data_51420 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51420 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for EZH2 loop at 310K and 278K ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-04-28 _Entry.Accession_date 2022-04-28 _Entry.Last_release_date 2022-04-28 _Entry.Original_release_date 2022-04-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Csenge Szabo . L. . 0000-0002-6508-3439 51420 2 Fanni Sebak . . . 0000-0001-9252-9961 51420 3 Andrea Bodor . . . 0000-0002-7422-298X 51420 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 51420 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 476 51420 '15N chemical shifts' 185 51420 '1H chemical shifts' 483 51420 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 . . 2022-06-03 . original BMRB . 51420 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51421 'T345D mutant of EZH2 loop' 51420 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51420 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI 10.3390/ijms23116150 _Citation.Full_citation . _Citation.Title ; The Disordered EZH2 Loop: Atomic Level Characterization by 1HN- and 1Ha-Detected NMR Approaches, Interaction with the Long Noncoding HOTAIR RNA ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Int. J. Mol. Sci.' _Citation.Journal_name_full 'International Journal of Molecular Sciences' _Citation.Journal_volume 23 _Citation.Journal_issue 11 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 6150 _Citation.Page_last 6150 _Citation.Year 2022 _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 Csenge Szabo . L. . . 51420 1 2 Beata Szabo . . . . 51420 1 3 Fanni Sebak . . . . 51420 1 4 Wolfgang Bermel . . . . 51420 1 5 Agnes Tantos . . . . 51420 1 6 Andrea Bodor . . . . 51420 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51420 _Assembly.ID 1 _Assembly.Name 'EZH2 loop' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 1 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'EZH2 loop' 1 $entity_1 . . yes native no no . . . 51420 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51420 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MDAERIKTPPKRPGGRRRGR LPNNSSRPSTPTINVLESKD TDSDREAGTETGGENNDKEE EEKKDETSSSSEANSRCQTP IKMKPNIEPPENVEWSGALE HHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; M,338 D,339 A,340 ...... H,441 H,442 H,443 ; _Entity.Polymer_author_seq_details 'Residues 338-339 and 436-443 represent cloning artifacts.' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 106 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 338 MET . 51420 1 2 339 ASP . 51420 1 3 340 ALA . 51420 1 4 341 GLU . 51420 1 5 342 ARG . 51420 1 6 343 ILE . 51420 1 7 344 LYS . 51420 1 8 345 THR . 51420 1 9 346 PRO . 51420 1 10 347 PRO . 51420 1 11 348 LYS . 51420 1 12 349 ARG . 51420 1 13 350 PRO . 51420 1 14 351 GLY . 51420 1 15 352 GLY . 51420 1 16 353 ARG . 51420 1 17 354 ARG . 51420 1 18 355 ARG . 51420 1 19 356 GLY . 51420 1 20 357 ARG . 51420 1 21 358 LEU . 51420 1 22 359 PRO . 51420 1 23 360 ASN . 51420 1 24 361 ASN . 51420 1 25 362 SER . 51420 1 26 363 SER . 51420 1 27 364 ARG . 51420 1 28 365 PRO . 51420 1 29 366 SER . 51420 1 30 367 THR . 51420 1 31 368 PRO . 51420 1 32 369 THR . 51420 1 33 370 ILE . 51420 1 34 371 ASN . 51420 1 35 372 VAL . 51420 1 36 373 LEU . 51420 1 37 374 GLU . 51420 1 38 375 SER . 51420 1 39 376 LYS . 51420 1 40 377 ASP . 51420 1 41 378 THR . 51420 1 42 379 ASP . 51420 1 43 380 SER . 51420 1 44 381 ASP . 51420 1 45 382 ARG . 51420 1 46 383 GLU . 51420 1 47 384 ALA . 51420 1 48 385 GLY . 51420 1 49 386 THR . 51420 1 50 387 GLU . 51420 1 51 388 THR . 51420 1 52 389 GLY . 51420 1 53 390 GLY . 51420 1 54 391 GLU . 51420 1 55 392 ASN . 51420 1 56 393 ASN . 51420 1 57 394 ASP . 51420 1 58 395 LYS . 51420 1 59 396 GLU . 51420 1 60 397 GLU . 51420 1 61 398 GLU . 51420 1 62 399 GLU . 51420 1 63 400 LYS . 51420 1 64 401 LYS . 51420 1 65 402 ASP . 51420 1 66 403 GLU . 51420 1 67 404 THR . 51420 1 68 405 SER . 51420 1 69 406 SER . 51420 1 70 407 SER . 51420 1 71 408 SER . 51420 1 72 409 GLU . 51420 1 73 410 ALA . 51420 1 74 411 ASN . 51420 1 75 412 SER . 51420 1 76 413 ARG . 51420 1 77 414 CYS . 51420 1 78 415 GLN . 51420 1 79 416 THR . 51420 1 80 417 PRO . 51420 1 81 418 ILE . 51420 1 82 419 LYS . 51420 1 83 420 MET . 51420 1 84 421 LYS . 51420 1 85 422 PRO . 51420 1 86 423 ASN . 51420 1 87 424 ILE . 51420 1 88 425 GLU . 51420 1 89 426 PRO . 51420 1 90 427 PRO . 51420 1 91 428 GLU . 51420 1 92 429 ASN . 51420 1 93 430 VAL . 51420 1 94 431 GLU . 51420 1 95 432 TRP . 51420 1 96 433 SER . 51420 1 97 434 GLY . 51420 1 98 435 ALA . 51420 1 99 436 LEU . 51420 1 100 437 GLU . 51420 1 101 438 HIS . 51420 1 102 439 HIS . 51420 1 103 440 HIS . 51420 1 104 441 HIS . 51420 1 105 442 HIS . 51420 1 106 443 HIS . 51420 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 51420 1 . ASP 2 2 51420 1 . ALA 3 3 51420 1 . GLU 4 4 51420 1 . ARG 5 5 51420 1 . ILE 6 6 51420 1 . LYS 7 7 51420 1 . THR 8 8 51420 1 . PRO 9 9 51420 1 . PRO 10 10 51420 1 . LYS 11 11 51420 1 . ARG 12 12 51420 1 . PRO 13 13 51420 1 . GLY 14 14 51420 1 . GLY 15 15 51420 1 . ARG 16 16 51420 1 . ARG 17 17 51420 1 . ARG 18 18 51420 1 . GLY 19 19 51420 1 . ARG 20 20 51420 1 . LEU 21 21 51420 1 . PRO 22 22 51420 1 . ASN 23 23 51420 1 . ASN 24 24 51420 1 . SER 25 25 51420 1 . SER 26 26 51420 1 . ARG 27 27 51420 1 . PRO 28 28 51420 1 . SER 29 29 51420 1 . THR 30 30 51420 1 . PRO 31 31 51420 1 . THR 32 32 51420 1 . ILE 33 33 51420 1 . ASN 34 34 51420 1 . VAL 35 35 51420 1 . LEU 36 36 51420 1 . GLU 37 37 51420 1 . SER 38 38 51420 1 . LYS 39 39 51420 1 . ASP 40 40 51420 1 . THR 41 41 51420 1 . ASP 42 42 51420 1 . SER 43 43 51420 1 . ASP 44 44 51420 1 . ARG 45 45 51420 1 . GLU 46 46 51420 1 . ALA 47 47 51420 1 . GLY 48 48 51420 1 . THR 49 49 51420 1 . GLU 50 50 51420 1 . THR 51 51 51420 1 . GLY 52 52 51420 1 . GLY 53 53 51420 1 . GLU 54 54 51420 1 . ASN 55 55 51420 1 . ASN 56 56 51420 1 . ASP 57 57 51420 1 . LYS 58 58 51420 1 . GLU 59 59 51420 1 . GLU 60 60 51420 1 . GLU 61 61 51420 1 . GLU 62 62 51420 1 . LYS 63 63 51420 1 . LYS 64 64 51420 1 . ASP 65 65 51420 1 . GLU 66 66 51420 1 . THR 67 67 51420 1 . SER 68 68 51420 1 . SER 69 69 51420 1 . SER 70 70 51420 1 . SER 71 71 51420 1 . GLU 72 72 51420 1 . ALA 73 73 51420 1 . ASN 74 74 51420 1 . SER 75 75 51420 1 . ARG 76 76 51420 1 . CYS 77 77 51420 1 . GLN 78 78 51420 1 . THR 79 79 51420 1 . PRO 80 80 51420 1 . ILE 81 81 51420 1 . LYS 82 82 51420 1 . MET 83 83 51420 1 . LYS 84 84 51420 1 . PRO 85 85 51420 1 . ASN 86 86 51420 1 . ILE 87 87 51420 1 . GLU 88 88 51420 1 . PRO 89 89 51420 1 . PRO 90 90 51420 1 . GLU 91 91 51420 1 . ASN 92 92 51420 1 . VAL 93 93 51420 1 . GLU 94 94 51420 1 . TRP 95 95 51420 1 . SER 96 96 51420 1 . GLY 97 97 51420 1 . ALA 98 98 51420 1 . LEU 99 99 51420 1 . GLU 100 100 51420 1 . HIS 101 101 51420 1 . HIS 102 102 51420 1 . HIS 103 103 51420 1 . HIS 104 104 51420 1 . HIS 105 105 51420 1 . HIS 106 106 51420 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51420 _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 . . . . . . . . . . . . . 51420 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51420 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . 'pET22b (+)' . . . 51420 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51420 _Sample.ID 1 _Sample.Name EZH2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'EZH2 loop' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 1 . . mM . . . . 51420 1 2 PBS 'natural abundance' . . . . . . 150 . . mM . . . . 51420 1 3 TCEP 'natural abundance' . . . . . . 10 . . mM . . . . 51420 1 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 51420 1 5 DSS 'natural abundance' . . . . . . 1 . . % . . . . 51420 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51420 _Sample_condition_list.ID 1 _Sample_condition_list.Name 310K _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7 . pH 51420 1 pressure 1 . atm 51420 1 temperature 310 . K 51420 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 51420 _Sample_condition_list.ID 2 _Sample_condition_list.Name 278K _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7 . pH 51420 2 pressure 1 . atm 51420 2 temperature 278 . K 51420 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51420 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51420 1 processing . 51420 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51420 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51420 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51420 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name NMR1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51420 _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 SHACA-HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 2 '3D HCAN' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 3 '3D HCA(CO)N' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 4 '3D HCA(N)CO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 5 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 6 '3D HNCA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 7 '3D HN(CO)CA' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 8 '3D HNCACB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 9 '3D HN(CO)CACB' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 10 '3D HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 11 '3D HNCACO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 12 '3D CCCONH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 13 '2D SHCA-HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 14 '3D HCAN' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 15 '3D HCA(CO)N' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 16 '3D HCA(N)CO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51420 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51420 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'reference 1' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 51420 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51420 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 51420 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 51420 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name EZH2loop_278K _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 5 '2D 1H-15N HSQC' . . . 51420 1 6 '3D HNCA' . . . 51420 1 7 '3D HN(CO)CA' . . . 51420 1 8 '3D HNCACB' . . . 51420 1 9 '3D HN(CO)CACB' . . . 51420 1 10 '3D HNCO' . . . 51420 1 11 '3D HNCACO' . . . 51420 1 12 '3D CCCONH' . . . 51420 1 13 '2D SHCA-HSQC' . . . 51420 1 14 '3D HCAN' . . . 51420 1 15 '3D HCA(CO)N' . . . 51420 1 16 '3D HCA(N)CO' . . . 51420 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51420 1 2 $software_2 . . 51420 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 3 3 ALA H H 1 8.636 0.02 . 1 . . . . . 340 ALA H . 51420 1 2 . 1 . 1 3 3 ALA HA H 1 4.246 0.02 . 1 . . . . . 340 ALA HA . 51420 1 3 . 1 . 1 3 3 ALA HB1 H 1 1.334 0.02 . 1 . . . . . 340 ALA HB . 51420 1 4 . 1 . 1 3 3 ALA HB2 H 1 1.334 0.02 . 1 . . . . . 340 ALA HB . 51420 1 5 . 1 . 1 3 3 ALA HB3 H 1 1.334 0.02 . 1 . . . . . 340 ALA HB . 51420 1 6 . 1 . 1 3 3 ALA C C 13 177.92 0.3 . 1 . . . . . 340 ALA C . 51420 1 7 . 1 . 1 3 3 ALA CA C 13 52.657 0.3 . 1 . . . . . 340 ALA CA . 51420 1 8 . 1 . 1 3 3 ALA CB C 13 18.958 0.3 . 1 . . . . . 340 ALA CB . 51420 1 9 . 1 . 1 3 3 ALA N N 15 125.034 0.3 . 1 . . . . . 340 ALA N . 51420 1 10 . 1 . 1 4 4 GLU H H 1 8.525 0.02 . 1 . . . . . 341 GLU H . 51420 1 11 . 1 . 1 4 4 GLU HA H 1 4.207 0.02 . 1 . . . . . 341 GLU HA . 51420 1 12 . 1 . 1 4 4 GLU HB2 H 1 1.974 0.02 . 1 . . . . . 341 GLU HB2 . 51420 1 13 . 1 . 1 4 4 GLU HB3 H 1 1.974 0.02 . 1 . . . . . 341 GLU HB3 . 51420 1 14 . 1 . 1 4 4 GLU C C 13 176.651 0.3 . 1 . . . . . 341 GLU C . 51420 1 15 . 1 . 1 4 4 GLU CA C 13 56.576 0.3 . 1 . . . . . 341 GLU CA . 51420 1 16 . 1 . 1 4 4 GLU CB C 13 29.886 0.3 . 1 . . . . . 341 GLU CB . 51420 1 17 . 1 . 1 4 4 GLU CG C 13 36.048 0.3 . 1 . . . . . 341 GLU CG . 51420 1 18 . 1 . 1 4 4 GLU N N 15 119.859 0.3 . 1 . . . . . 341 GLU N . 51420 1 19 . 1 . 1 5 5 ARG H H 1 8.384 0.02 . 1 . . . . . 342 ARG H . 51420 1 20 . 1 . 1 5 5 ARG HA H 1 4.301 0.02 . 1 . . . . . 342 ARG HA . 51420 1 21 . 1 . 1 5 5 ARG HB2 H 1 1.694 0.02 . 1 . . . . . 342 ARG HB2 . 51420 1 22 . 1 . 1 5 5 ARG HB3 H 1 1.694 0.02 . 1 . . . . . 342 ARG HB3 . 51420 1 23 . 1 . 1 5 5 ARG C C 13 176.259 0.3 . 1 . . . . . 342 ARG C . 51420 1 24 . 1 . 1 5 5 ARG CA C 13 56.167 0.3 . 1 . . . . . 342 ARG CA . 51420 1 25 . 1 . 1 5 5 ARG CB C 13 30.52 0.3 . 1 . . . . . 342 ARG CB . 51420 1 26 . 1 . 1 5 5 ARG CG C 13 27.106 0.3 . 1 . . . . . 342 ARG CG . 51420 1 27 . 1 . 1 5 5 ARG CD C 13 42.936 0.3 . 1 . . . . . 342 ARG CD . 51420 1 28 . 1 . 1 5 5 ARG N N 15 122.503 0.3 . 1 . . . . . 342 ARG N . 51420 1 29 . 1 . 1 6 6 ILE H H 1 8.282 0.02 . 1 . . . . . 343 ILE H . 51420 1 30 . 1 . 1 6 6 ILE HA H 1 4.11 0.02 . 1 . . . . . 343 ILE HA . 51420 1 31 . 1 . 1 6 6 ILE HB H 1 1.789 0.02 . 1 . . . . . 343 ILE HB . 51420 1 32 . 1 . 1 6 6 ILE HD11 H 1 0.854 0.02 . 1 . . . . . 343 ILE HD1 . 51420 1 33 . 1 . 1 6 6 ILE HD12 H 1 0.854 0.02 . 1 . . . . . 343 ILE HD1 . 51420 1 34 . 1 . 1 6 6 ILE HD13 H 1 0.854 0.02 . 1 . . . . . 343 ILE HD1 . 51420 1 35 . 1 . 1 6 6 ILE C C 13 176.233 0.3 . 1 . . . . . 343 ILE C . 51420 1 36 . 1 . 1 6 6 ILE CA C 13 61.144 0.3 . 1 . . . . . 343 ILE CA . 51420 1 37 . 1 . 1 6 6 ILE CB C 13 38.323 0.3 . 1 . . . . . 343 ILE CB . 51420 1 38 . 1 . 1 6 6 ILE CG1 C 13 27.289 0.3 . 1 . . . . . 343 ILE CG1 . 51420 1 39 . 1 . 1 6 6 ILE CG2 C 13 17.265 0.3 . 1 . . . . . 343 ILE CG2 . 51420 1 40 . 1 . 1 6 6 ILE N N 15 122.651 0.3 . 1 . . . . . 343 ILE N . 51420 1 41 . 1 . 1 7 7 LYS H H 1 8.582 0.02 . 1 . . . . . 344 LYS H . 51420 1 42 . 1 . 1 7 7 LYS HA H 1 4.363 0.02 . 1 . . . . . 344 LYS HA . 51420 1 43 . 1 . 1 7 7 LYS HB2 H 1 1.695 0.02 . 1 . . . . . 344 LYS HB2 . 51420 1 44 . 1 . 1 7 7 LYS HB3 H 1 1.695 0.02 . 1 . . . . . 344 LYS HB3 . 51420 1 45 . 1 . 1 7 7 LYS HG2 H 1 1.382 0.02 . 1 . . . . . 344 LYS HG2 . 51420 1 46 . 1 . 1 7 7 LYS HG3 H 1 1.382 0.02 . 1 . . . . . 344 LYS HG3 . 51420 1 47 . 1 . 1 7 7 LYS C C 13 176.386 0.3 . 1 . . . . . 344 LYS C . 51420 1 48 . 1 . 1 7 7 LYS CA C 13 56.208 0.3 . 1 . . . . . 344 LYS CA . 51420 1 49 . 1 . 1 7 7 LYS CB C 13 32.919 0.3 . 1 . . . . . 344 LYS CB . 51420 1 50 . 1 . 1 7 7 LYS CG C 13 24.562 0.3 . 1 . . . . . 344 LYS CG . 51420 1 51 . 1 . 1 7 7 LYS CD C 13 29.239 0.3 . 1 . . . . . 344 LYS CD . 51420 1 52 . 1 . 1 7 7 LYS CE C 13 42.334 0.3 . 1 . . . . . 344 LYS CE . 51420 1 53 . 1 . 1 7 7 LYS N N 15 126.599 0.3 . 1 . . . . . 344 LYS N . 51420 1 54 . 1 . 1 8 8 THR H H 1 8.381 0.02 . 1 . . . . . 345 THR H . 51420 1 55 . 1 . 1 8 8 THR HA H 1 4.547 0.02 . 1 . . . . . 345 THR HA . 51420 1 56 . 1 . 1 8 8 THR HB H 1 4.05 0.02 . 1 . . . . . 345 THR HB . 51420 1 57 . 1 . 1 8 8 THR HG21 H 1 1.225 0.02 . 1 . . . . . 345 THR HG2 . 51420 1 58 . 1 . 1 8 8 THR HG22 H 1 1.225 0.02 . 1 . . . . . 345 THR HG2 . 51420 1 59 . 1 . 1 8 8 THR HG23 H 1 1.225 0.02 . 1 . . . . . 345 THR HG2 . 51420 1 60 . 1 . 1 8 8 THR C C 13 172.29 0.3 . 1 . . . . . 345 THR C . 51420 1 61 . 1 . 1 8 8 THR CA C 13 59.912 0.3 . 1 . . . . . 345 THR CA . 51420 1 62 . 1 . 1 8 8 THR CB C 13 69.385 0.3 . 1 . . . . . 345 THR CB . 51420 1 63 . 1 . 1 8 8 THR N N 15 119.233 0.3 . 1 . . . . . 345 THR N . 51420 1 64 . 1 . 1 9 9 PRO HA H 1 4.696 0.02 . 1 . . . . . 346 PRO HA . 51420 1 65 . 1 . 1 9 9 PRO C C 13 174.54 0.3 . 1 . . . . . 346 PRO C . 51420 1 66 . 1 . 1 9 9 PRO CA C 13 61.617 0.3 . 1 . . . . . 346 PRO CA . 51420 1 67 . 1 . 1 9 9 PRO N N 15 140.624 0.3 . 1 . . . . . 346 PRO N . 51420 1 68 . 1 . 1 10 10 PRO HA H 1 4.424 0.02 . 1 . . . . . 347 PRO HA . 51420 1 69 . 1 . 1 10 10 PRO C C 13 176.746 0.3 . 1 . . . . . 347 PRO C . 51420 1 70 . 1 . 1 10 10 PRO CA C 13 62.722 0.3 . 1 . . . . . 347 PRO CA . 51420 1 71 . 1 . 1 10 10 PRO CB C 13 32.048 0.3 . 1 . . . . . 347 PRO CB . 51420 1 72 . 1 . 1 10 10 PRO CG C 13 27.401 0.3 . 1 . . . . . 347 PRO CG . 51420 1 73 . 1 . 1 10 10 PRO N N 15 135.382 0.3 . 1 . . . . . 347 PRO N . 51420 1 74 . 1 . 1 11 11 LYS H H 1 8.587 0.02 . 1 . . . . . 348 LYS H . 51420 1 75 . 1 . 1 11 11 LYS HA H 1 4.255 0.02 . 1 . . . . . 348 LYS HA . 51420 1 76 . 1 . 1 11 11 LYS HB2 H 1 1.695 0.02 . 1 . . . . . 348 LYS HB2 . 51420 1 77 . 1 . 1 11 11 LYS HB3 H 1 1.695 0.02 . 1 . . . . . 348 LYS HB3 . 51420 1 78 . 1 . 1 11 11 LYS C C 13 176.568 0.3 . 1 . . . . . 348 LYS C . 51420 1 79 . 1 . 1 11 11 LYS CA C 13 56.264 0.3 . 1 . . . . . 348 LYS CA . 51420 1 80 . 1 . 1 11 11 LYS CB C 13 32.95 0.3 . 1 . . . . . 348 LYS CB . 51420 1 81 . 1 . 1 11 11 LYS CG C 13 24.558 0.3 . 1 . . . . . 348 LYS CG . 51420 1 82 . 1 . 1 11 11 LYS CD C 13 28.8 0.3 . 1 . . . . . 348 LYS CD . 51420 1 83 . 1 . 1 11 11 LYS N N 15 122.242 0.3 . 1 . . . . . 348 LYS N . 51420 1 84 . 1 . 1 12 12 ARG H H 1 8.649 0.02 . 1 . . . . . 349 ARG H . 51420 1 85 . 1 . 1 12 12 ARG HA H 1 4.633 0.02 . 1 . . . . . 349 ARG HA . 51420 1 86 . 1 . 1 12 12 ARG HB2 H 1 1.741 0.02 . 1 . . . . . 349 ARG HB2 . 51420 1 87 . 1 . 1 12 12 ARG HB3 H 1 1.741 0.02 . 1 . . . . . 349 ARG HB3 . 51420 1 88 . 1 . 1 12 12 ARG HG2 H 1 1.62 0.02 . 1 . . . . . 349 ARG HG2 . 51420 1 89 . 1 . 1 12 12 ARG HG3 H 1 1.62 0.02 . 1 . . . . . 349 ARG HG3 . 51420 1 90 . 1 . 1 12 12 ARG C C 13 174.295 0.3 . 1 . . . . . 349 ARG C . 51420 1 91 . 1 . 1 12 12 ARG CA C 13 53.858 0.3 . 1 . . . . . 349 ARG CA . 51420 1 92 . 1 . 1 12 12 ARG CB C 13 30.095 0.3 . 1 . . . . . 349 ARG CB . 51420 1 93 . 1 . 1 12 12 ARG N N 15 124.201 0.3 . 1 . . . . . 349 ARG N . 51420 1 94 . 1 . 1 13 13 PRO HA H 1 4.435 0.02 . 1 . . . . . 350 PRO HA . 51420 1 95 . 1 . 1 13 13 PRO C C 13 177.471 0.3 . 1 . . . . . 350 PRO C . 51420 1 96 . 1 . 1 13 13 PRO CA C 13 63.408 0.3 . 1 . . . . . 350 PRO CA . 51420 1 97 . 1 . 1 13 13 PRO CB C 13 31.77 0.3 . 1 . . . . . 350 PRO CB . 51420 1 98 . 1 . 1 13 13 PRO CG C 13 27.408 0.3 . 1 . . . . . 350 PRO CG . 51420 1 99 . 1 . 1 13 13 PRO CD C 13 50.648 0.3 . 1 . . . . . 350 PRO CD . 51420 1 100 . 1 . 1 13 13 PRO N N 15 137.467 0.3 . 1 . . . . . 350 PRO N . 51420 1 101 . 1 . 1 14 14 GLY H H 1 8.705 0.02 . 1 . . . . . 351 GLY H . 51420 1 102 . 1 . 1 14 14 GLY HA2 H 1 3.967 0.02 . 1 . . . . . 351 GLY HA2 . 51420 1 103 . 1 . 1 14 14 GLY HA3 H 1 3.967 0.02 . 1 . . . . . 351 GLY HA3 . 51420 1 104 . 1 . 1 14 14 GLY C C 13 174.677 0.3 . 1 . . . . . 351 GLY C . 51420 1 105 . 1 . 1 14 14 GLY CA C 13 45.223 0.3 . 1 . . . . . 351 GLY CA . 51420 1 106 . 1 . 1 14 14 GLY N N 15 109.841 0.3 . 1 . . . . . 351 GLY N . 51420 1 107 . 1 . 1 15 15 GLY H H 1 8.438 0.02 . 1 . . . . . 352 GLY H . 51420 1 108 . 1 . 1 15 15 GLY HA2 H 1 3.957 0.02 . 1 . . . . . 352 GLY HA2 . 51420 1 109 . 1 . 1 15 15 GLY HA3 H 1 3.957 0.02 . 1 . . . . . 352 GLY HA3 . 51420 1 110 . 1 . 1 15 15 GLY C C 13 174.062 0.3 . 1 . . . . . 352 GLY C . 51420 1 111 . 1 . 1 15 15 GLY CA C 13 45.073 0.3 . 1 . . . . . 352 GLY CA . 51420 1 112 . 1 . 1 15 15 GLY N N 15 108.786 0.3 . 1 . . . . . 352 GLY N . 51420 1 113 . 1 . 1 16 16 ARG H H 1 8.484 0.02 . 1 . . . . . 353 ARG H . 51420 1 114 . 1 . 1 16 16 ARG HA H 1 4.318 0.02 . 1 . . . . . 353 ARG HA . 51420 1 115 . 1 . 1 16 16 ARG C C 13 176.415 0.3 . 1 . . . . . 353 ARG C . 51420 1 116 . 1 . 1 16 16 ARG CA C 13 56.155 0.3 . 1 . . . . . 353 ARG CA . 51420 1 117 . 1 . 1 16 16 ARG CB C 13 30.715 0.3 . 1 . . . . . 353 ARG CB . 51420 1 118 . 1 . 1 16 16 ARG N N 15 120.898 0.3 . 1 . . . . . 353 ARG N . 51420 1 119 . 1 . 1 17 17 ARG H H 1 8.677 0.02 . 1 . . . . . 354 ARG H . 51420 1 120 . 1 . 1 17 17 ARG C C 13 176.42 0.3 . 1 . . . . . 354 ARG C . 51420 1 121 . 1 . 1 17 17 ARG CA C 13 56.166 0.3 . 1 . . . . . 354 ARG CA . 51420 1 122 . 1 . 1 17 17 ARG CB C 13 30.525 0.3 . 1 . . . . . 354 ARG CB . 51420 1 123 . 1 . 1 17 17 ARG N N 15 123.254 0.3 . 1 . . . . . 354 ARG N . 51420 1 124 . 1 . 1 18 18 ARG H H 1 8.771 0.02 . 1 . . . . . 355 ARG H . 51420 1 125 . 1 . 1 18 18 ARG HA H 1 4.321 0.02 . 1 . . . . . 355 ARG HA . 51420 1 126 . 1 . 1 18 18 ARG C C 13 176.726 0.3 . 1 . . . . . 355 ARG C . 51420 1 127 . 1 . 1 18 18 ARG CA C 13 56.151 0.3 . 1 . . . . . 355 ARG CA . 51420 1 128 . 1 . 1 18 18 ARG CB C 13 30.211 0.3 . 1 . . . . . 355 ARG CB . 51420 1 129 . 1 . 1 18 18 ARG N N 15 123.776 0.3 . 1 . . . . . 355 ARG N . 51420 1 130 . 1 . 1 19 19 GLY H H 1 8.622 0.02 . 1 . . . . . 356 GLY H . 51420 1 131 . 1 . 1 19 19 GLY HA2 H 1 3.969 0.02 . 1 . . . . . 356 GLY HA . 51420 1 132 . 1 . 1 19 19 GLY HA3 H 1 3.969 0.02 . 1 . . . . . 356 GLY HA . 51420 1 133 . 1 . 1 19 19 GLY C C 13 173.601 0.3 . 1 . . . . . 356 GLY C . 51420 1 134 . 1 . 1 19 19 GLY CA C 13 45.149 0.3 . 1 . . . . . 356 GLY CA . 51420 1 135 . 1 . 1 19 19 GLY N N 15 110.415 0.3 . 1 . . . . . 356 GLY N . 51420 1 136 . 1 . 1 20 20 ARG H H 1 8.389 0.02 . 1 . . . . . 357 ARG H . 51420 1 137 . 1 . 1 20 20 ARG HA H 1 4.343 0.02 . 1 . . . . . 357 ARG HA . 51420 1 138 . 1 . 1 20 20 ARG C C 13 176.395 0.3 . 1 . . . . . 357 ARG C . 51420 1 139 . 1 . 1 20 20 ARG CA C 13 55.888 0.3 . 1 . . . . . 357 ARG CA . 51420 1 140 . 1 . 1 20 20 ARG CB C 13 30.846 0.3 . 1 . . . . . 357 ARG CB . 51420 1 141 . 1 . 1 20 20 ARG N N 15 120.749 0.3 . 1 . . . . . 357 ARG N . 51420 1 142 . 1 . 1 21 21 LEU H H 1 8.609 0.02 . 1 . . . . . 358 LEU H . 51420 1 143 . 1 . 1 21 21 LEU HA H 1 4.593 0.02 . 1 . . . . . 358 LEU HA . 51420 1 144 . 1 . 1 21 21 LEU HB2 H 1 1.57 0.02 . 1 . . . . . 358 LEU HB2 . 51420 1 145 . 1 . 1 21 21 LEU HB3 H 1 1.57 0.02 . 1 . . . . . 358 LEU HB3 . 51420 1 146 . 1 . 1 21 21 LEU HD11 H 1 0.916 0.02 . 1 . . . . . 358 LEU HD1 . 51420 1 147 . 1 . 1 21 21 LEU HD12 H 1 0.916 0.02 . 1 . . . . . 358 LEU HD1 . 51420 1 148 . 1 . 1 21 21 LEU HD13 H 1 0.916 0.02 . 1 . . . . . 358 LEU HD1 . 51420 1 149 . 1 . 1 21 21 LEU HD21 H 1 0.916 0.02 . 1 . . . . . 358 LEU HD2 . 51420 1 150 . 1 . 1 21 21 LEU HD22 H 1 0.916 0.02 . 1 . . . . . 358 LEU HD2 . 51420 1 151 . 1 . 1 21 21 LEU HD23 H 1 0.916 0.02 . 1 . . . . . 358 LEU HD2 . 51420 1 152 . 1 . 1 21 21 LEU C C 13 176.495 0.3 . 1 . . . . . 358 LEU C . 51420 1 153 . 1 . 1 21 21 LEU CA C 13 53.123 0.3 . 1 . . . . . 358 LEU CA . 51420 1 154 . 1 . 1 21 21 LEU CB C 13 41.266 0.3 . 1 . . . . . 358 LEU CB . 51420 1 155 . 1 . 1 21 21 LEU N N 15 125.439 0.3 . 1 . . . . . 358 LEU N . 51420 1 156 . 1 . 1 22 22 PRO HA H 1 4.405 0.02 . 1 . . . . . 359 PRO HA . 51420 1 157 . 1 . 1 22 22 PRO C C 13 176.51 0.3 . 1 . . . . . 359 PRO C . 51420 1 158 . 1 . 1 22 22 PRO CA C 13 62.996 0.3 . 1 . . . . . 359 PRO CA . 51420 1 159 . 1 . 1 22 22 PRO CB C 13 32.045 0.3 . 1 . . . . . 359 PRO CB . 51420 1 160 . 1 . 1 22 22 PRO CG C 13 27.233 0.3 . 1 . . . . . 359 PRO CG . 51420 1 161 . 1 . 1 22 22 PRO CD C 13 50.338 0.3 . 1 . . . . . 359 PRO CD . 51420 1 162 . 1 . 1 22 22 PRO N N 15 135.432 0.3 . 1 . . . . . 359 PRO N . 51420 1 163 . 1 . 1 23 23 ASN H H 1 8.693 0.02 . 1 . . . . . 360 ASN H . 51420 1 164 . 1 . 1 23 23 ASN HA H 1 4.656 0.02 . 1 . . . . . 360 ASN HA . 51420 1 165 . 1 . 1 23 23 ASN HB2 H 1 2.724 0.02 . 1 . . . . . 360 ASN HB2 . 51420 1 166 . 1 . 1 23 23 ASN HB3 H 1 2.724 0.02 . 1 . . . . . 360 ASN HB3 . 51420 1 167 . 1 . 1 23 23 ASN C C 13 174.972 0.3 . 1 . . . . . 360 ASN C . 51420 1 168 . 1 . 1 23 23 ASN CA C 13 53.286 0.3 . 1 . . . . . 360 ASN CA . 51420 1 169 . 1 . 1 23 23 ASN CB C 13 38.648 0.3 . 1 . . . . . 360 ASN CB . 51420 1 170 . 1 . 1 23 23 ASN N N 15 119.557 0.3 . 1 . . . . . 360 ASN N . 51420 1 171 . 1 . 1 24 24 ASN H H 1 8.553 0.02 . 1 . . . . . 361 ASN H . 51420 1 172 . 1 . 1 24 24 ASN HA H 1 4.752 0.02 . 1 . . . . . 361 ASN HA . 51420 1 173 . 1 . 1 24 24 ASN HB2 H 1 2.665 0.02 . 1 . . . . . 361 ASN HB2 . 51420 1 174 . 1 . 1 24 24 ASN HB3 H 1 2.665 0.02 . 1 . . . . . 361 ASN HB3 . 51420 1 175 . 1 . 1 24 24 ASN CA C 13 53.341 0.3 . 1 . . . . . 361 ASN CA . 51420 1 176 . 1 . 1 24 24 ASN CB C 13 38.603 0.3 . 1 . . . . . 361 ASN CB . 51420 1 177 . 1 . 1 24 24 ASN N N 15 120.054 0.3 . 1 . . . . . 361 ASN N . 51420 1 178 . 1 . 1 25 25 SER HA H 1 4.459 0.02 . 1 . . . . . 362 SER HA . 51420 1 179 . 1 . 1 25 25 SER C C 13 174.639 0.3 . 1 . . . . . 362 SER C . 51420 1 180 . 1 . 1 25 25 SER CA C 13 58.717 0.3 . 1 . . . . . 362 SER CA . 51420 1 181 . 1 . 1 25 25 SER N N 15 116.018 0.3 . 1 . . . . . 362 SER N . 51420 1 182 . 1 . 1 26 26 SER H H 1 8.462 0.02 . 1 . . . . . 363 SER H . 51420 1 183 . 1 . 1 26 26 SER HA H 1 4.463 0.02 . 1 . . . . . 363 SER HA . 51420 1 184 . 1 . 1 26 26 SER C C 13 174.041 0.3 . 1 . . . . . 363 SER C . 51420 1 185 . 1 . 1 26 26 SER CA C 13 58.388 0.3 . 1 . . . . . 363 SER CA . 51420 1 186 . 1 . 1 26 26 SER CB C 13 63.654 0.3 . 1 . . . . . 363 SER CB . 51420 1 187 . 1 . 1 26 26 SER N N 15 117.787 0.3 . 1 . . . . . 363 SER N . 51420 1 188 . 1 . 1 27 27 ARG H H 1 8.357 0.02 . 1 . . . . . 364 ARG H . 51420 1 189 . 1 . 1 27 27 ARG HA H 1 4.652 0.02 . 1 . . . . . 364 ARG HA . 51420 1 190 . 1 . 1 27 27 ARG HB2 H 1 1.709 0.02 . 1 . . . . . 364 ARG HB2 . 51420 1 191 . 1 . 1 27 27 ARG HB3 H 1 1.709 0.02 . 1 . . . . . 364 ARG HB3 . 51420 1 192 . 1 . 1 27 27 ARG C C 13 174.027 0.3 . 1 . . . . . 364 ARG C . 51420 1 193 . 1 . 1 27 27 ARG CA C 13 53.987 0.3 . 1 . . . . . 364 ARG CA . 51420 1 194 . 1 . 1 27 27 ARG CB C 13 30.032 0.3 . 1 . . . . . 364 ARG CB . 51420 1 195 . 1 . 1 27 27 ARG N N 15 123.868 0.3 . 1 . . . . . 364 ARG N . 51420 1 196 . 1 . 1 28 28 PRO HA H 1 4.476 0.02 . 1 . . . . . 365 PRO HA . 51420 1 197 . 1 . 1 28 28 PRO C C 13 176.978 0.3 . 1 . . . . . 365 PRO C . 51420 1 198 . 1 . 1 28 28 PRO CA C 13 63.14 0.3 . 1 . . . . . 365 PRO CA . 51420 1 199 . 1 . 1 28 28 PRO CB C 13 32.089 0.3 . 1 . . . . . 365 PRO CB . 51420 1 200 . 1 . 1 28 28 PRO CG C 13 27.282 0.3 . 1 . . . . . 365 PRO CG . 51420 1 201 . 1 . 1 28 28 PRO CD C 13 50.43 0.3 . 1 . . . . . 365 PRO CD . 51420 1 202 . 1 . 1 28 28 PRO N N 15 137.461 0.3 . 1 . . . . . 365 PRO N . 51420 1 203 . 1 . 1 29 29 SER H H 1 8.672 0.02 . 1 . . . . . 366 SER H . 51420 1 204 . 1 . 1 29 29 SER HA H 1 4.447 0.02 . 1 . . . . . 366 SER HA . 51420 1 205 . 1 . 1 29 29 SER HB2 H 1 3.849 0.02 . 1 . . . . . 366 SER HB2 . 51420 1 206 . 1 . 1 29 29 SER HB3 H 1 3.849 0.02 . 1 . . . . . 366 SER HB3 . 51420 1 207 . 1 . 1 29 29 SER C C 13 174.382 0.3 . 1 . . . . . 366 SER C . 51420 1 208 . 1 . 1 29 29 SER CA C 13 58.303 0.3 . 1 . . . . . 366 SER CA . 51420 1 209 . 1 . 1 29 29 SER CB C 13 63.493 0.3 . 1 . . . . . 366 SER CB . 51420 1 210 . 1 . 1 29 29 SER N N 15 116.834 0.3 . 1 . . . . . 366 SER N . 51420 1 211 . 1 . 1 30 30 THR H H 1 8.279 0.02 . 1 . . . . . 367 THR H . 51420 1 212 . 1 . 1 30 30 THR HA H 1 4.637 0.02 . 1 . . . . . 367 THR HA . 51420 1 213 . 1 . 1 30 30 THR HB H 1 4.122 0.02 . 1 . . . . . 367 THR HB . 51420 1 214 . 1 . 1 30 30 THR HG21 H 1 1.211 0.02 . 1 . . . . . 367 THR HG2 . 51420 1 215 . 1 . 1 30 30 THR HG22 H 1 1.211 0.02 . 1 . . . . . 367 THR HG2 . 51420 1 216 . 1 . 1 30 30 THR HG23 H 1 1.211 0.02 . 1 . . . . . 367 THR HG2 . 51420 1 217 . 1 . 1 30 30 THR C C 13 172.632 0.3 . 1 . . . . . 367 THR C . 51420 1 218 . 1 . 1 30 30 THR CA C 13 59.759 0.3 . 1 . . . . . 367 THR CA . 51420 1 219 . 1 . 1 30 30 THR CB C 13 69.59 0.3 . 1 . . . . . 367 THR CB . 51420 1 220 . 1 . 1 30 30 THR N N 15 118.18 0.3 . 1 . . . . . 367 THR N . 51420 1 221 . 1 . 1 31 31 PRO HA H 1 4.479 0.02 . 1 . . . . . 368 PRO HA . 51420 1 222 . 1 . 1 31 31 PRO C C 13 176.94 0.3 . 1 . . . . . 368 PRO C . 51420 1 223 . 1 . 1 31 31 PRO CA C 13 63.325 0.3 . 1 . . . . . 368 PRO CA . 51420 1 224 . 1 . 1 31 31 PRO CB C 13 32.113 0.3 . 1 . . . . . 368 PRO CB . 51420 1 225 . 1 . 1 31 31 PRO CG C 13 27.132 0.3 . 1 . . . . . 368 PRO CG . 51420 1 226 . 1 . 1 31 31 PRO CD C 13 50.893 0.3 . 1 . . . . . 368 PRO CD . 51420 1 227 . 1 . 1 31 31 PRO N N 15 138.859 0.3 . 1 . . . . . 368 PRO N . 51420 1 228 . 1 . 1 32 32 THR H H 1 8.444 0.02 . 1 . . . . . 369 THR H . 51420 1 229 . 1 . 1 32 32 THR HA H 1 4.289 0.02 . 1 . . . . . 369 THR HA . 51420 1 230 . 1 . 1 32 32 THR HG21 H 1 1.137 0.02 . 1 . . . . . 369 THR HG2 . 51420 1 231 . 1 . 1 32 32 THR HG22 H 1 1.137 0.02 . 1 . . . . . 369 THR HG2 . 51420 1 232 . 1 . 1 32 32 THR HG23 H 1 1.137 0.02 . 1 . . . . . 369 THR HG2 . 51420 1 233 . 1 . 1 32 32 THR C C 13 174.43 0.3 . 1 . . . . . 369 THR C . 51420 1 234 . 1 . 1 32 32 THR CA C 13 62.118 0.3 . 1 . . . . . 369 THR CA . 51420 1 235 . 1 . 1 32 32 THR CB C 13 69.593 0.3 . 1 . . . . . 369 THR CB . 51420 1 236 . 1 . 1 32 32 THR CG2 C 13 21.698 0.3 . 1 . . . . . 369 THR CG2 . 51420 1 237 . 1 . 1 32 32 THR N N 15 115.84 0.3 . 1 . . . . . 369 THR N . 51420 1 238 . 1 . 1 33 33 ILE H H 1 8.302 0.02 . 1 . . . . . 370 ILE H . 51420 1 239 . 1 . 1 33 33 ILE HA H 1 4.174 0.02 . 1 . . . . . 370 ILE HA . 51420 1 240 . 1 . 1 33 33 ILE HB H 1 1.79 0.02 . 1 . . . . . 370 ILE HB . 51420 1 241 . 1 . 1 33 33 ILE HG12 H 1 0.853 0.02 . 1 . . . . . 370 ILE HG12 . 51420 1 242 . 1 . 1 33 33 ILE C C 13 175.609 0.3 . 1 . . . . . 370 ILE C . 51420 1 243 . 1 . 1 33 33 ILE CA C 13 61.003 0.3 . 1 . . . . . 370 ILE CA . 51420 1 244 . 1 . 1 33 33 ILE CB C 13 38.662 0.3 . 1 . . . . . 370 ILE CB . 51420 1 245 . 1 . 1 33 33 ILE CG1 C 13 27.083 0.3 . 1 . . . . . 370 ILE CG1 . 51420 1 246 . 1 . 1 33 33 ILE CG2 C 13 17.179 0.3 . 1 . . . . . 370 ILE CG2 . 51420 1 247 . 1 . 1 33 33 ILE CD1 C 13 12.624 0.3 . 1 . . . . . 370 ILE CD . 51420 1 248 . 1 . 1 33 33 ILE N N 15 123.462 0.3 . 1 . . . . . 370 ILE N . 51420 1 249 . 1 . 1 34 34 ASN H H 1 8.678 0.02 . 1 . . . . . 371 ASN H . 51420 1 250 . 1 . 1 34 34 ASN HA H 1 4.746 0.02 . 1 . . . . . 371 ASN HA . 51420 1 251 . 1 . 1 34 34 ASN HB2 H 1 2.724 0.02 . 1 . . . . . 371 ASN HB2 . 51420 1 252 . 1 . 1 34 34 ASN HB3 H 1 2.724 0.02 . 1 . . . . . 371 ASN HB3 . 51420 1 253 . 1 . 1 34 34 ASN C C 13 175.139 0.3 . 1 . . . . . 371 ASN C . 51420 1 254 . 1 . 1 34 34 ASN CA C 13 53.026 0.3 . 1 . . . . . 371 ASN CA . 51420 1 255 . 1 . 1 34 34 ASN CB C 13 38.66 0.3 . 1 . . . . . 371 ASN CB . 51420 1 256 . 1 . 1 34 34 ASN N N 15 123.346 0.3 . 1 . . . . . 371 ASN N . 51420 1 257 . 1 . 1 35 35 VAL H H 1 8.337 0.02 . 1 . . . . . 372 VAL H . 51420 1 258 . 1 . 1 35 35 VAL HA H 1 4.073 0.02 . 1 . . . . . 372 VAL HA . 51420 1 259 . 1 . 1 35 35 VAL HB H 1 2.058 0.02 . 1 . . . . . 372 VAL HB . 51420 1 260 . 1 . 1 35 35 VAL HG11 H 1 0.911 0.02 . 1 . . . . . 372 VAL HG12 . 51420 1 261 . 1 . 1 35 35 VAL HG12 H 1 0.911 0.02 . 1 . . . . . 372 VAL HG12 . 51420 1 262 . 1 . 1 35 35 VAL HG13 H 1 0.911 0.02 . 1 . . . . . 372 VAL HG12 . 51420 1 263 . 1 . 1 35 35 VAL C C 13 176.256 0.3 . 1 . . . . . 372 VAL C . 51420 1 264 . 1 . 1 35 35 VAL CA C 13 62.676 0.3 . 1 . . . . . 372 VAL CA . 51420 1 265 . 1 . 1 35 35 VAL CB C 13 32.436 0.3 . 1 . . . . . 372 VAL CB . 51420 1 266 . 1 . 1 35 35 VAL CG1 C 13 20.688 0.3 . 1 . . . . . 372 VAL CG1 . 51420 1 267 . 1 . 1 35 35 VAL CG2 C 13 20.688 0.3 . 1 . . . . . 372 VAL CG2 . 51420 1 268 . 1 . 1 35 35 VAL N N 15 121.465 0.3 . 1 . . . . . 372 VAL N . 51420 1 269 . 1 . 1 36 36 LEU H H 1 8.409 0.02 . 1 . . . . . 373 LEU H . 51420 1 270 . 1 . 1 36 36 LEU HA H 1 4.352 0.02 . 1 . . . . . 373 LEU HA . 51420 1 271 . 1 . 1 36 36 LEU HB2 H 1 1.606 0.02 . 1 . . . . . 373 LEU HB2 . 51420 1 272 . 1 . 1 36 36 LEU HB3 H 1 1.606 0.02 . 1 . . . . . 373 LEU HB3 . 51420 1 273 . 1 . 1 36 36 LEU C C 13 177.36 0.3 . 1 . . . . . 373 LEU C . 51420 1 274 . 1 . 1 36 36 LEU CA C 13 55.189 0.3 . 1 . . . . . 373 LEU CA . 51420 1 275 . 1 . 1 36 36 LEU CB C 13 41.96 0.3 . 1 . . . . . 373 LEU CB . 51420 1 276 . 1 . 1 36 36 LEU CG C 13 27.172 0.3 . 1 . . . . . 373 LEU CG . 51420 1 277 . 1 . 1 36 36 LEU CD1 C 13 24.349 0.3 . 1 . . . . . 373 LEU CD1 . 51420 1 278 . 1 . 1 36 36 LEU CD2 C 13 24.349 0.3 . 1 . . . . . 373 LEU CD2 . 51420 1 279 . 1 . 1 36 36 LEU N N 15 125.141 0.3 . 1 . . . . . 373 LEU N . 51420 1 280 . 1 . 1 37 37 GLU H H 1 8.399 0.02 . 1 . . . . . 374 GLU H . 51420 1 281 . 1 . 1 37 37 GLU HA H 1 4.288 0.02 . 1 . . . . . 374 GLU HA . 51420 1 282 . 1 . 1 37 37 GLU HB2 H 1 1.973 0.02 . 1 . . . . . 374 GLU HB2 . 51420 1 283 . 1 . 1 37 37 GLU HB3 H 1 1.973 0.02 . 1 . . . . . 374 GLU HB3 . 51420 1 284 . 1 . 1 37 37 GLU C C 13 176.313 0.3 . 1 . . . . . 374 GLU C . 51420 1 285 . 1 . 1 37 37 GLU CA C 13 56.438 0.3 . 1 . . . . . 374 GLU CA . 51420 1 286 . 1 . 1 37 37 GLU CB C 13 30.213 0.3 . 1 . . . . . 374 GLU CB . 51420 1 287 . 1 . 1 37 37 GLU N N 15 121.838 0.3 . 1 . . . . . 374 GLU N . 51420 1 288 . 1 . 1 38 38 SER H H 1 8.459 0.02 . 1 . . . . . 375 SER H . 51420 1 289 . 1 . 1 38 38 SER HA H 1 4.434 0.02 . 1 . . . . . 375 SER HA . 51420 1 290 . 1 . 1 38 38 SER HB2 H 1 3.829 0.02 . 1 . . . . . 375 SER HB2 . 51420 1 291 . 1 . 1 38 38 SER HB3 H 1 3.829 0.02 . 1 . . . . . 375 SER HB3 . 51420 1 292 . 1 . 1 38 38 SER C C 13 174.541 0.3 . 1 . . . . . 375 SER C . 51420 1 293 . 1 . 1 38 38 SER CA C 13 58.31 0.3 . 1 . . . . . 375 SER CA . 51420 1 294 . 1 . 1 38 38 SER CB C 13 63.648 0.3 . 1 . . . . . 375 SER CB . 51420 1 295 . 1 . 1 38 38 SER N N 15 117.579 0.3 . 1 . . . . . 375 SER N . 51420 1 296 . 1 . 1 39 39 LYS H H 1 8.568 0.02 . 1 . . . . . 376 LYS H . 51420 1 297 . 1 . 1 39 39 LYS HA H 1 4.39 0.02 . 1 . . . . . 376 LYS HA . 51420 1 298 . 1 . 1 39 39 LYS HB2 H 1 1.772 0.02 . 1 . . . . . 376 LYS HB2 . 51420 1 299 . 1 . 1 39 39 LYS HB3 H 1 1.772 0.02 . 1 . . . . . 376 LYS HB3 . 51420 1 300 . 1 . 1 39 39 LYS HG2 H 1 1.454 0.02 . 1 . . . . . 376 LYS HG1 . 51420 1 301 . 1 . 1 39 39 LYS HG3 H 1 1.454 0.02 . 1 . . . . . 376 LYS HG2 . 51420 1 302 . 1 . 1 39 39 LYS C C 13 176.422 0.3 . 1 . . . . . 376 LYS C . 51420 1 303 . 1 . 1 39 39 LYS CA C 13 56.217 0.3 . 1 . . . . . 376 LYS CA . 51420 1 304 . 1 . 1 39 39 LYS CB C 13 33.002 0.3 . 1 . . . . . 376 LYS CB . 51420 1 305 . 1 . 1 39 39 LYS CG C 13 24.25 0.3 . 1 . . . . . 376 LYS CG . 51420 1 306 . 1 . 1 39 39 LYS N N 15 123.539 0.3 . 1 . . . . . 376 LYS N . 51420 1 307 . 1 . 1 40 40 ASP H H 1 8.535 0.02 . 1 . . . . . 377 ASP H . 51420 1 308 . 1 . 1 40 40 ASP HA H 1 4.659 0.02 . 1 . . . . . 377 ASP HA . 51420 1 309 . 1 . 1 40 40 ASP HB2 H 1 2.68 0.02 . 1 . . . . . 377 ASP HB2 . 51420 1 310 . 1 . 1 40 40 ASP HB3 H 1 2.68 0.02 . 1 . . . . . 377 ASP HB3 . 51420 1 311 . 1 . 1 40 40 ASP C C 13 176.57 0.3 . 1 . . . . . 377 ASP C . 51420 1 312 . 1 . 1 40 40 ASP CA C 13 54.636 0.3 . 1 . . . . . 377 ASP CA . 51420 1 313 . 1 . 1 40 40 ASP CB C 13 40.837 0.3 . 1 . . . . . 377 ASP CB . 51420 1 314 . 1 . 1 40 40 ASP N N 15 121.718 0.3 . 1 . . . . . 377 ASP N . 51420 1 315 . 1 . 1 41 41 THR H H 1 8.21 0.02 . 1 . . . . . 378 THR H . 51420 1 316 . 1 . 1 41 41 THR HA H 1 4.334 0.02 . 1 . . . . . 378 THR HA . 51420 1 317 . 1 . 1 41 41 THR HB H 1 4.227 0.02 . 1 . . . . . 378 THR HB . 51420 1 318 . 1 . 1 41 41 THR HG21 H 1 1.187 0.02 . 1 . . . . . 378 THR HG2 . 51420 1 319 . 1 . 1 41 41 THR HG22 H 1 1.187 0.02 . 1 . . . . . 378 THR HG2 . 51420 1 320 . 1 . 1 41 41 THR HG23 H 1 1.187 0.02 . 1 . . . . . 378 THR HG2 . 51420 1 321 . 1 . 1 41 41 THR C C 13 174.705 0.3 . 1 . . . . . 378 THR C . 51420 1 322 . 1 . 1 41 41 THR CA C 13 62.014 0.3 . 1 . . . . . 378 THR CA . 51420 1 323 . 1 . 1 41 41 THR CB C 13 69.594 0.3 . 1 . . . . . 378 THR CB . 51420 1 324 . 1 . 1 41 41 THR CG2 C 13 21.466 0.3 . 1 . . . . . 378 THR CG2 . 51420 1 325 . 1 . 1 41 41 THR N N 15 113.695 0.3 . 1 . . . . . 378 THR N . 51420 1 326 . 1 . 1 42 42 ASP H H 1 8.504 0.02 . 1 . . . . . 379 ASP H . 51420 1 327 . 1 . 1 42 42 ASP HA H 1 4.645 0.02 . 1 . . . . . 379 ASP HA . 51420 1 328 . 1 . 1 42 42 ASP HB2 H 1 2.639 0.02 . 1 . . . . . 379 ASP HB2 . 51420 1 329 . 1 . 1 42 42 ASP HB3 H 1 2.639 0.02 . 1 . . . . . 379 ASP HB3 . 51420 1 330 . 1 . 1 42 42 ASP C C 13 176.733 0.3 . 1 . . . . . 379 ASP C . 51420 1 331 . 1 . 1 42 42 ASP CA C 13 54.903 0.3 . 1 . . . . . 379 ASP CA . 51420 1 332 . 1 . 1 42 42 ASP CB C 13 40.847 0.3 . 1 . . . . . 379 ASP CB . 51420 1 333 . 1 . 1 42 42 ASP N N 15 122.788 0.3 . 1 . . . . . 379 ASP N . 51420 1 334 . 1 . 1 43 43 SER H H 1 8.331 0.02 . 1 . . . . . 380 SER H . 51420 1 335 . 1 . 1 43 43 SER HA H 1 4.386 0.02 . 1 . . . . . 380 SER HA . 51420 1 336 . 1 . 1 43 43 SER HB2 H 1 3.848 0.02 . 1 . . . . . 380 SER HB2 . 51420 1 337 . 1 . 1 43 43 SER HB3 H 1 3.848 0.02 . 1 . . . . . 380 SER HB3 . 51420 1 338 . 1 . 1 43 43 SER C C 13 174.651 0.3 . 1 . . . . . 380 SER C . 51420 1 339 . 1 . 1 43 43 SER CA C 13 58.969 0.3 . 1 . . . . . 380 SER CA . 51420 1 340 . 1 . 1 43 43 SER CB C 13 63.463 0.3 . 1 . . . . . 380 SER CB . 51420 1 341 . 1 . 1 43 43 SER N N 15 116.097 0.3 . 1 . . . . . 380 SER N . 51420 1 342 . 1 . 1 44 44 ASP H H 1 8.432 0.02 . 1 . . . . . 381 ASP H . 51420 1 343 . 1 . 1 44 44 ASP HA H 1 4.616 0.02 . 1 . . . . . 381 ASP HA . 51420 1 344 . 1 . 1 44 44 ASP HB2 H 1 2.635 0.02 . 1 . . . . . 381 ASP HB2 . 51420 1 345 . 1 . 1 44 44 ASP HB3 H 1 2.635 0.02 . 1 . . . . . 381 ASP HB3 . 51420 1 346 . 1 . 1 44 44 ASP C C 13 176.416 0.3 . 1 . . . . . 381 ASP C . 51420 1 347 . 1 . 1 44 44 ASP CA C 13 54.67 0.3 . 1 . . . . . 381 ASP CA . 51420 1 348 . 1 . 1 44 44 ASP CB C 13 40.696 0.3 . 1 . . . . . 381 ASP CB . 51420 1 349 . 1 . 1 44 44 ASP N N 15 122.209 0.3 . 1 . . . . . 381 ASP N . 51420 1 350 . 1 . 1 45 45 ARG H H 1 8.185 0.02 . 1 . . . . . 382 ARG H . 51420 1 351 . 1 . 1 45 45 ARG HA H 1 4.293 0.02 . 1 . . . . . 382 ARG HA . 51420 1 352 . 1 . 1 45 45 ARG HB2 H 1 1.701 0.02 . 1 . . . . . 382 ARG HB2 . 51420 1 353 . 1 . 1 45 45 ARG HB3 H 1 1.701 0.02 . 1 . . . . . 382 ARG HB3 . 51420 1 354 . 1 . 1 45 45 ARG C C 13 176.617 0.3 . 1 . . . . . 382 ARG C . 51420 1 355 . 1 . 1 45 45 ARG CA C 13 56.42 0.3 . 1 . . . . . 382 ARG CA . 51420 1 356 . 1 . 1 45 45 ARG CB C 13 30.555 0.3 . 1 . . . . . 382 ARG CB . 51420 1 357 . 1 . 1 45 45 ARG N N 15 121.053 0.3 . 1 . . . . . 382 ARG N . 51420 1 358 . 1 . 1 46 46 GLU H H 1 8.519 0.02 . 1 . . . . . 383 GLU H . 51420 1 359 . 1 . 1 46 46 GLU HA H 1 4.241 0.02 . 1 . . . . . 383 GLU HA . 51420 1 360 . 1 . 1 46 46 GLU HB2 H 1 1.97 0.02 . 1 . . . . . 383 GLU HB2 . 51420 1 361 . 1 . 1 46 46 GLU HB3 H 1 1.97 0.02 . 1 . . . . . 383 GLU HB3 . 51420 1 362 . 1 . 1 46 46 GLU HG2 H 1 2.184 0.02 . 1 . . . . . 383 GLU HG2 . 51420 1 363 . 1 . 1 46 46 GLU HG3 H 1 2.184 0.02 . 1 . . . . . 383 GLU HG3 . 51420 1 364 . 1 . 1 46 46 GLU C C 13 176.517 0.3 . 1 . . . . . 383 GLU C . 51420 1 365 . 1 . 1 46 46 GLU CA C 13 56.647 0.3 . 1 . . . . . 383 GLU CA . 51420 1 366 . 1 . 1 46 46 GLU CB C 13 29.886 0.3 . 1 . . . . . 383 GLU CB . 51420 1 367 . 1 . 1 46 46 GLU CG C 13 36.153 0.3 . 1 . . . . . 383 GLU CG . 51420 1 368 . 1 . 1 46 46 GLU N N 15 121.772 0.3 . 1 . . . . . 383 GLU N . 51420 1 369 . 1 . 1 47 47 ALA H H 1 8.461 0.02 . 1 . . . . . 384 ALA H . 51420 1 370 . 1 . 1 47 47 ALA HA H 1 4.302 0.02 . 1 . . . . . 384 ALA HA . 51420 1 371 . 1 . 1 47 47 ALA HB1 H 1 1.37 0.02 . 1 . . . . . 384 ALA HB . 51420 1 372 . 1 . 1 47 47 ALA HB2 H 1 1.37 0.02 . 1 . . . . . 384 ALA HB . 51420 1 373 . 1 . 1 47 47 ALA HB3 H 1 1.37 0.02 . 1 . . . . . 384 ALA HB . 51420 1 374 . 1 . 1 47 47 ALA C C 13 178.429 0.3 . 1 . . . . . 384 ALA C . 51420 1 375 . 1 . 1 47 47 ALA CA C 13 52.965 0.3 . 1 . . . . . 384 ALA CA . 51420 1 376 . 1 . 1 47 47 ALA CB C 13 19.01 0.3 . 1 . . . . . 384 ALA CB . 51420 1 377 . 1 . 1 47 47 ALA N N 15 125.436 0.3 . 1 . . . . . 384 ALA N . 51420 1 378 . 1 . 1 48 48 GLY H H 1 8.57 0.02 . 1 . . . . . 385 GLY H . 51420 1 379 . 1 . 1 48 48 GLY HA2 H 1 4.03 0.02 . 1 . . . . . 385 GLY HA2 . 51420 1 380 . 1 . 1 48 48 GLY HA3 H 1 4.03 0.02 . 1 . . . . . 385 GLY HA3 . 51420 1 381 . 1 . 1 48 48 GLY C C 13 174.596 0.3 . 1 . . . . . 385 GLY C . 51420 1 382 . 1 . 1 48 48 GLY CA C 13 45.346 0.3 . 1 . . . . . 385 GLY CA . 51420 1 383 . 1 . 1 48 48 GLY N N 15 108.428 0.3 . 1 . . . . . 385 GLY N . 51420 1 384 . 1 . 1 49 49 THR H H 1 8.149 0.02 . 1 . . . . . 386 THR H . 51420 1 385 . 1 . 1 49 49 THR HA H 1 4.367 0.02 . 1 . . . . . 386 THR HA . 51420 1 386 . 1 . 1 49 49 THR HG21 H 1 1.133 0.02 . 1 . . . . . 386 THR HG2 . 51420 1 387 . 1 . 1 49 49 THR HG22 H 1 1.133 0.02 . 1 . . . . . 386 THR HG2 . 51420 1 388 . 1 . 1 49 49 THR HG23 H 1 1.133 0.02 . 1 . . . . . 386 THR HG2 . 51420 1 389 . 1 . 1 49 49 THR C C 13 174.828 0.3 . 1 . . . . . 386 THR C . 51420 1 390 . 1 . 1 49 49 THR CA C 13 61.938 0.3 . 1 . . . . . 386 THR CA . 51420 1 391 . 1 . 1 49 49 THR CB C 13 69.694 0.3 . 1 . . . . . 386 THR CB . 51420 1 392 . 1 . 1 49 49 THR CG2 C 13 21.46 0.3 . 1 . . . . . 386 THR CG2 . 51420 1 393 . 1 . 1 49 49 THR N N 15 113.124 0.3 . 1 . . . . . 386 THR N . 51420 1 394 . 1 . 1 50 50 GLU H H 1 8.773 0.02 . 1 . . . . . 387 GLU H . 51420 1 395 . 1 . 1 50 50 GLU HA H 1 4.406 0.02 . 1 . . . . . 387 GLU HA . 51420 1 396 . 1 . 1 50 50 GLU HB2 H 1 1.978 0.02 . 1 . . . . . 387 GLU HB2 . 51420 1 397 . 1 . 1 50 50 GLU HB3 H 1 1.978 0.02 . 1 . . . . . 387 GLU HB3 . 51420 1 398 . 1 . 1 50 50 GLU HG2 H 1 2.169 0.02 . 1 . . . . . 387 GLU HG2 . 51420 1 399 . 1 . 1 50 50 GLU HG3 H 1 2.169 0.02 . 1 . . . . . 387 GLU HG3 . 51420 1 400 . 1 . 1 50 50 GLU C C 13 176.833 0.3 . 1 . . . . . 387 GLU C . 51420 1 401 . 1 . 1 50 50 GLU CA C 13 56.688 0.3 . 1 . . . . . 387 GLU CA . 51420 1 402 . 1 . 1 50 50 GLU CB C 13 29.9 0.3 . 1 . . . . . 387 GLU CB . 51420 1 403 . 1 . 1 50 50 GLU N N 15 123.658 0.3 . 1 . . . . . 387 GLU N . 51420 1 404 . 1 . 1 51 51 THR H H 1 8.457 0.02 . 1 . . . . . 388 THR H . 51420 1 405 . 1 . 1 51 51 THR HA H 1 4.39 0.02 . 1 . . . . . 388 THR HA . 51420 1 406 . 1 . 1 51 51 THR C C 13 175.318 0.3 . 1 . . . . . 388 THR C . 51420 1 407 . 1 . 1 51 51 THR CA C 13 61.968 0.3 . 1 . . . . . 388 THR CA . 51420 1 408 . 1 . 1 51 51 THR CB C 13 69.665 0.3 . 1 . . . . . 388 THR CB . 51420 1 409 . 1 . 1 51 51 THR CG2 C 13 21.466 0.3 . 1 . . . . . 388 THR CG . 51420 1 410 . 1 . 1 51 51 THR N N 15 115.011 0.3 . 1 . . . . . 388 THR N . 51420 1 411 . 1 . 1 52 52 GLY H H 1 8.667 0.02 . 1 . . . . . 389 GLY H . 51420 1 412 . 1 . 1 52 52 GLY HA2 H 1 4.032 0.02 . 1 . . . . . 389 GLY HA2 . 51420 1 413 . 1 . 1 52 52 GLY HA3 H 1 4.016 0.02 . 1 . . . . . 389 GLY HA3 . 51420 1 414 . 1 . 1 52 52 GLY C C 13 174.695 0.3 . 1 . . . . . 389 GLY C . 51420 1 415 . 1 . 1 52 52 GLY CA C 13 45.455 0.3 . 1 . . . . . 389 GLY CA . 51420 1 416 . 1 . 1 52 52 GLY N N 15 111.71 0.3 . 1 . . . . . 389 GLY N . 51420 1 417 . 1 . 1 53 53 GLY H H 1 8.454 0.02 . 1 . . . . . 390 GLY H . 51420 1 418 . 1 . 1 53 53 GLY HA2 H 1 3.988 0.02 . 1 . . . . . 390 GLY HA2 . 51420 1 419 . 1 . 1 53 53 GLY HA3 H 1 3.988 0.02 . 1 . . . . . 390 GLY HA3 . 51420 1 420 . 1 . 1 53 53 GLY C C 13 174.235 0.3 . 1 . . . . . 390 GLY C . 51420 1 421 . 1 . 1 53 53 GLY CA C 13 45.152 0.3 . 1 . . . . . 390 GLY CA . 51420 1 422 . 1 . 1 53 53 GLY N N 15 109.048 0.3 . 1 . . . . . 390 GLY N . 51420 1 423 . 1 . 1 54 54 GLU H H 1 8.63 0.02 . 1 . . . . . 391 GLU H . 51420 1 424 . 1 . 1 54 54 GLU HA H 1 4.269 0.02 . 1 . . . . . 391 GLU HA . 51420 1 425 . 1 . 1 54 54 GLU HB2 H 1 1.911 0.02 . 1 . . . . . 391 GLU HB2 . 51420 1 426 . 1 . 1 54 54 GLU HB3 H 1 1.911 0.02 . 1 . . . . . 391 GLU HB3 . 51420 1 427 . 1 . 1 54 54 GLU HG2 H 1 2.13 0.02 . 1 . . . . . 391 GLU HG2 . 51420 1 428 . 1 . 1 54 54 GLU HG3 H 1 2.13 0.02 . 1 . . . . . 391 GLU HG3 . 51420 1 429 . 1 . 1 54 54 GLU C C 13 176.34 0.3 . 1 . . . . . 391 GLU C . 51420 1 430 . 1 . 1 54 54 GLU CA C 13 56.742 0.3 . 1 . . . . . 391 GLU CA . 51420 1 431 . 1 . 1 54 54 GLU CB C 13 29.901 0.3 . 1 . . . . . 391 GLU CB . 51420 1 432 . 1 . 1 54 54 GLU CG C 13 36.151 0.3 . 1 . . . . . 391 GLU CG . 51420 1 433 . 1 . 1 54 54 GLU N N 15 120.606 0.3 . 1 . . . . . 391 GLU N . 51420 1 434 . 1 . 1 55 55 ASN H H 1 8.69 0.02 . 1 . . . . . 392 ASN H . 51420 1 435 . 1 . 1 55 55 ASN HA H 1 4.713 0.02 . 1 . . . . . 392 ASN HA . 51420 1 436 . 1 . 1 55 55 ASN HB2 H 1 2.727 0.02 . 1 . . . . . 392 ASN HB2 . 51420 1 437 . 1 . 1 55 55 ASN HB3 H 1 2.727 0.02 . 1 . . . . . 392 ASN HB3 . 51420 1 438 . 1 . 1 55 55 ASN C C 13 174.981 0.3 . 1 . . . . . 392 ASN C . 51420 1 439 . 1 . 1 55 55 ASN CA C 13 53.288 0.3 . 1 . . . . . 392 ASN CA . 51420 1 440 . 1 . 1 55 55 ASN CB C 13 38.708 0.3 . 1 . . . . . 392 ASN CB . 51420 1 441 . 1 . 1 55 55 ASN N N 15 119.468 0.3 . 1 . . . . . 392 ASN N . 51420 1 442 . 1 . 1 56 56 ASN H H 1 8.547 0.02 . 1 . . . . . 393 ASN H . 51420 1 443 . 1 . 1 56 56 ASN HA H 1 4.752 0.02 . 1 . . . . . 393 ASN HA . 51420 1 444 . 1 . 1 56 56 ASN HB2 H 1 2.721 0.02 . 1 . . . . . 393 ASN HB2 . 51420 1 445 . 1 . 1 56 56 ASN HB3 H 1 2.721 0.02 . 1 . . . . . 393 ASN HB3 . 51420 1 446 . 1 . 1 56 56 ASN C C 13 175.005 0.3 . 1 . . . . . 393 ASN C . 51420 1 447 . 1 . 1 56 56 ASN CA C 13 53.305 0.3 . 1 . . . . . 393 ASN CA . 51420 1 448 . 1 . 1 56 56 ASN CB C 13 38.758 0.3 . 1 . . . . . 393 ASN CB . 51420 1 449 . 1 . 1 56 56 ASN N N 15 119.914 0.3 . 1 . . . . . 393 ASN N . 51420 1 450 . 1 . 1 57 57 ASP H H 1 8.487 0.02 . 1 . . . . . 394 ASP H . 51420 1 451 . 1 . 1 57 57 ASP HA H 1 4.565 0.02 . 1 . . . . . 394 ASP HA . 51420 1 452 . 1 . 1 57 57 ASP HB2 H 1 2.626 0.02 . 1 . . . . . 394 ASP HB2 . 51420 1 453 . 1 . 1 57 57 ASP HB3 H 1 2.626 0.02 . 1 . . . . . 394 ASP HB3 . 51420 1 454 . 1 . 1 57 57 ASP C C 13 176.31 0.3 . 1 . . . . . 394 ASP C . 51420 1 455 . 1 . 1 57 57 ASP CA C 13 54.719 0.3 . 1 . . . . . 394 ASP CA . 51420 1 456 . 1 . 1 57 57 ASP CB C 13 40.703 0.3 . 1 . . . . . 394 ASP CB . 51420 1 457 . 1 . 1 57 57 ASP N N 15 120.956 0.3 . 1 . . . . . 394 ASP N . 51420 1 458 . 1 . 1 58 58 LYS H H 1 8.325 0.02 . 1 . . . . . 395 LYS H . 51420 1 459 . 1 . 1 58 58 LYS HA H 1 4.283 0.02 . 1 . . . . . 395 LYS HA . 51420 1 460 . 1 . 1 58 58 LYS HB2 H 1 1.772 0.02 . 1 . . . . . 395 LYS HB2 . 51420 1 461 . 1 . 1 58 58 LYS HB3 H 1 1.772 0.02 . 1 . . . . . 395 LYS HB3 . 51420 1 462 . 1 . 1 58 58 LYS HG2 H 1 1.439 0.02 . 1 . . . . . 395 LYS HG2 . 51420 1 463 . 1 . 1 58 58 LYS HG3 H 1 1.439 0.02 . 1 . . . . . 395 LYS HG3 . 51420 1 464 . 1 . 1 58 58 LYS C C 13 176.728 0.3 . 1 . . . . . 395 LYS C . 51420 1 465 . 1 . 1 58 58 LYS CA C 13 56.176 0.3 . 1 . . . . . 395 LYS CA . 51420 1 466 . 1 . 1 58 58 LYS CB C 13 32.87 0.3 . 1 . . . . . 395 LYS CB . 51420 1 467 . 1 . 1 58 58 LYS N N 15 121.387 0.3 . 1 . . . . . 395 LYS N . 51420 1 468 . 1 . 1 59 59 GLU H H 1 8.547 0.02 . 1 . . . . . 396 GLU H . 51420 1 469 . 1 . 1 59 59 GLU HA H 1 4.221 0.02 . 1 . . . . . 396 GLU HA . 51420 1 470 . 1 . 1 59 59 GLU HB2 H 1 1.95 0.02 . 1 . . . . . 396 GLU HB2 . 51420 1 471 . 1 . 1 59 59 GLU HB3 H 1 1.95 0.02 . 1 . . . . . 396 GLU HB3 . 51420 1 472 . 1 . 1 59 59 GLU CA C 13 56.463 0.3 . 1 . . . . . 396 GLU CA . 51420 1 473 . 1 . 1 59 59 GLU CB C 13 30.103 0.3 . 1 . . . . . 396 GLU CB . 51420 1 474 . 1 . 1 59 59 GLU N N 15 122.375 0.3 . 1 . . . . . 396 GLU N . 51420 1 475 . 1 . 1 60 60 GLU H H 1 8.562 0.02 . 1 . . . . . 397 GLU H . 51420 1 476 . 1 . 1 60 60 GLU HA H 1 4.216 0.02 . 1 . . . . . 397 GLU HA . 51420 1 477 . 1 . 1 60 60 GLU HB2 H 1 1.955 0.02 . 1 . . . . . 397 GLU HB2 . 51420 1 478 . 1 . 1 60 60 GLU HB3 H 1 1.955 0.02 . 1 . . . . . 397 GLU HB3 . 51420 1 479 . 1 . 1 60 60 GLU CA C 13 56.687 0.3 . 1 . . . . . 397 GLU CA . 51420 1 480 . 1 . 1 60 60 GLU CB C 13 30.194 0.3 . 1 . . . . . 397 GLU CB . 51420 1 481 . 1 . 1 60 60 GLU N N 15 121.985 0.3 . 1 . . . . . 397 GLU N . 51420 1 482 . 1 . 1 61 61 GLU H H 1 8.544 0.02 . 1 . . . . . 398 GLU H . 51420 1 483 . 1 . 1 61 61 GLU HA H 1 4.206 0.02 . 1 . . . . . 398 GLU HA . 51420 1 484 . 1 . 1 61 61 GLU HB2 H 1 1.977 0.02 . 1 . . . . . 398 GLU HB2 . 51420 1 485 . 1 . 1 61 61 GLU HB3 H 1 1.977 0.02 . 1 . . . . . 398 GLU HB3 . 51420 1 486 . 1 . 1 61 61 GLU CA C 13 56.521 0.3 . 1 . . . . . 398 GLU CA . 51420 1 487 . 1 . 1 61 61 GLU CB C 13 30.217 0.3 . 1 . . . . . 398 GLU CB . 51420 1 488 . 1 . 1 61 61 GLU N N 15 122.457 0.3 . 1 . . . . . 398 GLU N . 51420 1 489 . 1 . 1 62 62 GLU H H 1 8.589 0.02 . 1 . . . . . 399 GLU H . 51420 1 490 . 1 . 1 62 62 GLU HA H 1 4.186 0.02 . 1 . . . . . 399 GLU HA . 51420 1 491 . 1 . 1 62 62 GLU HB2 H 1 1.979 0.02 . 1 . . . . . 399 GLU HB2 . 51420 1 492 . 1 . 1 62 62 GLU HB3 H 1 1.979 0.02 . 1 . . . . . 399 GLU HB3 . 51420 1 493 . 1 . 1 62 62 GLU CA C 13 56.81 0.3 . 1 . . . . . 399 GLU CA . 51420 1 494 . 1 . 1 62 62 GLU CB C 13 30.212 0.3 . 1 . . . . . 399 GLU CB . 51420 1 495 . 1 . 1 62 62 GLU N N 15 122.751 0.3 . 1 . . . . . 399 GLU N . 51420 1 496 . 1 . 1 63 63 LYS H H 1 8.528 0.02 . 1 . . . . . 400 LYS H . 51420 1 497 . 1 . 1 63 63 LYS HA H 1 4.289 0.02 . 1 . . . . . 400 LYS HA . 51420 1 498 . 1 . 1 63 63 LYS HB2 H 1 1.735 0.02 . 1 . . . . . 400 LYS HB2 . 51420 1 499 . 1 . 1 63 63 LYS HB3 H 1 1.735 0.02 . 1 . . . . . 400 LYS HB3 . 51420 1 500 . 1 . 1 63 63 LYS C C 13 176.662 0.3 . 1 . . . . . 400 LYS C . 51420 1 501 . 1 . 1 63 63 LYS CA C 13 56.154 0.3 . 1 . . . . . 400 LYS CA . 51420 1 502 . 1 . 1 63 63 LYS CB C 13 32.784 0.3 . 1 . . . . . 400 LYS CB . 51420 1 503 . 1 . 1 63 63 LYS N N 15 123.823 0.3 . 1 . . . . . 400 LYS N . 51420 1 504 . 1 . 1 64 64 LYS H H 1 8.54 0.02 . 1 . . . . . 401 LYS H . 51420 1 505 . 1 . 1 64 64 LYS HA H 1 4.307 0.02 . 1 . . . . . 401 LYS HA . 51420 1 506 . 1 . 1 64 64 LYS HB2 H 1 1.735 0.02 . 1 . . . . . 401 LYS HB2 . 51420 1 507 . 1 . 1 64 64 LYS HB3 H 1 1.735 0.02 . 1 . . . . . 401 LYS HB3 . 51420 1 508 . 1 . 1 64 64 LYS CA C 13 56.133 0.3 . 1 . . . . . 401 LYS CA . 51420 1 509 . 1 . 1 64 64 LYS CB C 13 32.917 0.3 . 1 . . . . . 401 LYS CB . 51420 1 510 . 1 . 1 64 64 LYS CG C 13 24.477 0.3 . 1 . . . . . 401 LYS CG . 51420 1 511 . 1 . 1 64 64 LYS N N 15 123.812 0.3 . 1 . . . . . 401 LYS N . 51420 1 512 . 1 . 1 65 65 ASP H H 1 8.569 0.02 . 1 . . . . . 402 ASP H . 51420 1 513 . 1 . 1 65 65 ASP HA H 1 4.603 0.02 . 1 . . . . . 402 ASP HA . 51420 1 514 . 1 . 1 65 65 ASP HB2 H 1 2.672 0.02 . 1 . . . . . 402 ASP HB2 . 51420 1 515 . 1 . 1 65 65 ASP HB3 H 1 2.672 0.02 . 1 . . . . . 402 ASP HB3 . 51420 1 516 . 1 . 1 65 65 ASP C C 13 176.515 0.3 . 1 . . . . . 402 ASP C . 51420 1 517 . 1 . 1 65 65 ASP CA C 13 54.442 0.3 . 1 . . . . . 402 ASP CA . 51420 1 518 . 1 . 1 65 65 ASP CB C 13 40.846 0.3 . 1 . . . . . 402 ASP CB . 51420 1 519 . 1 . 1 65 65 ASP N N 15 121.949 0.3 . 1 . . . . . 402 ASP N . 51420 1 520 . 1 . 1 66 66 GLU H H 1 8.7 0.02 . 1 . . . . . 403 GLU H . 51420 1 521 . 1 . 1 66 66 GLU HA H 1 4.378 0.02 . 1 . . . . . 403 GLU HA . 51420 1 522 . 1 . 1 66 66 GLU HB2 H 1 2.002 0.02 . 1 . . . . . 403 GLU HB2 . 51420 1 523 . 1 . 1 66 66 GLU HB3 H 1 2.002 0.02 . 1 . . . . . 403 GLU HB3 . 51420 1 524 . 1 . 1 66 66 GLU HG2 H 1 2.164 0.02 . 1 . . . . . 403 GLU HG2 . 51420 1 525 . 1 . 1 66 66 GLU HG3 H 1 2.164 0.02 . 1 . . . . . 403 GLU HG3 . 51420 1 526 . 1 . 1 66 66 GLU C C 13 176.993 0.3 . 1 . . . . . 403 GLU C . 51420 1 527 . 1 . 1 66 66 GLU CA C 13 56.787 0.3 . 1 . . . . . 403 GLU CA . 51420 1 528 . 1 . 1 66 66 GLU CB C 13 29.922 0.3 . 1 . . . . . 403 GLU CB . 51420 1 529 . 1 . 1 66 66 GLU CG C 13 36.139 0.3 . 1 . . . . . 403 GLU CG . 51420 1 530 . 1 . 1 66 66 GLU N N 15 122.56 0.3 . 1 . . . . . 403 GLU N . 51420 1 531 . 1 . 1 67 67 THR H H 1 8.46 0.02 . 1 . . . . . 404 THR H . 51420 1 532 . 1 . 1 67 67 THR HA H 1 4.353 0.02 . 1 . . . . . 404 THR HA . 51420 1 533 . 1 . 1 67 67 THR HG21 H 1 1.18 0.02 . 1 . . . . . 404 THR HG2 . 51420 1 534 . 1 . 1 67 67 THR HG22 H 1 1.18 0.02 . 1 . . . . . 404 THR HG2 . 51420 1 535 . 1 . 1 67 67 THR HG23 H 1 1.18 0.02 . 1 . . . . . 404 THR HG2 . 51420 1 536 . 1 . 1 67 67 THR C C 13 175.009 0.3 . 1 . . . . . 404 THR C . 51420 1 537 . 1 . 1 67 67 THR CA C 13 62.505 0.3 . 1 . . . . . 404 THR CA . 51420 1 538 . 1 . 1 67 67 THR CB C 13 69.591 0.3 . 1 . . . . . 404 THR CB . 51420 1 539 . 1 . 1 67 67 THR CG2 C 13 21.574 0.3 . 1 . . . . . 404 THR CG . 51420 1 540 . 1 . 1 67 67 THR N N 15 114.979 0.3 . 1 . . . . . 404 THR N . 51420 1 541 . 1 . 1 68 68 SER H H 1 8.468 0.02 . 1 . . . . . 405 SER H . 51420 1 542 . 1 . 1 68 68 SER HA H 1 4.461 0.02 . 1 . . . . . 405 SER HA . 51420 1 543 . 1 . 1 68 68 SER HB2 H 1 3.902 0.02 . 1 . . . . . 405 SER HB2 . 51420 1 544 . 1 . 1 68 68 SER HB3 H 1 3.902 0.02 . 1 . . . . . 405 SER HB3 . 51420 1 545 . 1 . 1 68 68 SER CA C 13 58.587 0.3 . 1 . . . . . 405 SER CA . 51420 1 546 . 1 . 1 68 68 SER CB C 13 63.63 0.3 . 1 . . . . . 405 SER CB . 51420 1 547 . 1 . 1 68 68 SER N N 15 118.296 0.3 . 1 . . . . . 405 SER N . 51420 1 548 . 1 . 1 69 69 SER H H 1 8.552 0.02 . 1 . . . . . 406 SER H . 51420 1 549 . 1 . 1 69 69 SER HA H 1 4.491 0.02 . 1 . . . . . 406 SER HA . 51420 1 550 . 1 . 1 69 69 SER HB2 H 1 3.903 0.02 . 1 . . . . . 406 SER HB2 . 51420 1 551 . 1 . 1 69 69 SER HB3 H 1 3.903 0.02 . 1 . . . . . 406 SER HB3 . 51420 1 552 . 1 . 1 69 69 SER C C 13 175.004 0.3 . 1 . . . . . 406 SER C . 51420 1 553 . 1 . 1 69 69 SER CA C 13 58.632 0.3 . 1 . . . . . 406 SER CA . 51420 1 554 . 1 . 1 69 69 SER CB C 13 63.581 0.3 . 1 . . . . . 406 SER CB . 51420 1 555 . 1 . 1 69 69 SER N N 15 118.157 0.3 . 1 . . . . . 406 SER N . 51420 1 556 . 1 . 1 70 70 SER H H 1 8.475 0.02 . 1 . . . . . 407 SER H . 51420 1 557 . 1 . 1 70 70 SER HA H 1 4.46 0.02 . 1 . . . . . 407 SER HA . 51420 1 558 . 1 . 1 70 70 SER HB2 H 1 3.886 0.02 . 1 . . . . . 407 SER HB2 . 51420 1 559 . 1 . 1 70 70 SER HB3 H 1 3.886 0.02 . 1 . . . . . 407 SER HB3 . 51420 1 560 . 1 . 1 70 70 SER C C 13 174.948 0.3 . 1 . . . . . 407 SER C . 51420 1 561 . 1 . 1 70 70 SER CA C 13 58.658 0.3 . 1 . . . . . 407 SER CA . 51420 1 562 . 1 . 1 70 70 SER CB C 13 63.565 0.3 . 1 . . . . . 407 SER CB . 51420 1 563 . 1 . 1 70 70 SER N N 15 118.052 0.3 . 1 . . . . . 407 SER N . 51420 1 564 . 1 . 1 71 71 SER H H 1 8.469 0.02 . 1 . . . . . 408 SER H . 51420 1 565 . 1 . 1 71 71 SER HA H 1 4.449 0.02 . 1 . . . . . 408 SER HA . 51420 1 566 . 1 . 1 71 71 SER HB2 H 1 3.859 0.02 . 1 . . . . . 408 SER HB2 . 51420 1 567 . 1 . 1 71 71 SER HB3 H 1 3.859 0.02 . 1 . . . . . 408 SER HB3 . 51420 1 568 . 1 . 1 71 71 SER C C 13 175.111 0.3 . 1 . . . . . 408 SER C . 51420 1 569 . 1 . 1 71 71 SER CA C 13 58.958 0.3 . 1 . . . . . 408 SER CA . 51420 1 570 . 1 . 1 71 71 SER CB C 13 63.552 0.3 . 1 . . . . . 408 SER CB . 51420 1 571 . 1 . 1 71 71 SER N N 15 118.363 0.3 . 1 . . . . . 408 SER N . 51420 1 572 . 1 . 1 72 72 GLU H H 1 8.505 0.02 . 1 . . . . . 409 GLU H . 51420 1 573 . 1 . 1 72 72 GLU HA H 1 4.25 0.02 . 1 . . . . . 409 GLU HA . 51420 1 574 . 1 . 1 72 72 GLU HB2 H 1 1.992 0.02 . 1 . . . . . 409 GLU HB2 . 51420 1 575 . 1 . 1 72 72 GLU HB3 H 1 1.992 0.02 . 1 . . . . . 409 GLU HB3 . 51420 1 576 . 1 . 1 72 72 GLU C C 13 176.951 0.3 . 1 . . . . . 409 GLU C . 51420 1 577 . 1 . 1 72 72 GLU CA C 13 57.115 0.3 . 1 . . . . . 409 GLU CA . 51420 1 578 . 1 . 1 72 72 GLU CB C 13 29.813 0.3 . 1 . . . . . 409 GLU CB . 51420 1 579 . 1 . 1 72 72 GLU N N 15 123 0.3 . 1 . . . . . 409 GLU N . 51420 1 580 . 1 . 1 73 73 ALA H H 1 8.374 0.02 . 1 . . . . . 410 ALA H . 51420 1 581 . 1 . 1 73 73 ALA HA H 1 4.218 0.02 . 1 . . . . . 410 ALA HA . 51420 1 582 . 1 . 1 73 73 ALA HB1 H 1 1.349 0.02 . 1 . . . . . 410 ALA HB . 51420 1 583 . 1 . 1 73 73 ALA HB2 H 1 1.349 0.02 . 1 . . . . . 410 ALA HB . 51420 1 584 . 1 . 1 73 73 ALA HB3 H 1 1.349 0.02 . 1 . . . . . 410 ALA HB . 51420 1 585 . 1 . 1 73 73 ALA C C 13 178.254 0.3 . 1 . . . . . 410 ALA C . 51420 1 586 . 1 . 1 73 73 ALA CA C 13 53.399 0.3 . 1 . . . . . 410 ALA CA . 51420 1 587 . 1 . 1 73 73 ALA CB C 13 18.733 0.3 . 1 . . . . . 410 ALA CB . 51420 1 588 . 1 . 1 73 73 ALA N N 15 124.241 0.3 . 1 . . . . . 410 ALA N . 51420 1 589 . 1 . 1 74 74 ASN H H 1 8.401 0.02 . 1 . . . . . 411 ASN H . 51420 1 590 . 1 . 1 74 74 ASN HA H 1 4.708 0.02 . 1 . . . . . 411 ASN HA . 51420 1 591 . 1 . 1 74 74 ASN HB2 H 1 2.821 0.02 . 1 . . . . . 411 ASN HB2 . 51420 1 592 . 1 . 1 74 74 ASN HB3 H 1 2.821 0.02 . 1 . . . . . 411 ASN HB3 . 51420 1 593 . 1 . 1 74 74 ASN C C 13 175.787 0.3 . 1 . . . . . 411 ASN C . 51420 1 594 . 1 . 1 74 74 ASN CA C 13 53.593 0.3 . 1 . . . . . 411 ASN CA . 51420 1 595 . 1 . 1 74 74 ASN CB C 13 38.606 0.3 . 1 . . . . . 411 ASN CB . 51420 1 596 . 1 . 1 74 74 ASN N N 15 117.04 0.3 . 1 . . . . . 411 ASN N . 51420 1 597 . 1 . 1 75 75 SER H H 1 8.259 0.02 . 1 . . . . . 412 SER H . 51420 1 598 . 1 . 1 75 75 SER HA H 1 4.413 0.02 . 1 . . . . . 412 SER HA . 51420 1 599 . 1 . 1 75 75 SER HB2 H 1 3.853 0.02 . 1 . . . . . 412 SER HB2 . 51420 1 600 . 1 . 1 75 75 SER HB3 H 1 3.853 0.02 . 1 . . . . . 412 SER HB3 . 51420 1 601 . 1 . 1 75 75 SER C C 13 174.805 0.3 . 1 . . . . . 412 SER C . 51420 1 602 . 1 . 1 75 75 SER CA C 13 58.987 0.3 . 1 . . . . . 412 SER CA . 51420 1 603 . 1 . 1 75 75 SER CB C 13 63.497 0.3 . 1 . . . . . 412 SER CB . 51420 1 604 . 1 . 1 75 75 SER N N 15 116.036 0.3 . 1 . . . . . 412 SER N . 51420 1 605 . 1 . 1 76 76 ARG H H 1 8.339 0.02 . 1 . . . . . 413 ARG H . 51420 1 606 . 1 . 1 76 76 ARG HA H 1 4.37 0.02 . 1 . . . . . 413 ARG HA . 51420 1 607 . 1 . 1 76 76 ARG HB2 H 1 1.778 0.02 . 1 . . . . . 413 ARG HB2 . 51420 1 608 . 1 . 1 76 76 ARG HB3 H 1 1.778 0.02 . 1 . . . . . 413 ARG HB3 . 51420 1 609 . 1 . 1 76 76 ARG C C 13 176.366 0.3 . 1 . . . . . 413 ARG C . 51420 1 610 . 1 . 1 76 76 ARG CA C 13 56.394 0.3 . 1 . . . . . 413 ARG CA . 51420 1 611 . 1 . 1 76 76 ARG CB C 13 30.388 0.3 . 1 . . . . . 413 ARG CB . 51420 1 612 . 1 . 1 76 76 ARG N N 15 122.383 0.3 . 1 . . . . . 413 ARG N . 51420 1 613 . 1 . 1 77 77 CYS H H 1 8.336 0.02 . 1 . . . . . 414 CYS H . 51420 1 614 . 1 . 1 77 77 CYS HA H 1 4.458 0.02 . 1 . . . . . 414 CYS HA . 51420 1 615 . 1 . 1 77 77 CYS C C 13 174.653 0.3 . 1 . . . . . 414 CYS C . 51420 1 616 . 1 . 1 77 77 CYS CA C 13 58.71 0.3 . 1 . . . . . 414 CYS CA . 51420 1 617 . 1 . 1 77 77 CYS N N 15 120.17 0.3 . 1 . . . . . 414 CYS N . 51420 1 618 . 1 . 1 78 78 GLN H H 1 8.651 0.02 . 1 . . . . . 415 GLN H . 51420 1 619 . 1 . 1 78 78 GLN HA H 1 4.395 0.02 . 1 . . . . . 415 GLN HA . 51420 1 620 . 1 . 1 78 78 GLN C C 13 175.755 0.3 . 1 . . . . . 415 GLN C . 51420 1 621 . 1 . 1 78 78 GLN CA C 13 55.759 0.3 . 1 . . . . . 415 GLN CA . 51420 1 622 . 1 . 1 78 78 GLN CB C 13 29.284 0.3 . 1 . . . . . 415 GLN CB . 51420 1 623 . 1 . 1 78 78 GLN N N 15 123.361 0.3 . 1 . . . . . 415 GLN N . 51420 1 624 . 1 . 1 79 79 THR H H 1 8.416 0.02 . 1 . . . . . 416 THR H . 51420 1 625 . 1 . 1 79 79 THR HA H 1 4.56 0.02 . 1 . . . . . 416 THR HA . 51420 1 626 . 1 . 1 79 79 THR HB H 1 4.094 0.02 . 1 . . . . . 416 THR HB . 51420 1 627 . 1 . 1 79 79 THR HG21 H 1 1.226 0.02 . 1 . . . . . 416 THR HG2 . 51420 1 628 . 1 . 1 79 79 THR HG22 H 1 1.226 0.02 . 1 . . . . . 416 THR HG2 . 51420 1 629 . 1 . 1 79 79 THR HG23 H 1 1.226 0.02 . 1 . . . . . 416 THR HG2 . 51420 1 630 . 1 . 1 79 79 THR C C 13 172.617 0.3 . 1 . . . . . 416 THR C . 51420 1 631 . 1 . 1 79 79 THR CA C 13 60.141 0.3 . 1 . . . . . 416 THR CA . 51420 1 632 . 1 . 1 79 79 THR CB C 13 69.501 0.3 . 1 . . . . . 416 THR CB . 51420 1 633 . 1 . 1 79 79 THR N N 15 119.269 0.3 . 1 . . . . . 416 THR N . 51420 1 634 . 1 . 1 80 80 PRO HA H 1 4.424 0.02 . 1 . . . . . 417 PRO HA . 51420 1 635 . 1 . 1 80 80 PRO C C 13 176.769 0.3 . 1 . . . . . 417 PRO C . 51420 1 636 . 1 . 1 80 80 PRO CA C 13 63.16 0.3 . 1 . . . . . 417 PRO CA . 51420 1 637 . 1 . 1 80 80 PRO CB C 13 32.103 0.3 . 1 . . . . . 417 PRO CB . 51420 1 638 . 1 . 1 80 80 PRO CG C 13 27.289 0.3 . 1 . . . . . 417 PRO CG . 51420 1 639 . 1 . 1 80 80 PRO N N 15 139.223 0.3 . 1 . . . . . 417 PRO N . 51420 1 640 . 1 . 1 81 81 ILE H H 1 8.422 0.02 . 1 . . . . . 418 ILE H . 51420 1 641 . 1 . 1 81 81 ILE HA H 1 4.069 0.02 . 1 . . . . . 418 ILE HA . 51420 1 642 . 1 . 1 81 81 ILE HB H 1 1.808 0.02 . 1 . . . . . 418 ILE HB . 51420 1 643 . 1 . 1 81 81 ILE HG21 H 1 0.89 0.02 . 1 . . . . . 418 ILE HG2 . 51420 1 644 . 1 . 1 81 81 ILE HG22 H 1 0.89 0.02 . 1 . . . . . 418 ILE HG2 . 51420 1 645 . 1 . 1 81 81 ILE HG23 H 1 0.89 0.02 . 1 . . . . . 418 ILE HG2 . 51420 1 646 . 1 . 1 81 81 ILE C C 13 176.22 0.3 . 1 . . . . . 418 ILE C . 51420 1 647 . 1 . 1 81 81 ILE CA C 13 61.22 0.3 . 1 . . . . . 418 ILE CA . 51420 1 648 . 1 . 1 81 81 ILE CB C 13 38.539 0.3 . 1 . . . . . 418 ILE CB . 51420 1 649 . 1 . 1 81 81 ILE CG1 C 13 27.444 0.3 . 1 . . . . . 418 ILE CG1 . 51420 1 650 . 1 . 1 81 81 ILE CG2 C 13 17.387 0.3 . 1 . . . . . 418 ILE CG2 . 51420 1 651 . 1 . 1 81 81 ILE CD1 C 13 12.742 0.3 . 1 . . . . . 418 ILE CD1 . 51420 1 652 . 1 . 1 81 81 ILE N N 15 122.284 0.3 . 1 . . . . . 418 ILE N . 51420 1 653 . 1 . 1 82 82 LYS H H 1 8.538 0.02 . 1 . . . . . 419 LYS H . 51420 1 654 . 1 . 1 82 82 LYS HA H 1 4.316 0.02 . 1 . . . . . 419 LYS HA . 51420 1 655 . 1 . 1 82 82 LYS HB2 H 1 1.735 0.02 . 1 . . . . . 419 LYS HB2 . 51420 1 656 . 1 . 1 82 82 LYS HB3 H 1 1.735 0.02 . 1 . . . . . 419 LYS HB3 . 51420 1 657 . 1 . 1 82 82 LYS HG2 H 1 1.441 0.02 . 1 . . . . . 419 LYS HG2 . 51420 1 658 . 1 . 1 82 82 LYS HG3 H 1 1.441 0.02 . 1 . . . . . 419 LYS HG3 . 51420 1 659 . 1 . 1 82 82 LYS C C 13 176.198 0.3 . 1 . . . . . 419 LYS C . 51420 1 660 . 1 . 1 82 82 LYS CA C 13 55.965 0.3 . 1 . . . . . 419 LYS CA . 51420 1 661 . 1 . 1 82 82 LYS CB C 13 32.899 0.3 . 1 . . . . . 419 LYS CB . 51420 1 662 . 1 . 1 82 82 LYS CG C 13 24.466 0.3 . 1 . . . . . 419 LYS CG . 51420 1 663 . 1 . 1 82 82 LYS CD C 13 29.075 0.3 . 1 . . . . . 419 LYS CD . 51420 1 664 . 1 . 1 82 82 LYS N N 15 126.559 0.3 . 1 . . . . . 419 LYS N . 51420 1 665 . 1 . 1 83 83 MET H H 1 8.575 0.02 . 1 . . . . . 420 MET H . 51420 1 666 . 1 . 1 83 83 MET HA H 1 4.45 0.02 . 1 . . . . . 420 MET HA . 51420 1 667 . 1 . 1 83 83 MET HB2 H 1 1.975 0.02 . 1 . . . . . 420 MET HB2 . 51420 1 668 . 1 . 1 83 83 MET HB3 H 1 1.975 0.02 . 1 . . . . . 420 MET HB3 . 51420 1 669 . 1 . 1 83 83 MET HG2 H 1 2.327 0.02 . 1 . . . . . 420 MET HG2 . 51420 1 670 . 1 . 1 83 83 MET HG3 H 1 2.327 0.02 . 1 . . . . . 420 MET HG3 . 51420 1 671 . 1 . 1 83 83 MET C C 13 175.945 0.3 . 1 . . . . . 420 MET C . 51420 1 672 . 1 . 1 83 83 MET CA C 13 55.126 0.3 . 1 . . . . . 420 MET CA . 51420 1 673 . 1 . 1 83 83 MET CB C 13 32.884 0.3 . 1 . . . . . 420 MET CB . 51420 1 674 . 1 . 1 83 83 MET N N 15 123.231 0.3 . 1 . . . . . 420 MET N . 51420 1 675 . 1 . 1 84 84 LYS H H 1 8.563 0.02 . 1 . . . . . 421 LYS H . 51420 1 676 . 1 . 1 84 84 LYS HA H 1 4.578 0.02 . 1 . . . . . 421 LYS HA . 51420 1 677 . 1 . 1 84 84 LYS HB2 H 1 1.735 0.02 . 1 . . . . . 421 LYS HB2 . 51420 1 678 . 1 . 1 84 84 LYS HB3 H 1 1.735 0.02 . 1 . . . . . 421 LYS HB3 . 51420 1 679 . 1 . 1 84 84 LYS HG2 H 1 1.482 0.02 . 1 . . . . . 421 LYS HG2 . 51420 1 680 . 1 . 1 84 84 LYS HG3 H 1 1.482 0.02 . 1 . . . . . 421 LYS HG3 . 51420 1 681 . 1 . 1 84 84 LYS C C 13 174.339 0.3 . 1 . . . . . 421 LYS C . 51420 1 682 . 1 . 1 84 84 LYS CA C 13 54.37 0.3 . 1 . . . . . 421 LYS CA . 51420 1 683 . 1 . 1 84 84 LYS CB C 13 32.404 0.3 . 1 . . . . . 421 LYS CB . 51420 1 684 . 1 . 1 84 84 LYS N N 15 124.935 0.3 . 1 . . . . . 421 LYS N . 51420 1 685 . 1 . 1 85 85 PRO HA H 1 4.402 0.02 . 1 . . . . . 422 PRO HA . 51420 1 686 . 1 . 1 85 85 PRO C C 13 176.552 0.3 . 1 . . . . . 422 PRO C . 51420 1 687 . 1 . 1 85 85 PRO CA C 13 63.101 0.3 . 1 . . . . . 422 PRO CA . 51420 1 688 . 1 . 1 85 85 PRO N N 15 136.787 0.3 . 1 . . . . . 422 PRO N . 51420 1 689 . 1 . 1 86 86 ASN HA H 1 4.664 0.02 . 1 . . . . . 423 ASN HA . 51420 1 690 . 1 . 1 86 86 ASN C C 13 174.997 0.3 . 1 . . . . . 423 ASN C . 51420 1 691 . 1 . 1 86 86 ASN CA C 13 53.363 0.3 . 1 . . . . . 423 ASN CA . 51420 1 692 . 1 . 1 86 86 ASN CB C 13 38.642 0.3 . 1 . . . . . 423 ASN CB . 51420 1 693 . 1 . 1 86 86 ASN N N 15 119.324 0.3 . 1 . . . . . 423 ASN N . 51420 1 694 . 1 . 1 87 87 ILE H H 1 8.234 0.02 . 1 . . . . . 424 ILE H . 51420 1 695 . 1 . 1 87 87 ILE HA H 1 4.205 0.02 . 1 . . . . . 424 ILE HA . 51420 1 696 . 1 . 1 87 87 ILE HB H 1 1.808 0.02 . 1 . . . . . 424 ILE HB . 51420 1 697 . 1 . 1 87 87 ILE HG21 H 1 0.871 0.02 . 1 . . . . . 424 ILE HG2 . 51420 1 698 . 1 . 1 87 87 ILE HG22 H 1 0.871 0.02 . 1 . . . . . 424 ILE HG2 . 51420 1 699 . 1 . 1 87 87 ILE HG23 H 1 0.871 0.02 . 1 . . . . . 424 ILE HG2 . 51420 1 700 . 1 . 1 87 87 ILE C C 13 175.967 0.3 . 1 . . . . . 424 ILE C . 51420 1 701 . 1 . 1 87 87 ILE CA C 13 60.635 0.3 . 1 . . . . . 424 ILE CA . 51420 1 702 . 1 . 1 87 87 ILE CB C 13 38.662 0.3 . 1 . . . . . 424 ILE CB . 51420 1 703 . 1 . 1 87 87 ILE CG1 C 13 27.326 0.3 . 1 . . . . . 424 ILE CG1 . 51420 1 704 . 1 . 1 87 87 ILE CG2 C 13 17.275 0.3 . 1 . . . . . 424 ILE CG2 . 51420 1 705 . 1 . 1 87 87 ILE CD1 C 13 12.823 0.3 . 1 . . . . . 424 ILE CD . 51420 1 706 . 1 . 1 87 87 ILE N N 15 121.337 0.3 . 1 . . . . . 424 ILE N . 51420 1 707 . 1 . 1 88 88 GLU H H 1 8.625 0.02 . 1 . . . . . 425 GLU H . 51420 1 708 . 1 . 1 88 88 GLU HA H 1 4.534 0.02 . 1 . . . . . 425 GLU HA . 51420 1 709 . 1 . 1 88 88 GLU HB2 H 1 1.845 0.02 . 1 . . . . . 425 GLU HB2 . 51420 1 710 . 1 . 1 88 88 GLU HB3 H 1 1.845 0.02 . 1 . . . . . 425 GLU HB3 . 51420 1 711 . 1 . 1 88 88 GLU HG2 H 1 2.231 0.02 . 1 . . . . . 425 GLU HG2 . 51420 1 712 . 1 . 1 88 88 GLU HG3 H 1 2.231 0.02 . 1 . . . . . 425 GLU HG3 . 51420 1 713 . 1 . 1 88 88 GLU C C 13 173.733 0.3 . 1 . . . . . 425 GLU C . 51420 1 714 . 1 . 1 88 88 GLU CA C 13 54.226 0.3 . 1 . . . . . 425 GLU CA . 51420 1 715 . 1 . 1 88 88 GLU CB C 13 29.275 0.3 . 1 . . . . . 425 GLU CB . 51420 1 716 . 1 . 1 88 88 GLU N N 15 127.326 0.3 . 1 . . . . . 425 GLU N . 51420 1 717 . 1 . 1 89 89 PRO HA H 1 4.668 0.02 . 1 . . . . . 426 PRO HA . 51420 1 718 . 1 . 1 89 89 PRO C C 13 174.667 0.3 . 1 . . . . . 426 PRO C . 51420 1 719 . 1 . 1 89 89 PRO CA C 13 61.418 0.3 . 1 . . . . . 426 PRO CA . 51420 1 720 . 1 . 1 89 89 PRO N N 15 138.177 0.3 . 1 . . . . . 426 PRO N . 51420 1 721 . 1 . 1 90 90 PRO HA H 1 4.413 0.02 . 1 . . . . . 427 PRO HA . 51420 1 722 . 1 . 1 90 90 PRO C C 13 176.88 0.3 . 1 . . . . . 427 PRO C . 51420 1 723 . 1 . 1 90 90 PRO CA C 13 62.87 0.3 . 1 . . . . . 427 PRO CA . 51420 1 724 . 1 . 1 90 90 PRO CB C 13 31.926 0.3 . 1 . . . . . 427 PRO CB . 51420 1 725 . 1 . 1 90 90 PRO CG C 13 27.233 0.3 . 1 . . . . . 427 PRO CG . 51420 1 726 . 1 . 1 90 90 PRO CD C 13 50.388 0.3 . 1 . . . . . 427 PRO CD . 51420 1 727 . 1 . 1 90 90 PRO N N 15 135.359 0.3 . 1 . . . . . 427 PRO N . 51420 1 728 . 1 . 1 91 91 GLU H H 1 8.682 0.02 . 1 . . . . . 428 GLU H . 51420 1 729 . 1 . 1 91 91 GLU HA H 1 4.138 0.02 . 1 . . . . . 428 GLU HA . 51420 1 730 . 1 . 1 91 91 GLU HB2 H 1 1.937 0.02 . 1 . . . . . 428 GLU HB2 . 51420 1 731 . 1 . 1 91 91 GLU HB3 H 1 1.937 0.02 . 1 . . . . . 428 GLU HB3 . 51420 1 732 . 1 . 1 91 91 GLU HG2 H 1 2.176 0.02 . 1 . . . . . 428 GLU HG2 . 51420 1 733 . 1 . 1 91 91 GLU HG3 H 1 2.176 0.02 . 1 . . . . . 428 GLU HG3 . 51420 1 734 . 1 . 1 91 91 GLU C C 13 176.212 0.3 . 1 . . . . . 428 GLU C . 51420 1 735 . 1 . 1 91 91 GLU CA C 13 56.675 0.3 . 1 . . . . . 428 GLU CA . 51420 1 736 . 1 . 1 91 91 GLU CB C 13 30.144 0.3 . 1 . . . . . 428 GLU CB . 51420 1 737 . 1 . 1 91 91 GLU CG C 13 36.128 0.3 . 1 . . . . . 428 GLU CG . 51420 1 738 . 1 . 1 91 91 GLU N N 15 120.833 0.3 . 1 . . . . . 428 GLU N . 51420 1 739 . 1 . 1 92 92 ASN H H 1 8.59 0.02 . 1 . . . . . 429 ASN H . 51420 1 740 . 1 . 1 92 92 ASN HA H 1 4.684 0.02 . 1 . . . . . 429 ASN HA . 51420 1 741 . 1 . 1 92 92 ASN HB2 H 1 2.727 0.02 . 1 . . . . . 429 ASN HB2 . 51420 1 742 . 1 . 1 92 92 ASN HB3 H 1 2.727 0.02 . 1 . . . . . 429 ASN HB3 . 51420 1 743 . 1 . 1 92 92 ASN C C 13 175.149 0.3 . 1 . . . . . 429 ASN C . 51420 1 744 . 1 . 1 92 92 ASN CA C 13 53.173 0.3 . 1 . . . . . 429 ASN CA . 51420 1 745 . 1 . 1 92 92 ASN CB C 13 38.611 0.3 . 1 . . . . . 429 ASN CB . 51420 1 746 . 1 . 1 92 92 ASN N N 15 120.155 0.3 . 1 . . . . . 429 ASN N . 51420 1 747 . 1 . 1 93 93 VAL H H 1 8.227 0.02 . 1 . . . . . 430 VAL H . 51420 1 748 . 1 . 1 93 93 VAL HA H 1 4.089 0.02 . 1 . . . . . 430 VAL HA . 51420 1 749 . 1 . 1 93 93 VAL HB H 1 1.937 0.02 . 1 . . . . . 430 VAL HB . 51420 1 750 . 1 . 1 93 93 VAL HG11 H 1 0.816 0.02 . 1 . . . . . 430 VAL HG1 . 51420 1 751 . 1 . 1 93 93 VAL HG12 H 1 0.816 0.02 . 1 . . . . . 430 VAL HG1 . 51420 1 752 . 1 . 1 93 93 VAL HG13 H 1 0.816 0.02 . 1 . . . . . 430 VAL HG1 . 51420 1 753 . 1 . 1 93 93 VAL HG21 H 1 0.816 0.02 . 1 . . . . . 430 VAL HG2 . 51420 1 754 . 1 . 1 93 93 VAL HG22 H 1 0.816 0.02 . 1 . . . . . 430 VAL HG2 . 51420 1 755 . 1 . 1 93 93 VAL HG23 H 1 0.816 0.02 . 1 . . . . . 430 VAL HG2 . 51420 1 756 . 1 . 1 93 93 VAL C C 13 176.102 0.3 . 1 . . . . . 430 VAL C . 51420 1 757 . 1 . 1 93 93 VAL CA C 13 62.347 0.3 . 1 . . . . . 430 VAL CA . 51420 1 758 . 1 . 1 93 93 VAL CB C 13 32.547 0.3 . 1 . . . . . 430 VAL CB . 51420 1 759 . 1 . 1 93 93 VAL CG1 C 13 20.701 0.3 . 1 . . . . . 430 VAL CG1 . 51420 1 760 . 1 . 1 93 93 VAL CG2 C 13 20.701 0.3 . 1 . . . . . 430 VAL CG2 . 51420 1 761 . 1 . 1 93 93 VAL N N 15 120.928 0.3 . 1 . . . . . 430 VAL N . 51420 1 762 . 1 . 1 94 94 GLU H H 1 8.568 0.02 . 1 . . . . . 431 GLU H . 51420 1 763 . 1 . 1 94 94 GLU HA H 1 4.257 0.02 . 1 . . . . . 431 GLU HA . 51420 1 764 . 1 . 1 94 94 GLU HB2 H 1 1.919 0.02 . 1 . . . . . 431 GLU HB2 . 51420 1 765 . 1 . 1 94 94 GLU HB3 H 1 1.919 0.02 . 1 . . . . . 431 GLU HB3 . 51420 1 766 . 1 . 1 94 94 GLU C C 13 176.259 0.3 . 1 . . . . . 431 GLU C . 51420 1 767 . 1 . 1 94 94 GLU CA C 13 56.571 0.3 . 1 . . . . . 431 GLU CA . 51420 1 768 . 1 . 1 94 94 GLU CB C 13 29.899 0.3 . 1 . . . . . 431 GLU CB . 51420 1 769 . 1 . 1 94 94 GLU N N 15 124.56 0.3 . 1 . . . . . 431 GLU N . 51420 1 770 . 1 . 1 95 95 TRP H H 1 8.412 0.02 . 1 . . . . . 432 TRP H . 51420 1 771 . 1 . 1 95 95 TRP HA H 1 4.67 0.02 . 1 . . . . . 432 TRP HA . 51420 1 772 . 1 . 1 95 95 TRP HB2 H 1 3.206 0.02 . 1 . . . . . 432 TRP HB2 . 51420 1 773 . 1 . 1 95 95 TRP HB3 H 1 3.206 0.02 . 1 . . . . . 432 TRP HB3 . 51420 1 774 . 1 . 1 95 95 TRP C C 13 176.414 0.3 . 1 . . . . . 432 TRP C . 51420 1 775 . 1 . 1 95 95 TRP CA C 13 57.424 0.3 . 1 . . . . . 432 TRP CA . 51420 1 776 . 1 . 1 95 95 TRP CB C 13 29.353 0.3 . 1 . . . . . 432 TRP CB . 51420 1 777 . 1 . 1 95 95 TRP N N 15 123.151 0.3 . 1 . . . . . 432 TRP N . 51420 1 778 . 1 . 1 96 96 SER H H 1 8.24 0.02 . 1 . . . . . 433 SER H . 51420 1 779 . 1 . 1 96 96 SER HA H 1 4.275 0.02 . 1 . . . . . 433 SER HA . 51420 1 780 . 1 . 1 96 96 SER HB2 H 1 3.684 0.02 . 1 . . . . . 433 SER HB2 . 51420 1 781 . 1 . 1 96 96 SER HB3 H 1 3.684 0.02 . 1 . . . . . 433 SER HB3 . 51420 1 782 . 1 . 1 96 96 SER C C 13 174.692 0.3 . 1 . . . . . 433 SER C . 51420 1 783 . 1 . 1 96 96 SER CA C 13 58.366 0.3 . 1 . . . . . 433 SER CA . 51420 1 784 . 1 . 1 96 96 SER CB C 13 63.634 0.3 . 1 . . . . . 433 SER CB . 51420 1 785 . 1 . 1 96 96 SER N N 15 119.036 0.3 . 1 . . . . . 433 SER N . 51420 1 786 . 1 . 1 97 97 GLY H H 1 7.524 0.02 . 1 . . . . . 434 GLY H . 51420 1 787 . 1 . 1 97 97 GLY HA2 H 1 3.655 0.02 . 1 . . . . . 434 GLY HA2 . 51420 1 788 . 1 . 1 97 97 GLY HA3 H 1 3.655 0.02 . 1 . . . . . 434 GLY HA3 . 51420 1 789 . 1 . 1 97 97 GLY C C 13 173.927 0.3 . 1 . . . . . 434 GLY C . 51420 1 790 . 1 . 1 97 97 GLY CA C 13 44.979 0.3 . 1 . . . . . 434 GLY CA . 51420 1 791 . 1 . 1 97 97 GLY N N 15 110.211 0.3 . 1 . . . . . 434 GLY N . 51420 1 792 . 1 . 1 98 98 ALA H H 1 8.05 0.02 . 1 . . . . . 435 ALA H . 51420 1 793 . 1 . 1 98 98 ALA HA H 1 4.23 0.02 . 1 . . . . . 435 ALA HA . 51420 1 794 . 1 . 1 98 98 ALA HB1 H 1 1.349 0.02 . 1 . . . . . 435 ALA HB . 51420 1 795 . 1 . 1 98 98 ALA HB2 H 1 1.349 0.02 . 1 . . . . . 435 ALA HB . 51420 1 796 . 1 . 1 98 98 ALA HB3 H 1 1.349 0.02 . 1 . . . . . 435 ALA HB . 51420 1 797 . 1 . 1 98 98 ALA C C 13 178.095 0.3 . 1 . . . . . 435 ALA C . 51420 1 798 . 1 . 1 98 98 ALA CA C 13 52.457 0.3 . 1 . . . . . 435 ALA CA . 51420 1 799 . 1 . 1 98 98 ALA CB C 13 18.971 0.3 . 1 . . . . . 435 ALA CB . 51420 1 800 . 1 . 1 98 98 ALA N N 15 123.327 0.3 . 1 . . . . . 435 ALA N . 51420 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 51420 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name EZH2loop_310K _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D SHACA-HSQC' . . . 51420 2 2 '3D HCAN' . . . 51420 2 3 '3D HCA(CO)N' . . . 51420 2 4 '3D HCA(N)CO' . . . 51420 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51420 2 2 $software_2 . . 51420 2 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 3 3 ALA HA H 1 4.257 0.02 . 1 . . . . . 340 ALA HA . 51420 2 2 . 1 . 1 3 3 ALA C C 13 177.889 0.3 . 1 . . . . . 340 ALA C . 51420 2 3 . 1 . 1 3 3 ALA CA C 13 53.01 0.3 . 1 . . . . . 340 ALA CA . 51420 2 4 . 1 . 1 3 3 ALA N N 15 123.913 0.3 . 1 . . . . . 340 ALA N . 51420 2 5 . 1 . 1 4 4 GLU HA H 1 4.212 0.02 . 1 . . . . . 341 GLU HA . 51420 2 6 . 1 . 1 4 4 GLU C C 13 176.744 0.3 . 1 . . . . . 341 GLU C . 51420 2 7 . 1 . 1 4 4 GLU CA C 13 56.904 0.3 . 1 . . . . . 341 GLU CA . 51420 2 8 . 1 . 1 4 4 GLU N N 15 119.118 0.3 . 1 . . . . . 341 GLU N . 51420 2 9 . 1 . 1 6 6 ILE HA H 1 4.141 0.02 . 1 . . . . . 343 ILE HA . 51420 2 10 . 1 . 1 6 6 ILE C C 13 176.187 0.3 . 1 . . . . . 343 ILE C . 51420 2 11 . 1 . 1 6 6 ILE CA C 13 61.215 0.3 . 1 . . . . . 343 ILE CA . 51420 2 12 . 1 . 1 6 6 ILE N N 15 120.922 0.3 . 1 . . . . . 343 ILE N . 51420 2 13 . 1 . 1 7 7 LYS HA H 1 4.377 0.02 . 1 . . . . . 344 LYS HA . 51420 2 14 . 1 . 1 7 7 LYS C C 13 174.631 0.3 . 1 . . . . . 344 LYS C . 51420 2 15 . 1 . 1 7 7 LYS CA C 13 56.26 0.3 . 1 . . . . . 344 LYS CA . 51420 2 16 . 1 . 1 7 7 LYS N N 15 125.182 0.3 . 1 . . . . . 344 LYS N . 51420 2 17 . 1 . 1 8 8 THR HA H 1 4.565 0.02 . 1 . . . . . 345 THR HA . 51420 2 18 . 1 . 1 8 8 THR CA C 13 59.745 0.3 . 1 . . . . . 345 THR CA . 51420 2 19 . 1 . 1 8 8 THR N N 15 117.422 0.3 . 1 . . . . . 345 THR N . 51420 2 20 . 1 . 1 9 9 PRO HA H 1 4.683 0.02 . 1 . . . . . 346 PRO HA . 51420 2 21 . 1 . 1 9 9 PRO C C 13 174.754 0.3 . 1 . . . . . 346 PRO C . 51420 2 22 . 1 . 1 9 9 PRO CA C 13 61.618 0.3 . 1 . . . . . 346 PRO CA . 51420 2 23 . 1 . 1 9 9 PRO N N 15 140.211 0.3 . 1 . . . . . 346 PRO N . 51420 2 24 . 1 . 1 10 10 PRO HA H 1 4.425 0.02 . 1 . . . . . 347 PRO HA . 51420 2 25 . 1 . 1 10 10 PRO C C 13 176.799 0.3 . 1 . . . . . 347 PRO C . 51420 2 26 . 1 . 1 10 10 PRO CA C 13 62.833 0.3 . 1 . . . . . 347 PRO CA . 51420 2 27 . 1 . 1 10 10 PRO N N 15 135.213 0.3 . 1 . . . . . 347 PRO N . 51420 2 28 . 1 . 1 11 11 LYS HA H 1 4.275 0.02 . 1 . . . . . 348 LYS HA . 51420 2 29 . 1 . 1 11 11 LYS C C 13 174.203 0.3 . 1 . . . . . 348 LYS C . 51420 2 30 . 1 . 1 11 11 LYS CA C 13 56.265 0.3 . 1 . . . . . 348 LYS CA . 51420 2 31 . 1 . 1 11 11 LYS N N 15 121.493 0.3 . 1 . . . . . 348 LYS N . 51420 2 32 . 1 . 1 12 12 ARG HA H 1 4.642 0.02 . 1 . . . . . 349 ARG HA . 51420 2 33 . 1 . 1 12 12 ARG CA C 13 53.82 0.3 . 1 . . . . . 349 ARG CA . 51420 2 34 . 1 . 1 12 12 ARG N N 15 123.278 0.3 . 1 . . . . . 349 ARG N . 51420 2 35 . 1 . 1 13 13 PRO HA H 1 4.435 0.02 . 1 . . . . . 350 PRO HA . 51420 2 36 . 1 . 1 13 13 PRO C C 13 177.436 0.3 . 1 . . . . . 350 PRO C . 51420 2 37 . 1 . 1 13 13 PRO CA C 13 63.439 0.3 . 1 . . . . . 350 PRO CA . 51420 2 38 . 1 . 1 13 13 PRO N N 15 137.12 0.3 . 1 . . . . . 350 PRO N . 51420 2 39 . 1 . 1 14 14 GLY HA2 H 1 3.976 0.02 . 1 . . . . . 351 GLY HA2 . 51420 2 40 . 1 . 1 14 14 GLY HA3 H 1 3.976 0.02 . 1 . . . . . 351 GLY HA3 . 51420 2 41 . 1 . 1 14 14 GLY CA C 13 45.327 0.3 . 1 . . . . . 351 GLY CA . 51420 2 42 . 1 . 1 14 14 GLY N N 15 109.068 0.3 . 1 . . . . . 351 GLY N . 51420 2 43 . 1 . 1 15 15 GLY HA2 H 1 3.972 0.02 . 1 . . . . . 352 GLY HA2 . 51420 2 44 . 1 . 1 15 15 GLY HA3 H 1 3.987 0.02 . 1 . . . . . 352 GLY HA3 . 51420 2 45 . 1 . 1 15 15 GLY CA C 13 45.286 0.3 . 1 . . . . . 352 GLY CA . 51420 2 46 . 1 . 1 15 15 GLY N N 15 108.373 0.3 . 1 . . . . . 352 GLY N . 51420 2 47 . 1 . 1 16 16 ARG HA H 1 4.34 0.02 . 1 . . . . . 353 ARG HA . 51420 2 48 . 1 . 1 16 16 ARG CA C 13 56.218 0.3 . 1 . . . . . 353 ARG CA . 51420 2 49 . 1 . 1 16 16 ARG N N 15 120.447 0.3 . 1 . . . . . 353 ARG N . 51420 2 50 . 1 . 1 18 18 ARG HA H 1 4.339 0.02 . 1 . . . . . 355 ARG HA . 51420 2 51 . 1 . 1 18 18 ARG CA C 13 56.227 0.3 . 1 . . . . . 355 ARG CA . 51420 2 52 . 1 . 1 18 18 ARG N N 15 122.67 0.3 . 1 . . . . . 355 ARG N . 51420 2 53 . 1 . 1 19 19 GLY HA2 H 1 3.949 0.02 . 1 . . . . . 356 GLY HA2 . 51420 2 54 . 1 . 1 19 19 GLY HA3 H 1 3.97 0.02 . 1 . . . . . 356 GLY HA3 . 51420 2 55 . 1 . 1 19 19 GLY C C 13 173.546 0.3 . 1 . . . . . 356 GLY C . 51420 2 56 . 1 . 1 19 19 GLY CA C 13 45.168 0.3 . 1 . . . . . 356 GLY CA . 51420 2 57 . 1 . 1 19 19 GLY N N 15 109.679 0.3 . 1 . . . . . 356 GLY N . 51420 2 58 . 1 . 1 20 20 ARG HA H 1 4.354 0.02 . 1 . . . . . 357 ARG HA . 51420 2 59 . 1 . 1 20 20 ARG C C 13 176.081 0.3 . 1 . . . . . 357 ARG C . 51420 2 60 . 1 . 1 20 20 ARG CA C 13 55.923 0.3 . 1 . . . . . 357 ARG CA . 51420 2 61 . 1 . 1 20 20 ARG N N 15 120.305 0.3 . 1 . . . . . 357 ARG N . 51420 2 62 . 1 . 1 21 21 LEU HA H 1 4.609 0.02 . 1 . . . . . 358 LEU HA . 51420 2 63 . 1 . 1 21 21 LEU CA C 13 53.097 0.3 . 1 . . . . . 358 LEU CA . 51420 2 64 . 1 . 1 21 21 LEU N N 15 124.961 0.3 . 1 . . . . . 358 LEU N . 51420 2 65 . 1 . 1 22 22 PRO HA H 1 4.413 0.02 . 1 . . . . . 359 PRO HA . 51420 2 66 . 1 . 1 22 22 PRO C C 13 176.679 0.3 . 1 . . . . . 359 PRO C . 51420 2 67 . 1 . 1 22 22 PRO CA C 13 63.126 0.3 . 1 . . . . . 359 PRO CA . 51420 2 68 . 1 . 1 22 22 PRO N N 15 135.194 0.3 . 1 . . . . . 359 PRO N . 51420 2 69 . 1 . 1 23 23 ASN HA H 1 4.661 0.02 . 1 . . . . . 360 ASN HA . 51420 2 70 . 1 . 1 23 23 ASN CA C 13 53.35 0.3 . 1 . . . . . 360 ASN CA . 51420 2 71 . 1 . 1 23 23 ASN N N 15 119.269 0.3 . 1 . . . . . 360 ASN N . 51420 2 72 . 1 . 1 24 24 ASN HA H 1 4.743 0.02 . 1 . . . . . 361 ASN HA . 51420 2 73 . 1 . 1 24 24 ASN CA C 13 53.43 0.3 . 1 . . . . . 361 ASN CA . 51420 2 74 . 1 . 1 24 24 ASN N N 15 119.183 0.3 . 1 . . . . . 361 ASN N . 51420 2 75 . 1 . 1 25 25 SER HA H 1 4.471 0.02 . 1 . . . . . 362 SER HA . 51420 2 76 . 1 . 1 25 25 SER CA C 13 58.42 0.3 . 1 . . . . . 362 SER CA . 51420 2 77 . 1 . 1 25 25 SER N N 15 115.659 0.3 . 1 . . . . . 362 SER N . 51420 2 78 . 1 . 1 26 26 SER HA H 1 4.47 0.02 . 1 . . . . . 363 SER HA . 51420 2 79 . 1 . 1 26 26 SER C C 13 174.444 0.3 . 1 . . . . . 363 SER C . 51420 2 80 . 1 . 1 26 26 SER CA C 13 58.388 0.3 . 1 . . . . . 363 SER CA . 51420 2 81 . 1 . 1 26 26 SER N N 15 117.38 0.3 . 1 . . . . . 363 SER N . 51420 2 82 . 1 . 1 27 27 ARG HA H 1 4.642 0.02 . 1 . . . . . 364 ARG HA . 51420 2 83 . 1 . 1 27 27 ARG C C 13 174.027 0.3 . 1 . . . . . 364 ARG C . 51420 2 84 . 1 . 1 27 27 ARG CA C 13 53.82 0.3 . 1 . . . . . 364 ARG CA . 51420 2 85 . 1 . 1 27 27 ARG N N 15 123.459 0.3 . 1 . . . . . 364 ARG N . 51420 2 86 . 1 . 1 28 28 PRO HA H 1 4.477 0.02 . 1 . . . . . 365 PRO HA . 51420 2 87 . 1 . 1 28 28 PRO C C 13 176.888 0.3 . 1 . . . . . 365 PRO C . 51420 2 88 . 1 . 1 28 28 PRO CA C 13 63.254 0.3 . 1 . . . . . 365 PRO CA . 51420 2 89 . 1 . 1 28 28 PRO N N 15 137.12 0.3 . 1 . . . . . 365 PRO N . 51420 2 90 . 1 . 1 29 29 SER HA H 1 4.457 0.02 . 1 . . . . . 366 SER HA . 51420 2 91 . 1 . 1 29 29 SER C C 13 174.436 0.3 . 1 . . . . . 366 SER C . 51420 2 92 . 1 . 1 29 29 SER CA C 13 58.318 0.3 . 1 . . . . . 366 SER CA . 51420 2 93 . 1 . 1 29 29 SER N N 15 116.022 0.3 . 1 . . . . . 366 SER N . 51420 2 94 . 1 . 1 30 30 THR HA H 1 4.645 0.02 . 1 . . . . . 367 THR HA . 51420 2 95 . 1 . 1 30 30 THR C C 13 172.738 0.3 . 1 . . . . . 367 THR C . 51420 2 96 . 1 . 1 30 30 THR CA C 13 59.69 0.3 . 1 . . . . . 367 THR CA . 51420 2 97 . 1 . 1 30 30 THR N N 15 117.427 0.3 . 1 . . . . . 367 THR N . 51420 2 98 . 1 . 1 31 31 PRO HA H 1 4.488 0.02 . 1 . . . . . 368 PRO HA . 51420 2 99 . 1 . 1 31 31 PRO C C 13 176.954 0.3 . 1 . . . . . 368 PRO C . 51420 2 100 . 1 . 1 31 31 PRO CA C 13 63.461 0.3 . 1 . . . . . 368 PRO CA . 51420 2 101 . 1 . 1 31 31 PRO N N 15 138.204 0.3 . 1 . . . . . 368 PRO N . 51420 2 102 . 1 . 1 32 32 THR HA H 1 4.314 0.02 . 1 . . . . . 369 THR HA . 51420 2 103 . 1 . 1 32 32 THR C C 13 174.444 0.3 . 1 . . . . . 369 THR C . 51420 2 104 . 1 . 1 32 32 THR CA C 13 61.996 0.3 . 1 . . . . . 369 THR CA . 51420 2 105 . 1 . 1 32 32 THR N N 15 114.623 0.3 . 1 . . . . . 369 THR N . 51420 2 106 . 1 . 1 33 33 ILE HA H 1 4.198 0.02 . 1 . . . . . 370 ILE HA . 51420 2 107 . 1 . 1 33 33 ILE C C 13 175.554 0.3 . 1 . . . . . 370 ILE C . 51420 2 108 . 1 . 1 33 33 ILE CA C 13 61.093 0.3 . 1 . . . . . 370 ILE CA . 51420 2 109 . 1 . 1 33 33 ILE N N 15 122.382 0.3 . 1 . . . . . 370 ILE N . 51420 2 110 . 1 . 1 34 34 ASN HA H 1 4.754 0.02 . 1 . . . . . 371 ASN HA . 51420 2 111 . 1 . 1 34 34 ASN C C 13 175.072 0.3 . 1 . . . . . 371 ASN C . 51420 2 112 . 1 . 1 34 34 ASN CA C 13 53.168 0.3 . 1 . . . . . 371 ASN CA . 51420 2 113 . 1 . 1 34 34 ASN N N 15 122.649 0.3 . 1 . . . . . 371 ASN N . 51420 2 114 . 1 . 1 35 35 VAL HA H 1 4.093 0.02 . 1 . . . . . 372 VAL HA . 51420 2 115 . 1 . 1 35 35 VAL C C 13 176.011 0.3 . 1 . . . . . 372 VAL C . 51420 2 116 . 1 . 1 35 35 VAL CA C 13 62.66 0.3 . 1 . . . . . 372 VAL CA . 51420 2 117 . 1 . 1 35 35 VAL N N 15 120.548 0.3 . 1 . . . . . 372 VAL N . 51420 2 118 . 1 . 1 36 36 LEU HA H 1 4.353 0.02 . 1 . . . . . 373 LEU HA . 51420 2 119 . 1 . 1 36 36 LEU C C 13 177.262 0.3 . 1 . . . . . 373 LEU C . 51420 2 120 . 1 . 1 36 36 LEU CA C 13 55.329 0.3 . 1 . . . . . 373 LEU CA . 51420 2 121 . 1 . 1 36 36 LEU N N 15 124.778 0.3 . 1 . . . . . 373 LEU N . 51420 2 122 . 1 . 1 37 37 GLU HA H 1 4.307 0.02 . 1 . . . . . 374 GLU HA . 51420 2 123 . 1 . 1 37 37 GLU C C 13 176.269 0.3 . 1 . . . . . 374 GLU C . 51420 2 124 . 1 . 1 37 37 GLU CA C 13 56.569 0.3 . 1 . . . . . 374 GLU CA . 51420 2 125 . 1 . 1 37 37 GLU N N 15 121.22 0.3 . 1 . . . . . 374 GLU N . 51420 2 126 . 1 . 1 38 38 SER HA H 1 4.447 0.02 . 1 . . . . . 375 SER HA . 51420 2 127 . 1 . 1 38 38 SER C C 13 174.443 0.3 . 1 . . . . . 375 SER C . 51420 2 128 . 1 . 1 38 38 SER CA C 13 58.265 0.3 . 1 . . . . . 375 SER CA . 51420 2 129 . 1 . 1 38 38 SER N N 15 116.729 0.3 . 1 . . . . . 375 SER N . 51420 2 130 . 1 . 1 39 39 LYS HA H 1 4.397 0.02 . 1 . . . . . 376 LYS HA . 51420 2 131 . 1 . 1 39 39 LYS CA C 13 56.26 0.3 . 1 . . . . . 376 LYS CA . 51420 2 132 . 1 . 1 39 39 LYS N N 15 123.031 0.3 . 1 . . . . . 376 LYS N . 51420 2 133 . 1 . 1 40 40 ASP HA H 1 4.664 0.02 . 1 . . . . . 377 ASP HA . 51420 2 134 . 1 . 1 40 40 ASP C C 13 174.456 0.3 . 1 . . . . . 377 ASP C . 51420 2 135 . 1 . 1 40 40 ASP CA C 13 54.654 0.3 . 1 . . . . . 377 ASP CA . 51420 2 136 . 1 . 1 40 40 ASP N N 15 121.296 0.3 . 1 . . . . . 377 ASP N . 51420 2 137 . 1 . 1 41 41 THR HA H 1 4.339 0.02 . 1 . . . . . 378 THR HA . 51420 2 138 . 1 . 1 41 41 THR C C 13 174.456 0.3 . 1 . . . . . 378 THR C . 51420 2 139 . 1 . 1 41 41 THR CA C 13 61.985 0.3 . 1 . . . . . 378 THR CA . 51420 2 140 . 1 . 1 41 41 THR N N 15 113.194 0.3 . 1 . . . . . 378 THR N . 51420 2 141 . 1 . 1 42 42 ASP HA H 1 4.659 0.02 . 1 . . . . . 379 ASP HA . 51420 2 142 . 1 . 1 42 42 ASP C C 13 176.484 0.3 . 1 . . . . . 379 ASP C . 51420 2 143 . 1 . 1 42 42 ASP CA C 13 54.825 0.3 . 1 . . . . . 379 ASP CA . 51420 2 144 . 1 . 1 42 42 ASP N N 15 122.406 0.3 . 1 . . . . . 379 ASP N . 51420 2 145 . 1 . 1 43 43 SER HA H 1 4.401 0.02 . 1 . . . . . 380 SER HA . 51420 2 146 . 1 . 1 43 43 SER C C 13 174.47 0.3 . 1 . . . . . 380 SER C . 51420 2 147 . 1 . 1 43 43 SER CA C 13 59.006 0.3 . 1 . . . . . 380 SER CA . 51420 2 148 . 1 . 1 43 43 SER N N 15 115.618 0.3 . 1 . . . . . 380 SER N . 51420 2 149 . 1 . 1 44 44 ASP HA H 1 4.622 0.02 . 1 . . . . . 381 ASP HA . 51420 2 150 . 1 . 1 44 44 ASP CA C 13 54.688 0.3 . 1 . . . . . 381 ASP CA . 51420 2 151 . 1 . 1 44 44 ASP N N 15 121.972 0.3 . 1 . . . . . 381 ASP N . 51420 2 152 . 1 . 1 45 45 ARG HA H 1 4.299 0.02 . 1 . . . . . 382 ARG HA . 51420 2 153 . 1 . 1 45 45 ARG CA C 13 56.454 0.3 . 1 . . . . . 382 ARG CA . 51420 2 154 . 1 . 1 45 45 ARG N N 15 120.327 0.3 . 1 . . . . . 382 ARG N . 51420 2 155 . 1 . 1 46 46 GLU HA H 1 4.263 0.02 . 1 . . . . . 383 GLU HA . 51420 2 156 . 1 . 1 46 46 GLU C C 13 176.326 0.3 . 1 . . . . . 383 GLU C . 51420 2 157 . 1 . 1 46 46 GLU CA C 13 56.736 0.3 . 1 . . . . . 383 GLU CA . 51420 2 158 . 1 . 1 46 46 GLU N N 15 121.458 0.3 . 1 . . . . . 383 GLU N . 51420 2 159 . 1 . 1 47 47 ALA HA H 1 4.326 0.02 . 1 . . . . . 384 ALA HA . 51420 2 160 . 1 . 1 47 47 ALA C C 13 178.209 0.3 . 1 . . . . . 384 ALA C . 51420 2 161 . 1 . 1 47 47 ALA CA C 13 52.882 0.3 . 1 . . . . . 384 ALA CA . 51420 2 162 . 1 . 1 47 47 ALA N N 15 124.822 0.3 . 1 . . . . . 384 ALA N . 51420 2 163 . 1 . 1 48 48 GLY HA2 H 1 4.023 0.02 . 1 . . . . . 385 GLY HA2 . 51420 2 164 . 1 . 1 48 48 GLY HA3 H 1 4.023 0.02 . 1 . . . . . 385 GLY HA3 . 51420 2 165 . 1 . 1 48 48 GLY CA C 13 45.488 0.3 . 1 . . . . . 385 GLY CA . 51420 2 166 . 1 . 1 48 48 GLY N N 15 107.947 0.3 . 1 . . . . . 385 GLY N . 51420 2 167 . 1 . 1 49 49 THR HA H 1 4.366 0.02 . 1 . . . . . 386 THR HA . 51420 2 168 . 1 . 1 49 49 THR C C 13 174.77 0.3 . 1 . . . . . 386 THR C . 51420 2 169 . 1 . 1 49 49 THR CA C 13 61.945 0.3 . 1 . . . . . 386 THR CA . 51420 2 170 . 1 . 1 49 49 THR N N 15 112.846 0.3 . 1 . . . . . 386 THR N . 51420 2 171 . 1 . 1 50 50 GLU HA H 1 4.405 0.02 . 1 . . . . . 387 GLU HA . 51420 2 172 . 1 . 1 50 50 GLU C C 13 176.798 0.3 . 1 . . . . . 387 GLU C . 51420 2 173 . 1 . 1 50 50 GLU CA C 13 56.834 0.3 . 1 . . . . . 387 GLU CA . 51420 2 174 . 1 . 1 50 50 GLU N N 15 123.062 0.3 . 1 . . . . . 387 GLU N . 51420 2 175 . 1 . 1 51 51 THR HA H 1 4.389 0.02 . 1 . . . . . 388 THR HA . 51420 2 176 . 1 . 1 51 51 THR C C 13 175.241 0.3 . 1 . . . . . 388 THR C . 51420 2 177 . 1 . 1 51 51 THR CA C 13 61.938 0.3 . 1 . . . . . 388 THR CA . 51420 2 178 . 1 . 1 51 51 THR N N 15 114.346 0.3 . 1 . . . . . 388 THR N . 51420 2 179 . 1 . 1 52 52 GLY HA2 H 1 4.022 0.02 . 1 . . . . . 389 GLY HA2 . 51420 2 180 . 1 . 1 52 52 GLY HA3 H 1 4.022 0.02 . 1 . . . . . 389 GLY HA3 . 51420 2 181 . 1 . 1 52 52 GLY CA C 13 45.535 0.3 . 1 . . . . . 389 GLY CA . 51420 2 182 . 1 . 1 52 52 GLY N N 15 111.124 0.3 . 1 . . . . . 389 GLY N . 51420 2 183 . 1 . 1 53 53 GLY HA2 H 1 3.978 0.02 . 1 . . . . . 390 GLY HA2 . 51420 2 184 . 1 . 1 53 53 GLY HA3 H 1 3.978 0.02 . 1 . . . . . 390 GLY HA3 . 51420 2 185 . 1 . 1 53 53 GLY CA C 13 45.328 0.3 . 1 . . . . . 390 GLY CA . 51420 2 186 . 1 . 1 53 53 GLY N N 15 108.641 0.3 . 1 . . . . . 390 GLY N . 51420 2 187 . 1 . 1 54 54 GLU HA H 1 4.287 0.02 . 1 . . . . . 391 GLU HA . 51420 2 188 . 1 . 1 54 54 GLU CA C 13 56.792 0.3 . 1 . . . . . 391 GLU CA . 51420 2 189 . 1 . 1 54 54 GLU N N 15 120.301 0.3 . 1 . . . . . 391 GLU N . 51420 2 190 . 1 . 1 55 55 ASN HA H 1 4.717 0.02 . 1 . . . . . 392 ASN HA . 51420 2 191 . 1 . 1 55 55 ASN CA C 13 53.339 0.3 . 1 . . . . . 392 ASN CA . 51420 2 192 . 1 . 1 55 55 ASN N N 15 119.184 0.3 . 1 . . . . . 392 ASN N . 51420 2 193 . 1 . 1 56 56 ASN HA H 1 4.743 0.02 . 1 . . . . . 393 ASN HA . 51420 2 194 . 1 . 1 56 56 ASN CA C 13 53.417 0.3 . 1 . . . . . 393 ASN CA . 51420 2 195 . 1 . 1 56 56 ASN N N 15 119.208 0.3 . 1 . . . . . 393 ASN N . 51420 2 196 . 1 . 1 57 57 ASP HA H 1 4.579 0.02 . 1 . . . . . 394 ASP HA . 51420 2 197 . 1 . 1 57 57 ASP CA C 13 54.694 0.3 . 1 . . . . . 394 ASP CA . 51420 2 198 . 1 . 1 58 58 LYS HA H 1 4.329 0.02 . 1 . . . . . 395 LYS HA . 51420 2 199 . 1 . 1 58 58 LYS CA C 13 56.39 0.3 . 1 . . . . . 395 LYS CA . 51420 2 200 . 1 . 1 59 59 GLU HA H 1 4.329 0.02 . 1 . . . . . 396 GLU HA . 51420 2 201 . 1 . 1 59 59 GLU CA C 13 56.39 0.3 . 1 . . . . . 396 GLU CA . 51420 2 202 . 1 . 1 59 59 GLU N N 15 121.944 0.3 . 1 . . . . . 396 GLU N . 51420 2 203 . 1 . 1 60 60 GLU HA H 1 4.238 0.02 . 1 . . . . . 397 GLU HA . 51420 2 204 . 1 . 1 60 60 GLU CA C 13 56.766 0.3 . 1 . . . . . 397 GLU CA . 51420 2 205 . 1 . 1 60 60 GLU N N 15 121.843 0.3 . 1 . . . . . 397 GLU N . 51420 2 206 . 1 . 1 61 61 GLU HA H 1 4.234 0.02 . 1 . . . . . 398 GLU HA . 51420 2 207 . 1 . 1 61 61 GLU CA C 13 56.856 0.3 . 1 . . . . . 398 GLU CA . 51420 2 208 . 1 . 1 61 61 GLU N N 15 121.898 0.3 . 1 . . . . . 398 GLU N . 51420 2 209 . 1 . 1 62 62 GLU HA H 1 4.254 0.02 . 1 . . . . . 399 GLU HA . 51420 2 210 . 1 . 1 62 62 GLU CA C 13 56.894 0.3 . 1 . . . . . 399 GLU CA . 51420 2 211 . 1 . 1 62 62 GLU N N 15 121.974 0.3 . 1 . . . . . 399 GLU N . 51420 2 212 . 1 . 1 65 65 ASP HA H 1 4.628 0.02 . 1 . . . . . 402 ASP HA . 51420 2 213 . 1 . 1 65 65 ASP C C 13 176.333 0.3 . 1 . . . . . 402 ASP C . 51420 2 214 . 1 . 1 65 65 ASP CA C 13 54.533 0.3 . 1 . . . . . 402 ASP CA . 51420 2 215 . 1 . 1 66 66 GLU HA H 1 4.371 0.02 . 1 . . . . . 403 GLU HA . 51420 2 216 . 1 . 1 66 66 GLU C C 13 176.96 0.3 . 1 . . . . . 403 GLU C . 51420 2 217 . 1 . 1 66 66 GLU CA C 13 56.944 0.3 . 1 . . . . . 403 GLU CA . 51420 2 218 . 1 . 1 66 66 GLU N N 15 121.691 0.3 . 1 . . . . . 403 GLU N . 51420 2 219 . 1 . 1 67 67 THR HA H 1 4.357 0.02 . 1 . . . . . 404 THR HA . 51420 2 220 . 1 . 1 67 67 THR CA C 13 62.46 0.3 . 1 . . . . . 404 THR CA . 51420 2 221 . 1 . 1 67 67 THR N N 15 114.251 0.3 . 1 . . . . . 404 THR N . 51420 2 222 . 1 . 1 68 68 SER HA H 1 4.523 0.02 . 1 . . . . . 405 SER HA . 51420 2 223 . 1 . 1 68 68 SER C C 13 174.77 0.3 . 1 . . . . . 405 SER C . 51420 2 224 . 1 . 1 68 68 SER CA C 13 58.571 0.3 . 1 . . . . . 405 SER CA . 51420 2 225 . 1 . 1 68 68 SER N N 15 117.52 0.3 . 1 . . . . . 405 SER N . 51420 2 226 . 1 . 1 69 69 SER HA H 1 4.52 0.02 . 1 . . . . . 406 SER HA . 51420 2 227 . 1 . 1 69 69 SER CA C 13 58.599 0.3 . 1 . . . . . 406 SER CA . 51420 2 228 . 1 . 1 69 69 SER N N 15 117.448 0.3 . 1 . . . . . 406 SER N . 51420 2 229 . 1 . 1 70 70 SER HA H 1 4.517 0.02 . 1 . . . . . 407 SER HA . 51420 2 230 . 1 . 1 70 70 SER CA C 13 58.604 0.3 . 1 . . . . . 407 SER CA . 51420 2 231 . 1 . 1 70 70 SER N N 15 117.437 0.3 . 1 . . . . . 407 SER N . 51420 2 232 . 1 . 1 71 71 SER HA H 1 4.459 0.02 . 1 . . . . . 408 SER HA . 51420 2 233 . 1 . 1 71 71 SER C C 13 174.864 0.3 . 1 . . . . . 408 SER C . 51420 2 234 . 1 . 1 71 71 SER CA C 13 58.867 0.3 . 1 . . . . . 408 SER CA . 51420 2 235 . 1 . 1 71 71 SER N N 15 117.48 0.3 . 1 . . . . . 408 SER N . 51420 2 236 . 1 . 1 72 72 GLU HA H 1 4.272 0.02 . 1 . . . . . 409 GLU HA . 51420 2 237 . 1 . 1 72 72 GLU C C 13 176.644 0.3 . 1 . . . . . 409 GLU C . 51420 2 238 . 1 . 1 72 72 GLU CA C 13 57.063 0.3 . 1 . . . . . 409 GLU CA . 51420 2 239 . 1 . 1 72 72 GLU N N 15 122.35 0.3 . 1 . . . . . 409 GLU N . 51420 2 240 . 1 . 1 73 73 ALA HA H 1 4.251 0.02 . 1 . . . . . 410 ALA HA . 51420 2 241 . 1 . 1 73 73 ALA C C 13 177.896 0.3 . 1 . . . . . 410 ALA C . 51420 2 242 . 1 . 1 73 73 ALA CA C 13 53.244 0.3 . 1 . . . . . 410 ALA CA . 51420 2 243 . 1 . 1 73 73 ALA N N 15 123.764 0.3 . 1 . . . . . 410 ALA N . 51420 2 244 . 1 . 1 74 74 ASN HA H 1 4.714 0.02 . 1 . . . . . 411 ASN HA . 51420 2 245 . 1 . 1 74 74 ASN C C 13 175.569 0.3 . 1 . . . . . 411 ASN C . 51420 2 246 . 1 . 1 74 74 ASN CA C 13 53.573 0.3 . 1 . . . . . 411 ASN CA . 51420 2 247 . 1 . 1 74 74 ASN N N 15 116.725 0.3 . 1 . . . . . 411 ASN N . 51420 2 248 . 1 . 1 75 75 SER HA H 1 4.424 0.02 . 1 . . . . . 412 SER HA . 51420 2 249 . 1 . 1 75 75 SER C C 13 174.732 0.3 . 1 . . . . . 412 SER C . 51420 2 250 . 1 . 1 75 75 SER CA C 13 58.891 0.3 . 1 . . . . . 412 SER CA . 51420 2 251 . 1 . 1 75 75 SER N N 15 115.666 0.3 . 1 . . . . . 412 SER N . 51420 2 252 . 1 . 1 76 76 ARG HA H 1 4.378 0.02 . 1 . . . . . 413 ARG HA . 51420 2 253 . 1 . 1 76 76 ARG C C 13 176.172 0.3 . 1 . . . . . 413 ARG C . 51420 2 254 . 1 . 1 76 76 ARG CA C 13 56.419 0.3 . 1 . . . . . 413 ARG CA . 51420 2 255 . 1 . 1 76 76 ARG N N 15 121.978 0.3 . 1 . . . . . 413 ARG N . 51420 2 256 . 1 . 1 77 77 CYS HA H 1 4.468 0.02 . 1 . . . . . 414 CYS HA . 51420 2 257 . 1 . 1 77 77 CYS C C 13 174.459 0.3 . 1 . . . . . 414 CYS C . 51420 2 258 . 1 . 1 77 77 CYS CA C 13 58.617 0.3 . 1 . . . . . 414 CYS CA . 51420 2 259 . 1 . 1 77 77 CYS N N 15 119.436 0.3 . 1 . . . . . 414 CYS N . 51420 2 260 . 1 . 1 78 78 GLN HA H 1 4.409 0.02 . 1 . . . . . 415 GLN HA . 51420 2 261 . 1 . 1 78 78 GLN C C 13 175.702 0.3 . 1 . . . . . 415 GLN C . 51420 2 262 . 1 . 1 78 78 GLN CA C 13 55.917 0.3 . 1 . . . . . 415 GLN CA . 51420 2 263 . 1 . 1 78 78 GLN N N 15 122.697 0.3 . 1 . . . . . 415 GLN N . 51420 2 264 . 1 . 1 79 79 THR HA H 1 4.581 0.02 . 1 . . . . . 416 THR HA . 51420 2 265 . 1 . 1 79 79 THR C C 13 172.726 0.3 . 1 . . . . . 416 THR C . 51420 2 266 . 1 . 1 79 79 THR CA C 13 59.966 0.3 . 1 . . . . . 416 THR CA . 51420 2 267 . 1 . 1 79 79 THR N N 15 118.196 0.3 . 1 . . . . . 416 THR N . 51420 2 268 . 1 . 1 80 80 PRO HA H 1 4.436 0.02 . 1 . . . . . 417 PRO HA . 51420 2 269 . 1 . 1 80 80 PRO C C 13 176.733 0.3 . 1 . . . . . 417 PRO C . 51420 2 270 . 1 . 1 80 80 PRO CA C 13 63.308 0.3 . 1 . . . . . 417 PRO CA . 51420 2 271 . 1 . 1 80 80 PRO N N 15 138.523 0.3 . 1 . . . . . 417 PRO N . 51420 2 272 . 1 . 1 81 81 ILE HA H 1 4.099 0.02 . 1 . . . . . 418 ILE HA . 51420 2 273 . 1 . 1 81 81 ILE C C 13 176.143 0.3 . 1 . . . . . 418 ILE C . 51420 2 274 . 1 . 1 81 81 ILE CA C 13 61.272 0.3 . 1 . . . . . 418 ILE CA . 51420 2 275 . 1 . 1 81 81 ILE N N 15 120.946 0.3 . 1 . . . . . 418 ILE N . 51420 2 276 . 1 . 1 82 82 LYS HA H 1 4.334 0.02 . 1 . . . . . 419 LYS HA . 51420 2 277 . 1 . 1 82 82 LYS C C 13 176.026 0.3 . 1 . . . . . 419 LYS C . 51420 2 278 . 1 . 1 82 82 LYS CA C 13 56.133 0.3 . 1 . . . . . 419 LYS CA . 51420 2 279 . 1 . 1 82 82 LYS N N 15 125.156 0.3 . 1 . . . . . 419 LYS N . 51420 2 280 . 1 . 1 83 83 MET HA H 1 4.456 0.02 . 1 . . . . . 420 MET HA . 51420 2 281 . 1 . 1 83 83 MET C C 13 175.711 0.3 . 1 . . . . . 420 MET C . 51420 2 282 . 1 . 1 83 83 MET CA C 13 55.275 0.3 . 1 . . . . . 420 MET CA . 51420 2 283 . 1 . 1 83 83 MET N N 15 121.986 0.3 . 1 . . . . . 420 MET N . 51420 2 284 . 1 . 1 84 84 LYS HA H 1 4.586 0.02 . 1 . . . . . 421 LYS HA . 51420 2 285 . 1 . 1 84 84 LYS C C 13 174.318 0.3 . 1 . . . . . 421 LYS C . 51420 2 286 . 1 . 1 84 84 LYS CA C 13 54.309 0.3 . 1 . . . . . 421 LYS CA . 51420 2 287 . 1 . 1 84 84 LYS N N 15 123.751 0.3 . 1 . . . . . 421 LYS N . 51420 2 288 . 1 . 1 85 85 PRO HA H 1 4.408 0.02 . 1 . . . . . 422 PRO HA . 51420 2 289 . 1 . 1 85 85 PRO C C 13 176.552 0.3 . 1 . . . . . 422 PRO C . 51420 2 290 . 1 . 1 85 85 PRO CA C 13 63.22 0.3 . 1 . . . . . 422 PRO CA . 51420 2 291 . 1 . 1 85 85 PRO N N 15 136.057 0.3 . 1 . . . . . 422 PRO N . 51420 2 292 . 1 . 1 86 86 ASN HA H 1 4.68 0.02 . 1 . . . . . 423 ASN HA . 51420 2 293 . 1 . 1 86 86 ASN C C 13 174.773 0.3 . 1 . . . . . 423 ASN C . 51420 2 294 . 1 . 1 86 86 ASN CA C 13 53.409 0.3 . 1 . . . . . 423 ASN CA . 51420 2 295 . 1 . 1 86 86 ASN N N 15 119.435 0.3 . 1 . . . . . 423 ASN N . 51420 2 296 . 1 . 1 87 87 ILE HA H 1 4.213 0.02 . 1 . . . . . 424 ILE HA . 51420 2 297 . 1 . 1 87 87 ILE C C 13 175.704 0.3 . 1 . . . . . 424 ILE C . 51420 2 298 . 1 . 1 87 87 ILE CA C 13 60.794 0.3 . 1 . . . . . 424 ILE CA . 51420 2 299 . 1 . 1 87 87 ILE N N 15 120.242 0.3 . 1 . . . . . 424 ILE N . 51420 2 300 . 1 . 1 88 88 GLU HA H 1 4.575 0.02 . 1 . . . . . 425 GLU HA . 51420 2 301 . 1 . 1 88 88 GLU C C 13 173.823 0.3 . 1 . . . . . 425 GLU C . 51420 2 302 . 1 . 1 88 88 GLU CA C 13 54.279 0.3 . 1 . . . . . 425 GLU CA . 51420 2 303 . 1 . 1 88 88 GLU N N 15 126.207 0.3 . 1 . . . . . 425 GLU N . 51420 2 304 . 1 . 1 89 89 PRO HA H 1 4.645 0.02 . 1 . . . . . 426 PRO HA . 51420 2 305 . 1 . 1 89 89 PRO C C 13 174.379 0.3 . 1 . . . . . 426 PRO C . 51420 2 306 . 1 . 1 89 89 PRO CA C 13 61.467 0.3 . 1 . . . . . 426 PRO CA . 51420 2 307 . 1 . 1 89 89 PRO N N 15 138.273 0.3 . 1 . . . . . 426 PRO N . 51420 2 308 . 1 . 1 90 90 PRO HA H 1 4.415 0.02 . 1 . . . . . 427 PRO HA . 51420 2 309 . 1 . 1 90 90 PRO C C 13 176.785 0.3 . 1 . . . . . 427 PRO C . 51420 2 310 . 1 . 1 90 90 PRO CA C 13 63.018 0.3 . 1 . . . . . 427 PRO CA . 51420 2 311 . 1 . 1 90 90 PRO N N 15 136.026 0.3 . 1 . . . . . 427 PRO N . 51420 2 312 . 1 . 1 91 91 GLU HA H 1 4.16 0.02 . 1 . . . . . 428 GLU HA . 51420 2 313 . 1 . 1 91 91 GLU C C 13 176.179 0.3 . 1 . . . . . 428 GLU C . 51420 2 314 . 1 . 1 91 91 GLU CA C 13 56.794 0.3 . 1 . . . . . 428 GLU CA . 51420 2 315 . 1 . 1 91 91 GLU N N 15 120.541 0.3 . 1 . . . . . 428 GLU N . 51420 2 316 . 1 . 1 92 92 ASN HA H 1 4.684 0.02 . 1 . . . . . 429 ASN HA . 51420 2 317 . 1 . 1 92 92 ASN C C 13 175.056 0.3 . 1 . . . . . 429 ASN C . 51420 2 318 . 1 . 1 92 92 ASN CA C 13 53.272 0.3 . 1 . . . . . 429 ASN CA . 51420 2 319 . 1 . 1 92 92 ASN N N 15 119.486 0.3 . 1 . . . . . 429 ASN N . 51420 2 320 . 1 . 1 93 93 VAL HA H 1 4.087 0.02 . 1 . . . . . 430 VAL HA . 51420 2 321 . 1 . 1 93 93 VAL C C 13 176.02 0.3 . 1 . . . . . 430 VAL C . 51420 2 322 . 1 . 1 93 93 VAL CA C 13 62.367 0.3 . 1 . . . . . 430 VAL CA . 51420 2 323 . 1 . 1 93 93 VAL N N 15 119.837 0.3 . 1 . . . . . 430 VAL N . 51420 2 324 . 1 . 1 94 94 GLU HA H 1 4.263 0.02 . 1 . . . . . 431 GLU HA . 51420 2 325 . 1 . 1 94 94 GLU C C 13 176.208 0.3 . 1 . . . . . 431 GLU C . 51420 2 326 . 1 . 1 94 94 GLU CA C 13 56.721 0.3 . 1 . . . . . 431 GLU CA . 51420 2 327 . 1 . 1 94 94 GLU N N 15 123.758 0.3 . 1 . . . . . 431 GLU N . 51420 2 328 . 1 . 1 95 95 TRP HA H 1 4.695 0.02 . 1 . . . . . 432 TRP HA . 51420 2 329 . 1 . 1 95 95 TRP C C 13 176.215 0.3 . 1 . . . . . 432 TRP C . 51420 2 330 . 1 . 1 95 95 TRP CA C 13 57.295 0.3 . 1 . . . . . 432 TRP CA . 51420 2 331 . 1 . 1 95 95 TRP N N 15 122.11 0.3 . 1 . . . . . 432 TRP N . 51420 2 332 . 1 . 1 96 96 SER HA H 1 4.296 0.02 . 1 . . . . . 433 SER HA . 51420 2 333 . 1 . 1 96 96 SER C C 13 174.77 0.3 . 1 . . . . . 433 SER C . 51420 2 334 . 1 . 1 96 96 SER CA C 13 58.562 0.3 . 1 . . . . . 433 SER CA . 51420 2 335 . 1 . 1 96 96 SER N N 15 117.93 0.3 . 1 . . . . . 433 SER N . 51420 2 336 . 1 . 1 97 97 GLY HA2 H 1 3.729 0.02 . 1 . . . . . 434 GLY HA2 . 51420 2 337 . 1 . 1 97 97 GLY HA3 H 1 3.729 0.02 . 1 . . . . . 434 GLY HA3 . 51420 2 338 . 1 . 1 97 97 GLY C C 13 173.682 0.3 . 1 . . . . . 434 GLY C . 51420 2 339 . 1 . 1 97 97 GLY CA C 13 45.376 0.3 . 1 . . . . . 434 GLY CA . 51420 2 340 . 1 . 1 97 97 GLY N N 15 109.73 0.3 . 1 . . . . . 434 GLY N . 51420 2 341 . 1 . 1 98 98 ALA HA H 1 4.272 0.02 . 1 . . . . . 435 ALA HA . 51420 2 342 . 1 . 1 98 98 ALA C C 13 177.703 0.3 . 1 . . . . . 435 ALA C . 51420 2 343 . 1 . 1 98 98 ALA CA C 13 52.616 0.3 . 1 . . . . . 435 ALA CA . 51420 2 344 . 1 . 1 98 98 ALA N N 15 123.071 0.3 . 1 . . . . . 435 ALA N . 51420 2 stop_ save_