404 VAL N . 34050 1 727 . 1 1 106 106 ALA H H 1 8.956 0.004 . . . . . A 405 ALA H . 34050 1 728 . 1 1 106 106 ALA HA H 1 3.882 0.010 . . . . . A 405 ALA HA . 34050 1 729 . 1 1 106 106 ALA HB1 H 1 1.431 0.002 . . . . . A 405 ALA HB1 . 34050 1 730 . 1 1 106 106 ALA HB2 H 1 1.431 0.002 . . . . . A 405 ALA HB2 . 34050 1 731 . 1 1 106 106 ALA HB3 H 1 1.431 0.002 . . . . . A 405 ALA HB3 . 34050 1 732 . 1 1 106 106 ALA N N 15 122.950 0.000 . . . . . A 405 ALA N . 34050 1 733 . 1 1 107 107 THR H H 1 8.315 0.002 . . . . . A 406 THR H . 34050 1 734 . 1 1 107 107 THR HA H 1 3.824 0.008 . . . . . A 406 THR HA . 34050 1 735 . 1 1 107 107 THR HB H 1 3.682 0.002 . . . . . A 406 THR HB . 34050 1 736 . 1 1 107 107 THR HG21 H 1 1.052 0.001 . . . . . A 406 THR HG21 . 34050 1 737 . 1 1 107 107 THR HG22 H 1 1.052 0.001 . . . . . A 406 THR HG22 . 34050 1 738 . 1 1 107 107 THR HG23 H 1 1.052 0.001 . . . . . A 406 THR HG23 . 34050 1 739 . 1 1 107 107 THR N N 15 114.513 0.000 . . . . . A 406 THR N . 34050 1 740 . 1 1 108 108 ALA H H 1 7.542 0.002 . . . . . A 407 ALA H . 34050 1 741 . 1 1 108 108 ALA HA H 1 3.702 0.000 . . . . . A 407 ALA HA . 34050 1 742 . 1 1 108 108 ALA HB1 H 1 1.346 0.002 . . . . . A 407 ALA HB1 . 34050 1 743 . 1 1 108 108 ALA HB2 H 1 1.346 0.002 . . . . . A 407 ALA HB2 . 34050 1 744 . 1 1 108 108 ALA HB3 H 1 1.346 0.002 . . . . . A 407 ALA HB3 . 34050 1 745 . 1 1 108 108 ALA N N 15 123.512 0.000 . . . . . A 407 ALA N . 34050 1 746 . 1 1 109 109 TYR H H 1 8.882 0.001 . . . . . A 408 TYR H . 34050 1 747 . 1 1 109 109 TYR HA H 1 3.577 0.009 . . . . . A 408 TYR HA . 34050 1 748 . 1 1 109 109 TYR HB2 H 1 3.231 0.003 . . . . . A 408 TYR HB2 . 34050 1 749 . 1 1 109 109 TYR HB3 H 1 2.650 0.003 . . . . . A 408 TYR HB3 . 34050 1 750 . 1 1 109 109 TYR N N 15 119.294 0.000 . . . . . A 408 TYR N . 34050 1 751 . 1 1 110 110 THR H H 1 8.113 0.001 . . . . . A 409 THR H . 34050 1 752 . 1 1 110 110 THR HA H 1 3.545 0.006 . . . . . A 409 THR HA . 34050 1 753 . 1 1 110 110 THR HB H 1 4.175 0.000 . . . . . A 409 THR HB . 34050 1 754 . 1 1 110 110 THR HG21 H 1 1.217 0.000 . . . . . A 409 THR HG21 . 34050 1 755 . 1 1 110 110 THR HG22 H 1 1.217 0.000 . . . . . A 409 THR HG22 . 34050 1 756 . 1 1 110 110 THR HG23 H 1 1.217 0.000 . . . . . A 409 THR HG23 . 34050 1 757 . 1 1 110 110 THR N N 15 116.763 0.000 . . . . . A 409 THR N . 34050 1 758 . 1 1 111 111 LEU H H 1 8.310 0.003 . . . . . A 410 LEU H . 34050 1 759 . 1 1 111 111 LEU HA H 1 4.041 0.016 . . . . . A 410 LEU HA . 34050 1 760 . 1 1 111 111 LEU HB2 H 1 1.697 0.002 . . . . . A 410 LEU HB2 . 34050 1 761 . 1 1 111 111 LEU HB3 H 1 1.173 0.000 . . . . . A 410 LEU HB3 . 34050 1 762 . 1 1 111 111 LEU HG H 1 1.634 0.004 . . . . . A 410 LEU HG . 34050 1 763 . 1 1 111 111 LEU HD11 H 1 0.706 0.015 . . . . . A 410 LEU HD11 . 34050 1 764 . 1 1 111 111 LEU HD12 H 1 0.706 0.015 . . . . . A 410 LEU HD12 . 34050 1 765 . 1 1 111 111 LEU HD13 H 1 0.706 0.015 . . . . . A 410 LEU HD13 . 34050 1 766 . 1 1 111 111 LEU HD21 H 1 0.758 0.000 . . . . . A 410 LEU HD21 . 34050 1 767 . 1 1 111 111 LEU HD22 H 1 0.758 0.000 . . . . . A 410 LEU HD22 . 34050 1 768 . 1 1 111 111 LEU HD23 H 1 0.758 0.000 . . . . . A 410 LEU HD23 . 34050 1 769 . 1 1 111 111 LEU N N 15 121.825 0.000 . . . . . A 410 LEU N . 34050 1 770 . 1 1 112 112 GLY H H 1 8.745 0.003 . . . . . A 411 GLY H . 34050 1 771 . 1 1 112 112 GLY HA2 H 1 3.280 0.000 . . . . . A 411 GLY HA2 . 34050 1 772 . 1 1 112 112 GLY HA3 H 1 3.359 0.000 . . . . . A 411 GLY HA3 . 34050 1 773 . 1 1 112 112 GLY N N 15 108.326 0.000 . . . . . A 411 GLY N . 34050 1 774 . 1 1 113 113 MET H H 1 8.498 0.002 . . . . . A 412 MET H . 34050 1 775 . 1 1 113 113 MET HA H 1 3.847 0.002 . . . . . A 412 MET HA . 34050 1 776 . 1 1 113 113 MET HB2 H 1 2.014 0.000 . . . . . A 412 MET HB2 . 34050 1 777 . 1 1 113 113 MET HB3 H 1 1.615 0.007 . . . . . A 412 MET HB3 . 34050 1 778 . 1 1 113 113 MET HG2 H 1 1.652 0.000 . . . . . A 412 MET HG2 . 34050 1 779 . 1 1 113 113 MET N N 15 122.106 0.000 . . . . . A 412 MET N . 34050 1 780 . 1 1 114 114 MET H H 1 7.542 0.002 . . . . . A 413 MET H . 34050 1 781 . 1 1 114 114 MET HA H 1 4.045 0.000 . . . . . A 413 MET HA . 34050 1 782 . 1 1 114 114 MET HB2 H 1 2.175 0.001 . . . . . A 413 MET HB2 . 34050 1 783 . 1 1 114 114 MET HB3 H 1 2.036 0.007 . . . . . A 413 MET HB3 . 34050 1 784 . 1 1 114 114 MET HG2 H 1 2.812 0.000 . . . . . A 413 MET HG2 . 34050 1 785 . 1 1 114 114 MET HG3 H 1 2.512 0.000 . . . . . A 413 MET HG3 . 34050 1 786 . 1 1 114 114 MET N N 15 120.419 0.000 . . . . . A 413 MET N . 34050 1 787 . 1 1 115 115 LEU H H 1 8.346 0.003 . . . . . A 414 LEU H . 34050 1 788 . 1 1 115 115 LEU HA H 1 3.854 0.000 . . . . . A 414 LEU HA . 34050 1 789 . 1 1 115 115 LEU HB2 H 1 1.412 0.000 . . . . . A 414 LEU HB2 . 34050 1 790 . 1 1 115 115 LEU HB3 H 1 0.911 0.000 . . . . . A 414 LEU HB3 . 34050 1 791 . 1 1 115 115 LEU HG H 1 1.634 0.002 . . . . . A 414 LEU HG . 34050 1 792 . 1 1 115 115 LEU HD11 H 1 0.223 0.000 . . . . . A 414 LEU HD11 . 34050 1 793 . 1 1 115 115 LEU HD12 H 1 0.223 0.000 . . . . . A 414 LEU HD12 . 34050 1 794 . 1 1 115 115 LEU HD13 H 1 0.223 0.000 . . . . . A 414 LEU HD13 . 34050 1 795 . 1 1 115 115 LEU HD21 H 1 0.550 0.000 . . . . . A 414 LEU HD21 . 34050 1 796 . 1 1 115 115 LEU HD22 H 1 0.550 0.000 . . . . . A 414 LEU HD22 . 34050 1 797 . 1 1 115 115 LEU HD23 H 1 0.550 0.000 . . . . . A 414 LEU HD23 . 34050 1 798 . 1 1 115 115 LEU N N 15 116.200 0.000 . . . . . A 414 LEU N . 34050 1 799 . 1 1 116 116 SER H H 1 7.547 0.002 . . . . . A 415 SER H . 34050 1 800 . 1 1 116 116 SER HA H 1 4.356 0.002 . . . . . A 415 SER HA . 34050 1 801 . 1 1 116 116 SER HB2 H 1 4.144 0.000 . . . . . A 415 SER HB2 . 34050 1 802 . 1 1 116 116 SER HB3 H 1 3.582 0.000 . . . . . A 415 SER HB3 . 34050 1 803 . 1 1 116 116 SER N N 15 108.045 0.000 . . . . . A 415 SER N . 34050 1 804 . 1 1 117 117 GLY H H 1 7.511 0.005 . . . . . A 416 GLY H . 34050 1 805 . 1 1 117 117 GLY HA2 H 1 3.856 0.000 . . . . . A 416 GLY HA2 . 34050 1 806 . 1 1 117 117 GLY HA3 H 1 3.940 0.000 . . . . . A 416 GLY HA3 . 34050 1 807 . 1 1 117 117 GLY N N 15 111.138 0.000 . . . . . A 416 GLY N . 34050 1 808 . 1 1 118 118 GLN H H 1 9.121 0.003 . . . . . A 417 GLN H . 34050 1 809 . 1 1 118 118 GLN HA H 1 3.510 0.003 . . . . . A 417 GLN HA . 34050 1 810 . 1 1 118 118 GLN HB2 H 1 2.386 0.000 . . . . . A 417 GLN HB2 . 34050 1 811 . 1 1 118 118 GLN HB3 H 1 2.132 0.001 . . . . . A 417 GLN HB3 . 34050 1 812 . 1 1 118 118 GLN HG2 H 1 2.278 0.003 . . . . . A 417 GLN HG2 . 34050 1 813 . 1 1 118 118 GLN HG3 H 1 2.033 0.004 . . . . . A 417 GLN HG3 . 34050 1 814 . 1 1 118 118 GLN HE21 H 1 7.778 0.002 . . . . . A 417 GLN HE21 . 34050 1 815 . 1 1 118 118 GLN HE22 H 1 6.692 0.001 . . . . . A 417 GLN HE22 . 34050 1 816 . 1 1 118 118 GLN N N 15 113.388 0.000 . . . . . A 417 GLN N . 34050 1 817 . 1 1 118 118 GLN NE2 N 15 112.826 0.000 . . . . . A 417 GLN NE2 . 34050 1 818 . 1 1 119 119 ASN H H 1 7.205 0.003 . . . . . A 418 ASN H . 34050 1 819 . 1 1 119 119 ASN HB2 H 1 2.970 0.002 . . . . . A 418 ASN HB2 . 34050 1 820 . 1 1 119 119 ASN HB3 H 1 2.607 0.004 . . . . . A 418 ASN HB3 . 34050 1 821 . 1 1 119 119 ASN HD21 H 1 7.903 0.001 . . . . . A 418 ASN HD21 . 34050 1 822 . 1 1 119 119 ASN HD22 H 1 6.873 0.001 . . . . . A 418 ASN HD22 . 34050 1 823 . 1 1 119 119 ASN N N 15 118.169 0.000 . . . . . A 418 ASN N . 34050 1 824 . 1 1 119 119 ASN ND2 N 15 112.263 0.000 . . . . . A 418 ASN ND2 . 34050 1 825 . 1 1 120 120 TYR H H 1 7.877 0.004 . . . . . A 419 TYR H . 34050 1 826 . 1 1 120 120 TYR HA H 1 4.041 0.000 . . . . . A 419 TYR HA . 34050 1 827 . 1 1 120 120 TYR HB2 H 1 3.155 0.000 . . . . . A 419 TYR HB2 . 34050 1 828 . 1 1 120 120 TYR HB3 H 1 2.790 0.000 . . . . . A 419 TYR HB3 . 34050 1 829 . 1 1 120 120 TYR HD1 H 1 6.720 0.003 . . . . . A 419 TYR HD1 . 34050 1 830 . 1 1 120 120 TYR HD2 H 1 6.720 0.003 . . . . . A 419 TYR HD2 . 34050 1 831 . 1 1 120 120 TYR HE1 H 1 6.710 0.000 . . . . . A 419 TYR HE1 . 34050 1 832 . 1 1 120 120 TYR HE2 H 1 6.710 0.000 . . . . . A 419 TYR HE2 . 34050 1 833 . 1 1 120 120 TYR N N 15 125.199 0.000 . . . . . A 419 TYR N . 34050 1 834 . 1 1 121 121 GLN H H 1 9.294 0.001 . . . . . A 420 GLN H . 34050 1 835 . 1 1 121 121 GLN HA H 1 3.391 0.000 . . . . . A 420 GLN HA . 34050 1 836 . 1 1 121 121 GLN HB2 H 1 2.109 0.000 . . . . . A 420 GLN HB2 . 34050 1 837 . 1 1 121 121 GLN HB3 H 1 2.039 0.000 . . . . . A 420 GLN HB3 . 34050 1 838 . 1 1 121 121 GLN HG2 H 1 2.558 0.000 . . . . . A 420 GLN HG2 . 34050 1 839 . 1 1 121 121 GLN HG3 H 1 2.460 0.000 . . . . . A 420 GLN HG3 . 34050 1 840 . 1 1 121 121 GLN HE21 H 1 8.097 0.002 . . . . . A 420 GLN HE21 . 34050 1 841 . 1 1 121 121 GLN HE22 H 1 6.906 0.001 . . . . . A 420 GLN HE22 . 34050 1 842 . 1 1 121 121 GLN N N 15 120.981 0.000 . . . . . A 420 GLN N . 34050 1 843 . 1 1 121 121 GLN NE2 N 15 113.388 0.000 . . . . . A 420 GLN NE2 . 34050 1 844 . 1 1 122 122 LEU H H 1 7.117 0.001 . . . . . A 421 LEU H . 34050 1 845 . 1 1 122 122 LEU HA H 1 4.005 0.000 . . . . . A 421 LEU HA . 34050 1 846 . 1 1 122 122 LEU HB2 H 1 1.443 0.015 . . . . . A 421 LEU HB2 . 34050 1 847 . 1 1 122 122 LEU HB3 H 1 1.443 0.015 . . . . . A 421 LEU HB3 . 34050 1 848 . 1 1 122 122 LEU HG H 1 1.283 0.000 . . . . . A 421 LEU HG . 34050 1 849 . 1 1 122 122 LEU HD11 H 1 0.891 0.000 . . . . . A 421 LEU HD11 . 34050 1 850 . 1 1 122 122 LEU HD12 H 1 0.891 0.000 . . . . . A 421 LEU HD12 . 34050 1 851 . 1 1 122 122 LEU HD13 H 1 0.891 0.000 . . . . . A 421 LEU HD13 . 34050 1 852 . 1 1 122 122 LEU HD21 H 1 0.852 0.000 . . . . . A 421 LEU HD21 . 34050 1 853 . 1 1 122 122 LEU HD22 H 1 0.852 0.000 . . . . . A 421 LEU HD22 . 34050 1 854 . 1 1 122 122 LEU HD23 H 1 0.852 0.000 . . . . . A 421 LEU HD23 . 34050 1 855 . 1 1 122 122 LEU N N 15 119.575 0.000 . . . . . A 421 LEU N . 34050 1 856 . 1 1 123 123 VAL H H 1 8.144 0.003 . . . . . A 422 VAL H . 34050 1 857 . 1 1 123 123 VAL HA H 1 3.073 0.000 . . . . . A 422 VAL HA . 34050 1 858 . 1 1 123 123 VAL HB H 1 1.716 0.002 . . . . . A 422 VAL HB . 34050 1 859 . 1 1 123 123 VAL HG11 H 1 0.526 0.000 . . . . . A 422 VAL HG11 . 34050 1 860 . 1 1 123 123 VAL HG12 H 1 0.526 0.000 . . . . . A 422 VAL HG12 . 34050 1 861 . 1 1 123 123 VAL HG13 H 1 0.526 0.000 . . . . . A 422 VAL HG13 . 34050 1 862 . 1 1 123 123 VAL HG21 H 1 0.523 0.000 . . . . . A 422 VAL HG21 . 34050 1 863 . 1 1 123 123 VAL HG22 H 1 0.523 0.000 . . . . . A 422 VAL HG22 . 34050 1 864 . 1 1 123 123 VAL HG23 H 1 0.523 0.000 . . . . . A 422 VAL HG23 . 34050 1 865 . 1 1 123 123 VAL N N 15 117.325 0.000 . . . . . A 422 VAL N . 34050 1 866 . 1 1 124 124 SER H H 1 8.630 0.001 . . . . . A 423 SER H . 34050 1 867 . 1 1 124 124 SER HA H 1 3.511 0.005 . . . . . A 423 SER HA . 34050 1 868 . 1 1 124 124 SER HB2 H 1 3.492 0.002 . . . . . A 423 SER HB2 . 34050 1 869 . 1 1 124 124 SER HB3 H 1 3.083 0.000 . . . . . A 423 SER HB3 . 34050 1 870 . 1 1 124 124 SER N N 15 114.513 0.000 . . . . . A 423 SER N . 34050 1 871 . 1 1 125 125 GLY H H 1 7.149 0.004 . . . . . A 424 GLY H . 34050 1 872 . 1 1 125 125 GLY HA2 H 1 3.733 0.003 . . . . . A 424 GLY HA2 . 34050 1 873 . 1 1 125 125 GLY HA3 H 1 3.898 0.006 . . . . . A 424 GLY HA3 . 34050 1 874 . 1 1 125 125 GLY N N 15 109.451 0.000 . . . . . A 424 GLY N . 34050 1 875 . 1 1 126 126 ILE H H 1 7.487 0.004 . . . . . A 425 ILE H . 34050 1 876 . 1 1 126 126 ILE HA H 1 3.664 0.015 . . . . . A 425 ILE HA . 34050 1 877 . 1 1 126 126 ILE HB H 1 1.728 0.000 . . . . . A 425 ILE HB . 34050 1 878 . 1 1 126 126 ILE HG12 H 1 1.836 0.000 . . . . . A 425 ILE HG12 . 34050 1 879 . 1 1 126 126 ILE HG13 H 1 0.891 0.000 . . . . . A 425 ILE HG13 . 34050 1 880 . 1 1 126 126 ILE HG21 H 1 1.005 0.000 . . . . . A 425 ILE HG21 . 34050 1 881 . 1 1 126 126 ILE HG22 H 1 1.005 0.000 . . . . . A 425 ILE HG22 . 34050 1 882 . 1 1 126 126 ILE HG23 H 1 1.005 0.000 . . . . . A 425 ILE HG23 . 34050 1 883 . 1 1 126 126 ILE HD11 H 1 0.685 0.000 . . . . . A 425 ILE HD11 . 34050 1 884 . 1 1 126 126 ILE HD12 H 1 0.685 0.000 . . . . . A 425 ILE HD12 . 34050 1 885 . 1 1 126 126 ILE HD13 H 1 0.685 0.000 . . . . . A 425 ILE HD13 . 34050 1 886 . 1 1 126 126 ILE N N 15 121.825 0.000 . . . . . A 425 ILE N . 34050 1 887 . 1 1 127 127 ILE H H 1 8.532 0.002 . . . . . A 426 ILE H . 34050 1 888 . 1 1 127 127 ILE HA H 1 3.675 0.001 . . . . . A 426 ILE HA . 34050 1 889 . 1 1 127 127 ILE HB H 1 2.051 0.000 . . . . . A 426 ILE HB . 34050 1 890 . 1 1 127 127 ILE HG12 H 1 1.524 0.000 . . . . . A 426 ILE HG12 . 34050 1 891 . 1 1 127 127 ILE HG13 H 1 1.457 0.000 . . . . . A 426 ILE HG13 . 34050 1 892 . 1 1 127 127 ILE HG21 H 1 0.959 0.000 . . . . . A 426 ILE HG21 . 34050 1 893 . 1 1 127 127 ILE HG22 H 1 0.959 0.000 . . . . . A 426 ILE HG22 . 34050 1 894 . 1 1 127 127 ILE HG23 H 1 0.959 0.000 . . . . . A 426 ILE HG23 . 34050 1 895 . 1 1 127 127 ILE HD11 H 1 0.702 0.000 . . . . . A 426 ILE HD11 . 34050 1 896 . 1 1 127 127 ILE HD12 H 1 0.702 0.000 . . . . . A 426 ILE HD12 . 34050 1 897 . 1 1 127 127 ILE HD13 H 1 0.702 0.000 . . . . . A 426 ILE HD13 . 34050 1 898 . 1 1 127 127 ILE N N 15 118.731 0.000 . . . . . A 426 ILE N . 34050 1 899 . 1 1 128 128 ARG H H 1 7.956 0.002 . . . . . A 427 ARG H . 34050 1 900 . 1 1 128 128 ARG HA H 1 3.889 0.003 . . . . . A 427 ARG HA . 34050 1 901 . 1 1 128 128 ARG HB2 H 1 2.018 0.002 . . . . . A 427 ARG HB2 . 34050 1 902 . 1 1 128 128 ARG HB3 H 1 1.792 0.003 . . . . . A 427 ARG HB3 . 34050 1 903 . 1 1 128 128 ARG HG3 H 1 1.593 0.002 . . . . . A 427 ARG HG3 . 34050 1 904 . 1 1 128 128 ARG HD2 H 1 3.189 0.000 . . . . . A 427 ARG HD2 . 34050 1 905 . 1 1 128 128 ARG HD3 H 1 3.189 0.000 . . . . . A 427 ARG HD3 . 34050 1 906 . 1 1 128 128 ARG N N 15 119.013 0.000 . . . . . A 427 ARG N . 34050 1 907 . 1 1 129 129 GLY H H 1 7.167 0.009 . . . . . A 428 GLY H . 34050 1 908 . 1 1 129 129 GLY HA2 H 1 3.582 0.005 . . . . . A 428 GLY HA2 . 34050 1 909 . 1 1 129 129 GLY HA3 H 1 3.968 0.001 . . . . . A 428 GLY HA3 . 34050 1 910 . 1 1 129 129 GLY N N 15 102.139 0.000 . . . . . A 428 GLY N . 34050 1 911 . 1 1 130 130 TYR H H 1 7.962 0.002 . . . . . A 429 TYR H . 34050 1 912 . 1 1 130 130 TYR HA H 1 4.865 0.001 . . . . . A 429 TYR HA . 34050 1 913 . 1 1 130 130 TYR HB2 H 1 3.494 0.016 . . . . . A 429 TYR HB2 . 34050 1 914 . 1 1 130 130 TYR HB3 H 1 2.583 0.001 . . . . . A 429 TYR HB3 . 34050 1 915 . 1 1 130 130 TYR HD1 H 1 7.010 0.000 . . . . . A 429 TYR HD1 . 34050 1 916 . 1 1 130 130 TYR HD2 H 1 7.010 0.000 . . . . . A 429 TYR HD2 . 34050 1 917 . 1 1 130 130 TYR HE1 H 1 6.665 0.000 . . . . . A 429 TYR HE1 . 34050 1 918 . 1 1 130 130 TYR HE2 H 1 6.665 0.000 . . . . . A 429 TYR HE2 . 34050 1 919 . 1 1 130 130 TYR N N 15 118.169 0.000 . . . . . A 429 TYR N . 34050 1 920 . 1 1 131 131 LEU H H 1 7.151 0.004 . . . . . A 430 LEU H . 34050 1 921 . 1 1 131 131 LEU HA H 1 4.472 0.000 . . . . . A 430 LEU HA . 34050 1 922 . 1 1 131 131 LEU HB2 H 1 1.900 0.000 . . . . . A 430 LEU HB2 . 34050 1 923 . 1 1 131 131 LEU HB3 H 1 1.198 0.000 . . . . . A 430 LEU HB3 . 34050 1 924 . 1 1 131 131 LEU HG H 1 2.266 0.000 . . . . . A 430 LEU HG . 34050 1 925 . 1 1 131 131 LEU HD11 H 1 0.970 0.000 . . . . . A 430 LEU HD11 . 34050 1 926 . 1 1 131 131 LEU HD12 H 1 0.970 0.000 . . . . . A 430 LEU HD12 . 34050 1 927 . 1 1 131 131 LEU HD13 H 1 0.970 0.000 . . . . . A 430 LEU HD13 . 34050 1 928 . 1 1 131 131 LEU HD21 H 1 1.086 0.000 . . . . . A 430 LEU HD21 . 34050 1 929 . 1 1 131 131 LEU HD22 H 1 1.086 0.000 . . . . . A 430 LEU HD22 . 34050 1 930 . 1 1 131 131 LEU HD23 H 1 1.086 0.000 . . . . . A 430 LEU HD23 . 34050 1 931 . 1 1 131 131 LEU N N 15 120.419 0.000 . . . . . A 430 LEU N . 34050 1 932 . 1 1 132 132 PRO HB2 H 1 2.199 0.000 . . . . . A 431 PRO HB2 . 34050 1 933 . 1 1 132 132 PRO HB3 H 1 2.123 0.000 . . . . . A 431 PRO HB3 . 34050 1 934 . 1 1 132 132 PRO HG2 H 1 2.084 0.000 . . . . . A 431 PRO HG2 . 34050 1 935 . 1 1 132 132 PRO HG3 H 1 1.905 0.000 . . . . . A 431 PRO HG3 . 34050 1 936 . 1 1 132 132 PRO HD2 H 1 3.889 0.002 . . . . . A 431 PRO HD2 . 34050 1 937 . 1 1 132 132 PRO HD3 H 1 3.542 0.001 . . . . . A 431 PRO HD3 . 34050 1 938 . 1 1 133 133 GLY H H 1 7.504 0.000 . . . . . A 432 GLY H . 34050 1 939 . 1 1 133 133 GLY HA2 H 1 3.917 0.000 . . . . . A 432 GLY HA2 . 34050 1 940 . 1 1 133 133 GLY HA3 H 1 4.397 0.000 . . . . . A 432 GLY HA3 . 34050 1 941 . 1 1 133 133 GLY N N 15 108.045 0.000 . . . . . A 432 GLY N . 34050 1 942 . 1 1 134 134 GLN H H 1 8.660 0.001 . . . . . A 433 GLN H . 34050 1 943 . 1 1 134 134 GLN HA H 1 3.922 0.000 . . . . . A 433 GLN HA . 34050 1 944 . 1 1 134 134 GLN HB2 H 1 2.154 0.000 . . . . . A 433 GLN HB2 . 34050 1 945 . 1 1 134 134 GLN HB3 H 1 2.025 0.000 . . . . . A 433 GLN HB3 . 34050 1 946 . 1 1 134 134 GLN HG2 H 1 2.411 0.000 . . . . . A 433 GLN HG2 . 34050 1 947 . 1 1 134 134 GLN HG3 H 1 2.411 0.000 . . . . . A 433 GLN HG3 . 34050 1 948 . 1 1 134 134 GLN HE21 H 1 7.442 0.002 . . . . . A 433 GLN HE21 . 34050 1 949 . 1 1 134 134 GLN HE22 H 1 6.835 0.002 . . . . . A 433 GLN HE22 . 34050 1 950 . 1 1 134 134 GLN N N 15 120.700 0.000 . . . . . A 433 GLN N . 34050 1 951 . 1 1 134 134 GLN NE2 N 15 112.544 0.000 . . . . . A 433 GLN NE2 . 34050 1 952 . 1 1 135 135 ALA HA H 1 4.082 0.000 . . . . . A 434 ALA HA . 34050 1 953 . 1 1 135 135 ALA HB1 H 1 1.406 0.000 . . . . . A 434 ALA HB1 . 34050 1 954 . 1 1 135 135 ALA HB2 H 1 1.406 0.000 . . . . . A 434 ALA HB2 . 34050 1 955 . 1 1 135 135 ALA HB3 H 1 1.406 0.000 . . . . . A 434 ALA HB3 . 34050 1 956 . 1 1 136 136 VAL H H 1 7.337 0.001 . . . . . A 435 VAL H . 34050 1 957 . 1 1 136 136 VAL HA H 1 3.461 0.003 . . . . . A 435 VAL HA . 34050 1 958 . 1 1 136 136 VAL HB H 1 2.098 0.002 . . . . . A 435 VAL HB . 34050 1 959 . 1 1 136 136 VAL HG11 H 1 1.057 0.000 . . . . . A 435 VAL HG11 . 34050 1 960 . 1 1 136 136 VAL HG12 H 1 1.057 0.000 . . . . . A 435 VAL HG12 . 34050 1 961 . 1 1 136 136 VAL HG13 H 1 1.057 0.000 . . . . . A 435 VAL HG13 . 34050 1 962 . 1 1 136 136 VAL HG21 H 1 0.831 0.000 . . . . . A 435 VAL HG21 . 34050 1 963 . 1 1 136 136 VAL HG22 H 1 0.831 0.000 . . . . . A 435 VAL HG22 . 34050 1 964 . 1 1 136 136 VAL HG23 H 1 0.831 0.000 . . . . . A 435 VAL HG23 . 34050 1 965 . 1 1 136 136 VAL N N 15 116.763 0.000 . . . . . A 435 VAL N . 34050 1 966 . 1 1 137 137 VAL H H 1 7.529 0.001 . . . . . A 436 VAL H . 34050 1 967 . 1 1 137 137 VAL HA H 1 3.360 0.002 . . . . . A 436 VAL HA . 34050 1 968 . 1 1 137 137 VAL HB H 1 2.170 0.001 . . . . . A 436 VAL HB . 34050 1 969 . 1 1 137 137 VAL HG11 H 1 1.072 0.004 . . . . . A 436 VAL HG11 . 34050 1 970 . 1 1 137 137 VAL HG12 H 1 1.072 0.004 . . . . . A 436 VAL HG12 . 34050 1 971 . 1 1 137 137 VAL HG13 H 1 1.072 0.004 . . . . . A 436 VAL HG13 . 34050 1 972 . 1 1 137 137 VAL HG21 H 1 0.912 0.005 . . . . . A 436 VAL HG21 . 34050 1 973 . 1 1 137 137 VAL HG22 H 1 0.912 0.005 . . . . . A 436 VAL HG22 . 34050 1 974 . 1 1 137 137 VAL HG23 H 1 0.912 0.005 . . . . . A 436 VAL HG23 . 34050 1 975 . 1 1 137 137 VAL N N 15 118.731 0.000 . . . . . A 436 VAL N . 34050 1 976 . 1 1 138 138 THR H H 1 8.473 0.002 . . . . . A 437 THR H . 34050 1 977 . 1 1 138 138 THR HA H 1 3.876 0.008 . . . . . A 437 THR HA . 34050 1 978 . 1 1 138 138 THR HB H 1 4.051 0.003 . . . . . A 437 THR HB . 34050 1 979 . 1 1 138 138 THR HG21 H 1 1.207 0.000 . . . . . A 437 THR HG21 . 34050 1 980 . 1 1 138 138 THR HG22 H 1 1.207 0.000 . . . . . A 437 THR HG22 . 34050 1 981 . 1 1 138 138 THR HG23 H 1 1.207 0.000 . . . . . A 437 THR HG23 . 34050 1 982 . 1 1 138 138 THR N N 15 113.107 0.000 . . . . . A 437 THR N . 34050 1 983 . 1 1 139 139 ALA H H 1 7.482 0.004 . . . . . A 438 ALA H . 34050 1 984 . 1 1 139 139 ALA HA H 1 4.125 0.004 . . . . . A 438 ALA HA . 34050 1 985 . 1 1 139 139 ALA HB1 H 1 1.494 0.000 . . . . . A 438 ALA HB1 . 34050 1 986 . 1 1 139 139 ALA HB2 H 1 1.494 0.000 . . . . . A 438 ALA HB2 . 34050 1 987 . 1 1 139 139 ALA HB3 H 1 1.494 0.000 . . . . . A 438 ALA HB3 . 34050 1 988 . 1 1 139 139 ALA N N 15 123.512 0.000 . . . . . A 438 ALA N . 34050 1 989 . 1 1 140 140 LEU H H 1 8.704 0.001 . . . . . A 439 LEU H . 34050 1 990 . 1 1 140 140 LEU HA H 1 3.847 0.011 . . . . . A 439 LEU HA . 34050 1 991 . 1 1 140 140 LEU HB2 H 1 1.938 0.001 . . . . . A 439 LEU HB2 . 34050 1 992 . 1 1 140 140 LEU HB3 H 1 1.223 0.005 . . . . . A 439 LEU HB3 . 34050 1 993 . 1 1 140 140 LEU HG H 1 0.567 0.000 . . . . . A 439 LEU HG . 34050 1 994 . 1 1 140 140 LEU HD11 H 1 0.959 0.000 . . . . . A 439 LEU HD11 . 34050 1 995 . 1 1 140 140 LEU HD12 H 1 0.959 0.000 . . . . . A 439 LEU HD12 . 34050 1 996 . 1 1 140 140 LEU HD13 H 1 0.959 0.000 . . . . . A 439 LEU HD13 . 34050 1 997 . 1 1 140 140 LEU HD21 H 1 0.401 0.000 . . . . . A 439 LEU HD21 . 34050 1 998 . 1 1 140 140 LEU HD22 H 1 0.401 0.000 . . . . . A 439 LEU HD22 . 34050 1 999 . 1 1 140 140 LEU HD23 H 1 0.401 0.000 . . . . . A 439 LEU HD23 . 34050 1 1000 . 1 1 140 140 LEU N N 15 118.731 0.000 . . . . . A 439 LEU N . 34050 1 1001 . 1 1 141 141 GLN H H 1 8.380 0.003 . . . . . A 440 GLN H . 34050 1 1002 . 1 1 141 141 GLN HA H 1 3.662 0.005 . . . . . A 440 GLN HA . 34050 1 1003 . 1 1 141 141 GLN HB2 H 1 2.241 0.000 . . . . . A 440 GLN HB2 . 34050 1 1004 . 1 1 141 141 GLN HB3 H 1 2.066 0.004 . . . . . A 440 GLN HB3 . 34050 1 1005 . 1 1 141 141 GLN HG2 H 1 2.466 0.005 . . . . . A 440 GLN HG2 . 34050 1 1006 . 1 1 141 141 GLN HG3 H 1 2.324 0.005 . . . . . A 440 GLN HG3 . 34050 1 1007 . 1 1 141 141 GLN HE21 H 1 8.021 0.000 . . . . . A 440 GLN HE21 . 34050 1 1008 . 1 1 141 141 GLN HE22 H 1 6.656 0.002 . . . . . A 440 GLN HE22 . 34050 1 1009 . 1 1 141 141 GLN N N 15 119.013 0.000 . . . . . A 440 GLN N . 34050 1 1010 . 1 1 141 141 GLN NE2 N 15 114.794 0.000 . . . . . A 440 GLN NE2 . 34050 1 1011 . 1 1 142 142 GLN H H 1 7.699 0.003 . . . . . A 441 GLN H . 34050 1 1012 . 1 1 142 142 GLN HA H 1 3.970 0.004 . . . . . A 441 GLN HA . 34050 1 1013 . 1 1 142 142 GLN HB2 H 1 2.081 0.000 . . . . . A 441 GLN HB2 . 34050 1 1014 . 1 1 142 142 GLN HB3 H 1 2.004 0.000 . . . . . A 441 GLN HB3 . 34050 1 1015 . 1 1 142 142 GLN HG2 H 1 2.501 0.001 . . . . . A 441 GLN HG2 . 34050 1 1016 . 1 1 142 142 GLN HG3 H 1 2.305 0.003 . . . . . A 441 GLN HG3 . 34050 1 1017 . 1 1 142 142 GLN HE21 H 1 7.337 0.002 . . . . . A 441 GLN HE21 . 34050 1 1018 . 1 1 142 142 GLN HE22 H 1 6.711 0.001 . . . . . A 441 GLN HE22 . 34050 1 1019 . 1 1 142 142 GLN N N 15 115.638 0.000 . . . . . A 441 GLN N . 34050 1 1020 . 1 1 142 142 GLN NE2 N 15 111.138 0.000 . . . . . A 441 GLN NE2 . 34050 1 1021 . 1 1 143 143 ARG H H 1 6.856 0.002 . . . . . A 442 ARG H . 34050 1 1022 . 1 1 143 143 ARG HA H 1 3.702 0.000 . . . . . A 442 ARG HA . 34050 1 1023 . 1 1 143 143 ARG HB2 H 1 1.667 0.000 . . . . . A 442 ARG HB2 . 34050 1 1024 . 1 1 143 143 ARG HB3 H 1 1.430 0.000 . . . . . A 442 ARG HB3 . 34050 1 1025 . 1 1 143 143 ARG HG2 H 1 1.579 0.000 . . . . . A 442 ARG HG2 . 34050 1 1026 . 1 1 143 143 ARG HG3 H 1 1.289 0.000 . . . . . A 442 ARG HG3 . 34050 1 1027 . 1 1 143 143 ARG HD2 H 1 3.029 0.000 . . . . . A 442 ARG HD2 . 34050 1 1028 . 1 1 143 143 ARG HD3 H 1 2.993 0.000 . . . . . A 442 ARG HD3 . 34050 1 1029 . 1 1 143 143 ARG N N 15 116.763 0.000 . . . . . A 442 ARG N . 34050 1 1030 . 1 1 144 144 LEU H H 1 8.103 0.002 . . . . . A 443 LEU H . 34050 1 1031 . 1 1 144 144 LEU HA H 1 3.685 0.003 . . . . . A 443 LEU HA . 34050 1 1032 . 1 1 144 144 LEU HB2 H 1 1.803 0.000 . . . . . A 443 LEU HB2 . 34050 1 1033 . 1 1 144 144 LEU HB3 H 1 1.205 0.001 . . . . . A 443 LEU HB3 . 34050 1 1034 . 1 1 144 144 LEU HG H 1 1.576 0.002 . . . . . A 443 LEU HG . 34050 1 1035 . 1 1 144 144 LEU HD11 H 1 0.911 0.000 . . . . . A 443 LEU HD11 . 34050 1 1036 . 1 1 144 144 LEU HD12 H 1 0.911 0.000 . . . . . A 443 LEU HD12 . 34050 1 1037 . 1 1 144 144 LEU HD13 H 1 0.911 0.000 . . . . . A 443 LEU HD13 . 34050 1 1038 . 1 1 144 144 LEU HD21 H 1 0.897 0.000 . . . . . A 443 LEU HD21 . 34050 1 1039 . 1 1 144 144 LEU HD22 H 1 0.897 0.000 . . . . . A 443 LEU HD22 . 34050 1 1040 . 1 1 144 144 LEU HD23 H 1 0.897 0.000 . . . . . A 443 LEU HD23 . 34050 1 1041 . 1 1 144 144 LEU N N 15 119.294 0.000 . . . . . A 443 LEU N . 34050 1 1042 . 1 1 145 145 ASP H H 1 8.832 0.001 . . . . . A 444 ASP H . 34050 1 1043 . 1 1 145 145 ASP HA H 1 4.336 0.001 . . . . . A 444 ASP HA . 34050 1 1044 . 1 1 145 145 ASP HB2 H 1 2.682 0.002 . . . . . A 444 ASP HB2 . 34050 1 1045 . 1 1 145 145 ASP HB3 H 1 2.579 0.003 . . . . . A 444 ASP HB3 . 34050 1 1046 . 1 1 145 145 ASP N N 15 120.137 0.000 . . . . . A 444 ASP N . 34050 1 1047 . 1 1 146 146 GLN H H 1 6.951 0.002 . . . . . A 445 GLN H . 34050 1 1048 . 1 1 146 146 GLN HA H 1 4.167 0.002 . . . . . A 445 GLN HA . 34050 1 1049 . 1 1 146 146 GLN HB2 H 1 2.184 0.001 . . . . . A 445 GLN HB2 . 34050 1 1050 . 1 1 146 146 GLN HB3 H 1 2.026 0.004 . . . . . A 445 GLN HB3 . 34050 1 1051 . 1 1 146 146 GLN HG2 H 1 2.518 0.002 . . . . . A 445 GLN HG2 . 34050 1 1052 . 1 1 146 146 GLN HG3 H 1 2.401 0.000 . . . . . A 445 GLN HG3 . 34050 1 1053 . 1 1 146 146 GLN HE21 H 1 7.438 0.002 . . . . . A 445 GLN HE21 . 34050 1 1054 . 1 1 146 146 GLN HE22 H 1 6.747 0.001 . . . . . A 445 GLN HE22 . 34050 1 1055 . 1 1 146 146 GLN N N 15 114.513 0.000 . . . . . A 445 GLN N . 34050 1 1056 . 1 1 146 146 GLN NE2 N 15 111.982 0.000 . . . . . A 445 GLN NE2 . 34050 1 1057 . 1 1 147 147 GLU H H 1 7.196 0.001 . . . . . A 446 GLU H . 34050 1 1058 . 1 1 147 147 GLU HB2 H 1 2.206 0.000 . . . . . A 446 GLU HB2 . 34050 1 1059 . 1 1 147 147 GLU HB3 H 1 2.033 0.001 . . . . . A 446 GLU HB3 . 34050 1 1060 . 1 1 147 147 GLU HG2 H 1 2.544 0.000 . . . . . A 446 GLU HG2 . 34050 1 1061 . 1 1 147 147 GLU HG3 H 1 2.405 0.000 . . . . . A 446 GLU HG3 . 34050 1 1062 . 1 1 147 147 GLU N N 15 117.888 0.000 . . . . . A 446 GLU N . 34050 1 1063 . 1 1 148 148 ILE H H 1 8.716 0.003 . . . . . A 447 ILE H . 34050 1 1064 . 1 1 148 148 ILE HA H 1 3.923 0.001 . . . . . A 447 ILE HA . 34050 1 1065 . 1 1 148 148 ILE HB H 1 1.861 0.001 . . . . . A 447 ILE HB . 34050 1 1066 . 1 1 148 148 ILE HG12 H 1 1.444 0.000 . . . . . A 447 ILE HG12 . 34050 1 1067 . 1 1 148 148 ILE HG13 H 1 1.250 0.000 . . . . . A 447 ILE HG13 . 34050 1 1068 . 1 1 148 148 ILE HG21 H 1 0.953 0.000 . . . . . A 447 ILE HG21 . 34050 1 1069 . 1 1 148 148 ILE HG22 H 1 0.953 0.000 . . . . . A 447 ILE HG22 . 34050 1 1070 . 1 1 148 148 ILE HG23 H 1 0.953 0.000 . . . . . A 447 ILE HG23 . 34050 1 1071 . 1 1 148 148 ILE HD11 H 1 0.865 0.000 . . . . . A 447 ILE HD11 . 34050 1 1072 . 1 1 148 148 ILE HD12 H 1 0.865 0.000 . . . . . A 447 ILE HD12 . 34050 1 1073 . 1 1 148 148 ILE HD13 H 1 0.865 0.000 . . . . . A 447 ILE HD13 . 34050 1 1074 . 1 1 148 148 ILE N N 15 116.482 0.000 . . . . . A 447 ILE N . 34050 1 1075 . 1 1 149 149 ASP H H 1 7.267 0.001 . . . . . A 448 ASP H . 34050 1 1076 . 1 1 149 149 ASP HA H 1 4.617 0.000 . . . . . A 448 ASP HA . 34050 1 1077 . 1 1 149 149 ASP HB2 H 1 3.067 0.000 . . . . . A 448 ASP HB2 . 34050 1 1078 . 1 1 149 149 ASP HB3 H 1 2.954 0.000 . . . . . A 448 ASP HB3 . 34050 1 1079 . 1 1 149 149 ASP N N 15 115.357 0.000 . . . . . A 448 ASP N . 34050 1 1080 . 1 1 150 150 ASP H H 1 8.734 0.001 . . . . . A 449 ASP H . 34050 1 1081 . 1 1 150 150 ASP HA H 1 4.241 0.000 . . . . . A 449 ASP HA . 34050 1 1082 . 1 1 150 150 ASP HB2 H 1 2.674 0.000 . . . . . A 449 ASP HB2 . 34050 1 1083 . 1 1 150 150 ASP HB3 H 1 2.578 0.000 . . . . . A 449 ASP HB3 . 34050 1 1084 . 1 1 150 150 ASP N N 15 118.731 0.000 . . . . . A 449 ASP N . 34050 1 1085 . 1 1 151 151 GLN H H 1 8.352 0.002 . . . . . A 450 GLN H . 34050 1 1086 . 1 1 151 151 GLN HA H 1 3.926 0.000 . . . . . A 450 GLN HA . 34050 1 1087 . 1 1 151 151 GLN HB2 H 1 2.118 0.008 . . . . . A 450 GLN HB2 . 34050 1 1088 . 1 1 151 151 GLN HB3 H 1 1.980 0.002 . . . . . A 450 GLN HB3 . 34050 1 1089 . 1 1 151 151 GLN HG2 H 1 2.379 0.005 . . . . . A 450 GLN HG2 . 34050 1 1090 . 1 1 151 151 GLN HG3 H 1 2.318 0.002 . . . . . A 450 GLN HG3 . 34050 1 1091 . 1 1 151 151 GLN HE21 H 1 7.741 0.001 . . . . . A 450 GLN HE21 . 34050 1 1092 . 1 1 151 151 GLN HE22 H 1 6.787 0.001 . . . . . A 450 GLN HE22 . 34050 1 1093 . 1 1 151 151 GLN N N 15 122.668 0.000 . . . . . A 450 GLN N . 34050 1 1094 . 1 1 151 151 GLN NE2 N 15 112.826 0.000 . . . . . A 450 GLN NE2 . 34050 1 1095 . 1 1 152 152 THR H H 1 8.563 0.002 . . . . . A 451 THR H . 34050 1 1096 . 1 1 152 152 THR HA H 1 4.023 0.000 . . . . . A 451 THR HA . 34050 1 1097 . 1 1 152 152 THR HB H 1 4.145 0.002 . . . . . A 451 THR HB . 34050 1 1098 . 1 1 152 152 THR HG21 H 1 1.340 0.000 . . . . . A 451 THR HG21 . 34050 1 1099 . 1 1 152 152 THR HG22 H 1 1.340 0.000 . . . . . A 451 THR HG22 . 34050 1 1100 . 1 1 152 152 THR HG23 H 1 1.340 0.000 . . . . . A 451 THR HG23 . 34050 1 1101 . 1 1 152 152 THR N N 15 116.200 0.000 . . . . . A 451 THR N . 34050 1 1102 . 1 1 153 153 ARG H H 1 8.099 0.001 . . . . . A 452 ARG H . 34050 1 1103 . 1 1 153 153 ARG HA H 1 3.623 0.000 . . . . . A 452 ARG HA . 34050 1 1104 . 1 1 153 153 ARG HB2 H 1 1.853 0.000 . . . . . A 452 ARG HB2 . 34050 1 1105 . 1 1 153 153 ARG HB3 H 1 1.549 0.000 . . . . . A 452 ARG HB3 . 34050 1 1106 . 1 1 153 153 ARG HG2 H 1 1.728 0.000 . . . . . A 452 ARG HG2 . 34050 1 1107 . 1 1 153 153 ARG N N 15 124.356 0.000 . . . . . A 452 ARG N . 34050 1 1108 . 1 1 154 154 ALA H H 1 7.858 0.001 . . . . . A 453 ALA H . 34050 1 1109 . 1 1 154 154 ALA HA H 1 4.261 0.000 . . . . . A 453 ALA HA . 34050 1 1110 . 1 1 154 154 ALA HB1 H 1 1.370 0.002 . . . . . A 453 ALA HB1 . 34050 1 1111 . 1 1 154 154 ALA HB2 H 1 1.370 0.002 . . . . . A 453 ALA HB2 . 34050 1 1112 . 1 1 154 154 ALA HB3 H 1 1.370 0.002 . . . . . A 453 ALA HB3 . 34050 1 1113 . 1 1 154 154 ALA N N 15 118.731 0.000 . . . . . A 453 ALA N . 34050 1 1114 . 1 1 155 155 GLU H H 1 7.636 0.002 . . . . . A 454 GLU H . 34050 1 1115 . 1 1 155 155 GLU HA H 1 4.247 0.001 . . . . . A 454 GLU HA . 34050 1 1116 . 1 1 155 155 GLU HB2 H 1 2.233 0.001 . . . . . A 454 GLU HB2 . 34050 1 1117 . 1 1 155 155 GLU HB3 H 1 2.171 0.009 . . . . . A 454 GLU HB3 . 34050 1 1118 . 1 1 155 155 GLU HG2 H 1 2.521 0.000 . . . . . A 454 GLU HG2 . 34050 1 1119 . 1 1 155 155 GLU HG3 H 1 2.341 0.000 . . . . . A 454 GLU HG3 . 34050 1 1120 . 1 1 155 155 GLU N N 15 116.763 0.000 . . . . . A 454 GLU N . 34050 1 1121 . 1 1 156 156 THR H H 1 7.867 0.003 . . . . . A 455 THR H . 34050 1 1122 . 1 1 156 156 THR HA H 1 4.358 0.003 . . . . . A 455 THR HA . 34050 1 1123 . 1 1 156 156 THR HB H 1 3.924 0.005 . . . . . A 455 THR HB . 34050 1 1124 . 1 1 156 156 THR HG21 H 1 1.132 0.001 . . . . . A 455 THR HG21 . 34050 1 1125 . 1 1 156 156 THR HG22 H 1 1.132 0.001 . . . . . A 455 THR HG22 . 34050 1 1126 . 1 1 156 156 THR HG23 H 1 1.132 0.001 . . . . . A 455 THR HG23 . 34050 1 1127 . 1 1 156 156 THR N N 15 108.607 0.000 . . . . . A 455 THR N . 34050 1 1128 . 1 1 157 157 PHE H H 1 7.711 0.001 . . . . . A 456 PHE H . 34050 1 1129 . 1 1 157 157 PHE HA H 1 3.718 0.003 . . . . . A 456 PHE HA . 34050 1 1130 . 1 1 157 157 PHE HB2 H 1 3.472 0.000 . . . . . A 456 PHE HB2 . 34050 1 1131 . 1 1 157 157 PHE HB3 H 1 2.570 0.000 . . . . . A 456 PHE HB3 . 34050 1 1132 . 1 1 157 157 PHE HD1 H 1 6.632 0.000 . . . . . A 456 PHE HD1 . 34050 1 1133 . 1 1 157 157 PHE HD2 H 1 6.632 0.000 . . . . . A 456 PHE HD2 . 34050 1 1134 . 1 1 157 157 PHE N N 15 124.637 0.000 . . . . . A 456 PHE N . 34050 1 1135 . 1 1 158 158 ILE H H 1 8.402 0.002 . . . . . A 457 ILE H . 34050 1 1136 . 1 1 158 158 ILE HA H 1 3.473 0.002 . . . . . A 457 ILE HA . 34050 1 1137 . 1 1 158 158 ILE HB H 1 1.909 0.000 . . . . . A 457 ILE HB . 34050 1 1138 . 1 1 158 158 ILE HG12 H 1 1.745 0.000 . . . . . A 457 ILE HG12 . 34050 1 1139 . 1 1 158 158 ILE HG13 H 1 1.302 0.000 . . . . . A 457 ILE HG13 . 34050 1 1140 . 1 1 158 158 ILE HG21 H 1 0.837 0.000 . . . . . A 457 ILE HG21 . 34050 1 1141 . 1 1 158 158 ILE HG22 H 1 0.837 0.000 . . . . . A 457 ILE HG22 . 34050 1 1142 . 1 1 158 158 ILE HG23 H 1 0.837 0.000 . . . . . A 457 ILE HG23 . 34050 1 1143 . 1 1 158 158 ILE HD11 H 1 1.030 0.000 . . . . . A 457 ILE HD11 . 34050 1 1144 . 1 1 158 158 ILE HD12 H 1 1.030 0.000 . . . . . A 457 ILE HD12 . 34050 1 1145 . 1 1 158 158 ILE HD13 H 1 1.030 0.000 . . . . . A 457 ILE HD13 . 34050 1 1146 . 1 1 158 158 ILE N N 15 115.919 0.000 . . . . . A 457 ILE N . 34050 1 1147 . 1 1 159 159 GLN H H 1 7.839 0.002 . . . . . A 458 GLN H . 34050 1 1148 . 1 1 159 159 GLN HA H 1 3.918 0.003 . . . . . A 458 GLN HA . 34050 1 1149 . 1 1 159 159 GLN HB2 H 1 1.942 0.004 . . . . . A 458 GLN HB2 . 34050 1 1150 . 1 1 159 159 GLN HB3 H 1 1.837 0.004 . . . . . A 458 GLN HB3 . 34050 1 1151 . 1 1 159 159 GLN HG2 H 1 2.207 0.010 . . . . . A 458 GLN HG2 . 34050 1 1152 . 1 1 159 159 GLN HG3 H 1 2.142 0.007 . . . . . A 458 GLN HG3 . 34050 1 1153 . 1 1 159 159 GLN HE21 H 1 7.188 0.000 . . . . . A 458 GLN HE21 . 34050 1 1154 . 1 1 159 159 GLN HE22 H 1 6.754 0.001 . . . . . A 458 GLN HE22 . 34050 1 1155 . 1 1 159 159 GLN N N 15 120.981 0.000 . . . . . A 458 GLN N . 34050 1 1156 . 1 1 159 159 GLN NE2 N 15 111.138 0.000 . . . . . A 458 GLN NE2 . 34050 1 1157 . 1 1 160 160 HIS H H 1 8.330 0.002 . . . . . A 459 HIS H . 34050 1 1158 . 1 1 160 160 HIS HA H 1 4.533 0.003 . . . . . A 459 HIS HA . 34050 1 1159 . 1 1 160 160 HIS HB2 H 1 2.785 0.000 . . . . . A 459 HIS HB2 . 34050 1 1160 . 1 1 160 160 HIS HB3 H 1 2.487 0.000 . . . . . A 459 HIS HB3 . 34050 1 1161 . 1 1 160 160 HIS N N 15 119.856 0.000 . . . . . A 459 HIS N . 34050 1 1162 . 1 1 161 161 LEU H H 1 8.627 0.002 . . . . . A 460 LEU H . 34050 1 1163 . 1 1 161 161 LEU HA H 1 3.475 0.001 . . . . . A 460 LEU HA . 34050 1 1164 . 1 1 161 161 LEU HB2 H 1 1.601 0.002 . . . . . A 460 LEU HB2 . 34050 1 1165 . 1 1 161 161 LEU HB3 H 1 0.916 0.004 . . . . . A 460 LEU HB3 . 34050 1 1166 . 1 1 161 161 LEU HG H 1 0.554 0.000 . . . . . A 460 LEU HG . 34050 1 1167 . 1 1 161 161 LEU HD11 H 1 0.530 0.000 . . . . . A 460 LEU HD11 . 34050 1 1168 . 1 1 161 161 LEU HD12 H 1 0.530 0.000 . . . . . A 460 LEU HD12 . 34050 1 1169 . 1 1 161 161 LEU HD13 H 1 0.530 0.000 . . . . . A 460 LEU HD13 . 34050 1 1170 . 1 1 161 161 LEU HD21 H 1 0.402 0.000 . . . . . A 460 LEU HD21 . 34050 1 1171 . 1 1 161 161 LEU HD22 H 1 0.402 0.000 . . . . . A 460 LEU HD22 . 34050 1 1172 . 1 1 161 161 LEU HD23 H 1 0.402 0.000 . . . . . A 460 LEU HD23 . 34050 1 1173 . 1 1 161 161 LEU N N 15 122.106 0.000 . . . . . A 460 LEU N . 34050 1 1174 . 1 1 162 162 ASN H H 1 8.647 0.001 . . . . . A 461 ASN H . 34050 1 1175 . 1 1 162 162 ASN HA H 1 4.182 0.003 . . . . . A 461 ASN HA . 34050 1 1176 . 1 1 162 162 ASN HB2 H 1 2.753 0.002 . . . . . A 461 ASN HB2 . 34050 1 1177 . 1 1 162 162 ASN HB3 H 1 2.682 0.007 . . . . . A 461 ASN HB3 . 34050 1 1178 . 1 1 162 162 ASN HD21 H 1 7.278 0.001 . . . . . A 461 ASN HD21 . 34050 1 1179 . 1 1 162 162 ASN HD22 H 1 6.564 0.001 . . . . . A 461 ASN HD22 . 34050 1 1180 . 1 1 162 162 ASN N N 15 116.200 0.000 . . . . . A 461 ASN N . 34050 1 1181 . 1 1 162 162 ASN ND2 N 15 109.732 0.000 . . . . . A 461 ASN ND2 . 34050 1 1182 . 1 1 163 163 ALA H H 1 7.892 0.003 . . . . . A 462 ALA H . 34050 1 1183 . 1 1 163 163 ALA HA H 1 4.190 0.001 . . . . . A 462 ALA HA . 34050 1 1184 . 1 1 163 163 ALA HB1 H 1 1.546 0.004 . . . . . A 462 ALA HB1 . 34050 1 1185 . 1 1 163 163 ALA HB2 H 1 1.546 0.004 . . . . . A 462 ALA HB2 . 34050 1 1186 . 1 1 163 163 ALA HB3 H 1 1.546 0.004 . . . . . A 462 ALA HB3 . 34050 1 1187 . 1 1 163 163 ALA N N 15 123.512 0.000 . . . . . A 462 ALA N . 34050 1 1188 . 1 1 164 164 VAL H H 1 8.326 0.001 . . . . . A 463 VAL H . 34050 1 1189 . 1 1 164 164 VAL HA H 1 3.601 0.001 . . . . . A 463 VAL HA . 34050 1 1190 . 1 1 164 164 VAL HB H 1 2.370 0.001 . . . . . A 463 VAL HB . 34050 1 1191 . 1 1 164 164 VAL HG11 H 1 1.076 0.000 . . . . . A 463 VAL HG11 . 34050 1 1192 . 1 1 164 164 VAL HG12 H 1 1.076 0.000 . . . . . A 463 VAL HG12 . 34050 1 1193 . 1 1 164 164 VAL HG13 H 1 1.076 0.000 . . . . . A 463 VAL HG13 . 34050 1 1194 . 1 1 164 164 VAL HG21 H 1 0.963 0.000 . . . . . A 463 VAL HG21 . 34050 1 1195 . 1 1 164 164 VAL HG22 H 1 0.963 0.000 . . . . . A 463 VAL HG22 . 34050 1 1196 . 1 1 164 164 VAL HG23 H 1 0.963 0.000 . . . . . A 463 VAL HG23 . 34050 1 1197 . 1 1 164 164 VAL N N 15 119.294 0.000 . . . . . A 463 VAL N . 34050 1 1198 . 1 1 165 165 TYR H H 1 8.971 0.001 . . . . . A 464 TYR H . 34050 1 1199 . 1 1 165 165 TYR HA H 1 4.082 0.009 . . . . . A 464 TYR HA . 34050 1 1200 . 1 1 165 165 TYR HB2 H 1 3.253 0.009 . . . . . A 464 TYR HB2 . 34050 1 1201 . 1 1 165 165 TYR HB3 H 1 3.094 0.001 . . . . . A 464 TYR HB3 . 34050 1 1202 . 1 1 165 165 TYR HD1 H 1 6.935 0.003 . . . . . A 464 TYR HD1 . 34050 1 1203 . 1 1 165 165 TYR HD2 H 1 6.935 0.003 . . . . . A 464 TYR HD2 . 34050 1 1204 . 1 1 165 165 TYR HE1 H 1 6.602 0.005 . . . . . A 464 TYR HE1 . 34050 1 1205 . 1 1 165 165 TYR HE2 H 1 6.602 0.005 . . . . . A 464 TYR HE2 . 34050 1 1206 . 1 1 165 165 TYR N N 15 121.262 0.000 . . . . . A 464 TYR N . 34050 1 1207 . 1 1 166 166 GLU H H 1 8.094 0.002 . . . . . A 465 GLU H . 34050 1 1208 . 1 1 166 166 GLU HA H 1 4.201 0.005 . . . . . A 465 GLU HA . 34050 1 1209 . 1 1 166 166 GLU HB2 H 1 2.230 0.000 . . . . . A 465 GLU HB2 . 34050 1 1210 . 1 1 166 166 GLU HB3 H 1 2.175 0.001 . . . . . A 465 GLU HB3 . 34050 1 1211 . 1 1 166 166 GLU HG2 H 1 2.345 0.000 . . . . . A 465 GLU HG2 . 34050 1 1212 . 1 1 166 166 GLU N N 15 119.013 0.000 . . . . . A 465 GLU N . 34050 1 1213 . 1 1 167 167 ILE H H 1 7.974 0.001 . . . . . A 466 ILE H . 34050 1 1214 . 1 1 167 167 ILE HA H 1 3.765 0.000 . . . . . A 466 ILE HA . 34050 1 1215 . 1 1 167 167 ILE HB H 1 1.921 0.007 . . . . . A 466 ILE HB . 34050 1 1216 . 1 1 167 167 ILE HG12 H 1 1.755 0.000 . . . . . A 466 ILE HG12 . 34050 1 1217 . 1 1 167 167 ILE HG13 H 1 1.169 0.000 . . . . . A 466 ILE HG13 . 34050 1 1218 . 1 1 167 167 ILE HG21 H 1 0.817 0.000 . . . . . A 466 ILE HG21 . 34050 1 1219 . 1 1 167 167 ILE HG22 H 1 0.817 0.000 . . . . . A 466 ILE HG22 . 34050 1 1220 . 1 1 167 167 ILE HG23 H 1 0.817 0.000 . . . . . A 466 ILE HG23 . 34050 1 1221 . 1 1 167 167 ILE HD11 H 1 0.922 0.000 . . . . . A 466 ILE HD11 . 34050 1 1222 . 1 1 167 167 ILE HD12 H 1 0.922 0.000 . . . . . A 466 ILE HD12 . 34050 1 1223 . 1 1 167 167 ILE HD13 H 1 0.922 0.000 . . . . . A 466 ILE HD13 . 34050 1 1224 . 1 1 167 167 ILE N N 15 121.262 0.000 . . . . . A 466 ILE N . 34050 1 1225 . 1 1 168 168 LEU H H 1 7.963 0.001 . . . . . A 467 LEU H . 34050 1 1226 . 1 1 168 168 LEU HA H 1 4.266 0.000 . . . . . A 467 LEU HA . 34050 1 1227 . 1 1 168 168 LEU HB2 H 1 1.597 0.003 . . . . . A 467 LEU HB2 . 34050 1 1228 . 1 1 168 168 LEU HB3 H 1 1.503 0.002 . . . . . A 467 LEU HB3 . 34050 1 1229 . 1 1 168 168 LEU HG H 1 0.699 0.000 . . . . . A 467 LEU HG . 34050 1 1230 . 1 1 168 168 LEU HD21 H 1 0.801 0.000 . . . . . A 467 LEU HD21 . 34050 1 1231 . 1 1 168 168 LEU HD22 H 1 0.801 0.000 . . . . . A 467 LEU HD22 . 34050 1 1232 . 1 1 168 168 LEU HD23 H 1 0.801 0.000 . . . . . A 467 LEU HD23 . 34050 1 1233 . 1 1 168 168 LEU N N 15 117.888 0.000 . . . . . A 467 LEU N . 34050 1 1234 . 1 1 169 169 GLY H H 1 7.813 0.002 . . . . . A 468 GLY H . 34050 1 1235 . 1 1 169 169 GLY HA2 H 1 3.845 0.001 . . . . . A 468 GLY HA2 . 34050 1 1236 . 1 1 169 169 GLY HA3 H 1 3.937 0.002 . . . . . A 468 GLY HA3 . 34050 1 1237 . 1 1 169 169 GLY N N 15 110.295 0.000 . . . . . A 468 GLY N . 34050 1 1238 . 1 1 170 170 LEU H H 1 8.476 0.001 . . . . . A 469 LEU H . 34050 1 1239 . 1 1 170 170 LEU HB2 H 1 1.202 0.000 . . . . . A 469 LEU HB2 . 34050 1 1240 . 1 1 170 170 LEU HB3 H 1 0.770 0.000 . . . . . A 469 LEU HB3 . 34050 1 1241 . 1 1 170 170 LEU HD11 H 1 0.278 0.005 . . . . . A 469 LEU HD11 . 34050 1 1242 . 1 1 170 170 LEU HD12 H 1 0.278 0.005 . . . . . A 469 LEU HD12 . 34050 1 1243 . 1 1 170 170 LEU HD13 H 1 0.278 0.005 . . . . . A 469 LEU HD13 . 34050 1 1244 . 1 1 170 170 LEU HD21 H 1 0.413 0.002 . . . . . A 469 LEU HD21 . 34050 1 1245 . 1 1 170 170 LEU HD22 H 1 0.413 0.002 . . . . . A 469 LEU HD22 . 34050 1 1246 . 1 1 170 170 LEU HD23 H 1 0.413 0.002 . . . . . A 469 LEU HD23 . 34050 1 1247 . 1 1 170 170 LEU N N 15 119.856 0.000 . . . . . A 469 LEU N . 34050 1 1248 . 1 1 171 171 ASN H H 1 8.578 0.003 . . . . . A 470 ASN H . 34050 1 1249 . 1 1 171 171 ASN HB2 H 1 3.456 0.004 . . . . . A 470 ASN HB2 . 34050 1 1250 . 1 1 171 171 ASN HB3 H 1 2.798 0.001 . . . . . A 470 ASN HB3 . 34050 1 1251 . 1 1 171 171 ASN HD21 H 1 7.663 0.004 . . . . . A 470 ASN HD21 . 34050 1 1252 . 1 1 171 171 ASN HD22 H 1 7.073 0.002 . . . . . A 470 ASN HD22 . 34050 1 1253 . 1 1 171 171 ASN N N 15 118.731 0.000 . . . . . A 470 ASN N . 34050 1 1254 . 1 1 171 171 ASN ND2 N 15 111.420 0.000 . . . . . A 470 ASN ND2 . 34050 1 1255 . 1 1 172 172 ALA H H 1 8.389 0.002 . . . . . A 471 ALA H . 34050 1 1256 . 1 1 172 172 ALA HA H 1 4.275 0.000 . . . . . A 471 ALA HA . 34050 1 1257 . 1 1 172 172 ALA HB1 H 1 1.538 0.003 . . . . . A 471 ALA HB1 . 34050 1 1258 . 1 1 172 172 ALA HB2 H 1 1.538 0.003 . . . . . A 471 ALA HB2 . 34050 1 1259 . 1 1 172 172 ALA HB3 H 1 1.538 0.003 . . . . . A 471 ALA HB3 . 34050 1 1260 . 1 1 172 172 ALA N N 15 119.013 0.000 . . . . . A 471 ALA N . 34050 1 1261 . 1 1 173 173 ARG H H 1 7.666 0.001 . . . . . A 472 ARG H . 34050 1 1262 . 1 1 173 173 ARG HA H 1 4.269 0.000 . . . . . A 472 ARG HA . 34050 1 1263 . 1 1 173 173 ARG HB2 H 1 2.166 0.003 . . . . . A 472 ARG HB2 . 34050 1 1264 . 1 1 173 173 ARG HB3 H 1 1.643 0.004 . . . . . A 472 ARG HB3 . 34050 1 1265 . 1 1 173 173 ARG HG2 H 1 1.667 0.000 . . . . . A 472 ARG HG2 . 34050 1 1266 . 1 1 173 173 ARG HG3 H 1 1.380 0.004 . . . . . A 472 ARG HG3 . 34050 1 1267 . 1 1 173 173 ARG HD3 H 1 3.106 0.000 . . . . . A 472 ARG HD3 . 34050 1 1268 . 1 1 173 173 ARG N N 15 116.482 0.000 . . . . . A 472 ARG N . 34050 1 1269 . 1 1 174 174 GLY H H 1 8.714 0.002 . . . . . A 473 GLY H . 34050 1 1270 . 1 1 174 174 GLY HA2 H 1 3.282 0.005 . . . . . A 473 GLY HA2 . 34050 1 1271 . 1 1 174 174 GLY HA3 H 1 4.026 0.002 . . . . . A 473 GLY HA3 . 34050 1 1272 . 1 1 174 174 GLY N N 15 109.451 0.000 . . . . . A 473 GLY N . 34050 1 1273 . 1 1 175 175 GLN H H 1 7.752 0.003 . . . . . A 474 GLN H . 34050 1 1274 . 1 1 175 175 GLN HA H 1 4.378 0.003 . . . . . A 474 GLN HA . 34050 1 1275 . 1 1 175 175 GLN HB2 H 1 1.989 0.005 . . . . . A 474 GLN HB2 . 34050 1 1276 . 1 1 175 175 GLN HB3 H 1 1.877 0.000 . . . . . A 474 GLN HB3 . 34050 1 1277 . 1 1 175 175 GLN HG2 H 1 2.258 0.001 . . . . . A 474 GLN HG2 . 34050 1 1278 . 1 1 175 175 GLN HG3 H 1 2.181 0.007 . . . . . A 474 GLN HG3 . 34050 1 1279 . 1 1 175 175 GLN HE21 H 1 7.523 0.001 . . . . . A 474 GLN HE21 . 34050 1 1280 . 1 1 175 175 GLN HE22 H 1 6.810 0.001 . . . . . A 474 GLN HE22 . 34050 1 1281 . 1 1 175 175 GLN N N 15 118.169 0.000 . . . . . A 474 GLN N . 34050 1 1282 . 1 1 175 175 GLN NE2 N 15 112.263 0.000 . . . . . A 474 GLN NE2 . 34050 1 1283 . 1 1 176 176 SER H H 1 8.600 0.006 . . . . . A 475 SER H . 34050 1 1284 . 1 1 176 176 SER HA H 1 4.569 0.000 . . . . . A 475 SER HA . 34050 1 1285 . 1 1 176 176 SER HB2 H 1 3.824 0.016 . . . . . A 475 SER HB2 . 34050 1 1286 . 1 1 176 176 SER HB3 H 1 3.776 0.004 . . . . . A 475 SER HB3 . 34050 1 1287 . 1 1 176 176 SER N N 15 116.482 0.000 . . . . . A 475 SER N . 34050 1 1288 . 1 1 177 177 ILE H H 1 8.379 0.003 . . . . . A 476 ILE H . 34050 1 1289 . 1 1 177 177 ILE HA H 1 4.143 0.001 . . . . . A 476 ILE HA . 34050 1 1290 . 1 1 177 177 ILE HB H 1 1.856 0.001 . . . . . A 476 ILE HB . 34050 1 1291 . 1 1 177 177 ILE HG12 H 1 1.302 0.000 . . . . . A 476 ILE HG12 . 34050 1 1292 . 1 1 177 177 ILE HG13 H 1 1.022 0.000 . . . . . A 476 ILE HG13 . 34050 1 1293 . 1 1 177 177 ILE HG21 H 1 0.841 0.000 . . . . . A 476 ILE HG21 . 34050 1 1294 . 1 1 177 177 ILE HG22 H 1 0.841 0.000 . . . . . A 476 ILE HG22 . 34050 1 1295 . 1 1 177 177 ILE HG23 H 1 0.841 0.000 . . . . . A 476 ILE HG23 . 34050 1 1296 . 1 1 177 177 ILE HD11 H 1 0.745 0.000 . . . . . A 476 ILE HD11 . 34050 1 1297 . 1 1 177 177 ILE HD12 H 1 0.745 0.000 . . . . . A 476 ILE HD12 . 34050 1 1298 . 1 1 177 177 ILE HD13 H 1 0.745 0.000 . . . . . A 476 ILE HD13 . 34050 1 1299 . 1 1 177 177 ILE N N 15 123.793 0.000 . . . . . A 476 ILE N . 34050 1 1300 . 1 1 178 178 ARG H H 1 8.189 0.002 . . . . . A 477 ARG H . 34050 1 1301 . 1 1 178 178 ARG HA H 1 4.304 0.000 . . . . . A 477 ARG HA . 34050 1 1302 . 1 1 178 178 ARG HB2 H 1 1.799 0.004 . . . . . A 477 ARG HB2 . 34050 1 1303 . 1 1 178 178 ARG HB3 H 1 1.681 0.000 . . . . . A 477 ARG HB3 . 34050 1 1304 . 1 1 178 178 ARG HG2 H 1 1.597 0.000 . . . . . A 477 ARG HG2 . 34050 1 1305 . 1 1 178 178 ARG HG3 H 1 1.533 0.000 . . . . . A 477 ARG HG3 . 34050 1 1306 . 1 1 178 178 ARG HD2 H 1 3.146 0.000 . . . . . A 477 ARG HD2 . 34050 1 1307 . 1 1 178 178 ARG HD3 H 1 3.146 0.000 . . . . . A 477 ARG HD3 . 34050 1 1308 . 1 1 178 178 ARG N N 15 122.668 0.000 . . . . . A 477 ARG N . 34050 1 1309 . 1 1 179 179 LEU H H 1 8.127 0.002 . . . . . A 478 LEU H . 34050 1 1310 . 1 1 179 179 LEU HA H 1 4.281 0.012 . . . . . A 478 LEU HA . 34050 1 1311 . 1 1 179 179 LEU HB2 H 1 1.542 0.000 . . . . . A 478 LEU HB2 . 34050 1 1312 . 1 1 179 179 LEU HB3 H 1 1.465 0.000 . . . . . A 478 LEU HB3 . 34050 1 1313 . 1 1 179 179 LEU HD11 H 1 0.859 0.000 . . . . . A 478 LEU HD11 . 34050 1 1314 . 1 1 179 179 LEU HD12 H 1 0.859 0.000 . . . . . A 478 LEU HD12 . 34050 1 1315 . 1 1 179 179 LEU HD13 H 1 0.859 0.000 . . . . . A 478 LEU HD13 . 34050 1 1316 . 1 1 179 179 LEU HD21 H 1 0.785 0.000 . . . . . A 478 LEU HD21 . 34050 1 1317 . 1 1 179 179 LEU HD22 H 1 0.785 0.000 . . . . . A 478 LEU HD22 . 34050 1 1318 . 1 1 179 179 LEU HD23 H 1 0.785 0.000 . . . . . A 478 LEU HD23 . 34050 1 1319 . 1 1 179 179 LEU N N 15 123.512 0.000 . . . . . A 478 LEU N . 34050 1 1320 . 1 1 180 180 GLU H H 1 8.326 0.006 . . . . . A 479 GLU H . 34050 1 1321 . 1 1 180 180 GLU HA H 1 4.164 0.000 . . . . . A 479 GLU HA . 34050 1 1322 . 1 1 180 180 GLU HB2 H 1 1.889 0.000 . . . . . A 479 GLU HB2 . 34050 1 1323 . 1 1 180 180 GLU HB3 H 1 1.794 0.000 . . . . . A 479 GLU HB3 . 34050 1 1324 . 1 1 180 180 GLU HG2 H 1 2.168 0.000 . . . . . A 479 GLU HG2 . 34050 1 1325 . 1 1 180 180 GLU HG3 H 1 2.095 0.000 . . . . . A 479 GLU HG3 . 34050 1 1326 . 1 1 180 180 GLU N N 15 121.262 0.000 . . . . . A 479 GLU N . 34050 1 stop_ save_