data_51974 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51974 _Entry.Title ; Chemical shift assignments for the seventh (HhH)2 repeat from Topoisomerase V ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-05-23 _Entry.Accession_date 2023-05-23 _Entry.Last_release_date 2023-05-23 _Entry.Original_release_date 2023-05-23 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Mark Petersen . . . 0000-0002-5655-805X 51974 2 Rebecca Fang . . . . 51974 3 Ananya Majumdar . . . 0000-0001-9899-0433 51974 4 Doug Barrick . . . 0000-0001-7291-1389 51974 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51974 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 331 51974 '15N chemical shifts' 79 51974 '1H chemical shifts' 489 51974 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 . . 2023-08-19 . original BMRB . 51974 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51975 'the sixth and seventh (HhH)2 repeats from Topoisomerase V' 51974 BMRB 51983 'the seventh and eighth (HhH)2 repeats from Topoisomerase V' 51974 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51974 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37262333 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Stability Islands and the Folding Cooperativity of a Seven-Repeat Array from Topoisomerase V ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 145 _Citation.Journal_issue 23 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-5126 _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 12641 _Citation.Page_last 12650 _Citation.Year 2023 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Mark Petersen . . . . 51974 1 2 Rebecca Fang . . . . 51974 1 3 Ananya Majumdar . . . . 51974 1 4 Doug Barrick . . . . 51974 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51974 _Assembly.ID 1 _Assembly.Name 'Topoisomerase V repeat G' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Topoisomerase V repeat G' 1 $entity_1 . . yes native no no . . . 51974 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51974 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGSWGPEFKFLLNIEGVGPK LAERILEAVDYDLERLASLN PEELAEKVEGLGEELAERVV YAARERVESRRKSGRQERSE EEWK ; _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 84 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 51974 1 2 . GLY . 51974 1 3 . SER . 51974 1 4 . TRP . 51974 1 5 . GLY . 51974 1 6 . PRO . 51974 1 7 . GLU . 51974 1 8 . PHE . 51974 1 9 . LYS . 51974 1 10 . PHE . 51974 1 11 . LEU . 51974 1 12 . LEU . 51974 1 13 . ASN . 51974 1 14 . ILE . 51974 1 15 . GLU . 51974 1 16 . GLY . 51974 1 17 . VAL . 51974 1 18 . GLY . 51974 1 19 . PRO . 51974 1 20 . LYS . 51974 1 21 . LEU . 51974 1 22 . ALA . 51974 1 23 . GLU . 51974 1 24 . ARG . 51974 1 25 . ILE . 51974 1 26 . LEU . 51974 1 27 . GLU . 51974 1 28 . ALA . 51974 1 29 . VAL . 51974 1 30 . ASP . 51974 1 31 . TYR . 51974 1 32 . ASP . 51974 1 33 . LEU . 51974 1 34 . GLU . 51974 1 35 . ARG . 51974 1 36 . LEU . 51974 1 37 . ALA . 51974 1 38 . SER . 51974 1 39 . LEU . 51974 1 40 . ASN . 51974 1 41 . PRO . 51974 1 42 . GLU . 51974 1 43 . GLU . 51974 1 44 . LEU . 51974 1 45 . ALA . 51974 1 46 . GLU . 51974 1 47 . LYS . 51974 1 48 . VAL . 51974 1 49 . GLU . 51974 1 50 . GLY . 51974 1 51 . LEU . 51974 1 52 . GLY . 51974 1 53 . GLU . 51974 1 54 . GLU . 51974 1 55 . LEU . 51974 1 56 . ALA . 51974 1 57 . GLU . 51974 1 58 . ARG . 51974 1 59 . VAL . 51974 1 60 . VAL . 51974 1 61 . TYR . 51974 1 62 . ALA . 51974 1 63 . ALA . 51974 1 64 . ARG . 51974 1 65 . GLU . 51974 1 66 . ARG . 51974 1 67 . VAL . 51974 1 68 . GLU . 51974 1 69 . SER . 51974 1 70 . ARG . 51974 1 71 . ARG . 51974 1 72 . LYS . 51974 1 73 . SER . 51974 1 74 . GLY . 51974 1 75 . ARG . 51974 1 76 . GLN . 51974 1 77 . GLU . 51974 1 78 . ARG . 51974 1 79 . SER . 51974 1 80 . GLU . 51974 1 81 . GLU . 51974 1 82 . GLU . 51974 1 83 . TRP . 51974 1 84 . LYS . 51974 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 51974 1 . GLY 2 2 51974 1 . SER 3 3 51974 1 . TRP 4 4 51974 1 . GLY 5 5 51974 1 . PRO 6 6 51974 1 . GLU 7 7 51974 1 . PHE 8 8 51974 1 . LYS 9 9 51974 1 . PHE 10 10 51974 1 . LEU 11 11 51974 1 . LEU 12 12 51974 1 . ASN 13 13 51974 1 . ILE 14 14 51974 1 . GLU 15 15 51974 1 . GLY 16 16 51974 1 . VAL 17 17 51974 1 . GLY 18 18 51974 1 . PRO 19 19 51974 1 . LYS 20 20 51974 1 . LEU 21 21 51974 1 . ALA 22 22 51974 1 . GLU 23 23 51974 1 . ARG 24 24 51974 1 . ILE 25 25 51974 1 . LEU 26 26 51974 1 . GLU 27 27 51974 1 . ALA 28 28 51974 1 . VAL 29 29 51974 1 . ASP 30 30 51974 1 . TYR 31 31 51974 1 . ASP 32 32 51974 1 . LEU 33 33 51974 1 . GLU 34 34 51974 1 . ARG 35 35 51974 1 . LEU 36 36 51974 1 . ALA 37 37 51974 1 . SER 38 38 51974 1 . LEU 39 39 51974 1 . ASN 40 40 51974 1 . PRO 41 41 51974 1 . GLU 42 42 51974 1 . GLU 43 43 51974 1 . LEU 44 44 51974 1 . ALA 45 45 51974 1 . GLU 46 46 51974 1 . LYS 47 47 51974 1 . VAL 48 48 51974 1 . GLU 49 49 51974 1 . GLY 50 50 51974 1 . LEU 51 51 51974 1 . GLY 52 52 51974 1 . GLU 53 53 51974 1 . GLU 54 54 51974 1 . LEU 55 55 51974 1 . ALA 56 56 51974 1 . GLU 57 57 51974 1 . ARG 58 58 51974 1 . VAL 59 59 51974 1 . VAL 60 60 51974 1 . TYR 61 61 51974 1 . ALA 62 62 51974 1 . ALA 63 63 51974 1 . ARG 64 64 51974 1 . GLU 65 65 51974 1 . ARG 66 66 51974 1 . VAL 67 67 51974 1 . GLU 68 68 51974 1 . SER 69 69 51974 1 . ARG 70 70 51974 1 . ARG 71 71 51974 1 . LYS 72 72 51974 1 . SER 73 73 51974 1 . GLY 74 74 51974 1 . ARG 75 75 51974 1 . GLN 76 76 51974 1 . GLU 77 77 51974 1 . ARG 78 78 51974 1 . SER 79 79 51974 1 . GLU 80 80 51974 1 . GLU 81 81 51974 1 . GLU 82 82 51974 1 . TRP 83 83 51974 1 . LYS 84 84 51974 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51974 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 2320 organism . 'Methanopyrus kandleri' 'Methanopyrus kandleri' . . Archaea . Methanopyrus kandleri . . . . . . . . . . . top5 . 51974 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51974 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . plasmid . . pMal . . . 51974 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51974 _Sample.ID 1 _Sample.Name '13C 15N Topo V G' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '93% H2O/7% 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 'Topoisomerase V repeat G' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 325 300 350 uM . . . . 51974 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51974 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 51974 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 51974 _Sample.ID 2 _Sample.Name '15N Topo V G' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '93% H2O/7% 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 'Topoisomerase V repeat G' '[U-100% 15N]' . . 1 $entity_1 . . 625 600 650 uM . . . . 51974 2 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51974 2 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 51974 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51974 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'standard conditions for repeat G' _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 6.4 . pH 51974 1 pressure 1 . atm 51974 1 temperature 298 . K 51974 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51974 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51974 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51974 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51974 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51974 _Software.ID 3 _Software.Type . _Software.Name TALOS-N _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 51974 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 51974 _Software.ID 4 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51974 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 51974 _Software.ID 5 _Software.Type . _Software.Name CS-Rosetta _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure solution' . 51974 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51974 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'JHU Biomolecular NMR AVANCE II 600 MHz Spectrometer - "Brew"' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE II' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51974 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 2 '3D HNCO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 3 '3D HNCACB' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 4 '3D CBCA(CO)NH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 5 '3D (H)CCH-TOCSY' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 6 '3D HCCH-TOCSY' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 7 '2D 1H-13C HSQC methyl' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51974 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51974 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'G chemical shift references' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.251449530 . . . . . 51974 1 H 1 water protons . . . . ppm 4.76 internal direct 1 . . . . . 51974 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 internal indirect 0.101329118 . . . . . 51974 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51974 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Topo V repeat G chemical shifts' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 51974 1 2 '3D HNCO' . . . 51974 1 3 '3D HNCACB' . . . 51974 1 4 '3D CBCA(CO)NH' . . . 51974 1 5 '3D (H)CCH-TOCSY' . . . 51974 1 6 '3D HCCH-TOCSY' . . . 51974 1 7 '2D 1H-13C HSQC methyl' . . . 51974 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $software_4 . . 51974 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 GLY HA2 H 1 3.791 . . 2 . . . . . 2 GLY HA2 . 51974 1 2 . 1 . 1 2 2 GLY HA3 H 1 3.791 . . 2 . . . . . 2 GLY HA3 . 51974 1 3 . 1 . 1 2 2 GLY C C 13 173.081 . . 1 . . . . . 2 GLY C . 51974 1 4 . 1 . 1 2 2 GLY CA C 13 45.109 . . 1 . . . . . 2 GLY CA . 51974 1 5 . 1 . 1 3 3 SER H H 1 7.964 . . 1 . . . . . 3 SER H . 51974 1 6 . 1 . 1 3 3 SER HA H 1 4.205 . . 1 . . . . . 3 SER HA . 51974 1 7 . 1 . 1 3 3 SER HB2 H 1 3.642 . . 2 . . . . . 3 SER HB2 . 51974 1 8 . 1 . 1 3 3 SER HB3 H 1 3.642 . . 2 . . . . . 3 SER HB3 . 51974 1 9 . 1 . 1 3 3 SER C C 13 173.568 . . 1 . . . . . 3 SER C . 51974 1 10 . 1 . 1 3 3 SER CA C 13 57.771 . . 1 . . . . . 3 SER CA . 51974 1 11 . 1 . 1 3 3 SER CB C 13 64.380 . . 1 . . . . . 3 SER CB . 51974 1 12 . 1 . 1 3 3 SER N N 15 114.570 . . 1 . . . . . 3 SER N . 51974 1 13 . 1 . 1 4 4 TRP H H 1 8.232 . . 1 . . . . . 4 TRP H . 51974 1 14 . 1 . 1 4 4 TRP C C 13 176.178 . . 1 . . . . . 4 TRP C . 51974 1 15 . 1 . 1 4 4 TRP CA C 13 57.731 . . 1 . . . . . 4 TRP CA . 51974 1 16 . 1 . 1 4 4 TRP CB C 13 29.669 . . 1 . . . . . 4 TRP CB . 51974 1 17 . 1 . 1 4 4 TRP N N 15 121.776 . . 1 . . . . . 4 TRP N . 51974 1 18 . 1 . 1 5 5 GLY H H 1 7.567 . . 1 . . . . . 5 GLY H . 51974 1 19 . 1 . 1 5 5 GLY CA C 13 45.237 . . 1 . . . . . 5 GLY CA . 51974 1 20 . 1 . 1 5 5 GLY N N 15 110.533 . . 1 . . . . . 5 GLY N . 51974 1 21 . 1 . 1 6 6 PRO HA H 1 4.242 . . 1 . . . . . 6 PRO HA . 51974 1 22 . 1 . 1 6 6 PRO HB2 H 1 1.999 . . 2 . . . . . 6 PRO HB2 . 51974 1 23 . 1 . 1 6 6 PRO HB3 H 1 1.999 . . 2 . . . . . 6 PRO HB3 . 51974 1 24 . 1 . 1 6 6 PRO HG2 H 1 2.364 . . 2 . . . . . 6 PRO HG2 . 51974 1 25 . 1 . 1 6 6 PRO HG3 H 1 2.364 . . 2 . . . . . 6 PRO HG3 . 51974 1 26 . 1 . 1 6 6 PRO HD2 H 1 3.790 . . 1 . . . . . 6 PRO HD2 . 51974 1 27 . 1 . 1 6 6 PRO HD3 H 1 3.622 . . 1 . . . . . 6 PRO HD3 . 51974 1 28 . 1 . 1 6 6 PRO C C 13 178.650 . . 1 . . . . . 6 PRO C . 51974 1 29 . 1 . 1 6 6 PRO CA C 13 64.983 . . 1 . . . . . 6 PRO CA . 51974 1 30 . 1 . 1 6 6 PRO CB C 13 32.085 . . 1 . . . . . 6 PRO CB . 51974 1 31 . 1 . 1 6 6 PRO CG C 13 27.440 . . 1 . . . . . 6 PRO CG . 51974 1 32 . 1 . 1 6 6 PRO CD C 13 50.112 . . 1 . . . . . 6 PRO CD . 51974 1 33 . 1 . 1 7 7 GLU H H 1 9.617 . . 1 . . . . . 7 GLU H . 51974 1 34 . 1 . 1 7 7 GLU HA H 1 4.095 . . 1 . . . . . 7 GLU HA . 51974 1 35 . 1 . 1 7 7 GLU HB2 H 1 1.652 . . 2 . . . . . 7 GLU HB2 . 51974 1 36 . 1 . 1 7 7 GLU HB3 H 1 1.652 . . 2 . . . . . 7 GLU HB3 . 51974 1 37 . 1 . 1 7 7 GLU HG2 H 1 1.835 . . 2 . . . . . 7 GLU HG2 . 51974 1 38 . 1 . 1 7 7 GLU HG3 H 1 1.835 . . 2 . . . . . 7 GLU HG3 . 51974 1 39 . 1 . 1 7 7 GLU C C 13 176.614 . . 1 . . . . . 7 GLU C . 51974 1 40 . 1 . 1 7 7 GLU CA C 13 59.018 . . 1 . . . . . 7 GLU CA . 51974 1 41 . 1 . 1 7 7 GLU CB C 13 28.429 . . 1 . . . . . 7 GLU CB . 51974 1 42 . 1 . 1 7 7 GLU CG C 13 35.746 . . 1 . . . . . 7 GLU CG . 51974 1 43 . 1 . 1 7 7 GLU N N 15 120.229 . . 1 . . . . . 7 GLU N . 51974 1 44 . 1 . 1 8 8 PHE H H 1 7.663 . . 1 . . . . . 8 PHE H . 51974 1 45 . 1 . 1 8 8 PHE C C 13 176.108 . . 1 . . . . . 8 PHE C . 51974 1 46 . 1 . 1 8 8 PHE CA C 13 58.458 . . 1 . . . . . 8 PHE CA . 51974 1 47 . 1 . 1 8 8 PHE CB C 13 40.226 . . 1 . . . . . 8 PHE CB . 51974 1 48 . 1 . 1 8 8 PHE N N 15 115.491 . . 1 . . . . . 8 PHE N . 51974 1 49 . 1 . 1 9 9 LYS H H 1 7.686 . . 1 . . . . . 9 LYS H . 51974 1 50 . 1 . 1 9 9 LYS HA H 1 3.913 . . 1 . . . . . 9 LYS HA . 51974 1 51 . 1 . 1 9 9 LYS HB2 H 1 1.954 . . 2 . . . . . 9 LYS HB2 . 51974 1 52 . 1 . 1 9 9 LYS HB3 H 1 1.954 . . 2 . . . . . 9 LYS HB3 . 51974 1 53 . 1 . 1 9 9 LYS HG2 H 1 1.670 . . 2 . . . . . 9 LYS HG2 . 51974 1 54 . 1 . 1 9 9 LYS HG3 H 1 1.670 . . 2 . . . . . 9 LYS HG3 . 51974 1 55 . 1 . 1 9 9 LYS C C 13 178.48 . . 1 . . . . . 9 LYS C . 51974 1 56 . 1 . 1 9 9 LYS CA C 13 60.247 . . 1 . . . . . 9 LYS CA . 51974 1 57 . 1 . 1 9 9 LYS CB C 13 32.152 . . 1 . . . . . 9 LYS CB . 51974 1 58 . 1 . 1 9 9 LYS CG C 13 25.860 . . 1 . . . . . 9 LYS CG . 51974 1 59 . 1 . 1 9 9 LYS CD C 13 29.530 . . 1 . . . . . 9 LYS CD . 51974 1 60 . 1 . 1 9 9 LYS CE C 13 42.155 . . 1 . . . . . 9 LYS CE . 51974 1 61 . 1 . 1 9 9 LYS N N 15 120.180 . . 1 . . . . . 9 LYS N . 51974 1 62 . 1 . 1 10 10 PHE H H 1 8.292 . . 1 . . . . . 10 PHE H . 51974 1 63 . 1 . 1 10 10 PHE HA H 1 3.198 . . 1 . . . . . 10 PHE HA . 51974 1 64 . 1 . 1 10 10 PHE C C 13 177.195 . . 1 . . . . . 10 PHE C . 51974 1 65 . 1 . 1 10 10 PHE CA C 13 60.791 . . 1 . . . . . 10 PHE CA . 51974 1 66 . 1 . 1 10 10 PHE CB C 13 37.506 . . 1 . . . . . 10 PHE CB . 51974 1 67 . 1 . 1 10 10 PHE N N 15 116.721 . . 1 . . . . . 10 PHE N . 51974 1 68 . 1 . 1 11 11 LEU H H 1 7.009 . . 1 . . . . . 11 LEU H . 51974 1 69 . 1 . 1 11 11 LEU HA H 1 3.539 . . 1 . . . . . 11 LEU HA . 51974 1 70 . 1 . 1 11 11 LEU HB2 H 1 1.452 . . 2 . . . . . 11 LEU HB2 . 51974 1 71 . 1 . 1 11 11 LEU HB3 H 1 1.452 . . 2 . . . . . 11 LEU HB3 . 51974 1 72 . 1 . 1 11 11 LEU HG H 1 1.119 . . 1 . . . . . 11 LEU HG . 51974 1 73 . 1 . 1 11 11 LEU HD11 H 1 0.652 . . 1 . . . . . 11 LEU MD1 . 51974 1 74 . 1 . 1 11 11 LEU HD12 H 1 0.652 . . 1 . . . . . 11 LEU MD1 . 51974 1 75 . 1 . 1 11 11 LEU HD13 H 1 0.652 . . 1 . . . . . 11 LEU MD1 . 51974 1 76 . 1 . 1 11 11 LEU HD21 H 1 0.598 . . 1 . . . . . 11 LEU MD2 . 51974 1 77 . 1 . 1 11 11 LEU HD22 H 1 0.598 . . 1 . . . . . 11 LEU MD2 . 51974 1 78 . 1 . 1 11 11 LEU HD23 H 1 0.598 . . 1 . . . . . 11 LEU MD2 . 51974 1 79 . 1 . 1 11 11 LEU C C 13 177.069 . . 1 . . . . . 11 LEU C . 51974 1 80 . 1 . 1 11 11 LEU CA C 13 57.339 . . 1 . . . . . 11 LEU CA . 51974 1 81 . 1 . 1 11 11 LEU CB C 13 42.594 . . 1 . . . . . 11 LEU CB . 51974 1 82 . 1 . 1 11 11 LEU CD1 C 13 26.478 . . 1 . . . . . 11 LEU CD1 . 51974 1 83 . 1 . 1 11 11 LEU CD2 C 13 25.089 . . 1 . . . . . 11 LEU CD2 . 51974 1 84 . 1 . 1 11 11 LEU N N 15 121.989 . . 1 . . . . . 11 LEU N . 51974 1 85 . 1 . 1 12 12 LEU H H 1 7.297 . . 1 . . . . . 12 LEU H . 51974 1 86 . 1 . 1 12 12 LEU HA H 1 4.118 . . 1 . . . . . 12 LEU HA . 51974 1 87 . 1 . 1 12 12 LEU HB2 H 1 1.641 . . 2 . . . . . 12 LEU HB2 . 51974 1 88 . 1 . 1 12 12 LEU HB3 H 1 1.641 . . 2 . . . . . 12 LEU HB3 . 51974 1 89 . 1 . 1 12 12 LEU HD11 H 1 0.776 . . 1 . . . . . 12 LEU MD1 . 51974 1 90 . 1 . 1 12 12 LEU HD12 H 1 0.776 . . 1 . . . . . 12 LEU MD1 . 51974 1 91 . 1 . 1 12 12 LEU HD13 H 1 0.776 . . 1 . . . . . 12 LEU MD1 . 51974 1 92 . 1 . 1 12 12 LEU HD21 H 1 0.552 . . 1 . . . . . 12 LEU MD2 . 51974 1 93 . 1 . 1 12 12 LEU HD22 H 1 0.552 . . 1 . . . . . 12 LEU MD2 . 51974 1 94 . 1 . 1 12 12 LEU HD23 H 1 0.552 . . 1 . . . . . 12 LEU MD2 . 51974 1 95 . 1 . 1 12 12 LEU C C 13 177.615 . . 1 . . . . . 12 LEU C . 51974 1 96 . 1 . 1 12 12 LEU CA C 13 55.210 . . 1 . . . . . 12 LEU CA . 51974 1 97 . 1 . 1 12 12 LEU CB C 13 40.762 . . 1 . . . . . 12 LEU CB . 51974 1 98 . 1 . 1 12 12 LEU CG C 13 27.748 . . 1 . . . . . 12 LEU CG . 51974 1 99 . 1 . 1 12 12 LEU CD1 C 13 25.366 . . 1 . . . . . 12 LEU CD1 . 51974 1 100 . 1 . 1 12 12 LEU CD2 C 13 22.574 . . 1 . . . . . 12 LEU CD2 . 51974 1 101 . 1 . 1 12 12 LEU N N 15 112.384 . . 1 . . . . . 12 LEU N . 51974 1 102 . 1 . 1 13 13 ASN H H 1 7.329 . . 1 . . . . . 13 ASN H . 51974 1 103 . 1 . 1 13 13 ASN HA H 1 4.797 . . 1 . . . . . 13 ASN HA . 51974 1 104 . 1 . 1 13 13 ASN HB2 H 1 3.040 . . 1 . . . . . 13 ASN HB2 . 51974 1 105 . 1 . 1 13 13 ASN HB3 H 1 2.705 . . 1 . . . . . 13 ASN HB3 . 51974 1 106 . 1 . 1 13 13 ASN C C 13 174.639 . . 1 . . . . . 13 ASN C . 51974 1 107 . 1 . 1 13 13 ASN CA C 13 52.858 . . 1 . . . . . 13 ASN CA . 51974 1 108 . 1 . 1 13 13 ASN CB C 13 39.445 . . 1 . . . . . 13 ASN CB . 51974 1 109 . 1 . 1 13 13 ASN N N 15 115.320 . . 1 . . . . . 13 ASN N . 51974 1 110 . 1 . 1 14 14 ILE H H 1 7.351 . . 1 . . . . . 14 ILE H . 51974 1 111 . 1 . 1 14 14 ILE HA H 1 3.912 . . 1 . . . . . 14 ILE HA . 51974 1 112 . 1 . 1 14 14 ILE HB H 1 1.911 . . 1 . . . . . 14 ILE HB . 51974 1 113 . 1 . 1 14 14 ILE HG12 H 1 1.027 . . 2 . . . . . 14 ILE HG12 . 51974 1 114 . 1 . 1 14 14 ILE HG13 H 1 1.027 . . 2 . . . . . 14 ILE HG13 . 51974 1 115 . 1 . 1 14 14 ILE HG21 H 1 0.780 . . 1 . . . . . 14 ILE MG . 51974 1 116 . 1 . 1 14 14 ILE HG22 H 1 0.780 . . 1 . . . . . 14 ILE MG . 51974 1 117 . 1 . 1 14 14 ILE HG23 H 1 0.780 . . 1 . . . . . 14 ILE MG . 51974 1 118 . 1 . 1 14 14 ILE HD11 H 1 0.852 . . 1 . . . . . 14 ILE MD . 51974 1 119 . 1 . 1 14 14 ILE HD12 H 1 0.852 . . 1 . . . . . 14 ILE MD . 51974 1 120 . 1 . 1 14 14 ILE HD13 H 1 0.852 . . 1 . . . . . 14 ILE MD . 51974 1 121 . 1 . 1 14 14 ILE C C 13 175.462 . . 1 . . . . . 14 ILE C . 51974 1 122 . 1 . 1 14 14 ILE CA C 13 61.352 . . 1 . . . . . 14 ILE CA . 51974 1 123 . 1 . 1 14 14 ILE CB C 13 37.715 . . 1 . . . . . 14 ILE CB . 51974 1 124 . 1 . 1 14 14 ILE CG1 C 13 27.234 . . 1 . . . . . 14 ILE CG1 . 51974 1 125 . 1 . 1 14 14 ILE CG2 C 13 17.499 . . 1 . . . . . 14 ILE CG2 . 51974 1 126 . 1 . 1 14 14 ILE CD1 C 13 15.238 . . 1 . . . . . 14 ILE CD1 . 51974 1 127 . 1 . 1 14 14 ILE N N 15 122.938 . . 1 . . . . . 14 ILE N . 51974 1 128 . 1 . 1 15 15 GLU H H 1 8.682 . . 1 . . . . . 15 GLU H . 51974 1 129 . 1 . 1 15 15 GLU HA H 1 3.921 . . 1 . . . . . 15 GLU HA . 51974 1 130 . 1 . 1 15 15 GLU HB2 H 1 1.916 . . 2 . . . . . 15 GLU HB2 . 51974 1 131 . 1 . 1 15 15 GLU HB3 H 1 1.916 . . 2 . . . . . 15 GLU HB3 . 51974 1 132 . 1 . 1 15 15 GLU HG2 H 1 2.227 . . 2 . . . . . 15 GLU HG2 . 51974 1 133 . 1 . 1 15 15 GLU HG3 H 1 2.227 . . 2 . . . . . 15 GLU HG3 . 51974 1 134 . 1 . 1 15 15 GLU C C 13 176.601 . . 1 . . . . . 15 GLU C . 51974 1 135 . 1 . 1 15 15 GLU CA C 13 58.784 . . 1 . . . . . 15 GLU CA . 51974 1 136 . 1 . 1 15 15 GLU CB C 13 29.279 . . 1 . . . . . 15 GLU CB . 51974 1 137 . 1 . 1 15 15 GLU CG C 13 36.009 . . 1 . . . . . 15 GLU CG . 51974 1 138 . 1 . 1 15 15 GLU N N 15 130.515 . . 1 . . . . . 15 GLU N . 51974 1 139 . 1 . 1 16 16 GLY H H 1 8.657 . . 1 . . . . . 16 GLY H . 51974 1 140 . 1 . 1 16 16 GLY C C 13 174.236 . . 1 . . . . . 16 GLY C . 51974 1 141 . 1 . 1 16 16 GLY N N 15 113.327 . . 1 . . . . . 16 GLY N . 51974 1 142 . 1 . 1 17 17 VAL H H 1 8.036 . . 1 . . . . . 17 VAL H . 51974 1 143 . 1 . 1 17 17 VAL HA H 1 3.955 . . 1 . . . . . 17 VAL HA . 51974 1 144 . 1 . 1 17 17 VAL HB H 1 2.574 . . 1 . . . . . 17 VAL HB . 51974 1 145 . 1 . 1 17 17 VAL HG11 H 1 0.611 . . 1 . . . . . 17 VAL MG1 . 51974 1 146 . 1 . 1 17 17 VAL HG12 H 1 0.611 . . 1 . . . . . 17 VAL MG1 . 51974 1 147 . 1 . 1 17 17 VAL HG13 H 1 0.611 . . 1 . . . . . 17 VAL MG1 . 51974 1 148 . 1 . 1 17 17 VAL HG21 H 1 0.691 . . 1 . . . . . 17 VAL MG2 . 51974 1 149 . 1 . 1 17 17 VAL HG22 H 1 0.691 . . 1 . . . . . 17 VAL MG2 . 51974 1 150 . 1 . 1 17 17 VAL HG23 H 1 0.691 . . 1 . . . . . 17 VAL MG2 . 51974 1 151 . 1 . 1 17 17 VAL C C 13 174.672 . . 1 . . . . . 17 VAL C . 51974 1 152 . 1 . 1 17 17 VAL CA C 13 63.219 . . 1 . . . . . 17 VAL CA . 51974 1 153 . 1 . 1 17 17 VAL CB C 13 30.793 . . 1 . . . . . 17 VAL CB . 51974 1 154 . 1 . 1 17 17 VAL CG1 C 13 22.407 . . 1 . . . . . 17 VAL CG1 . 51974 1 155 . 1 . 1 17 17 VAL CG2 C 13 22.454 . . 1 . . . . . 17 VAL CG2 . 51974 1 156 . 1 . 1 17 17 VAL N N 15 122.155 . . 1 . . . . . 17 VAL N . 51974 1 157 . 1 . 1 18 18 GLY H H 1 7.256 . . 1 . . . . . 18 GLY H . 51974 1 158 . 1 . 1 18 18 GLY CA C 13 43.918 . . 1 . . . . . 18 GLY CA . 51974 1 159 . 1 . 1 18 18 GLY N N 15 112.444 . . 1 . . . . . 18 GLY N . 51974 1 160 . 1 . 1 19 19 PRO HA H 1 4.001 . . 1 . . . . . 19 PRO HA . 51974 1 161 . 1 . 1 19 19 PRO HB2 H 1 1.971 . . 2 . . . . . 19 PRO HB2 . 51974 1 162 . 1 . 1 19 19 PRO HB3 H 1 1.971 . . 2 . . . . . 19 PRO HB3 . 51974 1 163 . 1 . 1 19 19 PRO HG2 H 1 2.244 . . 2 . . . . . 19 PRO HG2 . 51974 1 164 . 1 . 1 19 19 PRO HG3 H 1 2.244 . . 2 . . . . . 19 PRO HG3 . 51974 1 165 . 1 . 1 19 19 PRO HD2 H 1 3.696 . . 2 . . . . . 19 PRO HD2 . 51974 1 166 . 1 . 1 19 19 PRO HD3 H 1 3.696 . . 2 . . . . . 19 PRO HD3 . 51974 1 167 . 1 . 1 19 19 PRO C C 13 178.647 . . 1 . . . . . 19 PRO C . 51974 1 168 . 1 . 1 19 19 PRO CA C 13 66.329 . . 1 . . . . . 19 PRO CA . 51974 1 169 . 1 . 1 19 19 PRO CB C 13 32.258 . . 1 . . . . . 19 PRO CB . 51974 1 170 . 1 . 1 19 19 PRO CG C 13 27.876 . . 1 . . . . . 19 PRO CG . 51974 1 171 . 1 . 1 19 19 PRO CD C 13 49.379 . . 1 . . . . . 19 PRO CD . 51974 1 172 . 1 . 1 20 20 LYS H H 1 8.137 . . 1 . . . . . 20 LYS H . 51974 1 173 . 1 . 1 20 20 LYS HA H 1 4.140 . . 1 . . . . . 20 LYS HA . 51974 1 174 . 1 . 1 20 20 LYS HB2 H 1 1.768 . . 2 . . . . . 20 LYS HB2 . 51974 1 175 . 1 . 1 20 20 LYS HB3 H 1 1.768 . . 2 . . . . . 20 LYS HB3 . 51974 1 176 . 1 . 1 20 20 LYS HG2 H 1 1.463 . . 2 . . . . . 20 LYS HG2 . 51974 1 177 . 1 . 1 20 20 LYS HG3 H 1 1.463 . . 2 . . . . . 20 LYS HG3 . 51974 1 178 . 1 . 1 20 20 LYS HE2 H 1 2.242 . . 2 . . . . . 20 LYS HE2 . 51974 1 179 . 1 . 1 20 20 LYS HE3 H 1 2.242 . . 2 . . . . . 20 LYS HE3 . 51974 1 180 . 1 . 1 20 20 LYS C C 13 179.042 . . 1 . . . . . 20 LYS C . 51974 1 181 . 1 . 1 20 20 LYS CA C 13 58.995 . . 1 . . . . . 20 LYS CA . 51974 1 182 . 1 . 1 20 20 LYS CB C 13 31.497 . . 1 . . . . . 20 LYS CB . 51974 1 183 . 1 . 1 20 20 LYS CG C 13 24.984 . . 1 . . . . . 20 LYS CG . 51974 1 184 . 1 . 1 20 20 LYS CD C 13 28.619 . . 1 . . . . . 20 LYS CD . 51974 1 185 . 1 . 1 20 20 LYS CE C 13 42.238 . . 1 . . . . . 20 LYS CE . 51974 1 186 . 1 . 1 20 20 LYS N N 15 116.886 . . 1 . . . . . 20 LYS N . 51974 1 187 . 1 . 1 21 21 LEU H H 1 7.816 . . 1 . . . . . 21 LEU H . 51974 1 188 . 1 . 1 21 21 LEU HA H 1 4.063 . . 1 . . . . . 21 LEU HA . 51974 1 189 . 1 . 1 21 21 LEU HB2 H 1 1.645 . . 2 . . . . . 21 LEU HB2 . 51974 1 190 . 1 . 1 21 21 LEU HB3 H 1 1.645 . . 2 . . . . . 21 LEU HB3 . 51974 1 191 . 1 . 1 21 21 LEU HD11 H 1 0.938 . . 1 . . . . . 21 LEU MD1 . 51974 1 192 . 1 . 1 21 21 LEU HD12 H 1 0.938 . . 1 . . . . . 21 LEU MD1 . 51974 1 193 . 1 . 1 21 21 LEU HD13 H 1 0.938 . . 1 . . . . . 21 LEU MD1 . 51974 1 194 . 1 . 1 21 21 LEU HD21 H 1 0.910 . . 1 . . . . . 21 LEU MD2 . 51974 1 195 . 1 . 1 21 21 LEU HD22 H 1 0.910 . . 1 . . . . . 21 LEU MD2 . 51974 1 196 . 1 . 1 21 21 LEU HD23 H 1 0.910 . . 1 . . . . . 21 LEU MD2 . 51974 1 197 . 1 . 1 21 21 LEU C C 13 178.407 . . 1 . . . . . 21 LEU C . 51974 1 198 . 1 . 1 21 21 LEU CA C 13 57.487 . . 1 . . . . . 21 LEU CA . 51974 1 199 . 1 . 1 21 21 LEU CB C 13 42.091 . . 1 . . . . . 21 LEU CB . 51974 1 200 . 1 . 1 21 21 LEU CG C 13 27.246 . . 1 . . . . . 21 LEU CG . 51974 1 201 . 1 . 1 21 21 LEU CD1 C 13 25.755 . . 1 . . . . . 21 LEU CD1 . 51974 1 202 . 1 . 1 21 21 LEU CD2 C 13 24.071 . . 1 . . . . . 21 LEU CD2 . 51974 1 203 . 1 . 1 21 21 LEU N N 15 120.887 . . 1 . . . . . 21 LEU N . 51974 1 204 . 1 . 1 22 22 ALA H H 1 8.566 . . 1 . . . . . 22 ALA H . 51974 1 205 . 1 . 1 22 22 ALA HA H 1 3.591 . . 1 . . . . . 22 ALA HA . 51974 1 206 . 1 . 1 22 22 ALA HB1 H 1 1.148 . . 1 . . . . . 22 ALA MB . 51974 1 207 . 1 . 1 22 22 ALA HB2 H 1 1.148 . . 1 . . . . . 22 ALA MB . 51974 1 208 . 1 . 1 22 22 ALA HB3 H 1 1.148 . . 1 . . . . . 22 ALA MB . 51974 1 209 . 1 . 1 22 22 ALA C C 13 178.350 . . 1 . . . . . 22 ALA C . 51974 1 210 . 1 . 1 22 22 ALA CA C 13 55.938 . . 1 . . . . . 22 ALA CA . 51974 1 211 . 1 . 1 22 22 ALA CB C 13 18.365 . . 1 . . . . . 22 ALA CB . 51974 1 212 . 1 . 1 22 22 ALA N N 15 120.117 . . 1 . . . . . 22 ALA N . 51974 1 213 . 1 . 1 23 23 GLU H H 1 7.681 . . 1 . . . . . 23 GLU H . 51974 1 214 . 1 . 1 23 23 GLU HA H 1 3.768 . . 1 . . . . . 23 GLU HA . 51974 1 215 . 1 . 1 23 23 GLU HB2 H 1 2.248 . . 2 . . . . . 23 GLU HB2 . 51974 1 216 . 1 . 1 23 23 GLU HB3 H 1 2.248 . . 2 . . . . . 23 GLU HB3 . 51974 1 217 . 1 . 1 23 23 GLU HG2 H 1 2.449 . . 2 . . . . . 23 GLU HG2 . 51974 1 218 . 1 . 1 23 23 GLU HG3 H 1 2.449 . . 2 . . . . . 23 GLU HG3 . 51974 1 219 . 1 . 1 23 23 GLU C C 13 177.849 . . 1 . . . . . 23 GLU C . 51974 1 220 . 1 . 1 23 23 GLU CA C 13 60.096 . . 1 . . . . . 23 GLU CA . 51974 1 221 . 1 . 1 23 23 GLU CB C 13 30.041 . . 1 . . . . . 23 GLU CB . 51974 1 222 . 1 . 1 23 23 GLU CG C 13 36.780 . . 1 . . . . . 23 GLU CG . 51974 1 223 . 1 . 1 23 23 GLU N N 15 115.539 . . 1 . . . . . 23 GLU N . 51974 1 224 . 1 . 1 24 24 ARG H H 1 7.571 . . 1 . . . . . 24 ARG H . 51974 1 225 . 1 . 1 24 24 ARG HA H 1 4.044 . . 1 . . . . . 24 ARG HA . 51974 1 226 . 1 . 1 24 24 ARG HB2 H 1 1.956 . . 2 . . . . . 24 ARG HB2 . 51974 1 227 . 1 . 1 24 24 ARG HB3 H 1 1.956 . . 2 . . . . . 24 ARG HB3 . 51974 1 228 . 1 . 1 24 24 ARG HD2 H 1 3.251 . . 2 . . . . . 24 ARG HD2 . 51974 1 229 . 1 . 1 24 24 ARG HD3 H 1 3.251 . . 2 . . . . . 24 ARG HD3 . 51974 1 230 . 1 . 1 24 24 ARG C C 13 180.051 . . 1 . . . . . 24 ARG C . 51974 1 231 . 1 . 1 24 24 ARG CA C 13 59.630 . . 1 . . . . . 24 ARG CA . 51974 1 232 . 1 . 1 24 24 ARG CB C 13 31.149 . . 1 . . . . . 24 ARG CB . 51974 1 233 . 1 . 1 24 24 ARG CG C 13 28.088 . . 1 . . . . . 24 ARG CG . 51974 1 234 . 1 . 1 24 24 ARG CD C 13 44.059 . . 1 . . . . . 24 ARG CD . 51974 1 235 . 1 . 1 24 24 ARG N N 15 117.811 . . 1 . . . . . 24 ARG N . 51974 1 236 . 1 . 1 25 25 ILE H H 1 8.401 . . 1 . . . . . 25 ILE H . 51974 1 237 . 1 . 1 25 25 ILE HA H 1 3.363 . . 1 . . . . . 25 ILE HA . 51974 1 238 . 1 . 1 25 25 ILE HB H 1 1.903 . . 1 . . . . . 25 ILE HB . 51974 1 239 . 1 . 1 25 25 ILE HG21 H 1 0.644 . . 1 . . . . . 25 ILE MG . 51974 1 240 . 1 . 1 25 25 ILE HG22 H 1 0.644 . . 1 . . . . . 25 ILE MG . 51974 1 241 . 1 . 1 25 25 ILE HG23 H 1 0.644 . . 1 . . . . . 25 ILE MG . 51974 1 242 . 1 . 1 25 25 ILE HD11 H 1 0.746 . . 1 . . . . . 25 ILE MD . 51974 1 243 . 1 . 1 25 25 ILE HD12 H 1 0.746 . . 1 . . . . . 25 ILE MD . 51974 1 244 . 1 . 1 25 25 ILE HD13 H 1 0.746 . . 1 . . . . . 25 ILE MD . 51974 1 245 . 1 . 1 25 25 ILE C C 13 176.214 . . 1 . . . . . 25 ILE C . 51974 1 246 . 1 . 1 25 25 ILE CA C 13 65.849 . . 1 . . . . . 25 ILE CA . 51974 1 247 . 1 . 1 25 25 ILE CB C 13 38.062 . . 1 . . . . . 25 ILE CB . 51974 1 248 . 1 . 1 25 25 ILE CG1 C 13 30.239 . . 1 . . . . . 25 ILE CG1 . 51974 1 249 . 1 . 1 25 25 ILE CG2 C 13 17.898 . . 1 . . . . . 25 ILE CG2 . 51974 1 250 . 1 . 1 25 25 ILE CD1 C 13 14.954 . . 1 . . . . . 25 ILE CD1 . 51974 1 251 . 1 . 1 25 25 ILE N N 15 120.842 . . 1 . . . . . 25 ILE N . 51974 1 252 . 1 . 1 26 26 LEU H H 1 7.662 . . 1 . . . . . 26 LEU H . 51974 1 253 . 1 . 1 26 26 LEU HA H 1 3.308 . . 1 . . . . . 26 LEU HA . 51974 1 254 . 1 . 1 26 26 LEU HB2 H 1 1.109 . . 2 . . . . . 26 LEU HB2 . 51974 1 255 . 1 . 1 26 26 LEU HB3 H 1 1.109 . . 2 . . . . . 26 LEU HB3 . 51974 1 256 . 1 . 1 26 26 LEU HD11 H 1 -0.275 . . 1 . . . . . 26 LEU MD1 . 51974 1 257 . 1 . 1 26 26 LEU HD12 H 1 -0.275 . . 1 . . . . . 26 LEU MD1 . 51974 1 258 . 1 . 1 26 26 LEU HD13 H 1 -0.275 . . 1 . . . . . 26 LEU MD1 . 51974 1 259 . 1 . 1 26 26 LEU HD21 H 1 0.087 . . 1 . . . . . 26 LEU MD2 . 51974 1 260 . 1 . 1 26 26 LEU HD22 H 1 0.087 . . 1 . . . . . 26 LEU MD2 . 51974 1 261 . 1 . 1 26 26 LEU HD23 H 1 0.087 . . 1 . . . . . 26 LEU MD2 . 51974 1 262 . 1 . 1 26 26 LEU C C 13 179.994 . . 1 . . . . . 26 LEU C . 51974 1 263 . 1 . 1 26 26 LEU CA C 13 57.235 . . 1 . . . . . 26 LEU CA . 51974 1 264 . 1 . 1 26 26 LEU CB C 13 39.611 . . 1 . . . . . 26 LEU CB . 51974 1 265 . 1 . 1 26 26 LEU CD1 C 13 21.764 . . 1 . . . . . 26 LEU CD1 . 51974 1 266 . 1 . 1 26 26 LEU CD2 C 13 25.130 . . 1 . . . . . 26 LEU CD2 . 51974 1 267 . 1 . 1 26 26 LEU N N 15 116.844 . . 1 . . . . . 26 LEU N . 51974 1 268 . 1 . 1 27 27 GLU H H 1 8.352 . . 1 . . . . . 27 GLU H . 51974 1 269 . 1 . 1 27 27 GLU HA H 1 3.786 . . 1 . . . . . 27 GLU HA . 51974 1 270 . 1 . 1 27 27 GLU HB2 H 1 2.063 . . 2 . . . . . 27 GLU HB2 . 51974 1 271 . 1 . 1 27 27 GLU HB3 H 1 2.063 . . 2 . . . . . 27 GLU HB3 . 51974 1 272 . 1 . 1 27 27 GLU HG2 H 1 2.511 . . 1 . . . . . 27 GLU HG2 . 51974 1 273 . 1 . 1 27 27 GLU HG3 H 1 2.351 . . 1 . . . . . 27 GLU HG3 . 51974 1 274 . 1 . 1 27 27 GLU C C 13 179.738 . . 1 . . . . . 27 GLU C . 51974 1 275 . 1 . 1 27 27 GLU CA C 13 59.563 . . 1 . . . . . 27 GLU CA . 51974 1 276 . 1 . 1 27 27 GLU CB C 13 29.616 . . 1 . . . . . 27 GLU CB . 51974 1 277 . 1 . 1 27 27 GLU CG C 13 36.713 . . 1 . . . . . 27 GLU CG . 51974 1 278 . 1 . 1 27 27 GLU N N 15 119.499 . . 1 . . . . . 27 GLU N . 51974 1 279 . 1 . 1 28 28 ALA H H 1 7.472 . . 1 . . . . . 28 ALA H . 51974 1 280 . 1 . 1 28 28 ALA HA H 1 4.156 . . 1 . . . . . 28 ALA HA . 51974 1 281 . 1 . 1 28 28 ALA HB1 H 1 1.388 . . 1 . . . . . 28 ALA MB . 51974 1 282 . 1 . 1 28 28 ALA HB2 H 1 1.388 . . 1 . . . . . 28 ALA MB . 51974 1 283 . 1 . 1 28 28 ALA HB3 H 1 1.388 . . 1 . . . . . 28 ALA MB . 51974 1 284 . 1 . 1 28 28 ALA C C 13 178.703 . . 1 . . . . . 28 ALA C . 51974 1 285 . 1 . 1 28 28 ALA CA C 13 54.548 . . 1 . . . . . 28 ALA CA . 51974 1 286 . 1 . 1 28 28 ALA CB C 13 18.560 . . 1 . . . . . 28 ALA CB . 51974 1 287 . 1 . 1 28 28 ALA N N 15 120.425 . . 1 . . . . . 28 ALA N . 51974 1 288 . 1 . 1 29 29 VAL H H 1 7.051 . . 1 . . . . . 29 VAL H . 51974 1 289 . 1 . 1 29 29 VAL HA H 1 4.445 . . 1 . . . . . 29 VAL HA . 51974 1 290 . 1 . 1 29 29 VAL HB H 1 2.656 . . 1 . . . . . 29 VAL HB . 51974 1 291 . 1 . 1 29 29 VAL HG11 H 1 0.665 . . 1 . . . . . 29 VAL MG1 . 51974 1 292 . 1 . 1 29 29 VAL HG12 H 1 0.665 . . 1 . . . . . 29 VAL MG1 . 51974 1 293 . 1 . 1 29 29 VAL HG13 H 1 0.665 . . 1 . . . . . 29 VAL MG1 . 51974 1 294 . 1 . 1 29 29 VAL HG21 H 1 0.806 . . 1 . . . . . 29 VAL MG2 . 51974 1 295 . 1 . 1 29 29 VAL HG22 H 1 0.806 . . 1 . . . . . 29 VAL MG2 . 51974 1 296 . 1 . 1 29 29 VAL HG23 H 1 0.806 . . 1 . . . . . 29 VAL MG2 . 51974 1 297 . 1 . 1 29 29 VAL C C 13 174.434 . . 1 . . . . . 29 VAL C . 51974 1 298 . 1 . 1 29 29 VAL CA C 13 59.857 . . 1 . . . . . 29 VAL CA . 51974 1 299 . 1 . 1 29 29 VAL CB C 13 31.072 . . 1 . . . . . 29 VAL CB . 51974 1 300 . 1 . 1 29 29 VAL CG1 C 13 21.780 . . 1 . . . . . 29 VAL CG1 . 51974 1 301 . 1 . 1 29 29 VAL CG2 C 13 18.742 . . 1 . . . . . 29 VAL CG2 . 51974 1 302 . 1 . 1 29 29 VAL N N 15 106.237 . . 1 . . . . . 29 VAL N . 51974 1 303 . 1 . 1 30 30 ASP H H 1 7.704 . . 1 . . . . . 30 ASP H . 51974 1 304 . 1 . 1 30 30 ASP HA H 1 4.344 . . 1 . . . . . 30 ASP HA . 51974 1 305 . 1 . 1 30 30 ASP HB2 H 1 3.028 . . 1 . . . . . 30 ASP HB2 . 51974 1 306 . 1 . 1 30 30 ASP HB3 H 1 2.574 . . 1 . . . . . 30 ASP HB3 . 51974 1 307 . 1 . 1 30 30 ASP C C 13 175.106 . . 1 . . . . . 30 ASP C . 51974 1 308 . 1 . 1 30 30 ASP CA C 13 56.132 . . 1 . . . . . 30 ASP CA . 51974 1 309 . 1 . 1 30 30 ASP CB C 13 39.826 . . 1 . . . . . 30 ASP CB . 51974 1 310 . 1 . 1 30 30 ASP N N 15 120.993 . . 1 . . . . . 30 ASP N . 51974 1 311 . 1 . 1 31 31 TYR H H 1 8.771 . . 1 . . . . . 31 TYR H . 51974 1 312 . 1 . 1 31 31 TYR HB2 H 1 3.044 . . 2 . . . . . 31 TYR HB2 . 51974 1 313 . 1 . 1 31 31 TYR HB3 H 1 3.044 . . 2 . . . . . 31 TYR HB3 . 51974 1 314 . 1 . 1 31 31 TYR C C 13 173.278 . . 1 . . . . . 31 TYR C . 51974 1 315 . 1 . 1 31 31 TYR CA C 13 60.308 . . 1 . . . . . 31 TYR CA . 51974 1 316 . 1 . 1 31 31 TYR CB C 13 34.673 . . 1 . . . . . 31 TYR CB . 51974 1 317 . 1 . 1 31 31 TYR N N 15 108.075 . . 1 . . . . . 31 TYR N . 51974 1 318 . 1 . 1 32 32 ASP H H 1 7.122 . . 1 . . . . . 32 ASP H . 51974 1 319 . 1 . 1 32 32 ASP HA H 1 5.037 . . 1 . . . . . 32 ASP HA . 51974 1 320 . 1 . 1 32 32 ASP HB2 H 1 3.261 . . 1 . . . . . 32 ASP HB2 . 51974 1 321 . 1 . 1 32 32 ASP HB3 H 1 2.451 . . 1 . . . . . 32 ASP HB3 . 51974 1 322 . 1 . 1 32 32 ASP C C 13 176.226 . . 1 . . . . . 32 ASP C . 51974 1 323 . 1 . 1 32 32 ASP CA C 13 53.131 . . 1 . . . . . 32 ASP CA . 51974 1 324 . 1 . 1 32 32 ASP CB C 13 42.880 . . 1 . . . . . 32 ASP CB . 51974 1 325 . 1 . 1 32 32 ASP N N 15 117.540 . . 1 . . . . . 32 ASP N . 51974 1 326 . 1 . 1 33 33 LEU H H 1 9.065 . . 1 . . . . . 33 LEU H . 51974 1 327 . 1 . 1 33 33 LEU HA H 1 4.013 . . 1 . . . . . 33 LEU HA . 51974 1 328 . 1 . 1 33 33 LEU HB2 H 1 1.595 . . 2 . . . . . 33 LEU HB2 . 51974 1 329 . 1 . 1 33 33 LEU HB3 H 1 1.595 . . 2 . . . . . 33 LEU HB3 . 51974 1 330 . 1 . 1 33 33 LEU HD11 H 1 0.771 . . 1 . . . . . 33 LEU MD1 . 51974 1 331 . 1 . 1 33 33 LEU HD12 H 1 0.771 . . 1 . . . . . 33 LEU MD1 . 51974 1 332 . 1 . 1 33 33 LEU HD13 H 1 0.771 . . 1 . . . . . 33 LEU MD1 . 51974 1 333 . 1 . 1 33 33 LEU HD21 H 1 0.990 . . 1 . . . . . 33 LEU MD2 . 51974 1 334 . 1 . 1 33 33 LEU HD22 H 1 0.990 . . 1 . . . . . 33 LEU MD2 . 51974 1 335 . 1 . 1 33 33 LEU HD23 H 1 0.990 . . 1 . . . . . 33 LEU MD2 . 51974 1 336 . 1 . 1 33 33 LEU C C 13 178.303 . . 1 . . . . . 33 LEU C . 51974 1 337 . 1 . 1 33 33 LEU CA C 13 58.105 . . 1 . . . . . 33 LEU CA . 51974 1 338 . 1 . 1 33 33 LEU CB C 13 42.133 . . 1 . . . . . 33 LEU CB . 51974 1 339 . 1 . 1 33 33 LEU CG C 13 26.935 . . 1 . . . . . 33 LEU CG . 51974 1 340 . 1 . 1 33 33 LEU CD1 C 13 24.925 . . 1 . . . . . 33 LEU CD1 . 51974 1 341 . 1 . 1 33 33 LEU CD2 C 13 24.653 . . 1 . . . . . 33 LEU CD2 . 51974 1 342 . 1 . 1 33 33 LEU N N 15 126.502 . . 1 . . . . . 33 LEU N . 51974 1 343 . 1 . 1 34 34 GLU H H 1 8.183 . . 1 . . . . . 34 GLU H . 51974 1 344 . 1 . 1 34 34 GLU HA H 1 3.904 . . 1 . . . . . 34 GLU HA . 51974 1 345 . 1 . 1 34 34 GLU C C 13 179.716 . . 1 . . . . . 34 GLU C . 51974 1 346 . 1 . 1 34 34 GLU CA C 13 60.144 . . 1 . . . . . 34 GLU CA . 51974 1 347 . 1 . 1 34 34 GLU CB C 13 28.757 . . 1 . . . . . 34 GLU CB . 51974 1 348 . 1 . 1 34 34 GLU CG C 13 37.448 . . 1 . . . . . 34 GLU CG . 51974 1 349 . 1 . 1 34 34 GLU N N 15 117.974 . . 1 . . . . . 34 GLU N . 51974 1 350 . 1 . 1 35 35 ARG H H 1 8.013 . . 1 . . . . . 35 ARG H . 51974 1 351 . 1 . 1 35 35 ARG HA H 1 3.994 . . 1 . . . . . 35 ARG HA . 51974 1 352 . 1 . 1 35 35 ARG HB2 H 1 1.959 . . 2 . . . . . 35 ARG HB2 . 51974 1 353 . 1 . 1 35 35 ARG HB3 H 1 1.959 . . 2 . . . . . 35 ARG HB3 . 51974 1 354 . 1 . 1 35 35 ARG HG2 H 1 1.612 . . 2 . . . . . 35 ARG HG2 . 51974 1 355 . 1 . 1 35 35 ARG HG3 H 1 1.612 . . 2 . . . . . 35 ARG HG3 . 51974 1 356 . 1 . 1 35 35 ARG HD2 H 1 3.211 . . 2 . . . . . 35 ARG HD2 . 51974 1 357 . 1 . 1 35 35 ARG HD3 H 1 3.211 . . 2 . . . . . 35 ARG HD3 . 51974 1 358 . 1 . 1 35 35 ARG C C 13 179.387 . . 1 . . . . . 35 ARG C . 51974 1 359 . 1 . 1 35 35 ARG CA C 13 58.757 . . 1 . . . . . 35 ARG CA . 51974 1 360 . 1 . 1 35 35 ARG CB C 13 29.841 . . 1 . . . . . 35 ARG CB . 51974 1 361 . 1 . 1 35 35 ARG CG C 13 27.181 . . 1 . . . . . 35 ARG CG . 51974 1 362 . 1 . 1 35 35 ARG CD C 13 43.433 . . 1 . . . . . 35 ARG CD . 51974 1 363 . 1 . 1 35 35 ARG N N 15 121.884 . . 1 . . . . . 35 ARG N . 51974 1 364 . 1 . 1 36 36 LEU H H 1 7.845 . . 1 . . . . . 36 LEU H . 51974 1 365 . 1 . 1 36 36 LEU HA H 1 3.948 . . 1 . . . . . 36 LEU HA . 51974 1 366 . 1 . 1 36 36 LEU HB2 H 1 1.476 . . 2 . . . . . 36 LEU HB2 . 51974 1 367 . 1 . 1 36 36 LEU HB3 H 1 1.476 . . 2 . . . . . 36 LEU HB3 . 51974 1 368 . 1 . 1 36 36 LEU HG H 1 2.218 . . 1 . . . . . 36 LEU HG . 51974 1 369 . 1 . 1 36 36 LEU HD11 H 1 0.829 . . 1 . . . . . 36 LEU MD1 . 51974 1 370 . 1 . 1 36 36 LEU HD12 H 1 0.829 . . 1 . . . . . 36 LEU MD1 . 51974 1 371 . 1 . 1 36 36 LEU HD13 H 1 0.829 . . 1 . . . . . 36 LEU MD1 . 51974 1 372 . 1 . 1 36 36 LEU HD21 H 1 0.821 . . 1 . . . . . 36 LEU MD2 . 51974 1 373 . 1 . 1 36 36 LEU HD22 H 1 0.821 . . 1 . . . . . 36 LEU MD2 . 51974 1 374 . 1 . 1 36 36 LEU HD23 H 1 0.821 . . 1 . . . . . 36 LEU MD2 . 51974 1 375 . 1 . 1 36 36 LEU C C 13 175.800 . . 1 . . . . . 36 LEU C . 51974 1 376 . 1 . 1 36 36 LEU CA C 13 58.478 . . 1 . . . . . 36 LEU CA . 51974 1 377 . 1 . 1 36 36 LEU CB C 13 41.637 . . 1 . . . . . 36 LEU CB . 51974 1 378 . 1 . 1 36 36 LEU CD1 C 13 26.254 . . 1 . . . . . 36 LEU CD1 . 51974 1 379 . 1 . 1 36 36 LEU CD2 C 13 24.173 . . 1 . . . . . 36 LEU CD2 . 51974 1 380 . 1 . 1 36 36 LEU N N 15 119.921 . . 1 . . . . . 36 LEU N . 51974 1 381 . 1 . 1 37 37 ALA H H 1 7.846 . . 1 . . . . . 37 ALA H . 51974 1 382 . 1 . 1 37 37 ALA HB1 H 1 1.357 . . 1 . . . . . 37 ALA MB . 51974 1 383 . 1 . 1 37 37 ALA HB2 H 1 1.357 . . 1 . . . . . 37 ALA MB . 51974 1 384 . 1 . 1 37 37 ALA HB3 H 1 1.357 . . 1 . . . . . 37 ALA MB . 51974 1 385 . 1 . 1 37 37 ALA C C 13 177.767 . . 1 . . . . . 37 ALA C . 51974 1 386 . 1 . 1 37 37 ALA CA C 13 54.059 . . 1 . . . . . 37 ALA CA . 51974 1 387 . 1 . 1 37 37 ALA CB C 13 19.477 . . 1 . . . . . 37 ALA CB . 51974 1 388 . 1 . 1 37 37 ALA N N 15 114.206 . . 1 . . . . . 37 ALA N . 51974 1 389 . 1 . 1 38 38 SER H H 1 7.582 . . 1 . . . . . 38 SER H . 51974 1 390 . 1 . 1 38 38 SER HA H 1 4.340 . . 1 . . . . . 38 SER HA . 51974 1 391 . 1 . 1 38 38 SER HB2 H 1 3.985 . . 2 . . . . . 38 SER HB2 . 51974 1 392 . 1 . 1 38 38 SER HB3 H 1 3.985 . . 2 . . . . . 38 SER HB3 . 51974 1 393 . 1 . 1 38 38 SER C C 13 174.526 . . 1 . . . . . 38 SER C . 51974 1 394 . 1 . 1 38 38 SER CA C 13 59.440 . . 1 . . . . . 38 SER CA . 51974 1 395 . 1 . 1 38 38 SER CB C 13 64.663 . . 1 . . . . . 38 SER CB . 51974 1 396 . 1 . 1 38 38 SER N N 15 111.438 . . 1 . . . . . 38 SER N . 51974 1 397 . 1 . 1 39 39 LEU H H 1 7.206 . . 1 . . . . . 39 LEU H . 51974 1 398 . 1 . 1 39 39 LEU HA H 1 4.259 . . 1 . . . . . 39 LEU HA . 51974 1 399 . 1 . 1 39 39 LEU HB2 H 1 2.057 . . 2 . . . . . 39 LEU HB2 . 51974 1 400 . 1 . 1 39 39 LEU HB3 H 1 2.057 . . 2 . . . . . 39 LEU HB3 . 51974 1 401 . 1 . 1 39 39 LEU HG H 1 1.367 . . 1 . . . . . 39 LEU HG . 51974 1 402 . 1 . 1 39 39 LEU HD11 H 1 0.689 . . 1 . . . . . 39 LEU MD1 . 51974 1 403 . 1 . 1 39 39 LEU HD12 H 1 0.689 . . 1 . . . . . 39 LEU MD1 . 51974 1 404 . 1 . 1 39 39 LEU HD13 H 1 0.689 . . 1 . . . . . 39 LEU MD1 . 51974 1 405 . 1 . 1 39 39 LEU HD21 H 1 0.708 . . 1 . . . . . 39 LEU MD2 . 51974 1 406 . 1 . 1 39 39 LEU HD22 H 1 0.708 . . 1 . . . . . 39 LEU MD2 . 51974 1 407 . 1 . 1 39 39 LEU HD23 H 1 0.708 . . 1 . . . . . 39 LEU MD2 . 51974 1 408 . 1 . 1 39 39 LEU C C 13 176.158 . . 1 . . . . . 39 LEU C . 51974 1 409 . 1 . 1 39 39 LEU CA C 13 55.010 . . 1 . . . . . 39 LEU CA . 51974 1 410 . 1 . 1 39 39 LEU CB C 13 42.676 . . 1 . . . . . 39 LEU CB . 51974 1 411 . 1 . 1 39 39 LEU CG C 13 26.317 . . 1 . . . . . 39 LEU CG . 51974 1 412 . 1 . 1 39 39 LEU CD1 C 13 27.488 . . 1 . . . . . 39 LEU CD1 . 51974 1 413 . 1 . 1 39 39 LEU CD2 C 13 23.313 . . 1 . . . . . 39 LEU CD2 . 51974 1 414 . 1 . 1 39 39 LEU N N 15 123.527 . . 1 . . . . . 39 LEU N . 51974 1 415 . 1 . 1 40 40 ASN H H 1 8.614 . . 1 . . . . . 40 ASN H . 51974 1 416 . 1 . 1 40 40 ASN CA C 13 50.951 . . 1 . . . . . 40 ASN CA . 51974 1 417 . 1 . 1 40 40 ASN CB C 13 37.939 . . 1 . . . . . 40 ASN CB . 51974 1 418 . 1 . 1 40 40 ASN N N 15 117.652 . . 1 . . . . . 40 ASN N . 51974 1 419 . 1 . 1 41 41 PRO HA H 1 3.913 . . 1 . . . . . 41 PRO HA . 51974 1 420 . 1 . 1 41 41 PRO HB2 H 1 2.090 . . 2 . . . . . 41 PRO HB2 . 51974 1 421 . 1 . 1 41 41 PRO HB3 H 1 2.090 . . 2 . . . . . 41 PRO HB3 . 51974 1 422 . 1 . 1 41 41 PRO HG2 H 1 1.823 . . 2 . . . . . 41 PRO HG2 . 51974 1 423 . 1 . 1 41 41 PRO HG3 H 1 1.823 . . 2 . . . . . 41 PRO HG3 . 51974 1 424 . 1 . 1 41 41 PRO HD2 H 1 2.410 . . 2 . . . . . 41 PRO HD2 . 51974 1 425 . 1 . 1 41 41 PRO HD3 H 1 2.410 . . 2 . . . . . 41 PRO HD3 . 51974 1 426 . 1 . 1 41 41 PRO C C 13 177.140 . . 1 . . . . . 41 PRO C . 51974 1 427 . 1 . 1 41 41 PRO CA C 13 66.685 . . 1 . . . . . 41 PRO CA . 51974 1 428 . 1 . 1 41 41 PRO CB C 13 32.004 . . 1 . . . . . 41 PRO CB . 51974 1 429 . 1 . 1 41 41 PRO CG C 13 28.775 . . 1 . . . . . 41 PRO CG . 51974 1 430 . 1 . 1 41 41 PRO CD C 13 50.630 . . 1 . . . . . 41 PRO CD . 51974 1 431 . 1 . 1 42 42 GLU H H 1 9.327 . . 1 . . . . . 42 GLU H . 51974 1 432 . 1 . 1 42 42 GLU HA H 1 3.973 . . 1 . . . . . 42 GLU HA . 51974 1 433 . 1 . 1 42 42 GLU HB2 H 1 2.018 . . 2 . . . . . 42 GLU HB2 . 51974 1 434 . 1 . 1 42 42 GLU HB3 H 1 2.018 . . 2 . . . . . 42 GLU HB3 . 51974 1 435 . 1 . 1 42 42 GLU HG2 H 1 2.302 . . 2 . . . . . 42 GLU HG2 . 51974 1 436 . 1 . 1 42 42 GLU HG3 H 1 2.302 . . 2 . . . . . 42 GLU HG3 . 51974 1 437 . 1 . 1 42 42 GLU C C 13 178.987 . . 1 . . . . . 42 GLU C . 51974 1 438 . 1 . 1 42 42 GLU CA C 13 59.833 . . 1 . . . . . 42 GLU CA . 51974 1 439 . 1 . 1 42 42 GLU CB C 13 28.729 . . 1 . . . . . 42 GLU CB . 51974 1 440 . 1 . 1 42 42 GLU CG C 13 36.334 . . 1 . . . . . 42 GLU CG . 51974 1 441 . 1 . 1 42 42 GLU N N 15 115.716 . . 1 . . . . . 42 GLU N . 51974 1 442 . 1 . 1 43 43 GLU H H 1 7.539 . . 1 . . . . . 43 GLU H . 51974 1 443 . 1 . 1 43 43 GLU HA H 1 4.124 . . 1 . . . . . 43 GLU HA . 51974 1 444 . 1 . 1 43 43 GLU HB2 H 1 2.054 . . 2 . . . . . 43 GLU HB2 . 51974 1 445 . 1 . 1 43 43 GLU HB3 H 1 2.054 . . 2 . . . . . 43 GLU HB3 . 51974 1 446 . 1 . 1 43 43 GLU HG2 H 1 2.308 . . 2 . . . . . 43 GLU HG2 . 51974 1 447 . 1 . 1 43 43 GLU HG3 H 1 2.308 . . 2 . . . . . 43 GLU HG3 . 51974 1 448 . 1 . 1 43 43 GLU C C 13 179.035 . . 1 . . . . . 43 GLU C . 51974 1 449 . 1 . 1 43 43 GLU CA C 13 58.458 . . 1 . . . . . 43 GLU CA . 51974 1 450 . 1 . 1 43 43 GLU CB C 13 30.690 . . 1 . . . . . 43 GLU CB . 51974 1 451 . 1 . 1 43 43 GLU CG C 13 37.364 . . 1 . . . . . 43 GLU CG . 51974 1 452 . 1 . 1 43 43 GLU N N 15 119.414 . . 1 . . . . . 43 GLU N . 51974 1 453 . 1 . 1 44 44 LEU H H 1 7.518 . . 1 . . . . . 44 LEU H . 51974 1 454 . 1 . 1 44 44 LEU HA H 1 3.958 . . 1 . . . . . 44 LEU HA . 51974 1 455 . 1 . 1 44 44 LEU HB2 H 1 1.818 . . 2 . . . . . 44 LEU HB2 . 51974 1 456 . 1 . 1 44 44 LEU HB3 H 1 1.818 . . 2 . . . . . 44 LEU HB3 . 51974 1 457 . 1 . 1 44 44 LEU HG H 1 1.210 . . 1 . . . . . 44 LEU HG . 51974 1 458 . 1 . 1 44 44 LEU HD11 H 1 0.782 . . 1 . . . . . 44 LEU MD1 . 51974 1 459 . 1 . 1 44 44 LEU HD12 H 1 0.782 . . 1 . . . . . 44 LEU MD1 . 51974 1 460 . 1 . 1 44 44 LEU HD13 H 1 0.782 . . 1 . . . . . 44 LEU MD1 . 51974 1 461 . 1 . 1 44 44 LEU HD21 H 1 0.691 . . 1 . . . . . 44 LEU MD2 . 51974 1 462 . 1 . 1 44 44 LEU HD22 H 1 0.691 . . 1 . . . . . 44 LEU MD2 . 51974 1 463 . 1 . 1 44 44 LEU HD23 H 1 0.691 . . 1 . . . . . 44 LEU MD2 . 51974 1 464 . 1 . 1 44 44 LEU C C 13 177.653 . . 1 . . . . . 44 LEU C . 51974 1 465 . 1 . 1 44 44 LEU CA C 13 57.807 . . 1 . . . . . 44 LEU CA . 51974 1 466 . 1 . 1 44 44 LEU CB C 13 40.887 . . 1 . . . . . 44 LEU CB . 51974 1 467 . 1 . 1 44 44 LEU CD1 C 13 27.063 . . 1 . . . . . 44 LEU CD1 . 51974 1 468 . 1 . 1 44 44 LEU CD2 C 13 22.471 . . 1 . . . . . 44 LEU CD2 . 51974 1 469 . 1 . 1 44 44 LEU N N 15 119.397 . . 1 . . . . . 44 LEU N . 51974 1 470 . 1 . 1 45 45 ALA H H 1 8.154 . . 1 . . . . . 45 ALA H . 51974 1 471 . 1 . 1 45 45 ALA HA H 1 3.893 . . 1 . . . . . 45 ALA HA . 51974 1 472 . 1 . 1 45 45 ALA HB1 H 1 1.285 . . 1 . . . . . 45 ALA MB . 51974 1 473 . 1 . 1 45 45 ALA HB2 H 1 1.285 . . 1 . . . . . 45 ALA MB . 51974 1 474 . 1 . 1 45 45 ALA HB3 H 1 1.285 . . 1 . . . . . 45 ALA MB . 51974 1 475 . 1 . 1 45 45 ALA C C 13 178.602 . . 1 . . . . . 45 ALA C . 51974 1 476 . 1 . 1 45 45 ALA CA C 13 55.323 . . 1 . . . . . 45 ALA CA . 51974 1 477 . 1 . 1 45 45 ALA CB C 13 17.428 . . 1 . . . . . 45 ALA CB . 51974 1 478 . 1 . 1 45 45 ALA N N 15 118.434 . . 1 . . . . . 45 ALA N . 51974 1 479 . 1 . 1 46 46 GLU H H 1 7.353 . . 1 . . . . . 46 GLU H . 51974 1 480 . 1 . 1 46 46 GLU HA H 1 4.013 . . 1 . . . . . 46 GLU HA . 51974 1 481 . 1 . 1 46 46 GLU HG2 H 1 2.343 . . 2 . . . . . 46 GLU HG2 . 51974 1 482 . 1 . 1 46 46 GLU HG3 H 1 2.343 . . 2 . . . . . 46 GLU HG3 . 51974 1 483 . 1 . 1 46 46 GLU C C 13 177.953 . . 1 . . . . . 46 GLU C . 51974 1 484 . 1 . 1 46 46 GLU CA C 13 58.574 . . 1 . . . . . 46 GLU CA . 51974 1 485 . 1 . 1 46 46 GLU CB C 13 30.015 . . 1 . . . . . 46 GLU CB . 51974 1 486 . 1 . 1 46 46 GLU CG C 13 36.306 . . 1 . . . . . 46 GLU CG . 51974 1 487 . 1 . 1 46 46 GLU N N 15 115.085 . . 1 . . . . . 46 GLU N . 51974 1 488 . 1 . 1 47 47 LYS H H 1 7.386 . . 1 . . . . . 47 LYS H . 51974 1 489 . 1 . 1 47 47 LYS HA H 1 4.198 . . 1 . . . . . 47 LYS HA . 51974 1 490 . 1 . 1 47 47 LYS HB2 H 1 1.840 . . 2 . . . . . 47 LYS HB2 . 51974 1 491 . 1 . 1 47 47 LYS HB3 H 1 1.840 . . 2 . . . . . 47 LYS HB3 . 51974 1 492 . 1 . 1 47 47 LYS HE2 H 1 2.978 . . 2 . . . . . 47 LYS HE2 . 51974 1 493 . 1 . 1 47 47 LYS HE3 H 1 2.978 . . 2 . . . . . 47 LYS HE3 . 51974 1 494 . 1 . 1 47 47 LYS C C 13 176.320 . . 1 . . . . . 47 LYS C . 51974 1 495 . 1 . 1 47 47 LYS CA C 13 57.639 . . 1 . . . . . 47 LYS CA . 51974 1 496 . 1 . 1 47 47 LYS CB C 13 34.790 . . 1 . . . . . 47 LYS CB . 51974 1 497 . 1 . 1 47 47 LYS CG C 13 25.526 . . 1 . . . . . 47 LYS CG . 51974 1 498 . 1 . 1 47 47 LYS CD C 13 29.327 . . 1 . . . . . 47 LYS CD . 51974 1 499 . 1 . 1 47 47 LYS CE C 13 42.213 . . 1 . . . . . 47 LYS CE . 51974 1 500 . 1 . 1 47 47 LYS N N 15 116.191 . . 1 . . . . . 47 LYS N . 51974 1 501 . 1 . 1 48 48 VAL H H 1 7.413 . . 1 . . . . . 48 VAL H . 51974 1 502 . 1 . 1 48 48 VAL HA H 1 4.084 . . 1 . . . . . 48 VAL HA . 51974 1 503 . 1 . 1 48 48 VAL HB H 1 1.936 . . 1 . . . . . 48 VAL HB . 51974 1 504 . 1 . 1 48 48 VAL HG11 H 1 0.662 . . 1 . . . . . 48 VAL MG1 . 51974 1 505 . 1 . 1 48 48 VAL HG12 H 1 0.662 . . 1 . . . . . 48 VAL MG1 . 51974 1 506 . 1 . 1 48 48 VAL HG13 H 1 0.662 . . 1 . . . . . 48 VAL MG1 . 51974 1 507 . 1 . 1 48 48 VAL HG21 H 1 0.685 . . 1 . . . . . 48 VAL MG2 . 51974 1 508 . 1 . 1 48 48 VAL HG22 H 1 0.685 . . 1 . . . . . 48 VAL MG2 . 51974 1 509 . 1 . 1 48 48 VAL HG23 H 1 0.685 . . 1 . . . . . 48 VAL MG2 . 51974 1 510 . 1 . 1 48 48 VAL C C 13 173.821 . . 1 . . . . . 48 VAL C . 51974 1 511 . 1 . 1 48 48 VAL CA C 13 61.059 . . 1 . . . . . 48 VAL CA . 51974 1 512 . 1 . 1 48 48 VAL CB C 13 32.360 . . 1 . . . . . 48 VAL CB . 51974 1 513 . 1 . 1 48 48 VAL CG1 C 13 22.608 . . 1 . . . . . 48 VAL CG1 . 51974 1 514 . 1 . 1 48 48 VAL CG2 C 13 21.860 . . 1 . . . . . 48 VAL CG2 . 51974 1 515 . 1 . 1 48 48 VAL N N 15 119.687 . . 1 . . . . . 48 VAL N . 51974 1 516 . 1 . 1 49 49 GLU H H 1 8.453 . . 1 . . . . . 49 GLU H . 51974 1 517 . 1 . 1 49 49 GLU HA H 1 4.073 . . 1 . . . . . 49 GLU HA . 51974 1 518 . 1 . 1 49 49 GLU HB2 H 1 1.864 . . 2 . . . . . 49 GLU HB2 . 51974 1 519 . 1 . 1 49 49 GLU HB3 H 1 1.864 . . 2 . . . . . 49 GLU HB3 . 51974 1 520 . 1 . 1 49 49 GLU HG2 H 1 2.209 . . 2 . . . . . 49 GLU HG2 . 51974 1 521 . 1 . 1 49 49 GLU HG3 H 1 2.209 . . 2 . . . . . 49 GLU HG3 . 51974 1 522 . 1 . 1 49 49 GLU C C 13 177.436 . . 1 . . . . . 49 GLU C . 51974 1 523 . 1 . 1 49 49 GLU CA C 13 58.071 . . 1 . . . . . 49 GLU CA . 51974 1 524 . 1 . 1 49 49 GLU CB C 13 29.441 . . 1 . . . . . 49 GLU CB . 51974 1 525 . 1 . 1 49 49 GLU CG C 13 35.990 . . 1 . . . . . 49 GLU CG . 51974 1 526 . 1 . 1 49 49 GLU N N 15 128.261 . . 1 . . . . . 49 GLU N . 51974 1 527 . 1 . 1 50 50 GLY H H 1 8.835 . . 1 . . . . . 50 GLY H . 51974 1 528 . 1 . 1 50 50 GLY HA2 H 1 4.154 . . . . . . . . 50 GLY HA2 . 51974 1 529 . 1 . 1 50 50 GLY HA3 H 1 3.645 . . . . . . . . 50 GLY HA3 . 51974 1 530 . 1 . 1 50 50 GLY C C 13 173.700 . . 1 . . . . . 50 GLY C . 51974 1 531 . 1 . 1 50 50 GLY CA C 13 45.342 . . 1 . . . . . 50 GLY CA . 51974 1 532 . 1 . 1 50 50 GLY N N 15 113.485 . . 1 . . . . . 50 GLY N . 51974 1 533 . 1 . 1 51 51 LEU H H 1 7.741 . . 1 . . . . . 51 LEU H . 51974 1 534 . 1 . 1 51 51 LEU HA H 1 4.332 . . 1 . . . . . 51 LEU HA . 51974 1 535 . 1 . 1 51 51 LEU HB2 H 1 2.094 . . 2 . . . . . 51 LEU HB2 . 51974 1 536 . 1 . 1 51 51 LEU HB3 H 1 2.094 . . 2 . . . . . 51 LEU HB3 . 51974 1 537 . 1 . 1 51 51 LEU HG H 1 1.779 . . 1 . . . . . 51 LEU HG . 51974 1 538 . 1 . 1 51 51 LEU HD11 H 1 0.677 . . . . . . . . 51 LEU MD1 . 51974 1 539 . 1 . 1 51 51 LEU HD12 H 1 0.677 . . . . . . . . 51 LEU MD1 . 51974 1 540 . 1 . 1 51 51 LEU HD13 H 1 0.677 . . . . . . . . 51 LEU MD1 . 51974 1 541 . 1 . 1 51 51 LEU HD21 H 1 1.127 . . . . . . . . 51 LEU MD2 . 51974 1 542 . 1 . 1 51 51 LEU HD22 H 1 1.127 . . . . . . . . 51 LEU MD2 . 51974 1 543 . 1 . 1 51 51 LEU HD23 H 1 1.127 . . . . . . . . 51 LEU MD2 . 51974 1 544 . 1 . 1 51 51 LEU C C 13 176.042 . . 1 . . . . . 51 LEU C . 51974 1 545 . 1 . 1 51 51 LEU CA C 13 55.730 . . 1 . . . . . 51 LEU CA . 51974 1 546 . 1 . 1 51 51 LEU CB C 13 43.806 . . 1 . . . . . 51 LEU CB . 51974 1 547 . 1 . 1 51 51 LEU CD1 C 13 27.202 . . . . . . . . 51 LEU CD1 . 51974 1 548 . 1 . 1 51 51 LEU CD2 C 13 25.080 . . . . . . . . 51 LEU CD2 . 51974 1 549 . 1 . 1 51 51 LEU N N 15 122.627 . . 1 . . . . . 51 LEU N . 51974 1 550 . 1 . 1 52 52 GLY H H 1 8.559 . . 1 . . . . . 52 GLY H . 51974 1 551 . 1 . 1 52 52 GLY C C 13 173.606 . . 1 . . . . . 52 GLY C . 51974 1 552 . 1 . 1 52 52 GLY CA C 13 44.205 . . 1 . . . . . 52 GLY CA . 51974 1 553 . 1 . 1 52 52 GLY N N 15 109.407 . . 1 . . . . . 52 GLY N . 51974 1 554 . 1 . 1 53 53 GLU H H 1 8.657 . . 1 . . . . . 53 GLU H . 51974 1 555 . 1 . 1 53 53 GLU HA H 1 3.659 . . 1 . . . . . 53 GLU HA . 51974 1 556 . 1 . 1 53 53 GLU HB2 H 1 2.006 . . 2 . . . . . 53 GLU HB2 . 51974 1 557 . 1 . 1 53 53 GLU HB3 H 1 2.006 . . 2 . . . . . 53 GLU HB3 . 51974 1 558 . 1 . 1 53 53 GLU HG2 H 1 2.248 . . 2 . . . . . 53 GLU HG2 . 51974 1 559 . 1 . 1 53 53 GLU HG3 H 1 2.248 . . 2 . . . . . 53 GLU HG3 . 51974 1 560 . 1 . 1 53 53 GLU C C 13 177.890 . . 1 . . . . . 53 GLU C . 51974 1 561 . 1 . 1 53 53 GLU CA C 13 60.637 . . 1 . . . . . 53 GLU CA . 51974 1 562 . 1 . 1 53 53 GLU CB C 13 29.546 . . 1 . . . . . 53 GLU CB . 51974 1 563 . 1 . 1 53 53 GLU CG C 13 36.685 . . 1 . . . . . 53 GLU CG . 51974 1 564 . 1 . 1 53 53 GLU N N 15 119.874 . . 1 . . . . . 53 GLU N . 51974 1 565 . 1 . 1 54 54 GLU H H 1 8.560 . . 1 . . . . . 54 GLU H . 51974 1 566 . 1 . 1 54 54 GLU HA H 1 4.030 . . 1 . . . . . 54 GLU HA . 51974 1 567 . 1 . 1 54 54 GLU HB2 H 1 2.005 . . 2 . . . . . 54 GLU HB2 . 51974 1 568 . 1 . 1 54 54 GLU HB3 H 1 2.005 . . 2 . . . . . 54 GLU HB3 . 51974 1 569 . 1 . 1 54 54 GLU HG2 H 1 2.323 . . 2 . . . . . 54 GLU HG2 . 51974 1 570 . 1 . 1 54 54 GLU HG3 H 1 2.323 . . 2 . . . . . 54 GLU HG3 . 51974 1 571 . 1 . 1 54 54 GLU C C 13 179.294 . . 1 . . . . . 54 GLU C . 51974 1 572 . 1 . 1 54 54 GLU CA C 13 60.176 . . 1 . . . . . 54 GLU CA . 51974 1 573 . 1 . 1 54 54 GLU CB C 13 29.040 . . 1 . . . . . 54 GLU CB . 51974 1 574 . 1 . 1 54 54 GLU CG C 13 36.697 . . 1 . . . . . 54 GLU CG . 51974 1 575 . 1 . 1 54 54 GLU N N 15 119.758 . . 1 . . . . . 54 GLU N . 51974 1 576 . 1 . 1 55 55 LEU H H 1 8.320 . . 1 . . . . . 55 LEU H . 51974 1 577 . 1 . 1 55 55 LEU HA H 1 4.135 . . 1 . . . . . 55 LEU HA . 51974 1 578 . 1 . 1 55 55 LEU HB2 H 1 1.570 . . 2 . . . . . 55 LEU HB2 . 51974 1 579 . 1 . 1 55 55 LEU HB3 H 1 1.570 . . 2 . . . . . 55 LEU HB3 . 51974 1 580 . 1 . 1 55 55 LEU HD11 H 1 0.826 . . 1 . . . . . 55 LEU MD1 . 51974 1 581 . 1 . 1 55 55 LEU HD12 H 1 0.826 . . 1 . . . . . 55 LEU MD1 . 51974 1 582 . 1 . 1 55 55 LEU HD13 H 1 0.826 . . 1 . . . . . 55 LEU MD1 . 51974 1 583 . 1 . 1 55 55 LEU HD21 H 1 0.951 . . 1 . . . . . 55 LEU MD2 . 51974 1 584 . 1 . 1 55 55 LEU HD22 H 1 0.951 . . 1 . . . . . 55 LEU MD2 . 51974 1 585 . 1 . 1 55 55 LEU HD23 H 1 0.951 . . 1 . . . . . 55 LEU MD2 . 51974 1 586 . 1 . 1 55 55 LEU C C 13 178.782 . . 1 . . . . . 55 LEU C . 51974 1 587 . 1 . 1 55 55 LEU CA C 13 57.140 . . 1 . . . . . 55 LEU CA . 51974 1 588 . 1 . 1 55 55 LEU CB C 13 41.393 . . 1 . . . . . 55 LEU CB . 51974 1 589 . 1 . 1 55 55 LEU CG C 13 27.224 . . 1 . . . . . 55 LEU CG . 51974 1 590 . 1 . 1 55 55 LEU CD1 C 13 25.242 . . 1 . . . . . 55 LEU CD1 . 51974 1 591 . 1 . 1 55 55 LEU CD2 C 13 24.358 . . 1 . . . . . 55 LEU CD2 . 51974 1 592 . 1 . 1 55 55 LEU N N 15 120.635 . . 1 . . . . . 55 LEU N . 51974 1 593 . 1 . 1 56 56 ALA H H 1 8.262 . . 1 . . . . . 56 ALA H . 51974 1 594 . 1 . 1 56 56 ALA HA H 1 3.783 . . 1 . . . . . 56 ALA HA . 51974 1 595 . 1 . 1 56 56 ALA HB1 H 1 1.473 . . 1 . . . . . 56 ALA MB . 51974 1 596 . 1 . 1 56 56 ALA HB2 H 1 1.473 . . 1 . . . . . 56 ALA MB . 51974 1 597 . 1 . 1 56 56 ALA HB3 H 1 1.473 . . 1 . . . . . 56 ALA MB . 51974 1 598 . 1 . 1 56 56 ALA C C 13 179.053 . . 1 . . . . . 56 ALA C . 51974 1 599 . 1 . 1 56 56 ALA CA C 13 55.998 . . 1 . . . . . 56 ALA CA . 51974 1 600 . 1 . 1 56 56 ALA CB C 13 19.195 . . 1 . . . . . 56 ALA CB . 51974 1 601 . 1 . 1 56 56 ALA N N 15 120.552 . . 1 . . . . . 56 ALA N . 51974 1 602 . 1 . 1 57 57 GLU H H 1 8.052 . . 1 . . . . . 57 GLU H . 51974 1 603 . 1 . 1 57 57 GLU HA H 1 3.606 . . 1 . . . . . 57 GLU HA . 51974 1 604 . 1 . 1 57 57 GLU HB2 H 1 2.079 . . 2 . . . . . 57 GLU HB2 . 51974 1 605 . 1 . 1 57 57 GLU HB3 H 1 2.079 . . 2 . . . . . 57 GLU HB3 . 51974 1 606 . 1 . 1 57 57 GLU HG2 H 1 2.290 . . 2 . . . . . 57 GLU HG2 . 51974 1 607 . 1 . 1 57 57 GLU HG3 H 1 2.290 . . 2 . . . . . 57 GLU HG3 . 51974 1 608 . 1 . 1 57 57 GLU C C 13 177.259 . . 1 . . . . . 57 GLU C . 51974 1 609 . 1 . 1 57 57 GLU CA C 13 60.162 . . 1 . . . . . 57 GLU CA . 51974 1 610 . 1 . 1 57 57 GLU CG C 13 36.577 . . 1 . . . . . 57 GLU CG . 51974 1 611 . 1 . 1 57 57 GLU N N 15 116.639 . . 1 . . . . . 57 GLU N . 51974 1 612 . 1 . 1 58 58 ARG H H 1 7.382 . . 1 . . . . . 58 ARG H . 51974 1 613 . 1 . 1 58 58 ARG HA H 1 4.079 . . 1 . . . . . 58 ARG HA . 51974 1 614 . 1 . 1 58 58 ARG HB2 H 1 1.949 . . 2 . . . . . 58 ARG HB2 . 51974 1 615 . 1 . 1 58 58 ARG HB3 H 1 1.949 . . 2 . . . . . 58 ARG HB3 . 51974 1 616 . 1 . 1 58 58 ARG HG2 H 1 1.757 . . 2 . . . . . 58 ARG HG2 . 51974 1 617 . 1 . 1 58 58 ARG HG3 H 1 1.757 . . 2 . . . . . 58 ARG HG3 . 51974 1 618 . 1 . 1 58 58 ARG HD2 H 1 3.248 . . 2 . . . . . 58 ARG HD2 . 51974 1 619 . 1 . 1 58 58 ARG HD3 H 1 3.248 . . 2 . . . . . 58 ARG HD3 . 51974 1 620 . 1 . 1 58 58 ARG C C 13 179.944 . . 1 . . . . . 58 ARG C . 51974 1 621 . 1 . 1 58 58 ARG CA C 13 59.869 . . 1 . . . . . 58 ARG CA . 51974 1 622 . 1 . 1 58 58 ARG CB C 13 30.774 . . 1 . . . . . 58 ARG CB . 51974 1 623 . 1 . 1 58 58 ARG CG C 13 28.144 . . 1 . . . . . 58 ARG CG . 51974 1 624 . 1 . 1 58 58 ARG CD C 13 43.872 . . 1 . . . . . 58 ARG CD . 51974 1 625 . 1 . 1 58 58 ARG N N 15 117.320 . . 1 . . . . . 58 ARG N . 51974 1 626 . 1 . 1 59 59 VAL H H 1 8.417 . . 1 . . . . . 59 VAL H . 51974 1 627 . 1 . 1 59 59 VAL HA H 1 3.616 . . 1 . . . . . 59 VAL HA . 51974 1 628 . 1 . 1 59 59 VAL HB H 1 2.138 . . 1 . . . . . 59 VAL HB . 51974 1 629 . 1 . 1 59 59 VAL HG11 H 1 0.901 . . 2 . . . . . 59 VAL MG1 . 51974 1 630 . 1 . 1 59 59 VAL HG12 H 1 0.901 . . 2 . . . . . 59 VAL MG1 . 51974 1 631 . 1 . 1 59 59 VAL HG13 H 1 0.901 . . 2 . . . . . 59 VAL MG1 . 51974 1 632 . 1 . 1 59 59 VAL HG21 H 1 0.901 . . 2 . . . . . 59 VAL MG2 . 51974 1 633 . 1 . 1 59 59 VAL HG22 H 1 0.901 . . 2 . . . . . 59 VAL MG2 . 51974 1 634 . 1 . 1 59 59 VAL HG23 H 1 0.901 . . 2 . . . . . 59 VAL MG2 . 51974 1 635 . 1 . 1 59 59 VAL C C 13 177.045 . . 1 . . . . . 59 VAL C . 51974 1 636 . 1 . 1 59 59 VAL CA C 13 67.098 . . 1 . . . . . 59 VAL CA . 51974 1 637 . 1 . 1 59 59 VAL CB C 13 31.727 . . 1 . . . . . 59 VAL CB . 51974 1 638 . 1 . 1 59 59 VAL CG1 C 13 22.768 . . 2 . . . . . 59 VAL CG1 . 51974 1 639 . 1 . 1 59 59 VAL CG2 C 13 22.768 . . 2 . . . . . 59 VAL CG2 . 51974 1 640 . 1 . 1 59 59 VAL N N 15 119.435 . . 1 . . . . . 59 VAL N . 51974 1 641 . 1 . 1 60 60 VAL H H 1 8.391 . . 1 . . . . . 60 VAL H . 51974 1 642 . 1 . 1 60 60 VAL HA H 1 3.784 . . 1 . . . . . 60 VAL HA . 51974 1 643 . 1 . 1 60 60 VAL HB H 1 1.965 . . 1 . . . . . 60 VAL HB . 51974 1 644 . 1 . 1 60 60 VAL HG11 H 1 0.950 . . 1 . . . . . 60 VAL MG1 . 51974 1 645 . 1 . 1 60 60 VAL HG12 H 1 0.950 . . 1 . . . . . 60 VAL MG1 . 51974 1 646 . 1 . 1 60 60 VAL HG13 H 1 0.950 . . 1 . . . . . 60 VAL MG1 . 51974 1 647 . 1 . 1 60 60 VAL HG21 H 1 1.015 . . 1 . . . . . 60 VAL MG2 . 51974 1 648 . 1 . 1 60 60 VAL HG22 H 1 1.015 . . 1 . . . . . 60 VAL MG2 . 51974 1 649 . 1 . 1 60 60 VAL HG23 H 1 1.015 . . 1 . . . . . 60 VAL MG2 . 51974 1 650 . 1 . 1 60 60 VAL C C 13 178.554 . . 1 . . . . . 60 VAL C . 51974 1 651 . 1 . 1 60 60 VAL CA C 13 67.827 . . 1 . . . . . 60 VAL CA . 51974 1 652 . 1 . 1 60 60 VAL CB C 13 32.182 . . 1 . . . . . 60 VAL CB . 51974 1 653 . 1 . 1 60 60 VAL CG1 C 13 22.899 . . 1 . . . . . 60 VAL CG1 . 51974 1 654 . 1 . 1 60 60 VAL CG2 C 13 21.358 . . 1 . . . . . 60 VAL CG2 . 51974 1 655 . 1 . 1 60 60 VAL N N 15 119.345 . . 1 . . . . . 60 VAL N . 51974 1 656 . 1 . 1 61 61 TYR H H 1 8.606 . . 1 . . . . . 61 TYR H . 51974 1 657 . 1 . 1 61 61 TYR HA H 1 4.238 . . 1 . . . . . 61 TYR HA . 51974 1 658 . 1 . 1 61 61 TYR HB2 H 1 3.170 . . 2 . . . . . 61 TYR HB2 . 51974 1 659 . 1 . 1 61 61 TYR HB3 H 1 3.170 . . 2 . . . . . 61 TYR HB3 . 51974 1 660 . 1 . 1 61 61 TYR C C 13 178.996 . . 1 . . . . . 61 TYR C . 51974 1 661 . 1 . 1 61 61 TYR CB C 13 36.726 . . 1 . . . . . 61 TYR CB . 51974 1 662 . 1 . 1 61 61 TYR N N 15 118.525 . . 1 . . . . . 61 TYR N . 51974 1 663 . 1 . 1 62 62 ALA H H 1 8.053 . . 1 . . . . . 62 ALA H . 51974 1 664 . 1 . 1 62 62 ALA HA H 1 4.291 . . 1 . . . . . 62 ALA HA . 51974 1 665 . 1 . 1 62 62 ALA HB1 H 1 1.707 . . 1 . . . . . 62 ALA MB . 51974 1 666 . 1 . 1 62 62 ALA HB2 H 1 1.707 . . 1 . . . . . 62 ALA MB . 51974 1 667 . 1 . 1 62 62 ALA HB3 H 1 1.707 . . 1 . . . . . 62 ALA MB . 51974 1 668 . 1 . 1 62 62 ALA C C 13 180.616 . . 1 . . . . . 62 ALA C . 51974 1 669 . 1 . 1 62 62 ALA CA C 13 55.092 . . 1 . . . . . 62 ALA CA . 51974 1 670 . 1 . 1 62 62 ALA CB C 13 18.741 . . 1 . . . . . 62 ALA CB . 51974 1 671 . 1 . 1 62 62 ALA N N 15 122.431 . . 1 . . . . . 62 ALA N . 51974 1 672 . 1 . 1 63 63 ALA H H 1 8.634 . . 1 . . . . . 63 ALA H . 51974 1 673 . 1 . 1 63 63 ALA HA H 1 3.830 . . 1 . . . . . 63 ALA HA . 51974 1 674 . 1 . 1 63 63 ALA HB1 H 1 1.565 . . 1 . . . . . 63 ALA MB . 51974 1 675 . 1 . 1 63 63 ALA HB2 H 1 1.565 . . 1 . . . . . 63 ALA MB . 51974 1 676 . 1 . 1 63 63 ALA HB3 H 1 1.565 . . 1 . . . . . 63 ALA MB . 51974 1 677 . 1 . 1 63 63 ALA C C 13 179.099 . . 1 . . . . . 63 ALA C . 51974 1 678 . 1 . 1 63 63 ALA CA C 13 55.576 . . 1 . . . . . 63 ALA CA . 51974 1 679 . 1 . 1 63 63 ALA CB C 13 17.675 . . 1 . . . . . 63 ALA CB . 51974 1 680 . 1 . 1 63 63 ALA N N 15 122.070 . . 1 . . . . . 63 ALA N . 51974 1 681 . 1 . 1 64 64 ARG H H 1 8.737 . . 1 . . . . . 64 ARG H . 51974 1 682 . 1 . 1 64 64 ARG HA H 1 3.900 . . 1 . . . . . 64 ARG HA . 51974 1 683 . 1 . 1 64 64 ARG HD2 H 1 2.939 . . 2 . . . . . 64 ARG HD2 . 51974 1 684 . 1 . 1 64 64 ARG HD3 H 1 2.939 . . 2 . . . . . 64 ARG HD3 . 51974 1 685 . 1 . 1 64 64 ARG C C 13 178.545 . . 1 . . . . . 64 ARG C . 51974 1 686 . 1 . 1 64 64 ARG CA C 13 60.416 . . 1 . . . . . 64 ARG CA . 51974 1 687 . 1 . 1 64 64 ARG CB C 13 30.111 . . 1 . . . . . 64 ARG CB . 51974 1 688 . 1 . 1 64 64 ARG CG C 13 28.563 . . 1 . . . . . 64 ARG CG . 51974 1 689 . 1 . 1 64 64 ARG CD C 13 44.346 . . 1 . . . . . 64 ARG CD . 51974 1 690 . 1 . 1 64 64 ARG N N 15 118.473 . . 1 . . . . . 64 ARG N . 51974 1 691 . 1 . 1 65 65 GLU H H 1 7.840 . . 1 . . . . . 65 GLU H . 51974 1 692 . 1 . 1 65 65 GLU HA H 1 3.999 . . 1 . . . . . 65 GLU HA . 51974 1 693 . 1 . 1 65 65 GLU HB2 H 1 2.125 . . 2 . . . . . 65 GLU HB2 . 51974 1 694 . 1 . 1 65 65 GLU HB3 H 1 2.125 . . 2 . . . . . 65 GLU HB3 . 51974 1 695 . 1 . 1 65 65 GLU HG2 H 1 2.361 . . 2 . . . . . 65 GLU HG2 . 51974 1 696 . 1 . 1 65 65 GLU HG3 H 1 2.361 . . 2 . . . . . 65 GLU HG3 . 51974 1 697 . 1 . 1 65 65 GLU C C 13 178.988 . . 1 . . . . . 65 GLU C . 51974 1 698 . 1 . 1 65 65 GLU CA C 13 59.446 . . 1 . . . . . 65 GLU CA . 51974 1 699 . 1 . 1 65 65 GLU CB C 13 29.549 . . 1 . . . . . 65 GLU CB . 51974 1 700 . 1 . 1 65 65 GLU CG C 13 36.467 . . 1 . . . . . 65 GLU CG . 51974 1 701 . 1 . 1 65 65 GLU N N 15 119.246 . . 1 . . . . . 65 GLU N . 51974 1 702 . 1 . 1 66 66 ARG H H 1 7.585 . . 1 . . . . . 66 ARG H . 51974 1 703 . 1 . 1 66 66 ARG HA H 1 3.986 . . 1 . . . . . 66 ARG HA . 51974 1 704 . 1 . 1 66 66 ARG HD2 H 1 2.584 . . 2 . . . . . 66 ARG HD2 . 51974 1 705 . 1 . 1 66 66 ARG HD3 H 1 2.584 . . 2 . . . . . 66 ARG HD3 . 51974 1 706 . 1 . 1 66 66 ARG C C 13 178.874 . . 1 . . . . . 66 ARG C . 51974 1 707 . 1 . 1 66 66 ARG CA C 13 58.127 . . 1 . . . . . 66 ARG CA . 51974 1 708 . 1 . 1 66 66 ARG CB C 13 29.727 . . 1 . . . . . 66 ARG CB . 51974 1 709 . 1 . 1 66 66 ARG CG C 13 26.251 . . 1 . . . . . 66 ARG CG . 51974 1 710 . 1 . 1 66 66 ARG CD C 13 42.468 . . 1 . . . . . 66 ARG CD . 51974 1 711 . 1 . 1 66 66 ARG N N 15 119.363 . . 1 . . . . . 66 ARG N . 51974 1 712 . 1 . 1 67 67 VAL H H 1 8.137 . . 1 . . . . . 67 VAL H . 51974 1 713 . 1 . 1 67 67 VAL HA H 1 3.617 . . 1 . . . . . 67 VAL HA . 51974 1 714 . 1 . 1 67 67 VAL HG11 H 1 0.927 . . 1 . . . . . 67 VAL MG1 . 51974 1 715 . 1 . 1 67 67 VAL HG12 H 1 0.927 . . 1 . . . . . 67 VAL MG1 . 51974 1 716 . 1 . 1 67 67 VAL HG13 H 1 0.927 . . 1 . . . . . 67 VAL MG1 . 51974 1 717 . 1 . 1 67 67 VAL HG21 H 1 0.889 . . 1 . . . . . 67 VAL MG2 . 51974 1 718 . 1 . 1 67 67 VAL HG22 H 1 0.889 . . 1 . . . . . 67 VAL MG2 . 51974 1 719 . 1 . 1 67 67 VAL HG23 H 1 0.889 . . 1 . . . . . 67 VAL MG2 . 51974 1 720 . 1 . 1 67 67 VAL C C 13 178.316 . . 1 . . . . . 67 VAL C . 51974 1 721 . 1 . 1 67 67 VAL CA C 13 66.192 . . 1 . . . . . 67 VAL CA . 51974 1 722 . 1 . 1 67 67 VAL CB C 13 32.202 . . 1 . . . . . 67 VAL CB . 51974 1 723 . 1 . 1 67 67 VAL CG2 C 13 21.428 . . 1 . . . . . 67 VAL CG2 . 51974 1 724 . 1 . 1 67 67 VAL N N 15 119.413 . . 1 . . . . . 67 VAL N . 51974 1 725 . 1 . 1 68 68 GLU H H 1 8.173 . . 1 . . . . . 68 GLU H . 51974 1 726 . 1 . 1 68 68 GLU HA H 1 4.070 . . 1 . . . . . 68 GLU HA . 51974 1 727 . 1 . 1 68 68 GLU HB2 H 1 2.041 . . 2 . . . . . 68 GLU HB2 . 51974 1 728 . 1 . 1 68 68 GLU HB3 H 1 2.041 . . 2 . . . . . 68 GLU HB3 . 51974 1 729 . 1 . 1 68 68 GLU HG2 H 1 2.304 . . 2 . . . . . 68 GLU HG2 . 51974 1 730 . 1 . 1 68 68 GLU HG3 H 1 2.304 . . 2 . . . . . 68 GLU HG3 . 51974 1 731 . 1 . 1 68 68 GLU C C 13 178.802 . . 1 . . . . . 68 GLU C . 51974 1 732 . 1 . 1 68 68 GLU CA C 13 59.006 . . 1 . . . . . 68 GLU CA . 51974 1 733 . 1 . 1 68 68 GLU CB C 13 29.314 . . 1 . . . . . 68 GLU CB . 51974 1 734 . 1 . 1 68 68 GLU CG C 13 36.186 . . 1 . . . . . 68 GLU CG . 51974 1 735 . 1 . 1 68 68 GLU N N 15 120.244 . . 1 . . . . . 68 GLU N . 51974 1 736 . 1 . 1 69 69 SER H H 1 8.070 . . 1 . . . . . 69 SER H . 51974 1 737 . 1 . 1 69 69 SER HA H 1 4.182 . . 1 . . . . . 69 SER HA . 51974 1 738 . 1 . 1 69 69 SER HB2 H 1 3.962 . . 2 . . . . . 69 SER HB2 . 51974 1 739 . 1 . 1 69 69 SER HB3 H 1 3.962 . . 2 . . . . . 69 SER HB3 . 51974 1 740 . 1 . 1 69 69 SER C C 13 176.545 . . 1 . . . . . 69 SER C . 51974 1 741 . 1 . 1 69 69 SER CA C 13 61.107 . . 1 . . . . . 69 SER CA . 51974 1 742 . 1 . 1 69 69 SER CB C 13 63.118 . . 1 . . . . . 69 SER CB . 51974 1 743 . 1 . 1 69 69 SER N N 15 114.355 . . 1 . . . . . 69 SER N . 51974 1 744 . 1 . 1 70 70 ARG H H 1 7.774 . . 1 . . . . . 70 ARG H . 51974 1 745 . 1 . 1 70 70 ARG HA H 1 4.171 . . 1 . . . . . 70 ARG HA . 51974 1 746 . 1 . 1 70 70 ARG HB2 H 1 1.899 . . 2 . . . . . 70 ARG HB2 . 51974 1 747 . 1 . 1 70 70 ARG HB3 H 1 1.899 . . 2 . . . . . 70 ARG HB3 . 51974 1 748 . 1 . 1 70 70 ARG HG2 H 1 1.675 . . 2 . . . . . 70 ARG HG2 . 51974 1 749 . 1 . 1 70 70 ARG HG3 H 1 1.675 . . 2 . . . . . 70 ARG HG3 . 51974 1 750 . 1 . 1 70 70 ARG HD2 H 1 3.083 . . 2 . . . . . 70 ARG HD2 . 51974 1 751 . 1 . 1 70 70 ARG HD3 H 1 3.083 . . 2 . . . . . 70 ARG HD3 . 51974 1 752 . 1 . 1 70 70 ARG C C 13 177.790 . . 1 . . . . . 70 ARG C . 51974 1 753 . 1 . 1 70 70 ARG CA C 13 57.983 . . 1 . . . . . 70 ARG CA . 51974 1 754 . 1 . 1 70 70 ARG CB C 13 30.409 . . 1 . . . . . 70 ARG CB . 51974 1 755 . 1 . 1 70 70 ARG CG C 13 27.254 . . 1 . . . . . 70 ARG CG . 51974 1 756 . 1 . 1 70 70 ARG CD C 13 43.885 . . 1 . . . . . 70 ARG CD . 51974 1 757 . 1 . 1 70 70 ARG N N 15 121.145 . . 1 . . . . . 70 ARG N . 51974 1 758 . 1 . 1 71 71 ARG H H 1 7.869 . . 1 . . . . . 71 ARG H . 51974 1 759 . 1 . 1 71 71 ARG HA H 1 4.159 . . 1 . . . . . 71 ARG HA . 51974 1 760 . 1 . 1 71 71 ARG HB2 H 1 1.861 . . 2 . . . . . 71 ARG HB2 . 51974 1 761 . 1 . 1 71 71 ARG HB3 H 1 1.861 . . 2 . . . . . 71 ARG HB3 . 51974 1 762 . 1 . 1 71 71 ARG HG2 H 1 1.657 . . 2 . . . . . 71 ARG HG2 . 51974 1 763 . 1 . 1 71 71 ARG HG3 H 1 1.657 . . 2 . . . . . 71 ARG HG3 . 51974 1 764 . 1 . 1 71 71 ARG HD2 H 1 3.139 . . 2 . . . . . 71 ARG HD2 . 51974 1 765 . 1 . 1 71 71 ARG HD3 H 1 3.139 . . 2 . . . . . 71 ARG HD3 . 51974 1 766 . 1 . 1 71 71 ARG C C 13 177.564 . . 1 . . . . . 71 ARG C . 51974 1 767 . 1 . 1 71 71 ARG CA C 13 57.983 . . 1 . . . . . 71 ARG CA . 51974 1 768 . 1 . 1 71 71 ARG CB C 13 30.580 . . 1 . . . . . 71 ARG CB . 51974 1 769 . 1 . 1 71 71 ARG CG C 13 27.561 . . 1 . . . . . 71 ARG CG . 51974 1 770 . 1 . 1 71 71 ARG CD C 13 43.611 . . 1 . . . . . 71 ARG CD . 51974 1 771 . 1 . 1 71 71 ARG N N 15 119.961 . . 1 . . . . . 71 ARG N . 51974 1 772 . 1 . 1 72 72 LYS H H 1 7.988 . . 1 . . . . . 72 LYS H . 51974 1 773 . 1 . 1 72 72 LYS HA H 1 4.249 . . 1 . . . . . 72 LYS HA . 51974 1 774 . 1 . 1 72 72 LYS HB2 H 1 1.860 . . 2 . . . . . 72 LYS HB2 . 51974 1 775 . 1 . 1 72 72 LYS HB3 H 1 1.860 . . 2 . . . . . 72 LYS HB3 . 51974 1 776 . 1 . 1 72 72 LYS HD2 H 1 1.473 . . 2 . . . . . 72 LYS HD2 . 51974 1 777 . 1 . 1 72 72 LYS HD3 H 1 1.473 . . 2 . . . . . 72 LYS HD3 . 51974 1 778 . 1 . 1 72 72 LYS HE2 H 1 2.943 . . 2 . . . . . 72 LYS HE2 . 51974 1 779 . 1 . 1 72 72 LYS HE3 H 1 2.943 . . 2 . . . . . 72 LYS HE3 . 51974 1 780 . 1 . 1 72 72 LYS C C 13 177.204 . . 1 . . . . . 72 LYS C . 51974 1 781 . 1 . 1 72 72 LYS CA C 13 57.395 . . 1 . . . . . 72 LYS CA . 51974 1 782 . 1 . 1 72 72 LYS CB C 13 32.936 . . 1 . . . . . 72 LYS CB . 51974 1 783 . 1 . 1 72 72 LYS CG C 13 25.106 . . 1 . . . . . 72 LYS CG . 51974 1 784 . 1 . 1 72 72 LYS CD C 13 29.296 . . 1 . . . . . 72 LYS CD . 51974 1 785 . 1 . 1 72 72 LYS CE C 13 42.315 . . 1 . . . . . 72 LYS CE . 51974 1 786 . 1 . 1 72 72 LYS N N 15 119.866 . . 1 . . . . . 72 LYS N . 51974 1 787 . 1 . 1 73 73 SER H H 1 8.081 . . 1 . . . . . 73 SER H . 51974 1 788 . 1 . 1 73 73 SER HA H 1 4.419 . . 1 . . . . . 73 SER HA . 51974 1 789 . 1 . 1 73 73 SER HB2 H 1 3.915 . . 2 . . . . . 73 SER HB2 . 51974 1 790 . 1 . 1 73 73 SER HB3 H 1 3.915 . . 2 . . . . . 73 SER HB3 . 51974 1 791 . 1 . 1 73 73 SER C C 13 175.246 . . 1 . . . . . 73 SER C . 51974 1 792 . 1 . 1 73 73 SER CA C 13 59.216 . . 1 . . . . . 73 SER CA . 51974 1 793 . 1 . 1 73 73 SER CB C 13 63.913 . . 1 . . . . . 73 SER CB . 51974 1 794 . 1 . 1 73 73 SER N N 15 115.365 . . 1 . . . . . 73 SER N . 51974 1 795 . 1 . 1 74 74 GLY H H 1 8.271 . . 1 . . . . . 74 GLY H . 51974 1 796 . 1 . 1 74 74 GLY HA2 H 1 3.977 . . 2 . . . . . 74 GLY HA2 . 51974 1 797 . 1 . 1 74 74 GLY HA3 H 1 3.977 . . 2 . . . . . 74 GLY HA3 . 51974 1 798 . 1 . 1 74 74 GLY C C 13 174.130 . . 1 . . . . . 74 GLY C . 51974 1 799 . 1 . 1 74 74 GLY CA C 13 45.634 . . 1 . . . . . 74 GLY CA . 51974 1 800 . 1 . 1 74 74 GLY N N 15 110.421 . . 1 . . . . . 74 GLY N . 51974 1 801 . 1 . 1 75 75 ARG H H 1 8.109 . . 1 . . . . . 75 ARG H . 51974 1 802 . 1 . 1 75 75 ARG HA H 1 4.295 . . 1 . . . . . 75 ARG HA . 51974 1 803 . 1 . 1 75 75 ARG HB2 H 1 1.786 . . 2 . . . . . 75 ARG HB2 . 51974 1 804 . 1 . 1 75 75 ARG HB3 H 1 1.786 . . 2 . . . . . 75 ARG HB3 . 51974 1 805 . 1 . 1 75 75 ARG HG2 H 1 1.621 . . 2 . . . . . 75 ARG HG2 . 51974 1 806 . 1 . 1 75 75 ARG HG3 H 1 1.621 . . 2 . . . . . 75 ARG HG3 . 51974 1 807 . 1 . 1 75 75 ARG HD2 H 1 3.153 . . 2 . . . . . 75 ARG HD2 . 51974 1 808 . 1 . 1 75 75 ARG HD3 H 1 3.153 . . 2 . . . . . 75 ARG HD3 . 51974 1 809 . 1 . 1 75 75 ARG C C 13 176.317 . . 1 . . . . . 75 ARG C . 51974 1 810 . 1 . 1 75 75 ARG CA C 13 56.383 . . 1 . . . . . 75 ARG CA . 51974 1 811 . 1 . 1 75 75 ARG CB C 13 30.916 . . 1 . . . . . 75 ARG CB . 51974 1 812 . 1 . 1 75 75 ARG CG C 13 27.219 . . 1 . . . . . 75 ARG CG . 51974 1 813 . 1 . 1 75 75 ARG CD C 13 43.466 . . 1 . . . . . 75 ARG CD . 51974 1 814 . 1 . 1 75 75 ARG N N 15 120.379 . . 1 . . . . . 75 ARG N . 51974 1 815 . 1 . 1 76 76 GLN H H 1 8.463 . . 1 . . . . . 76 GLN H . 51974 1 816 . 1 . 1 76 76 GLN HA H 1 4.294 . . 1 . . . . . 76 GLN HA . 51974 1 817 . 1 . 1 76 76 GLN HB2 H 1 2.022 . . 2 . . . . . 76 GLN HB2 . 51974 1 818 . 1 . 1 76 76 GLN HB3 H 1 2.022 . . 2 . . . . . 76 GLN HB3 . 51974 1 819 . 1 . 1 76 76 GLN HG2 H 1 2.342 . . 2 . . . . . 76 GLN HG2 . 51974 1 820 . 1 . 1 76 76 GLN HG3 H 1 2.342 . . 2 . . . . . 76 GLN HG3 . 51974 1 821 . 1 . 1 76 76 GLN C C 13 175.929 . . 1 . . . . . 76 GLN C . 51974 1 822 . 1 . 1 76 76 GLN CA C 13 56.093 . . 1 . . . . . 76 GLN CA . 51974 1 823 . 1 . 1 76 76 GLN CB C 13 29.360 . . 1 . . . . . 76 GLN CB . 51974 1 824 . 1 . 1 76 76 GLN CG C 13 33.961 . . 1 . . . . . 76 GLN CG . 51974 1 825 . 1 . 1 76 76 GLN N N 15 121.575 . . 1 . . . . . 76 GLN N . 51974 1 826 . 1 . 1 77 77 GLU H H 1 8.486 . . 1 . . . . . 77 GLU H . 51974 1 827 . 1 . 1 77 77 GLU HA H 1 4.260 . . 1 . . . . . 77 GLU HA . 51974 1 828 . 1 . 1 77 77 GLU HB2 H 1 1.976 . . 2 . . . . . 77 GLU HB2 . 51974 1 829 . 1 . 1 77 77 GLU HB3 H 1 1.976 . . 2 . . . . . 77 GLU HB3 . 51974 1 830 . 1 . 1 77 77 GLU HG2 H 1 2.250 . . 2 . . . . . 77 GLU HG2 . 51974 1 831 . 1 . 1 77 77 GLU HG3 H 1 2.250 . . 2 . . . . . 77 GLU HG3 . 51974 1 832 . 1 . 1 77 77 GLU C C 13 176.337 . . 1 . . . . . 77 GLU C . 51974 1 833 . 1 . 1 77 77 GLU CA C 13 56.894 . . 1 . . . . . 77 GLU CA . 51974 1 834 . 1 . 1 77 77 GLU CB C 13 30.282 . . 1 . . . . . 77 GLU CB . 51974 1 835 . 1 . 1 77 77 GLU CG C 13 36.326 . . 1 . . . . . 77 GLU CG . 51974 1 836 . 1 . 1 77 77 GLU N N 15 122.285 . . 1 . . . . . 77 GLU N . 51974 1 837 . 1 . 1 78 78 ARG H H 1 8.374 . . 1 . . . . . 78 ARG H . 51974 1 838 . 1 . 1 78 78 ARG HA H 1 4.371 . . 1 . . . . . 78 ARG HA . 51974 1 839 . 1 . 1 78 78 ARG HB2 H 1 1.781 . . 2 . . . . . 78 ARG HB2 . 51974 1 840 . 1 . 1 78 78 ARG HB3 H 1 1.781 . . 2 . . . . . 78 ARG HB3 . 51974 1 841 . 1 . 1 78 78 ARG HG2 H 1 1.606 . . 2 . . . . . 78 ARG HG2 . 51974 1 842 . 1 . 1 78 78 ARG HG3 H 1 1.606 . . 2 . . . . . 78 ARG HG3 . 51974 1 843 . 1 . 1 78 78 ARG HD2 H 1 3.109 . . 2 . . . . . 78 ARG HD2 . 51974 1 844 . 1 . 1 78 78 ARG HD3 H 1 3.109 . . 2 . . . . . 78 ARG HD3 . 51974 1 845 . 1 . 1 78 78 ARG C C 13 176.200 . . 1 . . . . . 78 ARG C . 51974 1 846 . 1 . 1 78 78 ARG CA C 13 56.095 . . 1 . . . . . 78 ARG CA . 51974 1 847 . 1 . 1 78 78 ARG CB C 13 31.063 . . 1 . . . . . 78 ARG CB . 51974 1 848 . 1 . 1 78 78 ARG CG C 13 27.163 . . 1 . . . . . 78 ARG CG . 51974 1 849 . 1 . 1 78 78 ARG CD C 13 43.432 . . 1 . . . . . 78 ARG CD . 51974 1 850 . 1 . 1 78 78 ARG N N 15 121.621 . . 1 . . . . . 78 ARG N . 51974 1 851 . 1 . 1 79 79 SER H H 1 8.430 . . 1 . . . . . 79 SER H . 51974 1 852 . 1 . 1 79 79 SER HA H 1 4.413 . . 1 . . . . . 79 SER HA . 51974 1 853 . 1 . 1 79 79 SER HB2 H 1 3.876 . . 2 . . . . . 79 SER HB2 . 51974 1 854 . 1 . 1 79 79 SER HB3 H 1 3.876 . . 2 . . . . . 79 SER HB3 . 51974 1 855 . 1 . 1 79 79 SER C C 13 174.766 . . 1 . . . . . 79 SER C . 51974 1 856 . 1 . 1 79 79 SER CA C 13 58.633 . . 1 . . . . . 79 SER CA . 51974 1 857 . 1 . 1 79 79 SER CB C 13 63.772 . . 1 . . . . . 79 SER CB . 51974 1 858 . 1 . 1 79 79 SER N N 15 117.577 . . 1 . . . . . 79 SER N . 51974 1 859 . 1 . 1 80 80 GLU H H 1 8.557 . . 1 . . . . . 80 GLU H . 51974 1 860 . 1 . 1 80 80 GLU HA H 1 4.176 . . 1 . . . . . 80 GLU HA . 51974 1 861 . 1 . 1 80 80 GLU HB2 H 1 1.988 . . 2 . . . . . 80 GLU HB2 . 51974 1 862 . 1 . 1 80 80 GLU HB3 H 1 1.988 . . 2 . . . . . 80 GLU HB3 . 51974 1 863 . 1 . 1 80 80 GLU HG2 H 1 2.232 . . 2 . . . . . 80 GLU HG2 . 51974 1 864 . 1 . 1 80 80 GLU HG3 H 1 2.232 . . 2 . . . . . 80 GLU HG3 . 51974 1 865 . 1 . 1 80 80 GLU C C 13 176.632 . . 1 . . . . . 80 GLU C . 51974 1 866 . 1 . 1 80 80 GLU CA C 13 57.146 . . 1 . . . . . 80 GLU CA . 51974 1 867 . 1 . 1 80 80 GLU CB C 13 30.049 . . 1 . . . . . 80 GLU CB . 51974 1 868 . 1 . 1 80 80 GLU CG C 13 36.387 . . 1 . . . . . 80 GLU CG . 51974 1 869 . 1 . 1 80 80 GLU N N 15 122.542 . . 1 . . . . . 80 GLU N . 51974 1 870 . 1 . 1 81 81 GLU H H 1 8.293 . . 1 . . . . . 81 GLU H . 51974 1 871 . 1 . 1 81 81 GLU HA H 1 4.144 . . 1 . . . . . 81 GLU HA . 51974 1 872 . 1 . 1 81 81 GLU HB2 H 1 1.847 . . 2 . . . . . 81 GLU HB2 . 51974 1 873 . 1 . 1 81 81 GLU HB3 H 1 1.847 . . 2 . . . . . 81 GLU HB3 . 51974 1 874 . 1 . 1 81 81 GLU HG2 H 1 2.185 . . 2 . . . . . 81 GLU HG2 . 51974 1 875 . 1 . 1 81 81 GLU HG3 H 1 2.185 . . 2 . . . . . 81 GLU HG3 . 51974 1 876 . 1 . 1 81 81 GLU C C 13 176.449 . . 1 . . . . . 81 GLU C . 51974 1 877 . 1 . 1 81 81 GLU CA C 13 56.874 . . 1 . . . . . 81 GLU CA . 51974 1 878 . 1 . 1 81 81 GLU CB C 13 30.197 . . 1 . . . . . 81 GLU CB . 51974 1 879 . 1 . 1 81 81 GLU CG C 13 36.390 . . 1 . . . . . 81 GLU CG . 51974 1 880 . 1 . 1 81 81 GLU N N 15 120.445 . . 1 . . . . . 81 GLU N . 51974 1 881 . 1 . 1 82 82 GLU H H 1 8.191 . . 1 . . . . . 82 GLU H . 51974 1 882 . 1 . 1 82 82 GLU HA H 1 4.176 . . 1 . . . . . 82 GLU HA . 51974 1 883 . 1 . 1 82 82 GLU HB2 H 1 1.868 . . 2 . . . . . 82 GLU HB2 . 51974 1 884 . 1 . 1 82 82 GLU HB3 H 1 1.868 . . 2 . . . . . 82 GLU HB3 . 51974 1 885 . 1 . 1 82 82 GLU HG2 H 1 2.125 . . 2 . . . . . 82 GLU HG2 . 51974 1 886 . 1 . 1 82 82 GLU HG3 H 1 2.125 . . 2 . . . . . 82 GLU HG3 . 51974 1 887 . 1 . 1 82 82 GLU C C 13 175.935 . . 1 . . . . . 82 GLU C . 51974 1 888 . 1 . 1 82 82 GLU CA C 13 56.857 . . 1 . . . . . 82 GLU CA . 51974 1 889 . 1 . 1 82 82 GLU CB C 13 30.451 . . 1 . . . . . 82 GLU CB . 51974 1 890 . 1 . 1 82 82 GLU CG C 13 36.427 . . 1 . . . . . 82 GLU CG . 51974 1 891 . 1 . 1 82 82 GLU N N 15 120.781 . . 1 . . . . . 82 GLU N . 51974 1 892 . 1 . 1 83 83 TRP H H 1 7.995 . . 1 . . . . . 83 TRP H . 51974 1 893 . 1 . 1 83 83 TRP C C 13 175.019 . . 1 . . . . . 83 TRP C . 51974 1 894 . 1 . 1 83 83 TRP CA C 13 57.085 . . 1 . . . . . 83 TRP CA . 51974 1 895 . 1 . 1 83 83 TRP N N 15 121.801 . . 1 . . . . . 83 TRP N . 51974 1 896 . 1 . 1 84 84 LYS H H 1 7.591 . . 1 . . . . . 84 LYS H . 51974 1 897 . 1 . 1 84 84 LYS CA C 13 57.720 . . 1 . . . . . 84 LYS CA . 51974 1 898 . 1 . 1 84 84 LYS CB C 13 33.787 . . 1 . . . . . 84 LYS CB . 51974 1 899 . 1 . 1 84 84 LYS N N 15 127.793 . . 1 . . . . . 84 LYS N . 51974 1 stop_ save_