data_25883 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25883 _Entry.Title ; DD homodimer ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-11-07 _Entry.Accession_date 2015-11-07 _Entry.Last_release_date 2015-12-21 _Entry.Original_release_date 2015-12-21 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Zhi Lin . . . 25883 2 Carlos Ibanez . F. . 25883 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25883 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'death domain' . 25883 p75NTR . 25883 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25883 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 284 25883 '15N chemical shifts' 96 25883 '1H chemical shifts' 589 25883 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 . . 2015-12-21 . original BMRB . 25883 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2N97 'BMRB Entry Tracking System' 25883 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25883 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26646181 _Citation.Full_citation . _Citation.Title ; Structural basis of death domain signaling in the p75 neurotrophin receptor ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Elife _Citation.Journal_name_full . _Citation.Journal_volume 4 _Citation.Journal_issue . _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 11692 _Citation.Page_last 11692 _Citation.Year 2015 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Zhi Lin . . . 25883 1 2 Jason Tann . Y. . 25883 1 3 Eddy Goh . TH . 25883 1 4 Claire Kelly . . . 25883 1 5 Kim Lim . B. . 25883 1 6 Jian Gao . F. . 25883 1 7 Carlos Ibanez . F. . 25883 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25883 _Assembly.ID 1 _Assembly.Name 'DD homodimer' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity A . yes native no no . . . 25883 1 2 entity_2 1 $entity B . yes native no no . . . 25883 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 25883 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A,B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GLYSSLPPAKREEVEKLLNG SAGDTWRHLAGELGYQPEHI DSFTHEACPVRALLASWATQ DSATLDALLAALRRIQRADL VESLCSESTATSPV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 94 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10172.424 _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 1 334 GLY . 25883 1 2 335 LEU . 25883 1 3 336 TYR . 25883 1 4 337 SER . 25883 1 5 338 SER . 25883 1 6 339 LEU . 25883 1 7 340 PRO . 25883 1 8 341 PRO . 25883 1 9 342 ALA . 25883 1 10 343 LYS . 25883 1 11 344 ARG . 25883 1 12 345 GLU . 25883 1 13 346 GLU . 25883 1 14 347 VAL . 25883 1 15 348 GLU . 25883 1 16 349 LYS . 25883 1 17 350 LEU . 25883 1 18 351 LEU . 25883 1 19 352 ASN . 25883 1 20 353 GLY . 25883 1 21 354 SER . 25883 1 22 355 ALA . 25883 1 23 356 GLY . 25883 1 24 357 ASP . 25883 1 25 358 THR . 25883 1 26 359 TRP . 25883 1 27 360 ARG . 25883 1 28 361 HIS . 25883 1 29 362 LEU . 25883 1 30 363 ALA . 25883 1 31 364 GLY . 25883 1 32 365 GLU . 25883 1 33 366 LEU . 25883 1 34 367 GLY . 25883 1 35 368 TYR . 25883 1 36 369 GLN . 25883 1 37 370 PRO . 25883 1 38 371 GLU . 25883 1 39 372 HIS . 25883 1 40 373 ILE . 25883 1 41 374 ASP . 25883 1 42 375 SER . 25883 1 43 376 PHE . 25883 1 44 377 THR . 25883 1 45 378 HIS . 25883 1 46 379 GLU . 25883 1 47 380 ALA . 25883 1 48 381 CYS . 25883 1 49 382 PRO . 25883 1 50 383 VAL . 25883 1 51 384 ARG . 25883 1 52 385 ALA . 25883 1 53 386 LEU . 25883 1 54 387 LEU . 25883 1 55 388 ALA . 25883 1 56 389 SER . 25883 1 57 390 TRP . 25883 1 58 391 ALA . 25883 1 59 392 THR . 25883 1 60 393 GLN . 25883 1 61 394 ASP . 25883 1 62 395 SER . 25883 1 63 396 ALA . 25883 1 64 397 THR . 25883 1 65 398 LEU . 25883 1 66 399 ASP . 25883 1 67 400 ALA . 25883 1 68 401 LEU . 25883 1 69 402 LEU . 25883 1 70 403 ALA . 25883 1 71 404 ALA . 25883 1 72 405 LEU . 25883 1 73 406 ARG . 25883 1 74 407 ARG . 25883 1 75 408 ILE . 25883 1 76 409 GLN . 25883 1 77 410 ARG . 25883 1 78 411 ALA . 25883 1 79 412 ASP . 25883 1 80 413 LEU . 25883 1 81 414 VAL . 25883 1 82 415 GLU . 25883 1 83 416 SER . 25883 1 84 417 LEU . 25883 1 85 418 CYS . 25883 1 86 419 SER . 25883 1 87 420 GLU . 25883 1 88 421 SER . 25883 1 89 422 THR . 25883 1 90 423 ALA . 25883 1 91 424 THR . 25883 1 92 425 SER . 25883 1 93 426 PRO . 25883 1 94 427 VAL . 25883 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 . GLY 1 1 25883 1 . LEU 2 2 25883 1 . TYR 3 3 25883 1 . SER 4 4 25883 1 . SER 5 5 25883 1 . LEU 6 6 25883 1 . PRO 7 7 25883 1 . PRO 8 8 25883 1 . ALA 9 9 25883 1 . LYS 10 10 25883 1 . ARG 11 11 25883 1 . GLU 12 12 25883 1 . GLU 13 13 25883 1 . VAL 14 14 25883 1 . GLU 15 15 25883 1 . LYS 16 16 25883 1 . LEU 17 17 25883 1 . LEU 18 18 25883 1 . ASN 19 19 25883 1 . GLY 20 20 25883 1 . SER 21 21 25883 1 . ALA 22 22 25883 1 . GLY 23 23 25883 1 . ASP 24 24 25883 1 . THR 25 25 25883 1 . TRP 26 26 25883 1 . ARG 27 27 25883 1 . HIS 28 28 25883 1 . LEU 29 29 25883 1 . ALA 30 30 25883 1 . GLY 31 31 25883 1 . GLU 32 32 25883 1 . LEU 33 33 25883 1 . GLY 34 34 25883 1 . TYR 35 35 25883 1 . GLN 36 36 25883 1 . PRO 37 37 25883 1 . GLU 38 38 25883 1 . HIS 39 39 25883 1 . ILE 40 40 25883 1 . ASP 41 41 25883 1 . SER 42 42 25883 1 . PHE 43 43 25883 1 . THR 44 44 25883 1 . HIS 45 45 25883 1 . GLU 46 46 25883 1 . ALA 47 47 25883 1 . CYS 48 48 25883 1 . PRO 49 49 25883 1 . VAL 50 50 25883 1 . ARG 51 51 25883 1 . ALA 52 52 25883 1 . LEU 53 53 25883 1 . LEU 54 54 25883 1 . ALA 55 55 25883 1 . SER 56 56 25883 1 . TRP 57 57 25883 1 . ALA 58 58 25883 1 . THR 59 59 25883 1 . GLN 60 60 25883 1 . ASP 61 61 25883 1 . SER 62 62 25883 1 . ALA 63 63 25883 1 . THR 64 64 25883 1 . LEU 65 65 25883 1 . ASP 66 66 25883 1 . ALA 67 67 25883 1 . LEU 68 68 25883 1 . LEU 69 69 25883 1 . ALA 70 70 25883 1 . ALA 71 71 25883 1 . LEU 72 72 25883 1 . ARG 73 73 25883 1 . ARG 74 74 25883 1 . ILE 75 75 25883 1 . GLN 76 76 25883 1 . ARG 77 77 25883 1 . ALA 78 78 25883 1 . ASP 79 79 25883 1 . LEU 80 80 25883 1 . VAL 81 81 25883 1 . GLU 82 82 25883 1 . SER 83 83 25883 1 . LEU 84 84 25883 1 . CYS 85 85 25883 1 . SER 86 86 25883 1 . GLU 87 87 25883 1 . SER 88 88 25883 1 . THR 89 89 25883 1 . ALA 90 90 25883 1 . THR 91 91 25883 1 . SER 92 92 25883 1 . PRO 93 93 25883 1 . VAL 94 94 25883 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25883 _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 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25883 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 25883 _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 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET32a-derived . . . 25883 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25883 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'p75NTR DD' '[U-99% 13C; U-99% 15N]' . . 1 $entity . . 1 . . mM . . . . 25883 1 2 DTT '[U-98% 2H]' . . . . . . 10 . . mM . . . . 25883 1 3 'p75NTR DD' 'natural abundance' . . 1 $entity . . 1 . . mM . . . . 25883 1 4 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 25883 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 25883 1 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 25883 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 25883 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.9 . pH 25883 1 pressure 1 . atm 25883 1 temperature 273 . K 25883 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25883 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25883 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25883 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 25883 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 25883 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25883 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25883 _Software.ID 3 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Braun and Wuthrich' . . 25883 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25883 3 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 25883 _Software.ID 4 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 25883 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25883 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25883 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25883 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 25883 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 25883 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 7 '3D 13C,15N-filtered NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 8 '3D 13C, 15N-edited NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 10 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 11 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 12 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 13 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 14 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 15 '3D 13C,15N-filtered NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 16 '4D 13C, 15N-edited NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25883 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25883 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 25883 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 external direct 1.000000000 . . . . . . . . . 25883 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 25883 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25883 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25883 1 2 '2D 1H-13C HSQC aliphatic' . . . 25883 1 3 '2D 1H-13C HSQC aromatic' . . . 25883 1 4 '3D HNCACB' . . . 25883 1 5 '3D CBCA(CO)NH' . . . 25883 1 6 '3D HCCH-TOCSY' . . . 25883 1 7 '3D 13C,15N-filtered NOESY' . . . 25883 1 8 '3D 13C, 15N-edited NOESY' . . . 25883 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY H H 1 8.420 0.02 . 1 . . . A 334 GLY HN . 25883 1 2 . 1 1 1 1 GLY HA2 H 1 4.020 0.02 . 2 . . . A 334 GLY HA2 . 25883 1 3 . 1 1 1 1 GLY HA3 H 1 4.020 0.02 . 2 . . . A 334 GLY HA3 . 25883 1 4 . 1 1 1 1 GLY CA C 13 44.719 0.2 . 1 . . . A 334 GLY CA . 25883 1 5 . 1 1 1 1 GLY N N 15 108.174 0.1 . 1 . . . A 334 GLY N . 25883 1 6 . 1 1 2 2 LEU H H 1 8.199 0.02 . 1 . . . A 335 LEU H . 25883 1 7 . 1 1 2 2 LEU HA H 1 4.287 0.02 . 1 . . . A 335 LEU HA . 25883 1 8 . 1 1 2 2 LEU HB2 H 1 1.873 0.02 . 2 . . . A 335 LEU HB2 . 25883 1 9 . 1 1 2 2 LEU HB3 H 1 1.660 0.02 . 2 . . . A 335 LEU HB3 . 25883 1 10 . 1 1 2 2 LEU HG H 1 1.691 0.02 . 1 . . . A 335 LEU HG . 25883 1 11 . 1 1 2 2 LEU HD11 H 1 0.900 0.02 . 2 . . . A 335 LEU HD11 . 25883 1 12 . 1 1 2 2 LEU HD12 H 1 0.900 0.02 . 2 . . . A 335 LEU HD12 . 25883 1 13 . 1 1 2 2 LEU HD13 H 1 0.900 0.02 . 2 . . . A 335 LEU HD13 . 25883 1 14 . 1 1 2 2 LEU HD21 H 1 0.780 0.02 . 2 . . . A 335 LEU HD21 . 25883 1 15 . 1 1 2 2 LEU HD22 H 1 0.780 0.02 . 2 . . . A 335 LEU HD22 . 25883 1 16 . 1 1 2 2 LEU HD23 H 1 0.780 0.02 . 2 . . . A 335 LEU HD23 . 25883 1 17 . 1 1 2 2 LEU CA C 13 55.162 0.2 . 1 . . . A 335 LEU CA . 25883 1 18 . 1 1 2 2 LEU CB C 13 41.170 0.2 . 1 . . . A 335 LEU CB . 25883 1 19 . 1 1 2 2 LEU CG C 13 26.720 0.2 . 1 . . . A 335 LEU CG . 25883 1 20 . 1 1 2 2 LEU CD1 C 13 24.738 0.2 . 1 . . . A 335 LEU CD1 . 25883 1 21 . 1 1 2 2 LEU CD2 C 13 22.300 0.2 . 1 . . . A 335 LEU CD2 . 25883 1 22 . 1 1 2 2 LEU N N 15 120.620 0.1 . 1 . . . A 335 LEU N . 25883 1 23 . 1 1 3 3 TYR H H 1 8.905 0.02 . 1 . . . A 336 TYR H . 25883 1 24 . 1 1 3 3 TYR HA H 1 4.089 0.02 . 1 . . . A 336 TYR HA . 25883 1 25 . 1 1 3 3 TYR HB2 H 1 3.044 0.02 . 2 . . . A 336 TYR HB2 . 25883 1 26 . 1 1 3 3 TYR HB3 H 1 2.888 0.02 . 2 . . . A 336 TYR HB3 . 25883 1 27 . 1 1 3 3 TYR HD1 H 1 6.950 0.02 . 3 . . . A 336 TYR HD1 . 25883 1 28 . 1 1 3 3 TYR HE1 H 1 6.668 0.02 . 3 . . . A 336 TYR HE1 . 25883 1 29 . 1 1 3 3 TYR CA C 13 61.763 0.2 . 1 . . . A 336 TYR CA . 25883 1 30 . 1 1 3 3 TYR CB C 13 38.965 0.2 . 1 . . . A 336 TYR CB . 25883 1 31 . 1 1 3 3 TYR CD1 C 13 132.300 0.2 . 3 . . . A 336 TYR CD1 . 25883 1 32 . 1 1 3 3 TYR CE1 C 13 117.080 0.2 . 3 . . . A 336 TYR CE1 . 25883 1 33 . 1 1 3 3 TYR N N 15 126.786 0.1 . 1 . . . A 336 TYR N . 25883 1 34 . 1 1 4 4 SER H H 1 9.291 0.02 . 1 . . . A 337 SER H . 25883 1 35 . 1 1 4 4 SER HA H 1 4.027 0.02 . 1 . . . A 337 SER HA . 25883 1 36 . 1 1 4 4 SER HB2 H 1 3.922 0.02 . 2 . . . A 337 SER HB2 . 25883 1 37 . 1 1 4 4 SER HB3 H 1 3.922 0.02 . 2 . . . A 337 SER HB3 . 25883 1 38 . 1 1 4 4 SER CA C 13 59.545 0.2 . 1 . . . A 337 SER CA . 25883 1 39 . 1 1 4 4 SER CB C 13 62.530 0.2 . 1 . . . A 337 SER CB . 25883 1 40 . 1 1 4 4 SER N N 15 111.277 0.1 . 1 . . . A 337 SER N . 25883 1 41 . 1 1 5 5 SER H H 1 7.519 0.02 . 1 . . . A 338 SER H . 25883 1 42 . 1 1 5 5 SER HA H 1 4.511 0.02 . 1 . . . A 338 SER HA . 25883 1 43 . 1 1 5 5 SER HB2 H 1 4.008 0.02 . 2 . . . A 338 SER HB2 . 25883 1 44 . 1 1 5 5 SER HB3 H 1 4.008 0.02 . 2 . . . A 338 SER HB3 . 25883 1 45 . 1 1 5 5 SER CA C 13 58.349 0.2 . 1 . . . A 338 SER CA . 25883 1 46 . 1 1 5 5 SER CB C 13 63.785 0.2 . 1 . . . A 338 SER CB . 25883 1 47 . 1 1 5 5 SER N N 15 115.966 0.1 . 1 . . . A 338 SER N . 25883 1 48 . 1 1 6 6 LEU H H 1 7.593 0.02 . 1 . . . A 339 LEU H . 25883 1 49 . 1 1 6 6 LEU CA C 13 53.084 0.2 . 1 . . . A 339 LEU CA . 25883 1 50 . 1 1 6 6 LEU CB C 13 41.356 0.2 . 1 . . . A 339 LEU CB . 25883 1 51 . 1 1 6 6 LEU N N 15 124.049 0.1 . 1 . . . A 339 LEU N . 25883 1 52 . 1 1 8 8 PRO HA H 1 4.033 0.02 . 1 . . . A 341 PRO HA . 25883 1 53 . 1 1 8 8 PRO HB2 H 1 2.030 0.02 . 2 . . . A 341 PRO HB2 . 25883 1 54 . 1 1 8 8 PRO HB3 H 1 2.394 0.02 . 2 . . . A 341 PRO HB3 . 25883 1 55 . 1 1 8 8 PRO HG2 H 1 2.080 0.02 . 2 . . . A 341 PRO HG2 . 25883 1 56 . 1 1 8 8 PRO HG3 H 1 2.227 0.02 . 2 . . . A 341 PRO HG3 . 25883 1 57 . 1 1 8 8 PRO HD2 H 1 3.875 0.02 . 2 . . . A 341 PRO HD2 . 25883 1 58 . 1 1 8 8 PRO HD3 H 1 3.875 0.02 . 2 . . . A 341 PRO HD3 . 25883 1 59 . 1 1 8 8 PRO CA C 13 65.596 0.2 . 1 . . . A 341 PRO CA . 25883 1 60 . 1 1 8 8 PRO CB C 13 31.370 0.2 . 1 . . . A 341 PRO CB . 25883 1 61 . 1 1 8 8 PRO CG C 13 27.023 0.2 . 1 . . . A 341 PRO CG . 25883 1 62 . 1 1 8 8 PRO CD C 13 50.200 0.2 . 1 . . . A 341 PRO CD . 25883 1 63 . 1 1 9 9 ALA H H 1 8.656 0.02 . 1 . . . A 342 ALA H . 25883 1 64 . 1 1 9 9 ALA HA H 1 4.194 0.02 . 1 . . . A 342 ALA HA . 25883 1 65 . 1 1 9 9 ALA HB1 H 1 1.442 0.02 . 1 . . . A 342 ALA HB1 . 25883 1 66 . 1 1 9 9 ALA HB2 H 1 1.442 0.02 . 1 . . . A 342 ALA HB2 . 25883 1 67 . 1 1 9 9 ALA HB3 H 1 1.442 0.02 . 1 . . . A 342 ALA HB3 . 25883 1 68 . 1 1 9 9 ALA CA C 13 54.703 0.2 . 1 . . . A 342 ALA CA . 25883 1 69 . 1 1 9 9 ALA CB C 13 18.052 0.2 . 1 . . . A 342 ALA CB . 25883 1 70 . 1 1 9 9 ALA N N 15 117.577 0.1 . 1 . . . A 342 ALA N . 25883 1 71 . 1 1 10 10 LYS H H 1 7.273 0.02 . 1 . . . A 343 LYS H . 25883 1 72 . 1 1 10 10 LYS HA H 1 4.341 0.02 . 1 . . . A 343 LYS HA . 25883 1 73 . 1 1 10 10 LYS HB2 H 1 1.941 0.02 . 2 . . . A 343 LYS HB2 . 25883 1 74 . 1 1 10 10 LYS HB3 H 1 1.941 0.02 . 2 . . . A 343 LYS HB3 . 25883 1 75 . 1 1 10 10 LYS HG2 H 1 1.482 0.02 . 2 . . . A 343 LYS HG2 . 25883 1 76 . 1 1 10 10 LYS HG3 H 1 1.613 0.02 . 2 . . . A 343 LYS HG3 . 25883 1 77 . 1 1 10 10 LYS HD2 H 1 1.803 0.02 . 2 . . . A 343 LYS HD2 . 25883 1 78 . 1 1 10 10 LYS HD3 H 1 1.803 0.02 . 2 . . . A 343 LYS HD3 . 25883 1 79 . 1 1 10 10 LYS HE2 H 1 3.000 0.02 . 2 . . . A 343 LYS HE2 . 25883 1 80 . 1 1 10 10 LYS HE3 H 1 2.910 0.02 . 2 . . . A 343 LYS HE3 . 25883 1 81 . 1 1 10 10 LYS CA C 13 56.547 0.2 . 1 . . . A 343 LYS CA . 25883 1 82 . 1 1 10 10 LYS CB C 13 31.345 0.2 . 1 . . . A 343 LYS CB . 25883 1 83 . 1 1 10 10 LYS CG C 13 24.188 0.2 . 1 . . . A 343 LYS CG . 25883 1 84 . 1 1 10 10 LYS CD C 13 27.523 0.2 . 1 . . . A 343 LYS CD . 25883 1 85 . 1 1 10 10 LYS CE C 13 41.459 0.2 . 1 . . . A 343 LYS CE . 25883 1 86 . 1 1 10 10 LYS N N 15 117.177 0.1 . 1 . . . A 343 LYS N . 25883 1 87 . 1 1 11 11 ARG H H 1 7.583 0.02 . 1 . . . A 344 ARG H . 25883 1 88 . 1 1 11 11 ARG HA H 1 3.870 0.02 . 1 . . . A 344 ARG HA . 25883 1 89 . 1 1 11 11 ARG HB2 H 1 1.970 0.02 . 2 . . . A 344 ARG HB2 . 25883 1 90 . 1 1 11 11 ARG HB3 H 1 1.728 0.02 . 2 . . . A 344 ARG HB3 . 25883 1 91 . 1 1 11 11 ARG HG2 H 1 1.346 0.02 . 2 . . . A 344 ARG HG2 . 25883 1 92 . 1 1 11 11 ARG HG3 H 1 1.105 0.02 . 2 . . . A 344 ARG HG3 . 25883 1 93 . 1 1 11 11 ARG HD2 H 1 2.913 0.02 . 2 . . . A 344 ARG HD2 . 25883 1 94 . 1 1 11 11 ARG HD3 H 1 3.030 0.02 . 2 . . . A 344 ARG HD3 . 25883 1 95 . 1 1 11 11 ARG CA C 13 59.977 0.2 . 1 . . . A 344 ARG CA . 25883 1 96 . 1 1 11 11 ARG CB C 13 29.711 0.2 . 1 . . . A 344 ARG CB . 25883 1 97 . 1 1 11 11 ARG CG C 13 29.200 0.2 . 1 . . . A 344 ARG CG . 25883 1 98 . 1 1 11 11 ARG CD C 13 42.990 0.2 . 1 . . . A 344 ARG CD . 25883 1 99 . 1 1 11 11 ARG N N 15 118.906 0.1 . 1 . . . A 344 ARG N . 25883 1 100 . 1 1 12 12 GLU H H 1 8.221 0.02 . 1 . . . A 345 GLU H . 25883 1 101 . 1 1 12 12 GLU HA H 1 3.956 0.02 . 1 . . . A 345 GLU HA . 25883 1 102 . 1 1 12 12 GLU HB2 H 1 2.050 0.02 . 2 . . . A 345 GLU HB2 . 25883 1 103 . 1 1 12 12 GLU HB3 H 1 2.065 0.02 . 2 . . . A 345 GLU HB3 . 25883 1 104 . 1 1 12 12 GLU HG2 H 1 2.232 0.02 . 2 . . . A 345 GLU HG2 . 25883 1 105 . 1 1 12 12 GLU HG3 H 1 2.375 0.02 . 2 . . . A 345 GLU HG3 . 25883 1 106 . 1 1 12 12 GLU CA C 13 59.016 0.2 . 1 . . . A 345 GLU CA . 25883 1 107 . 1 1 12 12 GLU CB C 13 29.000 0.2 . 1 . . . A 345 GLU CB . 25883 1 108 . 1 1 12 12 GLU CG C 13 36.166 0.2 . 1 . . . A 345 GLU CG . 25883 1 109 . 1 1 12 12 GLU N N 15 117.580 0.1 . 1 . . . A 345 GLU N . 25883 1 110 . 1 1 13 13 GLU H H 1 7.372 0.02 . 1 . . . A 346 GLU H . 25883 1 111 . 1 1 13 13 GLU HA H 1 4.039 0.02 . 1 . . . A 346 GLU HA . 25883 1 112 . 1 1 13 13 GLU HB2 H 1 2.258 0.02 . 2 . . . A 346 GLU HB2 . 25883 1 113 . 1 1 13 13 GLU HB3 H 1 2.258 0.02 . 2 . . . A 346 GLU HB3 . 25883 1 114 . 1 1 13 13 GLU HG2 H 1 2.441 0.02 . 2 . . . A 346 GLU HG2 . 25883 1 115 . 1 1 13 13 GLU HG3 H 1 2.250 0.02 . 2 . . . A 346 GLU HG3 . 25883 1 116 . 1 1 13 13 GLU CA C 13 59.074 0.2 . 1 . . . A 346 GLU CA . 25883 1 117 . 1 1 13 13 GLU CB C 13 29.385 0.2 . 1 . . . A 346 GLU CB . 25883 1 118 . 1 1 13 13 GLU CG C 13 35.657 0.2 . 1 . . . A 346 GLU CG . 25883 1 119 . 1 1 13 13 GLU N N 15 119.310 0.1 . 1 . . . A 346 GLU N . 25883 1 120 . 1 1 14 14 VAL H H 1 7.974 0.02 . 1 . . . A 347 VAL H . 25883 1 121 . 1 1 14 14 VAL HA H 1 3.503 0.02 . 1 . . . A 347 VAL HA . 25883 1 122 . 1 1 14 14 VAL HB H 1 2.508 0.02 . 1 . . . A 347 VAL HB . 25883 1 123 . 1 1 14 14 VAL HG11 H 1 0.940 0.02 . 2 . . . A 347 VAL HG11 . 25883 1 124 . 1 1 14 14 VAL HG12 H 1 0.940 0.02 . 2 . . . A 347 VAL HG12 . 25883 1 125 . 1 1 14 14 VAL HG13 H 1 0.940 0.02 . 2 . . . A 347 VAL HG13 . 25883 1 126 . 1 1 14 14 VAL HG21 H 1 1.113 0.02 . 2 . . . A 347 VAL HG21 . 25883 1 127 . 1 1 14 14 VAL HG22 H 1 1.113 0.02 . 2 . . . A 347 VAL HG22 . 25883 1 128 . 1 1 14 14 VAL HG23 H 1 1.113 0.02 . 2 . . . A 347 VAL HG23 . 25883 1 129 . 1 1 14 14 VAL CA C 13 66.670 0.2 . 1 . . . A 347 VAL CA . 25883 1 130 . 1 1 14 14 VAL CB C 13 31.000 0.2 . 1 . . . A 347 VAL CB . 25883 1 131 . 1 1 14 14 VAL CG1 C 13 21.624 0.2 . 1 . . . A 347 VAL CG1 . 25883 1 132 . 1 1 14 14 VAL CG2 C 13 22.450 0.2 . 1 . . . A 347 VAL CG2 . 25883 1 133 . 1 1 14 14 VAL N N 15 119.380 0.1 . 1 . . . A 347 VAL N . 25883 1 134 . 1 1 15 15 GLU H H 1 8.054 0.02 . 1 . . . A 348 GLU H . 25883 1 135 . 1 1 15 15 GLU HA H 1 3.565 0.02 . 1 . . . A 348 GLU HA . 25883 1 136 . 1 1 15 15 GLU HB2 H 1 1.832 0.02 . 2 . . . A 348 GLU HB2 . 25883 1 137 . 1 1 15 15 GLU HB3 H 1 2.093 0.02 . 2 . . . A 348 GLU HB3 . 25883 1 138 . 1 1 15 15 GLU HG2 H 1 2.586 0.02 . 2 . . . A 348 GLU HG2 . 25883 1 139 . 1 1 15 15 GLU HG3 H 1 2.030 0.02 . 2 . . . A 348 GLU HG3 . 25883 1 140 . 1 1 15 15 GLU CA C 13 59.438 0.2 . 1 . . . A 348 GLU CA . 25883 1 141 . 1 1 15 15 GLU CB C 13 28.833 0.2 . 1 . . . A 348 GLU CB . 25883 1 142 . 1 1 15 15 GLU CG C 13 36.932 0.2 . 1 . . . A 348 GLU CG . 25883 1 143 . 1 1 15 15 GLU N N 15 116.894 0.1 . 1 . . . A 348 GLU N . 25883 1 144 . 1 1 16 16 LYS H H 1 7.818 0.02 . 1 . . . A 349 LYS H . 25883 1 145 . 1 1 16 16 LYS HA H 1 4.032 0.02 . 1 . . . A 349 LYS HA . 25883 1 146 . 1 1 16 16 LYS HB2 H 1 1.949 0.02 . 2 . . . A 349 LYS HB2 . 25883 1 147 . 1 1 16 16 LYS HB3 H 1 1.949 0.02 . 2 . . . A 349 LYS HB3 . 25883 1 148 . 1 1 16 16 LYS HG2 H 1 1.450 0.02 . 2 . . . A 349 LYS HG2 . 25883 1 149 . 1 1 16 16 LYS HG3 H 1 1.670 0.02 . 2 . . . A 349 LYS HG3 . 25883 1 150 . 1 1 16 16 LYS HD2 H 1 1.710 0.02 . 2 . . . A 349 LYS HD2 . 25883 1 151 . 1 1 16 16 LYS HE2 H 1 2.980 0.02 . 2 . . . A 349 LYS HE2 . 25883 1 152 . 1 1 16 16 LYS HE3 H 1 2.980 0.02 . 2 . . . A 349 LYS HE3 . 25883 1 153 . 1 1 16 16 LYS CA C 13 58.827 0.2 . 1 . . . A 349 LYS CA . 25883 1 154 . 1 1 16 16 LYS CB C 13 32.188 0.2 . 1 . . . A 349 LYS CB . 25883 1 155 . 1 1 16 16 LYS CG C 13 24.955 0.2 . 1 . . . A 349 LYS CG . 25883 1 156 . 1 1 16 16 LYS CD C 13 29.100 0.2 . 1 . . . A 349 LYS CD . 25883 1 157 . 1 1 16 16 LYS CE C 13 41.714 0.2 . 1 . . . A 349 LYS CE . 25883 1 158 . 1 1 16 16 LYS N N 15 116.820 0.1 . 1 . . . A 349 LYS N . 25883 1 159 . 1 1 17 17 LEU H H 1 7.922 0.02 . 1 . . . A 350 LEU H . 25883 1 160 . 1 1 17 17 LEU HA H 1 4.214 0.02 . 1 . . . A 350 LEU HA . 25883 1 161 . 1 1 17 17 LEU HB2 H 1 1.946 0.02 . 2 . . . A 350 LEU HB2 . 25883 1 162 . 1 1 17 17 LEU HB3 H 1 1.587 0.02 . 2 . . . A 350 LEU HB3 . 25883 1 163 . 1 1 17 17 LEU HG H 1 1.900 0.02 . 1 . . . A 350 LEU HG . 25883 1 164 . 1 1 17 17 LEU HD11 H 1 0.927 0.02 . 2 . . . A 350 LEU HD11 . 25883 1 165 . 1 1 17 17 LEU HD12 H 1 0.927 0.02 . 2 . . . A 350 LEU HD12 . 25883 1 166 . 1 1 17 17 LEU HD13 H 1 0.927 0.02 . 2 . . . A 350 LEU HD13 . 25883 1 167 . 1 1 17 17 LEU HD21 H 1 0.927 0.02 . 2 . . . A 350 LEU HD21 . 25883 1 168 . 1 1 17 17 LEU HD22 H 1 0.927 0.02 . 2 . . . A 350 LEU HD22 . 25883 1 169 . 1 1 17 17 LEU HD23 H 1 0.927 0.02 . 2 . . . A 350 LEU HD23 . 25883 1 170 . 1 1 17 17 LEU CA C 13 56.421 0.2 . 1 . . . A 350 LEU CA . 25883 1 171 . 1 1 17 17 LEU CB C 13 42.000 0.2 . 1 . . . A 350 LEU CB . 25883 1 172 . 1 1 17 17 LEU CG C 13 26.549 0.2 . 1 . . . A 350 LEU CG . 25883 1 173 . 1 1 17 17 LEU CD1 C 13 24.901 0.2 . 1 . . . A 350 LEU CD1 . 25883 1 174 . 1 1 17 17 LEU CD2 C 13 23.030 0.2 . 1 . . . A 350 LEU CD2 . 25883 1 175 . 1 1 17 17 LEU N N 15 119.412 0.1 . 1 . . . A 350 LEU N . 25883 1 176 . 1 1 18 18 LEU H H 1 7.519 0.02 . 1 . . . A 351 LEU H . 25883 1 177 . 1 1 18 18 LEU HA H 1 4.322 0.02 . 1 . . . A 351 LEU HA . 25883 1 178 . 1 1 18 18 LEU HB2 H 1 1.700 0.02 . 2 . . . A 351 LEU HB2 . 25883 1 179 . 1 1 18 18 LEU HB3 H 1 1.638 0.02 . 2 . . . A 351 LEU HB3 . 25883 1 180 . 1 1 18 18 LEU HG H 1 1.689 0.02 . 1 . . . A 351 LEU HG . 25883 1 181 . 1 1 18 18 LEU HD11 H 1 0.740 0.02 . 2 . . . A 351 LEU HD11 . 25883 1 182 . 1 1 18 18 LEU HD12 H 1 0.740 0.02 . 2 . . . A 351 LEU HD12 . 25883 1 183 . 1 1 18 18 LEU HD13 H 1 0.740 0.02 . 2 . . . A 351 LEU HD13 . 25883 1 184 . 1 1 18 18 LEU HD21 H 1 0.750 0.02 . 2 . . . A 351 LEU HD21 . 25883 1 185 . 1 1 18 18 LEU HD22 H 1 0.750 0.02 . 2 . . . A 351 LEU HD22 . 25883 1 186 . 1 1 18 18 LEU HD23 H 1 0.750 0.02 . 2 . . . A 351 LEU HD23 . 25883 1 187 . 1 1 18 18 LEU CA C 13 54.455 0.2 . 1 . . . A 351 LEU CA . 25883 1 188 . 1 1 18 18 LEU CB C 13 42.453 0.2 . 1 . . . A 351 LEU CB . 25883 1 189 . 1 1 18 18 LEU CG C 13 26.463 0.2 . 1 . . . A 351 LEU CG . 25883 1 190 . 1 1 18 18 LEU CD1 C 13 25.512 0.2 . 1 . . . A 351 LEU CD1 . 25883 1 191 . 1 1 18 18 LEU CD2 C 13 23.631 0.2 . 1 . . . A 351 LEU CD2 . 25883 1 192 . 1 1 18 18 LEU N N 15 117.000 0.1 . 1 . . . A 351 LEU N . 25883 1 193 . 1 1 19 19 ASN H H 1 7.237 0.02 . 1 . . . A 352 ASN H . 25883 1 194 . 1 1 19 19 ASN HA H 1 4.640 0.02 . 1 . . . A 352 ASN HA . 25883 1 195 . 1 1 19 19 ASN HB2 H 1 2.690 0.02 . 2 . . . A 352 ASN HB2 . 25883 1 196 . 1 1 19 19 ASN HB3 H 1 2.832 0.02 . 2 . . . A 352 ASN HB3 . 25883 1 197 . 1 1 19 19 ASN HD21 H 1 7.643 0.02 . 2 . . . A 352 ASN HD21 . 25883 1 198 . 1 1 19 19 ASN HD22 H 1 6.740 0.02 . 2 . . . A 352 ASN HD22 . 25883 1 199 . 1 1 19 19 ASN CA C 13 54.573 0.2 . 1 . . . A 352 ASN CA . 25883 1 200 . 1 1 19 19 ASN CB C 13 41.100 0.2 . 1 . . . A 352 ASN CB . 25883 1 201 . 1 1 19 19 ASN N N 15 122.679 0.1 . 1 . . . A 352 ASN N . 25883 1 202 . 1 1 19 19 ASN ND2 N 15 112.824 0.1 . 1 . . . A 352 ASN ND2 . 25883 1 203 . 1 1 20 20 GLY H H 1 8.638 0.02 . 1 . . . A 353 GLY H . 25883 1 204 . 1 1 20 20 GLY HA2 H 1 4.700 0.02 . 2 . . . A 353 GLY HA2 . 25883 1 205 . 1 1 20 20 GLY CA C 13 45.340 0.2 . 1 . . . A 353 GLY CA . 25883 1 206 . 1 1 20 20 GLY N N 15 115.977 0.1 . 1 . . . A 353 GLY N . 25883 1 207 . 1 1 21 21 SER H H 1 8.800 0.02 . 1 . . . A 354 SER H . 25883 1 208 . 1 1 21 21 SER HA H 1 4.640 0.02 . 1 . . . A 354 SER HA . 25883 1 209 . 1 1 21 21 SER HB2 H 1 4.179 0.02 . 2 . . . A 354 SER HB2 . 25883 1 210 . 1 1 21 21 SER HB3 H 1 4.063 0.02 . 2 . . . A 354 SER HB3 . 25883 1 211 . 1 1 21 21 SER CA C 13 58.437 0.2 . 1 . . . A 354 SER CA . 25883 1 212 . 1 1 21 21 SER CB C 13 64.586 0.2 . 1 . . . A 354 SER CB . 25883 1 213 . 1 1 21 21 SER N N 15 117.878 0.1 . 1 . . . A 354 SER N . 25883 1 214 . 1 1 22 22 ALA H H 1 8.404 0.02 . 1 . . . A 355 ALA H . 25883 1 215 . 1 1 22 22 ALA HA H 1 4.551 0.02 . 1 . . . A 355 ALA HA . 25883 1 216 . 1 1 22 22 ALA HB1 H 1 1.545 0.02 . 1 . . . A 355 ALA HB1 . 25883 1 217 . 1 1 22 22 ALA HB2 H 1 1.545 0.02 . 1 . . . A 355 ALA HB2 . 25883 1 218 . 1 1 22 22 ALA HB3 H 1 1.545 0.02 . 1 . . . A 355 ALA HB3 . 25883 1 219 . 1 1 22 22 ALA CA C 13 52.133 0.2 . 1 . . . A 355 ALA CA . 25883 1 220 . 1 1 22 22 ALA CB C 13 17.908 0.2 . 1 . . . A 355 ALA CB . 25883 1 221 . 1 1 22 22 ALA N N 15 122.760 0.1 . 1 . . . A 355 ALA N . 25883 1 222 . 1 1 23 23 GLY H H 1 8.379 0.02 . 1 . . . A 356 GLY H . 25883 1 223 . 1 1 23 23 GLY CA C 13 45.200 0.2 . 1 . . . A 356 GLY CA . 25883 1 224 . 1 1 23 23 GLY N N 15 107.748 0.1 . 1 . . . A 356 GLY N . 25883 1 225 . 1 1 24 24 ASP H H 1 8.260 0.02 . 1 . . . A 357 ASP H . 25883 1 226 . 1 1 24 24 ASP HA H 1 4.545 0.02 . 1 . . . A 357 ASP HA . 25883 1 227 . 1 1 24 24 ASP HB2 H 1 2.546 0.02 . 2 . . . A 357 ASP HB2 . 25883 1 228 . 1 1 24 24 ASP HB3 H 1 2.546 0.02 . 2 . . . A 357 ASP HB3 . 25883 1 229 . 1 1 24 24 ASP CA C 13 53.839 0.2 . 1 . . . A 357 ASP CA . 25883 1 230 . 1 1 24 24 ASP CB C 13 40.902 0.2 . 1 . . . A 357 ASP CB . 25883 1 231 . 1 1 24 24 ASP N N 15 117.021 0.1 . 1 . . . A 357 ASP N . 25883 1 232 . 1 1 25 25 THR H H 1 8.130 0.02 . 1 . . . A 358 THR H . 25883 1 233 . 1 1 25 25 THR HA H 1 3.796 0.02 . 1 . . . A 358 THR HA . 25883 1 234 . 1 1 25 25 THR HB H 1 4.320 0.02 . 1 . . . A 358 THR HB . 25883 1 235 . 1 1 25 25 THR HG21 H 1 1.140 0.02 . 1 . . . A 358 THR HG21 . 25883 1 236 . 1 1 25 25 THR HG22 H 1 1.140 0.02 . 1 . . . A 358 THR HG22 . 25883 1 237 . 1 1 25 25 THR HG23 H 1 1.140 0.02 . 1 . . . A 358 THR HG23 . 25883 1 238 . 1 1 25 25 THR CA C 13 67.200 0.2 . 1 . . . A 358 THR CA . 25883 1 239 . 1 1 25 25 THR CB C 13 67.500 0.2 . 1 . . . A 358 THR CB . 25883 1 240 . 1 1 25 25 THR CG2 C 13 21.480 0.2 . 1 . . . A 358 THR CG2 . 25883 1 241 . 1 1 25 25 THR N N 15 118.470 0.1 . 1 . . . A 358 THR N . 25883 1 242 . 1 1 26 26 TRP H H 1 8.612 0.02 . 1 . . . A 359 TRP H . 25883 1 243 . 1 1 26 26 TRP HA H 1 3.965 0.02 . 1 . . . A 359 TRP HA . 25883 1 244 . 1 1 26 26 TRP HB2 H 1 3.104 0.02 . 2 . . . A 359 TRP HB2 . 25883 1 245 . 1 1 26 26 TRP HB3 H 1 3.261 0.02 . 2 . . . A 359 TRP HB3 . 25883 1 246 . 1 1 26 26 TRP HD1 H 1 7.680 0.02 . 1 . . . A 359 TRP HD1 . 25883 1 247 . 1 1 26 26 TRP HE1 H 1 10.387 0.02 . 1 . . . A 359 TRP HE1 . 25883 1 248 . 1 1 26 26 TRP CA C 13 59.400 0.2 . 1 . . . A 359 TRP CA . 25883 1 249 . 1 1 26 26 TRP CB C 13 26.700 0.2 . 1 . . . A 359 TRP CB . 25883 1 250 . 1 1 26 26 TRP CD1 C 13 126.800 0.2 . 1 . . . A 359 TRP CD1 . 25883 1 251 . 1 1 26 26 TRP N N 15 118.128 0.1 . 1 . . . A 359 TRP N . 25883 1 252 . 1 1 26 26 TRP NE1 N 15 130.585 0.1 . 1 . . . A 359 TRP NE1 . 25883 1 253 . 1 1 27 27 ARG H H 1 6.248 0.02 . 1 . . . A 360 ARG H . 25883 1 254 . 1 1 27 27 ARG HA H 1 3.013 0.02 . 1 . . . A 360 ARG HA . 25883 1 255 . 1 1 27 27 ARG HB2 H 1 1.098 0.02 . 2 . . . A 360 ARG HB2 . 25883 1 256 . 1 1 27 27 ARG HB3 H 1 0.820 0.02 . 2 . . . A 360 ARG HB3 . 25883 1 257 . 1 1 27 27 ARG HG2 H 1 0.040 0.02 . 2 . . . A 360 ARG HG2 . 25883 1 258 . 1 1 27 27 ARG HG3 H 1 0.075 0.02 . 2 . . . A 360 ARG HG3 . 25883 1 259 . 1 1 27 27 ARG HD2 H 1 2.797 0.02 . 2 . . . A 360 ARG HD2 . 25883 1 260 . 1 1 27 27 ARG HD3 H 1 2.797 0.02 . 2 . . . A 360 ARG HD3 . 25883 1 261 . 1 1 27 27 ARG CA C 13 58.952 0.2 . 1 . . . A 360 ARG CA . 25883 1 262 . 1 1 27 27 ARG CB C 13 28.955 0.2 . 1 . . . A 360 ARG CB . 25883 1 263 . 1 1 27 27 ARG CG C 13 26.469 0.2 . 1 . . . A 360 ARG CG . 25883 1 264 . 1 1 27 27 ARG CD C 13 42.400 0.2 . 1 . . . A 360 ARG CD . 25883 1 265 . 1 1 27 27 ARG N N 15 122.540 0.1 . 1 . . . A 360 ARG N . 25883 1 266 . 1 1 28 28 HIS H H 1 7.262 0.02 . 1 . . . A 361 HIS H . 25883 1 267 . 1 1 28 28 HIS HA H 1 4.390 0.02 . 1 . . . A 361 HIS HA . 25883 1 268 . 1 1 28 28 HIS HB2 H 1 3.161 0.02 . 2 . . . A 361 HIS HB2 . 25883 1 269 . 1 1 28 28 HIS HB3 H 1 3.161 0.02 . 2 . . . A 361 HIS HB3 . 25883 1 270 . 1 1 28 28 HIS CA C 13 57.400 0.2 . 1 . . . A 361 HIS CA . 25883 1 271 . 1 1 28 28 HIS CB C 13 29.820 0.2 . 1 . . . A 361 HIS CB . 25883 1 272 . 1 1 28 28 HIS N N 15 120.330 0.1 . 1 . . . A 361 HIS N . 25883 1 273 . 1 1 29 29 LEU H H 1 8.428 0.02 . 1 . . . A 362 LEU H . 25883 1 274 . 1 1 29 29 LEU HA H 1 3.818 0.02 . 1 . . . A 362 LEU HA . 25883 1 275 . 1 1 29 29 LEU HB2 H 1 1.862 0.02 . 2 . . . A 362 LEU HB2 . 25883 1 276 . 1 1 29 29 LEU HB3 H 1 1.259 0.02 . 2 . . . A 362 LEU HB3 . 25883 1 277 . 1 1 29 29 LEU HD11 H 1 0.603 0.02 . 2 . . . A 362 LEU HD11 . 25883 1 278 . 1 1 29 29 LEU HD12 H 1 0.603 0.02 . 2 . . . A 362 LEU HD12 . 25883 1 279 . 1 1 29 29 LEU HD13 H 1 0.603 0.02 . 2 . . . A 362 LEU HD13 . 25883 1 280 . 1 1 29 29 LEU HD21 H 1 0.615 0.02 . 2 . . . A 362 LEU HD21 . 25883 1 281 . 1 1 29 29 LEU HD22 H 1 0.615 0.02 . 2 . . . A 362 LEU HD22 . 25883 1 282 . 1 1 29 29 LEU HD23 H 1 0.615 0.02 . 2 . . . A 362 LEU HD23 . 25883 1 283 . 1 1 29 29 LEU CA C 13 57.317 0.2 . 1 . . . A 362 LEU CA . 25883 1 284 . 1 1 29 29 LEU CB C 13 41.430 0.2 . 1 . . . A 362 LEU CB . 25883 1 285 . 1 1 29 29 LEU CD1 C 13 25.500 0.2 . 1 . . . A 362 LEU CD1 . 25883 1 286 . 1 1 29 29 LEU CD2 C 13 22.560 0.2 . 1 . . . A 362 LEU CD2 . 25883 1 287 . 1 1 29 29 LEU N N 15 120.602 0.1 . 1 . . . A 362 LEU N . 25883 1 288 . 1 1 30 30 ALA H H 1 8.458 0.02 . 1 . . . A 363 ALA H . 25883 1 289 . 1 1 30 30 ALA HA H 1 3.858 0.02 . 1 . . . A 363 ALA HA . 25883 1 290 . 1 1 30 30 ALA HB1 H 1 1.503 0.02 . 1 . . . A 363 ALA HB1 . 25883 1 291 . 1 1 30 30 ALA HB2 H 1 1.503 0.02 . 1 . . . A 363 ALA HB2 . 25883 1 292 . 1 1 30 30 ALA HB3 H 1 1.503 0.02 . 1 . . . A 363 ALA HB3 . 25883 1 293 . 1 1 30 30 ALA CA C 13 55.239 0.2 . 1 . . . A 363 ALA CA . 25883 1 294 . 1 1 30 30 ALA CB C 13 18.300 0.2 . 1 . . . A 363 ALA CB . 25883 1 295 . 1 1 30 30 ALA N N 15 119.079 0.1 . 1 . . . A 363 ALA N . 25883 1 296 . 1 1 31 31 GLY H H 1 7.645 0.02 . 1 . . . A 364 GLY H . 25883 1 297 . 1 1 31 31 GLY CA C 13 46.610 0.2 . 1 . . . A 364 GLY CA . 25883 1 298 . 1 1 31 31 GLY N N 15 103.410 0.1 . 1 . . . A 364 GLY N . 25883 1 299 . 1 1 32 32 GLU H H 1 7.781 0.02 . 1 . . . A 365 GLU H . 25883 1 300 . 1 1 32 32 GLU HA H 1 4.324 0.02 . 1 . . . A 365 GLU HA . 25883 1 301 . 1 1 32 32 GLU HB2 H 1 2.002 0.02 . 2 . . . A 365 GLU HB2 . 25883 1 302 . 1 1 32 32 GLU HB3 H 1 2.115 0.02 . 2 . . . A 365 GLU HB3 . 25883 1 303 . 1 1 32 32 GLU HG2 H 1 2.283 0.02 . 2 . . . A 365 GLU HG2 . 25883 1 304 . 1 1 32 32 GLU HG3 H 1 2.400 0.02 . 2 . . . A 365 GLU HG3 . 25883 1 305 . 1 1 32 32 GLU CA C 13 57.269 0.2 . 1 . . . A 365 GLU CA . 25883 1 306 . 1 1 32 32 GLU CB C 13 29.341 0.2 . 1 . . . A 365 GLU CB . 25883 1 307 . 1 1 32 32 GLU CG C 13 35.640 0.2 . 1 . . . A 365 GLU CG . 25883 1 308 . 1 1 32 32 GLU N N 15 122.343 0.1 . 1 . . . A 365 GLU N . 25883 1 309 . 1 1 33 33 LEU H H 1 7.866 0.02 . 1 . . . A 366 LEU H . 25883 1 310 . 1 1 33 33 LEU HA H 1 4.386 0.02 . 1 . . . A 366 LEU HA . 25883 1 311 . 1 1 33 33 LEU HB2 H 1 1.757 0.02 . 2 . . . A 366 LEU HB2 . 25883 1 312 . 1 1 33 33 LEU HB3 H 1 1.628 0.02 . 2 . . . A 366 LEU HB3 . 25883 1 313 . 1 1 33 33 LEU HG H 1 1.468 0.02 . 1 . . . A 366 LEU HG . 25883 1 314 . 1 1 33 33 LEU HD11 H 1 0.230 0.02 . 2 . . . A 366 LEU HD11 . 25883 1 315 . 1 1 33 33 LEU HD12 H 1 0.230 0.02 . 2 . . . A 366 LEU HD12 . 25883 1 316 . 1 1 33 33 LEU HD13 H 1 0.230 0.02 . 2 . . . A 366 LEU HD13 . 25883 1 317 . 1 1 33 33 LEU HD21 H 1 -0.280 0.02 . 2 . . . A 366 LEU HD21 . 25883 1 318 . 1 1 33 33 LEU HD22 H 1 -0.280 0.02 . 2 . . . A 366 LEU HD22 . 25883 1 319 . 1 1 33 33 LEU HD23 H 1 -0.280 0.02 . 2 . . . A 366 LEU HD23 . 25883 1 320 . 1 1 33 33 LEU CA C 13 54.200 0.2 . 1 . . . A 366 LEU CA . 25883 1 321 . 1 1 33 33 LEU CB C 13 41.000 0.2 . 1 . . . A 366 LEU CB . 25883 1 322 . 1 1 33 33 LEU CG C 13 24.750 0.2 . 1 . . . A 366 LEU CG . 25883 1 323 . 1 1 33 33 LEU CD1 C 13 19.970 0.2 . 1 . . . A 366 LEU CD1 . 25883 1 324 . 1 1 33 33 LEU CD2 C 13 23.050 0.2 . 1 . . . A 366 LEU CD2 . 25883 1 325 . 1 1 33 33 LEU N N 15 117.720 0.1 . 1 . . . A 366 LEU N . 25883 1 326 . 1 1 34 34 GLY H H 1 7.654 0.02 . 1 . . . A 367 GLY H . 25883 1 327 . 1 1 34 34 GLY HA2 H 1 4.040 0.02 . 2 . . . A 367 GLY HA2 . 25883 1 328 . 1 1 34 34 GLY CA C 13 45.093 0.2 . 1 . . . A 367 GLY CA . 25883 1 329 . 1 1 34 34 GLY N N 15 105.723 0.1 . 1 . . . A 367 GLY N . 25883 1 330 . 1 1 35 35 TYR H H 1 7.992 0.02 . 1 . . . A 368 TYR H . 25883 1 331 . 1 1 35 35 TYR HA H 1 4.503 0.02 . 1 . . . A 368 TYR HA . 25883 1 332 . 1 1 35 35 TYR HB2 H 1 2.728 0.02 . 2 . . . A 368 TYR HB2 . 25883 1 333 . 1 1 35 35 TYR HB3 H 1 2.948 0.02 . 2 . . . A 368 TYR HB3 . 25883 1 334 . 1 1 35 35 TYR HD1 H 1 7.164 0.02 . 3 . . . A 368 TYR HD1 . 25883 1 335 . 1 1 35 35 TYR HE1 H 1 6.790 0.02 . 3 . . . A 368 TYR HE1 . 25883 1 336 . 1 1 35 35 TYR CA C 13 59.116 0.2 . 1 . . . A 368 TYR CA . 25883 1 337 . 1 1 35 35 TYR CB C 13 38.346 0.2 . 1 . . . A 368 TYR CB . 25883 1 338 . 1 1 35 35 TYR CD1 C 13 132.010 0.2 . 3 . . . A 368 TYR CD1 . 25883 1 339 . 1 1 35 35 TYR CE1 C 13 117.650 0.2 . 3 . . . A 368 TYR CE1 . 25883 1 340 . 1 1 35 35 TYR N N 15 119.660 0.1 . 1 . . . A 368 TYR N . 25883 1 341 . 1 1 36 36 GLN H H 1 9.687 0.02 . 1 . . . A 369 GLN H . 25883 1 342 . 1 1 36 36 GLN HB2 H 1 1.804 0.02 . 2 . . . A 369 GLN HB2 . 25883 1 343 . 1 1 36 36 GLN HB3 H 1 2.474 0.02 . 2 . . . A 369 GLN HB3 . 25883 1 344 . 1 1 36 36 GLN HG2 H 1 2.593 0.02 . 2 . . . A 369 GLN HG2 . 25883 1 345 . 1 1 36 36 GLN HG3 H 1 2.593 0.02 . 2 . . . A 369 GLN HG3 . 25883 1 346 . 1 1 36 36 GLN HE21 H 1 7.446 0.02 . 2 . . . A 369 GLN HE21 . 25883 1 347 . 1 1 36 36 GLN HE22 H 1 6.885 0.02 . 2 . . . A 369 GLN HE22 . 25883 1 348 . 1 1 36 36 GLN CA C 13 53.635 0.2 . 1 . . . A 369 GLN CA . 25883 1 349 . 1 1 36 36 GLN CB C 13 27.487 0.2 . 1 . . . A 369 GLN CB . 25883 1 350 . 1 1 36 36 GLN CG C 13 33.693 0.2 . 1 . . . A 369 GLN CG . 25883 1 351 . 1 1 36 36 GLN N N 15 123.038 0.1 . 1 . . . A 369 GLN N . 25883 1 352 . 1 1 36 36 GLN NE2 N 15 113.225 0.1 . 1 . . . A 369 GLN NE2 . 25883 1 353 . 1 1 37 37 PRO HA H 1 4.122 0.02 . 1 . . . A 370 PRO HA . 25883 1 354 . 1 1 37 37 PRO HB2 H 1 1.973 0.02 . 2 . . . A 370 PRO HB2 . 25883 1 355 . 1 1 37 37 PRO HB3 H 1 2.425 0.02 . 2 . . . A 370 PRO HB3 . 25883 1 356 . 1 1 37 37 PRO HG2 H 1 2.242 0.02 . 2 . . . A 370 PRO HG2 . 25883 1 357 . 1 1 37 37 PRO HG3 H 1 2.040 0.02 . 2 . . . A 370 PRO HG3 . 25883 1 358 . 1 1 37 37 PRO HD2 H 1 3.850 0.02 . 2 . . . A 370 PRO HD2 . 25883 1 359 . 1 1 37 37 PRO CA C 13 66.461 0.2 . 1 . . . A 370 PRO CA . 25883 1 360 . 1 1 37 37 PRO CB C 13 31.693 0.2 . 1 . . . A 370 PRO CB . 25883 1 361 . 1 1 37 37 PRO CG C 13 27.455 0.2 . 1 . . . A 370 PRO CG . 25883 1 362 . 1 1 37 37 PRO CD C 13 50.159 0.2 . 1 . . . A 370 PRO CD . 25883 1 363 . 1 1 38 38 GLU H H 1 9.512 0.02 . 1 . . . A 371 GLU H . 25883 1 364 . 1 1 38 38 GLU HA H 1 4.175 0.02 . 1 . . . A 371 GLU HA . 25883 1 365 . 1 1 38 38 GLU HB2 H 1 1.949 0.02 . 2 . . . A 371 GLU HB2 . 25883 1 366 . 1 1 38 38 GLU HB3 H 1 1.949 0.02 . 2 . . . A 371 GLU HB3 . 25883 1 367 . 1 1 38 38 GLU HG2 H 1 2.100 0.02 . 2 . . . A 371 GLU HG2 . 25883 1 368 . 1 1 38 38 GLU HG3 H 1 2.170 0.02 . 2 . . . A 371 GLU HG3 . 25883 1 369 . 1 1 38 38 GLU CA C 13 58.905 0.2 . 1 . . . A 371 GLU CA . 25883 1 370 . 1 1 38 38 GLU CB C 13 28.059 0.2 . 1 . . . A 371 GLU CB . 25883 1 371 . 1 1 38 38 GLU CG C 13 35.550 0.2 . 1 . . . A 371 GLU CG . 25883 1 372 . 1 1 38 38 GLU N N 15 116.210 0.1 . 1 . . . A 371 GLU N . 25883 1 373 . 1 1 39 39 HIS H H 1 7.544 0.02 . 1 . . . A 372 HIS H . 25883 1 374 . 1 1 39 39 HIS HA H 1 4.541 0.02 . 1 . . . A 372 HIS HA . 25883 1 375 . 1 1 39 39 HIS HB2 H 1 3.477 0.02 . 2 . . . A 372 HIS HB2 . 25883 1 376 . 1 1 39 39 HIS HB3 H 1 3.393 0.02 . 2 . . . A 372 HIS HB3 . 25883 1 377 . 1 1 39 39 HIS CA C 13 57.164 0.2 . 1 . . . A 372 HIS CA . 25883 1 378 . 1 1 39 39 HIS CB C 13 32.172 0.2 . 1 . . . A 372 HIS CB . 25883 1 379 . 1 1 39 39 HIS N N 15 120.015 0.1 . 1 . . . A 372 HIS N . 25883 1 380 . 1 1 40 40 ILE H H 1 7.991 0.02 . 1 . . . A 373 ILE H . 25883 1 381 . 1 1 40 40 ILE HA H 1 3.799 0.02 . 1 . . . A 373 ILE HA . 25883 1 382 . 1 1 40 40 ILE HB H 1 2.067 0.02 . 1 . . . A 373 ILE HB . 25883 1 383 . 1 1 40 40 ILE HG12 H 1 1.826 0.02 . 1 . . . A 373 ILE HG12 . 25883 1 384 . 1 1 40 40 ILE HG13 H 1 0.870 0.02 . 1 . . . A 373 ILE HG13 . 25883 1 385 . 1 1 40 40 ILE HG21 H 1 0.888 0.02 . 1 . . . A 373 ILE HG21 . 25883 1 386 . 1 1 40 40 ILE HG22 H 1 0.888 0.02 . 1 . . . A 373 ILE HG22 . 25883 1 387 . 1 1 40 40 ILE HG23 H 1 0.888 0.02 . 1 . . . A 373 ILE HG23 . 25883 1 388 . 1 1 40 40 ILE HD11 H 1 0.760 0.02 . 1 . . . A 373 ILE HD11 . 25883 1 389 . 1 1 40 40 ILE HD12 H 1 0.760 0.02 . 1 . . . A 373 ILE HD12 . 25883 1 390 . 1 1 40 40 ILE HD13 H 1 0.760 0.02 . 1 . . . A 373 ILE HD13 . 25883 1 391 . 1 1 40 40 ILE CA C 13 65.618 0.2 . 1 . . . A 373 ILE CA . 25883 1 392 . 1 1 40 40 ILE CB C 13 37.723 0.2 . 1 . . . A 373 ILE CB . 25883 1 393 . 1 1 40 40 ILE CG1 C 13 29.512 0.2 . 1 . . . A 373 ILE CG1 . 25883 1 394 . 1 1 40 40 ILE CG2 C 13 17.583 0.2 . 1 . . . A 373 ILE CG2 . 25883 1 395 . 1 1 40 40 ILE CD1 C 13 12.817 0.2 . 1 . . . A 373 ILE CD1 . 25883 1 396 . 1 1 40 40 ILE N N 15 120.084 0.1 . 1 . . . A 373 ILE N . 25883 1 397 . 1 1 41 41 ASP H H 1 8.123 0.02 . 1 . . . A 374 ASP H . 25883 1 398 . 1 1 41 41 ASP HA H 1 4.581 0.02 . 1 . . . A 374 ASP HA . 25883 1 399 . 1 1 41 41 ASP HB2 H 1 2.726 0.02 . 2 . . . A 374 ASP HB2 . 25883 1 400 . 1 1 41 41 ASP HB3 H 1 2.726 0.02 . 2 . . . A 374 ASP HB3 . 25883 1 401 . 1 1 41 41 ASP CA C 13 56.877 0.2 . 1 . . . A 374 ASP CA . 25883 1 402 . 1 1 41 41 ASP CB C 13 40.500 0.2 . 1 . . . A 374 ASP CB . 25883 1 403 . 1 1 41 41 ASP N N 15 117.700 0.1 . 1 . . . A 374 ASP N . 25883 1 404 . 1 1 42 42 SER H H 1 7.578 0.02 . 1 . . . A 375 SER H . 25883 1 405 . 1 1 42 42 SER HA H 1 4.271 0.02 . 1 . . . A 375 SER HA . 25883 1 406 . 1 1 42 42 SER HB2 H 1 3.824 0.02 . 2 . . . A 375 SER HB2 . 25883 1 407 . 1 1 42 42 SER HB3 H 1 3.824 0.02 . 2 . . . A 375 SER HB3 . 25883 1 408 . 1 1 42 42 SER CA C 13 61.109 0.2 . 1 . . . A 375 SER CA . 25883 1 409 . 1 1 42 42 SER CB C 13 62.318 0.2 . 1 . . . A 375 SER CB . 25883 1 410 . 1 1 42 42 SER N N 15 115.183 0.1 . 1 . . . A 375 SER N . 25883 1 411 . 1 1 43 43 PHE H H 1 7.789 0.02 . 1 . . . A 376 PHE H . 25883 1 412 . 1 1 43 43 PHE HA H 1 4.553 0.02 . 1 . . . A 376 PHE HA . 25883 1 413 . 1 1 43 43 PHE HB2 H 1 3.162 0.02 . 2 . . . A 376 PHE HB2 . 25883 1 414 . 1 1 43 43 PHE HB3 H 1 2.920 0.02 . 2 . . . A 376 PHE HB3 . 25883 1 415 . 1 1 43 43 PHE HD1 H 1 7.190 0.02 . 3 . . . A 376 PHE HD1 . 25883 1 416 . 1 1 43 43 PHE HE1 H 1 6.890 0.02 . 3 . . . A 376 PHE HE1 . 25883 1 417 . 1 1 43 43 PHE HZ H 1 7.027 0.02 . 1 . . . A 376 PHE HZ . 25883 1 418 . 1 1 43 43 PHE CA C 13 58.171 0.2 . 1 . . . A 376 PHE CA . 25883 1 419 . 1 1 43 43 PHE CB C 13 38.166 0.2 . 1 . . . A 376 PHE CB . 25883 1 420 . 1 1 43 43 PHE CD1 C 13 130.400 0.2 . 3 . . . A 376 PHE CD1 . 25883 1 421 . 1 1 43 43 PHE CE1 C 13 130.470 0.2 . 3 . . . A 376 PHE CE1 . 25883 1 422 . 1 1 43 43 PHE CZ C 13 128.500 0.2 . 1 . . . A 376 PHE CZ . 25883 1 423 . 1 1 43 43 PHE N N 15 120.100 0.1 . 1 . . . A 376 PHE N . 25883 1 424 . 1 1 44 44 THR H H 1 7.729 0.02 . 1 . . . A 377 THR H . 25883 1 425 . 1 1 44 44 THR HA H 1 3.927 0.02 . 1 . . . A 377 THR HA . 25883 1 426 . 1 1 44 44 THR HB H 1 4.269 0.02 . 1 . . . A 377 THR HB . 25883 1 427 . 1 1 44 44 THR HG21 H 1 1.409 0.02 . 1 . . . A 377 THR HG21 . 25883 1 428 . 1 1 44 44 THR HG22 H 1 1.409 0.02 . 1 . . . A 377 THR HG22 . 25883 1 429 . 1 1 44 44 THR HG23 H 1 1.409 0.02 . 1 . . . A 377 THR HG23 . 25883 1 430 . 1 1 44 44 THR CA C 13 65.098 0.2 . 1 . . . A 377 THR CA . 25883 1 431 . 1 1 44 44 THR CB C 13 69.327 0.2 . 1 . . . A 377 THR CB . 25883 1 432 . 1 1 44 44 THR CG2 C 13 21.433 0.2 . 1 . . . A 377 THR CG2 . 25883 1 433 . 1 1 44 44 THR N N 15 110.223 0.1 . 1 . . . A 377 THR N . 25883 1 434 . 1 1 45 45 HIS H H 1 7.560 0.02 . 1 . . . A 378 HIS H . 25883 1 435 . 1 1 45 45 HIS HA H 1 4.674 0.02 . 1 . . . A 378 HIS HA . 25883 1 436 . 1 1 45 45 HIS HB2 H 1 3.394 0.02 . 2 . . . A 378 HIS HB2 . 25883 1 437 . 1 1 45 45 HIS HB3 H 1 3.114 0.02 . 2 . . . A 378 HIS HB3 . 25883 1 438 . 1 1 45 45 HIS CA C 13 55.407 0.2 . 1 . . . A 378 HIS CA . 25883 1 439 . 1 1 45 45 HIS CB C 13 28.915 0.2 . 1 . . . A 378 HIS CB . 25883 1 440 . 1 1 45 45 HIS N N 15 116.200 0.1 . 1 . . . A 378 HIS N . 25883 1 441 . 1 1 46 46 GLU H H 1 7.239 0.02 . 1 . . . A 379 GLU H . 25883 1 442 . 1 1 46 46 GLU HA H 1 4.232 0.02 . 1 . . . A 379 GLU HA . 25883 1 443 . 1 1 46 46 GLU HB2 H 1 2.068 0.02 . 2 . . . A 379 GLU HB2 . 25883 1 444 . 1 1 46 46 GLU HB3 H 1 1.646 0.02 . 2 . . . A 379 GLU HB3 . 25883 1 445 . 1 1 46 46 GLU HG2 H 1 2.251 0.02 . 2 . . . A 379 GLU HG2 . 25883 1 446 . 1 1 46 46 GLU HG3 H 1 2.270 0.02 . 2 . . . A 379 GLU HG3 . 25883 1 447 . 1 1 46 46 GLU CA C 13 54.968 0.2 . 1 . . . A 379 GLU CA . 25883 1 448 . 1 1 46 46 GLU CB C 13 29.600 0.2 . 1 . . . A 379 GLU CB . 25883 1 449 . 1 1 46 46 GLU CG C 13 35.647 0.2 . 1 . . . A 379 GLU CG . 25883 1 450 . 1 1 46 46 GLU N N 15 119.598 0.1 . 1 . . . A 379 GLU N . 25883 1 451 . 1 1 47 47 ALA H H 1 8.615 0.02 . 1 . . . A 380 ALA H . 25883 1 452 . 1 1 47 47 ALA HA H 1 4.050 0.02 . 1 . . . A 380 ALA HA . 25883 1 453 . 1 1 47 47 ALA HB1 H 1 1.430 0.02 . 1 . . . A 380 ALA HB1 . 25883 1 454 . 1 1 47 47 ALA HB2 H 1 1.430 0.02 . 1 . . . A 380 ALA HB2 . 25883 1 455 . 1 1 47 47 ALA HB3 H 1 1.430 0.02 . 1 . . . A 380 ALA HB3 . 25883 1 456 . 1 1 47 47 ALA CA C 13 54.353 0.2 . 1 . . . A 380 ALA CA . 25883 1 457 . 1 1 47 47 ALA CB C 13 17.785 0.2 . 1 . . . A 380 ALA CB . 25883 1 458 . 1 1 47 47 ALA N N 15 123.263 0.1 . 1 . . . A 380 ALA N . 25883 1 459 . 1 1 48 48 CYS H H 1 7.984 0.02 . 1 . . . A 381 CYS H . 25883 1 460 . 1 1 48 48 CYS HB2 H 1 2.626 0.02 . 2 . . . A 381 CYS HB2 . 25883 1 461 . 1 1 48 48 CYS HB3 H 1 2.826 0.02 . 2 . . . A 381 CYS HB3 . 25883 1 462 . 1 1 48 48 CYS CA C 13 55.050 0.2 . 1 . . . A 381 CYS CA . 25883 1 463 . 1 1 48 48 CYS CB C 13 26.522 0.2 . 1 . . . A 381 CYS CB . 25883 1 464 . 1 1 48 48 CYS N N 15 114.630 0.1 . 1 . . . A 381 CYS N . 25883 1 465 . 1 1 49 49 PRO HA H 1 3.550 0.02 . 1 . . . A 382 PRO HA . 25883 1 466 . 1 1 49 49 PRO HB2 H 1 0.508 0.02 . 2 . . . A 382 PRO HB2 . 25883 1 467 . 1 1 49 49 PRO HB3 H 1 -0.183 0.02 . 2 . . . A 382 PRO HB3 . 25883 1 468 . 1 1 49 49 PRO HG2 H 1 1.570 0.02 . 2 . . . A 382 PRO HG2 . 25883 1 469 . 1 1 49 49 PRO HG3 H 1 1.755 0.02 . 2 . . . A 382 PRO HG3 . 25883 1 470 . 1 1 49 49 PRO HD2 H 1 3.442 0.02 . 2 . . . A 382 PRO HD2 . 25883 1 471 . 1 1 49 49 PRO HD3 H 1 3.650 0.02 . 2 . . . A 382 PRO HD3 . 25883 1 472 . 1 1 49 49 PRO CA C 13 65.600 0.2 . 1 . . . A 382 PRO CA . 25883 1 473 . 1 1 49 49 PRO CB C 13 30.200 0.2 . 1 . . . A 382 PRO CB . 25883 1 474 . 1 1 49 49 PRO CG C 13 26.500 0.2 . 1 . . . A 382 PRO CG . 25883 1 475 . 1 1 49 49 PRO CD C 13 50.200 0.2 . 1 . . . A 382 PRO CD . 25883 1 476 . 1 1 50 50 VAL H H 1 8.277 0.02 . 1 . . . A 383 VAL H . 25883 1 477 . 1 1 50 50 VAL HA H 1 3.498 0.02 . 1 . . . A 383 VAL HA . 25883 1 478 . 1 1 50 50 VAL HB H 1 2.093 0.02 . 1 . . . A 383 VAL HB . 25883 1 479 . 1 1 50 50 VAL HG11 H 1 0.825 0.02 . 2 . . . A 383 VAL HG11 . 25883 1 480 . 1 1 50 50 VAL HG12 H 1 0.825 0.02 . 2 . . . A 383 VAL HG12 . 25883 1 481 . 1 1 50 50 VAL HG13 H 1 0.825 0.02 . 2 . . . A 383 VAL HG13 . 25883 1 482 . 1 1 50 50 VAL HG21 H 1 0.947 0.02 . 2 . . . A 383 VAL HG21 . 25883 1 483 . 1 1 50 50 VAL HG22 H 1 0.947 0.02 . 2 . . . A 383 VAL HG22 . 25883 1 484 . 1 1 50 50 VAL HG23 H 1 0.947 0.02 . 2 . . . A 383 VAL HG23 . 25883 1 485 . 1 1 50 50 VAL CA C 13 65.300 0.2 . 1 . . . A 383 VAL CA . 25883 1 486 . 1 1 50 50 VAL CB C 13 30.500 0.2 . 1 . . . A 383 VAL CB . 25883 1 487 . 1 1 50 50 VAL CG1 C 13 20.642 0.2 . 1 . . . A 383 VAL CG1 . 25883 1 488 . 1 1 50 50 VAL CG2 C 13 22.871 0.2 . 1 . . . A 383 VAL CG2 . 25883 1 489 . 1 1 50 50 VAL N N 15 114.730 0.1 . 1 . . . A 383 VAL N . 25883 1 490 . 1 1 51 51 ARG H H 1 7.175 0.02 . 1 . . . A 384 ARG H . 25883 1 491 . 1 1 51 51 ARG HA H 1 3.848 0.02 . 1 . . . A 384 ARG HA . 25883 1 492 . 1 1 51 51 ARG HB2 H 1 1.810 0.02 . 2 . . . A 384 ARG HB2 . 25883 1 493 . 1 1 51 51 ARG HB3 H 1 1.830 0.02 . 2 . . . A 384 ARG HB3 . 25883 1 494 . 1 1 51 51 ARG HG2 H 1 1.510 0.02 . 2 . . . A 384 ARG HG2 . 25883 1 495 . 1 1 51 51 ARG HG3 H 1 1.770 0.02 . 2 . . . A 384 ARG HG3 . 25883 1 496 . 1 1 51 51 ARG HD2 H 1 3.170 0.02 . 2 . . . A 384 ARG HD2 . 25883 1 497 . 1 1 51 51 ARG HD3 H 1 3.250 0.02 . 2 . . . A 384 ARG HD3 . 25883 1 498 . 1 1 51 51 ARG CA C 13 58.860 0.2 . 1 . . . A 384 ARG CA . 25883 1 499 . 1 1 51 51 ARG CB C 13 29.954 0.2 . 1 . . . A 384 ARG CB . 25883 1 500 . 1 1 51 51 ARG CG C 13 26.936 0.2 . 1 . . . A 384 ARG CG . 25883 1 501 . 1 1 51 51 ARG CD C 13 43.399 0.2 . 1 . . . A 384 ARG CD . 25883 1 502 . 1 1 51 51 ARG N N 15 120.648 0.1 . 1 . . . A 384 ARG N . 25883 1 503 . 1 1 52 52 ALA H H 1 7.261 0.02 . 1 . . . A 385 ALA H . 25883 1 504 . 1 1 52 52 ALA HA H 1 4.080 0.02 . 1 . . . A 385 ALA HA . 25883 1 505 . 1 1 52 52 ALA HB1 H 1 1.411 0.02 . 1 . . . A 385 ALA HB1 . 25883 1 506 . 1 1 52 52 ALA HB2 H 1 1.411 0.02 . 1 . . . A 385 ALA HB2 . 25883 1 507 . 1 1 52 52 ALA HB3 H 1 1.411 0.02 . 1 . . . A 385 ALA HB3 . 25883 1 508 . 1 1 52 52 ALA CA C 13 54.156 0.2 . 1 . . . A 385 ALA CA . 25883 1 509 . 1 1 52 52 ALA CB C 13 17.991 0.2 . 1 . . . A 385 ALA CB . 25883 1 510 . 1 1 52 52 ALA N N 15 121.939 0.1 . 1 . . . A 385 ALA N . 25883 1 511 . 1 1 53 53 LEU H H 1 8.089 0.02 . 1 . . . A 386 LEU H . 25883 1 512 . 1 1 53 53 LEU HA H 1 2.927 0.02 . 1 . . . A 386 LEU HA . 25883 1 513 . 1 1 53 53 LEU HB2 H 1 1.665 0.02 . 2 . . . A 386 LEU HB2 . 25883 1 514 . 1 1 53 53 LEU HB3 H 1 0.715 0.02 . 2 . . . A 386 LEU HB3 . 25883 1 515 . 1 1 53 53 LEU HG H 1 1.055 0.02 . 1 . . . A 386 LEU HG . 25883 1 516 . 1 1 53 53 LEU HD11 H 1 0.770 0.02 . 2 . . . A 386 LEU HD11 . 25883 1 517 . 1 1 53 53 LEU HD12 H 1 0.770 0.02 . 2 . . . A 386 LEU HD12 . 25883 1 518 . 1 1 53 53 LEU HD13 H 1 0.770 0.02 . 2 . . . A 386 LEU HD13 . 25883 1 519 . 1 1 53 53 LEU HD21 H 1 0.327 0.02 . 2 . . . A 386 LEU HD21 . 25883 1 520 . 1 1 53 53 LEU HD22 H 1 0.327 0.02 . 2 . . . A 386 LEU HD22 . 25883 1 521 . 1 1 53 53 LEU HD23 H 1 0.327 0.02 . 2 . . . A 386 LEU HD23 . 25883 1 522 . 1 1 53 53 LEU CA C 13 57.093 0.2 . 1 . . . A 386 LEU CA . 25883 1 523 . 1 1 53 53 LEU CB C 13 41.070 0.2 . 1 . . . A 386 LEU CB . 25883 1 524 . 1 1 53 53 LEU CG C 13 26.820 0.2 . 1 . . . A 386 LEU CG . 25883 1 525 . 1 1 53 53 LEU CD1 C 13 26.050 0.2 . 1 . . . A 386 LEU CD1 . 25883 1 526 . 1 1 53 53 LEU CD2 C 13 23.729 0.2 . 1 . . . A 386 LEU CD2 . 25883 1 527 . 1 1 53 53 LEU N N 15 120.970 0.1 . 1 . . . A 386 LEU N . 25883 1 528 . 1 1 54 54 LEU H H 1 8.125 0.02 . 1 . . . A 387 LEU H . 25883 1 529 . 1 1 54 54 LEU HA H 1 4.109 0.02 . 1 . . . A 387 LEU HA . 25883 1 530 . 1 1 54 54 LEU HB2 H 1 1.875 0.02 . 2 . . . A 387 LEU HB2 . 25883 1 531 . 1 1 54 54 LEU HB3 H 1 1.420 0.02 . 2 . . . A 387 LEU HB3 . 25883 1 532 . 1 1 54 54 LEU HG H 1 1.650 0.02 . 1 . . . A 387 LEU HG . 25883 1 533 . 1 1 54 54 LEU HD11 H 1 0.735 0.02 . 2 . . . A 387 LEU HD11 . 25883 1 534 . 1 1 54 54 LEU HD12 H 1 0.735 0.02 . 2 . . . A 387 LEU HD12 . 25883 1 535 . 1 1 54 54 LEU HD13 H 1 0.735 0.02 . 2 . . . A 387 LEU HD13 . 25883 1 536 . 1 1 54 54 LEU HD21 H 1 0.365 0.02 . 2 . . . A 387 LEU HD21 . 25883 1 537 . 1 1 54 54 LEU HD22 H 1 0.365 0.02 . 2 . . . A 387 LEU HD22 . 25883 1 538 . 1 1 54 54 LEU HD23 H 1 0.365 0.02 . 2 . . . A 387 LEU HD23 . 25883 1 539 . 1 1 54 54 LEU CA C 13 57.554 0.2 . 1 . . . A 387 LEU CA . 25883 1 540 . 1 1 54 54 LEU CB C 13 40.516 0.2 . 1 . . . A 387 LEU CB . 25883 1 541 . 1 1 54 54 LEU CG C 13 26.856 0.2 . 1 . . . A 387 LEU CG . 25883 1 542 . 1 1 54 54 LEU CD1 C 13 25.476 0.2 . 1 . . . A 387 LEU CD1 . 25883 1 543 . 1 1 54 54 LEU CD2 C 13 21.538 0.2 . 1 . . . A 387 LEU CD2 . 25883 1 544 . 1 1 54 54 LEU N N 15 117.580 0.1 . 1 . . . A 387 LEU N . 25883 1 545 . 1 1 55 55 ALA H H 1 8.091 0.02 . 1 . . . A 388 ALA H . 25883 1 546 . 1 1 55 55 ALA HA H 1 4.195 0.02 . 1 . . . A 388 ALA HA . 25883 1 547 . 1 1 55 55 ALA HB1 H 1 1.498 0.02 . 1 . . . A 388 ALA HB1 . 25883 1 548 . 1 1 55 55 ALA HB2 H 1 1.498 0.02 . 1 . . . A 388 ALA HB2 . 25883 1 549 . 1 1 55 55 ALA HB3 H 1 1.498 0.02 . 1 . . . A 388 ALA HB3 . 25883 1 550 . 1 1 55 55 ALA CA C 13 54.459 0.2 . 1 . . . A 388 ALA CA . 25883 1 551 . 1 1 55 55 ALA CB C 13 17.646 0.2 . 1 . . . A 388 ALA CB . 25883 1 552 . 1 1 55 55 ALA N N 15 120.669 0.1 . 1 . . . A 388 ALA N . 25883 1 553 . 1 1 56 56 SER H H 1 7.499 0.02 . 1 . . . A 389 SER H . 25883 1 554 . 1 1 56 56 SER HA H 1 4.447 0.02 . 1 . . . A 389 SER HA . 25883 1 555 . 1 1 56 56 SER HB2 H 1 4.290 0.02 . 2 . . . A 389 SER HB2 . 25883 1 556 . 1 1 56 56 SER HB3 H 1 4.290 0.02 . 2 . . . A 389 SER HB3 . 25883 1 557 . 1 1 56 56 SER CA C 13 60.185 0.2 . 1 . . . A 389 SER CA . 25883 1 558 . 1 1 56 56 SER CB C 13 62.911 0.2 . 1 . . . A 389 SER CB . 25883 1 559 . 1 1 56 56 SER N N 15 112.108 0.1 . 1 . . . A 389 SER N . 25883 1 560 . 1 1 57 57 TRP H H 1 9.069 0.02 . 1 . . . A 390 TRP H . 25883 1 561 . 1 1 57 57 TRP HA H 1 4.368 0.02 . 1 . . . A 390 TRP HA . 25883 1 562 . 1 1 57 57 TRP HB2 H 1 3.548 0.02 . 2 . . . A 390 TRP HB2 . 25883 1 563 . 1 1 57 57 TRP HB3 H 1 3.307 0.02 . 2 . . . A 390 TRP HB3 . 25883 1 564 . 1 1 57 57 TRP HE1 H 1 10.308 0.02 . 1 . . . A 390 TRP HE1 . 25883 1 565 . 1 1 57 57 TRP CA C 13 61.155 0.2 . 1 . . . A 390 TRP CA . 25883 1 566 . 1 1 57 57 TRP CB C 13 27.869 0.2 . 1 . . . A 390 TRP CB . 25883 1 567 . 1 1 57 57 TRP N N 15 125.617 0.1 . 1 . . . A 390 TRP N . 25883 1 568 . 1 1 57 57 TRP NE1 N 15 130.165 0.1 . 1 . . . A 390 TRP NE1 . 25883 1 569 . 1 1 58 58 ALA H H 1 8.398 0.02 . 1 . . . A 391 ALA H . 25883 1 570 . 1 1 58 58 ALA HA H 1 3.702 0.02 . 1 . . . A 391 ALA HA . 25883 1 571 . 1 1 58 58 ALA HB1 H 1 1.710 0.02 . 1 . . . A 391 ALA HB1 . 25883 1 572 . 1 1 58 58 ALA HB2 H 1 1.710 0.02 . 1 . . . A 391 ALA HB2 . 25883 1 573 . 1 1 58 58 ALA HB3 H 1 1.710 0.02 . 1 . . . A 391 ALA HB3 . 25883 1 574 . 1 1 58 58 ALA CA C 13 53.000 0.2 . 1 . . . A 391 ALA CA . 25883 1 575 . 1 1 58 58 ALA CB C 13 18.826 0.2 . 1 . . . A 391 ALA CB . 25883 1 576 . 1 1 58 58 ALA N N 15 114.620 0.1 . 1 . . . A 391 ALA N . 25883 1 577 . 1 1 59 59 THR H H 1 7.312 0.02 . 1 . . . A 392 THR H . 25883 1 578 . 1 1 59 59 THR HA H 1 4.263 0.02 . 1 . . . A 392 THR HA . 25883 1 579 . 1 1 59 59 THR HB H 1 4.461 0.02 . 1 . . . A 392 THR HB . 25883 1 580 . 1 1 59 59 THR HG21 H 1 1.464 0.02 . 1 . . . A 392 THR HG21 . 25883 1 581 . 1 1 59 59 THR HG22 H 1 1.464 0.02 . 1 . . . A 392 THR HG22 . 25883 1 582 . 1 1 59 59 THR HG23 H 1 1.464 0.02 . 1 . . . A 392 THR HG23 . 25883 1 583 . 1 1 59 59 THR CA C 13 62.419 0.2 . 1 . . . A 392 THR CA . 25883 1 584 . 1 1 59 59 THR CB C 13 69.357 0.2 . 1 . . . A 392 THR CB . 25883 1 585 . 1 1 59 59 THR CG2 C 13 21.091 0.2 . 1 . . . A 392 THR CG2 . 25883 1 586 . 1 1 59 59 THR N N 15 106.581 0.1 . 1 . . . A 392 THR N . 25883 1 587 . 1 1 60 60 GLN H H 1 7.731 0.02 . 1 . . . A 393 GLN H . 25883 1 588 . 1 1 60 60 GLN HA H 1 4.364 0.02 . 1 . . . A 393 GLN HA . 25883 1 589 . 1 1 60 60 GLN HB2 H 1 2.148 0.02 . 2 . . . A 393 GLN HB2 . 25883 1 590 . 1 1 60 60 GLN HB3 H 1 1.882 0.02 . 2 . . . A 393 GLN HB3 . 25883 1 591 . 1 1 60 60 GLN HG2 H 1 2.556 0.02 . 2 . . . A 393 GLN HG2 . 25883 1 592 . 1 1 60 60 GLN HG3 H 1 2.381 0.02 . 2 . . . A 393 GLN HG3 . 25883 1 593 . 1 1 60 60 GLN HE21 H 1 7.236 0.02 . 2 . . . A 393 GLN HE21 . 25883 1 594 . 1 1 60 60 GLN HE22 H 1 6.951 0.02 . 2 . . . A 393 GLN HE22 . 25883 1 595 . 1 1 60 60 GLN CA C 13 55.177 0.2 . 1 . . . A 393 GLN CA . 25883 1 596 . 1 1 60 60 GLN CB C 13 29.473 0.2 . 1 . . . A 393 GLN CB . 25883 1 597 . 1 1 60 60 GLN CG C 13 33.985 0.2 . 1 . . . A 393 GLN CG . 25883 1 598 . 1 1 60 60 GLN N N 15 121.010 0.1 . 1 . . . A 393 GLN N . 25883 1 599 . 1 1 60 60 GLN NE2 N 15 111.000 0.1 . 1 . . . A 393 GLN NE2 . 25883 1 600 . 1 1 61 61 ASP H H 1 8.630 0.02 . 1 . . . A 394 ASP H . 25883 1 601 . 1 1 61 61 ASP HA H 1 4.307 0.02 . 1 . . . A 394 ASP HA . 25883 1 602 . 1 1 61 61 ASP HB2 H 1 2.695 0.02 . 2 . . . A 394 ASP HB2 . 25883 1 603 . 1 1 61 61 ASP HB3 H 1 2.695 0.02 . 2 . . . A 394 ASP HB3 . 25883 1 604 . 1 1 61 61 ASP CA C 13 55.700 0.2 . 1 . . . A 394 ASP CA . 25883 1 605 . 1 1 61 61 ASP CB C 13 40.139 0.2 . 1 . . . A 394 ASP CB . 25883 1 606 . 1 1 61 61 ASP N N 15 121.350 0.1 . 1 . . . A 394 ASP N . 25883 1 607 . 1 1 62 62 SER H H 1 7.512 0.02 . 1 . . . A 395 SER H . 25883 1 608 . 1 1 62 62 SER HA H 1 4.133 0.02 . 1 . . . A 395 SER HA . 25883 1 609 . 1 1 62 62 SER HB2 H 1 3.882 0.02 . 2 . . . A 395 SER HB2 . 25883 1 610 . 1 1 62 62 SER HB3 H 1 3.882 0.02 . 2 . . . A 395 SER HB3 . 25883 1 611 . 1 1 62 62 SER CA C 13 56.721 0.2 . 1 . . . A 395 SER CA . 25883 1 612 . 1 1 62 62 SER CB C 13 62.513 0.2 . 1 . . . A 395 SER CB . 25883 1 613 . 1 1 62 62 SER N N 15 108.736 0.1 . 1 . . . A 395 SER N . 25883 1 614 . 1 1 63 63 ALA H H 1 7.138 0.02 . 1 . . . A 396 ALA H . 25883 1 615 . 1 1 63 63 ALA HA H 1 4.014 0.02 . 1 . . . A 396 ALA HA . 25883 1 616 . 1 1 63 63 ALA HB1 H 1 -0.121 0.02 . 1 . . . A 396 ALA HB1 . 25883 1 617 . 1 1 63 63 ALA HB2 H 1 -0.121 0.02 . 1 . . . A 396 ALA HB2 . 25883 1 618 . 1 1 63 63 ALA HB3 H 1 -0.121 0.02 . 1 . . . A 396 ALA HB3 . 25883 1 619 . 1 1 63 63 ALA CA C 13 51.709 0.2 . 1 . . . A 396 ALA CA . 25883 1 620 . 1 1 63 63 ALA CB C 13 15.916 0.2 . 1 . . . A 396 ALA CB . 25883 1 621 . 1 1 63 63 ALA N N 15 127.664 0.1 . 1 . . . A 396 ALA N . 25883 1 622 . 1 1 64 64 THR H H 1 7.861 0.02 . 1 . . . A 397 THR H . 25883 1 623 . 1 1 64 64 THR HA H 1 4.734 0.02 . 1 . . . A 397 THR HA . 25883 1 624 . 1 1 64 64 THR HG21 H 1 1.165 0.02 . 1 . . . A 397 THR HG21 . 25883 1 625 . 1 1 64 64 THR HG22 H 1 1.165 0.02 . 1 . . . A 397 THR HG22 . 25883 1 626 . 1 1 64 64 THR HG23 H 1 1.165 0.02 . 1 . . . A 397 THR HG23 . 25883 1 627 . 1 1 64 64 THR CA C 13 59.224 0.2 . 1 . . . A 397 THR CA . 25883 1 628 . 1 1 64 64 THR CB C 13 70.910 0.2 . 1 . . . A 397 THR CB . 25883 1 629 . 1 1 64 64 THR CG2 C 13 21.500 0.2 . 1 . . . A 397 THR CG2 . 25883 1 630 . 1 1 64 64 THR N N 15 115.030 0.1 . 1 . . . A 397 THR N . 25883 1 631 . 1 1 65 65 LEU H H 1 8.872 0.02 . 1 . . . A 398 LEU H . 25883 1 632 . 1 1 65 65 LEU HA H 1 4.413 0.02 . 1 . . . A 398 LEU HA . 25883 1 633 . 1 1 65 65 LEU HB2 H 1 2.042 0.02 . 2 . . . A 398 LEU HB2 . 25883 1 634 . 1 1 65 65 LEU HB3 H 1 1.667 0.02 . 2 . . . A 398 LEU HB3 . 25883 1 635 . 1 1 65 65 LEU HG H 1 1.798 0.02 . 1 . . . A 398 LEU HG . 25883 1 636 . 1 1 65 65 LEU HD11 H 1 1.085 0.02 . 2 . . . A 398 LEU HD11 . 25883 1 637 . 1 1 65 65 LEU HD12 H 1 1.085 0.02 . 2 . . . A 398 LEU HD12 . 25883 1 638 . 1 1 65 65 LEU HD13 H 1 1.085 0.02 . 2 . . . A 398 LEU HD13 . 25883 1 639 . 1 1 65 65 LEU HD21 H 1 1.140 0.02 . 2 . . . A 398 LEU HD21 . 25883 1 640 . 1 1 65 65 LEU HD22 H 1 1.140 0.02 . 2 . . . A 398 LEU HD22 . 25883 1 641 . 1 1 65 65 LEU HD23 H 1 1.140 0.02 . 2 . . . A 398 LEU HD23 . 25883 1 642 . 1 1 65 65 LEU CA C 13 58.124 0.2 . 1 . . . A 398 LEU CA . 25883 1 643 . 1 1 65 65 LEU CB C 13 40.883 0.2 . 1 . . . A 398 LEU CB . 25883 1 644 . 1 1 65 65 LEU CG C 13 27.003 0.2 . 1 . . . A 398 LEU CG . 25883 1 645 . 1 1 65 65 LEU CD1 C 13 24.819 0.2 . 1 . . . A 398 LEU CD1 . 25883 1 646 . 1 1 65 65 LEU CD2 C 13 23.288 0.2 . 1 . . . A 398 LEU CD2 . 25883 1 647 . 1 1 65 65 LEU N N 15 122.203 0.1 . 1 . . . A 398 LEU N . 25883 1 648 . 1 1 66 66 ASP H H 1 8.698 0.02 . 1 . . . A 399 ASP H . 25883 1 649 . 1 1 66 66 ASP HA H 1 4.391 0.02 . 1 . . . A 399 ASP HA . 25883 1 650 . 1 1 66 66 ASP HB2 H 1 2.686 0.02 . 2 . . . A 399 ASP HB2 . 25883 1 651 . 1 1 66 66 ASP HB3 H 1 2.686 0.02 . 2 . . . A 399 ASP HB3 . 25883 1 652 . 1 1 66 66 ASP CA C 13 57.532 0.2 . 1 . . . A 399 ASP CA . 25883 1 653 . 1 1 66 66 ASP CB C 13 40.474 0.2 . 1 . . . A 399 ASP CB . 25883 1 654 . 1 1 66 66 ASP N N 15 116.966 0.1 . 1 . . . A 399 ASP N . 25883 1 655 . 1 1 67 67 ALA H H 1 8.261 0.02 . 1 . . . A 400 ALA H . 25883 1 656 . 1 1 67 67 ALA HA H 1 4.318 0.02 . 1 . . . A 400 ALA HA . 25883 1 657 . 1 1 67 67 ALA HB1 H 1 1.929 0.02 . 1 . . . A 400 ALA HB1 . 25883 1 658 . 1 1 67 67 ALA HB2 H 1 1.929 0.02 . 1 . . . A 400 ALA HB2 . 25883 1 659 . 1 1 67 67 ALA HB3 H 1 1.929 0.02 . 1 . . . A 400 ALA HB3 . 25883 1 660 . 1 1 67 67 ALA CA C 13 54.662 0.2 . 1 . . . A 400 ALA CA . 25883 1 661 . 1 1 67 67 ALA CB C 13 18.172 0.2 . 1 . . . A 400 ALA CB . 25883 1 662 . 1 1 67 67 ALA N N 15 123.237 0.1 . 1 . . . A 400 ALA N . 25883 1 663 . 1 1 68 68 LEU H H 1 8.061 0.02 . 1 . . . A 401 LEU H . 25883 1 664 . 1 1 68 68 LEU HA H 1 3.849 0.02 . 1 . . . A 401 LEU HA . 25883 1 665 . 1 1 68 68 LEU HB2 H 1 2.217 0.02 . 2 . . . A 401 LEU HB2 . 25883 1 666 . 1 1 68 68 LEU HB3 H 1 1.750 0.02 . 2 . . . A 401 LEU HB3 . 25883 1 667 . 1 1 68 68 LEU HG H 1 1.364 0.02 . 1 . . . A 401 LEU HG . 25883 1 668 . 1 1 68 68 LEU HD11 H 1 0.720 0.02 . 2 . . . A 401 LEU HD11 . 25883 1 669 . 1 1 68 68 LEU HD12 H 1 0.720 0.02 . 2 . . . A 401 LEU HD12 . 25883 1 670 . 1 1 68 68 LEU HD13 H 1 0.720 0.02 . 2 . . . A 401 LEU HD13 . 25883 1 671 . 1 1 68 68 LEU HD21 H 1 0.378 0.02 . 2 . . . A 401 LEU HD21 . 25883 1 672 . 1 1 68 68 LEU HD22 H 1 0.378 0.02 . 2 . . . A 401 LEU HD22 . 25883 1 673 . 1 1 68 68 LEU HD23 H 1 0.378 0.02 . 2 . . . A 401 LEU HD23 . 25883 1 674 . 1 1 68 68 LEU CA C 13 57.556 0.2 . 1 . . . A 401 LEU CA . 25883 1 675 . 1 1 68 68 LEU CB C 13 40.962 0.2 . 1 . . . A 401 LEU CB . 25883 1 676 . 1 1 68 68 LEU CG C 13 26.655 0.2 . 1 . . . A 401 LEU CG . 25883 1 677 . 1 1 68 68 LEU CD1 C 13 25.800 0.2 . 1 . . . A 401 LEU CD1 . 25883 1 678 . 1 1 68 68 LEU CD2 C 13 22.680 0.2 . 1 . . . A 401 LEU CD2 . 25883 1 679 . 1 1 68 68 LEU N N 15 121.846 0.1 . 1 . . . A 401 LEU N . 25883 1 680 . 1 1 69 69 LEU H H 1 8.725 0.02 . 1 . . . A 402 LEU H . 25883 1 681 . 1 1 69 69 LEU HA H 1 3.899 0.02 . 1 . . . A 402 LEU HA . 25883 1 682 . 1 1 69 69 LEU HB2 H 1 2.040 0.02 . 2 . . . A 402 LEU HB2 . 25883 1 683 . 1 1 69 69 LEU HB3 H 1 1.460 0.02 . 2 . . . A 402 LEU HB3 . 25883 1 684 . 1 1 69 69 LEU HG H 1 2.042 0.02 . 1 . . . A 402 LEU HG . 25883 1 685 . 1 1 69 69 LEU HD11 H 1 0.940 0.02 . 2 . . . A 402 LEU HD11 . 25883 1 686 . 1 1 69 69 LEU HD12 H 1 0.940 0.02 . 2 . . . A 402 LEU HD12 . 25883 1 687 . 1 1 69 69 LEU HD13 H 1 0.940 0.02 . 2 . . . A 402 LEU HD13 . 25883 1 688 . 1 1 69 69 LEU HD21 H 1 0.880 0.02 . 2 . . . A 402 LEU HD21 . 25883 1 689 . 1 1 69 69 LEU HD22 H 1 0.880 0.02 . 2 . . . A 402 LEU HD22 . 25883 1 690 . 1 1 69 69 LEU HD23 H 1 0.880 0.02 . 2 . . . A 402 LEU HD23 . 25883 1 691 . 1 1 69 69 LEU CA C 13 57.721 0.2 . 1 . . . A 402 LEU CA . 25883 1 692 . 1 1 69 69 LEU CB C 13 40.318 0.2 . 1 . . . A 402 LEU CB . 25883 1 693 . 1 1 69 69 LEU CG C 13 26.328 0.2 . 1 . . . A 402 LEU CG . 25883 1 694 . 1 1 69 69 LEU CD1 C 13 25.300 0.2 . 1 . . . A 402 LEU CD1 . 25883 1 695 . 1 1 69 69 LEU CD2 C 13 22.968 0.2 . 1 . . . A 402 LEU CD2 . 25883 1 696 . 1 1 69 69 LEU N N 15 117.731 0.1 . 1 . . . A 402 LEU N . 25883 1 697 . 1 1 70 70 ALA H H 1 8.141 0.02 . 1 . . . A 403 ALA H . 25883 1 698 . 1 1 70 70 ALA HA H 1 4.053 0.02 . 1 . . . A 403 ALA HA . 25883 1 699 . 1 1 70 70 ALA HB1 H 1 1.530 0.02 . 1 . . . A 403 ALA HB1 . 25883 1 700 . 1 1 70 70 ALA HB2 H 1 1.530 0.02 . 1 . . . A 403 ALA HB2 . 25883 1 701 . 1 1 70 70 ALA HB3 H 1 1.530 0.02 . 1 . . . A 403 ALA HB3 . 25883 1 702 . 1 1 70 70 ALA CA C 13 54.783 0.2 . 1 . . . A 403 ALA CA . 25883 1 703 . 1 1 70 70 ALA CB C 13 17.572 0.2 . 1 . . . A 403 ALA CB . 25883 1 704 . 1 1 70 70 ALA N N 15 120.019 0.1 . 1 . . . A 403 ALA N . 25883 1 705 . 1 1 71 71 ALA H H 1 7.646 0.02 . 1 . . . A 404 ALA H . 25883 1 706 . 1 1 71 71 ALA HA H 1 3.890 0.02 . 1 . . . A 404 ALA HA . 25883 1 707 . 1 1 71 71 ALA HB1 H 1 1.324 0.02 . 1 . . . A 404 ALA HB1 . 25883 1 708 . 1 1 71 71 ALA HB2 H 1 1.324 0.02 . 1 . . . A 404 ALA HB2 . 25883 1 709 . 1 1 71 71 ALA HB3 H 1 1.324 0.02 . 1 . . . A 404 ALA HB3 . 25883 1 710 . 1 1 71 71 ALA CA C 13 54.978 0.2 . 1 . . . A 404 ALA CA . 25883 1 711 . 1 1 71 71 ALA CB C 13 18.378 0.2 . 1 . . . A 404 ALA CB . 25883 1 712 . 1 1 71 71 ALA N N 15 121.270 0.1 . 1 . . . A 404 ALA N . 25883 1 713 . 1 1 72 72 LEU H H 1 8.128 0.02 . 1 . . . A 405 LEU H . 25883 1 714 . 1 1 72 72 LEU HA H 1 3.914 0.02 . 1 . . . A 405 LEU HA . 25883 1 715 . 1 1 72 72 LEU HB2 H 1 1.963 0.02 . 2 . . . A 405 LEU HB2 . 25883 1 716 . 1 1 72 72 LEU HB3 H 1 1.189 0.02 . 2 . . . A 405 LEU HB3 . 25883 1 717 . 1 1 72 72 LEU HG H 1 1.770 0.02 . 1 . . . A 405 LEU HG . 25883 1 718 . 1 1 72 72 LEU HD11 H 1 0.720 0.02 . 2 . . . A 405 LEU HD11 . 25883 1 719 . 1 1 72 72 LEU HD12 H 1 0.720 0.02 . 2 . . . A 405 LEU HD12 . 25883 1 720 . 1 1 72 72 LEU HD13 H 1 0.720 0.02 . 2 . . . A 405 LEU HD13 . 25883 1 721 . 1 1 72 72 LEU HD21 H 1 0.750 0.02 . 2 . . . A 405 LEU HD21 . 25883 1 722 . 1 1 72 72 LEU HD22 H 1 0.750 0.02 . 2 . . . A 405 LEU HD22 . 25883 1 723 . 1 1 72 72 LEU HD23 H 1 0.750 0.02 . 2 . . . A 405 LEU HD23 . 25883 1 724 . 1 1 72 72 LEU CA C 13 56.776 0.2 . 1 . . . A 405 LEU CA . 25883 1 725 . 1 1 72 72 LEU CB C 13 41.409 0.2 . 1 . . . A 405 LEU CB . 25883 1 726 . 1 1 72 72 LEU CG C 13 26.000 0.2 . 1 . . . A 405 LEU CG . 25883 1 727 . 1 1 72 72 LEU CD1 C 13 25.700 0.2 . 1 . . . A 405 LEU CD1 . 25883 1 728 . 1 1 72 72 LEU CD2 C 13 23.426 0.2 . 1 . . . A 405 LEU CD2 . 25883 1 729 . 1 1 72 72 LEU N N 15 116.562 0.1 . 1 . . . A 405 LEU N . 25883 1 730 . 1 1 73 73 ARG H H 1 8.036 0.02 . 1 . . . A 406 ARG H . 25883 1 731 . 1 1 73 73 ARG HA H 1 3.884 0.02 . 1 . . . A 406 ARG HA . 25883 1 732 . 1 1 73 73 ARG HB2 H 1 1.920 0.02 . 2 . . . A 406 ARG HB2 . 25883 1 733 . 1 1 73 73 ARG HG2 H 1 1.498 0.02 . 2 . . . A 406 ARG HG2 . 25883 1 734 . 1 1 73 73 ARG HG3 H 1 1.981 0.02 . 2 . . . A 406 ARG HG3 . 25883 1 735 . 1 1 73 73 ARG HD2 H 1 3.214 0.02 . 2 . . . A 406 ARG HD2 . 25883 1 736 . 1 1 73 73 ARG HD3 H 1 3.265 0.02 . 2 . . . A 406 ARG HD3 . 25883 1 737 . 1 1 73 73 ARG HE H 1 6.976 0.02 . 1 . . . A 406 ARG HE . 25883 1 738 . 1 1 73 73 ARG CA C 13 59.766 0.2 . 1 . . . A 406 ARG CA . 25883 1 739 . 1 1 73 73 ARG CB C 13 29.391 0.2 . 1 . . . A 406 ARG CB . 25883 1 740 . 1 1 73 73 ARG CG C 13 29.000 0.2 . 1 . . . A 406 ARG CG . 25883 1 741 . 1 1 73 73 ARG CD C 13 42.949 0.2 . 1 . . . A 406 ARG CD . 25883 1 742 . 1 1 73 73 ARG N N 15 118.370 0.1 . 1 . . . A 406 ARG N . 25883 1 743 . 1 1 73 73 ARG NE N 15 85.273 0.1 . 1 . . . A 406 ARG NE . 25883 1 744 . 1 1 74 74 ARG H H 1 7.885 0.02 . 1 . . . A 407 ARG H . 25883 1 745 . 1 1 74 74 ARG HA H 1 4.146 0.02 . 1 . . . A 407 ARG HA . 25883 1 746 . 1 1 74 74 ARG HB2 H 1 1.802 0.02 . 2 . . . A 407 ARG HB2 . 25883 1 747 . 1 1 74 74 ARG HB3 H 1 2.050 0.02 . 2 . . . A 407 ARG HB3 . 25883 1 748 . 1 1 74 74 ARG HG2 H 1 1.519 0.02 . 2 . . . A 407 ARG HG2 . 25883 1 749 . 1 1 74 74 ARG HG3 H 1 2.070 0.02 . 2 . . . A 407 ARG HG3 . 25883 1 750 . 1 1 74 74 ARG HD2 H 1 3.230 0.02 . 2 . . . A 407 ARG HD2 . 25883 1 751 . 1 1 74 74 ARG HD3 H 1 3.386 0.02 . 2 . . . A 407 ARG HD3 . 25883 1 752 . 1 1 74 74 ARG CA C 13 59.735 0.2 . 1 . . . A 407 ARG CA . 25883 1 753 . 1 1 74 74 ARG CB C 13 29.985 0.2 . 1 . . . A 407 ARG CB . 25883 1 754 . 1 1 74 74 ARG CG C 13 28.433 0.2 . 1 . . . A 407 ARG CG . 25883 1 755 . 1 1 74 74 ARG CD C 13 43.223 0.2 . 1 . . . A 407 ARG CD . 25883 1 756 . 1 1 74 74 ARG N N 15 120.166 0.1 . 1 . . . A 407 ARG N . 25883 1 757 . 1 1 75 75 ILE H H 1 7.353 0.02 . 1 . . . A 408 ILE H . 25883 1 758 . 1 1 75 75 ILE HA H 1 4.603 0.02 . 1 . . . A 408 ILE HA . 25883 1 759 . 1 1 75 75 ILE HB H 1 2.179 0.02 . 1 . . . A 408 ILE HB . 25883 1 760 . 1 1 75 75 ILE HG12 H 1 1.363 0.02 . 1 . . . A 408 ILE HG12 . 25883 1 761 . 1 1 75 75 ILE HG13 H 1 1.475 0.02 . 1 . . . A 408 ILE HG13 . 25883 1 762 . 1 1 75 75 ILE HG21 H 1 0.800 0.02 . 1 . . . A 408 ILE HG21 . 25883 1 763 . 1 1 75 75 ILE HG22 H 1 0.800 0.02 . 1 . . . A 408 ILE HG22 . 25883 1 764 . 1 1 75 75 ILE HG23 H 1 0.800 0.02 . 1 . . . A 408 ILE HG23 . 25883 1 765 . 1 1 75 75 ILE HD11 H 1 0.785 0.02 . 1 . . . A 408 ILE HD11 . 25883 1 766 . 1 1 75 75 ILE HD12 H 1 0.785 0.02 . 1 . . . A 408 ILE HD12 . 25883 1 767 . 1 1 75 75 ILE HD13 H 1 0.785 0.02 . 1 . . . A 408 ILE HD13 . 25883 1 768 . 1 1 75 75 ILE CA C 13 60.840 0.2 . 1 . . . A 408 ILE CA . 25883 1 769 . 1 1 75 75 ILE CB C 13 36.543 0.2 . 1 . . . A 408 ILE CB . 25883 1 770 . 1 1 75 75 ILE CG1 C 13 26.291 0.2 . 1 . . . A 408 ILE CG1 . 25883 1 771 . 1 1 75 75 ILE CG2 C 13 17.575 0.2 . 1 . . . A 408 ILE CG2 . 25883 1 772 . 1 1 75 75 ILE CD1 C 13 14.670 0.2 . 1 . . . A 408 ILE CD1 . 25883 1 773 . 1 1 75 75 ILE N N 15 110.667 0.1 . 1 . . . A 408 ILE N . 25883 1 774 . 1 1 76 76 GLN H H 1 7.744 0.02 . 1 . . . A 409 GLN H . 25883 1 775 . 1 1 76 76 GLN HA H 1 4.012 0.02 . 1 . . . A 409 GLN HA . 25883 1 776 . 1 1 76 76 GLN HB2 H 1 2.360 0.02 . 2 . . . A 409 GLN HB2 . 25883 1 777 . 1 1 76 76 GLN HB3 H 1 2.360 0.02 . 2 . . . A 409 GLN HB3 . 25883 1 778 . 1 1 76 76 GLN HG2 H 1 2.280 0.02 . 2 . . . A 409 GLN HG2 . 25883 1 779 . 1 1 76 76 GLN HG3 H 1 2.330 0.02 . 2 . . . A 409 GLN HG3 . 25883 1 780 . 1 1 76 76 GLN HE21 H 1 7.421 0.02 . 2 . . . A 409 GLN HE21 . 25883 1 781 . 1 1 76 76 GLN HE22 H 1 6.761 0.02 . 2 . . . A 409 GLN HE22 . 25883 1 782 . 1 1 76 76 GLN CA C 13 56.594 0.2 . 1 . . . A 409 GLN CA . 25883 1 783 . 1 1 76 76 GLN CB C 13 24.903 0.2 . 1 . . . A 409 GLN CB . 25883 1 784 . 1 1 76 76 GLN CG C 13 33.806 0.2 . 1 . . . A 409 GLN CG . 25883 1 785 . 1 1 76 76 GLN N N 15 113.809 0.1 . 1 . . . A 409 GLN N . 25883 1 786 . 1 1 76 76 GLN NE2 N 15 112.164 0.1 . 1 . . . A 409 GLN NE2 . 25883 1 787 . 1 1 77 77 ARG H H 1 8.083 0.02 . 1 . . . A 410 ARG H . 25883 1 788 . 1 1 77 77 ARG HA H 1 5.081 0.02 . 1 . . . A 410 ARG HA . 25883 1 789 . 1 1 77 77 ARG HB2 H 1 2.040 0.02 . 2 . . . A 410 ARG HB2 . 25883 1 790 . 1 1 77 77 ARG HB3 H 1 1.600 0.02 . 2 . . . A 410 ARG HB3 . 25883 1 791 . 1 1 77 77 ARG HG2 H 1 1.550 0.02 . 2 . . . A 410 ARG HG2 . 25883 1 792 . 1 1 77 77 ARG HG3 H 1 1.520 0.02 . 2 . . . A 410 ARG HG3 . 25883 1 793 . 1 1 77 77 ARG HD2 H 1 3.391 0.02 . 2 . . . A 410 ARG HD2 . 25883 1 794 . 1 1 77 77 ARG HD3 H 1 3.391 0.02 . 2 . . . A 410 ARG HD3 . 25883 1 795 . 1 1 77 77 ARG CA C 13 51.126 0.2 . 1 . . . A 410 ARG CA . 25883 1 796 . 1 1 77 77 ARG CB C 13 26.929 0.2 . 1 . . . A 410 ARG CB . 25883 1 797 . 1 1 77 77 ARG CG C 13 24.546 0.2 . 1 . . . A 410 ARG CG . 25883 1 798 . 1 1 77 77 ARG CD C 13 40.012 0.2 . 1 . . . A 410 ARG CD . 25883 1 799 . 1 1 77 77 ARG N N 15 117.456 0.1 . 1 . . . A 410 ARG N . 25883 1 800 . 1 1 78 78 ALA H H 1 8.132 0.02 . 1 . . . A 411 ALA H . 25883 1 801 . 1 1 78 78 ALA HA H 1 3.930 0.02 . 1 . . . A 411 ALA HA . 25883 1 802 . 1 1 78 78 ALA HB1 H 1 1.493 0.02 . 1 . . . A 411 ALA HB1 . 25883 1 803 . 1 1 78 78 ALA HB2 H 1 1.493 0.02 . 1 . . . A 411 ALA HB2 . 25883 1 804 . 1 1 78 78 ALA HB3 H 1 1.493 0.02 . 1 . . . A 411 ALA HB3 . 25883 1 805 . 1 1 78 78 ALA CA C 13 54.428 0.2 . 1 . . . A 411 ALA CA . 25883 1 806 . 1 1 78 78 ALA CB C 13 18.007 0.2 . 1 . . . A 411 ALA CB . 25883 1 807 . 1 1 78 78 ALA N N 15 123.150 0.1 . 1 . . . A 411 ALA N . 25883 1 808 . 1 1 79 79 ASP H H 1 8.995 0.02 . 1 . . . A 412 ASP H . 25883 1 809 . 1 1 79 79 ASP HA H 1 4.310 0.02 . 1 . . . A 412 ASP HA . 25883 1 810 . 1 1 79 79 ASP HB2 H 1 2.819 0.02 . 2 . . . A 412 ASP HB2 . 25883 1 811 . 1 1 79 79 ASP HB3 H 1 2.609 0.02 . 2 . . . A 412 ASP HB3 . 25883 1 812 . 1 1 79 79 ASP CA C 13 55.810 0.2 . 1 . . . A 412 ASP CA . 25883 1 813 . 1 1 79 79 ASP CB C 13 38.466 0.2 . 1 . . . A 412 ASP CB . 25883 1 814 . 1 1 79 79 ASP N N 15 116.480 0.1 . 1 . . . A 412 ASP N . 25883 1 815 . 1 1 80 80 LEU H H 1 7.520 0.02 . 1 . . . A 413 LEU H . 25883 1 816 . 1 1 80 80 LEU HA H 1 4.221 0.02 . 1 . . . A 413 LEU HA . 25883 1 817 . 1 1 80 80 LEU HB2 H 1 1.997 0.02 . 2 . . . A 413 LEU HB2 . 25883 1 818 . 1 1 80 80 LEU HB3 H 1 1.372 0.02 . 2 . . . A 413 LEU HB3 . 25883 1 819 . 1 1 80 80 LEU HG H 1 1.757 0.02 . 1 . . . A 413 LEU HG . 25883 1 820 . 1 1 80 80 LEU HD11 H 1 0.920 0.02 . 2 . . . A 413 LEU HD11 . 25883 1 821 . 1 1 80 80 LEU HD12 H 1 0.920 0.02 . 2 . . . A 413 LEU HD12 . 25883 1 822 . 1 1 80 80 LEU HD13 H 1 0.920 0.02 . 2 . . . A 413 LEU HD13 . 25883 1 823 . 1 1 80 80 LEU HD21 H 1 0.900 0.02 . 2 . . . A 413 LEU HD21 . 25883 1 824 . 1 1 80 80 LEU HD22 H 1 0.900 0.02 . 2 . . . A 413 LEU HD22 . 25883 1 825 . 1 1 80 80 LEU HD23 H 1 0.900 0.02 . 2 . . . A 413 LEU HD23 . 25883 1 826 . 1 1 80 80 LEU CA C 13 56.399 0.2 . 1 . . . A 413 LEU CA . 25883 1 827 . 1 1 80 80 LEU CB C 13 41.702 0.2 . 1 . . . A 413 LEU CB . 25883 1 828 . 1 1 80 80 LEU CG C 13 26.805 0.2 . 1 . . . A 413 LEU CG . 25883 1 829 . 1 1 80 80 LEU CD1 C 13 25.233 0.2 . 1 . . . A 413 LEU CD1 . 25883 1 830 . 1 1 80 80 LEU CD2 C 13 22.644 0.2 . 1 . . . A 413 LEU CD2 . 25883 1 831 . 1 1 80 80 LEU N N 15 120.767 0.1 . 1 . . . A 413 LEU N . 25883 1 832 . 1 1 81 81 VAL H H 1 7.287 0.02 . 1 . . . A 414 VAL H . 25883 1 833 . 1 1 81 81 VAL HA H 1 3.550 0.02 . 1 . . . A 414 VAL HA . 25883 1 834 . 1 1 81 81 VAL HB H 1 2.287 0.02 . 1 . . . A 414 VAL HB . 25883 1 835 . 1 1 81 81 VAL HG11 H 1 0.989 0.02 . 2 . . . A 414 VAL HG11 . 25883 1 836 . 1 1 81 81 VAL HG12 H 1 0.989 0.02 . 2 . . . A 414 VAL HG12 . 25883 1 837 . 1 1 81 81 VAL HG13 H 1 0.989 0.02 . 2 . . . A 414 VAL HG13 . 25883 1 838 . 1 1 81 81 VAL HG21 H 1 1.040 0.02 . 2 . . . A 414 VAL HG21 . 25883 1 839 . 1 1 81 81 VAL HG22 H 1 1.040 0.02 . 2 . . . A 414 VAL HG22 . 25883 1 840 . 1 1 81 81 VAL HG23 H 1 1.040 0.02 . 2 . . . A 414 VAL HG23 . 25883 1 841 . 1 1 81 81 VAL CA C 13 65.989 0.2 . 1 . . . A 414 VAL CA . 25883 1 842 . 1 1 81 81 VAL CB C 13 31.317 0.2 . 1 . . . A 414 VAL CB . 25883 1 843 . 1 1 81 81 VAL CG1 C 13 21.344 0.2 . 1 . . . A 414 VAL CG1 . 25883 1 844 . 1 1 81 81 VAL CG2 C 13 23.420 0.2 . 1 . . . A 414 VAL CG2 . 25883 1 845 . 1 1 81 81 VAL N N 15 117.918 0.1 . 1 . . . A 414 VAL N . 25883 1 846 . 1 1 82 82 GLU H H 1 8.017 0.02 . 1 . . . A 415 GLU H . 25883 1 847 . 1 1 82 82 GLU HA H 1 4.020 0.02 . 1 . . . A 415 GLU HA . 25883 1 848 . 1 1 82 82 GLU HB2 H 1 2.099 0.02 . 2 . . . A 415 GLU HB2 . 25883 1 849 . 1 1 82 82 GLU HB3 H 1 2.099 0.02 . 2 . . . A 415 GLU HB3 . 25883 1 850 . 1 1 82 82 GLU HG2 H 1 2.350 0.02 . 2 . . . A 415 GLU HG2 . 25883 1 851 . 1 1 82 82 GLU HG3 H 1 2.290 0.02 . 2 . . . A 415 GLU HG3 . 25883 1 852 . 1 1 82 82 GLU CA C 13 58.907 0.2 . 1 . . . A 415 GLU CA . 25883 1 853 . 1 1 82 82 GLU CB C 13 28.880 0.2 . 1 . . . A 415 GLU CB . 25883 1 854 . 1 1 82 82 GLU CG C 13 35.806 0.2 . 1 . . . A 415 GLU CG . 25883 1 855 . 1 1 82 82 GLU N N 15 118.646 0.1 . 1 . . . A 415 GLU N . 25883 1 856 . 1 1 83 83 SER H H 1 7.718 0.02 . 1 . . . A 416 SER H . 25883 1 857 . 1 1 83 83 SER HA H 1 4.313 0.02 . 1 . . . A 416 SER HA . 25883 1 858 . 1 1 83 83 SER HB2 H 1 3.979 0.02 . 2 . . . A 416 SER HB2 . 25883 1 859 . 1 1 83 83 SER HB3 H 1 3.979 0.02 . 2 . . . A 416 SER HB3 . 25883 1 860 . 1 1 83 83 SER CA C 13 60.967 0.2 . 1 . . . A 416 SER CA . 25883 1 861 . 1 1 83 83 SER CB C 13 62.950 0.2 . 1 . . . A 416 SER CB . 25883 1 862 . 1 1 83 83 SER N N 15 113.601 0.1 . 1 . . . A 416 SER N . 25883 1 863 . 1 1 84 84 LEU H H 1 7.866 0.02 . 1 . . . A 417 LEU H . 25883 1 864 . 1 1 84 84 LEU HA H 1 4.249 0.02 . 1 . . . A 417 LEU HA . 25883 1 865 . 1 1 84 84 LEU HB2 H 1 1.901 0.02 . 2 . . . A 417 LEU HB2 . 25883 1 866 . 1 1 84 84 LEU HB3 H 1 1.581 0.02 . 2 . . . A 417 LEU HB3 . 25883 1 867 . 1 1 84 84 LEU HG H 1 1.791 0.02 . 1 . . . A 417 LEU HG . 25883 1 868 . 1 1 84 84 LEU HD11 H 1 0.820 0.02 . 2 . . . A 417 LEU HD11 . 25883 1 869 . 1 1 84 84 LEU HD12 H 1 0.820 0.02 . 2 . . . A 417 LEU HD12 . 25883 1 870 . 1 1 84 84 LEU HD13 H 1 0.820 0.02 . 2 . . . A 417 LEU HD13 . 25883 1 871 . 1 1 84 84 LEU HD21 H 1 0.890 0.02 . 2 . . . A 417 LEU HD21 . 25883 1 872 . 1 1 84 84 LEU HD22 H 1 0.890 0.02 . 2 . . . A 417 LEU HD22 . 25883 1 873 . 1 1 84 84 LEU HD23 H 1 0.890 0.02 . 2 . . . A 417 LEU HD23 . 25883 1 874 . 1 1 84 84 LEU CA C 13 56.530 0.2 . 1 . . . A 417 LEU CA . 25883 1 875 . 1 1 84 84 LEU CB C 13 42.773 0.2 . 1 . . . A 417 LEU CB . 25883 1 876 . 1 1 84 84 LEU CG C 13 26.914 0.2 . 1 . . . A 417 LEU CG . 25883 1 877 . 1 1 84 84 LEU CD1 C 13 25.004 0.2 . 1 . . . A 417 LEU CD1 . 25883 1 878 . 1 1 84 84 LEU CD2 C 13 24.198 0.2 . 1 . . . A 417 LEU CD2 . 25883 1 879 . 1 1 84 84 LEU N N 15 120.719 0.1 . 1 . . . A 417 LEU N . 25883 1 880 . 1 1 85 85 CYS H H 1 7.895 0.02 . 1 . . . A 418 CYS H . 25883 1 881 . 1 1 85 85 CYS HA H 1 4.547 0.02 . 1 . . . A 418 CYS HA . 25883 1 882 . 1 1 85 85 CYS HB2 H 1 3.047 0.02 . 2 . . . A 418 CYS HB2 . 25883 1 883 . 1 1 85 85 CYS HB3 H 1 2.919 0.02 . 2 . . . A 418 CYS HB3 . 25883 1 884 . 1 1 85 85 CYS CA C 13 59.395 0.2 . 1 . . . A 418 CYS CA . 25883 1 885 . 1 1 85 85 CYS CB C 13 27.706 0.2 . 1 . . . A 418 CYS CB . 25883 1 886 . 1 1 85 85 CYS N N 15 115.958 0.1 . 1 . . . A 418 CYS N . 25883 1 887 . 1 1 86 86 SER H H 1 7.874 0.02 . 1 . . . A 419 SER H . 25883 1 888 . 1 1 86 86 SER HA H 1 4.468 0.02 . 1 . . . A 419 SER HA . 25883 1 889 . 1 1 86 86 SER HB2 H 1 3.972 0.02 . 2 . . . A 419 SER HB2 . 25883 1 890 . 1 1 86 86 SER HB3 H 1 3.972 0.02 . 2 . . . A 419 SER HB3 . 25883 1 891 . 1 1 86 86 SER CA C 13 58.500 0.2 . 1 . . . A 419 SER CA . 25883 1 892 . 1 1 86 86 SER CB C 13 63.543 0.2 . 1 . . . A 419 SER CB . 25883 1 893 . 1 1 86 86 SER N N 15 116.649 0.1 . 1 . . . A 419 SER N . 25883 1 894 . 1 1 87 87 GLU H H 1 8.455 0.02 . 1 . . . A 420 GLU H . 25883 1 895 . 1 1 87 87 GLU HA H 1 4.398 0.02 . 1 . . . A 420 GLU HA . 25883 1 896 . 1 1 87 87 GLU HB2 H 1 1.990 0.02 . 2 . . . A 420 GLU HB2 . 25883 1 897 . 1 1 87 87 GLU HB3 H 1 2.128 0.02 . 2 . . . A 420 GLU HB3 . 25883 1 898 . 1 1 87 87 GLU HG2 H 1 2.302 0.02 . 2 . . . A 420 GLU HG2 . 25883 1 899 . 1 1 87 87 GLU HG3 H 1 2.302 0.02 . 2 . . . A 420 GLU HG3 . 25883 1 900 . 1 1 87 87 GLU CA C 13 56.280 0.2 . 1 . . . A 420 GLU CA . 25883 1 901 . 1 1 87 87 GLU CB C 13 29.906 0.2 . 1 . . . A 420 GLU CB . 25883 1 902 . 1 1 87 87 GLU CG C 13 35.888 0.2 . 1 . . . A 420 GLU CG . 25883 1 903 . 1 1 87 87 GLU N N 15 122.588 0.1 . 1 . . . A 420 GLU N . 25883 1 904 . 1 1 88 88 SER H H 1 8.347 0.02 . 1 . . . A 421 SER H . 25883 1 905 . 1 1 88 88 SER HA H 1 4.544 0.02 . 1 . . . A 421 SER HA . 25883 1 906 . 1 1 88 88 SER HB2 H 1 3.917 0.02 . 2 . . . A 421 SER HB2 . 25883 1 907 . 1 1 88 88 SER HB3 H 1 3.917 0.02 . 2 . . . A 421 SER HB3 . 25883 1 908 . 1 1 88 88 SER CA C 13 58.123 0.2 . 1 . . . A 421 SER CA . 25883 1 909 . 1 1 88 88 SER CB C 13 63.468 0.2 . 1 . . . A 421 SER CB . 25883 1 910 . 1 1 88 88 SER N N 15 116.577 0.1 . 1 . . . A 421 SER N . 25883 1 911 . 1 1 89 89 THR H H 1 8.170 0.02 . 1 . . . A 422 THR H . 25883 1 912 . 1 1 89 89 THR HA H 1 4.400 0.02 . 1 . . . A 422 THR HA . 25883 1 913 . 1 1 89 89 THR HB H 1 4.299 0.02 . 1 . . . A 422 THR HB . 25883 1 914 . 1 1 89 89 THR HG21 H 1 1.236 0.02 . 1 . . . A 422 THR HG21 . 25883 1 915 . 1 1 89 89 THR HG22 H 1 1.236 0.02 . 1 . . . A 422 THR HG22 . 25883 1 916 . 1 1 89 89 THR HG23 H 1 1.236 0.02 . 1 . . . A 422 THR HG23 . 25883 1 917 . 1 1 89 89 THR CA C 13 61.459 0.2 . 1 . . . A 422 THR CA . 25883 1 918 . 1 1 89 89 THR CB C 13 69.302 0.2 . 1 . . . A 422 THR CB . 25883 1 919 . 1 1 89 89 THR CG2 C 13 21.253 0.2 . 1 . . . A 422 THR CG2 . 25883 1 920 . 1 1 89 89 THR N N 15 115.750 0.1 . 1 . . . A 422 THR N . 25883 1 921 . 1 1 90 90 ALA H H 1 8.257 0.02 . 1 . . . A 423 ALA H . 25883 1 922 . 1 1 90 90 ALA HA H 1 4.430 0.02 . 1 . . . A 423 ALA HA . 25883 1 923 . 1 1 90 90 ALA HB1 H 1 1.431 0.02 . 1 . . . A 423 ALA HB1 . 25883 1 924 . 1 1 90 90 ALA HB2 H 1 1.431 0.02 . 1 . . . A 423 ALA HB2 . 25883 1 925 . 1 1 90 90 ALA HB3 H 1 1.431 0.02 . 1 . . . A 423 ALA HB3 . 25883 1 926 . 1 1 90 90 ALA CA C 13 52.251 0.2 . 1 . . . A 423 ALA CA . 25883 1 927 . 1 1 90 90 ALA CB C 13 18.917 0.2 . 1 . . . A 423 ALA CB . 25883 1 928 . 1 1 90 90 ALA N N 15 126.283 0.1 . 1 . . . A 423 ALA N . 25883 1 929 . 1 1 91 91 THR H H 1 8.085 0.02 . 1 . . . A 424 THR H . 25883 1 930 . 1 1 91 91 THR HA H 1 4.379 0.02 . 1 . . . A 424 THR HA . 25883 1 931 . 1 1 91 91 THR HB H 1 4.242 0.02 . 1 . . . A 424 THR HB . 25883 1 932 . 1 1 91 91 THR HG21 H 1 1.216 0.02 . 1 . . . A 424 THR HG21 . 25883 1 933 . 1 1 91 91 THR HG22 H 1 1.216 0.02 . 1 . . . A 424 THR HG22 . 25883 1 934 . 1 1 91 91 THR HG23 H 1 1.216 0.02 . 1 . . . A 424 THR HG23 . 25883 1 935 . 1 1 91 91 THR CA C 13 61.184 0.2 . 1 . . . A 424 THR CA . 25883 1 936 . 1 1 91 91 THR CB C 13 69.503 0.2 . 1 . . . A 424 THR CB . 25883 1 937 . 1 1 91 91 THR CG2 C 13 21.226 0.2 . 1 . . . A 424 THR CG2 . 25883 1 938 . 1 1 91 91 THR N N 15 113.037 0.1 . 1 . . . A 424 THR N . 25883 1 939 . 1 1 92 92 SER H H 1 8.236 0.02 . 1 . . . A 425 SER H . 25883 1 940 . 1 1 92 92 SER HB2 H 1 3.848 0.02 . 2 . . . A 425 SER HB2 . 25883 1 941 . 1 1 92 92 SER HB3 H 1 3.917 0.02 . 2 . . . A 425 SER HB3 . 25883 1 942 . 1 1 92 92 SER CA C 13 55.912 0.2 . 1 . . . A 425 SER CA . 25883 1 943 . 1 1 92 92 SER CB C 13 63.141 0.2 . 1 . . . A 425 SER CB . 25883 1 944 . 1 1 92 92 SER N N 15 119.377 0.1 . 1 . . . A 425 SER N . 25883 1 945 . 1 1 93 93 PRO HA H 1 4.520 0.02 . 1 . . . A 426 PRO HA . 25883 1 946 . 1 1 93 93 PRO HB2 H 1 2.293 0.02 . 2 . . . A 426 PRO HB2 . 25883 1 947 . 1 1 93 93 PRO HB3 H 1 2.293 0.02 . 2 . . . A 426 PRO HB3 . 25883 1 948 . 1 1 93 93 PRO HG2 H 1 2.035 0.02 . 2 . . . A 426 PRO HG2 . 25883 1 949 . 1 1 93 93 PRO HG3 H 1 2.035 0.02 . 2 . . . A 426 PRO HG3 . 25883 1 950 . 1 1 93 93 PRO HD2 H 1 3.811 0.02 . 2 . . . A 426 PRO HD2 . 25883 1 951 . 1 1 93 93 PRO HD3 H 1 3.811 0.02 . 2 . . . A 426 PRO HD3 . 25883 1 952 . 1 1 93 93 PRO CA C 13 63.158 0.2 . 1 . . . A 426 PRO CA . 25883 1 953 . 1 1 93 93 PRO CB C 13 31.588 0.2 . 1 . . . A 426 PRO CB . 25883 1 954 . 1 1 93 93 PRO CG C 13 26.793 0.2 . 1 . . . A 426 PRO CG . 25883 1 955 . 1 1 93 93 PRO CD C 13 50.373 0.2 . 1 . . . A 426 PRO CD . 25883 1 956 . 1 1 94 94 VAL H H 1 7.632 0.02 . 1 . . . A 427 VAL H . 25883 1 957 . 1 1 94 94 VAL HA H 1 4.067 0.02 . 1 . . . A 427 VAL HA . 25883 1 958 . 1 1 94 94 VAL HB H 1 2.095 0.02 . 1 . . . A 427 VAL HB . 25883 1 959 . 1 1 94 94 VAL HG11 H 1 0.902 0.02 . 2 . . . A 427 VAL HG11 . 25883 1 960 . 1 1 94 94 VAL HG12 H 1 0.902 0.02 . 2 . . . A 427 VAL HG12 . 25883 1 961 . 1 1 94 94 VAL HG13 H 1 0.902 0.02 . 2 . . . A 427 VAL HG13 . 25883 1 962 . 1 1 94 94 VAL HG21 H 1 0.933 0.02 . 2 . . . A 427 VAL HG21 . 25883 1 963 . 1 1 94 94 VAL HG22 H 1 0.933 0.02 . 2 . . . A 427 VAL HG22 . 25883 1 964 . 1 1 94 94 VAL HG23 H 1 0.933 0.02 . 2 . . . A 427 VAL HG23 . 25883 1 965 . 1 1 94 94 VAL CA C 13 63.138 0.2 . 1 . . . A 427 VAL CA . 25883 1 966 . 1 1 94 94 VAL CB C 13 33.010 0.2 . 1 . . . A 427 VAL CB . 25883 1 967 . 1 1 94 94 VAL CG1 C 13 19.660 0.2 . 1 . . . A 427 VAL CG1 . 25883 1 968 . 1 1 94 94 VAL CG2 C 13 21.234 0.2 . 1 . . . A 427 VAL CG2 . 25883 1 969 . 1 1 94 94 VAL N N 15 123.322 0.1 . 1 . . . A 427 VAL N . 25883 1 stop_ save_