data_36136 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36136 _Entry.Title ; Designed protein dRafX6 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-12-05 _Entry.Accession_date 2017-02-15 _Entry.Last_release_date 2018-02-15 _Entry.Original_release_date 2018-02-15 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1.1.99 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 36136 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 R. Liu R. . . . 36136 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DE NOVO PROTEIN' . 36136 'Designed protein' . 36136 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36136 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 261 36136 '15N chemical shifts' 69 36136 '1H chemical shifts' 550 36136 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 . . 2018-12-03 . original BMRB . 36136 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5YXI . 36136 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36136 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Designed protein dRafX6 ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 R. Liu R. . . . 36136 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36136 _Assembly.ID 1 _Assembly.Name dRafX6 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 36136 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36136 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name dRafX6 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MADRTIEVELPNKQRTVINV RPGLTLKEALKKALKVRGID PNKVQVYLLLSGDDGAEQPL SLNHPAERLIGKKLKVVPL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 79 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8763.368 _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 1 MET . 36136 1 2 2 ALA . 36136 1 3 3 ASP . 36136 1 4 4 ARG . 36136 1 5 5 THR . 36136 1 6 6 ILE . 36136 1 7 7 GLU . 36136 1 8 8 VAL . 36136 1 9 9 GLU . 36136 1 10 10 LEU . 36136 1 11 11 PRO . 36136 1 12 12 ASN . 36136 1 13 13 LYS . 36136 1 14 14 GLN . 36136 1 15 15 ARG . 36136 1 16 16 THR . 36136 1 17 17 VAL . 36136 1 18 18 ILE . 36136 1 19 19 ASN . 36136 1 20 20 VAL . 36136 1 21 21 ARG . 36136 1 22 22 PRO . 36136 1 23 23 GLY . 36136 1 24 24 LEU . 36136 1 25 25 THR . 36136 1 26 26 LEU . 36136 1 27 27 LYS . 36136 1 28 28 GLU . 36136 1 29 29 ALA . 36136 1 30 30 LEU . 36136 1 31 31 LYS . 36136 1 32 32 LYS . 36136 1 33 33 ALA . 36136 1 34 34 LEU . 36136 1 35 35 LYS . 36136 1 36 36 VAL . 36136 1 37 37 ARG . 36136 1 38 38 GLY . 36136 1 39 39 ILE . 36136 1 40 40 ASP . 36136 1 41 41 PRO . 36136 1 42 42 ASN . 36136 1 43 43 LYS . 36136 1 44 44 VAL . 36136 1 45 45 GLN . 36136 1 46 46 VAL . 36136 1 47 47 TYR . 36136 1 48 48 LEU . 36136 1 49 49 LEU . 36136 1 50 50 LEU . 36136 1 51 51 SER . 36136 1 52 52 GLY . 36136 1 53 53 ASP . 36136 1 54 54 ASP . 36136 1 55 55 GLY . 36136 1 56 56 ALA . 36136 1 57 57 GLU . 36136 1 58 58 GLN . 36136 1 59 59 PRO . 36136 1 60 60 LEU . 36136 1 61 61 SER . 36136 1 62 62 LEU . 36136 1 63 63 ASN . 36136 1 64 64 HIS . 36136 1 65 65 PRO . 36136 1 66 66 ALA . 36136 1 67 67 GLU . 36136 1 68 68 ARG . 36136 1 69 69 LEU . 36136 1 70 70 ILE . 36136 1 71 71 GLY . 36136 1 72 72 LYS . 36136 1 73 73 LYS . 36136 1 74 74 LEU . 36136 1 75 75 LYS . 36136 1 76 76 VAL . 36136 1 77 77 VAL . 36136 1 78 78 PRO . 36136 1 79 79 LEU . 36136 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 36136 1 . ALA 2 2 36136 1 . ASP 3 3 36136 1 . ARG 4 4 36136 1 . THR 5 5 36136 1 . ILE 6 6 36136 1 . GLU 7 7 36136 1 . VAL 8 8 36136 1 . GLU 9 9 36136 1 . LEU 10 10 36136 1 . PRO 11 11 36136 1 . ASN 12 12 36136 1 . LYS 13 13 36136 1 . GLN 14 14 36136 1 . ARG 15 15 36136 1 . THR 16 16 36136 1 . VAL 17 17 36136 1 . ILE 18 18 36136 1 . ASN 19 19 36136 1 . VAL 20 20 36136 1 . ARG 21 21 36136 1 . PRO 22 22 36136 1 . GLY 23 23 36136 1 . LEU 24 24 36136 1 . THR 25 25 36136 1 . LEU 26 26 36136 1 . LYS 27 27 36136 1 . GLU 28 28 36136 1 . ALA 29 29 36136 1 . LEU 30 30 36136 1 . LYS 31 31 36136 1 . LYS 32 32 36136 1 . ALA 33 33 36136 1 . LEU 34 34 36136 1 . LYS 35 35 36136 1 . VAL 36 36 36136 1 . ARG 37 37 36136 1 . GLY 38 38 36136 1 . ILE 39 39 36136 1 . ASP 40 40 36136 1 . PRO 41 41 36136 1 . ASN 42 42 36136 1 . LYS 43 43 36136 1 . VAL 44 44 36136 1 . GLN 45 45 36136 1 . VAL 46 46 36136 1 . TYR 47 47 36136 1 . LEU 48 48 36136 1 . LEU 49 49 36136 1 . LEU 50 50 36136 1 . SER 51 51 36136 1 . GLY 52 52 36136 1 . ASP 53 53 36136 1 . ASP 54 54 36136 1 . GLY 55 55 36136 1 . ALA 56 56 36136 1 . GLU 57 57 36136 1 . GLN 58 58 36136 1 . PRO 59 59 36136 1 . LEU 60 60 36136 1 . SER 61 61 36136 1 . LEU 62 62 36136 1 . ASN 63 63 36136 1 . HIS 64 64 36136 1 . PRO 65 65 36136 1 . ALA 66 66 36136 1 . GLU 67 67 36136 1 . ARG 68 68 36136 1 . LEU 69 69 36136 1 . ILE 70 70 36136 1 . GLY 71 71 36136 1 . LYS 72 72 36136 1 . LYS 73 73 36136 1 . LEU 74 74 36136 1 . LYS 75 75 36136 1 . VAL 76 76 36136 1 . VAL 77 77 36136 1 . PRO 78 78 36136 1 . LEU 79 79 36136 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 36136 _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 . 32630 . . 'synthetic construct' . . . . . . . . . . . . . . . . . . . . 36136 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 36136 _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' . . 562 Escherichia coli . . . . . . . . . . 36136 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36136 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.02 mM sodium phosphate, 0.01 mM EDTA, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 dRafX6 '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein 0.5 . . mM . . . . 36136 1 2 EDTA 'natural abundance' . . . . . . 0.01 . . mM . . . . 36136 1 3 'sodium phosphate' 'natural abundance' . . . . . buffer 0.02 . . mM . . . . 36136 1 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36136 1 5 D2O [U-2H] . . . . . solvent 10 . . % . . . . 36136 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 36136 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.05 . mM 36136 1 pH 6.5 . pH 36136 1 pressure 1 . atm 36136 1 temperature 298 . K 36136 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36136 _Software.ID 1 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert P.' . . 36136 1 'Guntert, Mumenthaler and Wuthrich' . . 36136 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 36136 1 'structure calculation' 36136 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36136 _Software.ID 2 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 36136 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 36136 2 'peak picking' 36136 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36136 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 36136 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker DMX . 600 . . . 36136 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 36136 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 2 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 4 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 7 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 8 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 9 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36136 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 36136 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 36136 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 36136 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 36136 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 36136 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36136 1 2 '3D 1H-15N TOCSY' 1 $sample_1 isotropic 36136 1 3 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36136 1 4 '3D C(CO)NH' 1 $sample_1 isotropic 36136 1 5 '3D HNCACB' 1 $sample_1 isotropic 36136 1 6 '3D H(CCO)NH' 1 $sample_1 isotropic 36136 1 7 '3D HN(CO)CA' 1 $sample_1 isotropic 36136 1 8 '3D HBHA(CO)NH' 1 $sample_1 isotropic 36136 1 9 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36136 1 10 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36136 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 ALA H H 1 7.572 . . . . . . . A 2 ALA H . 36136 1 2 . 1 1 2 2 ALA HA H 1 4.947 . . . . . . . A 2 ALA HA . 36136 1 3 . 1 1 3 3 ASP HA H 1 4.671 . . . . . . . A 3 ASP HA . 36136 1 4 . 1 1 3 3 ASP HB2 H 1 2.693 . . . . . . . A 3 ASP HB2 . 36136 1 5 . 1 1 3 3 ASP HB3 H 1 2.581 . . . . . . . A 3 ASP HB3 . 36136 1 6 . 1 1 3 3 ASP CA C 13 54.109 . . . . . . . A 3 ASP CA . 36136 1 7 . 1 1 3 3 ASP CB C 13 41.234 . . . . . . . A 3 ASP CB . 36136 1 8 . 1 1 4 4 ARG H H 1 8.816 . . . . . . . A 4 ARG H . 36136 1 9 . 1 1 4 4 ARG HA H 1 4.493 . . . . . . . A 4 ARG HA . 36136 1 10 . 1 1 4 4 ARG HB2 H 1 2.011 . . . . . . . A 4 ARG HB2 . 36136 1 11 . 1 1 4 4 ARG HB3 H 1 1.862 . . . . . . . A 4 ARG HB3 . 36136 1 12 . 1 1 4 4 ARG HG2 H 1 1.683 . . . . . . . A 4 ARG HG2 . 36136 1 13 . 1 1 4 4 ARG HG3 H 1 0 . . . . . . . A 4 ARG HG3 . 36136 1 14 . 1 1 4 4 ARG HD2 H 1 3.319 . . . . . . . A 4 ARG HD2 . 36136 1 15 . 1 1 4 4 ARG HD3 H 1 3.231 . . . . . . . A 4 ARG HD3 . 36136 1 16 . 1 1 4 4 ARG CA C 13 55.042 . . . . . . . A 4 ARG CA . 36136 1 17 . 1 1 4 4 ARG CB C 13 32.049 . . . . . . . A 4 ARG CB . 36136 1 18 . 1 1 4 4 ARG CG C 13 26.137 . . . . . . . A 4 ARG CG . 36136 1 19 . 1 1 4 4 ARG CD C 13 42.878 . . . . . . . A 4 ARG CD . 36136 1 20 . 1 1 4 4 ARG N N 15 122.671 . . . . . . . A 4 ARG N . 36136 1 21 . 1 1 5 5 THR H H 1 7.729 . . . . . . . A 5 THR H . 36136 1 22 . 1 1 5 5 THR HA H 1 5.625 . . . . . . . A 5 THR HA . 36136 1 23 . 1 1 5 5 THR HB H 1 4.053 . . . . . . . A 5 THR HB . 36136 1 24 . 1 1 5 5 THR HG21 H 1 1.025 . . . . . . . A 5 THR HG21 . 36136 1 25 . 1 1 5 5 THR HG22 H 1 1.025 . . . . . . . A 5 THR HG22 . 36136 1 26 . 1 1 5 5 THR HG23 H 1 1.025 . . . . . . . A 5 THR HG23 . 36136 1 27 . 1 1 5 5 THR CA C 13 59.214 . . . . . . . A 5 THR CA . 36136 1 28 . 1 1 5 5 THR CB C 13 72.521 . . . . . . . A 5 THR CB . 36136 1 29 . 1 1 5 5 THR CG2 C 13 21.438 . . . . . . . A 5 THR CG2 . 36136 1 30 . 1 1 5 5 THR N N 15 109.807 . . . . . . . A 5 THR N . 36136 1 31 . 1 1 6 6 ILE H H 1 8.418 . . . . . . . A 6 ILE H . 36136 1 32 . 1 1 6 6 ILE HA H 1 4.289 . . . . . . . A 6 ILE HA . 36136 1 33 . 1 1 6 6 ILE HB H 1 1.299 . . . . . . . A 6 ILE HB . 36136 1 34 . 1 1 6 6 ILE HG12 H 1 0.97 . . . . . . . A 6 ILE HG12 . 36136 1 35 . 1 1 6 6 ILE HG13 H 1 0.97 . . . . . . . A 6 ILE HG13 . 36136 1 36 . 1 1 6 6 ILE HG21 H 1 0.779 . . . . . . . A 6 ILE HG21 . 36136 1 37 . 1 1 6 6 ILE HG22 H 1 0.779 . . . . . . . A 6 ILE HG22 . 36136 1 38 . 1 1 6 6 ILE HG23 H 1 0.779 . . . . . . . A 6 ILE HG23 . 36136 1 39 . 1 1 6 6 ILE HD11 H 1 0.574 . . . . . . . A 6 ILE HD11 . 36136 1 40 . 1 1 6 6 ILE HD12 H 1 0.574 . . . . . . . A 6 ILE HD12 . 36136 1 41 . 1 1 6 6 ILE HD13 H 1 0.574 . . . . . . . A 6 ILE HD13 . 36136 1 42 . 1 1 6 6 ILE CA C 13 56.7 . . . . . . . A 6 ILE CA . 36136 1 43 . 1 1 6 6 ILE CB C 13 41.939 . . . . . . . A 6 ILE CB . 36136 1 44 . 1 1 6 6 ILE CG1 C 13 26.177 . . . . . . . A 6 ILE CG1 . 36136 1 45 . 1 1 6 6 ILE CG2 C 13 17.304 . . . . . . . A 6 ILE CG2 . 36136 1 46 . 1 1 6 6 ILE CD1 C 13 13.806 . . . . . . . A 6 ILE CD1 . 36136 1 47 . 1 1 6 6 ILE N N 15 117.6 . . . . . . . A 6 ILE N . 36136 1 48 . 1 1 7 7 GLU H H 1 7.896 . . . . . . . A 7 GLU H . 36136 1 49 . 1 1 7 7 GLU HA H 1 4.761 . . . . . . . A 7 GLU HA . 36136 1 50 . 1 1 7 7 GLU HB2 H 1 2.033 . . . . . . . A 7 GLU HB2 . 36136 1 51 . 1 1 7 7 GLU HB3 H 1 2.033 . . . . . . . A 7 GLU HB3 . 36136 1 52 . 1 1 7 7 GLU HG2 H 1 2.224 . . . . . . . A 7 GLU HG2 . 36136 1 53 . 1 1 7 7 GLU HG3 H 1 2.097 . . . . . . . A 7 GLU HG3 . 36136 1 54 . 1 1 7 7 GLU CA C 13 55.757 . . . . . . . A 7 GLU CA . 36136 1 55 . 1 1 7 7 GLU CB C 13 35.373 . . . . . . . A 7 GLU CB . 36136 1 56 . 1 1 7 7 GLU CG C 13 36.514 . . . . . . . A 7 GLU CG . 36136 1 57 . 1 1 7 7 GLU N N 15 126.528 . . . . . . . A 7 GLU N . 36136 1 58 . 1 1 8 8 VAL H H 1 8.867 . . . . . . . A 8 VAL H . 36136 1 59 . 1 1 8 8 VAL HA H 1 4.603 . . . . . . . A 8 VAL HA . 36136 1 60 . 1 1 8 8 VAL HB H 1 1.789 . . . . . . . A 8 VAL HB . 36136 1 61 . 1 1 8 8 VAL HG11 H 1 0.685 . . . . . . . A 8 VAL HG11 . 36136 1 62 . 1 1 8 8 VAL HG12 H 1 0.685 . . . . . . . A 8 VAL HG12 . 36136 1 63 . 1 1 8 8 VAL HG13 H 1 0.685 . . . . . . . A 8 VAL HG13 . 36136 1 64 . 1 1 8 8 VAL HG21 H 1 0.685 . . . . . . . A 8 VAL HG21 . 36136 1 65 . 1 1 8 8 VAL HG22 H 1 0.685 . . . . . . . A 8 VAL HG22 . 36136 1 66 . 1 1 8 8 VAL HG23 H 1 0.685 . . . . . . . A 8 VAL HG23 . 36136 1 67 . 1 1 8 8 VAL CA C 13 55.496 . . . . . . . A 8 VAL CA . 36136 1 68 . 1 1 8 8 VAL CB C 13 34.165 . . . . . . . A 8 VAL CB . 36136 1 69 . 1 1 8 8 VAL CG1 C 13 24.323 . . . . . . . A 8 VAL CG1 . 36136 1 70 . 1 1 8 8 VAL CG2 C 13 24.323 . . . . . . . A 8 VAL CG2 . 36136 1 71 . 1 1 8 8 VAL N N 15 123.837 . . . . . . . A 8 VAL N . 36136 1 72 . 1 1 9 9 GLU H H 1 9.185 . . . . . . . A 9 GLU H . 36136 1 73 . 1 1 9 9 GLU HA H 1 4.686 . . . . . . . A 9 GLU HA . 36136 1 74 . 1 1 9 9 GLU HB2 H 1 2.075 . . . . . . . A 9 GLU HB2 . 36136 1 75 . 1 1 9 9 GLU HB3 H 1 1.99 . . . . . . . A 9 GLU HB3 . 36136 1 76 . 1 1 9 9 GLU HG2 H 1 2.215 . . . . . . . A 9 GLU HG2 . 36136 1 77 . 1 1 9 9 GLU HG3 H 1 2.215 . . . . . . . A 9 GLU HG3 . 36136 1 78 . 1 1 9 9 GLU CA C 13 55.595 . . . . . . . A 9 GLU CA . 36136 1 79 . 1 1 9 9 GLU CB C 13 30.049 . . . . . . . A 9 GLU CB . 36136 1 80 . 1 1 9 9 GLU CG C 13 36.089 . . . . . . . A 9 GLU CG . 36136 1 81 . 1 1 9 9 GLU N N 15 127.653 . . . . . . . A 9 GLU N . 36136 1 82 . 1 1 10 10 LEU H H 1 8.62 . . . . . . . A 10 LEU H . 36136 1 83 . 1 1 10 10 LEU HA H 1 4.724 . . . . . . . A 10 LEU HA . 36136 1 84 . 1 1 10 10 LEU HB2 H 1 1.857 . . . . . . . A 10 LEU HB2 . 36136 1 85 . 1 1 10 10 LEU HB3 H 1 1.549 . . . . . . . A 10 LEU HB3 . 36136 1 86 . 1 1 10 10 LEU CA C 13 52.521 . . . . . . . A 10 LEU CA . 36136 1 87 . 1 1 10 10 LEU CB C 13 41.562 . . . . . . . A 10 LEU CB . 36136 1 88 . 1 1 10 10 LEU N N 15 126.701 . . . . . . . A 10 LEU N . 36136 1 89 . 1 1 12 12 ASN HA H 1 4.442 . . . . . . . A 12 ASN HA . 36136 1 90 . 1 1 12 12 ASN HB2 H 1 2.973 . . . . . . . A 12 ASN HB2 . 36136 1 91 . 1 1 12 12 ASN HB3 H 1 2.973 . . . . . . . A 12 ASN HB3 . 36136 1 92 . 1 1 12 12 ASN CA C 13 43.355 . . . . . . . A 12 ASN CA . 36136 1 93 . 1 1 12 12 ASN CB C 13 36.616 . . . . . . . A 12 ASN CB . 36136 1 94 . 1 1 13 13 LYS H H 1 8.628 . . . . . . . A 13 LYS H . 36136 1 95 . 1 1 13 13 LYS HA H 1 3.875 . . . . . . . A 13 LYS HA . 36136 1 96 . 1 1 13 13 LYS HB2 H 1 0 . . . . . . . A 13 LYS HB2 . 36136 1 97 . 1 1 13 13 LYS HB3 H 1 2.001 . . . . . . . A 13 LYS HB3 . 36136 1 98 . 1 1 13 13 LYS HG2 H 1 1.47 . . . . . . . A 13 LYS HG2 . 36136 1 99 . 1 1 13 13 LYS HG3 H 1 1.387 . . . . . . . A 13 LYS HG3 . 36136 1 100 . 1 1 13 13 LYS HD2 H 1 1.664 . . . . . . . A 13 LYS HD2 . 36136 1 101 . 1 1 13 13 LYS HD3 H 1 1.664 . . . . . . . A 13 LYS HD3 . 36136 1 102 . 1 1 13 13 LYS HE2 H 1 2.982 . . . . . . . A 13 LYS HE2 . 36136 1 103 . 1 1 13 13 LYS HE3 H 1 2.982 . . . . . . . A 13 LYS HE3 . 36136 1 104 . 1 1 13 13 LYS CA C 13 57.191 . . . . . . . A 13 LYS CA . 36136 1 105 . 1 1 13 13 LYS CB C 13 48.928 . . . . . . . A 13 LYS CB . 36136 1 106 . 1 1 13 13 LYS CG C 13 24.628 . . . . . . . A 13 LYS CG . 36136 1 107 . 1 1 13 13 LYS CD C 13 28.09 . . . . . . . A 13 LYS CD . 36136 1 108 . 1 1 13 13 LYS CE C 13 41.655 . . . . . . . A 13 LYS CE . 36136 1 109 . 1 1 13 13 LYS N N 15 111.709 . . . . . . . A 13 LYS N . 36136 1 110 . 1 1 14 14 GLN H H 1 7.087 . . . . . . . A 14 GLN H . 36136 1 111 . 1 1 14 14 GLN HA H 1 4.473 . . . . . . . A 14 GLN HA . 36136 1 112 . 1 1 14 14 GLN HB2 H 1 2.054 . . . . . . . A 14 GLN HB2 . 36136 1 113 . 1 1 14 14 GLN HB3 H 1 1.888 . . . . . . . A 14 GLN HB3 . 36136 1 114 . 1 1 14 14 GLN HG2 H 1 2.42 . . . . . . . A 14 GLN HG2 . 36136 1 115 . 1 1 14 14 GLN HG3 H 1 2.35 . . . . . . . A 14 GLN HG3 . 36136 1 116 . 1 1 14 14 GLN CA C 13 54.88 . . . . . . . A 14 GLN CA . 36136 1 117 . 1 1 14 14 GLN CB C 13 29.801 . . . . . . . A 14 GLN CB . 36136 1 118 . 1 1 14 14 GLN CG C 13 33.958 . . . . . . . A 14 GLN CG . 36136 1 119 . 1 1 14 14 GLN N N 15 117.792 . . . . . . . A 14 GLN N . 36136 1 120 . 1 1 15 15 ARG H H 1 8.591 . . . . . . . A 15 ARG H . 36136 1 121 . 1 1 15 15 ARG HA H 1 5.346 . . . . . . . A 15 ARG HA . 36136 1 122 . 1 1 15 15 ARG HB2 H 1 1.769 . . . . . . . A 15 ARG HB2 . 36136 1 123 . 1 1 15 15 ARG HB3 H 1 1.769 . . . . . . . A 15 ARG HB3 . 36136 1 124 . 1 1 15 15 ARG HG2 H 1 1.526 . . . . . . . A 15 ARG HG2 . 36136 1 125 . 1 1 15 15 ARG HG3 H 1 1.526 . . . . . . . A 15 ARG HG3 . 36136 1 126 . 1 1 15 15 ARG HD2 H 1 3.141 . . . . . . . A 15 ARG HD2 . 36136 1 127 . 1 1 15 15 ARG HD3 H 1 3.141 . . . . . . . A 15 ARG HD3 . 36136 1 128 . 1 1 15 15 ARG CA C 13 54.684 . . . . . . . A 15 ARG CA . 36136 1 129 . 1 1 15 15 ARG CB C 13 32.521 . . . . . . . A 15 ARG CB . 36136 1 130 . 1 1 15 15 ARG CG C 13 26.431 . . . . . . . A 15 ARG CG . 36136 1 131 . 1 1 15 15 ARG CD C 13 42.898 . . . . . . . A 15 ARG CD . 36136 1 132 . 1 1 15 15 ARG N N 15 120.328 . . . . . . . A 15 ARG N . 36136 1 133 . 1 1 16 16 THR H H 1 8.959 . . . . . . . A 16 THR H . 36136 1 134 . 1 1 16 16 THR HA H 1 4.709 . . . . . . . A 16 THR HA . 36136 1 135 . 1 1 16 16 THR HB H 1 3.899 . . . . . . . A 16 THR HB . 36136 1 136 . 1 1 16 16 THR HG21 H 1 0.888 . . . . . . . A 16 THR HG21 . 36136 1 137 . 1 1 16 16 THR HG22 H 1 0.888 . . . . . . . A 16 THR HG22 . 36136 1 138 . 1 1 16 16 THR HG23 H 1 0.888 . . . . . . . A 16 THR HG23 . 36136 1 139 . 1 1 16 16 THR CA C 13 59.885 . . . . . . . A 16 THR CA . 36136 1 140 . 1 1 16 16 THR CB C 13 69.775 . . . . . . . A 16 THR CB . 36136 1 141 . 1 1 16 16 THR CG2 C 13 17.908 . . . . . . . A 16 THR CG2 . 36136 1 142 . 1 1 16 16 THR N N 15 116.704 . . . . . . . A 16 THR N . 36136 1 143 . 1 1 17 17 VAL H H 1 8.087 . . . . . . . A 17 VAL H . 36136 1 144 . 1 1 17 17 VAL HA H 1 4.938 . . . . . . . A 17 VAL HA . 36136 1 145 . 1 1 17 17 VAL HB H 1 1.912 . . . . . . . A 17 VAL HB . 36136 1 146 . 1 1 17 17 VAL HG11 H 1 0.905 . . . . . . . A 17 VAL HG11 . 36136 1 147 . 1 1 17 17 VAL HG12 H 1 0.905 . . . . . . . A 17 VAL HG12 . 36136 1 148 . 1 1 17 17 VAL HG13 H 1 0.905 . . . . . . . A 17 VAL HG13 . 36136 1 149 . 1 1 17 17 VAL HG21 H 1 0.905 . . . . . . . A 17 VAL HG21 . 36136 1 150 . 1 1 17 17 VAL HG22 H 1 0.905 . . . . . . . A 17 VAL HG22 . 36136 1 151 . 1 1 17 17 VAL HG23 H 1 0.905 . . . . . . . A 17 VAL HG23 . 36136 1 152 . 1 1 17 17 VAL CA C 13 56.351 . . . . . . . A 17 VAL CA . 36136 1 153 . 1 1 17 17 VAL CB C 13 33.893 . . . . . . . A 17 VAL CB . 36136 1 154 . 1 1 17 17 VAL CG1 C 13 20.658 . . . . . . . A 17 VAL CG1 . 36136 1 155 . 1 1 17 17 VAL CG2 C 13 20.658 . . . . . . . A 17 VAL CG2 . 36136 1 156 . 1 1 17 17 VAL N N 15 123.819 . . . . . . . A 17 VAL N . 36136 1 157 . 1 1 18 18 ILE H H 1 8.857 . . . . . . . A 18 ILE H . 36136 1 158 . 1 1 18 18 ILE HA H 1 4.6 . . . . . . . A 18 ILE HA . 36136 1 159 . 1 1 18 18 ILE HB H 1 1.797 . . . . . . . A 18 ILE HB . 36136 1 160 . 1 1 18 18 ILE HG12 H 1 1.327 . . . . . . . A 18 ILE HG12 . 36136 1 161 . 1 1 18 18 ILE HG13 H 1 1.066 . . . . . . . A 18 ILE HG13 . 36136 1 162 . 1 1 18 18 ILE HG21 H 1 0.834 . . . . . . . A 18 ILE HG21 . 36136 1 163 . 1 1 18 18 ILE HG22 H 1 0.834 . . . . . . . A 18 ILE HG22 . 36136 1 164 . 1 1 18 18 ILE HG23 H 1 0.834 . . . . . . . A 18 ILE HG23 . 36136 1 165 . 1 1 18 18 ILE HD11 H 1 0.634 . . . . . . . A 18 ILE HD11 . 36136 1 166 . 1 1 18 18 ILE HD12 H 1 0.634 . . . . . . . A 18 ILE HD12 . 36136 1 167 . 1 1 18 18 ILE HD13 H 1 0.634 . . . . . . . A 18 ILE HD13 . 36136 1 168 . 1 1 18 18 ILE CA C 13 53.579 . . . . . . . A 18 ILE CA . 36136 1 169 . 1 1 18 18 ILE CB C 13 40.324 . . . . . . . A 18 ILE CB . 36136 1 170 . 1 1 18 18 ILE CG1 C 13 26.203 . . . . . . . A 18 ILE CG1 . 36136 1 171 . 1 1 18 18 ILE CG2 C 13 17.472 . . . . . . . A 18 ILE CG2 . 36136 1 172 . 1 1 18 18 ILE CD1 C 13 12.687 . . . . . . . A 18 ILE CD1 . 36136 1 173 . 1 1 18 18 ILE N N 15 122.849 . . . . . . . A 18 ILE N . 36136 1 174 . 1 1 19 19 ASN H H 1 8.703 . . . . . . . A 19 ASN H . 36136 1 175 . 1 1 19 19 ASN HA H 1 4.964 . . . . . . . A 19 ASN HA . 36136 1 176 . 1 1 19 19 ASN HB2 H 1 2.689 . . . . . . . A 19 ASN HB2 . 36136 1 177 . 1 1 19 19 ASN HB3 H 1 2.689 . . . . . . . A 19 ASN HB3 . 36136 1 178 . 1 1 19 19 ASN CA C 13 50.08 . . . . . . . A 19 ASN CA . 36136 1 179 . 1 1 19 19 ASN CB C 13 39.53 . . . . . . . A 19 ASN CB . 36136 1 180 . 1 1 19 19 ASN N N 15 122.825 . . . . . . . A 19 ASN N . 36136 1 181 . 1 1 20 20 VAL H H 1 8.506 . . . . . . . A 20 VAL H . 36136 1 182 . 1 1 20 20 VAL HA H 1 4.007 . . . . . . . A 20 VAL HA . 36136 1 183 . 1 1 20 20 VAL HB H 1 1.769 . . . . . . . A 20 VAL HB . 36136 1 184 . 1 1 20 20 VAL HG11 H 1 0.696 . . . . . . . A 20 VAL HG11 . 36136 1 185 . 1 1 20 20 VAL HG12 H 1 0.696 . . . . . . . A 20 VAL HG12 . 36136 1 186 . 1 1 20 20 VAL HG13 H 1 0.696 . . . . . . . A 20 VAL HG13 . 36136 1 187 . 1 1 20 20 VAL HG21 H 1 0.696 . . . . . . . A 20 VAL HG21 . 36136 1 188 . 1 1 20 20 VAL HG22 H 1 0.696 . . . . . . . A 20 VAL HG22 . 36136 1 189 . 1 1 20 20 VAL HG23 H 1 0.696 . . . . . . . A 20 VAL HG23 . 36136 1 190 . 1 1 20 20 VAL CA C 13 61.892 . . . . . . . A 20 VAL CA . 36136 1 191 . 1 1 20 20 VAL CB C 13 33.15 . . . . . . . A 20 VAL CB . 36136 1 192 . 1 1 20 20 VAL CG1 C 13 61.878 . . . . . . . A 20 VAL CG1 . 36136 1 193 . 1 1 20 20 VAL CG2 C 13 61.878 . . . . . . . A 20 VAL CG2 . 36136 1 194 . 1 1 20 20 VAL N N 15 121.134 . . . . . . . A 20 VAL N . 36136 1 195 . 1 1 21 21 ARG H H 1 7.187 . . . . . . . A 21 ARG H . 36136 1 196 . 1 1 21 21 ARG HA H 1 4.784 . . . . . . . A 21 ARG HA . 36136 1 197 . 1 1 21 21 ARG HB2 H 1 1.942 . . . . . . . A 21 ARG HB2 . 36136 1 198 . 1 1 21 21 ARG HB3 H 1 1.671 . . . . . . . A 21 ARG HB3 . 36136 1 199 . 1 1 21 21 ARG CA C 13 57.375 . . . . . . . A 21 ARG CA . 36136 1 200 . 1 1 21 21 ARG CB C 13 29.798 . . . . . . . A 21 ARG CB . 36136 1 201 . 1 1 21 21 ARG N N 15 125.317 . . . . . . . A 21 ARG N . 36136 1 202 . 1 1 22 22 PRO HA H 1 4.253 . . . . . . . A 22 PRO HA . 36136 1 203 . 1 1 22 22 PRO HB2 H 1 2.328 . . . . . . . A 22 PRO HB2 . 36136 1 204 . 1 1 22 22 PRO HB3 H 1 1.858 . . . . . . . A 22 PRO HB3 . 36136 1 205 . 1 1 22 22 PRO HG2 H 1 2.11 . . . . . . . A 22 PRO HG2 . 36136 1 206 . 1 1 22 22 PRO HG3 H 1 1.929 . . . . . . . A 22 PRO HG3 . 36136 1 207 . 1 1 22 22 PRO HD2 H 1 3.833 . . . . . . . A 22 PRO HD2 . 36136 1 208 . 1 1 22 22 PRO HD3 H 1 3.606 . . . . . . . A 22 PRO HD3 . 36136 1 209 . 1 1 22 22 PRO CA C 13 63.608 . . . . . . . A 22 PRO CA . 36136 1 210 . 1 1 22 22 PRO CB C 13 31.766 . . . . . . . A 22 PRO CB . 36136 1 211 . 1 1 22 22 PRO CG C 13 27.646 . . . . . . . A 22 PRO CG . 36136 1 212 . 1 1 22 22 PRO CD C 13 50.509 . . . . . . . A 22 PRO CD . 36136 1 213 . 1 1 23 23 GLY H H 1 8.71 . . . . . . . A 23 GLY H . 36136 1 214 . 1 1 23 23 GLY HA2 H 1 4.181 . . . . . . . A 23 GLY HA2 . 36136 1 215 . 1 1 23 23 GLY HA3 H 1 3.705 . . . . . . . A 23 GLY HA3 . 36136 1 216 . 1 1 23 23 GLY CA C 13 45.34 . . . . . . . A 23 GLY CA . 36136 1 217 . 1 1 23 23 GLY N N 15 110.465 . . . . . . . A 23 GLY N . 36136 1 218 . 1 1 24 24 LEU H H 1 7.235 . . . . . . . A 24 LEU H . 36136 1 219 . 1 1 24 24 LEU HA H 1 4.696 . . . . . . . A 24 LEU HA . 36136 1 220 . 1 1 24 24 LEU HB2 H 1 1.742 . . . . . . . A 24 LEU HB2 . 36136 1 221 . 1 1 24 24 LEU HB3 H 1 1.611 . . . . . . . A 24 LEU HB3 . 36136 1 222 . 1 1 24 24 LEU CA C 13 54.347 . . . . . . . A 24 LEU CA . 36136 1 223 . 1 1 24 24 LEU CB C 13 43.698 . . . . . . . A 24 LEU CB . 36136 1 224 . 1 1 24 24 LEU CG C 13 25.69 . . . . . . . A 24 LEU CG . 36136 1 225 . 1 1 24 24 LEU CD1 C 13 23.116 . . . . . . . A 24 LEU CD1 . 36136 1 226 . 1 1 24 24 LEU CD2 C 13 22.7 . . . . . . . A 24 LEU CD2 . 36136 1 227 . 1 1 24 24 LEU N N 15 119.072 . . . . . . . A 24 LEU N . 36136 1 228 . 1 1 25 25 THR H H 1 8.187 . . . . . . . A 25 THR H . 36136 1 229 . 1 1 25 25 THR HA H 1 4.648 . . . . . . . A 25 THR HA . 36136 1 230 . 1 1 25 25 THR HB H 1 4.548 . . . . . . . A 25 THR HB . 36136 1 231 . 1 1 25 25 THR HG21 H 1 1.339 . . . . . . . A 25 THR HG21 . 36136 1 232 . 1 1 25 25 THR HG22 H 1 1.339 . . . . . . . A 25 THR HG22 . 36136 1 233 . 1 1 25 25 THR HG23 H 1 1.339 . . . . . . . A 25 THR HG23 . 36136 1 234 . 1 1 25 25 THR CA C 13 60.811 . . . . . . . A 25 THR CA . 36136 1 235 . 1 1 25 25 THR CB C 13 72.521 . . . . . . . A 25 THR CB . 36136 1 236 . 1 1 25 25 THR CG2 C 13 21.624 . . . . . . . A 25 THR CG2 . 36136 1 237 . 1 1 25 25 THR N N 15 113.963 . . . . . . . A 25 THR N . 36136 1 238 . 1 1 26 26 LEU H H 1 8.871 . . . . . . . A 26 LEU H . 36136 1 239 . 1 1 26 26 LEU HA H 1 3.909 . . . . . . . A 26 LEU HA . 36136 1 240 . 1 1 26 26 LEU HB2 H 1 1.852 . . . . . . . A 26 LEU HB2 . 36136 1 241 . 1 1 26 26 LEU HB3 H 1 1.533 . . . . . . . A 26 LEU HB3 . 36136 1 242 . 1 1 26 26 LEU HG H 1 1.401 . . . . . . . A 26 LEU HG . 36136 1 243 . 1 1 26 26 LEU HD11 H 1 0.747 . . . . . . . A 26 LEU HD11 . 36136 1 244 . 1 1 26 26 LEU HD12 H 1 0.747 . . . . . . . A 26 LEU HD12 . 36136 1 245 . 1 1 26 26 LEU HD13 H 1 0.747 . . . . . . . A 26 LEU HD13 . 36136 1 246 . 1 1 26 26 LEU HD21 H 1 0.747 . . . . . . . A 26 LEU HD21 . 36136 1 247 . 1 1 26 26 LEU HD22 H 1 0.747 . . . . . . . A 26 LEU HD22 . 36136 1 248 . 1 1 26 26 LEU HD23 H 1 0.747 . . . . . . . A 26 LEU HD23 . 36136 1 249 . 1 1 26 26 LEU CA C 13 58.444 . . . . . . . A 26 LEU CA . 36136 1 250 . 1 1 26 26 LEU CB C 13 41.296 . . . . . . . A 26 LEU CB . 36136 1 251 . 1 1 26 26 LEU CG C 13 25.03 . . . . . . . A 26 LEU CG . 36136 1 252 . 1 1 26 26 LEU CD1 C 13 23.138 . . . . . . . A 26 LEU CD1 . 36136 1 253 . 1 1 26 26 LEU CD2 C 13 22.263 . . . . . . . A 26 LEU CD2 . 36136 1 254 . 1 1 26 26 LEU N N 15 121.934 . . . . . . . A 26 LEU N . 36136 1 255 . 1 1 27 27 LYS H H 1 8.644 . . . . . . . A 27 LYS H . 36136 1 256 . 1 1 27 27 LYS HA H 1 3.616 . . . . . . . A 27 LYS HA . 36136 1 257 . 1 1 27 27 LYS HB2 H 1 1.958 . . . . . . . A 27 LYS HB2 . 36136 1 258 . 1 1 27 27 LYS HB3 H 1 1.787 . . . . . . . A 27 LYS HB3 . 36136 1 259 . 1 1 27 27 LYS HG2 H 1 1.375 . . . . . . . A 27 LYS HG2 . 36136 1 260 . 1 1 27 27 LYS HG3 H 1 1.243 . . . . . . . A 27 LYS HG3 . 36136 1 261 . 1 1 27 27 LYS HD2 H 1 1.633 . . . . . . . A 27 LYS HD2 . 36136 1 262 . 1 1 27 27 LYS HD3 H 1 1.633 . . . . . . . A 27 LYS HD3 . 36136 1 263 . 1 1 27 27 LYS HE2 H 1 2.849 . . . . . . . A 27 LYS HE2 . 36136 1 264 . 1 1 27 27 LYS HE3 H 1 2.849 . . . . . . . A 27 LYS HE3 . 36136 1 265 . 1 1 27 27 LYS CA C 13 60.434 . . . . . . . A 27 LYS CA . 36136 1 266 . 1 1 27 27 LYS CB C 13 32.169 . . . . . . . A 27 LYS CB . 36136 1 267 . 1 1 27 27 LYS CG C 13 24.781 . . . . . . . A 27 LYS CG . 36136 1 268 . 1 1 27 27 LYS CD C 13 29.164 . . . . . . . A 27 LYS CD . 36136 1 269 . 1 1 27 27 LYS CE C 13 41.52 . . . . . . . A 27 LYS CE . 36136 1 270 . 1 1 27 27 LYS N N 15 116.897 . . . . . . . A 27 LYS N . 36136 1 271 . 1 1 28 28 GLU H H 1 7.494 . . . . . . . A 28 GLU H . 36136 1 272 . 1 1 28 28 GLU HA H 1 3.939 . . . . . . . A 28 GLU HA . 36136 1 273 . 1 1 28 28 GLU HB2 H 1 2.238 . . . . . . . A 28 GLU HB2 . 36136 1 274 . 1 1 28 28 GLU HB3 H 1 2.071 . . . . . . . A 28 GLU HB3 . 36136 1 275 . 1 1 28 28 GLU HG2 H 1 0 . . . . . . . A 28 GLU HG2 . 36136 1 276 . 1 1 28 28 GLU HG3 H 1 2.287 . . . . . . . A 28 GLU HG3 . 36136 1 277 . 1 1 28 28 GLU CA C 13 50.549 . . . . . . . A 28 GLU CA . 36136 1 278 . 1 1 28 28 GLU CB C 13 30.05 . . . . . . . A 28 GLU CB . 36136 1 279 . 1 1 28 28 GLU CG C 13 36.385 . . . . . . . A 28 GLU CG . 36136 1 280 . 1 1 28 28 GLU N N 15 115.989 . . . . . . . A 28 GLU N . 36136 1 281 . 1 1 29 29 ALA H H 1 8.636 . . . . . . . A 29 ALA H . 36136 1 282 . 1 1 29 29 ALA HA H 1 4.216 . . . . . . . A 29 ALA HA . 36136 1 283 . 1 1 29 29 ALA HB1 H 1 1.359 . . . . . . . A 29 ALA HB1 . 36136 1 284 . 1 1 29 29 ALA HB2 H 1 1.359 . . . . . . . A 29 ALA HB2 . 36136 1 285 . 1 1 29 29 ALA HB3 H 1 1.359 . . . . . . . A 29 ALA HB3 . 36136 1 286 . 1 1 29 29 ALA CA C 13 53.768 . . . . . . . A 29 ALA CA . 36136 1 287 . 1 1 29 29 ALA CB C 13 17.512 . . . . . . . A 29 ALA CB . 36136 1 288 . 1 1 29 29 ALA N N 15 120.878 . . . . . . . A 29 ALA N . 36136 1 289 . 1 1 30 30 LEU H H 1 7.977 . . . . . . . A 30 LEU H . 36136 1 290 . 1 1 30 30 LEU HA H 1 4.141 . . . . . . . A 30 LEU HA . 36136 1 291 . 1 1 30 30 LEU HB2 H 1 1.737 . . . . . . . A 30 LEU HB2 . 36136 1 292 . 1 1 30 30 LEU HB3 H 1 1.397 . . . . . . . A 30 LEU HB3 . 36136 1 293 . 1 1 30 30 LEU HD11 H 1 0.66 . . . . . . . A 30 LEU HD11 . 36136 1 294 . 1 1 30 30 LEU HD12 H 1 0.66 . . . . . . . A 30 LEU HD12 . 36136 1 295 . 1 1 30 30 LEU HD13 H 1 0.66 . . . . . . . A 30 LEU HD13 . 36136 1 296 . 1 1 30 30 LEU HD21 H 1 0.66 . . . . . . . A 30 LEU HD21 . 36136 1 297 . 1 1 30 30 LEU HD22 H 1 0.66 . . . . . . . A 30 LEU HD22 . 36136 1 298 . 1 1 30 30 LEU HD23 H 1 0.66 . . . . . . . A 30 LEU HD23 . 36136 1 299 . 1 1 30 30 LEU CA C 13 55.278 . . . . . . . A 30 LEU CA . 36136 1 300 . 1 1 30 30 LEU CB C 13 41.064 . . . . . . . A 30 LEU CB . 36136 1 301 . 1 1 30 30 LEU CG C 13 25.701 . . . . . . . A 30 LEU CG . 36136 1 302 . 1 1 30 30 LEU CD1 C 13 23.208 . . . . . . . A 30 LEU CD1 . 36136 1 303 . 1 1 30 30 LEU CD2 C 13 22.661 . . . . . . . A 30 LEU CD2 . 36136 1 304 . 1 1 30 30 LEU N N 15 115.076 . . . . . . . A 30 LEU N . 36136 1 305 . 1 1 31 31 LYS H H 1 7.4 . . . . . . . A 31 LYS H . 36136 1 306 . 1 1 31 31 LYS HA H 1 3.686 . . . . . . . A 31 LYS HA . 36136 1 307 . 1 1 31 31 LYS HB2 H 1 2.038 . . . . . . . A 31 LYS HB2 . 36136 1 308 . 1 1 31 31 LYS HB3 H 1 1.895 . . . . . . . A 31 LYS HB3 . 36136 1 309 . 1 1 31 31 LYS HG2 H 1 1.472 . . . . . . . A 31 LYS HG2 . 36136 1 310 . 1 1 31 31 LYS HG3 H 1 1.408 . . . . . . . A 31 LYS HG3 . 36136 1 311 . 1 1 31 31 LYS HD2 H 1 1.718 . . . . . . . A 31 LYS HD2 . 36136 1 312 . 1 1 31 31 LYS HD3 H 1 1.718 . . . . . . . A 31 LYS HD3 . 36136 1 313 . 1 1 31 31 LYS HE2 H 1 2.933 . . . . . . . A 31 LYS HE2 . 36136 1 314 . 1 1 31 31 LYS HE3 H 1 2.933 . . . . . . . A 31 LYS HE3 . 36136 1 315 . 1 1 31 31 LYS CA C 13 61.763 . . . . . . . A 31 LYS CA . 36136 1 316 . 1 1 31 31 LYS CB C 13 32.538 . . . . . . . A 31 LYS CB . 36136 1 317 . 1 1 31 31 LYS CG C 13 24.24 . . . . . . . A 31 LYS CG . 36136 1 318 . 1 1 31 31 LYS CD C 13 29.334 . . . . . . . A 31 LYS CD . 36136 1 319 . 1 1 31 31 LYS CE C 13 41.558 . . . . . . . A 31 LYS CE . 36136 1 320 . 1 1 31 31 LYS N N 15 117.911 . . . . . . . A 31 LYS N . 36136 1 321 . 1 1 32 32 LYS H H 1 8.442 . . . . . . . A 32 LYS H . 36136 1 322 . 1 1 32 32 LYS HA H 1 4.014 . . . . . . . A 32 LYS HA . 36136 1 323 . 1 1 32 32 LYS HB2 H 1 1.872 . . . . . . . A 32 LYS HB2 . 36136 1 324 . 1 1 32 32 LYS HB3 H 1 1.872 . . . . . . . A 32 LYS HB3 . 36136 1 325 . 1 1 32 32 LYS HG2 H 1 1.59 . . . . . . . A 32 LYS HG2 . 36136 1 326 . 1 1 32 32 LYS HG3 H 1 0 . . . . . . . A 32 LYS HG3 . 36136 1 327 . 1 1 32 32 LYS HD2 H 1 1.725 . . . . . . . A 32 LYS HD2 . 36136 1 328 . 1 1 32 32 LYS HD3 H 1 1.725 . . . . . . . A 32 LYS HD3 . 36136 1 329 . 1 1 32 32 LYS HE2 H 1 3.002 . . . . . . . A 32 LYS HE2 . 36136 1 330 . 1 1 32 32 LYS HE3 H 1 3.002 . . . . . . . A 32 LYS HE3 . 36136 1 331 . 1 1 32 32 LYS CA C 13 59.978 . . . . . . . A 32 LYS CA . 36136 1 332 . 1 1 32 32 LYS CB C 13 31.431 . . . . . . . A 32 LYS CB . 36136 1 333 . 1 1 32 32 LYS CG C 13 24.895 . . . . . . . A 32 LYS CG . 36136 1 334 . 1 1 32 32 LYS CD C 13 29.328 . . . . . . . A 32 LYS CD . 36136 1 335 . 1 1 32 32 LYS CE C 13 61.901 . . . . . . . A 32 LYS CE . 36136 1 336 . 1 1 32 32 LYS N N 15 118.628 . . . . . . . A 32 LYS N . 36136 1 337 . 1 1 33 33 ALA H H 1 8.348 . . . . . . . A 33 ALA H . 36136 1 338 . 1 1 33 33 ALA HA H 1 4.02 . . . . . . . A 33 ALA HA . 36136 1 339 . 1 1 33 33 ALA HB1 H 1 1.351 . . . . . . . A 33 ALA HB1 . 36136 1 340 . 1 1 33 33 ALA HB2 H 1 1.351 . . . . . . . A 33 ALA HB2 . 36136 1 341 . 1 1 33 33 ALA HB3 H 1 1.351 . . . . . . . A 33 ALA HB3 . 36136 1 342 . 1 1 33 33 ALA CA C 13 53.979 . . . . . . . A 33 ALA CA . 36136 1 343 . 1 1 33 33 ALA CB C 13 17.769 . . . . . . . A 33 ALA CB . 36136 1 344 . 1 1 33 33 ALA N N 15 120.532 . . . . . . . A 33 ALA N . 36136 1 345 . 1 1 34 34 LEU H H 1 7.94 . . . . . . . A 34 LEU H . 36136 1 346 . 1 1 34 34 LEU HA H 1 4.067 . . . . . . . A 34 LEU HA . 36136 1 347 . 1 1 34 34 LEU HB2 H 1 1.742 . . . . . . . A 34 LEU HB2 . 36136 1 348 . 1 1 34 34 LEU HB3 H 1 1.507 . . . . . . . A 34 LEU HB3 . 36136 1 349 . 1 1 34 34 LEU HG H 1 1.936 . . . . . . . A 34 LEU HG . 36136 1 350 . 1 1 34 34 LEU HD11 H 1 0.749 . . . . . . . A 34 LEU HD11 . 36136 1 351 . 1 1 34 34 LEU HD12 H 1 0.749 . . . . . . . A 34 LEU HD12 . 36136 1 352 . 1 1 34 34 LEU HD13 H 1 0.749 . . . . . . . A 34 LEU HD13 . 36136 1 353 . 1 1 34 34 LEU HD21 H 1 0.664 . . . . . . . A 34 LEU HD21 . 36136 1 354 . 1 1 34 34 LEU HD22 H 1 0.664 . . . . . . . A 34 LEU HD22 . 36136 1 355 . 1 1 34 34 LEU HD23 H 1 0.664 . . . . . . . A 34 LEU HD23 . 36136 1 356 . 1 1 34 34 LEU CA C 13 57.046 . . . . . . . A 34 LEU CA . 36136 1 357 . 1 1 34 34 LEU CB C 13 39.04 . . . . . . . A 34 LEU CB . 36136 1 358 . 1 1 34 34 LEU CG C 13 25.448 . . . . . . . A 34 LEU CG . 36136 1 359 . 1 1 34 34 LEU CD1 C 13 22.462 . . . . . . . A 34 LEU CD1 . 36136 1 360 . 1 1 34 34 LEU CD2 C 13 21.55 . . . . . . . A 34 LEU CD2 . 36136 1 361 . 1 1 34 34 LEU N N 15 114.328 . . . . . . . A 34 LEU N . 36136 1 362 . 1 1 35 35 LYS H H 1 8.516 . . . . . . . A 35 LYS H . 36136 1 363 . 1 1 35 35 LYS HA H 1 4.149 . . . . . . . A 35 LYS HA . 36136 1 364 . 1 1 35 35 LYS HB2 H 1 1.952 . . . . . . . A 35 LYS HB2 . 36136 1 365 . 1 1 35 35 LYS HB3 H 1 1.952 . . . . . . . A 35 LYS HB3 . 36136 1 366 . 1 1 35 35 LYS HG2 H 1 1.631 . . . . . . . A 35 LYS HG2 . 36136 1 367 . 1 1 35 35 LYS HG3 H 1 1.47 . . . . . . . A 35 LYS HG3 . 36136 1 368 . 1 1 35 35 LYS HD2 H 1 1.73 . . . . . . . A 35 LYS HD2 . 36136 1 369 . 1 1 35 35 LYS HD3 H 1 0 . . . . . . . A 35 LYS HD3 . 36136 1 370 . 1 1 35 35 LYS HE2 H 1 2.968 . . . . . . . A 35 LYS HE2 . 36136 1 371 . 1 1 35 35 LYS HE3 H 1 2.968 . . . . . . . A 35 LYS HE3 . 36136 1 372 . 1 1 35 35 LYS CA C 13 59.784 . . . . . . . A 35 LYS CA . 36136 1 373 . 1 1 35 35 LYS CB C 13 31.55 . . . . . . . A 35 LYS CB . 36136 1 374 . 1 1 35 35 LYS CG C 13 25.071 . . . . . . . A 35 LYS CG . 36136 1 375 . 1 1 35 35 LYS CD C 13 29.003 . . . . . . . A 35 LYS CD . 36136 1 376 . 1 1 35 35 LYS CE C 13 41.465 . . . . . . . A 35 LYS CE . 36136 1 377 . 1 1 35 35 LYS N N 15 121.343 . . . . . . . A 35 LYS N . 36136 1 378 . 1 1 36 36 VAL H H 1 8.226 . . . . . . . A 36 VAL H . 36136 1 379 . 1 1 36 36 VAL HA H 1 4.067 . . . . . . . A 36 VAL HA . 36136 1 380 . 1 1 36 36 VAL HB H 1 2.273 . . . . . . . A 36 VAL HB . 36136 1 381 . 1 1 36 36 VAL HG11 H 1 1.072 . . . . . . . A 36 VAL HG11 . 36136 1 382 . 1 1 36 36 VAL HG12 H 1 1.072 . . . . . . . A 36 VAL HG12 . 36136 1 383 . 1 1 36 36 VAL HG13 H 1 1.072 . . . . . . . A 36 VAL HG13 . 36136 1 384 . 1 1 36 36 VAL HG21 H 1 1.072 . . . . . . . A 36 VAL HG21 . 36136 1 385 . 1 1 36 36 VAL HG22 H 1 1.072 . . . . . . . A 36 VAL HG22 . 36136 1 386 . 1 1 36 36 VAL HG23 H 1 1.072 . . . . . . . A 36 VAL HG23 . 36136 1 387 . 1 1 36 36 VAL CA C 13 57.691 . . . . . . . A 36 VAL CA . 36136 1 388 . 1 1 36 36 VAL CB C 13 31.292 . . . . . . . A 36 VAL CB . 36136 1 389 . 1 1 36 36 VAL CG1 C 13 20.566 . . . . . . . A 36 VAL CG1 . 36136 1 390 . 1 1 36 36 VAL CG2 C 13 20.566 . . . . . . . A 36 VAL CG2 . 36136 1 391 . 1 1 36 36 VAL N N 15 116.329 . . . . . . . A 36 VAL N . 36136 1 392 . 1 1 37 37 ARG H H 1 7.029 . . . . . . . A 37 ARG H . 36136 1 393 . 1 1 37 37 ARG HA H 1 4.416 . . . . . . . A 37 ARG HA . 36136 1 394 . 1 1 37 37 ARG HB2 H 1 2.18 . . . . . . . A 37 ARG HB2 . 36136 1 395 . 1 1 37 37 ARG HB3 H 1 1.574 . . . . . . . A 37 ARG HB3 . 36136 1 396 . 1 1 37 37 ARG HG2 H 1 1.785 . . . . . . . A 37 ARG HG2 . 36136 1 397 . 1 1 37 37 ARG HG3 H 1 1.66 . . . . . . . A 37 ARG HG3 . 36136 1 398 . 1 1 37 37 ARG HD2 H 1 0 . . . . . . . A 37 ARG HD2 . 36136 1 399 . 1 1 37 37 ARG HD3 H 1 3.042 . . . . . . . A 37 ARG HD3 . 36136 1 400 . 1 1 37 37 ARG CA C 13 55.111 . . . . . . . A 37 ARG CA . 36136 1 401 . 1 1 37 37 ARG CB C 13 30.255 . . . . . . . A 37 ARG CB . 36136 1 402 . 1 1 37 37 ARG CG C 13 27.918 . . . . . . . A 37 ARG CG . 36136 1 403 . 1 1 37 37 ARG CD C 13 42.852 . . . . . . . A 37 ARG CD . 36136 1 404 . 1 1 37 37 ARG N N 15 118.486 . . . . . . . A 37 ARG N . 36136 1 405 . 1 1 38 38 GLY H H 1 7.964 . . . . . . . A 38 GLY H . 36136 1 406 . 1 1 38 38 GLY HA2 H 1 3.995 . . . . . . . A 38 GLY HA2 . 36136 1 407 . 1 1 38 38 GLY HA3 H 1 3.82 . . . . . . . A 38 GLY HA3 . 36136 1 408 . 1 1 38 38 GLY CA C 13 45.887 . . . . . . . A 38 GLY CA . 36136 1 409 . 1 1 38 38 GLY N N 15 108.65 . . . . . . . A 38 GLY N . 36136 1 410 . 1 1 39 39 ILE H H 1 7.882 . . . . . . . A 39 ILE H . 36136 1 411 . 1 1 39 39 ILE HA H 1 4.01 . . . . . . . A 39 ILE HA . 36136 1 412 . 1 1 39 39 ILE HB H 1 1.46 . . . . . . . A 39 ILE HB . 36136 1 413 . 1 1 39 39 ILE HG21 H 1 0.813 . . . . . . . A 39 ILE HG21 . 36136 1 414 . 1 1 39 39 ILE HG22 H 1 0.813 . . . . . . . A 39 ILE HG22 . 36136 1 415 . 1 1 39 39 ILE HG23 H 1 0.813 . . . . . . . A 39 ILE HG23 . 36136 1 416 . 1 1 39 39 ILE HD11 H 1 0.604 . . . . . . . A 39 ILE HD11 . 36136 1 417 . 1 1 39 39 ILE HD12 H 1 0.604 . . . . . . . A 39 ILE HD12 . 36136 1 418 . 1 1 39 39 ILE HD13 H 1 0.604 . . . . . . . A 39 ILE HD13 . 36136 1 419 . 1 1 39 39 ILE CA C 13 55.838 . . . . . . . A 39 ILE CA . 36136 1 420 . 1 1 39 39 ILE CB C 13 28.968 . . . . . . . A 39 ILE CB . 36136 1 421 . 1 1 39 39 ILE CG1 C 13 26.687 . . . . . . . A 39 ILE CG1 . 36136 1 422 . 1 1 39 39 ILE CG2 C 13 17.457 . . . . . . . A 39 ILE CG2 . 36136 1 423 . 1 1 39 39 ILE CD1 C 13 13.604 . . . . . . . A 39 ILE CD1 . 36136 1 424 . 1 1 39 39 ILE N N 15 121.871 . . . . . . . A 39 ILE N . 36136 1 425 . 1 1 40 40 ASP H H 1 8.59 . . . . . . . A 40 ASP H . 36136 1 426 . 1 1 40 40 ASP HA H 1 4.673 . . . . . . . A 40 ASP HA . 36136 1 427 . 1 1 40 40 ASP HB2 H 1 2.83 . . . . . . . A 40 ASP HB2 . 36136 1 428 . 1 1 40 40 ASP HB3 H 1 2.587 . . . . . . . A 40 ASP HB3 . 36136 1 429 . 1 1 40 40 ASP CA C 13 50.649 . . . . . . . A 40 ASP CA . 36136 1 430 . 1 1 40 40 ASP N N 15 128.278 . . . . . . . A 40 ASP N . 36136 1 431 . 1 1 41 41 PRO HA H 1 4.07 . . . . . . . A 41 PRO HA . 36136 1 432 . 1 1 41 41 PRO HB2 H 1 2.08 . . . . . . . A 41 PRO HB2 . 36136 1 433 . 1 1 41 41 PRO HB3 H 1 1.903 . . . . . . . A 41 PRO HB3 . 36136 1 434 . 1 1 41 41 PRO HG2 H 1 1.994 . . . . . . . A 41 PRO HG2 . 36136 1 435 . 1 1 41 41 PRO HD2 H 1 4.246 . . . . . . . A 41 PRO HD2 . 36136 1 436 . 1 1 41 41 PRO HD3 H 1 3.904 . . . . . . . A 41 PRO HD3 . 36136 1 437 . 1 1 41 41 PRO CA C 13 60.986 . . . . . . . A 41 PRO CA . 36136 1 438 . 1 1 41 41 PRO CB C 13 36.06 . . . . . . . A 41 PRO CB . 36136 1 439 . 1 1 41 41 PRO CG C 13 27.23 . . . . . . . A 41 PRO CG . 36136 1 440 . 1 1 41 41 PRO CD C 13 50.652 . . . . . . . A 41 PRO CD . 36136 1 441 . 1 1 42 42 ASN H H 1 8.496 . . . . . . . A 42 ASN H . 36136 1 442 . 1 1 42 42 ASN HA H 1 4.659 . . . . . . . A 42 ASN HA . 36136 1 443 . 1 1 42 42 ASN HB2 H 1 2.831 . . . . . . . A 42 ASN HB2 . 36136 1 444 . 1 1 42 42 ASN HB3 H 1 2.752 . . . . . . . A 42 ASN HB3 . 36136 1 445 . 1 1 42 42 ASN CA C 13 53.452 . . . . . . . A 42 ASN CA . 36136 1 446 . 1 1 42 42 ASN CB C 13 38.579 . . . . . . . A 42 ASN CB . 36136 1 447 . 1 1 42 42 ASN N N 15 111.914 . . . . . . . A 42 ASN N . 36136 1 448 . 1 1 43 43 LYS H H 1 8.098 . . . . . . . A 43 LYS H . 36136 1 449 . 1 1 43 43 LYS HA H 1 4.634 . . . . . . . A 43 LYS HA . 36136 1 450 . 1 1 43 43 LYS HB2 H 1 2.217 . . . . . . . A 43 LYS HB2 . 36136 1 451 . 1 1 43 43 LYS HB3 H 1 1.691 . . . . . . . A 43 LYS HB3 . 36136 1 452 . 1 1 43 43 LYS HG2 H 1 1.243 . . . . . . . A 43 LYS HG2 . 36136 1 453 . 1 1 43 43 LYS HD2 H 1 1.647 . . . . . . . A 43 LYS HD2 . 36136 1 454 . 1 1 43 43 LYS HD3 H 1 1.647 . . . . . . . A 43 LYS HD3 . 36136 1 455 . 1 1 43 43 LYS HE2 H 1 2.927 . . . . . . . A 43 LYS HE2 . 36136 1 456 . 1 1 43 43 LYS HE3 H 1 2.927 . . . . . . . A 43 LYS HE3 . 36136 1 457 . 1 1 43 43 LYS HZ1 H 1 7.544 . . . . . . . A 43 LYS HZ1 . 36136 1 458 . 1 1 43 43 LYS HZ2 H 1 7.544 . . . . . . . A 43 LYS HZ2 . 36136 1 459 . 1 1 43 43 LYS HZ3 H 1 7.544 . . . . . . . A 43 LYS HZ3 . 36136 1 460 . 1 1 43 43 LYS CA C 13 54.252 . . . . . . . A 43 LYS CA . 36136 1 461 . 1 1 43 43 LYS CB C 13 32.995 . . . . . . . A 43 LYS CB . 36136 1 462 . 1 1 43 43 LYS CG C 13 24.807 . . . . . . . A 43 LYS CG . 36136 1 463 . 1 1 43 43 LYS CD C 13 28.595 . . . . . . . A 43 LYS CD . 36136 1 464 . 1 1 43 43 LYS CE C 13 41.767 . . . . . . . A 43 LYS CE . 36136 1 465 . 1 1 43 43 LYS N N 15 120.135 . . . . . . . A 43 LYS N . 36136 1 466 . 1 1 44 44 VAL H H 1 7.307 . . . . . . . A 44 VAL H . 36136 1 467 . 1 1 44 44 VAL HA H 1 5.078 . . . . . . . A 44 VAL HA . 36136 1 468 . 1 1 44 44 VAL HB H 1 1.888 . . . . . . . A 44 VAL HB . 36136 1 469 . 1 1 44 44 VAL HG11 H 1 0.658 . . . . . . . A 44 VAL HG11 . 36136 1 470 . 1 1 44 44 VAL HG12 H 1 0.658 . . . . . . . A 44 VAL HG12 . 36136 1 471 . 1 1 44 44 VAL HG13 H 1 0.658 . . . . . . . A 44 VAL HG13 . 36136 1 472 . 1 1 44 44 VAL HG21 H 1 0.604 . . . . . . . A 44 VAL HG21 . 36136 1 473 . 1 1 44 44 VAL HG22 H 1 0.604 . . . . . . . A 44 VAL HG22 . 36136 1 474 . 1 1 44 44 VAL HG23 H 1 0.604 . . . . . . . A 44 VAL HG23 . 36136 1 475 . 1 1 44 44 VAL CA C 13 38.73 . . . . . . . A 44 VAL CA . 36136 1 476 . 1 1 44 44 VAL CB C 13 35.85 . . . . . . . A 44 VAL CB . 36136 1 477 . 1 1 44 44 VAL CG1 C 13 21.181 . . . . . . . A 44 VAL CG1 . 36136 1 478 . 1 1 44 44 VAL CG2 C 13 20.065 . . . . . . . A 44 VAL CG2 . 36136 1 479 . 1 1 44 44 VAL N N 15 111.191 . . . . . . . A 44 VAL N . 36136 1 480 . 1 1 45 45 GLN H H 1 8.858 . . . . . . . A 45 GLN H . 36136 1 481 . 1 1 45 45 GLN HA H 1 4.481 . . . . . . . A 45 GLN HA . 36136 1 482 . 1 1 45 45 GLN HB2 H 1 1.948 . . . . . . . A 45 GLN HB2 . 36136 1 483 . 1 1 45 45 GLN HB3 H 1 1.822 . . . . . . . A 45 GLN HB3 . 36136 1 484 . 1 1 45 45 GLN HG2 H 1 2.133 . . . . . . . A 45 GLN HG2 . 36136 1 485 . 1 1 45 45 GLN HG3 H 1 1.815 . . . . . . . A 45 GLN HG3 . 36136 1 486 . 1 1 45 45 GLN CA C 13 53.915 . . . . . . . A 45 GLN CA . 36136 1 487 . 1 1 45 45 GLN CB C 13 31.19 . . . . . . . A 45 GLN CB . 36136 1 488 . 1 1 45 45 GLN CG C 13 34.122 . . . . . . . A 45 GLN CG . 36136 1 489 . 1 1 45 45 GLN N N 15 119.788 . . . . . . . A 45 GLN N . 36136 1 490 . 1 1 46 46 VAL H H 1 9.04 . . . . . . . A 46 VAL H . 36136 1 491 . 1 1 46 46 VAL HA H 1 4.964 . . . . . . . A 46 VAL HA . 36136 1 492 . 1 1 46 46 VAL HB H 1 1.685 . . . . . . . A 46 VAL HB . 36136 1 493 . 1 1 46 46 VAL HG11 H 1 0.847 . . . . . . . A 46 VAL HG11 . 36136 1 494 . 1 1 46 46 VAL HG12 H 1 0.847 . . . . . . . A 46 VAL HG12 . 36136 1 495 . 1 1 46 46 VAL HG13 H 1 0.847 . . . . . . . A 46 VAL HG13 . 36136 1 496 . 1 1 46 46 VAL HG21 H 1 0.724 . . . . . . . A 46 VAL HG21 . 36136 1 497 . 1 1 46 46 VAL HG22 H 1 0.724 . . . . . . . A 46 VAL HG22 . 36136 1 498 . 1 1 46 46 VAL HG23 H 1 0.724 . . . . . . . A 46 VAL HG23 . 36136 1 499 . 1 1 46 46 VAL CA C 13 60.296 . . . . . . . A 46 VAL CA . 36136 1 500 . 1 1 46 46 VAL CB C 13 32.521 . . . . . . . A 46 VAL CB . 36136 1 501 . 1 1 46 46 VAL CG1 C 13 22.83 . . . . . . . A 46 VAL CG1 . 36136 1 502 . 1 1 46 46 VAL CG2 C 13 21.908 . . . . . . . A 46 VAL CG2 . 36136 1 503 . 1 1 46 46 VAL N N 15 123.13 . . . . . . . A 46 VAL N . 36136 1 504 . 1 1 47 47 TYR H H 1 9.166 . . . . . . . A 47 TYR H . 36136 1 505 . 1 1 47 47 TYR HA H 1 5.023 . . . . . . . A 47 TYR HA . 36136 1 506 . 1 1 47 47 TYR HB2 H 1 2.674 . . . . . . . A 47 TYR HB2 . 36136 1 507 . 1 1 47 47 TYR HB3 H 1 2.497 . . . . . . . A 47 TYR HB3 . 36136 1 508 . 1 1 47 47 TYR HD1 H 1 6.654 . . . . . . . A 47 TYR HD1 . 36136 1 509 . 1 1 47 47 TYR HD2 H 1 6.654 . . . . . . . A 47 TYR HD2 . 36136 1 510 . 1 1 47 47 TYR CA C 13 55.85 . . . . . . . A 47 TYR CA . 36136 1 511 . 1 1 47 47 TYR CB C 13 41.889 . . . . . . . A 47 TYR CB . 36136 1 512 . 1 1 47 47 TYR N N 15 123.368 . . . . . . . A 47 TYR N . 36136 1 513 . 1 1 48 48 LEU H H 1 9.361 . . . . . . . A 48 LEU H . 36136 1 514 . 1 1 48 48 LEU HA H 1 4.582 . . . . . . . A 48 LEU HA . 36136 1 515 . 1 1 48 48 LEU HB2 H 1 1.858 . . . . . . . A 48 LEU HB2 . 36136 1 516 . 1 1 48 48 LEU HB3 H 1 1.33 . . . . . . . A 48 LEU HB3 . 36136 1 517 . 1 1 48 48 LEU HG H 1 1.454 . . . . . . . A 48 LEU HG . 36136 1 518 . 1 1 48 48 LEU HD11 H 1 0.946 . . . . . . . A 48 LEU HD11 . 36136 1 519 . 1 1 48 48 LEU HD12 H 1 0.946 . . . . . . . A 48 LEU HD12 . 36136 1 520 . 1 1 48 48 LEU HD13 H 1 0.946 . . . . . . . A 48 LEU HD13 . 36136 1 521 . 1 1 48 48 LEU HD21 H 1 0 . . . . . . . A 48 LEU HD21 . 36136 1 522 . 1 1 48 48 LEU HD22 H 1 0 . . . . . . . A 48 LEU HD22 . 36136 1 523 . 1 1 48 48 LEU HD23 H 1 0 . . . . . . . A 48 LEU HD23 . 36136 1 524 . 1 1 48 48 LEU CA C 13 54.079 . . . . . . . A 48 LEU CA . 36136 1 525 . 1 1 48 48 LEU CB C 13 43.854 . . . . . . . A 48 LEU CB . 36136 1 526 . 1 1 48 48 LEU CG C 13 26.946 . . . . . . . A 48 LEU CG . 36136 1 527 . 1 1 48 48 LEU CD1 C 13 25.358 . . . . . . . A 48 LEU CD1 . 36136 1 528 . 1 1 48 48 LEU CD2 C 13 24.137 . . . . . . . A 48 LEU CD2 . 36136 1 529 . 1 1 48 48 LEU N N 15 123.779 . . . . . . . A 48 LEU N . 36136 1 530 . 1 1 49 49 LEU H H 1 8.55 . . . . . . . A 49 LEU H . 36136 1 531 . 1 1 49 49 LEU HA H 1 4.637 . . . . . . . A 49 LEU HA . 36136 1 532 . 1 1 49 49 LEU HB2 H 1 1.659 . . . . . . . A 49 LEU HB2 . 36136 1 533 . 1 1 49 49 LEU HB3 H 1 1.447 . . . . . . . A 49 LEU HB3 . 36136 1 534 . 1 1 49 49 LEU HG H 1 1.494 . . . . . . . A 49 LEU HG . 36136 1 535 . 1 1 49 49 LEU HD11 H 1 0.786 . . . . . . . A 49 LEU HD11 . 36136 1 536 . 1 1 49 49 LEU HD12 H 1 0.786 . . . . . . . A 49 LEU HD12 . 36136 1 537 . 1 1 49 49 LEU HD13 H 1 0.786 . . . . . . . A 49 LEU HD13 . 36136 1 538 . 1 1 49 49 LEU HD21 H 1 0.786 . . . . . . . A 49 LEU HD21 . 36136 1 539 . 1 1 49 49 LEU HD22 H 1 0.786 . . . . . . . A 49 LEU HD22 . 36136 1 540 . 1 1 49 49 LEU HD23 H 1 0.786 . . . . . . . A 49 LEU HD23 . 36136 1 541 . 1 1 49 49 LEU CA C 13 54.022 . . . . . . . A 49 LEU CA . 36136 1 542 . 1 1 49 49 LEU CB C 13 40.495 . . . . . . . A 49 LEU CB . 36136 1 543 . 1 1 49 49 LEU CG C 13 26.925 . . . . . . . A 49 LEU CG . 36136 1 544 . 1 1 49 49 LEU CD1 C 13 24.629 . . . . . . . A 49 LEU CD1 . 36136 1 545 . 1 1 49 49 LEU CD2 C 13 23.077 . . . . . . . A 49 LEU CD2 . 36136 1 546 . 1 1 49 49 LEU N N 15 127.374 . . . . . . . A 49 LEU N . 36136 1 547 . 1 1 50 50 LEU H H 1 8.307 . . . . . . . A 50 LEU H . 36136 1 548 . 1 1 50 50 LEU HA H 1 4.366 . . . . . . . A 50 LEU HA . 36136 1 549 . 1 1 50 50 LEU HB2 H 1 1.699 . . . . . . . A 50 LEU HB2 . 36136 1 550 . 1 1 50 50 LEU HB3 H 1 1.608 . . . . . . . A 50 LEU HB3 . 36136 1 551 . 1 1 50 50 LEU HD11 H 1 0.891 . . . . . . . A 50 LEU HD11 . 36136 1 552 . 1 1 50 50 LEU HD12 H 1 0.891 . . . . . . . A 50 LEU HD12 . 36136 1 553 . 1 1 50 50 LEU HD13 H 1 0.891 . . . . . . . A 50 LEU HD13 . 36136 1 554 . 1 1 50 50 LEU CA C 13 48.149 . . . . . . . A 50 LEU CA . 36136 1 555 . 1 1 50 50 LEU CB C 13 41.973 . . . . . . . A 50 LEU CB . 36136 1 556 . 1 1 50 50 LEU CG C 13 26.683 . . . . . . . A 50 LEU CG . 36136 1 557 . 1 1 50 50 LEU CD1 C 13 24.628 . . . . . . . A 50 LEU CD1 . 36136 1 558 . 1 1 50 50 LEU CD2 C 13 22.944 . . . . . . . A 50 LEU CD2 . 36136 1 559 . 1 1 50 50 LEU N N 15 124.614 . . . . . . . A 50 LEU N . 36136 1 560 . 1 1 51 51 SER H H 1 8.474 . . . . . . . A 51 SER H . 36136 1 561 . 1 1 51 51 SER HA H 1 4.45 . . . . . . . A 51 SER HA . 36136 1 562 . 1 1 51 51 SER HB2 H 1 3.89 . . . . . . . A 51 SER HB2 . 36136 1 563 . 1 1 51 51 SER HB3 H 1 3.89 . . . . . . . A 51 SER HB3 . 36136 1 564 . 1 1 51 51 SER HG H 1 4.8 . . . . . . . A 51 SER HG . 36136 1 565 . 1 1 51 51 SER CA C 13 58.043 . . . . . . . A 51 SER CA . 36136 1 566 . 1 1 51 51 SER CB C 13 63.448 . . . . . . . A 51 SER CB . 36136 1 567 . 1 1 51 51 SER N N 15 115.154 . . . . . . . A 51 SER N . 36136 1 568 . 1 1 52 52 GLY H H 1 8.4 . . . . . . . A 52 GLY H . 36136 1 569 . 1 1 52 52 GLY HA2 H 1 4.1 . . . . . . . A 52 GLY HA2 . 36136 1 570 . 1 1 52 52 GLY HA3 H 1 3.908 . . . . . . . A 52 GLY HA3 . 36136 1 571 . 1 1 52 52 GLY CA C 13 44.835 . . . . . . . A 52 GLY CA . 36136 1 572 . 1 1 52 52 GLY N N 15 109.973 . . . . . . . A 52 GLY N . 36136 1 573 . 1 1 53 53 ASP H H 1 8.332 . . . . . . . A 53 ASP H . 36136 1 574 . 1 1 53 53 ASP HA H 1 4.558 . . . . . . . A 53 ASP HA . 36136 1 575 . 1 1 53 53 ASP HB2 H 1 2.695 . . . . . . . A 53 ASP HB2 . 36136 1 576 . 1 1 53 53 ASP HB3 H 1 2.511 . . . . . . . A 53 ASP HB3 . 36136 1 577 . 1 1 53 53 ASP CA C 13 54.702 . . . . . . . A 53 ASP CA . 36136 1 578 . 1 1 53 53 ASP CB C 13 37.537 . . . . . . . A 53 ASP CB . 36136 1 579 . 1 1 53 53 ASP N N 15 120.3 . . . . . . . A 53 ASP N . 36136 1 580 . 1 1 54 54 ASP H H 1 8.375 . . . . . . . A 54 ASP H . 36136 1 581 . 1 1 54 54 ASP HA H 1 4.541 . . . . . . . A 54 ASP HA . 36136 1 582 . 1 1 54 54 ASP HB2 H 1 2.66 . . . . . . . A 54 ASP HB2 . 36136 1 583 . 1 1 54 54 ASP HB3 H 1 2.66 . . . . . . . A 54 ASP HB3 . 36136 1 584 . 1 1 54 54 ASP CA C 13 54.275 . . . . . . . A 54 ASP CA . 36136 1 585 . 1 1 54 54 ASP CB C 13 40.601 . . . . . . . A 54 ASP CB . 36136 1 586 . 1 1 54 54 ASP N N 15 119.08 . . . . . . . A 54 ASP N . 36136 1 587 . 1 1 55 55 GLY H H 1 8.17 . . . . . . . A 55 GLY H . 36136 1 588 . 1 1 55 55 GLY HA2 H 1 3.875 . . . . . . . A 55 GLY HA2 . 36136 1 589 . 1 1 55 55 GLY HA3 H 1 3.875 . . . . . . . A 55 GLY HA3 . 36136 1 590 . 1 1 55 55 GLY CA C 13 45.27 . . . . . . . A 55 GLY CA . 36136 1 591 . 1 1 55 55 GLY N N 15 109.093 . . . . . . . A 55 GLY N . 36136 1 592 . 1 1 56 56 ALA H H 1 7.944 . . . . . . . A 56 ALA H . 36136 1 593 . 1 1 56 56 ALA HA H 1 4.327 . . . . . . . A 56 ALA HA . 36136 1 594 . 1 1 56 56 ALA HB1 H 1 1.383 . . . . . . . A 56 ALA HB1 . 36136 1 595 . 1 1 56 56 ALA HB2 H 1 1.383 . . . . . . . A 56 ALA HB2 . 36136 1 596 . 1 1 56 56 ALA HB3 H 1 1.383 . . . . . . . A 56 ALA HB3 . 36136 1 597 . 1 1 56 56 ALA CA C 13 52.049 . . . . . . . A 56 ALA CA . 36136 1 598 . 1 1 56 56 ALA CB C 13 19.375 . . . . . . . A 56 ALA CB . 36136 1 599 . 1 1 56 56 ALA N N 15 123.137 . . . . . . . A 56 ALA N . 36136 1 600 . 1 1 57 57 GLU H H 1 8.36 . . . . . . . A 57 GLU H . 36136 1 601 . 1 1 57 57 GLU HA H 1 4.908 . . . . . . . A 57 GLU HA . 36136 1 602 . 1 1 57 57 GLU HB2 H 1 1.743 . . . . . . . A 57 GLU HB2 . 36136 1 603 . 1 1 57 57 GLU HB3 H 1 1.743 . . . . . . . A 57 GLU HB3 . 36136 1 604 . 1 1 57 57 GLU HG2 H 1 2.095 . . . . . . . A 57 GLU HG2 . 36136 1 605 . 1 1 57 57 GLU HG3 H 1 2.02 . . . . . . . A 57 GLU HG3 . 36136 1 606 . 1 1 57 57 GLU CA C 13 54.894 . . . . . . . A 57 GLU CA . 36136 1 607 . 1 1 57 57 GLU CB C 13 31.251 . . . . . . . A 57 GLU CB . 36136 1 608 . 1 1 57 57 GLU CG C 13 35.016 . . . . . . . A 57 GLU CG . 36136 1 609 . 1 1 57 57 GLU N N 15 119.461 . . . . . . . A 57 GLU N . 36136 1 610 . 1 1 58 58 GLN H H 1 8.905 . . . . . . . A 58 GLN H . 36136 1 611 . 1 1 58 58 GLN HA H 1 5.114 . . . . . . . A 58 GLN HA . 36136 1 612 . 1 1 58 58 GLN HB2 H 1 2.046 . . . . . . . A 58 GLN HB2 . 36136 1 613 . 1 1 58 58 GLN HB3 H 1 2.046 . . . . . . . A 58 GLN HB3 . 36136 1 614 . 1 1 58 58 GLN HG2 H 1 2.353 . . . . . . . A 58 GLN HG2 . 36136 1 615 . 1 1 58 58 GLN HG3 H 1 2.353 . . . . . . . A 58 GLN HG3 . 36136 1 616 . 1 1 58 58 GLN CA C 13 52.04 . . . . . . . A 58 GLN CA . 36136 1 617 . 1 1 58 58 GLN N N 15 122.611 . . . . . . . A 58 GLN N . 36136 1 618 . 1 1 59 59 PRO HA H 1 4.202 . . . . . . . A 59 PRO HA . 36136 1 619 . 1 1 59 59 PRO HB2 H 1 0 . . . . . . . A 59 PRO HB2 . 36136 1 620 . 1 1 59 59 PRO HB3 H 1 1.837 . . . . . . . A 59 PRO HB3 . 36136 1 621 . 1 1 59 59 PRO HG2 H 1 2.127 . . . . . . . A 59 PRO HG2 . 36136 1 622 . 1 1 59 59 PRO HG3 H 1 2.057 . . . . . . . A 59 PRO HG3 . 36136 1 623 . 1 1 59 59 PRO HD2 H 1 3.977 . . . . . . . A 59 PRO HD2 . 36136 1 624 . 1 1 59 59 PRO HD3 H 1 3.898 . . . . . . . A 59 PRO HD3 . 36136 1 625 . 1 1 59 59 PRO CA C 13 57.97 . . . . . . . A 59 PRO CA . 36136 1 626 . 1 1 59 59 PRO CB C 13 31.624 . . . . . . . A 59 PRO CB . 36136 1 627 . 1 1 59 59 PRO CG C 13 27.041 . . . . . . . A 59 PRO CG . 36136 1 628 . 1 1 59 59 PRO CD C 13 50.789 . . . . . . . A 59 PRO CD . 36136 1 629 . 1 1 60 60 LEU H H 1 8.118 . . . . . . . A 60 LEU H . 36136 1 630 . 1 1 60 60 LEU HA H 1 4.536 . . . . . . . A 60 LEU HA . 36136 1 631 . 1 1 60 60 LEU HB2 H 1 1.123 . . . . . . . A 60 LEU HB2 . 36136 1 632 . 1 1 60 60 LEU HB3 H 1 1.123 . . . . . . . A 60 LEU HB3 . 36136 1 633 . 1 1 60 60 LEU HG H 1 1.51 . . . . . . . A 60 LEU HG . 36136 1 634 . 1 1 60 60 LEU HD11 H 1 0.503 . . . . . . . A 60 LEU HD11 . 36136 1 635 . 1 1 60 60 LEU HD12 H 1 0.503 . . . . . . . A 60 LEU HD12 . 36136 1 636 . 1 1 60 60 LEU HD13 H 1 0.503 . . . . . . . A 60 LEU HD13 . 36136 1 637 . 1 1 60 60 LEU HD21 H 1 0.503 . . . . . . . A 60 LEU HD21 . 36136 1 638 . 1 1 60 60 LEU HD22 H 1 0.503 . . . . . . . A 60 LEU HD22 . 36136 1 639 . 1 1 60 60 LEU HD23 H 1 0.503 . . . . . . . A 60 LEU HD23 . 36136 1 640 . 1 1 60 60 LEU CA C 13 52.521 . . . . . . . A 60 LEU CA . 36136 1 641 . 1 1 60 60 LEU CB C 13 45.08 . . . . . . . A 60 LEU CB . 36136 1 642 . 1 1 60 60 LEU CG C 13 27.447 . . . . . . . A 60 LEU CG . 36136 1 643 . 1 1 60 60 LEU CD1 C 13 25.552 . . . . . . . A 60 LEU CD1 . 36136 1 644 . 1 1 60 60 LEU CD2 C 13 22.21 . . . . . . . A 60 LEU CD2 . 36136 1 645 . 1 1 60 60 LEU N N 15 121.865 . . . . . . . A 60 LEU N . 36136 1 646 . 1 1 61 61 SER H H 1 8.708 . . . . . . . A 61 SER H . 36136 1 647 . 1 1 61 61 SER HA H 1 4.509 . . . . . . . A 61 SER HA . 36136 1 648 . 1 1 61 61 SER HB2 H 1 4.024 . . . . . . . A 61 SER HB2 . 36136 1 649 . 1 1 61 61 SER HB3 H 1 3.784 . . . . . . . A 61 SER HB3 . 36136 1 650 . 1 1 61 61 SER HG H 1 4.987 . . . . . . . A 61 SER HG . 36136 1 651 . 1 1 61 61 SER CA C 13 56.674 . . . . . . . A 61 SER CA . 36136 1 652 . 1 1 61 61 SER CB C 13 63.47 . . . . . . . A 61 SER CB . 36136 1 653 . 1 1 61 61 SER N N 15 115.417 . . . . . . . A 61 SER N . 36136 1 654 . 1 1 62 62 LEU H H 1 8.919 . . . . . . . A 62 LEU H . 36136 1 655 . 1 1 62 62 LEU HA H 1 4.047 . . . . . . . A 62 LEU HA . 36136 1 656 . 1 1 62 62 LEU HB2 H 1 1.85 . . . . . . . A 62 LEU HB2 . 36136 1 657 . 1 1 62 62 LEU HB3 H 1 1.492 . . . . . . . A 62 LEU HB3 . 36136 1 658 . 1 1 62 62 LEU HD11 H 1 0.934 . . . . . . . A 62 LEU HD11 . 36136 1 659 . 1 1 62 62 LEU HD12 H 1 0.934 . . . . . . . A 62 LEU HD12 . 36136 1 660 . 1 1 62 62 LEU HD13 H 1 0.934 . . . . . . . A 62 LEU HD13 . 36136 1 661 . 1 1 62 62 LEU HD21 H 1 0.705 . . . . . . . A 62 LEU HD21 . 36136 1 662 . 1 1 62 62 LEU HD22 H 1 0.705 . . . . . . . A 62 LEU HD22 . 36136 1 663 . 1 1 62 62 LEU HD23 H 1 0.705 . . . . . . . A 62 LEU HD23 . 36136 1 664 . 1 1 62 62 LEU CA C 13 30.221 . . . . . . . A 62 LEU CA . 36136 1 665 . 1 1 62 62 LEU CB C 13 40.961 . . . . . . . A 62 LEU CB . 36136 1 666 . 1 1 62 62 LEU CG C 13 26.904 . . . . . . . A 62 LEU CG . 36136 1 667 . 1 1 62 62 LEU CD1 C 13 24.951 . . . . . . . A 62 LEU CD1 . 36136 1 668 . 1 1 62 62 LEU CD2 C 13 22.618 . . . . . . . A 62 LEU CD2 . 36136 1 669 . 1 1 62 62 LEU N N 15 125.713 . . . . . . . A 62 LEU N . 36136 1 670 . 1 1 63 63 ASN H H 1 8.147 . . . . . . . A 63 ASN H . 36136 1 671 . 1 1 63 63 ASN HA H 1 4.805 . . . . . . . A 63 ASN HA . 36136 1 672 . 1 1 63 63 ASN HB2 H 1 2.934 . . . . . . . A 63 ASN HB2 . 36136 1 673 . 1 1 63 63 ASN HB3 H 1 2.722 . . . . . . . A 63 ASN HB3 . 36136 1 674 . 1 1 63 63 ASN CA C 13 52.199 . . . . . . . A 63 ASN CA . 36136 1 675 . 1 1 63 63 ASN CB C 13 38.029 . . . . . . . A 63 ASN CB . 36136 1 676 . 1 1 63 63 ASN N N 15 114.12 . . . . . . . A 63 ASN N . 36136 1 677 . 1 1 64 64 HIS H H 1 7.697 . . . . . . . A 64 HIS H . 36136 1 678 . 1 1 64 64 HIS HA H 1 4.401 . . . . . . . A 64 HIS HA . 36136 1 679 . 1 1 64 64 HIS HB2 H 1 3.565 . . . . . . . A 64 HIS HB2 . 36136 1 680 . 1 1 64 64 HIS HB3 H 1 2.863 . . . . . . . A 64 HIS HB3 . 36136 1 681 . 1 1 64 64 HIS CA C 13 55.504 . . . . . . . A 64 HIS CA . 36136 1 682 . 1 1 64 64 HIS CB C 13 31.714 . . . . . . . A 64 HIS CB . 36136 1 683 . 1 1 64 64 HIS N N 15 122.943 . . . . . . . A 64 HIS N . 36136 1 684 . 1 1 65 65 PRO HA H 1 4.382 . . . . . . . A 65 PRO HA . 36136 1 685 . 1 1 65 65 PRO HB2 H 1 2.35 . . . . . . . A 65 PRO HB2 . 36136 1 686 . 1 1 65 65 PRO HB3 H 1 1.852 . . . . . . . A 65 PRO HB3 . 36136 1 687 . 1 1 65 65 PRO HG2 H 1 2.612 . . . . . . . A 65 PRO HG2 . 36136 1 688 . 1 1 65 65 PRO HG3 H 1 2.612 . . . . . . . A 65 PRO HG3 . 36136 1 689 . 1 1 65 65 PRO HD2 H 1 3.651 . . . . . . . A 65 PRO HD2 . 36136 1 690 . 1 1 65 65 PRO HD3 H 1 3.537 . . . . . . . A 65 PRO HD3 . 36136 1 691 . 1 1 65 65 PRO CA C 13 63.338 . . . . . . . A 65 PRO CA . 36136 1 692 . 1 1 65 65 PRO CB C 13 31.747 . . . . . . . A 65 PRO CB . 36136 1 693 . 1 1 65 65 PRO CG C 13 27.457 . . . . . . . A 65 PRO CG . 36136 1 694 . 1 1 65 65 PRO CD C 13 49.853 . . . . . . . A 65 PRO CD . 36136 1 695 . 1 1 66 66 ALA H H 1 8.67 . . . . . . . A 66 ALA H . 36136 1 696 . 1 1 66 66 ALA HA H 1 3.8 . . . . . . . A 66 ALA HA . 36136 1 697 . 1 1 66 66 ALA HB1 H 1 1.129 . . . . . . . A 66 ALA HB1 . 36136 1 698 . 1 1 66 66 ALA HB2 H 1 1.129 . . . . . . . A 66 ALA HB2 . 36136 1 699 . 1 1 66 66 ALA HB3 H 1 1.129 . . . . . . . A 66 ALA HB3 . 36136 1 700 . 1 1 66 66 ALA CA C 13 54.684 . . . . . . . A 66 ALA CA . 36136 1 701 . 1 1 66 66 ALA CB C 13 17.977 . . . . . . . A 66 ALA CB . 36136 1 702 . 1 1 66 66 ALA N N 15 129.346 . . . . . . . A 66 ALA N . 36136 1 703 . 1 1 67 67 GLU H H 1 9.3 . . . . . . . A 67 GLU H . 36136 1 704 . 1 1 67 67 GLU HA H 1 3.84 . . . . . . . A 67 GLU HA . 36136 1 705 . 1 1 67 67 GLU HB2 H 1 2.101 . . . . . . . A 67 GLU HB2 . 36136 1 706 . 1 1 67 67 GLU HB3 H 1 1.917 . . . . . . . A 67 GLU HB3 . 36136 1 707 . 1 1 67 67 GLU HG2 H 1 2.29 . . . . . . . A 67 GLU HG2 . 36136 1 708 . 1 1 67 67 GLU HG3 H 1 2.205 . . . . . . . A 67 GLU HG3 . 36136 1 709 . 1 1 67 67 GLU CA C 13 58.459 . . . . . . . A 67 GLU CA . 36136 1 710 . 1 1 67 67 GLU CB C 13 33.397 . . . . . . . A 67 GLU CB . 36136 1 711 . 1 1 67 67 GLU CG C 13 33.336 . . . . . . . A 67 GLU CG . 36136 1 712 . 1 1 67 67 GLU N N 15 115.554 . . . . . . . A 67 GLU N . 36136 1 713 . 1 1 68 68 ARG H H 1 7.216 . . . . . . . A 68 ARG H . 36136 1 714 . 1 1 68 68 ARG HA H 1 4.308 . . . . . . . A 68 ARG HA . 36136 1 715 . 1 1 68 68 ARG HB2 H 1 2.27 . . . . . . . A 68 ARG HB2 . 36136 1 716 . 1 1 68 68 ARG HB3 H 1 1.86 . . . . . . . A 68 ARG HB3 . 36136 1 717 . 1 1 68 68 ARG HG2 H 1 1.726 . . . . . . . A 68 ARG HG2 . 36136 1 718 . 1 1 68 68 ARG HG3 H 1 1.726 . . . . . . . A 68 ARG HG3 . 36136 1 719 . 1 1 68 68 ARG HD2 H 1 3.175 . . . . . . . A 68 ARG HD2 . 36136 1 720 . 1 1 68 68 ARG HD3 H 1 3.175 . . . . . . . A 68 ARG HD3 . 36136 1 721 . 1 1 68 68 ARG HE H 1 6.899 . . . . . . . A 68 ARG HE . 36136 1 722 . 1 1 68 68 ARG CA C 13 56.591 . . . . . . . A 68 ARG CA . 36136 1 723 . 1 1 68 68 ARG CB C 13 29.826 . . . . . . . A 68 ARG CB . 36136 1 724 . 1 1 68 68 ARG CG C 13 27.376 . . . . . . . A 68 ARG CG . 36136 1 725 . 1 1 68 68 ARG CD C 13 42.788 . . . . . . . A 68 ARG CD . 36136 1 726 . 1 1 68 68 ARG N N 15 114.462 . . . . . . . A 68 ARG N . 36136 1 727 . 1 1 69 69 LEU H H 1 7.826 . . . . . . . A 69 LEU H . 36136 1 728 . 1 1 69 69 LEU HA H 1 4.339 . . . . . . . A 69 LEU HA . 36136 1 729 . 1 1 69 69 LEU HB2 H 1 1.825 . . . . . . . A 69 LEU HB2 . 36136 1 730 . 1 1 69 69 LEU HB3 H 1 1.607 . . . . . . . A 69 LEU HB3 . 36136 1 731 . 1 1 69 69 LEU HD11 H 1 0 . . . . . . . A 69 LEU HD11 . 36136 1 732 . 1 1 69 69 LEU HD12 H 1 0 . . . . . . . A 69 LEU HD12 . 36136 1 733 . 1 1 69 69 LEU HD13 H 1 0 . . . . . . . A 69 LEU HD13 . 36136 1 734 . 1 1 69 69 LEU HD21 H 1 0.667 . . . . . . . A 69 LEU HD21 . 36136 1 735 . 1 1 69 69 LEU HD22 H 1 0.667 . . . . . . . A 69 LEU HD22 . 36136 1 736 . 1 1 69 69 LEU HD23 H 1 0.667 . . . . . . . A 69 LEU HD23 . 36136 1 737 . 1 1 69 69 LEU CA C 13 52.977 . . . . . . . A 69 LEU CA . 36136 1 738 . 1 1 69 69 LEU CB C 13 38.395 . . . . . . . A 69 LEU CB . 36136 1 739 . 1 1 69 69 LEU CG C 13 26.609 . . . . . . . A 69 LEU CG . 36136 1 740 . 1 1 69 69 LEU CD2 C 13 22.5 . . . . . . . A 69 LEU CD2 . 36136 1 741 . 1 1 69 69 LEU N N 15 118.311 . . . . . . . A 69 LEU N . 36136 1 742 . 1 1 70 70 ILE H H 1 6.704 . . . . . . . A 70 ILE H . 36136 1 743 . 1 1 70 70 ILE HA H 1 3.566 . . . . . . . A 70 ILE HA . 36136 1 744 . 1 1 70 70 ILE HB H 1 1.709 . . . . . . . A 70 ILE HB . 36136 1 745 . 1 1 70 70 ILE HG21 H 1 1.017 . . . . . . . A 70 ILE HG21 . 36136 1 746 . 1 1 70 70 ILE HG22 H 1 1.017 . . . . . . . A 70 ILE HG22 . 36136 1 747 . 1 1 70 70 ILE HG23 H 1 1.017 . . . . . . . A 70 ILE HG23 . 36136 1 748 . 1 1 70 70 ILE HD11 H 1 0.901 . . . . . . . A 70 ILE HD11 . 36136 1 749 . 1 1 70 70 ILE HD12 H 1 0.901 . . . . . . . A 70 ILE HD12 . 36136 1 750 . 1 1 70 70 ILE HD13 H 1 0.901 . . . . . . . A 70 ILE HD13 . 36136 1 751 . 1 1 70 70 ILE CA C 13 63.427 . . . . . . . A 70 ILE CA . 36136 1 752 . 1 1 70 70 ILE CB C 13 37.795 . . . . . . . A 70 ILE CB . 36136 1 753 . 1 1 70 70 ILE CG1 C 13 28.817 . . . . . . . A 70 ILE CG1 . 36136 1 754 . 1 1 70 70 ILE CG2 C 13 17.504 . . . . . . . A 70 ILE CG2 . 36136 1 755 . 1 1 70 70 ILE CD1 C 13 13.421 . . . . . . . A 70 ILE CD1 . 36136 1 756 . 1 1 70 70 ILE N N 15 118.247 . . . . . . . A 70 ILE N . 36136 1 757 . 1 1 71 71 GLY H H 1 8.977 . . . . . . . A 71 GLY H . 36136 1 758 . 1 1 71 71 GLY HA2 H 1 4.23 . . . . . . . A 71 GLY HA2 . 36136 1 759 . 1 1 71 71 GLY HA3 H 1 3.963 . . . . . . . A 71 GLY HA3 . 36136 1 760 . 1 1 71 71 GLY CA C 13 45.222 . . . . . . . A 71 GLY CA . 36136 1 761 . 1 1 71 71 GLY N N 15 114.474 . . . . . . . A 71 GLY N . 36136 1 762 . 1 1 72 72 LYS H H 1 7.627 . . . . . . . A 72 LYS H . 36136 1 763 . 1 1 72 72 LYS HA H 1 4.643 . . . . . . . A 72 LYS HA . 36136 1 764 . 1 1 72 72 LYS HB2 H 1 1.961 . . . . . . . A 72 LYS HB2 . 36136 1 765 . 1 1 72 72 LYS HB3 H 1 1.961 . . . . . . . A 72 LYS HB3 . 36136 1 766 . 1 1 72 72 LYS HG2 H 1 1.287 . . . . . . . A 72 LYS HG2 . 36136 1 767 . 1 1 72 72 LYS HG3 H 1 1.287 . . . . . . . A 72 LYS HG3 . 36136 1 768 . 1 1 72 72 LYS HD2 H 1 1.682 . . . . . . . A 72 LYS HD2 . 36136 1 769 . 1 1 72 72 LYS HD3 H 1 1.626 . . . . . . . A 72 LYS HD3 . 36136 1 770 . 1 1 72 72 LYS HE2 H 1 3.058 . . . . . . . A 72 LYS HE2 . 36136 1 771 . 1 1 72 72 LYS HE3 H 1 2.997 . . . . . . . A 72 LYS HE3 . 36136 1 772 . 1 1 72 72 LYS CA C 13 53.591 . . . . . . . A 72 LYS CA . 36136 1 773 . 1 1 72 72 LYS CB C 13 39.188 . . . . . . . A 72 LYS CB . 36136 1 774 . 1 1 72 72 LYS CG C 13 25.28 . . . . . . . A 72 LYS CG . 36136 1 775 . 1 1 72 72 LYS CD C 13 28.06 . . . . . . . A 72 LYS CD . 36136 1 776 . 1 1 72 72 LYS CE C 13 42.251 . . . . . . . A 72 LYS CE . 36136 1 777 . 1 1 72 72 LYS N N 15 118.822 . . . . . . . A 72 LYS N . 36136 1 778 . 1 1 73 73 LYS H H 1 8.554 . . . . . . . A 73 LYS H . 36136 1 779 . 1 1 73 73 LYS HA H 1 5.228 . . . . . . . A 73 LYS HA . 36136 1 780 . 1 1 73 73 LYS HB2 H 1 1.846 . . . . . . . A 73 LYS HB2 . 36136 1 781 . 1 1 73 73 LYS HB3 H 1 1.735 . . . . . . . A 73 LYS HB3 . 36136 1 782 . 1 1 73 73 LYS HG2 H 1 1.413 . . . . . . . A 73 LYS HG2 . 36136 1 783 . 1 1 73 73 LYS HG3 H 1 1.307 . . . . . . . A 73 LYS HG3 . 36136 1 784 . 1 1 73 73 LYS HD2 H 1 1.591 . . . . . . . A 73 LYS HD2 . 36136 1 785 . 1 1 73 73 LYS HD3 H 1 1.591 . . . . . . . A 73 LYS HD3 . 36136 1 786 . 1 1 73 73 LYS HE2 H 1 2.871 . . . . . . . A 73 LYS HE2 . 36136 1 787 . 1 1 73 73 LYS HE3 H 1 2.871 . . . . . . . A 73 LYS HE3 . 36136 1 788 . 1 1 73 73 LYS CA C 13 54.886 . . . . . . . A 73 LYS CA . 36136 1 789 . 1 1 73 73 LYS CB C 13 34.643 . . . . . . . A 73 LYS CB . 36136 1 790 . 1 1 73 73 LYS CG C 13 24.849 . . . . . . . A 73 LYS CG . 36136 1 791 . 1 1 73 73 LYS CD C 13 28.854 . . . . . . . A 73 LYS CD . 36136 1 792 . 1 1 73 73 LYS CE C 13 41.645 . . . . . . . A 73 LYS CE . 36136 1 793 . 1 1 73 73 LYS N N 15 120.036 . . . . . . . A 73 LYS N . 36136 1 794 . 1 1 74 74 LEU H H 1 8.714 . . . . . . . A 74 LEU H . 36136 1 795 . 1 1 74 74 LEU HA H 1 5.528 . . . . . . . A 74 LEU HA . 36136 1 796 . 1 1 74 74 LEU HB2 H 1 1.561 . . . . . . . A 74 LEU HB2 . 36136 1 797 . 1 1 74 74 LEU HB3 H 1 1.409 . . . . . . . A 74 LEU HB3 . 36136 1 798 . 1 1 74 74 LEU HG H 1 1.62 . . . . . . . A 74 LEU HG . 36136 1 799 . 1 1 74 74 LEU HD11 H 1 0.771 . . . . . . . A 74 LEU HD11 . 36136 1 800 . 1 1 74 74 LEU HD12 H 1 0.771 . . . . . . . A 74 LEU HD12 . 36136 1 801 . 1 1 74 74 LEU HD13 H 1 0.771 . . . . . . . A 74 LEU HD13 . 36136 1 802 . 1 1 74 74 LEU HD21 H 1 0.708 . . . . . . . A 74 LEU HD21 . 36136 1 803 . 1 1 74 74 LEU HD22 H 1 0.708 . . . . . . . A 74 LEU HD22 . 36136 1 804 . 1 1 74 74 LEU HD23 H 1 0.708 . . . . . . . A 74 LEU HD23 . 36136 1 805 . 1 1 74 74 LEU CA C 13 51.713 . . . . . . . A 74 LEU CA . 36136 1 806 . 1 1 74 74 LEU CB C 13 45.163 . . . . . . . A 74 LEU CB . 36136 1 807 . 1 1 74 74 LEU CG C 13 26.331 . . . . . . . A 74 LEU CG . 36136 1 808 . 1 1 74 74 LEU CD1 C 13 23.951 . . . . . . . A 74 LEU CD1 . 36136 1 809 . 1 1 74 74 LEU CD2 C 13 23.951 . . . . . . . A 74 LEU CD2 . 36136 1 810 . 1 1 74 74 LEU N N 15 120.373 . . . . . . . A 74 LEU N . 36136 1 811 . 1 1 75 75 LYS H H 1 9.261 . . . . . . . A 75 LYS H . 36136 1 812 . 1 1 75 75 LYS HA H 1 5.207 . . . . . . . A 75 LYS HA . 36136 1 813 . 1 1 75 75 LYS HB2 H 1 1.703 . . . . . . . A 75 LYS HB2 . 36136 1 814 . 1 1 75 75 LYS HB3 H 1 1.639 . . . . . . . A 75 LYS HB3 . 36136 1 815 . 1 1 75 75 LYS HG2 H 1 1.317 . . . . . . . A 75 LYS HG2 . 36136 1 816 . 1 1 75 75 LYS HG3 H 1 1.11 . . . . . . . A 75 LYS HG3 . 36136 1 817 . 1 1 75 75 LYS HD2 H 1 1.564 . . . . . . . A 75 LYS HD2 . 36136 1 818 . 1 1 75 75 LYS HD3 H 1 1.48 . . . . . . . A 75 LYS HD3 . 36136 1 819 . 1 1 75 75 LYS HE2 H 1 2.643 . . . . . . . A 75 LYS HE2 . 36136 1 820 . 1 1 75 75 LYS HE3 H 1 2.643 . . . . . . . A 75 LYS HE3 . 36136 1 821 . 1 1 75 75 LYS CA C 13 54.694 . . . . . . . A 75 LYS CA . 36136 1 822 . 1 1 75 75 LYS CB C 13 37.008 . . . . . . . A 75 LYS CB . 36136 1 823 . 1 1 75 75 LYS CG C 13 24.693 . . . . . . . A 75 LYS CG . 36136 1 824 . 1 1 75 75 LYS CD C 13 29.483 . . . . . . . A 75 LYS CD . 36136 1 825 . 1 1 75 75 LYS CE C 13 41.186 . . . . . . . A 75 LYS CE . 36136 1 826 . 1 1 75 75 LYS N N 15 121.159 . . . . . . . A 75 LYS N . 36136 1 827 . 1 1 76 76 VAL H H 1 8.583 . . . . . . . A 76 VAL H . 36136 1 828 . 1 1 76 76 VAL HA H 1 4.617 . . . . . . . A 76 VAL HA . 36136 1 829 . 1 1 76 76 VAL HB H 1 1.997 . . . . . . . A 76 VAL HB . 36136 1 830 . 1 1 76 76 VAL HG11 H 1 0.777 . . . . . . . A 76 VAL HG11 . 36136 1 831 . 1 1 76 76 VAL HG12 H 1 0.777 . . . . . . . A 76 VAL HG12 . 36136 1 832 . 1 1 76 76 VAL HG13 H 1 0.777 . . . . . . . A 76 VAL HG13 . 36136 1 833 . 1 1 76 76 VAL HG21 H 1 0.777 . . . . . . . A 76 VAL HG21 . 36136 1 834 . 1 1 76 76 VAL HG22 H 1 0.777 . . . . . . . A 76 VAL HG22 . 36136 1 835 . 1 1 76 76 VAL HG23 H 1 0.777 . . . . . . . A 76 VAL HG23 . 36136 1 836 . 1 1 76 76 VAL CA C 13 61.026 . . . . . . . A 76 VAL CA . 36136 1 837 . 1 1 76 76 VAL CB C 13 33.265 . . . . . . . A 76 VAL CB . 36136 1 838 . 1 1 76 76 VAL CG1 C 13 20.997 . . . . . . . A 76 VAL CG1 . 36136 1 839 . 1 1 76 76 VAL CG2 C 13 20.997 . . . . . . . A 76 VAL CG2 . 36136 1 840 . 1 1 76 76 VAL N N 15 125.59 . . . . . . . A 76 VAL N . 36136 1 841 . 1 1 77 77 VAL H H 1 9.033 . . . . . . . A 77 VAL H . 36136 1 842 . 1 1 77 77 VAL HA H 1 4.746 . . . . . . . A 77 VAL HA . 36136 1 843 . 1 1 77 77 VAL HB H 1 2.26 . . . . . . . A 77 VAL HB . 36136 1 844 . 1 1 77 77 VAL HG11 H 1 0.973 . . . . . . . A 77 VAL HG11 . 36136 1 845 . 1 1 77 77 VAL HG12 H 1 0.973 . . . . . . . A 77 VAL HG12 . 36136 1 846 . 1 1 77 77 VAL HG13 H 1 0.973 . . . . . . . A 77 VAL HG13 . 36136 1 847 . 1 1 77 77 VAL HG21 H 1 0.973 . . . . . . . A 77 VAL HG21 . 36136 1 848 . 1 1 77 77 VAL HG22 H 1 0.973 . . . . . . . A 77 VAL HG22 . 36136 1 849 . 1 1 77 77 VAL HG23 H 1 0.973 . . . . . . . A 77 VAL HG23 . 36136 1 850 . 1 1 77 77 VAL CA C 13 58.201 . . . . . . . A 77 VAL CA . 36136 1 851 . 1 1 77 77 VAL CB C 13 34.429 . . . . . . . A 77 VAL CB . 36136 1 852 . 1 1 77 77 VAL N N 15 125.29 . . . . . . . A 77 VAL N . 36136 1 853 . 1 1 78 78 PRO HA H 1 4.649 . . . . . . . A 78 PRO HA . 36136 1 854 . 1 1 78 78 PRO HB2 H 1 2.413 . . . . . . . A 78 PRO HB2 . 36136 1 855 . 1 1 78 78 PRO HB3 H 1 1.902 . . . . . . . A 78 PRO HB3 . 36136 1 856 . 1 1 78 78 PRO HG2 H 1 2.224 . . . . . . . A 78 PRO HG2 . 36136 1 857 . 1 1 78 78 PRO HG3 H 1 1.836 . . . . . . . A 78 PRO HG3 . 36136 1 858 . 1 1 78 78 PRO HD2 H 1 3.729 . . . . . . . A 78 PRO HD2 . 36136 1 859 . 1 1 78 78 PRO HD3 H 1 3.729 . . . . . . . A 78 PRO HD3 . 36136 1 860 . 1 1 78 78 PRO CA C 13 62.669 . . . . . . . A 78 PRO CA . 36136 1 861 . 1 1 78 78 PRO CB C 13 32.043 . . . . . . . A 78 PRO CB . 36136 1 862 . 1 1 78 78 PRO CG C 13 27.593 . . . . . . . A 78 PRO CG . 36136 1 863 . 1 1 78 78 PRO CD C 13 51.017 . . . . . . . A 78 PRO CD . 36136 1 864 . 1 1 79 79 LEU H H 1 7.934 . . . . . . . A 79 LEU H . 36136 1 865 . 1 1 79 79 LEU HA H 1 4.296 . . . . . . . A 79 LEU HA . 36136 1 866 . 1 1 79 79 LEU HB2 H 1 1.452 . . . . . . . A 79 LEU HB2 . 36136 1 867 . 1 1 79 79 LEU HB3 H 1 1.299 . . . . . . . A 79 LEU HB3 . 36136 1 868 . 1 1 79 79 LEU HG H 1 1.188 . . . . . . . A 79 LEU HG . 36136 1 869 . 1 1 79 79 LEU HD11 H 1 0.802 . . . . . . . A 79 LEU HD11 . 36136 1 870 . 1 1 79 79 LEU HD12 H 1 0.802 . . . . . . . A 79 LEU HD12 . 36136 1 871 . 1 1 79 79 LEU HD13 H 1 0.802 . . . . . . . A 79 LEU HD13 . 36136 1 872 . 1 1 79 79 LEU HD21 H 1 0.802 . . . . . . . A 79 LEU HD21 . 36136 1 873 . 1 1 79 79 LEU HD22 H 1 0.802 . . . . . . . A 79 LEU HD22 . 36136 1 874 . 1 1 79 79 LEU HD23 H 1 0.802 . . . . . . . A 79 LEU HD23 . 36136 1 875 . 1 1 79 79 LEU CA C 13 49.556 . . . . . . . A 79 LEU CA . 36136 1 876 . 1 1 79 79 LEU CB C 13 42.119 . . . . . . . A 79 LEU CB . 36136 1 877 . 1 1 79 79 LEU CG C 13 26.614 . . . . . . . A 79 LEU CG . 36136 1 878 . 1 1 79 79 LEU CD1 C 13 27.015 . . . . . . . A 79 LEU CD1 . 36136 1 879 . 1 1 79 79 LEU CD2 C 13 27.015 . . . . . . . A 79 LEU CD2 . 36136 1 880 . 1 1 79 79 LEU N N 15 123.303 . . . . . . . A 79 LEU N . 36136 1 stop_ save_