data_36272 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36272 _Entry.Title ; Solution Structure of the CS2 Domain of USP19 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-07-16 _Entry.Accession_date 2020-08-20 _Entry.Last_release_date 2020-08-20 _Entry.Original_release_date 2020-08-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 36272 stop_ 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 W. Xue W. . . . 36272 2 H. Hu H. Y. . . 36272 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'CS domain' . 36272 HSP90 . 36272 HYDROLASE . 36272 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36272 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 378 36272 '15N chemical shifts' 110 36272 '1H chemical shifts' 491 36272 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 . . 2025-09-15 . original BMRB . 36272 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 36283 'Solution Structure of the UbL Domain of USP19' 36272 PDB 6KHV 'BMRB Entry Tracking System' 36272 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36272 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33094816 _Citation.DOI 10.1042/BCJ20200536 _Citation.Full_citation . _Citation.Title ; Domain interactions reveal auto-inhibition of the deubiquitinating enzyme USP19 and its activation by HSP90 in the modulation of huntingtin aggregation. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biochem. J.' _Citation.Journal_name_full 'The Biochemical journal' _Citation.Journal_volume 477 _Citation.Journal_issue 21 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0264-6021 _Citation.Journal_CSD 0353 _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 4295 _Citation.Page_last 4312 _Citation.Year 2020 _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 Wei Xue W. . . . 36272 1 2 Shu-Xian Zhang S. X. . . 36272 1 3 Wen-Tian He W. T. . . 36272 1 4 Jun-Ye Hong J. Y. . . 36272 1 5 Lei-Lei Jiang L. L. . . 36272 1 6 Hong-Yu Hu H. Y. . . 36272 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36272 _Assembly.ID 1 _Assembly.Name 'Ubiquitin carboxyl-terminal hydrolase 19 (E.C.3.4.19.12)' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'all free' _Assembly.Molecular_mass 13338.205 _Assembly.Enzyme_commission_number 3.4.19.12 _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 . . . . ; Deubiquitinating enzyme 19,Ubiquitin thioesterase 19,Ubiquitin-specific-processing protease 19,Zinc finger MYND domain-containing protein 9 ; . 36272 1 stop_ loop_ _Chem_comp_assembly.Assembly_chem_comp_ID _Chem_comp_assembly.Entity_assembly_ID _Chem_comp_assembly.Entity_ID _Chem_comp_assembly.Comp_index_ID _Chem_comp_assembly.Comp_ID _Chem_comp_assembly.Seq_ID _Chem_comp_assembly.Auth_entity_assembly_ID _Chem_comp_assembly.Auth_asym_ID _Chem_comp_assembly.Auth_seq_ID _Chem_comp_assembly.Auth_comp_ID _Chem_comp_assembly.Auth_variant_ID _Chem_comp_assembly.Sequence_linking _Chem_comp_assembly.Cis_residue _Chem_comp_assembly.NEF_index _Chem_comp_assembly.Entry_ID _Chem_comp_assembly.Assembly_ID . 1 1 1 VAL 1 . A 273 VAL . start . . 36272 1 . 1 1 10 LEU 10 . A 282 LEU . middle . . 36272 1 . 1 1 100 LEU 100 . A 372 LEU . middle . . 36272 1 . 1 1 101 ARG 101 . A 373 ARG . middle . . 36272 1 . 1 1 102 LYS 102 . A 374 LYS . middle . . 36272 1 . 1 1 103 ARG 103 . A 375 ARG . middle . . 36272 1 . 1 1 104 GLN 104 . A 376 GLN . middle . . 36272 1 . 1 1 105 SER 105 . A 377 SER . middle . . 36272 1 . 1 1 106 GLN 106 . A 378 GLN . middle . . 36272 1 . 1 1 107 ARG 107 . A 379 ARG . middle . . 36272 1 . 1 1 108 TRP 108 . A 380 TRP . middle . . 36272 1 . 1 1 109 GLY 109 . A 381 GLY . middle no . 36272 1 . 1 1 11 ALA 11 . A 283 ALA . middle . . 36272 1 . 1 1 110 GLY 110 . A 382 GLY . middle no . 36272 1 . 1 1 111 LEU 111 . A 383 LEU . middle . . 36272 1 . 1 1 112 GLU 112 . A 384 GLU . middle . . 36272 1 . 1 1 113 ALA 113 . A 385 ALA . middle . . 36272 1 . 1 1 114 PRO 114 . A 386 PRO . end no . 36272 1 . 1 1 12 PHE 12 . A 284 PHE . middle . . 36272 1 . 1 1 13 VAL 13 . A 285 VAL . middle . . 36272 1 . 1 1 14 LYS 14 . A 286 LYS . middle . . 36272 1 . 1 1 15 ASN 15 . A 287 ASN . middle . . 36272 1 . 1 1 16 ASP 16 . A 288 ASP . middle . . 36272 1 . 1 1 17 SER 17 . A 289 SER . middle . . 36272 1 . 1 1 18 TYR 18 . A 290 TYR . middle . . 36272 1 . 1 1 19 GLU 19 . A 291 GLU . middle . . 36272 1 . 1 1 2 ASP 2 . A 274 ASP . middle . . 36272 1 . 1 1 20 LYS 20 . A 292 LYS . middle . . 36272 1 . 1 1 21 GLY 21 . A 293 GLY . middle no . 36272 1 . 1 1 22 PRO 22 . A 294 PRO . middle no . 36272 1 . 1 1 23 ASP 23 . A 295 ASP . middle . . 36272 1 . 1 1 24 SER 24 . A 296 SER . middle . . 36272 1 . 1 1 25 VAL 25 . A 297 VAL . middle . . 36272 1 . 1 1 26 VAL 26 . A 298 VAL . middle . . 36272 1 . 1 1 27 VAL 27 . A 299 VAL . middle . . 36272 1 . 1 1 28 HIS 28 . A 300 HIS . middle . . 36272 1 . 1 1 29 VAL 29 . A 301 VAL . middle . . 36272 1 . 1 1 3 GLU 3 . A 275 GLU . middle . . 36272 1 . 1 1 30 TYR 30 . A 302 TYR . middle . . 36272 1 . 1 1 31 VAL 31 . A 303 VAL . middle . . 36272 1 . 1 1 32 LYS 32 . A 304 LYS . middle . . 36272 1 . 1 1 33 GLU 33 . A 305 GLU . middle . . 36272 1 . 1 1 34 ILE 34 . A 306 ILE . middle . . 36272 1 . 1 1 35 CYS 35 . A 307 CYS . middle . . 36272 1 . 1 1 36 ARG 36 . A 308 ARG . middle . . 36272 1 . 1 1 37 ASP 37 . A 309 ASP . middle . . 36272 1 . 1 1 38 THR 38 . A 310 THR . middle . . 36272 1 . 1 1 39 SER 39 . A 311 SER . middle . . 36272 1 . 1 1 4 PRO 4 . A 276 PRO . middle no . 36272 1 . 1 1 40 ARG 40 . A 312 ARG . middle . . 36272 1 . 1 1 41 VAL 41 . A 313 VAL . middle . . 36272 1 . 1 1 42 LEU 42 . A 314 LEU . middle . . 36272 1 . 1 1 43 PHE 43 . A 315 PHE . middle . . 36272 1 . 1 1 44 ARG 44 . A 316 ARG . middle . . 36272 1 . 1 1 45 GLU 45 . A 317 GLU . middle . . 36272 1 . 1 1 46 GLN 46 . A 318 GLN . middle . . 36272 1 . 1 1 47 ASP 47 . A 319 ASP . middle . . 36272 1 . 1 1 48 PHE 48 . A 320 PHE . middle . . 36272 1 . 1 1 49 THR 49 . A 321 THR . middle . . 36272 1 . 1 1 5 GLU 5 . A 277 GLU . middle . . 36272 1 . 1 1 50 LEU 50 . A 322 LEU . middle . . 36272 1 . 1 1 51 ILE 51 . A 323 ILE . middle . . 36272 1 . 1 1 52 PHE 52 . A 324 PHE . middle . . 36272 1 . 1 1 53 GLN 53 . A 325 GLN . middle . . 36272 1 . 1 1 54 THR 54 . A 326 THR . middle . . 36272 1 . 1 1 55 ARG 55 . A 327 ARG . middle . . 36272 1 . 1 1 56 ASP 56 . A 328 ASP . middle . . 36272 1 . 1 1 57 GLY 57 . A 329 GLY . middle no . 36272 1 . 1 1 58 ASN 58 . A 330 ASN . middle . . 36272 1 . 1 1 59 PHE 59 . A 331 PHE . middle . . 36272 1 . 1 1 6 SER 6 . A 278 SER . middle . . 36272 1 . 1 1 60 LEU 60 . A 332 LEU . middle . . 36272 1 . 1 1 61 ARG 61 . A 333 ARG . middle . . 36272 1 . 1 1 62 LEU 62 . A 334 LEU . middle . . 36272 1 . 1 1 63 HIS 63 . A 335 HIS . middle . . 36272 1 . 1 1 64 PRO 64 . A 336 PRO . middle no . 36272 1 . 1 1 65 GLY 65 . A 337 GLY . middle no . 36272 1 . 1 1 66 CYS 66 . A 338 CYS . middle . . 36272 1 . 1 1 67 GLY 67 . A 339 GLY . middle no . 36272 1 . 1 1 68 PRO 68 . A 340 PRO . middle no . 36272 1 . 1 1 69 HIS 69 . A 341 HIS . middle . . 36272 1 . 1 1 7 MET 7 . A 279 MET . middle . . 36272 1 . 1 1 70 THR 70 . A 342 THR . middle . . 36272 1 . 1 1 71 THR 71 . A 343 THR . middle . . 36272 1 . 1 1 72 PHE 72 . A 344 PHE . middle . . 36272 1 . 1 1 73 ARG 73 . A 345 ARG . middle . . 36272 1 . 1 1 74 TRP 74 . A 346 TRP . middle . . 36272 1 . 1 1 75 GLN 75 . A 347 GLN . middle . . 36272 1 . 1 1 76 VAL 76 . A 348 VAL . middle . . 36272 1 . 1 1 77 LYS 77 . A 349 LYS . middle . . 36272 1 . 1 1 78 LEU 78 . A 350 LEU . middle . . 36272 1 . 1 1 79 ARG 79 . A 351 ARG . middle . . 36272 1 . 1 1 8 VAL 8 . A 280 VAL . middle . . 36272 1 . 1 1 80 ASN 80 . A 352 ASN . middle . . 36272 1 . 1 1 81 LEU 81 . A 353 LEU . middle . . 36272 1 . 1 1 82 ILE 82 . A 354 ILE . middle . . 36272 1 . 1 1 83 GLU 83 . A 355 GLU . middle . . 36272 1 . 1 1 84 PRO 84 . A 356 PRO . middle no . 36272 1 . 1 1 85 GLU 85 . A 357 GLU . middle . . 36272 1 . 1 1 86 GLN 86 . A 358 GLN . middle . . 36272 1 . 1 1 87 CYS 87 . A 359 CYS . middle . . 36272 1 . 1 1 88 THR 88 . A 360 THR . middle . . 36272 1 . 1 1 89 PHE 89 . A 361 PHE . middle . . 36272 1 . 1 1 9 ASN 9 . A 281 ASN . middle . . 36272 1 . 1 1 90 CYS 90 . A 362 CYS . middle . . 36272 1 . 1 1 91 PHE 91 . A 363 PHE . middle . . 36272 1 . 1 1 92 THR 92 . A 364 THR . middle . . 36272 1 . 1 1 93 ALA 93 . A 365 ALA . middle . . 36272 1 . 1 1 94 SER 94 . A 366 SER . middle . . 36272 1 . 1 1 95 ARG 95 . A 367 ARG . middle . . 36272 1 . 1 1 96 ILE 96 . A 368 ILE . middle . . 36272 1 . 1 1 97 ASP 97 . A 369 ASP . middle . . 36272 1 . 1 1 98 ILE 98 . A 370 ILE . middle . . 36272 1 . 1 1 99 CYS 99 . A 371 CYS . middle . . 36272 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36272 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Ubiquitin carboxyl-terminal hydrolase 19' _Entity.Type polymer _Entity.Polymer_common_type protein _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 ; VDEPESMVNLAFVKNDSYEK GPDSVVVHVYVKEICRDTSR VLFREQDFTLIFQTRDGNFL RLHPGCGPHTTFRWQVKLRN LIEPEQCTFCFTASRIDICL RKRQSQRWGGLEAP ; _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 114 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 3.4.19.12 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13338.205 _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 ; Deubiquitinating enzyme 19,Ubiquitin thioesterase 19,Ubiquitin-specific-processing protease 19,Zinc finger MYND domain-containing protein 9 ; common 36272 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 1 273 VAL . 36272 1 2 274 ASP . 36272 1 3 275 GLU . 36272 1 4 276 PRO . 36272 1 5 277 GLU . 36272 1 6 278 SER . 36272 1 7 279 MET . 36272 1 8 280 VAL . 36272 1 9 281 ASN . 36272 1 10 282 LEU . 36272 1 11 283 ALA . 36272 1 12 284 PHE . 36272 1 13 285 VAL . 36272 1 14 286 LYS . 36272 1 15 287 ASN . 36272 1 16 288 ASP . 36272 1 17 289 SER . 36272 1 18 290 TYR . 36272 1 19 291 GLU . 36272 1 20 292 LYS . 36272 1 21 293 GLY . 36272 1 22 294 PRO . 36272 1 23 295 ASP . 36272 1 24 296 SER . 36272 1 25 297 VAL . 36272 1 26 298 VAL . 36272 1 27 299 VAL . 36272 1 28 300 HIS . 36272 1 29 301 VAL . 36272 1 30 302 TYR . 36272 1 31 303 VAL . 36272 1 32 304 LYS . 36272 1 33 305 GLU . 36272 1 34 306 ILE . 36272 1 35 307 CYS . 36272 1 36 308 ARG . 36272 1 37 309 ASP . 36272 1 38 310 THR . 36272 1 39 311 SER . 36272 1 40 312 ARG . 36272 1 41 313 VAL . 36272 1 42 314 LEU . 36272 1 43 315 PHE . 36272 1 44 316 ARG . 36272 1 45 317 GLU . 36272 1 46 318 GLN . 36272 1 47 319 ASP . 36272 1 48 320 PHE . 36272 1 49 321 THR . 36272 1 50 322 LEU . 36272 1 51 323 ILE . 36272 1 52 324 PHE . 36272 1 53 325 GLN . 36272 1 54 326 THR . 36272 1 55 327 ARG . 36272 1 56 328 ASP . 36272 1 57 329 GLY . 36272 1 58 330 ASN . 36272 1 59 331 PHE . 36272 1 60 332 LEU . 36272 1 61 333 ARG . 36272 1 62 334 LEU . 36272 1 63 335 HIS . 36272 1 64 336 PRO . 36272 1 65 337 GLY . 36272 1 66 338 CYS . 36272 1 67 339 GLY . 36272 1 68 340 PRO . 36272 1 69 341 HIS . 36272 1 70 342 THR . 36272 1 71 343 THR . 36272 1 72 344 PHE . 36272 1 73 345 ARG . 36272 1 74 346 TRP . 36272 1 75 347 GLN . 36272 1 76 348 VAL . 36272 1 77 349 LYS . 36272 1 78 350 LEU . 36272 1 79 351 ARG . 36272 1 80 352 ASN . 36272 1 81 353 LEU . 36272 1 82 354 ILE . 36272 1 83 355 GLU . 36272 1 84 356 PRO . 36272 1 85 357 GLU . 36272 1 86 358 GLN . 36272 1 87 359 CYS . 36272 1 88 360 THR . 36272 1 89 361 PHE . 36272 1 90 362 CYS . 36272 1 91 363 PHE . 36272 1 92 364 THR . 36272 1 93 365 ALA . 36272 1 94 366 SER . 36272 1 95 367 ARG . 36272 1 96 368 ILE . 36272 1 97 369 ASP . 36272 1 98 370 ILE . 36272 1 99 371 CYS . 36272 1 100 372 LEU . 36272 1 101 373 ARG . 36272 1 102 374 LYS . 36272 1 103 375 ARG . 36272 1 104 376 GLN . 36272 1 105 377 SER . 36272 1 106 378 GLN . 36272 1 107 379 ARG . 36272 1 108 380 TRP . 36272 1 109 381 GLY . 36272 1 110 382 GLY . 36272 1 111 383 LEU . 36272 1 112 384 GLU . 36272 1 113 385 ALA . 36272 1 114 386 PRO . 36272 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 . VAL 1 1 36272 1 . ASP 2 2 36272 1 . GLU 3 3 36272 1 . PRO 4 4 36272 1 . GLU 5 5 36272 1 . SER 6 6 36272 1 . MET 7 7 36272 1 . VAL 8 8 36272 1 . ASN 9 9 36272 1 . LEU 10 10 36272 1 . ALA 11 11 36272 1 . PHE 12 12 36272 1 . VAL 13 13 36272 1 . LYS 14 14 36272 1 . ASN 15 15 36272 1 . ASP 16 16 36272 1 . SER 17 17 36272 1 . TYR 18 18 36272 1 . GLU 19 19 36272 1 . LYS 20 20 36272 1 . GLY 21 21 36272 1 . PRO 22 22 36272 1 . ASP 23 23 36272 1 . SER 24 24 36272 1 . VAL 25 25 36272 1 . VAL 26 26 36272 1 . VAL 27 27 36272 1 . HIS 28 28 36272 1 . VAL 29 29 36272 1 . TYR 30 30 36272 1 . VAL 31 31 36272 1 . LYS 32 32 36272 1 . GLU 33 33 36272 1 . ILE 34 34 36272 1 . CYS 35 35 36272 1 . ARG 36 36 36272 1 . ASP 37 37 36272 1 . THR 38 38 36272 1 . SER 39 39 36272 1 . ARG 40 40 36272 1 . VAL 41 41 36272 1 . LEU 42 42 36272 1 . PHE 43 43 36272 1 . ARG 44 44 36272 1 . GLU 45 45 36272 1 . GLN 46 46 36272 1 . ASP 47 47 36272 1 . PHE 48 48 36272 1 . THR 49 49 36272 1 . LEU 50 50 36272 1 . ILE 51 51 36272 1 . PHE 52 52 36272 1 . GLN 53 53 36272 1 . THR 54 54 36272 1 . ARG 55 55 36272 1 . ASP 56 56 36272 1 . GLY 57 57 36272 1 . ASN 58 58 36272 1 . PHE 59 59 36272 1 . LEU 60 60 36272 1 . ARG 61 61 36272 1 . LEU 62 62 36272 1 . HIS 63 63 36272 1 . PRO 64 64 36272 1 . GLY 65 65 36272 1 . CYS 66 66 36272 1 . GLY 67 67 36272 1 . PRO 68 68 36272 1 . HIS 69 69 36272 1 . THR 70 70 36272 1 . THR 71 71 36272 1 . PHE 72 72 36272 1 . ARG 73 73 36272 1 . TRP 74 74 36272 1 . GLN 75 75 36272 1 . VAL 76 76 36272 1 . LYS 77 77 36272 1 . LEU 78 78 36272 1 . ARG 79 79 36272 1 . ASN 80 80 36272 1 . LEU 81 81 36272 1 . ILE 82 82 36272 1 . GLU 83 83 36272 1 . PRO 84 84 36272 1 . GLU 85 85 36272 1 . GLN 86 86 36272 1 . CYS 87 87 36272 1 . THR 88 88 36272 1 . PHE 89 89 36272 1 . CYS 90 90 36272 1 . PHE 91 91 36272 1 . THR 92 92 36272 1 . ALA 93 93 36272 1 . SER 94 94 36272 1 . ARG 95 95 36272 1 . ILE 96 96 36272 1 . ASP 97 97 36272 1 . ILE 98 98 36272 1 . CYS 99 99 36272 1 . LEU 100 100 36272 1 . ARG 101 101 36272 1 . LYS 102 102 36272 1 . ARG 103 103 36272 1 . GLN 104 104 36272 1 . SER 105 105 36272 1 . GLN 106 106 36272 1 . ARG 107 107 36272 1 . TRP 108 108 36272 1 . GLY 109 109 36272 1 . GLY 110 110 36272 1 . LEU 111 111 36272 1 . GLU 112 112 36272 1 . ALA 113 113 36272 1 . PRO 114 114 36272 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 36272 _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 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'USP19, KIAA0891, ZMYND9' . 36272 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 36272 _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' 'E. coli' . 562 Escherichia coli . . . . . . . . . . 36272 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_13C_sample _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_sample _Sample.Entry_ID 36272 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.8 mM [U-99% 13C; U-99% 15N] CS2(273-386), 20 mM sodium phosphate, 50 mM sodium chloride, 0.05 mM sodium azide, 90 % v/v H2O, 10 % v/v D2O, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Ubiquitin carboxyl-terminal hydrolase 19' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein . . . mM . . . . 36272 1 2 'sodium azide' 'natural abundance' . . . . . cytocide 0.05 . . mM . . . . 36272 1 3 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 36272 1 4 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 36272 1 5 H2O 'natural abundance' . . . . . solvent 90 . . '% v/v' . . . . 36272 1 6 D2O [U-2H] . . . . . solvent 10 . . '% v/v' . . . . 36272 1 stop_ save_ save_15N_sample _Sample.Sf_category sample _Sample.Sf_framecode 15N_sample _Sample.Entry_ID 36272 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.8 mM [U-99% 15N] CS2(273-386), 20 mM sodium phosphate, 50 mM sodium chloride, 0.05 mM sodium azide, 90 % v/v H2O, 10 % v/v D2O, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Ubiquitin carboxyl-terminal hydrolase 19' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein . . . mM . . . . 36272 2 2 'sodium azide' 'natural abundance' . . . . . cytocide 0.05 . . mM . . . . 36272 2 3 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 36272 2 4 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 36272 2 5 H2O 'natural abundance' . . . . . solvent 90 . . '% v/v' . . . . 36272 2 6 D2O [U-2H] . . . . . solvent 10 . . '% v/v' . . . . 36272 2 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 36272 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details conditions_1 loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.08 . M 36272 1 pH 6.5 . pH 36272 1 pressure 1 . atm 36272 1 temperature 298 . K 36272 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36272 _Software.ID 1 _Software.Type . _Software.Name NMRDraw _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 36272 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36272 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36272 _Software.ID 2 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 36272 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 36272 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36272 _Software.ID 3 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 36272 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36272 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36272 _Software.ID 4 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 36272 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36272 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36272 _Software.ID 5 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 36272 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36272 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 36272 _Software.ID 6 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 36272 6 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36272 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 36272 _Software.ID 7 _Software.Type . _Software.Name ARIA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 36272 7 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36272 7 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 36272 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list_1 _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list_1 _NMR_spectrometer_list.Entry_ID 36272 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AVANCE . 600 . . . 36272 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 36272 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' . . . . . . . . . . . . . 2 $15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 2 '3D CBCA(CO)NH' . . . . . . . . . . . . . 1 $15N_13C_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 3 '3D HNCACB' . . . . . . . . . . . . . 1 $15N_13C_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 4 '3D H(CCO)NH' . . . . . . . . . . . . . 1 $15N_13C_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 5 '3D HNHA' . . . . . . . . . . . . . 2 $15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 6 '3D HCCH-TOCSY' . . . . . . . . . . . . . 1 $15N_13C_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 7 '3D 1H-13C NOESY' . . . . . . . . . . . . . 1 $15N_13C_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 8 '3D 1H-15N NOESY' . . . . . . . . . . . . . 2 $15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 9 '3D HNCO' . . . . . . . . . . . . . 1 $15N_13C_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36272 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 36272 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 36272 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 36272 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 36272 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 36272 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 2 $15N_sample isotropic 36272 1 2 '3D CBCA(CO)NH' 1 $15N_13C_sample isotropic 36272 1 3 '3D HNCACB' 1 $15N_13C_sample isotropic 36272 1 4 '3D H(CCO)NH' 1 $15N_13C_sample isotropic 36272 1 5 '3D HNHA' 2 $15N_sample isotropic 36272 1 6 '3D HCCH-TOCSY' 1 $15N_13C_sample isotropic 36272 1 7 '3D 1H-13C NOESY' 1 $15N_13C_sample isotropic 36272 1 8 '3D 1H-15N NOESY' 2 $15N_sample isotropic 36272 1 9 '3D HNCO' 1 $15N_13C_sample isotropic 36272 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 VAL HA H 1 3.976 0.007 . 1 . . . . A 273 VAL HA . 36272 1 2 . 1 . 1 1 1 VAL HB H 1 1.940 0.008 . 1 . . . . A 273 VAL HB . 36272 1 3 . 1 . 1 1 1 VAL HG11 H 1 0.754 0.009 . . . . . . A 273 VAL HG11 . 36272 1 4 . 1 . 1 1 1 VAL HG12 H 1 0.754 0.009 . . . . . . A 273 VAL HG12 . 36272 1 5 . 1 . 1 1 1 VAL HG13 H 1 0.754 0.009 . . . . . . A 273 VAL HG13 . 36272 1 6 . 1 . 1 1 1 VAL H1 H 1 8.194 0.014 . . . . . . A 273 VAL H1 . 36272 1 7 . 1 . 1 1 1 VAL C C 13 175.657 0.000 . 1 . . . . A 273 VAL C . 36272 1 8 . 1 . 1 1 1 VAL CA C 13 62.332 0.068 . 1 . . . . A 273 VAL CA . 36272 1 9 . 1 . 1 1 1 VAL CB C 13 32.447 0.066 . 1 . . . . A 273 VAL CB . 36272 1 10 . 1 . 1 1 1 VAL CG1 C 13 21.035 0.000 . . . . . . A 273 VAL CG1 . 36272 1 11 . 1 . 1 1 1 VAL N N 15 120.672 0.033 . 1 . . . . A 273 VAL N . 36272 1 12 . 1 . 1 2 2 ASP H H 1 8.155 0.002 . 1 . . . . A 274 ASP H . 36272 1 13 . 1 . 1 2 2 ASP HA H 1 4.410 0.004 . 1 . . . . A 274 ASP HA . 36272 1 14 . 1 . 1 2 2 ASP HB2 H 1 2.492 0.003 . . . . . . A 274 ASP HB2 . 36272 1 15 . 1 . 1 2 2 ASP HB3 H 1 2.359 0.009 . . . . . . A 274 ASP HB3 . 36272 1 16 . 1 . 1 2 2 ASP C C 13 175.515 0.000 . 1 . . . . A 274 ASP C . 36272 1 17 . 1 . 1 2 2 ASP CA C 13 54.190 0.043 . 1 . . . . A 274 ASP CA . 36272 1 18 . 1 . 1 2 2 ASP CB C 13 41.041 0.016 . 1 . . . . A 274 ASP CB . 36272 1 19 . 1 . 1 2 2 ASP N N 15 122.522 0.030 . 1 . . . . A 274 ASP N . 36272 1 20 . 1 . 1 3 3 GLU H H 1 7.973 0.003 . 1 . . . . A 275 GLU H . 36272 1 21 . 1 . 1 3 3 GLU HA H 1 4.414 0.005 . 1 . . . . A 275 GLU HA . 36272 1 22 . 1 . 1 3 3 GLU HB2 H 1 2.070 0.002 . . . . . . A 275 GLU HB2 . 36272 1 23 . 1 . 1 3 3 GLU HG2 H 1 2.443 0.000 . . . . . . A 275 GLU HG2 . 36272 1 24 . 1 . 1 3 3 GLU CA C 13 54.084 0.074 . 1 . . . . A 275 GLU CA . 36272 1 25 . 1 . 1 3 3 GLU CB C 13 29.662 0.000 . 1 . . . . A 275 GLU CB . 36272 1 26 . 1 . 1 3 3 GLU N N 15 121.911 0.027 . 1 . . . . A 275 GLU N . 36272 1 27 . 1 . 1 4 4 PRO HA H 1 4.224 0.005 . 1 . . . . A 276 PRO HA . 36272 1 28 . 1 . 1 4 4 PRO HB2 H 1 2.102 0.005 . . . . . . A 276 PRO HB2 . 36272 1 29 . 1 . 1 4 4 PRO HG2 H 1 1.815 0.006 . . . . . . A 276 PRO HG2 . 36272 1 30 . 1 . 1 4 4 PRO HG3 H 1 1.733 0.012 . . . . . . A 276 PRO HG3 . 36272 1 31 . 1 . 1 4 4 PRO HD2 H 1 3.558 0.011 . . . . . . A 276 PRO HD2 . 36272 1 32 . 1 . 1 4 4 PRO HD3 H 1 3.515 0.001 . . . . . . A 276 PRO HD3 . 36272 1 33 . 1 . 1 4 4 PRO C C 13 176.996 0.000 . 1 . . . . A 276 PRO C . 36272 1 34 . 1 . 1 4 4 PRO CA C 13 63.251 0.038 . 1 . . . . A 276 PRO CA . 36272 1 35 . 1 . 1 4 4 PRO CB C 13 31.972 0.044 . 1 . . . . A 276 PRO CB . 36272 1 36 . 1 . 1 4 4 PRO CG C 13 27.340 0.106 . 1 . . . . A 276 PRO CG . 36272 1 37 . 1 . 1 4 4 PRO CD C 13 50.466 0.032 . 1 . . . . A 276 PRO CD . 36272 1 38 . 1 . 1 5 5 GLU H H 1 8.497 0.007 . 1 . . . . A 277 GLU H . 36272 1 39 . 1 . 1 5 5 GLU HA H 1 4.062 0.006 . 1 . . . . A 277 GLU HA . 36272 1 40 . 1 . 1 5 5 GLU HB2 H 1 2.121 0.024 . . . . . . A 277 GLU HB2 . 36272 1 41 . 1 . 1 5 5 GLU C C 13 176.426 0.000 . 1 . . . . A 277 GLU C . 36272 1 42 . 1 . 1 5 5 GLU CA C 13 56.733 0.057 . 1 . . . . A 277 GLU CA . 36272 1 43 . 1 . 1 5 5 GLU CB C 13 29.964 0.062 . 1 . . . . A 277 GLU CB . 36272 1 44 . 1 . 1 5 5 GLU CG C 13 36.242 0.000 . 1 . . . . A 277 GLU CG . 36272 1 45 . 1 . 1 5 5 GLU N N 15 120.390 0.014 . 1 . . . . A 277 GLU N . 36272 1 46 . 1 . 1 6 6 SER H H 1 8.225 0.013 . 1 . . . . A 278 SER H . 36272 1 47 . 1 . 1 6 6 SER HA H 1 4.269 0.007 . 1 . . . . A 278 SER HA . 36272 1 48 . 1 . 1 6 6 SER HB2 H 1 3.671 0.007 . . . . . . A 278 SER HB2 . 36272 1 49 . 1 . 1 6 6 SER C C 13 174.030 0.000 . 1 . . . . A 278 SER C . 36272 1 50 . 1 . 1 6 6 SER CA C 13 58.114 0.087 . 1 . . . . A 278 SER CA . 36272 1 51 . 1 . 1 6 6 SER CB C 13 63.629 0.042 . 1 . . . . A 278 SER CB . 36272 1 52 . 1 . 1 6 6 SER N N 15 116.696 0.022 . 1 . . . . A 278 SER N . 36272 1 53 . 1 . 1 7 7 MET H H 1 8.055 0.003 . 1 . . . . A 279 MET H . 36272 1 54 . 1 . 1 7 7 MET HA H 1 4.601 0.014 . 1 . . . . A 279 MET HA . 36272 1 55 . 1 . 1 7 7 MET HB2 H 1 2.071 0.020 . . . . . . A 279 MET HB2 . 36272 1 56 . 1 . 1 7 7 MET HG2 H 1 2.266 0.007 . . . . . . A 279 MET HG2 . 36272 1 57 . 1 . 1 7 7 MET C C 13 173.011 0.000 . 1 . . . . A 279 MET C . 36272 1 58 . 1 . 1 7 7 MET CA C 13 55.129 0.068 . 1 . . . . A 279 MET CA . 36272 1 59 . 1 . 1 7 7 MET CB C 13 34.703 0.084 . 1 . . . . A 279 MET CB . 36272 1 60 . 1 . 1 7 7 MET N N 15 122.699 0.028 . 1 . . . . A 279 MET N . 36272 1 61 . 1 . 1 8 8 VAL H H 1 8.570 0.008 . 1 . . . . A 280 VAL H . 36272 1 62 . 1 . 1 8 8 VAL HA H 1 3.800 0.009 . 1 . . . . A 280 VAL HA . 36272 1 63 . 1 . 1 8 8 VAL HB H 1 1.347 0.006 . 1 . . . . A 280 VAL HB . 36272 1 64 . 1 . 1 8 8 VAL HG11 H 1 0.723 0.007 . . . . . . A 280 VAL HG11 . 36272 1 65 . 1 . 1 8 8 VAL HG12 H 1 0.723 0.007 . . . . . . A 280 VAL HG12 . 36272 1 66 . 1 . 1 8 8 VAL HG13 H 1 0.723 0.007 . . . . . . A 280 VAL HG13 . 36272 1 67 . 1 . 1 8 8 VAL HG21 H 1 0.533 0.017 . . . . . . A 280 VAL HG21 . 36272 1 68 . 1 . 1 8 8 VAL HG22 H 1 0.533 0.017 . . . . . . A 280 VAL HG22 . 36272 1 69 . 1 . 1 8 8 VAL HG23 H 1 0.533 0.017 . . . . . . A 280 VAL HG23 . 36272 1 70 . 1 . 1 8 8 VAL C C 13 174.637 0.000 . 1 . . . . A 280 VAL C . 36272 1 71 . 1 . 1 8 8 VAL CA C 13 62.115 0.056 . 1 . . . . A 280 VAL CA . 36272 1 72 . 1 . 1 8 8 VAL CB C 13 32.833 0.087 . 1 . . . . A 280 VAL CB . 36272 1 73 . 1 . 1 8 8 VAL CG1 C 13 21.025 0.022 . . . . . . A 280 VAL CG1 . 36272 1 74 . 1 . 1 8 8 VAL CG2 C 13 21.750 0.009 . . . . . . A 280 VAL CG2 . 36272 1 75 . 1 . 1 8 8 VAL N N 15 125.204 0.044 . 1 . . . . A 280 VAL N . 36272 1 76 . 1 . 1 9 9 ASN H H 1 8.680 0.006 . 1 . . . . A 281 ASN H . 36272 1 77 . 1 . 1 9 9 ASN HA H 1 5.064 0.016 . 1 . . . . A 281 ASN HA . 36272 1 78 . 1 . 1 9 9 ASN HB2 H 1 2.544 0.009 . . . . . . A 281 ASN HB2 . 36272 1 79 . 1 . 1 9 9 ASN HD21 H 1 7.495 0.003 . . . . . . A 281 ASN HD21 . 36272 1 80 . 1 . 1 9 9 ASN HD22 H 1 6.841 0.003 . . . . . . A 281 ASN HD22 . 36272 1 81 . 1 . 1 9 9 ASN C C 13 175.104 0.000 . 1 . . . . A 281 ASN C . 36272 1 82 . 1 . 1 9 9 ASN CA C 13 53.323 0.076 . 1 . . . . A 281 ASN CA . 36272 1 83 . 1 . 1 9 9 ASN CB C 13 39.532 0.055 . 1 . . . . A 281 ASN CB . 36272 1 84 . 1 . 1 9 9 ASN N N 15 126.589 0.048 . 1 . . . . A 281 ASN N . 36272 1 85 . 1 . 1 9 9 ASN ND2 N 15 114.245 0.027 . 1 . . . . A 281 ASN ND2 . 36272 1 86 . 1 . 1 10 10 LEU H H 1 9.204 0.008 . 1 . . . . A 282 LEU H . 36272 1 87 . 1 . 1 10 10 LEU HA H 1 4.539 0.015 . 1 . . . . A 282 LEU HA . 36272 1 88 . 1 . 1 10 10 LEU HB2 H 1 1.673 0.011 . . . . . . A 282 LEU HB2 . 36272 1 89 . 1 . 1 10 10 LEU C C 13 176.295 0.000 . 1 . . . . A 282 LEU C . 36272 1 90 . 1 . 1 10 10 LEU CA C 13 53.294 0.082 . 1 . . . . A 282 LEU CA . 36272 1 91 . 1 . 1 10 10 LEU CB C 13 43.944 0.039 . 1 . . . . A 282 LEU CB . 36272 1 92 . 1 . 1 10 10 LEU CG C 13 26.535 0.000 . 1 . . . . A 282 LEU CG . 36272 1 93 . 1 . 1 10 10 LEU N N 15 125.131 0.031 . 1 . . . . A 282 LEU N . 36272 1 94 . 1 . 1 11 11 ALA H H 1 8.836 0.007 . 1 . . . . A 283 ALA H . 36272 1 95 . 1 . 1 11 11 ALA HA H 1 4.536 0.007 . 1 . . . . A 283 ALA HA . 36272 1 96 . 1 . 1 11 11 ALA HB1 H 1 1.413 0.007 . 1 . . . . A 283 ALA HB1 . 36272 1 97 . 1 . 1 11 11 ALA HB2 H 1 1.413 0.007 . 1 . . . . A 283 ALA HB2 . 36272 1 98 . 1 . 1 11 11 ALA HB3 H 1 1.413 0.007 . 1 . . . . A 283 ALA HB3 . 36272 1 99 . 1 . 1 11 11 ALA C C 13 177.846 0.000 . 1 . . . . A 283 ALA C . 36272 1 100 . 1 . 1 11 11 ALA CA C 13 52.715 0.030 . 1 . . . . A 283 ALA CA . 36272 1 101 . 1 . 1 11 11 ALA CB C 13 19.437 0.041 . 1 . . . . A 283 ALA CB . 36272 1 102 . 1 . 1 11 11 ALA N N 15 123.783 0.051 . 1 . . . . A 283 ALA N . 36272 1 103 . 1 . 1 12 12 PHE H H 1 7.296 0.014 . 1 . . . . A 284 PHE H . 36272 1 104 . 1 . 1 12 12 PHE HA H 1 4.447 0.014 . 1 . . . . A 284 PHE HA . 36272 1 105 . 1 . 1 12 12 PHE HB2 H 1 3.092 0.010 . . . . . . A 284 PHE HB2 . 36272 1 106 . 1 . 1 12 12 PHE HB3 H 1 2.575 0.010 . . . . . . A 284 PHE HB3 . 36272 1 107 . 1 . 1 12 12 PHE HD1 H 1 7.069 0.013 . . . . . . A 284 PHE HD1 . 36272 1 108 . 1 . 1 12 12 PHE CA C 13 58.119 0.048 . 1 . . . . A 284 PHE CA . 36272 1 109 . 1 . 1 12 12 PHE CB C 13 42.226 0.118 . 1 . . . . A 284 PHE CB . 36272 1 110 . 1 . 1 12 12 PHE N N 15 115.823 0.035 . 1 . . . . A 284 PHE N . 36272 1 111 . 1 . 1 13 13 VAL C C 13 172.004 0.000 . 1 . . . . A 285 VAL C . 36272 1 112 . 1 . 1 13 13 VAL CA C 13 60.450 0.071 . 1 . . . . A 285 VAL CA . 36272 1 113 . 1 . 1 13 13 VAL CB C 13 33.804 0.023 . 1 . . . . A 285 VAL CB . 36272 1 114 . 1 . 1 13 13 VAL CG1 C 13 22.622 0.000 . . . . . . A 285 VAL CG1 . 36272 1 115 . 1 . 1 14 14 LYS H H 1 7.999 0.005 . 1 . . . . A 286 LYS H . 36272 1 116 . 1 . 1 14 14 LYS HA H 1 3.781 0.011 . 1 . . . . A 286 LYS HA . 36272 1 117 . 1 . 1 14 14 LYS HB2 H 1 1.732 0.010 . . . . . . A 286 LYS HB2 . 36272 1 118 . 1 . 1 14 14 LYS HG2 H 1 1.498 0.013 . . . . . . A 286 LYS HG2 . 36272 1 119 . 1 . 1 14 14 LYS HG3 H 1 1.281 0.007 . . . . . . A 286 LYS HG3 . 36272 1 120 . 1 . 1 14 14 LYS HE2 H 1 2.678 0.006 . . . . . . A 286 LYS HE2 . 36272 1 121 . 1 . 1 14 14 LYS C C 13 174.742 0.000 . 1 . . . . A 286 LYS C . 36272 1 122 . 1 . 1 14 14 LYS CA C 13 58.473 0.096 . 1 . . . . A 286 LYS CA . 36272 1 123 . 1 . 1 14 14 LYS CB C 13 32.439 0.062 . 1 . . . . A 286 LYS CB . 36272 1 124 . 1 . 1 14 14 LYS CG C 13 25.326 0.083 . 1 . . . . A 286 LYS CG . 36272 1 125 . 1 . 1 14 14 LYS N N 15 126.883 0.030 . 1 . . . . A 286 LYS N . 36272 1 126 . 1 . 1 15 15 ASN H H 1 8.180 0.010 . 1 . . . . A 287 ASN H . 36272 1 127 . 1 . 1 15 15 ASN HA H 1 5.722 0.004 . 1 . . . . A 287 ASN HA . 36272 1 128 . 1 . 1 15 15 ASN HB2 H 1 2.421 0.011 . . . . . . A 287 ASN HB2 . 36272 1 129 . 1 . 1 15 15 ASN HD21 H 1 7.576 0.015 . . . . . . A 287 ASN HD21 . 36272 1 130 . 1 . 1 15 15 ASN HD22 H 1 7.033 0.003 . . . . . . A 287 ASN HD22 . 36272 1 131 . 1 . 1 15 15 ASN C C 13 173.361 0.000 . 1 . . . . A 287 ASN C . 36272 1 132 . 1 . 1 15 15 ASN CA C 13 53.214 0.079 . 1 . . . . A 287 ASN CA . 36272 1 133 . 1 . 1 15 15 ASN CB C 13 43.413 0.046 . 1 . . . . A 287 ASN CB . 36272 1 134 . 1 . 1 15 15 ASN N N 15 121.612 0.050 . 1 . . . . A 287 ASN N . 36272 1 135 . 1 . 1 15 15 ASN ND2 N 15 113.447 0.028 . 1 . . . . A 287 ASN ND2 . 36272 1 136 . 1 . 1 16 16 ASP H H 1 8.955 0.007 . 1 . . . . A 288 ASP H . 36272 1 137 . 1 . 1 16 16 ASP HA H 1 4.933 0.019 . 1 . . . . A 288 ASP HA . 36272 1 138 . 1 . 1 16 16 ASP HB2 H 1 2.848 0.004 . . . . . . A 288 ASP HB2 . 36272 1 139 . 1 . 1 16 16 ASP C C 13 173.601 0.000 . 1 . . . . A 288 ASP C . 36272 1 140 . 1 . 1 16 16 ASP CA C 13 53.913 0.098 . 1 . . . . A 288 ASP CA . 36272 1 141 . 1 . 1 16 16 ASP CB C 13 44.843 0.060 . 1 . . . . A 288 ASP CB . 36272 1 142 . 1 . 1 16 16 ASP N N 15 118.249 0.057 . 1 . . . . A 288 ASP N . 36272 1 143 . 1 . 1 17 17 SER H H 1 8.429 0.004 . 1 . . . . A 289 SER H . 36272 1 144 . 1 . 1 17 17 SER HA H 1 5.519 0.006 . 1 . . . . A 289 SER HA . 36272 1 145 . 1 . 1 17 17 SER HB2 H 1 3.767 0.008 . . . . . . A 289 SER HB2 . 36272 1 146 . 1 . 1 17 17 SER HB3 H 1 3.559 0.005 . . . . . . A 289 SER HB3 . 36272 1 147 . 1 . 1 17 17 SER C C 13 173.377 0.000 . 1 . . . . A 289 SER C . 36272 1 148 . 1 . 1 17 17 SER CA C 13 56.910 0.070 . 1 . . . . A 289 SER CA . 36272 1 149 . 1 . 1 17 17 SER CB C 13 67.380 0.042 . 1 . . . . A 289 SER CB . 36272 1 150 . 1 . 1 17 17 SER N N 15 111.492 0.061 . 1 . . . . A 289 SER N . 36272 1 151 . 1 . 1 18 18 TYR H H 1 8.543 0.011 . 1 . . . . A 290 TYR H . 36272 1 152 . 1 . 1 18 18 TYR HA H 1 4.701 0.006 . 1 . . . . A 290 TYR HA . 36272 1 153 . 1 . 1 18 18 TYR HB2 H 1 3.042 0.009 . . . . . . A 290 TYR HB2 . 36272 1 154 . 1 . 1 18 18 TYR HB3 H 1 2.773 0.005 . . . . . . A 290 TYR HB3 . 36272 1 155 . 1 . 1 18 18 TYR HD1 H 1 6.694 0.008 . . . . . . A 290 TYR HD1 . 36272 1 156 . 1 . 1 18 18 TYR C C 13 173.123 0.000 . 1 . . . . A 290 TYR C . 36272 1 157 . 1 . 1 18 18 TYR CA C 13 56.230 0.032 . 1 . . . . A 290 TYR CA . 36272 1 158 . 1 . 1 18 18 TYR CB C 13 40.088 0.065 . 1 . . . . A 290 TYR CB . 36272 1 159 . 1 . 1 18 18 TYR N N 15 116.788 0.031 . 1 . . . . A 290 TYR N . 36272 1 160 . 1 . 1 19 19 GLU H H 1 8.800 0.006 . 1 . . . . A 291 GLU H . 36272 1 161 . 1 . 1 19 19 GLU HA H 1 4.263 0.016 . 1 . . . . A 291 GLU HA . 36272 1 162 . 1 . 1 19 19 GLU HB2 H 1 3.025 0.027 . . . . . . A 291 GLU HB2 . 36272 1 163 . 1 . 1 19 19 GLU HG2 H 1 2.128 0.012 . . . . . . A 291 GLU HG2 . 36272 1 164 . 1 . 1 19 19 GLU HG3 H 1 1.594 0.014 . . . . . . A 291 GLU HG3 . 36272 1 165 . 1 . 1 19 19 GLU C C 13 174.244 0.000 . 1 . . . . A 291 GLU C . 36272 1 166 . 1 . 1 19 19 GLU CA C 13 56.513 0.054 . 1 . . . . A 291 GLU CA . 36272 1 167 . 1 . 1 19 19 GLU CB C 13 29.640 0.048 . 1 . . . . A 291 GLU CB . 36272 1 168 . 1 . 1 19 19 GLU CG C 13 38.819 0.075 . 1 . . . . A 291 GLU CG . 36272 1 169 . 1 . 1 19 19 GLU N N 15 121.481 0.029 . 1 . . . . A 291 GLU N . 36272 1 170 . 1 . 1 20 20 LYS H H 1 7.447 0.006 . 1 . . . . A 292 LYS H . 36272 1 171 . 1 . 1 20 20 LYS HA H 1 4.390 0.011 . 1 . . . . A 292 LYS HA . 36272 1 172 . 1 . 1 20 20 LYS C C 13 175.229 0.000 . 1 . . . . A 292 LYS C . 36272 1 173 . 1 . 1 20 20 LYS CA C 13 54.806 0.047 . 1 . . . . A 292 LYS CA . 36272 1 174 . 1 . 1 20 20 LYS CB C 13 35.244 0.072 . 1 . . . . A 292 LYS CB . 36272 1 175 . 1 . 1 20 20 LYS N N 15 127.269 0.037 . 1 . . . . A 292 LYS N . 36272 1 176 . 1 . 1 21 21 GLY H H 1 8.728 0.006 . 1 . . . . A 293 GLY H . 36272 1 177 . 1 . 1 21 21 GLY CA C 13 44.858 0.000 . 1 . . . . A 293 GLY CA . 36272 1 178 . 1 . 1 21 21 GLY N N 15 114.919 0.045 . 1 . . . . A 293 GLY N . 36272 1 179 . 1 . 1 22 22 PRO HA H 1 4.294 0.000 . 1 . . . . A 294 PRO HA . 36272 1 180 . 1 . 1 22 22 PRO HG2 H 1 2.772 0.004 . . . . . . A 294 PRO HG2 . 36272 1 181 . 1 . 1 22 22 PRO HG3 H 1 2.479 0.009 . . . . . . A 294 PRO HG3 . 36272 1 182 . 1 . 1 22 22 PRO C C 13 178.376 0.000 . 1 . . . . A 294 PRO C . 36272 1 183 . 1 . 1 22 22 PRO CA C 13 63.943 0.092 . 1 . . . . A 294 PRO CA . 36272 1 184 . 1 . 1 22 22 PRO CB C 13 32.126 0.105 . 1 . . . . A 294 PRO CB . 36272 1 185 . 1 . 1 22 22 PRO CG C 13 27.026 0.024 . 1 . . . . A 294 PRO CG . 36272 1 186 . 1 . 1 23 23 ASP H H 1 7.637 0.005 . 1 . . . . A 295 ASP H . 36272 1 187 . 1 . 1 23 23 ASP HA H 1 4.576 0.011 . 1 . . . . A 295 ASP HA . 36272 1 188 . 1 . 1 23 23 ASP HB2 H 1 2.655 0.011 . . . . . . A 295 ASP HB2 . 36272 1 189 . 1 . 1 23 23 ASP HB3 H 1 2.397 0.010 . . . . . . A 295 ASP HB3 . 36272 1 190 . 1 . 1 23 23 ASP C C 13 175.821 0.000 . 1 . . . . A 295 ASP C . 36272 1 191 . 1 . 1 23 23 ASP CA C 13 54.239 0.089 . 1 . . . . A 295 ASP CA . 36272 1 192 . 1 . 1 23 23 ASP CB C 13 42.865 0.066 . 1 . . . . A 295 ASP CB . 36272 1 193 . 1 . 1 23 23 ASP N N 15 112.107 0.045 . 1 . . . . A 295 ASP N . 36272 1 194 . 1 . 1 24 24 SER H H 1 7.157 0.004 . 1 . . . . A 296 SER H . 36272 1 195 . 1 . 1 24 24 SER HA H 1 5.688 0.005 . 1 . . . . A 296 SER HA . 36272 1 196 . 1 . 1 24 24 SER HB2 H 1 3.701 0.009 . . . . . . A 296 SER HB2 . 36272 1 197 . 1 . 1 24 24 SER HB3 H 1 3.442 0.004 . . . . . . A 296 SER HB3 . 36272 1 198 . 1 . 1 24 24 SER C C 13 174.006 0.000 . 1 . . . . A 296 SER C . 36272 1 199 . 1 . 1 24 24 SER CA C 13 57.781 0.037 . 1 . . . . A 296 SER CA . 36272 1 200 . 1 . 1 24 24 SER CB C 13 66.367 0.058 . 1 . . . . A 296 SER CB . 36272 1 201 . 1 . 1 24 24 SER N N 15 113.562 0.034 . 1 . . . . A 296 SER N . 36272 1 202 . 1 . 1 25 25 VAL H H 1 8.698 0.004 . 1 . . . . A 297 VAL H . 36272 1 203 . 1 . 1 25 25 VAL HA H 1 4.101 0.011 . 1 . . . . A 297 VAL HA . 36272 1 204 . 1 . 1 25 25 VAL HB H 1 1.324 0.016 . 1 . . . . A 297 VAL HB . 36272 1 205 . 1 . 1 25 25 VAL HG11 H 1 0.339 0.061 . . . . . . A 297 VAL HG11 . 36272 1 206 . 1 . 1 25 25 VAL HG12 H 1 0.339 0.061 . . . . . . A 297 VAL HG12 . 36272 1 207 . 1 . 1 25 25 VAL HG13 H 1 0.339 0.061 . . . . . . A 297 VAL HG13 . 36272 1 208 . 1 . 1 25 25 VAL HG21 H 1 -0.379 0.010 . . . . . . A 297 VAL HG21 . 36272 1 209 . 1 . 1 25 25 VAL HG22 H 1 -0.379 0.010 . . . . . . A 297 VAL HG22 . 36272 1 210 . 1 . 1 25 25 VAL HG23 H 1 -0.379 0.010 . . . . . . A 297 VAL HG23 . 36272 1 211 . 1 . 1 25 25 VAL C C 13 173.347 0.000 . 1 . . . . A 297 VAL C . 36272 1 212 . 1 . 1 25 25 VAL CA C 13 61.523 0.027 . 1 . . . . A 297 VAL CA . 36272 1 213 . 1 . 1 25 25 VAL CB C 13 34.569 0.056 . 1 . . . . A 297 VAL CB . 36272 1 214 . 1 . 1 25 25 VAL CG1 C 13 20.628 0.072 . . . . . . A 297 VAL CG1 . 36272 1 215 . 1 . 1 25 25 VAL CG2 C 13 20.658 0.092 . . . . . . A 297 VAL CG2 . 36272 1 216 . 1 . 1 25 25 VAL N N 15 126.248 0.050 . 1 . . . . A 297 VAL N . 36272 1 217 . 1 . 1 26 26 VAL H H 1 8.700 0.009 . 1 . . . . A 298 VAL H . 36272 1 218 . 1 . 1 26 26 VAL HA H 1 4.336 0.008 . 1 . . . . A 298 VAL HA . 36272 1 219 . 1 . 1 26 26 VAL HB H 1 0.855 0.015 . 1 . . . . A 298 VAL HB . 36272 1 220 . 1 . 1 26 26 VAL HG11 H 1 0.510 0.008 . . . . . . A 298 VAL HG11 . 36272 1 221 . 1 . 1 26 26 VAL HG12 H 1 0.510 0.008 . . . . . . A 298 VAL HG12 . 36272 1 222 . 1 . 1 26 26 VAL HG13 H 1 0.510 0.008 . . . . . . A 298 VAL HG13 . 36272 1 223 . 1 . 1 26 26 VAL HG21 H 1 0.229 0.039 . . . . . . A 298 VAL HG21 . 36272 1 224 . 1 . 1 26 26 VAL HG22 H 1 0.229 0.039 . . . . . . A 298 VAL HG22 . 36272 1 225 . 1 . 1 26 26 VAL HG23 H 1 0.229 0.039 . . . . . . A 298 VAL HG23 . 36272 1 226 . 1 . 1 26 26 VAL C C 13 173.965 0.000 . 1 . . . . A 298 VAL C . 36272 1 227 . 1 . 1 26 26 VAL CA C 13 61.093 0.104 . 1 . . . . A 298 VAL CA . 36272 1 228 . 1 . 1 26 26 VAL CB C 13 32.809 0.074 . 1 . . . . A 298 VAL CB . 36272 1 229 . 1 . 1 26 26 VAL CG1 C 13 21.646 0.102 . . . . . . A 298 VAL CG1 . 36272 1 230 . 1 . 1 26 26 VAL N N 15 128.354 0.035 . 1 . . . . A 298 VAL N . 36272 1 231 . 1 . 1 27 27 VAL H H 1 8.896 0.005 . 1 . . . . A 299 VAL H . 36272 1 232 . 1 . 1 27 27 VAL HA H 1 4.412 0.008 . 1 . . . . A 299 VAL HA . 36272 1 233 . 1 . 1 27 27 VAL HB H 1 1.669 0.008 . 1 . . . . A 299 VAL HB . 36272 1 234 . 1 . 1 27 27 VAL HG11 H 1 0.849 0.009 . . . . . . A 299 VAL HG11 . 36272 1 235 . 1 . 1 27 27 VAL HG12 H 1 0.849 0.009 . . . . . . A 299 VAL HG12 . 36272 1 236 . 1 . 1 27 27 VAL HG13 H 1 0.849 0.009 . . . . . . A 299 VAL HG13 . 36272 1 237 . 1 . 1 27 27 VAL HG21 H 1 0.653 0.011 . . . . . . A 299 VAL HG21 . 36272 1 238 . 1 . 1 27 27 VAL HG22 H 1 0.653 0.011 . . . . . . A 299 VAL HG22 . 36272 1 239 . 1 . 1 27 27 VAL HG23 H 1 0.653 0.011 . . . . . . A 299 VAL HG23 . 36272 1 240 . 1 . 1 27 27 VAL C C 13 174.491 0.000 . 1 . . . . A 299 VAL C . 36272 1 241 . 1 . 1 27 27 VAL CA C 13 60.026 0.056 . 1 . . . . A 299 VAL CA . 36272 1 242 . 1 . 1 27 27 VAL CB C 13 34.658 0.064 . 1 . . . . A 299 VAL CB . 36272 1 243 . 1 . 1 27 27 VAL CG1 C 13 21.385 0.022 . . . . . . A 299 VAL CG1 . 36272 1 244 . 1 . 1 27 27 VAL CG2 C 13 21.515 0.123 . . . . . . A 299 VAL CG2 . 36272 1 245 . 1 . 1 27 27 VAL N N 15 125.913 0.038 . 1 . . . . A 299 VAL N . 36272 1 246 . 1 . 1 28 28 HIS H H 1 9.114 0.007 . 1 . . . . A 300 HIS H . 36272 1 247 . 1 . 1 28 28 HIS HA H 1 5.432 0.018 . 1 . . . . A 300 HIS HA . 36272 1 248 . 1 . 1 28 28 HIS HB2 H 1 3.093 0.007 . . . . . . A 300 HIS HB2 . 36272 1 249 . 1 . 1 28 28 HIS C C 13 173.747 0.000 . 1 . . . . A 300 HIS C . 36272 1 250 . 1 . 1 28 28 HIS CA C 13 52.622 0.047 . 1 . . . . A 300 HIS CA . 36272 1 251 . 1 . 1 28 28 HIS CB C 13 31.233 0.031 . 1 . . . . A 300 HIS CB . 36272 1 252 . 1 . 1 28 28 HIS N N 15 124.342 0.041 . 1 . . . . A 300 HIS N . 36272 1 253 . 1 . 1 29 29 VAL H H 1 9.088 0.009 . 1 . . . . A 301 VAL H . 36272 1 254 . 1 . 1 29 29 VAL HA H 1 4.123 0.008 . 1 . . . . A 301 VAL HA . 36272 1 255 . 1 . 1 29 29 VAL HB H 1 1.825 0.019 . 1 . . . . A 301 VAL HB . 36272 1 256 . 1 . 1 29 29 VAL HG11 H 1 0.774 0.011 . . . . . . A 301 VAL HG11 . 36272 1 257 . 1 . 1 29 29 VAL HG12 H 1 0.774 0.011 . . . . . . A 301 VAL HG12 . 36272 1 258 . 1 . 1 29 29 VAL HG13 H 1 0.774 0.011 . . . . . . A 301 VAL HG13 . 36272 1 259 . 1 . 1 29 29 VAL HG21 H 1 0.367 0.040 . . . . . . A 301 VAL HG21 . 36272 1 260 . 1 . 1 29 29 VAL HG22 H 1 0.367 0.040 . . . . . . A 301 VAL HG22 . 36272 1 261 . 1 . 1 29 29 VAL HG23 H 1 0.367 0.040 . . . . . . A 301 VAL HG23 . 36272 1 262 . 1 . 1 29 29 VAL C C 13 176.248 0.000 . 1 . . . . A 301 VAL C . 36272 1 263 . 1 . 1 29 29 VAL CA C 13 61.130 0.057 . 1 . . . . A 301 VAL CA . 36272 1 264 . 1 . 1 29 29 VAL CB C 13 32.832 0.047 . 1 . . . . A 301 VAL CB . 36272 1 265 . 1 . 1 29 29 VAL CG1 C 13 22.104 0.034 . . . . . . A 301 VAL CG1 . 36272 1 266 . 1 . 1 29 29 VAL CG2 C 13 22.122 0.009 . . . . . . A 301 VAL CG2 . 36272 1 267 . 1 . 1 29 29 VAL N N 15 121.838 0.042 . 1 . . . . A 301 VAL N . 36272 1 268 . 1 . 1 30 30 TYR H H 1 8.060 0.005 . 1 . . . . A 302 TYR H . 36272 1 269 . 1 . 1 30 30 TYR HA H 1 4.234 0.014 . 1 . . . . A 302 TYR HA . 36272 1 270 . 1 . 1 30 30 TYR HB2 H 1 2.898 0.010 . . . . . . A 302 TYR HB2 . 36272 1 271 . 1 . 1 30 30 TYR HB3 H 1 2.326 0.010 . . . . . . A 302 TYR HB3 . 36272 1 272 . 1 . 1 30 30 TYR HD1 H 1 6.761 0.019 . . . . . . A 302 TYR HD1 . 36272 1 273 . 1 . 1 30 30 TYR C C 13 174.000 0.000 . 1 . . . . A 302 TYR C . 36272 1 274 . 1 . 1 30 30 TYR CA C 13 58.862 0.123 . 1 . . . . A 302 TYR CA . 36272 1 275 . 1 . 1 30 30 TYR CB C 13 36.305 0.053 . 1 . . . . A 302 TYR CB . 36272 1 276 . 1 . 1 30 30 TYR N N 15 129.004 0.046 . 1 . . . . A 302 TYR N . 36272 1 277 . 1 . 1 31 31 VAL H H 1 7.011 0.006 . 1 . . . . A 303 VAL H . 36272 1 278 . 1 . 1 31 31 VAL HA H 1 3.708 0.007 . 1 . . . . A 303 VAL HA . 36272 1 279 . 1 . 1 31 31 VAL HB H 1 0.916 0.006 . 1 . . . . A 303 VAL HB . 36272 1 280 . 1 . 1 31 31 VAL HG11 H 1 0.093 0.007 . . . . . . A 303 VAL HG11 . 36272 1 281 . 1 . 1 31 31 VAL HG12 H 1 0.093 0.007 . . . . . . A 303 VAL HG12 . 36272 1 282 . 1 . 1 31 31 VAL HG13 H 1 0.093 0.007 . . . . . . A 303 VAL HG13 . 36272 1 283 . 1 . 1 31 31 VAL HG21 H 1 -0.165 0.029 . . . . . . A 303 VAL HG21 . 36272 1 284 . 1 . 1 31 31 VAL HG22 H 1 -0.165 0.029 . . . . . . A 303 VAL HG22 . 36272 1 285 . 1 . 1 31 31 VAL HG23 H 1 -0.165 0.029 . . . . . . A 303 VAL HG23 . 36272 1 286 . 1 . 1 31 31 VAL C C 13 173.329 0.000 . 1 . . . . A 303 VAL C . 36272 1 287 . 1 . 1 31 31 VAL CA C 13 61.563 0.057 . 1 . . . . A 303 VAL CA . 36272 1 288 . 1 . 1 31 31 VAL CB C 13 34.394 0.057 . 1 . . . . A 303 VAL CB . 36272 1 289 . 1 . 1 31 31 VAL CG1 C 13 20.744 0.068 . . . . . . A 303 VAL CG1 . 36272 1 290 . 1 . 1 31 31 VAL CG2 C 13 20.800 0.075 . . . . . . A 303 VAL CG2 . 36272 1 291 . 1 . 1 31 31 VAL N N 15 123.784 0.039 . 1 . . . . A 303 VAL N . 36272 1 292 . 1 . 1 32 32 LYS H H 1 8.557 0.006 . 1 . . . . A 304 LYS H . 36272 1 293 . 1 . 1 32 32 LYS HA H 1 4.317 0.009 . 1 . . . . A 304 LYS HA . 36272 1 294 . 1 . 1 32 32 LYS HB2 H 1 1.715 0.013 . . . . . . A 304 LYS HB2 . 36272 1 295 . 1 . 1 32 32 LYS HB3 H 1 1.604 0.003 . . . . . . A 304 LYS HB3 . 36272 1 296 . 1 . 1 32 32 LYS HG2 H 1 1.308 0.013 . . . . . . A 304 LYS HG2 . 36272 1 297 . 1 . 1 32 32 LYS HG3 H 1 1.231 0.000 . . . . . . A 304 LYS HG3 . 36272 1 298 . 1 . 1 32 32 LYS HE2 H 1 2.866 0.019 . . . . . . A 304 LYS HE2 . 36272 1 299 . 1 . 1 32 32 LYS C C 13 174.511 0.000 . 1 . . . . A 304 LYS C . 36272 1 300 . 1 . 1 32 32 LYS CA C 13 54.886 0.073 . 1 . . . . A 304 LYS CA . 36272 1 301 . 1 . 1 32 32 LYS CB C 13 34.901 0.049 . 1 . . . . A 304 LYS CB . 36272 1 302 . 1 . 1 32 32 LYS CG C 13 25.117 0.041 . 1 . . . . A 304 LYS CG . 36272 1 303 . 1 . 1 32 32 LYS CE C 13 43.193 0.000 . 1 . . . . A 304 LYS CE . 36272 1 304 . 1 . 1 32 32 LYS N N 15 123.759 0.032 . 1 . . . . A 304 LYS N . 36272 1 305 . 1 . 1 33 33 GLU H H 1 8.600 0.005 . 1 . . . . A 305 GLU H . 36272 1 306 . 1 . 1 33 33 GLU HA H 1 3.658 0.012 . 1 . . . . A 305 GLU HA . 36272 1 307 . 1 . 1 33 33 GLU HB2 H 1 1.561 0.014 . . . . . . A 305 GLU HB2 . 36272 1 308 . 1 . 1 33 33 GLU HG2 H 1 2.001 0.014 . . . . . . A 305 GLU HG2 . 36272 1 309 . 1 . 1 33 33 GLU C C 13 176.151 0.000 . 1 . . . . A 305 GLU C . 36272 1 310 . 1 . 1 33 33 GLU CA C 13 56.192 0.049 . 1 . . . . A 305 GLU CA . 36272 1 311 . 1 . 1 33 33 GLU CB C 13 28.103 0.069 . 1 . . . . A 305 GLU CB . 36272 1 312 . 1 . 1 33 33 GLU CG C 13 36.176 0.063 . 1 . . . . A 305 GLU CG . 36272 1 313 . 1 . 1 33 33 GLU N N 15 114.599 0.045 . 1 . . . . A 305 GLU N . 36272 1 314 . 1 . 1 34 34 ILE H H 1 8.204 0.007 . 1 . . . . A 306 ILE H . 36272 1 315 . 1 . 1 34 34 ILE HA H 1 4.059 0.010 . 1 . . . . A 306 ILE HA . 36272 1 316 . 1 . 1 34 34 ILE HB H 1 1.458 0.006 . 1 . . . . A 306 ILE HB . 36272 1 317 . 1 . 1 34 34 ILE HG21 H 1 0.052 0.007 . 1 . . . . A 306 ILE HG21 . 36272 1 318 . 1 . 1 34 34 ILE HG22 H 1 0.052 0.007 . 1 . . . . A 306 ILE HG22 . 36272 1 319 . 1 . 1 34 34 ILE HG23 H 1 0.052 0.007 . 1 . . . . A 306 ILE HG23 . 36272 1 320 . 1 . 1 34 34 ILE C C 13 177.036 0.000 . 1 . . . . A 306 ILE C . 36272 1 321 . 1 . 1 34 34 ILE CA C 13 59.603 0.073 . 1 . . . . A 306 ILE CA . 36272 1 322 . 1 . 1 34 34 ILE CB C 13 36.851 0.064 . 1 . . . . A 306 ILE CB . 36272 1 323 . 1 . 1 34 34 ILE CG1 C 13 29.820 0.000 . 1 . . . . A 306 ILE CG1 . 36272 1 324 . 1 . 1 34 34 ILE CG2 C 13 16.957 0.023 . 1 . . . . A 306 ILE CG2 . 36272 1 325 . 1 . 1 34 34 ILE N N 15 119.745 0.051 . 1 . . . . A 306 ILE N . 36272 1 326 . 1 . 1 35 35 CYS H H 1 8.131 0.005 . 1 . . . . A 307 CYS H . 36272 1 327 . 1 . 1 35 35 CYS HA H 1 4.271 0.022 . 1 . . . . A 307 CYS HA . 36272 1 328 . 1 . 1 35 35 CYS HB2 H 1 2.834 0.013 . . . . . . A 307 CYS HB2 . 36272 1 329 . 1 . 1 35 35 CYS HB3 H 1 2.760 0.006 . . . . . . A 307 CYS HB3 . 36272 1 330 . 1 . 1 35 35 CYS C C 13 175.802 0.000 . 1 . . . . A 307 CYS C . 36272 1 331 . 1 . 1 35 35 CYS CA C 13 58.124 0.020 . 1 . . . . A 307 CYS CA . 36272 1 332 . 1 . 1 35 35 CYS CB C 13 26.325 0.063 . 1 . . . . A 307 CYS CB . 36272 1 333 . 1 . 1 35 35 CYS N N 15 125.905 0.045 . 1 . . . . A 307 CYS N . 36272 1 334 . 1 . 1 36 36 ARG H H 1 8.891 0.005 . 1 . . . . A 308 ARG H . 36272 1 335 . 1 . 1 36 36 ARG HA H 1 3.502 0.011 . 1 . . . . A 308 ARG HA . 36272 1 336 . 1 . 1 36 36 ARG HB2 H 1 1.822 0.011 . . . . . . A 308 ARG HB2 . 36272 1 337 . 1 . 1 36 36 ARG HB3 H 1 1.696 0.020 . . . . . . A 308 ARG HB3 . 36272 1 338 . 1 . 1 36 36 ARG HG2 H 1 1.260 0.014 . . . . . . A 308 ARG HG2 . 36272 1 339 . 1 . 1 36 36 ARG HD2 H 1 3.080 0.011 . . . . . . A 308 ARG HD2 . 36272 1 340 . 1 . 1 36 36 ARG HE H 1 6.627 0.004 . 1 . . . . A 308 ARG HE . 36272 1 341 . 1 . 1 36 36 ARG C C 13 176.915 0.000 . 1 . . . . A 308 ARG C . 36272 1 342 . 1 . 1 36 36 ARG CA C 13 59.568 0.039 . 1 . . . . A 308 ARG CA . 36272 1 343 . 1 . 1 36 36 ARG CB C 13 29.795 0.076 . 1 . . . . A 308 ARG CB . 36272 1 344 . 1 . 1 36 36 ARG CG C 13 27.702 0.059 . 1 . . . . A 308 ARG CG . 36272 1 345 . 1 . 1 36 36 ARG CD C 13 43.195 0.102 . 1 . . . . A 308 ARG CD . 36272 1 346 . 1 . 1 36 36 ARG N N 15 130.819 0.031 . 1 . . . . A 308 ARG N . 36272 1 347 . 1 . 1 36 36 ARG NE N 15 83.374 0.055 . 1 . . . . A 308 ARG NE . 36272 1 348 . 1 . 1 37 37 ASP H H 1 8.382 0.006 . 1 . . . . A 309 ASP H . 36272 1 349 . 1 . 1 37 37 ASP HA H 1 4.429 0.014 . 1 . . . . A 309 ASP HA . 36272 1 350 . 1 . 1 37 37 ASP HB2 H 1 2.638 0.006 . . . . . . A 309 ASP HB2 . 36272 1 351 . 1 . 1 37 37 ASP HB3 H 1 2.499 0.006 . . . . . . A 309 ASP HB3 . 36272 1 352 . 1 . 1 37 37 ASP C C 13 177.509 0.000 . 1 . . . . A 309 ASP C . 36272 1 353 . 1 . 1 37 37 ASP CA C 13 56.418 0.105 . 1 . . . . A 309 ASP CA . 36272 1 354 . 1 . 1 37 37 ASP CB C 13 40.755 0.037 . 1 . . . . A 309 ASP CB . 36272 1 355 . 1 . 1 37 37 ASP N N 15 114.909 0.055 . 1 . . . . A 309 ASP N . 36272 1 356 . 1 . 1 38 38 THR H H 1 7.107 0.014 . 1 . . . . A 310 THR H . 36272 1 357 . 1 . 1 38 38 THR HA H 1 4.356 0.006 . 1 . . . . A 310 THR HA . 36272 1 358 . 1 . 1 38 38 THR HB H 1 4.246 0.010 . 1 . . . . A 310 THR HB . 36272 1 359 . 1 . 1 38 38 THR HG21 H 1 0.898 0.009 . 1 . . . . A 310 THR HG21 . 36272 1 360 . 1 . 1 38 38 THR HG22 H 1 0.898 0.009 . 1 . . . . A 310 THR HG22 . 36272 1 361 . 1 . 1 38 38 THR HG23 H 1 0.898 0.009 . 1 . . . . A 310 THR HG23 . 36272 1 362 . 1 . 1 38 38 THR C C 13 174.104 0.000 . 1 . . . . A 310 THR C . 36272 1 363 . 1 . 1 38 38 THR CA C 13 60.388 0.090 . 1 . . . . A 310 THR CA . 36272 1 364 . 1 . 1 38 38 THR CB C 13 69.033 0.100 . 1 . . . . A 310 THR CB . 36272 1 365 . 1 . 1 38 38 THR CG2 C 13 22.175 0.084 . 1 . . . . A 310 THR CG2 . 36272 1 366 . 1 . 1 38 38 THR N N 15 105.606 0.042 . 1 . . . . A 310 THR N . 36272 1 367 . 1 . 1 39 39 SER H H 1 6.905 0.008 . 1 . . . . A 311 SER H . 36272 1 368 . 1 . 1 39 39 SER HA H 1 5.293 0.013 . 1 . . . . A 311 SER HA . 36272 1 369 . 1 . 1 39 39 SER HB2 H 1 3.612 0.015 . . . . . . A 311 SER HB2 . 36272 1 370 . 1 . 1 39 39 SER HB3 H 1 3.230 0.011 . . . . . . A 311 SER HB3 . 36272 1 371 . 1 . 1 39 39 SER C C 13 173.041 0.000 . 1 . . . . A 311 SER C . 36272 1 372 . 1 . 1 39 39 SER CA C 13 58.351 0.068 . 1 . . . . A 311 SER CA . 36272 1 373 . 1 . 1 39 39 SER CB C 13 64.861 0.052 . 1 . . . . A 311 SER CB . 36272 1 374 . 1 . 1 39 39 SER N N 15 116.462 0.038 . 1 . . . . A 311 SER N . 36272 1 375 . 1 . 1 40 40 ARG H H 1 9.592 0.004 . 1 . . . . A 312 ARG H . 36272 1 376 . 1 . 1 40 40 ARG HA H 1 4.294 0.010 . 1 . . . . A 312 ARG HA . 36272 1 377 . 1 . 1 40 40 ARG HB2 H 1 1.469 0.011 . . . . . . A 312 ARG HB2 . 36272 1 378 . 1 . 1 40 40 ARG HD2 H 1 3.012 0.017 . . . . . . A 312 ARG HD2 . 36272 1 379 . 1 . 1 40 40 ARG CA C 13 55.379 0.034 . 1 . . . . A 312 ARG CA . 36272 1 380 . 1 . 1 40 40 ARG CB C 13 32.128 0.038 . 1 . . . . A 312 ARG CB . 36272 1 381 . 1 . 1 40 40 ARG CD C 13 43.925 0.000 . 1 . . . . A 312 ARG CD . 36272 1 382 . 1 . 1 40 40 ARG N N 15 118.991 0.034 . 1 . . . . A 312 ARG N . 36272 1 383 . 1 . 1 41 41 VAL H H 1 8.321 0.005 . 1 . . . . A 313 VAL H . 36272 1 384 . 1 . 1 41 41 VAL HA H 1 3.986 0.007 . 1 . . . . A 313 VAL HA . 36272 1 385 . 1 . 1 41 41 VAL HG11 H 1 0.911 0.000 . . . . . . A 313 VAL HG11 . 36272 1 386 . 1 . 1 41 41 VAL HG12 H 1 0.911 0.000 . . . . . . A 313 VAL HG12 . 36272 1 387 . 1 . 1 41 41 VAL HG13 H 1 0.911 0.000 . . . . . . A 313 VAL HG13 . 36272 1 388 . 1 . 1 41 41 VAL C C 13 175.230 0.000 . 1 . . . . A 313 VAL C . 36272 1 389 . 1 . 1 41 41 VAL CA C 13 59.850 0.075 . 1 . . . . A 313 VAL CA . 36272 1 390 . 1 . 1 41 41 VAL CB C 13 32.517 0.071 . 1 . . . . A 313 VAL CB . 36272 1 391 . 1 . 1 41 41 VAL CG1 C 13 21.473 0.000 . . . . . . A 313 VAL CG1 . 36272 1 392 . 1 . 1 41 41 VAL CG2 C 13 22.716 0.000 . . . . . . A 313 VAL CG2 . 36272 1 393 . 1 . 1 41 41 VAL N N 15 115.717 0.040 . 1 . . . . A 313 VAL N . 36272 1 394 . 1 . 1 42 42 LEU H H 1 8.587 0.012 . 1 . . . . A 314 LEU H . 36272 1 395 . 1 . 1 42 42 LEU HA H 1 4.342 0.008 . 1 . . . . A 314 LEU HA . 36272 1 396 . 1 . 1 42 42 LEU HB2 H 1 1.348 0.007 . . . . . . A 314 LEU HB2 . 36272 1 397 . 1 . 1 42 42 LEU C C 13 176.589 0.000 . 1 . . . . A 314 LEU C . 36272 1 398 . 1 . 1 42 42 LEU CA C 13 52.711 0.056 . 1 . . . . A 314 LEU CA . 36272 1 399 . 1 . 1 42 42 LEU CB C 13 43.178 0.054 . 1 . . . . A 314 LEU CB . 36272 1 400 . 1 . 1 42 42 LEU N N 15 125.187 0.055 . 1 . . . . A 314 LEU N . 36272 1 401 . 1 . 1 43 43 PHE H H 1 9.235 0.004 . 1 . . . . A 315 PHE H . 36272 1 402 . 1 . 1 43 43 PHE HA H 1 4.945 0.009 . 1 . . . . A 315 PHE HA . 36272 1 403 . 1 . 1 43 43 PHE HB2 H 1 2.876 0.015 . . . . . . A 315 PHE HB2 . 36272 1 404 . 1 . 1 43 43 PHE C C 13 174.306 0.000 . 1 . . . . A 315 PHE C . 36272 1 405 . 1 . 1 43 43 PHE CA C 13 57.994 0.086 . 1 . . . . A 315 PHE CA . 36272 1 406 . 1 . 1 43 43 PHE CB C 13 41.777 0.119 . 1 . . . . A 315 PHE CB . 36272 1 407 . 1 . 1 43 43 PHE N N 15 123.982 0.036 . 1 . . . . A 315 PHE N . 36272 1 408 . 1 . 1 44 44 ARG H H 1 8.813 0.005 . 1 . . . . A 316 ARG H . 36272 1 409 . 1 . 1 44 44 ARG HA H 1 4.496 0.017 . 1 . . . . A 316 ARG HA . 36272 1 410 . 1 . 1 44 44 ARG HB2 H 1 2.020 0.012 . . . . . . A 316 ARG HB2 . 36272 1 411 . 1 . 1 44 44 ARG HB3 H 1 1.859 0.015 . . . . . . A 316 ARG HB3 . 36272 1 412 . 1 . 1 44 44 ARG HG2 H 1 1.527 0.022 . . . . . . A 316 ARG HG2 . 36272 1 413 . 1 . 1 44 44 ARG HE H 1 6.910 0.011 . 1 . . . . A 316 ARG HE . 36272 1 414 . 1 . 1 44 44 ARG C C 13 174.631 0.000 . 1 . . . . A 316 ARG C . 36272 1 415 . 1 . 1 44 44 ARG CA C 13 55.207 0.099 . 1 . . . . A 316 ARG CA . 36272 1 416 . 1 . 1 44 44 ARG CB C 13 33.059 0.126 . 1 . . . . A 316 ARG CB . 36272 1 417 . 1 . 1 44 44 ARG CG C 13 26.986 0.030 . 1 . . . . A 316 ARG CG . 36272 1 418 . 1 . 1 44 44 ARG CD C 13 43.827 0.000 . 1 . . . . A 316 ARG CD . 36272 1 419 . 1 . 1 44 44 ARG N N 15 123.430 0.063 . 1 . . . . A 316 ARG N . 36272 1 420 . 1 . 1 44 44 ARG NE N 15 78.729 0.000 . 1 . . . . A 316 ARG NE . 36272 1 421 . 1 . 1 45 45 GLU H H 1 8.326 0.009 . 1 . . . . A 317 GLU H . 36272 1 422 . 1 . 1 45 45 GLU HA H 1 3.989 0.015 . 1 . . . . A 317 GLU HA . 36272 1 423 . 1 . 1 45 45 GLU HB2 H 1 2.002 0.015 . . . . . . A 317 GLU HB2 . 36272 1 424 . 1 . 1 45 45 GLU HG2 H 1 2.312 0.007 . . . . . . A 317 GLU HG2 . 36272 1 425 . 1 . 1 45 45 GLU C C 13 175.261 0.000 . 1 . . . . A 317 GLU C . 36272 1 426 . 1 . 1 45 45 GLU CA C 13 59.894 0.045 . 1 . . . . A 317 GLU CA . 36272 1 427 . 1 . 1 45 45 GLU CB C 13 29.198 0.062 . 1 . . . . A 317 GLU CB . 36272 1 428 . 1 . 1 45 45 GLU CG C 13 36.328 0.090 . 1 . . . . A 317 GLU CG . 36272 1 429 . 1 . 1 45 45 GLU N N 15 115.111 0.061 . 1 . . . . A 317 GLU N . 36272 1 430 . 1 . 1 46 46 GLN H H 1 8.438 0.004 . 1 . . . . A 318 GLN H . 36272 1 431 . 1 . 1 46 46 GLN HA H 1 4.454 0.004 . 1 . . . . A 318 GLN HA . 36272 1 432 . 1 . 1 46 46 GLN HB2 H 1 1.964 0.018 . . . . . . A 318 GLN HB2 . 36272 1 433 . 1 . 1 46 46 GLN HG2 H 1 2.268 0.014 . . . . . . A 318 GLN HG2 . 36272 1 434 . 1 . 1 46 46 GLN HE21 H 1 6.978 0.014 . . . . . . A 318 GLN HE21 . 36272 1 435 . 1 . 1 46 46 GLN HE22 H 1 6.493 0.022 . . . . . . A 318 GLN HE22 . 36272 1 436 . 1 . 1 46 46 GLN C C 13 176.140 0.000 . 1 . . . . A 318 GLN C . 36272 1 437 . 1 . 1 46 46 GLN CA C 13 54.519 0.088 . 1 . . . . A 318 GLN CA . 36272 1 438 . 1 . 1 46 46 GLN CB C 13 31.001 0.014 . 1 . . . . A 318 GLN CB . 36272 1 439 . 1 . 1 46 46 GLN CG C 13 35.534 0.000 . 1 . . . . A 318 GLN CG . 36272 1 440 . 1 . 1 46 46 GLN N N 15 115.979 0.043 . 1 . . . . A 318 GLN N . 36272 1 441 . 1 . 1 46 46 GLN NE2 N 15 111.285 0.015 . 1 . . . . A 318 GLN NE2 . 36272 1 442 . 1 . 1 47 47 ASP H H 1 7.422 0.003 . 1 . . . . A 319 ASP H . 36272 1 443 . 1 . 1 47 47 ASP HA H 1 5.011 0.026 . 1 . . . . A 319 ASP HA . 36272 1 444 . 1 . 1 47 47 ASP HB2 H 1 2.660 0.008 . . . . . . A 319 ASP HB2 . 36272 1 445 . 1 . 1 47 47 ASP HB3 H 1 2.156 0.013 . . . . . . A 319 ASP HB3 . 36272 1 446 . 1 . 1 47 47 ASP C C 13 173.614 0.000 . 1 . . . . A 319 ASP C . 36272 1 447 . 1 . 1 47 47 ASP CA C 13 53.850 0.048 . 1 . . . . A 319 ASP CA . 36272 1 448 . 1 . 1 47 47 ASP CB C 13 44.247 0.032 . 1 . . . . A 319 ASP CB . 36272 1 449 . 1 . 1 47 47 ASP N N 15 115.412 0.047 . 1 . . . . A 319 ASP N . 36272 1 450 . 1 . 1 48 48 PHE H H 1 7.698 0.008 . 1 . . . . A 320 PHE H . 36272 1 451 . 1 . 1 48 48 PHE HA H 1 5.412 0.009 . 1 . . . . A 320 PHE HA . 36272 1 452 . 1 . 1 48 48 PHE HB2 H 1 2.676 0.011 . . . . . . A 320 PHE HB2 . 36272 1 453 . 1 . 1 48 48 PHE HD1 H 1 6.716 0.011 . . . . . . A 320 PHE HD1 . 36272 1 454 . 1 . 1 48 48 PHE C C 13 172.616 0.000 . 1 . . . . A 320 PHE C . 36272 1 455 . 1 . 1 48 48 PHE CA C 13 55.875 0.025 . 1 . . . . A 320 PHE CA . 36272 1 456 . 1 . 1 48 48 PHE CB C 13 43.396 0.080 . 1 . . . . A 320 PHE CB . 36272 1 457 . 1 . 1 48 48 PHE N N 15 110.463 0.031 . 1 . . . . A 320 PHE N . 36272 1 458 . 1 . 1 49 49 THR H H 1 8.704 0.010 . 1 . . . . A 321 THR H . 36272 1 459 . 1 . 1 49 49 THR HA H 1 4.756 0.011 . 1 . . . . A 321 THR HA . 36272 1 460 . 1 . 1 49 49 THR HB H 1 3.637 0.008 . 1 . . . . A 321 THR HB . 36272 1 461 . 1 . 1 49 49 THR HG21 H 1 0.800 0.013 . 1 . . . . A 321 THR HG21 . 36272 1 462 . 1 . 1 49 49 THR HG22 H 1 0.800 0.013 . 1 . . . . A 321 THR HG22 . 36272 1 463 . 1 . 1 49 49 THR HG23 H 1 0.800 0.013 . 1 . . . . A 321 THR HG23 . 36272 1 464 . 1 . 1 49 49 THR C C 13 172.525 0.000 . 1 . . . . A 321 THR C . 36272 1 465 . 1 . 1 49 49 THR CA C 13 61.539 0.021 . 1 . . . . A 321 THR CA . 36272 1 466 . 1 . 1 49 49 THR CB C 13 70.656 0.067 . 1 . . . . A 321 THR CB . 36272 1 467 . 1 . 1 49 49 THR CG2 C 13 21.346 0.070 . 1 . . . . A 321 THR CG2 . 36272 1 468 . 1 . 1 49 49 THR N N 15 116.334 0.034 . 1 . . . . A 321 THR N . 36272 1 469 . 1 . 1 50 50 LEU H H 1 9.399 0.043 . 1 . . . . A 322 LEU H . 36272 1 470 . 1 . 1 50 50 LEU HA H 1 4.722 0.006 . 1 . . . . A 322 LEU HA . 36272 1 471 . 1 . 1 50 50 LEU HB2 H 1 1.423 0.015 . . . . . . A 322 LEU HB2 . 36272 1 472 . 1 . 1 50 50 LEU C C 13 173.614 0.000 . 1 . . . . A 322 LEU C . 36272 1 473 . 1 . 1 50 50 LEU CA C 13 54.167 0.081 . 1 . . . . A 322 LEU CA . 36272 1 474 . 1 . 1 50 50 LEU CB C 13 44.134 0.089 . 1 . . . . A 322 LEU CB . 36272 1 475 . 1 . 1 50 50 LEU N N 15 130.719 0.046 . 1 . . . . A 322 LEU N . 36272 1 476 . 1 . 1 51 51 ILE H H 1 8.790 0.004 . 1 . . . . A 323 ILE H . 36272 1 477 . 1 . 1 51 51 ILE HA H 1 5.230 0.026 . 1 . . . . A 323 ILE HA . 36272 1 478 . 1 . 1 51 51 ILE HB H 1 1.491 0.011 . 1 . . . . A 323 ILE HB . 36272 1 479 . 1 . 1 51 51 ILE HG21 H 1 0.715 0.018 . 1 . . . . A 323 ILE HG21 . 36272 1 480 . 1 . 1 51 51 ILE HG22 H 1 0.715 0.018 . 1 . . . . A 323 ILE HG22 . 36272 1 481 . 1 . 1 51 51 ILE HG23 H 1 0.715 0.018 . 1 . . . . A 323 ILE HG23 . 36272 1 482 . 1 . 1 51 51 ILE C C 13 175.146 0.000 . 1 . . . . A 323 ILE C . 36272 1 483 . 1 . 1 51 51 ILE CA C 13 59.796 0.092 . 1 . . . . A 323 ILE CA . 36272 1 484 . 1 . 1 51 51 ILE CB C 13 40.578 0.043 . 1 . . . . A 323 ILE CB . 36272 1 485 . 1 . 1 51 51 ILE CG2 C 13 17.854 0.082 . 1 . . . . A 323 ILE CG2 . 36272 1 486 . 1 . 1 51 51 ILE N N 15 129.131 0.028 . 1 . . . . A 323 ILE N . 36272 1 487 . 1 . 1 52 52 PHE H H 1 9.076 0.006 . 1 . . . . A 324 PHE H . 36272 1 488 . 1 . 1 52 52 PHE HA H 1 5.357 0.017 . 1 . . . . A 324 PHE HA . 36272 1 489 . 1 . 1 52 52 PHE HB2 H 1 2.746 0.011 . . . . . . A 324 PHE HB2 . 36272 1 490 . 1 . 1 52 52 PHE HD1 H 1 7.350 0.009 . . . . . . A 324 PHE HD1 . 36272 1 491 . 1 . 1 52 52 PHE C C 13 172.267 0.000 . 1 . . . . A 324 PHE C . 36272 1 492 . 1 . 1 52 52 PHE CA C 13 55.756 0.064 . 1 . . . . A 324 PHE CA . 36272 1 493 . 1 . 1 52 52 PHE CB C 13 40.797 0.037 . 1 . . . . A 324 PHE CB . 36272 1 494 . 1 . 1 52 52 PHE N N 15 119.989 0.026 . 1 . . . . A 324 PHE N . 36272 1 495 . 1 . 1 53 53 GLN H H 1 7.359 0.010 . 1 . . . . A 325 GLN H . 36272 1 496 . 1 . 1 53 53 GLN HA H 1 4.784 0.036 . 1 . . . . A 325 GLN HA . 36272 1 497 . 1 . 1 53 53 GLN HB2 H 1 2.115 0.017 . . . . . . A 325 GLN HB2 . 36272 1 498 . 1 . 1 53 53 GLN HB3 H 1 1.633 0.011 . . . . . . A 325 GLN HB3 . 36272 1 499 . 1 . 1 53 53 GLN HG2 H 1 2.257 0.007 . . . . . . A 325 GLN HG2 . 36272 1 500 . 1 . 1 53 53 GLN HE21 H 1 7.482 0.003 . . . . . . A 325 GLN HE21 . 36272 1 501 . 1 . 1 53 53 GLN HE22 H 1 6.585 0.053 . . . . . . A 325 GLN HE22 . 36272 1 502 . 1 . 1 53 53 GLN C C 13 174.974 0.000 . 1 . . . . A 325 GLN C . 36272 1 503 . 1 . 1 53 53 GLN CA C 13 53.746 0.050 . 1 . . . . A 325 GLN CA . 36272 1 504 . 1 . 1 53 53 GLN CB C 13 31.460 0.080 . 1 . . . . A 325 GLN CB . 36272 1 505 . 1 . 1 53 53 GLN CG C 13 33.616 0.043 . 1 . . . . A 325 GLN CG . 36272 1 506 . 1 . 1 53 53 GLN N N 15 115.602 0.046 . 1 . . . . A 325 GLN N . 36272 1 507 . 1 . 1 53 53 GLN NE2 N 15 112.331 0.049 . 1 . . . . A 325 GLN NE2 . 36272 1 508 . 1 . 1 54 54 THR H H 1 10.430 0.003 . 1 . . . . A 326 THR H . 36272 1 509 . 1 . 1 54 54 THR HA H 1 5.145 0.012 . 1 . . . . A 326 THR HA . 36272 1 510 . 1 . 1 54 54 THR HB H 1 3.729 0.009 . 1 . . . . A 326 THR HB . 36272 1 511 . 1 . 1 54 54 THR HG21 H 1 1.028 0.008 . 1 . . . . A 326 THR HG21 . 36272 1 512 . 1 . 1 54 54 THR HG22 H 1 1.028 0.008 . 1 . . . . A 326 THR HG22 . 36272 1 513 . 1 . 1 54 54 THR HG23 H 1 1.028 0.008 . 1 . . . . A 326 THR HG23 . 36272 1 514 . 1 . 1 54 54 THR C C 13 170.203 0.000 . 1 . . . . A 326 THR C . 36272 1 515 . 1 . 1 54 54 THR CA C 13 58.980 0.065 . 1 . . . . A 326 THR CA . 36272 1 516 . 1 . 1 54 54 THR CB C 13 70.092 0.036 . 1 . . . . A 326 THR CB . 36272 1 517 . 1 . 1 54 54 THR CG2 C 13 19.828 0.088 . 1 . . . . A 326 THR CG2 . 36272 1 518 . 1 . 1 54 54 THR N N 15 119.064 0.032 . 1 . . . . A 326 THR N . 36272 1 519 . 1 . 1 55 55 ARG H H 1 7.460 0.010 . 1 . . . . A 327 ARG H . 36272 1 520 . 1 . 1 55 55 ARG HA H 1 4.392 0.010 . 1 . . . . A 327 ARG HA . 36272 1 521 . 1 . 1 55 55 ARG HB2 H 1 1.981 0.011 . . . . . . A 327 ARG HB2 . 36272 1 522 . 1 . 1 55 55 ARG HB3 H 1 1.505 0.006 . . . . . . A 327 ARG HB3 . 36272 1 523 . 1 . 1 55 55 ARG HG2 H 1 1.558 0.007 . . . . . . A 327 ARG HG2 . 36272 1 524 . 1 . 1 55 55 ARG HD2 H 1 3.076 0.010 . . . . . . A 327 ARG HD2 . 36272 1 525 . 1 . 1 55 55 ARG C C 13 176.539 0.000 . 1 . . . . A 327 ARG C . 36272 1 526 . 1 . 1 55 55 ARG CA C 13 54.689 0.053 . 1 . . . . A 327 ARG CA . 36272 1 527 . 1 . 1 55 55 ARG CB C 13 30.726 0.077 . 1 . . . . A 327 ARG CB . 36272 1 528 . 1 . 1 55 55 ARG CG C 13 28.242 0.036 . 1 . . . . A 327 ARG CG . 36272 1 529 . 1 . 1 55 55 ARG CD C 13 43.115 0.030 . 1 . . . . A 327 ARG CD . 36272 1 530 . 1 . 1 55 55 ARG N N 15 121.002 0.053 . 1 . . . . A 327 ARG N . 36272 1 531 . 1 . 1 56 56 ASP H H 1 8.772 0.008 . 1 . . . . A 328 ASP H . 36272 1 532 . 1 . 1 56 56 ASP HA H 1 4.156 0.011 . 1 . . . . A 328 ASP HA . 36272 1 533 . 1 . 1 56 56 ASP HB2 H 1 2.800 0.009 . . . . . . A 328 ASP HB2 . 36272 1 534 . 1 . 1 56 56 ASP HB3 H 1 2.512 0.010 . . . . . . A 328 ASP HB3 . 36272 1 535 . 1 . 1 56 56 ASP C C 13 177.082 0.000 . 1 . . . . A 328 ASP C . 36272 1 536 . 1 . 1 56 56 ASP CA C 13 54.135 0.058 . 1 . . . . A 328 ASP CA . 36272 1 537 . 1 . 1 56 56 ASP CB C 13 41.228 0.037 . 1 . . . . A 328 ASP CB . 36272 1 538 . 1 . 1 56 56 ASP N N 15 122.625 0.038 . 1 . . . . A 328 ASP N . 36272 1 539 . 1 . 1 57 57 GLY H H 1 9.045 0.005 . 1 . . . . A 329 GLY H . 36272 1 540 . 1 . 1 57 57 GLY HA2 H 1 3.887 0.024 . . . . . . A 329 GLY HA2 . 36272 1 541 . 1 . 1 57 57 GLY HA3 H 1 3.672 0.007 . . . . . . A 329 GLY HA3 . 36272 1 542 . 1 . 1 57 57 GLY C C 13 176.236 0.000 . 1 . . . . A 329 GLY C . 36272 1 543 . 1 . 1 57 57 GLY CA C 13 47.160 0.043 . 1 . . . . A 329 GLY CA . 36272 1 544 . 1 . 1 57 57 GLY N N 15 117.886 0.031 . 1 . . . . A 329 GLY N . 36272 1 545 . 1 . 1 58 58 ASN H H 1 8.160 0.012 . 1 . . . . A 330 ASN H . 36272 1 546 . 1 . 1 58 58 ASN HA H 1 4.288 0.007 . 1 . . . . A 330 ASN HA . 36272 1 547 . 1 . 1 58 58 ASN HB2 H 1 2.900 0.003 . . . . . . A 330 ASN HB2 . 36272 1 548 . 1 . 1 58 58 ASN HB3 H 1 2.663 0.007 . . . . . . A 330 ASN HB3 . 36272 1 549 . 1 . 1 58 58 ASN HD21 H 1 7.938 0.003 . . . . . . A 330 ASN HD21 . 36272 1 550 . 1 . 1 58 58 ASN HD22 H 1 6.979 0.011 . . . . . . A 330 ASN HD22 . 36272 1 551 . 1 . 1 58 58 ASN C C 13 176.713 0.000 . 1 . . . . A 330 ASN C . 36272 1 552 . 1 . 1 58 58 ASN CA C 13 55.684 0.201 . 1 . . . . A 330 ASN CA . 36272 1 553 . 1 . 1 58 58 ASN CB C 13 37.897 0.030 . 1 . . . . A 330 ASN CB . 36272 1 554 . 1 . 1 58 58 ASN N N 15 119.097 0.153 . 1 . . . . A 330 ASN N . 36272 1 555 . 1 . 1 58 58 ASN ND2 N 15 115.271 0.032 . 1 . . . . A 330 ASN ND2 . 36272 1 556 . 1 . 1 59 59 PHE H H 1 7.440 0.006 . 1 . . . . A 331 PHE H . 36272 1 557 . 1 . 1 59 59 PHE HA H 1 4.070 0.008 . 1 . . . . A 331 PHE HA . 36272 1 558 . 1 . 1 59 59 PHE HB2 H 1 3.101 0.012 . . . . . . A 331 PHE HB2 . 36272 1 559 . 1 . 1 59 59 PHE HB3 H 1 2.821 0.013 . . . . . . A 331 PHE HB3 . 36272 1 560 . 1 . 1 59 59 PHE HD1 H 1 6.883 0.006 . . . . . . A 331 PHE HD1 . 36272 1 561 . 1 . 1 59 59 PHE C C 13 178.142 0.000 . 1 . . . . A 331 PHE C . 36272 1 562 . 1 . 1 59 59 PHE CA C 13 61.043 0.037 . 1 . . . . A 331 PHE CA . 36272 1 563 . 1 . 1 59 59 PHE CB C 13 39.703 0.056 . 1 . . . . A 331 PHE CB . 36272 1 564 . 1 . 1 59 59 PHE N N 15 121.506 0.019 . 1 . . . . A 331 PHE N . 36272 1 565 . 1 . 1 60 60 LEU H H 1 8.524 0.012 . 1 . . . . A 332 LEU H . 36272 1 566 . 1 . 1 60 60 LEU HA H 1 3.724 0.008 . 1 . . . . A 332 LEU HA . 36272 1 567 . 1 . 1 60 60 LEU HB2 H 1 1.264 0.009 . . . . . . A 332 LEU HB2 . 36272 1 568 . 1 . 1 60 60 LEU HG H 1 1.746 0.020 . 1 . . . . A 332 LEU HG . 36272 1 569 . 1 . 1 60 60 LEU C C 13 180.127 0.000 . 1 . . . . A 332 LEU C . 36272 1 570 . 1 . 1 60 60 LEU CA C 13 58.107 0.042 . 1 . . . . A 332 LEU CA . 36272 1 571 . 1 . 1 60 60 LEU CB C 13 41.006 0.054 . 1 . . . . A 332 LEU CB . 36272 1 572 . 1 . 1 60 60 LEU CG C 13 26.624 0.033 . 1 . . . . A 332 LEU CG . 36272 1 573 . 1 . 1 60 60 LEU N N 15 117.979 0.031 . 1 . . . . A 332 LEU N . 36272 1 574 . 1 . 1 61 61 ARG H H 1 7.666 0.006 . 1 . . . . A 333 ARG H . 36272 1 575 . 1 . 1 61 61 ARG HA H 1 3.850 0.007 . 1 . . . . A 333 ARG HA . 36272 1 576 . 1 . 1 61 61 ARG HB2 H 1 1.825 0.008 . . . . . . A 333 ARG HB2 . 36272 1 577 . 1 . 1 61 61 ARG HB3 H 1 1.672 0.010 . . . . . . A 333 ARG HB3 . 36272 1 578 . 1 . 1 61 61 ARG HG2 H 1 1.509 0.014 . . . . . . A 333 ARG HG2 . 36272 1 579 . 1 . 1 61 61 ARG HD2 H 1 3.075 0.009 . . . . . . A 333 ARG HD2 . 36272 1 580 . 1 . 1 61 61 ARG C C 13 177.462 0.000 . 1 . . . . A 333 ARG C . 36272 1 581 . 1 . 1 61 61 ARG CA C 13 58.477 0.046 . 1 . . . . A 333 ARG CA . 36272 1 582 . 1 . 1 61 61 ARG CB C 13 29.586 0.053 . 1 . . . . A 333 ARG CB . 36272 1 583 . 1 . 1 61 61 ARG CG C 13 27.441 0.062 . 1 . . . . A 333 ARG CG . 36272 1 584 . 1 . 1 61 61 ARG CD C 13 43.466 0.000 . 1 . . . . A 333 ARG CD . 36272 1 585 . 1 . 1 61 61 ARG N N 15 118.227 0.062 . 1 . . . . A 333 ARG N . 36272 1 586 . 1 . 1 62 62 LEU H H 1 6.984 0.008 . 1 . . . . A 334 LEU H . 36272 1 587 . 1 . 1 62 62 LEU HA H 1 3.812 0.005 . 1 . . . . A 334 LEU HA . 36272 1 588 . 1 . 1 62 62 LEU HB2 H 1 1.262 0.010 . . . . . . A 334 LEU HB2 . 36272 1 589 . 1 . 1 62 62 LEU HB3 H 1 0.878 0.009 . . . . . . A 334 LEU HB3 . 36272 1 590 . 1 . 1 62 62 LEU HG H 1 0.662 0.020 . 1 . . . . A 334 LEU HG . 36272 1 591 . 1 . 1 62 62 LEU C C 13 175.575 0.000 . 1 . . . . A 334 LEU C . 36272 1 592 . 1 . 1 62 62 LEU CA C 13 54.855 0.056 . 1 . . . . A 334 LEU CA . 36272 1 593 . 1 . 1 62 62 LEU CB C 13 41.200 0.052 . 1 . . . . A 334 LEU CB . 36272 1 594 . 1 . 1 62 62 LEU CG C 13 25.400 0.020 . 1 . . . . A 334 LEU CG . 36272 1 595 . 1 . 1 62 62 LEU N N 15 116.963 0.030 . 1 . . . . A 334 LEU N . 36272 1 596 . 1 . 1 63 63 HIS H H 1 7.410 0.006 . 1 . . . . A 335 HIS H . 36272 1 597 . 1 . 1 63 63 HIS HA H 1 4.651 0.010 . 1 . . . . A 335 HIS HA . 36272 1 598 . 1 . 1 63 63 HIS HB2 H 1 3.319 0.020 . . . . . . A 335 HIS HB2 . 36272 1 599 . 1 . 1 63 63 HIS CA C 13 53.187 0.063 . 1 . . . . A 335 HIS CA . 36272 1 600 . 1 . 1 63 63 HIS CB C 13 29.832 0.016 . 1 . . . . A 335 HIS CB . 36272 1 601 . 1 . 1 63 63 HIS N N 15 118.034 0.047 . 1 . . . . A 335 HIS N . 36272 1 602 . 1 . 1 64 64 PRO C C 13 177.777 0.000 . 1 . . . . A 336 PRO C . 36272 1 603 . 1 . 1 64 64 PRO CA C 13 63.905 0.060 . 1 . . . . A 336 PRO CA . 36272 1 604 . 1 . 1 64 64 PRO CB C 13 31.928 0.362 . 1 . . . . A 336 PRO CB . 36272 1 605 . 1 . 1 64 64 PRO CG C 13 27.590 0.000 . 1 . . . . A 336 PRO CG . 36272 1 606 . 1 . 1 65 65 GLY H H 1 8.771 0.005 . 1 . . . . A 337 GLY H . 36272 1 607 . 1 . 1 65 65 GLY HA2 H 1 4.197 0.008 . . . . . . A 337 GLY HA2 . 36272 1 608 . 1 . 1 65 65 GLY HA3 H 1 3.601 0.007 . . . . . . A 337 GLY HA3 . 36272 1 609 . 1 . 1 65 65 GLY C C 13 174.649 0.000 . 1 . . . . A 337 GLY C . 36272 1 610 . 1 . 1 65 65 GLY CA C 13 44.919 0.080 . 1 . . . . A 337 GLY CA . 36272 1 611 . 1 . 1 65 65 GLY N N 15 112.315 0.065 . 1 . . . . A 337 GLY N . 36272 1 612 . 1 . 1 66 66 CYS H H 1 7.801 0.005 . 1 . . . . A 338 CYS H . 36272 1 613 . 1 . 1 66 66 CYS HA H 1 4.444 0.009 . 1 . . . . A 338 CYS HA . 36272 1 614 . 1 . 1 66 66 CYS HB2 H 1 2.684 0.010 . . . . . . A 338 CYS HB2 . 36272 1 615 . 1 . 1 66 66 CYS C C 13 174.060 0.000 . 1 . . . . A 338 CYS C . 36272 1 616 . 1 . 1 66 66 CYS CA C 13 58.916 0.100 . 1 . . . . A 338 CYS CA . 36272 1 617 . 1 . 1 66 66 CYS CB C 13 30.329 0.049 . 1 . . . . A 338 CYS CB . 36272 1 618 . 1 . 1 66 66 CYS N N 15 117.968 0.039 . 1 . . . . A 338 CYS N . 36272 1 619 . 1 . 1 67 67 GLY H H 1 8.747 0.009 . 1 . . . . A 339 GLY H . 36272 1 620 . 1 . 1 67 67 GLY HA2 H 1 4.511 0.008 . . . . . . A 339 GLY HA2 . 36272 1 621 . 1 . 1 67 67 GLY HA3 H 1 3.995 0.008 . . . . . . A 339 GLY HA3 . 36272 1 622 . 1 . 1 67 67 GLY CA C 13 45.731 0.062 . 1 . . . . A 339 GLY CA . 36272 1 623 . 1 . 1 67 67 GLY N N 15 110.546 0.038 . 1 . . . . A 339 GLY N . 36272 1 624 . 1 . 1 68 68 PRO C C 13 175.109 0.000 . 1 . . . . A 340 PRO C . 36272 1 625 . 1 . 1 68 68 PRO CA C 13 63.920 0.077 . 1 . . . . A 340 PRO CA . 36272 1 626 . 1 . 1 68 68 PRO CB C 13 32.381 0.118 . 1 . . . . A 340 PRO CB . 36272 1 627 . 1 . 1 68 68 PRO CG C 13 27.499 0.000 . 1 . . . . A 340 PRO CG . 36272 1 628 . 1 . 1 69 69 HIS H H 1 8.142 0.009 . 1 . . . . A 341 HIS H . 36272 1 629 . 1 . 1 69 69 HIS HA H 1 4.490 0.008 . 1 . . . . A 341 HIS HA . 36272 1 630 . 1 . 1 69 69 HIS HB2 H 1 3.044 0.014 . . . . . . A 341 HIS HB2 . 36272 1 631 . 1 . 1 69 69 HIS HB3 H 1 2.902 0.021 . . . . . . A 341 HIS HB3 . 36272 1 632 . 1 . 1 69 69 HIS HE1 H 1 7.779 0.000 . 1 . . . . A 341 HIS HE1 . 36272 1 633 . 1 . 1 69 69 HIS C C 13 175.339 0.000 . 1 . . . . A 341 HIS C . 36272 1 634 . 1 . 1 69 69 HIS CA C 13 54.593 0.048 . 1 . . . . A 341 HIS CA . 36272 1 635 . 1 . 1 69 69 HIS CB C 13 29.013 0.034 . 1 . . . . A 341 HIS CB . 36272 1 636 . 1 . 1 69 69 HIS N N 15 111.135 0.044 . 1 . . . . A 341 HIS N . 36272 1 637 . 1 . 1 70 70 THR H H 1 7.783 0.008 . 1 . . . . A 342 THR H . 36272 1 638 . 1 . 1 70 70 THR HA H 1 3.570 0.017 . 1 . . . . A 342 THR HA . 36272 1 639 . 1 . 1 70 70 THR HB H 1 3.626 0.006 . 1 . . . . A 342 THR HB . 36272 1 640 . 1 . 1 70 70 THR HG21 H 1 0.102 0.006 . 1 . . . . A 342 THR HG21 . 36272 1 641 . 1 . 1 70 70 THR HG22 H 1 0.102 0.006 . 1 . . . . A 342 THR HG22 . 36272 1 642 . 1 . 1 70 70 THR HG23 H 1 0.102 0.006 . 1 . . . . A 342 THR HG23 . 36272 1 643 . 1 . 1 70 70 THR C C 13 173.152 0.000 . 1 . . . . A 342 THR C . 36272 1 644 . 1 . 1 70 70 THR CA C 13 64.257 0.107 . 1 . . . . A 342 THR CA . 36272 1 645 . 1 . 1 70 70 THR CB C 13 69.236 0.038 . 1 . . . . A 342 THR CB . 36272 1 646 . 1 . 1 70 70 THR CG2 C 13 22.087 0.073 . 1 . . . . A 342 THR CG2 . 36272 1 647 . 1 . 1 70 70 THR N N 15 122.556 0.015 . 1 . . . . A 342 THR N . 36272 1 648 . 1 . 1 71 71 THR H H 1 8.418 0.006 . 1 . . . . A 343 THR H . 36272 1 649 . 1 . 1 71 71 THR HA H 1 4.242 0.011 . 1 . . . . A 343 THR HA . 36272 1 650 . 1 . 1 71 71 THR HB H 1 3.761 0.019 . 1 . . . . A 343 THR HB . 36272 1 651 . 1 . 1 71 71 THR HG21 H 1 0.870 0.009 . 1 . . . . A 343 THR HG21 . 36272 1 652 . 1 . 1 71 71 THR HG22 H 1 0.870 0.009 . 1 . . . . A 343 THR HG22 . 36272 1 653 . 1 . 1 71 71 THR HG23 H 1 0.870 0.009 . 1 . . . . A 343 THR HG23 . 36272 1 654 . 1 . 1 71 71 THR C C 13 171.849 0.000 . 1 . . . . A 343 THR C . 36272 1 655 . 1 . 1 71 71 THR CA C 13 62.605 0.066 . 1 . . . . A 343 THR CA . 36272 1 656 . 1 . 1 71 71 THR CB C 13 68.467 0.078 . 1 . . . . A 343 THR CB . 36272 1 657 . 1 . 1 71 71 THR CG2 C 13 23.031 0.091 . 1 . . . . A 343 THR CG2 . 36272 1 658 . 1 . 1 71 71 THR N N 15 123.635 0.036 . 1 . . . . A 343 THR N . 36272 1 659 . 1 . 1 72 72 PHE H H 1 8.985 0.009 . 1 . . . . A 344 PHE H . 36272 1 660 . 1 . 1 72 72 PHE HA H 1 4.738 0.015 . 1 . . . . A 344 PHE HA . 36272 1 661 . 1 . 1 72 72 PHE HB2 H 1 2.045 0.010 . . . . . . A 344 PHE HB2 . 36272 1 662 . 1 . 1 72 72 PHE HD1 H 1 6.546 0.019 . . . . . . A 344 PHE HD1 . 36272 1 663 . 1 . 1 72 72 PHE C C 13 174.038 0.000 . 1 . . . . A 344 PHE C . 36272 1 664 . 1 . 1 72 72 PHE CA C 13 56.801 0.091 . 1 . . . . A 344 PHE CA . 36272 1 665 . 1 . 1 72 72 PHE CB C 13 41.730 0.062 . 1 . . . . A 344 PHE CB . 36272 1 666 . 1 . 1 72 72 PHE N N 15 127.511 0.025 . 1 . . . . A 344 PHE N . 36272 1 667 . 1 . 1 73 73 ARG H H 1 8.404 0.005 . 1 . . . . A 345 ARG H . 36272 1 668 . 1 . 1 73 73 ARG HA H 1 5.341 0.013 . 1 . . . . A 345 ARG HA . 36272 1 669 . 1 . 1 73 73 ARG HB2 H 1 1.540 0.011 . . . . . . A 345 ARG HB2 . 36272 1 670 . 1 . 1 73 73 ARG HB3 H 1 1.462 0.014 . . . . . . A 345 ARG HB3 . 36272 1 671 . 1 . 1 73 73 ARG HG2 H 1 1.205 0.010 . . . . . . A 345 ARG HG2 . 36272 1 672 . 1 . 1 73 73 ARG HD2 H 1 2.939 0.013 . . . . . . A 345 ARG HD2 . 36272 1 673 . 1 . 1 73 73 ARG C C 13 174.025 0.000 . 1 . . . . A 345 ARG C . 36272 1 674 . 1 . 1 73 73 ARG CA C 13 54.080 0.059 . 1 . . . . A 345 ARG CA . 36272 1 675 . 1 . 1 73 73 ARG CB C 13 34.079 0.075 . 1 . . . . A 345 ARG CB . 36272 1 676 . 1 . 1 73 73 ARG CG C 13 27.742 0.067 . 1 . . . . A 345 ARG CG . 36272 1 677 . 1 . 1 73 73 ARG CD C 13 43.437 0.060 . 1 . . . . A 345 ARG CD . 36272 1 678 . 1 . 1 73 73 ARG N N 15 119.342 0.041 . 1 . . . . A 345 ARG N . 36272 1 679 . 1 . 1 74 74 TRP H H 1 9.408 0.006 . 1 . . . . A 346 TRP H . 36272 1 680 . 1 . 1 74 74 TRP HA H 1 5.283 0.005 . 1 . . . . A 346 TRP HA . 36272 1 681 . 1 . 1 74 74 TRP HB2 H 1 3.274 0.009 . . . . . . A 346 TRP HB2 . 36272 1 682 . 1 . 1 74 74 TRP HB3 H 1 2.639 0.013 . . . . . . A 346 TRP HB3 . 36272 1 683 . 1 . 1 74 74 TRP HD1 H 1 7.129 0.036 . 1 . . . . A 346 TRP HD1 . 36272 1 684 . 1 . 1 74 74 TRP C C 13 172.827 0.000 . 1 . . . . A 346 TRP C . 36272 1 685 . 1 . 1 74 74 TRP CA C 13 55.052 0.065 . 1 . . . . A 346 TRP CA . 36272 1 686 . 1 . 1 74 74 TRP CB C 13 31.302 0.050 . 1 . . . . A 346 TRP CB . 36272 1 687 . 1 . 1 74 74 TRP N N 15 128.376 0.038 . 1 . . . . A 346 TRP N . 36272 1 688 . 1 . 1 75 75 GLN H H 1 8.782 0.007 . 1 . . . . A 347 GLN H . 36272 1 689 . 1 . 1 75 75 GLN HA H 1 4.699 0.006 . 1 . . . . A 347 GLN HA . 36272 1 690 . 1 . 1 75 75 GLN HB2 H 1 1.760 0.013 . . . . . . A 347 GLN HB2 . 36272 1 691 . 1 . 1 75 75 GLN HB3 H 1 1.366 0.010 . . . . . . A 347 GLN HB3 . 36272 1 692 . 1 . 1 75 75 GLN HG2 H 1 1.991 0.013 . . . . . . A 347 GLN HG2 . 36272 1 693 . 1 . 1 75 75 GLN HE21 H 1 6.883 0.001 . . . . . . A 347 GLN HE21 . 36272 1 694 . 1 . 1 75 75 GLN HE22 H 1 6.470 0.000 . . . . . . A 347 GLN HE22 . 36272 1 695 . 1 . 1 75 75 GLN C C 13 173.361 0.000 . 1 . . . . A 347 GLN C . 36272 1 696 . 1 . 1 75 75 GLN CA C 13 53.785 0.058 . 1 . . . . A 347 GLN CA . 36272 1 697 . 1 . 1 75 75 GLN CB C 13 31.428 0.099 . 1 . . . . A 347 GLN CB . 36272 1 698 . 1 . 1 75 75 GLN CG C 13 34.055 0.064 . 1 . . . . A 347 GLN CG . 36272 1 699 . 1 . 1 75 75 GLN N N 15 129.092 0.048 . 1 . . . . A 347 GLN N . 36272 1 700 . 1 . 1 75 75 GLN NE2 N 15 108.520 0.015 . 1 . . . . A 347 GLN NE2 . 36272 1 701 . 1 . 1 76 76 VAL H H 1 7.827 0.007 . 1 . . . . A 348 VAL H . 36272 1 702 . 1 . 1 76 76 VAL HA H 1 3.339 0.006 . 1 . . . . A 348 VAL HA . 36272 1 703 . 1 . 1 76 76 VAL HB H 1 -0.247 0.011 . 1 . . . . A 348 VAL HB . 36272 1 704 . 1 . 1 76 76 VAL HG11 H 1 0.088 0.009 . . . . . . A 348 VAL HG11 . 36272 1 705 . 1 . 1 76 76 VAL HG12 H 1 0.088 0.009 . . . . . . A 348 VAL HG12 . 36272 1 706 . 1 . 1 76 76 VAL HG13 H 1 0.088 0.009 . . . . . . A 348 VAL HG13 . 36272 1 707 . 1 . 1 76 76 VAL HG21 H 1 -1.133 0.005 . . . . . . A 348 VAL HG21 . 36272 1 708 . 1 . 1 76 76 VAL HG22 H 1 -1.133 0.005 . . . . . . A 348 VAL HG22 . 36272 1 709 . 1 . 1 76 76 VAL HG23 H 1 -1.133 0.005 . . . . . . A 348 VAL HG23 . 36272 1 710 . 1 . 1 76 76 VAL C C 13 174.038 0.000 . 1 . . . . A 348 VAL C . 36272 1 711 . 1 . 1 76 76 VAL CA C 13 60.965 0.043 . 1 . . . . A 348 VAL CA . 36272 1 712 . 1 . 1 76 76 VAL CB C 13 33.094 0.103 . 1 . . . . A 348 VAL CB . 36272 1 713 . 1 . 1 76 76 VAL CG1 C 13 20.621 0.037 . . . . . . A 348 VAL CG1 . 36272 1 714 . 1 . 1 76 76 VAL CG2 C 13 20.678 0.000 . . . . . . A 348 VAL CG2 . 36272 1 715 . 1 . 1 76 76 VAL N N 15 128.449 0.031 . 1 . . . . A 348 VAL N . 36272 1 716 . 1 . 1 77 77 LYS H H 1 8.364 0.006 . 1 . . . . A 349 LYS H . 36272 1 717 . 1 . 1 77 77 LYS HA H 1 4.171 0.008 . 1 . . . . A 349 LYS HA . 36272 1 718 . 1 . 1 77 77 LYS HB2 H 1 1.675 0.002 . . . . . . A 349 LYS HB2 . 36272 1 719 . 1 . 1 77 77 LYS HB3 H 1 1.554 0.012 . . . . . . A 349 LYS HB3 . 36272 1 720 . 1 . 1 77 77 LYS HG2 H 1 1.271 0.004 . . . . . . A 349 LYS HG2 . 36272 1 721 . 1 . 1 77 77 LYS HG3 H 1 1.145 0.006 . . . . . . A 349 LYS HG3 . 36272 1 722 . 1 . 1 77 77 LYS C C 13 176.414 0.000 . 1 . . . . A 349 LYS C . 36272 1 723 . 1 . 1 77 77 LYS CA C 13 55.448 0.107 . 1 . . . . A 349 LYS CA . 36272 1 724 . 1 . 1 77 77 LYS CB C 13 31.485 0.209 . 1 . . . . A 349 LYS CB . 36272 1 725 . 1 . 1 77 77 LYS CG C 13 24.744 0.025 . 1 . . . . A 349 LYS CG . 36272 1 726 . 1 . 1 77 77 LYS N N 15 126.860 0.064 . 1 . . . . A 349 LYS N . 36272 1 727 . 1 . 1 78 78 LEU H H 1 7.809 0.006 . 1 . . . . A 350 LEU H . 36272 1 728 . 1 . 1 78 78 LEU HA H 1 4.500 0.011 . 1 . . . . A 350 LEU HA . 36272 1 729 . 1 . 1 78 78 LEU C C 13 174.522 0.000 . 1 . . . . A 350 LEU C . 36272 1 730 . 1 . 1 78 78 LEU CA C 13 54.111 0.042 . 1 . . . . A 350 LEU CA . 36272 1 731 . 1 . 1 78 78 LEU CB C 13 41.258 0.023 . 1 . . . . A 350 LEU CB . 36272 1 732 . 1 . 1 78 78 LEU N N 15 125.559 0.055 . 1 . . . . A 350 LEU N . 36272 1 733 . 1 . 1 79 79 ARG H H 1 7.743 0.004 . 1 . . . . A 351 ARG H . 36272 1 734 . 1 . 1 79 79 ARG HA H 1 4.996 0.005 . 1 . . . . A 351 ARG HA . 36272 1 735 . 1 . 1 79 79 ARG CA C 13 53.646 0.019 . 1 . . . . A 351 ARG CA . 36272 1 736 . 1 . 1 79 79 ARG CB C 13 31.191 0.000 . 1 . . . . A 351 ARG CB . 36272 1 737 . 1 . 1 79 79 ARG N N 15 120.199 0.039 . 1 . . . . A 351 ARG N . 36272 1 738 . 1 . 1 80 80 ASN CA C 13 50.396 0.050 . 1 . . . . A 352 ASN CA . 36272 1 739 . 1 . 1 80 80 ASN CB C 13 42.488 0.026 . 1 . . . . A 352 ASN CB . 36272 1 740 . 1 . 1 81 81 LEU H H 1 7.940 0.011 . 1 . . . . A 353 LEU H . 36272 1 741 . 1 . 1 81 81 LEU HA H 1 4.403 0.007 . 1 . . . . A 353 LEU HA . 36272 1 742 . 1 . 1 81 81 LEU HB2 H 1 2.335 0.012 . . . . . . A 353 LEU HB2 . 36272 1 743 . 1 . 1 81 81 LEU C C 13 178.916 0.000 . 1 . . . . A 353 LEU C . 36272 1 744 . 1 . 1 81 81 LEU CA C 13 55.010 0.069 . 1 . . . . A 353 LEU CA . 36272 1 745 . 1 . 1 81 81 LEU CB C 13 43.261 0.013 . 1 . . . . A 353 LEU CB . 36272 1 746 . 1 . 1 81 81 LEU N N 15 114.103 0.083 . 1 . . . . A 353 LEU N . 36272 1 747 . 1 . 1 82 82 ILE H H 1 9.196 0.009 . 1 . . . . A 354 ILE H . 36272 1 748 . 1 . 1 82 82 ILE HA H 1 4.989 0.010 . 1 . . . . A 354 ILE HA . 36272 1 749 . 1 . 1 82 82 ILE HB H 1 1.584 0.015 . 1 . . . . A 354 ILE HB . 36272 1 750 . 1 . 1 82 82 ILE HG21 H 1 0.954 0.004 . 1 . . . . A 354 ILE HG21 . 36272 1 751 . 1 . 1 82 82 ILE HG22 H 1 0.954 0.004 . 1 . . . . A 354 ILE HG22 . 36272 1 752 . 1 . 1 82 82 ILE HG23 H 1 0.954 0.004 . 1 . . . . A 354 ILE HG23 . 36272 1 753 . 1 . 1 82 82 ILE C C 13 174.435 0.000 . 1 . . . . A 354 ILE C . 36272 1 754 . 1 . 1 82 82 ILE CA C 13 59.582 0.091 . 1 . . . . A 354 ILE CA . 36272 1 755 . 1 . 1 82 82 ILE CB C 13 42.791 0.059 . 1 . . . . A 354 ILE CB . 36272 1 756 . 1 . 1 82 82 ILE CG2 C 13 19.799 0.092 . 1 . . . . A 354 ILE CG2 . 36272 1 757 . 1 . 1 82 82 ILE N N 15 116.648 0.047 . 1 . . . . A 354 ILE N . 36272 1 758 . 1 . 1 83 83 GLU H H 1 7.874 0.014 . 1 . . . . A 355 GLU H . 36272 1 759 . 1 . 1 83 83 GLU HA H 1 4.997 0.020 . 1 . . . . A 355 GLU HA . 36272 1 760 . 1 . 1 83 83 GLU HB2 H 1 1.366 0.018 . . . . . . A 355 GLU HB2 . 36272 1 761 . 1 . 1 83 83 GLU CA C 13 51.483 0.044 . 1 . . . . A 355 GLU CA . 36272 1 762 . 1 . 1 83 83 GLU CB C 13 29.847 0.090 . 1 . . . . A 355 GLU CB . 36272 1 763 . 1 . 1 83 83 GLU N N 15 118.768 0.040 . 1 . . . . A 355 GLU N . 36272 1 764 . 1 . 1 84 84 PRO C C 13 178.444 0.000 . 1 . . . . A 356 PRO C . 36272 1 765 . 1 . 1 84 84 PRO CA C 13 66.561 0.098 . 1 . . . . A 356 PRO CA . 36272 1 766 . 1 . 1 84 84 PRO CB C 13 32.839 0.054 . 1 . . . . A 356 PRO CB . 36272 1 767 . 1 . 1 84 84 PRO CG C 13 26.962 0.000 . 1 . . . . A 356 PRO CG . 36272 1 768 . 1 . 1 85 85 GLU H H 1 9.050 0.003 . 1 . . . . A 357 GLU H . 36272 1 769 . 1 . 1 85 85 GLU HA H 1 4.024 0.008 . 1 . . . . A 357 GLU HA . 36272 1 770 . 1 . 1 85 85 GLU HB2 H 1 2.003 0.005 . . . . . . A 357 GLU HB2 . 36272 1 771 . 1 . 1 85 85 GLU HB3 H 1 1.876 0.007 . . . . . . A 357 GLU HB3 . 36272 1 772 . 1 . 1 85 85 GLU HG2 H 1 2.221 0.027 . . . . . . A 357 GLU HG2 . 36272 1 773 . 1 . 1 85 85 GLU C C 13 177.102 0.000 . 1 . . . . A 357 GLU C . 36272 1 774 . 1 . 1 85 85 GLU CA C 13 58.543 0.076 . 1 . . . . A 357 GLU CA . 36272 1 775 . 1 . 1 85 85 GLU CB C 13 28.917 0.071 . 1 . . . . A 357 GLU CB . 36272 1 776 . 1 . 1 85 85 GLU CG C 13 36.843 0.051 . 1 . . . . A 357 GLU CG . 36272 1 777 . 1 . 1 85 85 GLU N N 15 114.923 0.024 . 1 . . . . A 357 GLU N . 36272 1 778 . 1 . 1 86 86 GLN H H 1 7.536 0.010 . 1 . . . . A 358 GLN H . 36272 1 779 . 1 . 1 86 86 GLN HA H 1 4.321 0.013 . 1 . . . . A 358 GLN HA . 36272 1 780 . 1 . 1 86 86 GLN HB2 H 1 2.198 0.034 . . . . . . A 358 GLN HB2 . 36272 1 781 . 1 . 1 86 86 GLN HB3 H 1 1.341 0.013 . . . . . . A 358 GLN HB3 . 36272 1 782 . 1 . 1 86 86 GLN HG2 H 1 2.099 0.007 . . . . . . A 358 GLN HG2 . 36272 1 783 . 1 . 1 86 86 GLN HE21 H 1 7.329 0.002 . . . . . . A 358 GLN HE21 . 36272 1 784 . 1 . 1 86 86 GLN HE22 H 1 6.723 0.009 . . . . . . A 358 GLN HE22 . 36272 1 785 . 1 . 1 86 86 GLN C C 13 175.321 0.000 . 1 . . . . A 358 GLN C . 36272 1 786 . 1 . 1 86 86 GLN CA C 13 54.514 0.047 . 1 . . . . A 358 GLN CA . 36272 1 787 . 1 . 1 86 86 GLN CB C 13 30.088 0.049 . 1 . . . . A 358 GLN CB . 36272 1 788 . 1 . 1 86 86 GLN CG C 13 33.667 0.050 . 1 . . . . A 358 GLN CG . 36272 1 789 . 1 . 1 86 86 GLN N N 15 114.679 0.036 . 1 . . . . A 358 GLN N . 36272 1 790 . 1 . 1 86 86 GLN NE2 N 15 111.354 0.038 . 1 . . . . A 358 GLN NE2 . 36272 1 791 . 1 . 1 87 87 CYS H H 1 6.790 0.010 . 1 . . . . A 359 CYS H . 36272 1 792 . 1 . 1 87 87 CYS HA H 1 4.261 0.013 . 1 . . . . A 359 CYS HA . 36272 1 793 . 1 . 1 87 87 CYS HB2 H 1 1.479 0.013 . . . . . . A 359 CYS HB2 . 36272 1 794 . 1 . 1 87 87 CYS HB3 H 1 1.152 0.018 . . . . . . A 359 CYS HB3 . 36272 1 795 . 1 . 1 87 87 CYS C C 13 173.537 0.000 . 1 . . . . A 359 CYS C . 36272 1 796 . 1 . 1 87 87 CYS CA C 13 59.109 0.076 . 1 . . . . A 359 CYS CA . 36272 1 797 . 1 . 1 87 87 CYS CB C 13 26.150 0.088 . 1 . . . . A 359 CYS CB . 36272 1 798 . 1 . 1 87 87 CYS N N 15 118.792 0.036 . 1 . . . . A 359 CYS N . 36272 1 799 . 1 . 1 88 88 THR H H 1 8.552 0.004 . 1 . . . . A 360 THR H . 36272 1 800 . 1 . 1 88 88 THR HA H 1 4.761 0.016 . 1 . . . . A 360 THR HA . 36272 1 801 . 1 . 1 88 88 THR HG21 H 1 0.796 0.018 . 1 . . . . A 360 THR HG21 . 36272 1 802 . 1 . 1 88 88 THR HG22 H 1 0.796 0.018 . 1 . . . . A 360 THR HG22 . 36272 1 803 . 1 . 1 88 88 THR HG23 H 1 0.796 0.018 . 1 . . . . A 360 THR HG23 . 36272 1 804 . 1 . 1 88 88 THR C C 13 172.730 0.000 . 1 . . . . A 360 THR C . 36272 1 805 . 1 . 1 88 88 THR CA C 13 59.758 0.103 . 1 . . . . A 360 THR CA . 36272 1 806 . 1 . 1 88 88 THR CB C 13 72.775 0.050 . 1 . . . . A 360 THR CB . 36272 1 807 . 1 . 1 88 88 THR CG2 C 13 21.253 0.017 . 1 . . . . A 360 THR CG2 . 36272 1 808 . 1 . 1 88 88 THR N N 15 111.964 0.033 . 1 . . . . A 360 THR N . 36272 1 809 . 1 . 1 89 89 PHE H H 1 8.165 0.004 . 1 . . . . A 361 PHE H . 36272 1 810 . 1 . 1 89 89 PHE HA H 1 5.491 0.009 . 1 . . . . A 361 PHE HA . 36272 1 811 . 1 . 1 89 89 PHE HB2 H 1 2.482 0.015 . . . . . . A 361 PHE HB2 . 36272 1 812 . 1 . 1 89 89 PHE C C 13 173.098 0.000 . 1 . . . . A 361 PHE C . 36272 1 813 . 1 . 1 89 89 PHE CA C 13 55.850 0.103 . 1 . . . . A 361 PHE CA . 36272 1 814 . 1 . 1 89 89 PHE CB C 13 43.187 0.041 . 1 . . . . A 361 PHE CB . 36272 1 815 . 1 . 1 89 89 PHE N N 15 115.123 0.043 . 1 . . . . A 361 PHE N . 36272 1 816 . 1 . 1 90 90 CYS H H 1 8.899 0.008 . 1 . . . . A 362 CYS H . 36272 1 817 . 1 . 1 90 90 CYS HA H 1 4.180 0.006 . 1 . . . . A 362 CYS HA . 36272 1 818 . 1 . 1 90 90 CYS HB2 H 1 2.689 0.026 . . . . . . A 362 CYS HB2 . 36272 1 819 . 1 . 1 90 90 CYS C C 13 172.214 0.000 . 1 . . . . A 362 CYS C . 36272 1 820 . 1 . 1 90 90 CYS CA C 13 56.861 0.084 . 1 . . . . A 362 CYS CA . 36272 1 821 . 1 . 1 90 90 CYS CB C 13 30.038 0.055 . 1 . . . . A 362 CYS CB . 36272 1 822 . 1 . 1 90 90 CYS N N 15 117.825 0.054 . 1 . . . . A 362 CYS N . 36272 1 823 . 1 . 1 91 91 PHE H H 1 8.909 0.012 . 1 . . . . A 363 PHE H . 36272 1 824 . 1 . 1 91 91 PHE HA H 1 5.065 0.016 . 1 . . . . A 363 PHE HA . 36272 1 825 . 1 . 1 91 91 PHE HB2 H 1 3.029 0.010 . . . . . . A 363 PHE HB2 . 36272 1 826 . 1 . 1 91 91 PHE HB3 H 1 2.864 0.007 . . . . . . A 363 PHE HB3 . 36272 1 827 . 1 . 1 91 91 PHE HD1 H 1 7.187 0.027 . . . . . . A 363 PHE HD1 . 36272 1 828 . 1 . 1 91 91 PHE C C 13 175.512 0.000 . 1 . . . . A 363 PHE C . 36272 1 829 . 1 . 1 91 91 PHE CA C 13 55.908 0.053 . 1 . . . . A 363 PHE CA . 36272 1 830 . 1 . 1 91 91 PHE CB C 13 39.335 0.060 . 1 . . . . A 363 PHE CB . 36272 1 831 . 1 . 1 91 91 PHE N N 15 123.973 0.055 . 1 . . . . A 363 PHE N . 36272 1 832 . 1 . 1 92 92 THR H H 1 8.464 0.009 . 1 . . . . A 364 THR H . 36272 1 833 . 1 . 1 92 92 THR HA H 1 4.761 0.006 . 1 . . . . A 364 THR HA . 36272 1 834 . 1 . 1 92 92 THR HB H 1 4.457 0.004 . 1 . . . . A 364 THR HB . 36272 1 835 . 1 . 1 92 92 THR HG21 H 1 1.036 0.008 . 1 . . . . A 364 THR HG21 . 36272 1 836 . 1 . 1 92 92 THR HG22 H 1 1.036 0.008 . 1 . . . . A 364 THR HG22 . 36272 1 837 . 1 . 1 92 92 THR HG23 H 1 1.036 0.008 . 1 . . . . A 364 THR HG23 . 36272 1 838 . 1 . 1 92 92 THR C C 13 173.972 0.000 . 1 . . . . A 364 THR C . 36272 1 839 . 1 . 1 92 92 THR CA C 13 59.797 0.051 . 1 . . . . A 364 THR CA . 36272 1 840 . 1 . 1 92 92 THR CB C 13 71.000 0.080 . 1 . . . . A 364 THR CB . 36272 1 841 . 1 . 1 92 92 THR CG2 C 13 21.751 0.016 . 1 . . . . A 364 THR CG2 . 36272 1 842 . 1 . 1 92 92 THR N N 15 115.981 0.034 . 1 . . . . A 364 THR N . 36272 1 843 . 1 . 1 93 93 ALA H H 1 8.617 0.017 . 1 . . . . A 365 ALA H . 36272 1 844 . 1 . 1 93 93 ALA HA H 1 4.112 0.007 . 1 . . . . A 365 ALA HA . 36272 1 845 . 1 . 1 93 93 ALA HB1 H 1 1.346 0.009 . 1 . . . . A 365 ALA HB1 . 36272 1 846 . 1 . 1 93 93 ALA HB2 H 1 1.346 0.009 . 1 . . . . A 365 ALA HB2 . 36272 1 847 . 1 . 1 93 93 ALA HB3 H 1 1.346 0.009 . 1 . . . . A 365 ALA HB3 . 36272 1 848 . 1 . 1 93 93 ALA C C 13 179.217 0.000 . 1 . . . . A 365 ALA C . 36272 1 849 . 1 . 1 93 93 ALA CA C 13 54.910 0.076 . 1 . . . . A 365 ALA CA . 36272 1 850 . 1 . 1 93 93 ALA CB C 13 18.330 0.065 . 1 . . . . A 365 ALA CB . 36272 1 851 . 1 . 1 93 93 ALA N N 15 120.421 0.038 . 1 . . . . A 365 ALA N . 36272 1 852 . 1 . 1 94 94 SER H H 1 8.098 0.006 . 1 . . . . A 366 SER H . 36272 1 853 . 1 . 1 94 94 SER HA H 1 4.467 0.006 . 1 . . . . A 366 SER HA . 36272 1 854 . 1 . 1 94 94 SER HB2 H 1 3.673 0.006 . . . . . . A 366 SER HB2 . 36272 1 855 . 1 . 1 94 94 SER C C 13 172.482 0.000 . 1 . . . . A 366 SER C . 36272 1 856 . 1 . 1 94 94 SER CA C 13 58.182 0.084 . 1 . . . . A 366 SER CA . 36272 1 857 . 1 . 1 94 94 SER CB C 13 64.984 0.041 . 1 . . . . A 366 SER CB . 36272 1 858 . 1 . 1 94 94 SER N N 15 108.939 0.023 . 1 . . . . A 366 SER N . 36272 1 859 . 1 . 1 95 95 ARG H H 1 7.357 0.008 . 1 . . . . A 367 ARG H . 36272 1 860 . 1 . 1 95 95 ARG HA H 1 4.696 0.014 . 1 . . . . A 367 ARG HA . 36272 1 861 . 1 . 1 95 95 ARG HB2 H 1 1.573 0.014 . . . . . . A 367 ARG HB2 . 36272 1 862 . 1 . 1 95 95 ARG HG2 H 1 1.192 0.007 . . . . . . A 367 ARG HG2 . 36272 1 863 . 1 . 1 95 95 ARG HG3 H 1 0.965 0.021 . . . . . . A 367 ARG HG3 . 36272 1 864 . 1 . 1 95 95 ARG HD2 H 1 3.687 0.000 . . . . . . A 367 ARG HD2 . 36272 1 865 . 1 . 1 95 95 ARG C C 13 173.502 0.000 . 1 . . . . A 367 ARG C . 36272 1 866 . 1 . 1 95 95 ARG CA C 13 55.369 0.080 . 1 . . . . A 367 ARG CA . 36272 1 867 . 1 . 1 95 95 ARG CB C 13 32.780 0.029 . 1 . . . . A 367 ARG CB . 36272 1 868 . 1 . 1 95 95 ARG CG C 13 25.372 0.017 . 1 . . . . A 367 ARG CG . 36272 1 869 . 1 . 1 95 95 ARG N N 15 117.470 0.050 . 1 . . . . A 367 ARG N . 36272 1 870 . 1 . 1 96 96 ILE H H 1 8.758 0.008 . 1 . . . . A 368 ILE H . 36272 1 871 . 1 . 1 96 96 ILE HA H 1 4.546 0.010 . 1 . . . . A 368 ILE HA . 36272 1 872 . 1 . 1 96 96 ILE HB H 1 1.600 0.011 . 1 . . . . A 368 ILE HB . 36272 1 873 . 1 . 1 96 96 ILE HG12 H 1 1.942 0.000 . . . . . . A 368 ILE HG12 . 36272 1 874 . 1 . 1 96 96 ILE HG13 H 1 1.942 0.000 . . . . . . A 368 ILE HG13 . 36272 1 875 . 1 . 1 96 96 ILE HG21 H 1 0.648 0.012 . 1 . . . . A 368 ILE HG21 . 36272 1 876 . 1 . 1 96 96 ILE HG22 H 1 0.648 0.012 . 1 . . . . A 368 ILE HG22 . 36272 1 877 . 1 . 1 96 96 ILE HG23 H 1 0.648 0.012 . 1 . . . . A 368 ILE HG23 . 36272 1 878 . 1 . 1 96 96 ILE C C 13 174.177 0.000 . 1 . . . . A 368 ILE C . 36272 1 879 . 1 . 1 96 96 ILE CA C 13 61.020 0.048 . 1 . . . . A 368 ILE CA . 36272 1 880 . 1 . 1 96 96 ILE CB C 13 40.397 0.080 . 1 . . . . A 368 ILE CB . 36272 1 881 . 1 . 1 96 96 ILE CG1 C 13 27.530 0.020 . 1 . . . . A 368 ILE CG1 . 36272 1 882 . 1 . 1 96 96 ILE CG2 C 13 16.602 0.036 . 1 . . . . A 368 ILE CG2 . 36272 1 883 . 1 . 1 96 96 ILE N N 15 121.332 0.054 . 1 . . . . A 368 ILE N . 36272 1 884 . 1 . 1 97 97 ASP H H 1 8.732 0.011 . 1 . . . . A 369 ASP H . 36272 1 885 . 1 . 1 97 97 ASP HA H 1 5.411 0.013 . 1 . . . . A 369 ASP HA . 36272 1 886 . 1 . 1 97 97 ASP HB2 H 1 2.533 0.014 . . . . . . A 369 ASP HB2 . 36272 1 887 . 1 . 1 97 97 ASP HB3 H 1 2.300 0.007 . . . . . . A 369 ASP HB3 . 36272 1 888 . 1 . 1 97 97 ASP C C 13 175.355 0.000 . 1 . . . . A 369 ASP C . 36272 1 889 . 1 . 1 97 97 ASP CA C 13 52.941 0.109 . 1 . . . . A 369 ASP CA . 36272 1 890 . 1 . 1 97 97 ASP CB C 13 41.724 0.061 . 1 . . . . A 369 ASP CB . 36272 1 891 . 1 . 1 97 97 ASP N N 15 127.078 0.097 . 1 . . . . A 369 ASP N . 36272 1 892 . 1 . 1 98 98 ILE H H 1 9.235 0.012 . 1 . . . . A 370 ILE H . 36272 1 893 . 1 . 1 98 98 ILE HA H 1 4.466 0.012 . 1 . . . . A 370 ILE HA . 36272 1 894 . 1 . 1 98 98 ILE HB H 1 1.382 0.014 . 1 . . . . A 370 ILE HB . 36272 1 895 . 1 . 1 98 98 ILE HG21 H 1 0.426 0.017 . 1 . . . . A 370 ILE HG21 . 36272 1 896 . 1 . 1 98 98 ILE HG22 H 1 0.426 0.017 . 1 . . . . A 370 ILE HG22 . 36272 1 897 . 1 . 1 98 98 ILE HG23 H 1 0.426 0.017 . 1 . . . . A 370 ILE HG23 . 36272 1 898 . 1 . 1 98 98 ILE C C 13 174.014 0.000 . 1 . . . . A 370 ILE C . 36272 1 899 . 1 . 1 98 98 ILE CA C 13 60.166 0.061 . 1 . . . . A 370 ILE CA . 36272 1 900 . 1 . 1 98 98 ILE CB C 13 41.243 0.062 . 1 . . . . A 370 ILE CB . 36272 1 901 . 1 . 1 98 98 ILE CG2 C 13 17.606 0.077 . 1 . . . . A 370 ILE CG2 . 36272 1 902 . 1 . 1 98 98 ILE N N 15 125.205 0.048 . 1 . . . . A 370 ILE N . 36272 1 903 . 1 . 1 99 99 CYS H H 1 8.851 0.013 . 1 . . . . A 371 CYS H . 36272 1 904 . 1 . 1 99 99 CYS HA H 1 4.848 0.028 . 1 . . . . A 371 CYS HA . 36272 1 905 . 1 . 1 99 99 CYS HB2 H 1 2.768 0.008 . . . . . . A 371 CYS HB2 . 36272 1 906 . 1 . 1 99 99 CYS HB3 H 1 2.478 0.008 . . . . . . A 371 CYS HB3 . 36272 1 907 . 1 . 1 99 99 CYS C C 13 173.594 0.000 . 1 . . . . A 371 CYS C . 36272 1 908 . 1 . 1 99 99 CYS CA C 13 57.622 0.040 . 1 . . . . A 371 CYS CA . 36272 1 909 . 1 . 1 99 99 CYS CB C 13 27.061 0.057 . 1 . . . . A 371 CYS CB . 36272 1 910 . 1 . 1 99 99 CYS N N 15 127.670 0.059 . 1 . . . . A 371 CYS N . 36272 1 911 . 1 . 1 100 100 LEU H H 1 9.417 0.007 . 1 . . . . A 372 LEU H . 36272 1 912 . 1 . 1 100 100 LEU HA H 1 4.537 0.019 . 1 . . . . A 372 LEU HA . 36272 1 913 . 1 . 1 100 100 LEU HB2 H 1 1.574 0.007 . . . . . . A 372 LEU HB2 . 36272 1 914 . 1 . 1 100 100 LEU C C 13 175.545 0.000 . 1 . . . . A 372 LEU C . 36272 1 915 . 1 . 1 100 100 LEU CA C 13 52.021 0.074 . 1 . . . . A 372 LEU CA . 36272 1 916 . 1 . 1 100 100 LEU CB C 13 42.035 0.045 . 1 . . . . A 372 LEU CB . 36272 1 917 . 1 . 1 100 100 LEU N N 15 125.726 0.036 . 1 . . . . A 372 LEU N . 36272 1 918 . 1 . 1 101 101 ARG H H 1 7.185 0.009 . 1 . . . . A 373 ARG H . 36272 1 919 . 1 . 1 101 101 ARG HA H 1 4.668 0.008 . 1 . . . . A 373 ARG HA . 36272 1 920 . 1 . 1 101 101 ARG HB2 H 1 1.546 0.004 . . . . . . A 373 ARG HB2 . 36272 1 921 . 1 . 1 101 101 ARG HD2 H 1 3.329 0.006 . . . . . . A 373 ARG HD2 . 36272 1 922 . 1 . 1 101 101 ARG C C 13 175.070 0.000 . 1 . . . . A 373 ARG C . 36272 1 923 . 1 . 1 101 101 ARG CA C 13 52.480 0.013 . 1 . . . . A 373 ARG CA . 36272 1 924 . 1 . 1 101 101 ARG CB C 13 30.330 0.041 . 1 . . . . A 373 ARG CB . 36272 1 925 . 1 . 1 101 101 ARG N N 15 125.734 0.073 . 1 . . . . A 373 ARG N . 36272 1 926 . 1 . 1 102 102 LYS H H 1 8.515 0.005 . 1 . . . . A 374 LYS H . 36272 1 927 . 1 . 1 102 102 LYS HA H 1 4.044 0.010 . 1 . . . . A 374 LYS HA . 36272 1 928 . 1 . 1 102 102 LYS C C 13 176.381 0.000 . 1 . . . . A 374 LYS C . 36272 1 929 . 1 . 1 102 102 LYS CA C 13 57.381 0.057 . 1 . . . . A 374 LYS CA . 36272 1 930 . 1 . 1 102 102 LYS CB C 13 34.784 0.028 . 1 . . . . A 374 LYS CB . 36272 1 931 . 1 . 1 102 102 LYS N N 15 126.557 0.054 . 1 . . . . A 374 LYS N . 36272 1 932 . 1 . 1 103 103 ARG H H 1 8.145 0.009 . 1 . . . . A 375 ARG H . 36272 1 933 . 1 . 1 103 103 ARG HA H 1 4.028 0.008 . 1 . . . . A 375 ARG HA . 36272 1 934 . 1 . 1 103 103 ARG HB2 H 1 1.568 0.011 . . . . . . A 375 ARG HB2 . 36272 1 935 . 1 . 1 103 103 ARG HB3 H 1 1.296 0.008 . . . . . . A 375 ARG HB3 . 36272 1 936 . 1 . 1 103 103 ARG CA C 13 58.699 0.068 . 1 . . . . A 375 ARG CA . 36272 1 937 . 1 . 1 103 103 ARG CB C 13 30.092 0.031 . 1 . . . . A 375 ARG CB . 36272 1 938 . 1 . 1 103 103 ARG N N 15 121.810 0.023 . 1 . . . . A 375 ARG N . 36272 1 939 . 1 . 1 105 105 SER C C 13 173.146 0.000 . 1 . . . . A 377 SER C . 36272 1 940 . 1 . 1 105 105 SER CA C 13 57.972 0.110 . 1 . . . . A 377 SER CA . 36272 1 941 . 1 . 1 105 105 SER CB C 13 61.682 0.000 . 1 . . . . A 377 SER CB . 36272 1 942 . 1 . 1 106 106 GLN H H 1 7.491 0.007 . 1 . . . . A 378 GLN H . 36272 1 943 . 1 . 1 106 106 GLN HA H 1 4.434 0.013 . 1 . . . . A 378 GLN HA . 36272 1 944 . 1 . 1 106 106 GLN HB2 H 1 1.966 0.011 . . . . . . A 378 GLN HB2 . 36272 1 945 . 1 . 1 106 106 GLN HB3 H 1 1.873 0.027 . . . . . . A 378 GLN HB3 . 36272 1 946 . 1 . 1 106 106 GLN HG2 H 1 2.181 0.005 . . . . . . A 378 GLN HG2 . 36272 1 947 . 1 . 1 106 106 GLN HG3 H 1 2.072 0.011 . . . . . . A 378 GLN HG3 . 36272 1 948 . 1 . 1 106 106 GLN HE21 H 1 7.453 0.000 . . . . . . A 378 GLN HE21 . 36272 1 949 . 1 . 1 106 106 GLN HE22 H 1 6.730 0.000 . . . . . . A 378 GLN HE22 . 36272 1 950 . 1 . 1 106 106 GLN C C 13 175.297 0.000 . 1 . . . . A 378 GLN C . 36272 1 951 . 1 . 1 106 106 GLN CA C 13 53.824 0.067 . 1 . . . . A 378 GLN CA . 36272 1 952 . 1 . 1 106 106 GLN CB C 13 31.212 0.087 . 1 . . . . A 378 GLN CB . 36272 1 953 . 1 . 1 106 106 GLN CG C 13 32.896 0.029 . 1 . . . . A 378 GLN CG . 36272 1 954 . 1 . 1 106 106 GLN N N 15 123.979 0.038 . 1 . . . . A 378 GLN N . 36272 1 955 . 1 . 1 106 106 GLN NE2 N 15 111.968 0.001 . 1 . . . . A 378 GLN NE2 . 36272 1 956 . 1 . 1 107 107 ARG H H 1 8.886 0.011 . 1 . . . . A 379 ARG H . 36272 1 957 . 1 . 1 107 107 ARG HA H 1 4.180 0.015 . 1 . . . . A 379 ARG HA . 36272 1 958 . 1 . 1 107 107 ARG HB2 H 1 2.676 0.004 . . . . . . A 379 ARG HB2 . 36272 1 959 . 1 . 1 107 107 ARG CA C 13 56.462 0.019 . 1 . . . . A 379 ARG CA . 36272 1 960 . 1 . 1 107 107 ARG CB C 13 30.308 0.023 . 1 . . . . A 379 ARG CB . 36272 1 961 . 1 . 1 107 107 ARG N N 15 125.248 0.047 . 1 . . . . A 379 ARG N . 36272 1 962 . 1 . 1 110 110 GLY C C 13 171.084 0.000 . 1 . . . . A 382 GLY C . 36272 1 963 . 1 . 1 110 110 GLY CA C 13 44.389 0.025 . 1 . . . . A 382 GLY CA . 36272 1 964 . 1 . 1 111 111 LEU H H 1 8.296 0.007 . 1 . . . . A 383 LEU H . 36272 1 965 . 1 . 1 111 111 LEU HA H 1 4.457 0.007 . 1 . . . . A 383 LEU HA . 36272 1 966 . 1 . 1 111 111 LEU CA C 13 57.443 0.013 . 1 . . . . A 383 LEU CA . 36272 1 967 . 1 . 1 111 111 LEU N N 15 120.074 0.070 . 1 . . . . A 383 LEU N . 36272 1 968 . 1 . 1 112 112 GLU C C 13 177.120 0.000 . 1 . . . . A 384 GLU C . 36272 1 969 . 1 . 1 112 112 GLU CA C 13 55.811 0.041 . 1 . . . . A 384 GLU CA . 36272 1 970 . 1 . 1 112 112 GLU CB C 13 32.107 0.060 . 1 . . . . A 384 GLU CB . 36272 1 971 . 1 . 1 112 112 GLU CG C 13 37.238 0.000 . 1 . . . . A 384 GLU CG . 36272 1 972 . 1 . 1 113 113 ALA H H 1 8.037 0.006 . 1 . . . . A 385 ALA H . 36272 1 973 . 1 . 1 113 113 ALA HA H 1 4.103 0.011 . 1 . . . . A 385 ALA HA . 36272 1 974 . 1 . 1 113 113 ALA HB1 H 1 1.002 0.004 . 1 . . . . A 385 ALA HB1 . 36272 1 975 . 1 . 1 113 113 ALA HB2 H 1 1.002 0.004 . 1 . . . . A 385 ALA HB2 . 36272 1 976 . 1 . 1 113 113 ALA HB3 H 1 1.002 0.004 . 1 . . . . A 385 ALA HB3 . 36272 1 977 . 1 . 1 113 113 ALA CA C 13 50.355 0.030 . 1 . . . . A 385 ALA CA . 36272 1 978 . 1 . 1 113 113 ALA CB C 13 17.384 0.023 . 1 . . . . A 385 ALA CB . 36272 1 979 . 1 . 1 113 113 ALA N N 15 126.846 0.024 . 1 . . . . A 385 ALA N . 36272 1 stop_ save_