data_30157 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30157 _Entry.Title ; NMR structure of the E. coli protein NPr, residues 1-85 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-08-18 _Entry.Accession_date 2016-08-18 _Entry.Last_release_date 2016-09-23 _Entry.Original_release_date 2016-09-23 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 G. Wang G. . . . 30157 2 X. Li X. . . . 30157 3 A. Peterkofsky A. . . . 30157 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID HPr-like . 30157 PTSNtr . 30157 TRANSFERASE . 30157 biofilm . 30157 'phosphotransfer protein' . 30157 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30157 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 312 30157 '15N chemical shifts' 88 30157 '1H chemical shifts' 417 30157 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 . . 2016-09-23 . original BMRB . 30157 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5T17 'BMRB Entry Tracking System' 30157 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30157 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s00726-008-0079-9 _Citation.PubMed_ID 18421563 _Citation.Full_citation . _Citation.Title ; Solution structure of NPr, a bacterial signal-transducing protein that controls the phosphorylation state of the potassium transporter-regulating protein IIA Ntr. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Amino Acids' _Citation.Journal_name_full . _Citation.Journal_volume 35 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1438-2199 _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 531 _Citation.Page_last 539 _Citation.Year 2008 _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 X. Li X. . . . 30157 1 2 A. Peterkofsky A. . . . 30157 1 3 G. Wang G. . . . 30157 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30157 _Assembly.ID 1 _Assembly.Name 'Phosphocarrier protein NPr (E.C.2.7.11.-)' _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 . . . . . . 30157 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30157 _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 A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MTVKQTVEITNKLGMHARPA MKLFELMQGFDAEVLLRNDE GTEAEANSVIALLMLDSAKG RQIEVEATGPQEEEALAAVI ALFNS ; _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 85 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'UNP residues 1-85' _Entity.Mutation . _Entity.EC_number 2.7.11.- _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9254.570 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Nitrogen-related HPr' na 30157 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 30157 1 2 . THR . 30157 1 3 . VAL . 30157 1 4 . LYS . 30157 1 5 . GLN . 30157 1 6 . THR . 30157 1 7 . VAL . 30157 1 8 . GLU . 30157 1 9 . ILE . 30157 1 10 . THR . 30157 1 11 . ASN . 30157 1 12 . LYS . 30157 1 13 . LEU . 30157 1 14 . GLY . 30157 1 15 . MET . 30157 1 16 . HIS . 30157 1 17 . ALA . 30157 1 18 . ARG . 30157 1 19 . PRO . 30157 1 20 . ALA . 30157 1 21 . MET . 30157 1 22 . LYS . 30157 1 23 . LEU . 30157 1 24 . PHE . 30157 1 25 . GLU . 30157 1 26 . LEU . 30157 1 27 . MET . 30157 1 28 . GLN . 30157 1 29 . GLY . 30157 1 30 . PHE . 30157 1 31 . ASP . 30157 1 32 . ALA . 30157 1 33 . GLU . 30157 1 34 . VAL . 30157 1 35 . LEU . 30157 1 36 . LEU . 30157 1 37 . ARG . 30157 1 38 . ASN . 30157 1 39 . ASP . 30157 1 40 . GLU . 30157 1 41 . GLY . 30157 1 42 . THR . 30157 1 43 . GLU . 30157 1 44 . ALA . 30157 1 45 . GLU . 30157 1 46 . ALA . 30157 1 47 . ASN . 30157 1 48 . SER . 30157 1 49 . VAL . 30157 1 50 . ILE . 30157 1 51 . ALA . 30157 1 52 . LEU . 30157 1 53 . LEU . 30157 1 54 . MET . 30157 1 55 . LEU . 30157 1 56 . ASP . 30157 1 57 . SER . 30157 1 58 . ALA . 30157 1 59 . LYS . 30157 1 60 . GLY . 30157 1 61 . ARG . 30157 1 62 . GLN . 30157 1 63 . ILE . 30157 1 64 . GLU . 30157 1 65 . VAL . 30157 1 66 . GLU . 30157 1 67 . ALA . 30157 1 68 . THR . 30157 1 69 . GLY . 30157 1 70 . PRO . 30157 1 71 . GLN . 30157 1 72 . GLU . 30157 1 73 . GLU . 30157 1 74 . GLU . 30157 1 75 . ALA . 30157 1 76 . LEU . 30157 1 77 . ALA . 30157 1 78 . ALA . 30157 1 79 . VAL . 30157 1 80 . ILE . 30157 1 81 . ALA . 30157 1 82 . LEU . 30157 1 83 . PHE . 30157 1 84 . ASN . 30157 1 85 . SER . 30157 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 30157 1 . THR 2 2 30157 1 . VAL 3 3 30157 1 . LYS 4 4 30157 1 . GLN 5 5 30157 1 . THR 6 6 30157 1 . VAL 7 7 30157 1 . GLU 8 8 30157 1 . ILE 9 9 30157 1 . THR 10 10 30157 1 . ASN 11 11 30157 1 . LYS 12 12 30157 1 . LEU 13 13 30157 1 . GLY 14 14 30157 1 . MET 15 15 30157 1 . HIS 16 16 30157 1 . ALA 17 17 30157 1 . ARG 18 18 30157 1 . PRO 19 19 30157 1 . ALA 20 20 30157 1 . MET 21 21 30157 1 . LYS 22 22 30157 1 . LEU 23 23 30157 1 . PHE 24 24 30157 1 . GLU 25 25 30157 1 . LEU 26 26 30157 1 . MET 27 27 30157 1 . GLN 28 28 30157 1 . GLY 29 29 30157 1 . PHE 30 30 30157 1 . ASP 31 31 30157 1 . ALA 32 32 30157 1 . GLU 33 33 30157 1 . VAL 34 34 30157 1 . LEU 35 35 30157 1 . LEU 36 36 30157 1 . ARG 37 37 30157 1 . ASN 38 38 30157 1 . ASP 39 39 30157 1 . GLU 40 40 30157 1 . GLY 41 41 30157 1 . THR 42 42 30157 1 . GLU 43 43 30157 1 . ALA 44 44 30157 1 . GLU 45 45 30157 1 . ALA 46 46 30157 1 . ASN 47 47 30157 1 . SER 48 48 30157 1 . VAL 49 49 30157 1 . ILE 50 50 30157 1 . ALA 51 51 30157 1 . LEU 52 52 30157 1 . LEU 53 53 30157 1 . MET 54 54 30157 1 . LEU 55 55 30157 1 . ASP 56 56 30157 1 . SER 57 57 30157 1 . ALA 58 58 30157 1 . LYS 59 59 30157 1 . GLY 60 60 30157 1 . ARG 61 61 30157 1 . GLN 62 62 30157 1 . ILE 63 63 30157 1 . GLU 64 64 30157 1 . VAL 65 65 30157 1 . GLU 66 66 30157 1 . ALA 67 67 30157 1 . THR 68 68 30157 1 . GLY 69 69 30157 1 . PRO 70 70 30157 1 . GLN 71 71 30157 1 . GLU 72 72 30157 1 . GLU 73 73 30157 1 . GLU 74 74 30157 1 . ALA 75 75 30157 1 . LEU 76 76 30157 1 . ALA 77 77 30157 1 . ALA 78 78 30157 1 . VAL 79 79 30157 1 . ILE 80 80 30157 1 . ALA 81 81 30157 1 . LEU 82 82 30157 1 . PHE 83 83 30157 1 . ASN 84 84 30157 1 . SER 85 85 30157 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 30157 _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 . 83334 organism . 'Escherichia coli O157:H7' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . 'ptsO, Z4569, ECs4085' . 30157 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 30157 _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 ER2566 . . Plasmid . . pETDuet1 . . . 30157 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30157 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-13C; U-15N] NPr, 25 mM Tris, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _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 NPr '[U-13C; U-15N]' . . 1 $entity_1 . . 1 . . mM . . . . 30157 1 2 Tris 'natural abundance' . . . . . . 25 . . mM . . . . 30157 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 30157 _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' 25 . mM 30157 1 pH 7 . pH 30157 1 pressure 1 . atm 30157 1 temperature 308 . K 30157 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30157 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30157 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30157 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30157 _Software.ID 2 _Software.Name PIPP _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Garrett . . 30157 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 30157 2 'peak picking' 30157 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30157 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 30157 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30157 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30157 _Software.ID 4 _Software.Name VNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 30157 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 30157 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30157 _Software.ID 5 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 30157 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30157 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 30157 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 30157 _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 Varian INOVA . 600 . . . 30157 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 30157 _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 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 3 '4D HNHC NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 7 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 9 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 11 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 1 12 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30157 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 30157 _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 0.25144953 . . . . . 30157 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30157 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30157 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 30157 _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 '3D 1H-15N NOESY' . . . 30157 1 2 '3D 1H-13C NOESY' . . . 30157 1 3 '4D HNHC NOESY' . . . 30157 1 4 '3D HNCACB' . . . 30157 1 5 '3D CBCA(CO)NH' . . . 30157 1 6 '3D HNCA' . . . 30157 1 7 '3D C(CO)NH' . . . 30157 1 8 '3D H(CCO)NH' . . . 30157 1 9 '3D HNHA' . . . 30157 1 10 '3D HBHA(CO)NH' . . . 30157 1 11 '3D HCCH-TOCSY' . . . 30157 1 12 '3D HCCH-COSY' . . . 30157 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 THR HA H 1 4.4981 . . . . . . A 2 THR HA . 30157 1 2 . 1 1 2 2 THR HB H 1 3.7836 . . . . . . A 2 THR HB . 30157 1 3 . 1 1 2 2 THR C C 13 170.8020 . . . . . . A 2 THR C . 30157 1 4 . 1 1 2 2 THR CA C 13 62.6020 . . . . . . A 2 THR CA . 30157 1 5 . 1 1 2 2 THR CB C 13 69.9524 . . . . . . A 2 THR CB . 30157 1 6 . 1 1 2 2 THR CG2 C 13 21.4792 . . . . . . A 2 THR CG2 . 30157 1 7 . 1 1 3 3 VAL H H 1 8.9703 . . . . . . A 3 VAL H . 30157 1 8 . 1 1 3 3 VAL HA H 1 4.7191 . . . . . . A 3 VAL HA . 30157 1 9 . 1 1 3 3 VAL HB H 1 2.1273 . . . . . . A 3 VAL HB . 30157 1 10 . 1 1 3 3 VAL C C 13 173.1300 . . . . . . A 3 VAL C . 30157 1 11 . 1 1 3 3 VAL CA C 13 59.7777 . . . . . . A 3 VAL CA . 30157 1 12 . 1 1 3 3 VAL CB C 13 35.1278 . . . . . . A 3 VAL CB . 30157 1 13 . 1 1 3 3 VAL CG1 C 13 22.3947 . . . . . . A 3 VAL CG1 . 30157 1 14 . 1 1 3 3 VAL CG2 C 13 20.4782 . . . . . . A 3 VAL CG2 . 30157 1 15 . 1 1 3 3 VAL N N 15 122.9099 . . . . . . A 3 VAL N . 30157 1 16 . 1 1 4 4 LYS H H 1 8.2925 . . . . . . A 4 LYS H . 30157 1 17 . 1 1 4 4 LYS HA H 1 5.7270 . . . . . . A 4 LYS HA . 30157 1 18 . 1 1 4 4 LYS HB2 H 1 1.6077 . . . . . . A 4 LYS HB2 . 30157 1 19 . 1 1 4 4 LYS HG2 H 1 1.2310 . . . . . . A 4 LYS HG2 . 30157 1 20 . 1 1 4 4 LYS HG3 H 1 1.2310 . . . . . . A 4 LYS HG3 . 30157 1 21 . 1 1 4 4 LYS C C 13 175.5660 . . . . . . A 4 LYS C . 30157 1 22 . 1 1 4 4 LYS CA C 13 54.7109 . . . . . . A 4 LYS CA . 30157 1 23 . 1 1 4 4 LYS CB C 13 37.0986 . . . . . . A 4 LYS CB . 30157 1 24 . 1 1 4 4 LYS CG C 13 23.9596 . . . . . . A 4 LYS CG . 30157 1 25 . 1 1 4 4 LYS CD C 13 35.7851 . . . . . . A 4 LYS CD . 30157 1 26 . 1 1 4 4 LYS N N 15 119.5260 . . . . . . A 4 LYS N . 30157 1 27 . 1 1 5 5 GLN H H 1 8.8408 . . . . . . A 5 GLN H . 30157 1 28 . 1 1 5 5 GLN HA H 1 4.5128 . . . . . . A 5 GLN HA . 30157 1 29 . 1 1 5 5 GLN HB2 H 1 1.7520 . . . . . . A 5 GLN HB2 . 30157 1 30 . 1 1 5 5 GLN HB3 H 1 2.1010 . . . . . . A 5 GLN HB3 . 30157 1 31 . 1 1 5 5 GLN HG2 H 1 2.4100 . . . . . . A 5 GLN HG2 . 30157 1 32 . 1 1 5 5 GLN HG3 H 1 2.4100 . . . . . . A 5 GLN HG3 . 30157 1 33 . 1 1 5 5 GLN HE21 H 1 7.5860 . . . . . . A 5 GLN HE21 . 30157 1 34 . 1 1 5 5 GLN HE22 H 1 6.7890 . . . . . . A 5 GLN HE22 . 30157 1 35 . 1 1 5 5 GLN C C 13 173.9740 . . . . . . A 5 GLN C . 30157 1 36 . 1 1 5 5 GLN CA C 13 56.0746 . . . . . . A 5 GLN CA . 30157 1 37 . 1 1 5 5 GLN CB C 13 33.9650 . . . . . . A 5 GLN CB . 30157 1 38 . 1 1 5 5 GLN CG C 13 34.1229 . . . . . . A 5 GLN CG . 30157 1 39 . 1 1 5 5 GLN N N 15 121.1022 . . . . . . A 5 GLN N . 30157 1 40 . 1 1 5 5 GLN NE2 N 15 111.1310 . . . . . . A 5 GLN NE2 . 30157 1 41 . 1 1 6 6 THR H H 1 8.5298 . . . . . . A 6 THR H . 30157 1 42 . 1 1 6 6 THR HA H 1 5.1139 . . . . . . A 6 THR HA . 30157 1 43 . 1 1 6 6 THR HB H 1 3.9461 . . . . . . A 6 THR HB . 30157 1 44 . 1 1 6 6 THR HG21 H 1 1.0800 . . . . . . A 6 THR HG21 . 30157 1 45 . 1 1 6 6 THR HG22 H 1 1.0800 . . . . . . A 6 THR HG22 . 30157 1 46 . 1 1 6 6 THR HG23 H 1 1.0800 . . . . . . A 6 THR HG23 . 30157 1 47 . 1 1 6 6 THR C C 13 174.1390 . . . . . . A 6 THR C . 30157 1 48 . 1 1 6 6 THR CA C 13 62.1039 . . . . . . A 6 THR CA . 30157 1 49 . 1 1 6 6 THR CB C 13 69.9581 . . . . . . A 6 THR CB . 30157 1 50 . 1 1 6 6 THR CG2 C 13 22.0828 . . . . . . A 6 THR CG2 . 30157 1 51 . 1 1 6 6 THR N N 15 119.8864 . . . . . . A 6 THR N . 30157 1 52 . 1 1 7 7 VAL H H 1 9.1488 . . . . . . A 7 VAL H . 30157 1 53 . 1 1 7 7 VAL HA H 1 4.4920 . . . . . . A 7 VAL HA . 30157 1 54 . 1 1 7 7 VAL HB H 1 1.9142 . . . . . . A 7 VAL HB . 30157 1 55 . 1 1 7 7 VAL HG11 H 1 0.7790 . . . . . . A 7 VAL HG11 . 30157 1 56 . 1 1 7 7 VAL HG12 H 1 0.7790 . . . . . . A 7 VAL HG12 . 30157 1 57 . 1 1 7 7 VAL HG13 H 1 0.7790 . . . . . . A 7 VAL HG13 . 30157 1 58 . 1 1 7 7 VAL HG21 H 1 0.7790 . . . . . . A 7 VAL HG21 . 30157 1 59 . 1 1 7 7 VAL HG22 H 1 0.7790 . . . . . . A 7 VAL HG22 . 30157 1 60 . 1 1 7 7 VAL HG23 H 1 0.7790 . . . . . . A 7 VAL HG23 . 30157 1 61 . 1 1 7 7 VAL C C 13 173.3050 . . . . . . A 7 VAL C . 30157 1 62 . 1 1 7 7 VAL CA C 13 60.0329 . . . . . . A 7 VAL CA . 30157 1 63 . 1 1 7 7 VAL CB C 13 35.3614 . . . . . . A 7 VAL CB . 30157 1 64 . 1 1 7 7 VAL CG1 C 13 20.9855 . . . . . . A 7 VAL CG1 . 30157 1 65 . 1 1 7 7 VAL CG2 C 13 20.9855 . . . . . . A 7 VAL CG2 . 30157 1 66 . 1 1 7 7 VAL N N 15 123.7901 . . . . . . A 7 VAL N . 30157 1 67 . 1 1 8 8 GLU H H 1 8.3788 . . . . . . A 8 GLU H . 30157 1 68 . 1 1 8 8 GLU HA H 1 4.5680 . . . . . . A 8 GLU HA . 30157 1 69 . 1 1 8 8 GLU HB2 H 1 1.9320 . . . . . . A 8 GLU HB2 . 30157 1 70 . 1 1 8 8 GLU HB3 H 1 1.9320 . . . . . . A 8 GLU HB3 . 30157 1 71 . 1 1 8 8 GLU C C 13 175.9020 . . . . . . A 8 GLU C . 30157 1 72 . 1 1 8 8 GLU CA C 13 55.5632 . . . . . . A 8 GLU CA . 30157 1 73 . 1 1 8 8 GLU CB C 13 30.8907 . . . . . . A 8 GLU CB . 30157 1 74 . 1 1 8 8 GLU CG C 13 36.5510 . . . . . . A 8 GLU CG . 30157 1 75 . 1 1 8 8 GLU N N 15 124.9014 . . . . . . A 8 GLU N . 30157 1 76 . 1 1 9 9 ILE H H 1 8.4600 . . . . . . A 9 ILE H . 30157 1 77 . 1 1 9 9 ILE HA H 1 4.2610 . . . . . . A 9 ILE HA . 30157 1 78 . 1 1 9 9 ILE HB H 1 2.0991 . . . . . . A 9 ILE HB . 30157 1 79 . 1 1 9 9 ILE HG12 H 1 1.1880 . . . . . . A 9 ILE HG12 . 30157 1 80 . 1 1 9 9 ILE HG13 H 1 1.1880 . . . . . . A 9 ILE HG13 . 30157 1 81 . 1 1 9 9 ILE HG21 H 1 0.8330 . . . . . . A 9 ILE HG21 . 30157 1 82 . 1 1 9 9 ILE HG22 H 1 0.8330 . . . . . . A 9 ILE HG22 . 30157 1 83 . 1 1 9 9 ILE HG23 H 1 0.8330 . . . . . . A 9 ILE HG23 . 30157 1 84 . 1 1 9 9 ILE HD11 H 1 0.6400 . . . . . . A 9 ILE HD11 . 30157 1 85 . 1 1 9 9 ILE HD12 H 1 0.6400 . . . . . . A 9 ILE HD12 . 30157 1 86 . 1 1 9 9 ILE HD13 H 1 0.6400 . . . . . . A 9 ILE HD13 . 30157 1 87 . 1 1 9 9 ILE C C 13 176.4490 . . . . . . A 9 ILE C . 30157 1 88 . 1 1 9 9 ILE CA C 13 59.8812 . . . . . . A 9 ILE CA . 30157 1 89 . 1 1 9 9 ILE CB C 13 36.1530 . . . . . . A 9 ILE CB . 30157 1 90 . 1 1 9 9 ILE CG1 C 13 26.8536 . . . . . . A 9 ILE CG1 . 30157 1 91 . 1 1 9 9 ILE CG2 C 13 17.7576 . . . . . . A 9 ILE CG2 . 30157 1 92 . 1 1 9 9 ILE CD1 C 13 11.2058 . . . . . . A 9 ILE CD1 . 30157 1 93 . 1 1 9 9 ILE N N 15 125.2729 . . . . . . A 9 ILE N . 30157 1 94 . 1 1 10 10 THR H H 1 8.2292 . . . . . . A 10 THR H . 30157 1 95 . 1 1 10 10 THR HA H 1 4.4942 . . . . . . A 10 THR HA . 30157 1 96 . 1 1 10 10 THR HB H 1 4.3410 . . . . . . A 10 THR HB . 30157 1 97 . 1 1 10 10 THR HG21 H 1 1.2420 . . . . . . A 10 THR HG21 . 30157 1 98 . 1 1 10 10 THR HG22 H 1 1.2420 . . . . . . A 10 THR HG22 . 30157 1 99 . 1 1 10 10 THR HG23 H 1 1.2420 . . . . . . A 10 THR HG23 . 30157 1 100 . 1 1 10 10 THR CA C 13 61.6174 . . . . . . A 10 THR CA . 30157 1 101 . 1 1 10 10 THR CB C 13 70.4432 . . . . . . A 10 THR CB . 30157 1 102 . 1 1 10 10 THR CG2 C 13 21.4765 . . . . . . A 10 THR CG2 . 30157 1 103 . 1 1 10 10 THR N N 15 119.2384 . . . . . . A 10 THR N . 30157 1 104 . 1 1 11 11 ASN H H 1 8.5197 . . . . . . A 11 ASN H . 30157 1 105 . 1 1 11 11 ASN HA H 1 4.7311 . . . . . . A 11 ASN HA . 30157 1 106 . 1 1 11 11 ASN HB2 H 1 2.8416 . . . . . . A 11 ASN HB2 . 30157 1 107 . 1 1 11 11 ASN HB3 H 1 2.8416 . . . . . . A 11 ASN HB3 . 30157 1 108 . 1 1 11 11 ASN HD21 H 1 7.5660 . . . . . . A 11 ASN HD21 . 30157 1 109 . 1 1 11 11 ASN HD22 H 1 6.8670 . . . . . . A 11 ASN HD22 . 30157 1 110 . 1 1 11 11 ASN C C 13 175.4560 . . . . . . A 11 ASN C . 30157 1 111 . 1 1 11 11 ASN CA C 13 53.4333 . . . . . . A 11 ASN CA . 30157 1 112 . 1 1 11 11 ASN CB C 13 38.7984 . . . . . . A 11 ASN CB . 30157 1 113 . 1 1 11 11 ASN N N 15 119.8662 . . . . . . A 11 ASN N . 30157 1 114 . 1 1 11 11 ASN ND2 N 15 111.5285 . . . . . . A 11 ASN ND2 . 30157 1 115 . 1 1 12 12 LYS H H 1 8.2582 . . . . . . A 12 LYS H . 30157 1 116 . 1 1 12 12 LYS HA H 1 4.2636 . . . . . . A 12 LYS HA . 30157 1 117 . 1 1 12 12 LYS HB2 H 1 1.7817 . . . . . . A 12 LYS HB2 . 30157 1 118 . 1 1 12 12 LYS HB3 H 1 1.7817 . . . . . . A 12 LYS HB3 . 30157 1 119 . 1 1 12 12 LYS C C 13 176.7670 . . . . . . A 12 LYS C . 30157 1 120 . 1 1 12 12 LYS CA C 13 57.0272 . . . . . . A 12 LYS CA . 30157 1 121 . 1 1 12 12 LYS CB C 13 32.9601 . . . . . . A 12 LYS CB . 30157 1 122 . 1 1 12 12 LYS CG C 13 24.8665 . . . . . . A 12 LYS CG . 30157 1 123 . 1 1 12 12 LYS CD C 13 28.9541 . . . . . . A 12 LYS CD . 30157 1 124 . 1 1 12 12 LYS CE C 13 42.4435 . . . . . . A 12 LYS CE . 30157 1 125 . 1 1 12 12 LYS N N 15 121.1008 . . . . . . A 12 LYS N . 30157 1 126 . 1 1 13 13 LEU H H 1 8.0932 . . . . . . A 13 LEU H . 30157 1 127 . 1 1 13 13 LEU HA H 1 4.3012 . . . . . . A 13 LEU HA . 30157 1 128 . 1 1 13 13 LEU HB2 H 1 1.6250 . . . . . . A 13 LEU HB2 . 30157 1 129 . 1 1 13 13 LEU HB3 H 1 1.6250 . . . . . . A 13 LEU HB3 . 30157 1 130 . 1 1 13 13 LEU HD11 H 1 0.9150 . . . . . . A 13 LEU HD11 . 30157 1 131 . 1 1 13 13 LEU HD12 H 1 0.9150 . . . . . . A 13 LEU HD12 . 30157 1 132 . 1 1 13 13 LEU HD13 H 1 0.9150 . . . . . . A 13 LEU HD13 . 30157 1 133 . 1 1 13 13 LEU HD21 H 1 0.9150 . . . . . . A 13 LEU HD21 . 30157 1 134 . 1 1 13 13 LEU HD22 H 1 0.9150 . . . . . . A 13 LEU HD22 . 30157 1 135 . 1 1 13 13 LEU HD23 H 1 0.9150 . . . . . . A 13 LEU HD23 . 30157 1 136 . 1 1 13 13 LEU C C 13 177.6700 . . . . . . A 13 LEU C . 30157 1 137 . 1 1 13 13 LEU CA C 13 55.7251 . . . . . . A 13 LEU CA . 30157 1 138 . 1 1 13 13 LEU CB C 13 42.2979 . . . . . . A 13 LEU CB . 30157 1 139 . 1 1 13 13 LEU CD1 C 13 25.0522 . . . . . . A 13 LEU CD1 . 30157 1 140 . 1 1 13 13 LEU CD2 C 13 23.8298 . . . . . . A 13 LEU CD2 . 30157 1 141 . 1 1 13 13 LEU N N 15 121.5541 . . . . . . A 13 LEU N . 30157 1 142 . 1 1 14 14 GLY H H 1 8.2160 . . . . . . A 14 GLY H . 30157 1 143 . 1 1 14 14 GLY HA2 H 1 4.6780 . . . . . . A 14 GLY HA2 . 30157 1 144 . 1 1 14 14 GLY HA3 H 1 3.9510 . . . . . . A 14 GLY HA3 . 30157 1 145 . 1 1 14 14 GLY C C 13 174.5510 . . . . . . A 14 GLY C . 30157 1 146 . 1 1 14 14 GLY CA C 13 45.5943 . . . . . . A 14 GLY CA . 30157 1 147 . 1 1 14 14 GLY N N 15 108.2917 . . . . . . A 14 GLY N . 30157 1 148 . 1 1 15 15 MET H H 1 8.0271 . . . . . . A 15 MET H . 30157 1 149 . 1 1 15 15 MET CA C 13 56.2086 . . . . . . A 15 MET CA . 30157 1 150 . 1 1 15 15 MET CB C 13 30.3812 . . . . . . A 15 MET CB . 30157 1 151 . 1 1 15 15 MET CG C 13 30.1783 . . . . . . A 15 MET CG . 30157 1 152 . 1 1 15 15 MET N N 15 120.8765 . . . . . . A 15 MET N . 30157 1 153 . 1 1 16 16 HIS H H 1 7.6220 . . . . . . A 16 HIS H . 30157 1 154 . 1 1 16 16 HIS C C 13 175.0350 . . . . . . A 16 HIS C . 30157 1 155 . 1 1 16 16 HIS CA C 13 56.3382 . . . . . . A 16 HIS CA . 30157 1 156 . 1 1 16 16 HIS CB C 13 30.5400 . . . . . . A 16 HIS CB . 30157 1 157 . 1 1 16 16 HIS N N 15 122.7142 . . . . . . A 16 HIS N . 30157 1 158 . 1 1 17 17 ALA H H 1 7.8948 . . . . . . A 17 ALA H . 30157 1 159 . 1 1 17 17 ALA HB1 H 1 1.3590 . . . . . . A 17 ALA HB1 . 30157 1 160 . 1 1 17 17 ALA HB2 H 1 1.3590 . . . . . . A 17 ALA HB2 . 30157 1 161 . 1 1 17 17 ALA HB3 H 1 1.3590 . . . . . . A 17 ALA HB3 . 30157 1 162 . 1 1 17 17 ALA C C 13 177.2220 . . . . . . A 17 ALA C . 30157 1 163 . 1 1 17 17 ALA CA C 13 52.7836 . . . . . . A 17 ALA CA . 30157 1 164 . 1 1 17 17 ALA CB C 13 19.4618 . . . . . . A 17 ALA CB . 30157 1 165 . 1 1 17 17 ALA N N 15 123.3472 . . . . . . A 17 ALA N . 30157 1 166 . 1 1 18 18 ARG H H 1 8.2910 . . . . . . A 18 ARG H . 30157 1 167 . 1 1 18 18 ARG N N 15 119.1488 . . . . . . A 18 ARG N . 30157 1 168 . 1 1 19 19 PRO C C 13 177.3200 . . . . . . A 19 PRO C . 30157 1 169 . 1 1 19 19 PRO CA C 13 64.5695 . . . . . . A 19 PRO CA . 30157 1 170 . 1 1 19 19 PRO CB C 13 31.7476 . . . . . . A 19 PRO CB . 30157 1 171 . 1 1 20 20 ALA H H 1 8.3287 . . . . . . A 20 ALA H . 30157 1 172 . 1 1 20 20 ALA HB1 H 1 1.3790 . . . . . . A 20 ALA HB1 . 30157 1 173 . 1 1 20 20 ALA HB2 H 1 1.3790 . . . . . . A 20 ALA HB2 . 30157 1 174 . 1 1 20 20 ALA HB3 H 1 1.3790 . . . . . . A 20 ALA HB3 . 30157 1 175 . 1 1 20 20 ALA C C 13 178.4810 . . . . . . A 20 ALA C . 30157 1 176 . 1 1 20 20 ALA CA C 13 54.5476 . . . . . . A 20 ALA CA . 30157 1 177 . 1 1 20 20 ALA CB C 13 19.0466 . . . . . . A 20 ALA CB . 30157 1 178 . 1 1 20 20 ALA N N 15 120.5885 . . . . . . A 20 ALA N . 30157 1 179 . 1 1 21 21 MET H H 1 7.9181 . . . . . . A 21 MET H . 30157 1 180 . 1 1 21 21 MET HA H 1 4.3110 . . . . . . A 21 MET HA . 30157 1 181 . 1 1 21 21 MET HB2 H 1 2.1220 . . . . . . A 21 MET HB2 . 30157 1 182 . 1 1 21 21 MET HB3 H 1 2.1220 . . . . . . A 21 MET HB3 . 30157 1 183 . 1 1 21 21 MET HG2 H 1 2.5480 . . . . . . A 21 MET HG2 . 30157 1 184 . 1 1 21 21 MET HG3 H 1 2.6810 . . . . . . A 21 MET HG3 . 30157 1 185 . 1 1 21 21 MET C C 13 177.6230 . . . . . . A 21 MET C . 30157 1 186 . 1 1 21 21 MET CA C 13 57.0202 . . . . . . A 21 MET CA . 30157 1 187 . 1 1 21 21 MET CB C 13 32.4492 . . . . . . A 21 MET CB . 30157 1 188 . 1 1 21 21 MET N N 15 115.3113 . . . . . . A 21 MET N . 30157 1 189 . 1 1 22 22 LYS H H 1 7.8781 . . . . . . A 22 LYS H . 30157 1 190 . 1 1 22 22 LYS HA H 1 4.3192 . . . . . . A 22 LYS HA . 30157 1 191 . 1 1 22 22 LYS C C 13 177.8520 . . . . . . A 22 LYS C . 30157 1 192 . 1 1 22 22 LYS CA C 13 56.9801 . . . . . . A 22 LYS CA . 30157 1 193 . 1 1 22 22 LYS CB C 13 32.3837 . . . . . . A 22 LYS CB . 30157 1 194 . 1 1 22 22 LYS CG C 13 24.7204 . . . . . . A 22 LYS CG . 30157 1 195 . 1 1 22 22 LYS CD C 13 28.4655 . . . . . . A 22 LYS CD . 30157 1 196 . 1 1 22 22 LYS N N 15 119.3446 . . . . . . A 22 LYS N . 30157 1 197 . 1 1 23 23 LEU H H 1 7.8868 . . . . . . A 23 LEU H . 30157 1 198 . 1 1 23 23 LEU HA H 1 3.9044 . . . . . . A 23 LEU HA . 30157 1 199 . 1 1 23 23 LEU HB2 H 1 1.5370 . . . . . . A 23 LEU HB2 . 30157 1 200 . 1 1 23 23 LEU HB3 H 1 1.7410 . . . . . . A 23 LEU HB3 . 30157 1 201 . 1 1 23 23 LEU HD11 H 1 0.8190 . . . . . . A 23 LEU HD11 . 30157 1 202 . 1 1 23 23 LEU HD12 H 1 0.8190 . . . . . . A 23 LEU HD12 . 30157 1 203 . 1 1 23 23 LEU HD13 H 1 0.8190 . . . . . . A 23 LEU HD13 . 30157 1 204 . 1 1 23 23 LEU HD21 H 1 0.8190 . . . . . . A 23 LEU HD21 . 30157 1 205 . 1 1 23 23 LEU HD22 H 1 0.8190 . . . . . . A 23 LEU HD22 . 30157 1 206 . 1 1 23 23 LEU HD23 H 1 0.8190 . . . . . . A 23 LEU HD23 . 30157 1 207 . 1 1 23 23 LEU C C 13 177.5650 . . . . . . A 23 LEU C . 30157 1 208 . 1 1 23 23 LEU CA C 13 58.5307 . . . . . . A 23 LEU CA . 30157 1 209 . 1 1 23 23 LEU CB C 13 41.9971 . . . . . . A 23 LEU CB . 30157 1 210 . 1 1 23 23 LEU CD1 C 13 25.9391 . . . . . . A 23 LEU CD1 . 30157 1 211 . 1 1 23 23 LEU CD2 C 13 24.3882 . . . . . . A 23 LEU CD2 . 30157 1 212 . 1 1 23 23 LEU N N 15 120.8266 . . . . . . A 23 LEU N . 30157 1 213 . 1 1 24 24 PHE H H 1 8.0444 . . . . . . A 24 PHE H . 30157 1 214 . 1 1 24 24 PHE HA H 1 4.2684 . . . . . . A 24 PHE HA . 30157 1 215 . 1 1 24 24 PHE HB2 H 1 3.2220 . . . . . . A 24 PHE HB2 . 30157 1 216 . 1 1 24 24 PHE HB3 H 1 3.2220 . . . . . . A 24 PHE HB3 . 30157 1 217 . 1 1 24 24 PHE C C 13 178.0770 . . . . . . A 24 PHE C . 30157 1 218 . 1 1 24 24 PHE CA C 13 60.4983 . . . . . . A 24 PHE CA . 30157 1 219 . 1 1 24 24 PHE CB C 13 38.2213 . . . . . . A 24 PHE CB . 30157 1 220 . 1 1 24 24 PHE N N 15 117.3373 . . . . . . A 24 PHE N . 30157 1 221 . 1 1 25 25 GLU H H 1 8.0450 . . . . . . A 25 GLU H . 30157 1 222 . 1 1 25 25 GLU HA H 1 3.9339 . . . . . . A 25 GLU HA . 30157 1 223 . 1 1 25 25 GLU HB2 H 1 2.1120 . . . . . . A 25 GLU HB2 . 30157 1 224 . 1 1 25 25 GLU HB3 H 1 2.1120 . . . . . . A 25 GLU HB3 . 30157 1 225 . 1 1 25 25 GLU HG2 H 1 2.2940 . . . . . . A 25 GLU HG2 . 30157 1 226 . 1 1 25 25 GLU HG3 H 1 2.2940 . . . . . . A 25 GLU HG3 . 30157 1 227 . 1 1 25 25 GLU C C 13 179.2650 . . . . . . A 25 GLU C . 30157 1 228 . 1 1 25 25 GLU CA C 13 59.2228 . . . . . . A 25 GLU CA . 30157 1 229 . 1 1 25 25 GLU CB C 13 29.8291 . . . . . . A 25 GLU CB . 30157 1 230 . 1 1 25 25 GLU CG C 13 36.8488 . . . . . . A 25 GLU CG . 30157 1 231 . 1 1 25 25 GLU N N 15 118.9447 . . . . . . A 25 GLU N . 30157 1 232 . 1 1 26 26 LEU H H 1 8.0273 . . . . . . A 26 LEU H . 30157 1 233 . 1 1 26 26 LEU HA H 1 4.1084 . . . . . . A 26 LEU HA . 30157 1 234 . 1 1 26 26 LEU HB2 H 1 1.5900 . . . . . . A 26 LEU HB2 . 30157 1 235 . 1 1 26 26 LEU HB3 H 1 1.7980 . . . . . . A 26 LEU HB3 . 30157 1 236 . 1 1 26 26 LEU HD11 H 1 0.9160 . . . . . . A 26 LEU HD11 . 30157 1 237 . 1 1 26 26 LEU HD12 H 1 0.9160 . . . . . . A 26 LEU HD12 . 30157 1 238 . 1 1 26 26 LEU HD13 H 1 0.9160 . . . . . . A 26 LEU HD13 . 30157 1 239 . 1 1 26 26 LEU HD21 H 1 0.9160 . . . . . . A 26 LEU HD21 . 30157 1 240 . 1 1 26 26 LEU HD22 H 1 0.9160 . . . . . . A 26 LEU HD22 . 30157 1 241 . 1 1 26 26 LEU HD23 H 1 0.9160 . . . . . . A 26 LEU HD23 . 30157 1 242 . 1 1 26 26 LEU C C 13 179.6860 . . . . . . A 26 LEU C . 30157 1 243 . 1 1 26 26 LEU CA C 13 57.6762 . . . . . . A 26 LEU CA . 30157 1 244 . 1 1 26 26 LEU CB C 13 42.8469 . . . . . . A 26 LEU CB . 30157 1 245 . 1 1 26 26 LEU CD2 C 13 25.3686 . . . . . . A 26 LEU CD2 . 30157 1 246 . 1 1 26 26 LEU N N 15 120.6436 . . . . . . A 26 LEU N . 30157 1 247 . 1 1 27 27 MET H H 1 8.0317 . . . . . . A 27 MET H . 30157 1 248 . 1 1 27 27 MET HA H 1 4.4835 . . . . . . A 27 MET HA . 30157 1 249 . 1 1 27 27 MET HB2 H 1 2.1700 . . . . . . A 27 MET HB2 . 30157 1 250 . 1 1 27 27 MET HB3 H 1 2.1700 . . . . . . A 27 MET HB3 . 30157 1 251 . 1 1 27 27 MET HG2 H 1 2.5760 . . . . . . A 27 MET HG2 . 30157 1 252 . 1 1 27 27 MET HG3 H 1 2.5760 . . . . . . A 27 MET HG3 . 30157 1 253 . 1 1 27 27 MET C C 13 178.1860 . . . . . . A 27 MET C . 30157 1 254 . 1 1 27 27 MET CA C 13 56.7485 . . . . . . A 27 MET CA . 30157 1 255 . 1 1 27 27 MET CB C 13 31.8844 . . . . . . A 27 MET CB . 30157 1 256 . 1 1 27 27 MET CG C 13 32.1651 . . . . . . A 27 MET CG . 30157 1 257 . 1 1 27 27 MET N N 15 114.9596 . . . . . . A 27 MET N . 30157 1 258 . 1 1 28 28 GLN H H 1 7.4384 . . . . . . A 28 GLN H . 30157 1 259 . 1 1 28 28 GLN HA H 1 4.2167 . . . . . . A 28 GLN HA . 30157 1 260 . 1 1 28 28 GLN HB2 H 1 2.0510 . . . . . . A 28 GLN HB2 . 30157 1 261 . 1 1 28 28 GLN HB3 H 1 2.0510 . . . . . . A 28 GLN HB3 . 30157 1 262 . 1 1 28 28 GLN HG2 H 1 2.3520 . . . . . . A 28 GLN HG2 . 30157 1 263 . 1 1 28 28 GLN HG3 H 1 2.3520 . . . . . . A 28 GLN HG3 . 30157 1 264 . 1 1 28 28 GLN HE21 H 1 7.1210 . . . . . . A 28 GLN HE21 . 30157 1 265 . 1 1 28 28 GLN HE22 H 1 6.7320 . . . . . . A 28 GLN HE22 . 30157 1 266 . 1 1 28 28 GLN C C 13 176.8890 . . . . . . A 28 GLN C . 30157 1 267 . 1 1 28 28 GLN CA C 13 57.2849 . . . . . . A 28 GLN CA . 30157 1 268 . 1 1 28 28 GLN CB C 13 28.6870 . . . . . . A 28 GLN CB . 30157 1 269 . 1 1 28 28 GLN CG C 13 34.0850 . . . . . . A 28 GLN CG . 30157 1 270 . 1 1 28 28 GLN N N 15 116.7112 . . . . . . A 28 GLN N . 30157 1 271 . 1 1 28 28 GLN NE2 N 15 111.6595 . . . . . . A 28 GLN NE2 . 30157 1 272 . 1 1 29 29 GLY H H 1 7.5727 . . . . . . A 29 GLY H . 30157 1 273 . 1 1 29 29 GLY HA2 H 1 4.0244 . . . . . . A 29 GLY HA2 . 30157 1 274 . 1 1 29 29 GLY HA3 H 1 3.4250 . . . . . . A 29 GLY HA3 . 30157 1 275 . 1 1 29 29 GLY C C 13 173.1210 . . . . . . A 29 GLY C . 30157 1 276 . 1 1 29 29 GLY CA C 13 45.1331 . . . . . . A 29 GLY CA . 30157 1 277 . 1 1 29 29 GLY N N 15 104.4387 . . . . . . A 29 GLY N . 30157 1 278 . 1 1 30 30 PHE H H 1 7.4452 . . . . . . A 30 PHE H . 30157 1 279 . 1 1 30 30 PHE HA H 1 4.9115 . . . . . . A 30 PHE HA . 30157 1 280 . 1 1 30 30 PHE HB2 H 1 2.7270 . . . . . . A 30 PHE HB2 . 30157 1 281 . 1 1 30 30 PHE HB3 H 1 2.7270 . . . . . . A 30 PHE HB3 . 30157 1 282 . 1 1 30 30 PHE C C 13 174.8000 . . . . . . A 30 PHE C . 30157 1 283 . 1 1 30 30 PHE CA C 13 56.5768 . . . . . . A 30 PHE CA . 30157 1 284 . 1 1 30 30 PHE CB C 13 43.1785 . . . . . . A 30 PHE CB . 30157 1 285 . 1 1 30 30 PHE N N 15 116.1865 . . . . . . A 30 PHE N . 30157 1 286 . 1 1 31 31 ASP H H 1 9.2212 . . . . . . A 31 ASP H . 30157 1 287 . 1 1 31 31 ASP HA H 1 4.8246 . . . . . . A 31 ASP HA . 30157 1 288 . 1 1 31 31 ASP HB2 H 1 2.4640 . . . . . . A 31 ASP HB2 . 30157 1 289 . 1 1 31 31 ASP HB3 H 1 2.8390 . . . . . . A 31 ASP HB3 . 30157 1 290 . 1 1 31 31 ASP C C 13 174.1940 . . . . . . A 31 ASP C . 30157 1 291 . 1 1 31 31 ASP CA C 13 52.1726 . . . . . . A 31 ASP CA . 30157 1 292 . 1 1 31 31 ASP CB C 13 38.5959 . . . . . . A 31 ASP CB . 30157 1 293 . 1 1 31 31 ASP N N 15 122.8482 . . . . . . A 31 ASP N . 30157 1 294 . 1 1 32 32 ALA H H 1 7.6706 . . . . . . A 32 ALA H . 30157 1 295 . 1 1 32 32 ALA HA H 1 4.5518 . . . . . . A 32 ALA HA . 30157 1 296 . 1 1 32 32 ALA HB1 H 1 0.7940 . . . . . . A 32 ALA HB1 . 30157 1 297 . 1 1 32 32 ALA HB2 H 1 0.7940 . . . . . . A 32 ALA HB2 . 30157 1 298 . 1 1 32 32 ALA HB3 H 1 0.7940 . . . . . . A 32 ALA HB3 . 30157 1 299 . 1 1 32 32 ALA C C 13 174.8960 . . . . . . A 32 ALA C . 30157 1 300 . 1 1 32 32 ALA CA C 13 51.9568 . . . . . . A 32 ALA CA . 30157 1 301 . 1 1 32 32 ALA CB C 13 20.2974 . . . . . . A 32 ALA CB . 30157 1 302 . 1 1 32 32 ALA N N 15 121.6880 . . . . . . A 32 ALA N . 30157 1 303 . 1 1 33 33 GLU H H 1 8.6277 . . . . . . A 33 GLU H . 30157 1 304 . 1 1 33 33 GLU HA H 1 4.6914 . . . . . . A 33 GLU HA . 30157 1 305 . 1 1 33 33 GLU HB2 H 1 1.9790 . . . . . . A 33 GLU HB2 . 30157 1 306 . 1 1 33 33 GLU HB3 H 1 2.1430 . . . . . . A 33 GLU HB3 . 30157 1 307 . 1 1 33 33 GLU HG2 H 1 2.2950 . . . . . . A 33 GLU HG2 . 30157 1 308 . 1 1 33 33 GLU HG3 H 1 2.2950 . . . . . . A 33 GLU HG3 . 30157 1 309 . 1 1 33 33 GLU C C 13 175.9470 . . . . . . A 33 GLU C . 30157 1 310 . 1 1 33 33 GLU CA C 13 55.3658 . . . . . . A 33 GLU CA . 30157 1 311 . 1 1 33 33 GLU CB C 13 32.0983 . . . . . . A 33 GLU CB . 30157 1 312 . 1 1 33 33 GLU N N 15 120.9597 . . . . . . A 33 GLU N . 30157 1 313 . 1 1 34 34 VAL H H 1 8.7117 . . . . . . A 34 VAL H . 30157 1 314 . 1 1 34 34 VAL HA H 1 5.1070 . . . . . . A 34 VAL HA . 30157 1 315 . 1 1 34 34 VAL HB H 1 1.9179 . . . . . . A 34 VAL HB . 30157 1 316 . 1 1 34 34 VAL HG11 H 1 0.7690 . . . . . . A 34 VAL HG11 . 30157 1 317 . 1 1 34 34 VAL HG12 H 1 0.7690 . . . . . . A 34 VAL HG12 . 30157 1 318 . 1 1 34 34 VAL HG13 H 1 0.7690 . . . . . . A 34 VAL HG13 . 30157 1 319 . 1 1 34 34 VAL HG21 H 1 0.7690 . . . . . . A 34 VAL HG21 . 30157 1 320 . 1 1 34 34 VAL HG22 H 1 0.7690 . . . . . . A 34 VAL HG22 . 30157 1 321 . 1 1 34 34 VAL HG23 H 1 0.7690 . . . . . . A 34 VAL HG23 . 30157 1 322 . 1 1 34 34 VAL C C 13 173.9150 . . . . . . A 34 VAL C . 30157 1 323 . 1 1 34 34 VAL CA C 13 61.0242 . . . . . . A 34 VAL CA . 30157 1 324 . 1 1 34 34 VAL CB C 13 33.9656 . . . . . . A 34 VAL CB . 30157 1 325 . 1 1 34 34 VAL CG1 C 13 21.6764 . . . . . . A 34 VAL CG1 . 30157 1 326 . 1 1 34 34 VAL CG2 C 13 21.6764 . . . . . . A 34 VAL CG2 . 30157 1 327 . 1 1 34 34 VAL N N 15 125.7192 . . . . . . A 34 VAL N . 30157 1 328 . 1 1 35 35 LEU H H 1 9.4206 . . . . . . A 35 LEU H . 30157 1 329 . 1 1 35 35 LEU HA H 1 4.9271 . . . . . . A 35 LEU HA . 30157 1 330 . 1 1 35 35 LEU HB2 H 1 1.5130 . . . . . . A 35 LEU HB2 . 30157 1 331 . 1 1 35 35 LEU HB3 H 1 1.5130 . . . . . . A 35 LEU HB3 . 30157 1 332 . 1 1 35 35 LEU C C 13 174.5220 . . . . . . A 35 LEU C . 30157 1 333 . 1 1 35 35 LEU CA C 13 53.5092 . . . . . . A 35 LEU CA . 30157 1 334 . 1 1 35 35 LEU CB C 13 46.1459 . . . . . . A 35 LEU CB . 30157 1 335 . 1 1 35 35 LEU CD1 C 13 24.9838 . . . . . . A 35 LEU CD1 . 30157 1 336 . 1 1 35 35 LEU CD2 C 13 24.9838 . . . . . . A 35 LEU CD2 . 30157 1 337 . 1 1 35 35 LEU N N 15 129.3410 . . . . . . A 35 LEU N . 30157 1 338 . 1 1 36 36 LEU H H 1 8.7921 . . . . . . A 36 LEU H . 30157 1 339 . 1 1 36 36 LEU HA H 1 5.3388 . . . . . . A 36 LEU HA . 30157 1 340 . 1 1 36 36 LEU HB2 H 1 1.3440 . . . . . . A 36 LEU HB2 . 30157 1 341 . 1 1 36 36 LEU HB3 H 1 1.7620 . . . . . . A 36 LEU HB3 . 30157 1 342 . 1 1 36 36 LEU HD11 H 1 0.9160 . . . . . . A 36 LEU HD11 . 30157 1 343 . 1 1 36 36 LEU HD12 H 1 0.9160 . . . . . . A 36 LEU HD12 . 30157 1 344 . 1 1 36 36 LEU HD13 H 1 0.9160 . . . . . . A 36 LEU HD13 . 30157 1 345 . 1 1 36 36 LEU HD21 H 1 0.6820 . . . . . . A 36 LEU HD21 . 30157 1 346 . 1 1 36 36 LEU HD22 H 1 0.6820 . . . . . . A 36 LEU HD22 . 30157 1 347 . 1 1 36 36 LEU HD23 H 1 0.6820 . . . . . . A 36 LEU HD23 . 30157 1 348 . 1 1 36 36 LEU C C 13 175.8450 . . . . . . A 36 LEU C . 30157 1 349 . 1 1 36 36 LEU CA C 13 53.1732 . . . . . . A 36 LEU CA . 30157 1 350 . 1 1 36 36 LEU CB C 13 44.5680 . . . . . . A 36 LEU CB . 30157 1 351 . 1 1 36 36 LEU CG C 13 28.3238 . . . . . . A 36 LEU CG . 30157 1 352 . 1 1 36 36 LEU CD1 C 13 25.9599 . . . . . . A 36 LEU CD1 . 30157 1 353 . 1 1 36 36 LEU CD2 C 13 25.1060 . . . . . . A 36 LEU CD2 . 30157 1 354 . 1 1 36 36 LEU N N 15 120.5669 . . . . . . A 36 LEU N . 30157 1 355 . 1 1 37 37 ARG H H 1 9.0474 . . . . . . A 37 ARG H . 30157 1 356 . 1 1 37 37 ARG HA H 1 5.4260 . . . . . . A 37 ARG HA . 30157 1 357 . 1 1 37 37 ARG HB2 H 1 1.5810 . . . . . . A 37 ARG HB2 . 30157 1 358 . 1 1 37 37 ARG HG2 H 1 1.3520 . . . . . . A 37 ARG HG2 . 30157 1 359 . 1 1 37 37 ARG HG3 H 1 1.6920 . . . . . . A 37 ARG HG3 . 30157 1 360 . 1 1 37 37 ARG HD2 H 1 3.2050 . . . . . . A 37 ARG HD2 . 30157 1 361 . 1 1 37 37 ARG HD3 H 1 3.2050 . . . . . . A 37 ARG HD3 . 30157 1 362 . 1 1 37 37 ARG C C 13 175.8390 . . . . . . A 37 ARG C . 30157 1 363 . 1 1 37 37 ARG CA C 13 54.4537 . . . . . . A 37 ARG CA . 30157 1 364 . 1 1 37 37 ARG CB C 13 34.3680 . . . . . . A 37 ARG CB . 30157 1 365 . 1 1 37 37 ARG CG C 13 28.3577 . . . . . . A 37 ARG CG . 30157 1 366 . 1 1 37 37 ARG CD C 13 43.2600 . . . . . . A 37 ARG CD . 30157 1 367 . 1 1 37 37 ARG N N 15 120.9329 . . . . . . A 37 ARG N . 30157 1 368 . 1 1 38 38 ASN H H 1 8.2780 . . . . . . A 38 ASN H . 30157 1 369 . 1 1 38 38 ASN HA H 1 5.1258 . . . . . . A 38 ASN HA . 30157 1 370 . 1 1 38 38 ASN HB2 H 1 2.8490 . . . . . . A 38 ASN HB2 . 30157 1 371 . 1 1 38 38 ASN HB3 H 1 3.5980 . . . . . . A 38 ASN HB3 . 30157 1 372 . 1 1 38 38 ASN HD21 H 1 7.5330 . . . . . . A 38 ASN HD21 . 30157 1 373 . 1 1 38 38 ASN HD22 H 1 7.1990 . . . . . . A 38 ASN HD22 . 30157 1 374 . 1 1 38 38 ASN C C 13 176.7060 . . . . . . A 38 ASN C . 30157 1 375 . 1 1 38 38 ASN CA C 13 50.9067 . . . . . . A 38 ASN CA . 30157 1 376 . 1 1 38 38 ASN CB C 13 39.5969 . . . . . . A 38 ASN CB . 30157 1 377 . 1 1 38 38 ASN N N 15 121.8791 . . . . . . A 38 ASN N . 30157 1 378 . 1 1 38 38 ASN ND2 N 15 109.8655 . . . . . . A 38 ASN ND2 . 30157 1 379 . 1 1 39 39 ASP H H 1 8.7647 . . . . . . A 39 ASP H . 30157 1 380 . 1 1 39 39 ASP HA H 1 4.3778 . . . . . . A 39 ASP HA . 30157 1 381 . 1 1 39 39 ASP HB2 H 1 2.7190 . . . . . . A 39 ASP HB2 . 30157 1 382 . 1 1 39 39 ASP HB3 H 1 2.8970 . . . . . . A 39 ASP HB3 . 30157 1 383 . 1 1 39 39 ASP C C 13 177.1450 . . . . . . A 39 ASP C . 30157 1 384 . 1 1 39 39 ASP CA C 13 55.8642 . . . . . . A 39 ASP CA . 30157 1 385 . 1 1 39 39 ASP CB C 13 40.1698 . . . . . . A 39 ASP CB . 30157 1 386 . 1 1 39 39 ASP N N 15 117.9439 . . . . . . A 39 ASP N . 30157 1 387 . 1 1 40 40 GLU H H 1 7.5840 . . . . . . A 40 GLU H . 30157 1 388 . 1 1 40 40 GLU HA H 1 4.3872 . . . . . . A 40 GLU HA . 30157 1 389 . 1 1 40 40 GLU HB2 H 1 2.0120 . . . . . . A 40 GLU HB2 . 30157 1 390 . 1 1 40 40 GLU HB3 H 1 2.2350 . . . . . . A 40 GLU HB3 . 30157 1 391 . 1 1 40 40 GLU C C 13 176.9550 . . . . . . A 40 GLU C . 30157 1 392 . 1 1 40 40 GLU CA C 13 56.0900 . . . . . . A 40 GLU CA . 30157 1 393 . 1 1 40 40 GLU CB C 13 32.6181 . . . . . . A 40 GLU CB . 30157 1 394 . 1 1 40 40 GLU CG C 13 36.7605 . . . . . . A 40 GLU CG . 30157 1 395 . 1 1 40 40 GLU N N 15 117.8384 . . . . . . A 40 GLU N . 30157 1 396 . 1 1 41 41 GLY H H 1 8.1039 . . . . . . A 41 GLY H . 30157 1 397 . 1 1 41 41 GLY HA2 H 1 4.2767 . . . . . . A 41 GLY HA2 . 30157 1 398 . 1 1 41 41 GLY HA3 H 1 3.6109 . . . . . . A 41 GLY HA3 . 30157 1 399 . 1 1 41 41 GLY C C 13 174.2420 . . . . . . A 41 GLY C . 30157 1 400 . 1 1 41 41 GLY CA C 13 45.1911 . . . . . . A 41 GLY CA . 30157 1 401 . 1 1 41 41 GLY N N 15 107.7380 . . . . . . A 41 GLY N . 30157 1 402 . 1 1 42 42 THR H H 1 7.9211 . . . . . . A 42 THR H . 30157 1 403 . 1 1 42 42 THR HA H 1 4.1367 . . . . . . A 42 THR HA . 30157 1 404 . 1 1 42 42 THR HB H 1 3.9130 . . . . . . A 42 THR HB . 30157 1 405 . 1 1 42 42 THR HG21 H 1 1.1590 . . . . . . A 42 THR HG21 . 30157 1 406 . 1 1 42 42 THR HG22 H 1 1.1590 . . . . . . A 42 THR HG22 . 30157 1 407 . 1 1 42 42 THR HG23 H 1 1.1590 . . . . . . A 42 THR HG23 . 30157 1 408 . 1 1 42 42 THR C C 13 172.7560 . . . . . . A 42 THR C . 30157 1 409 . 1 1 42 42 THR CA C 13 63.2892 . . . . . . A 42 THR CA . 30157 1 410 . 1 1 42 42 THR CB C 13 68.7030 . . . . . . A 42 THR CB . 30157 1 411 . 1 1 42 42 THR CG2 C 13 22.4805 . . . . . . A 42 THR CG2 . 30157 1 412 . 1 1 42 42 THR N N 15 119.7599 . . . . . . A 42 THR N . 30157 1 413 . 1 1 43 43 GLU H H 1 8.4059 . . . . . . A 43 GLU H . 30157 1 414 . 1 1 43 43 GLU HA H 1 5.2758 . . . . . . A 43 GLU HA . 30157 1 415 . 1 1 43 43 GLU HB2 H 1 1.9010 . . . . . . A 43 GLU HB2 . 30157 1 416 . 1 1 43 43 GLU HB3 H 1 1.9010 . . . . . . A 43 GLU HB3 . 30157 1 417 . 1 1 43 43 GLU HG2 H 1 2.2680 . . . . . . A 43 GLU HG2 . 30157 1 418 . 1 1 43 43 GLU HG3 H 1 2.2650 . . . . . . A 43 GLU HG3 . 30157 1 419 . 1 1 43 43 GLU C C 13 175.5630 . . . . . . A 43 GLU C . 30157 1 420 . 1 1 43 43 GLU CA C 13 54.6297 . . . . . . A 43 GLU CA . 30157 1 421 . 1 1 43 43 GLU CB C 13 32.8533 . . . . . . A 43 GLU CB . 30157 1 422 . 1 1 43 43 GLU CG C 13 36.7096 . . . . . . A 43 GLU CG . 30157 1 423 . 1 1 43 43 GLU N N 15 125.0171 . . . . . . A 43 GLU N . 30157 1 424 . 1 1 44 44 ALA H H 1 8.9812 . . . . . . A 44 ALA H . 30157 1 425 . 1 1 44 44 ALA HA H 1 4.6334 . . . . . . A 44 ALA HA . 30157 1 426 . 1 1 44 44 ALA HB1 H 1 1.2350 . . . . . . A 44 ALA HB1 . 30157 1 427 . 1 1 44 44 ALA HB2 H 1 1.2350 . . . . . . A 44 ALA HB2 . 30157 1 428 . 1 1 44 44 ALA HB3 H 1 1.2350 . . . . . . A 44 ALA HB3 . 30157 1 429 . 1 1 44 44 ALA C C 13 175.8440 . . . . . . A 44 ALA C . 30157 1 430 . 1 1 44 44 ALA CA C 13 51.2073 . . . . . . A 44 ALA CA . 30157 1 431 . 1 1 44 44 ALA CB C 13 22.5412 . . . . . . A 44 ALA CB . 30157 1 432 . 1 1 44 44 ALA N N 15 124.2489 . . . . . . A 44 ALA N . 30157 1 433 . 1 1 45 45 GLU H H 1 8.7641 . . . . . . A 45 GLU H . 30157 1 434 . 1 1 45 45 GLU HA H 1 4.5420 . . . . . . A 45 GLU HA . 30157 1 435 . 1 1 45 45 GLU HB2 H 1 2.2340 . . . . . . A 45 GLU HB2 . 30157 1 436 . 1 1 45 45 GLU HB3 H 1 2.0280 . . . . . . A 45 GLU HB3 . 30157 1 437 . 1 1 45 45 GLU HG2 H 1 2.4260 . . . . . . A 45 GLU HG2 . 30157 1 438 . 1 1 45 45 GLU HG3 H 1 2.4260 . . . . . . A 45 GLU HG3 . 30157 1 439 . 1 1 45 45 GLU C C 13 178.2580 . . . . . . A 45 GLU C . 30157 1 440 . 1 1 45 45 GLU CA C 13 56.7603 . . . . . . A 45 GLU CA . 30157 1 441 . 1 1 45 45 GLU CB C 13 30.0386 . . . . . . A 45 GLU CB . 30157 1 442 . 1 1 45 45 GLU CG C 13 36.3340 . . . . . . A 45 GLU CG . 30157 1 443 . 1 1 45 45 GLU N N 15 121.9802 . . . . . . A 45 GLU N . 30157 1 444 . 1 1 46 46 ALA H H 1 8.7108 . . . . . . A 46 ALA H . 30157 1 445 . 1 1 46 46 ALA HA H 1 3.9110 . . . . . . A 46 ALA HA . 30157 1 446 . 1 1 46 46 ALA HB1 H 1 1.3610 . . . . . . A 46 ALA HB1 . 30157 1 447 . 1 1 46 46 ALA HB2 H 1 1.3610 . . . . . . A 46 ALA HB2 . 30157 1 448 . 1 1 46 46 ALA HB3 H 1 1.3610 . . . . . . A 46 ALA HB3 . 30157 1 449 . 1 1 46 46 ALA CA C 13 54.9370 . . . . . . A 46 ALA CA . 30157 1 450 . 1 1 46 46 ALA CB C 13 18.7527 . . . . . . A 46 ALA CB . 30157 1 451 . 1 1 46 46 ALA N N 15 124.4078 . . . . . . A 46 ALA N . 30157 1 452 . 1 1 47 47 ASN HD21 H 1 7.5890 . . . . . . A 47 ASN HD21 . 30157 1 453 . 1 1 47 47 ASN HD22 H 1 6.7850 . . . . . . A 47 ASN HD22 . 30157 1 454 . 1 1 47 47 ASN C C 13 175.2680 . . . . . . A 47 ASN C . 30157 1 455 . 1 1 47 47 ASN CA C 13 52.9589 . . . . . . A 47 ASN CA . 30157 1 456 . 1 1 47 47 ASN CB C 13 37.7806 . . . . . . A 47 ASN CB . 30157 1 457 . 1 1 47 47 ASN ND2 N 15 110.8330 . . . . . . A 47 ASN ND2 . 30157 1 458 . 1 1 48 48 SER H H 1 7.8160 . . . . . . A 48 SER H . 30157 1 459 . 1 1 48 48 SER HA H 1 4.7103 . . . . . . A 48 SER HA . 30157 1 460 . 1 1 48 48 SER HB2 H 1 4.1150 . . . . . . A 48 SER HB2 . 30157 1 461 . 1 1 48 48 SER HB3 H 1 4.1150 . . . . . . A 48 SER HB3 . 30157 1 462 . 1 1 48 48 SER C C 13 175.6800 . . . . . . A 48 SER C . 30157 1 463 . 1 1 48 48 SER CA C 13 57.6643 . . . . . . A 48 SER CA . 30157 1 464 . 1 1 48 48 SER CB C 13 65.6476 . . . . . . A 48 SER CB . 30157 1 465 . 1 1 48 48 SER N N 15 114.4154 . . . . . . A 48 SER N . 30157 1 466 . 1 1 49 49 VAL H H 1 8.5863 . . . . . . A 49 VAL H . 30157 1 467 . 1 1 49 49 VAL C C 13 177.6885 . . . . . . A 49 VAL C . 30157 1 468 . 1 1 49 49 VAL CA C 13 65.6579 . . . . . . A 49 VAL CA . 30157 1 469 . 1 1 49 49 VAL CB C 13 31.6661 . . . . . . A 49 VAL CB . 30157 1 470 . 1 1 49 49 VAL CG1 C 13 21.3162 . . . . . . A 49 VAL CG1 . 30157 1 471 . 1 1 49 49 VAL CG2 C 13 21.3162 . . . . . . A 49 VAL CG2 . 30157 1 472 . 1 1 49 49 VAL N N 15 122.7974 . . . . . . A 49 VAL N . 30157 1 473 . 1 1 50 50 ILE H H 1 7.7670 . . . . . . A 50 ILE H . 30157 1 474 . 1 1 50 50 ILE HA H 1 3.7884 . . . . . . A 50 ILE HA . 30157 1 475 . 1 1 50 50 ILE HB H 1 1.8840 . . . . . . A 50 ILE HB . 30157 1 476 . 1 1 50 50 ILE HG12 H 1 1.3200 . . . . . . A 50 ILE HG12 . 30157 1 477 . 1 1 50 50 ILE HG13 H 1 1.3200 . . . . . . A 50 ILE HG13 . 30157 1 478 . 1 1 50 50 ILE HG21 H 1 0.9200 . . . . . . A 50 ILE HG21 . 30157 1 479 . 1 1 50 50 ILE HG22 H 1 0.9200 . . . . . . A 50 ILE HG22 . 30157 1 480 . 1 1 50 50 ILE HG23 H 1 0.9200 . . . . . . A 50 ILE HG23 . 30157 1 481 . 1 1 50 50 ILE HD11 H 1 0.7040 . . . . . . A 50 ILE HD11 . 30157 1 482 . 1 1 50 50 ILE HD12 H 1 0.7040 . . . . . . A 50 ILE HD12 . 30157 1 483 . 1 1 50 50 ILE HD13 H 1 0.7040 . . . . . . A 50 ILE HD13 . 30157 1 484 . 1 1 50 50 ILE C C 13 177.8940 . . . . . . A 50 ILE C . 30157 1 485 . 1 1 50 50 ILE CA C 13 63.6084 . . . . . . A 50 ILE CA . 30157 1 486 . 1 1 50 50 ILE CB C 13 37.2210 . . . . . . A 50 ILE CB . 30157 1 487 . 1 1 50 50 ILE CG1 C 13 28.4914 . . . . . . A 50 ILE CG1 . 30157 1 488 . 1 1 50 50 ILE CG2 C 13 17.8413 . . . . . . A 50 ILE CG2 . 30157 1 489 . 1 1 50 50 ILE CD1 C 13 11.9009 . . . . . . A 50 ILE CD1 . 30157 1 490 . 1 1 50 50 ILE N N 15 118.6860 . . . . . . A 50 ILE N . 30157 1 491 . 1 1 51 51 ALA H H 1 7.6619 . . . . . . A 51 ALA H . 30157 1 492 . 1 1 51 51 ALA HA H 1 3.9300 . . . . . . A 51 ALA HA . 30157 1 493 . 1 1 51 51 ALA HB1 H 1 1.5450 . . . . . . A 51 ALA HB1 . 30157 1 494 . 1 1 51 51 ALA HB2 H 1 1.5450 . . . . . . A 51 ALA HB2 . 30157 1 495 . 1 1 51 51 ALA HB3 H 1 1.5450 . . . . . . A 51 ALA HB3 . 30157 1 496 . 1 1 51 51 ALA C C 13 179.2550 . . . . . . A 51 ALA C . 30157 1 497 . 1 1 51 51 ALA CA C 13 55.3147 . . . . . . A 51 ALA CA . 30157 1 498 . 1 1 51 51 ALA CB C 13 18.8394 . . . . . . A 51 ALA CB . 30157 1 499 . 1 1 51 51 ALA N N 15 122.3972 . . . . . . A 51 ALA N . 30157 1 500 . 1 1 52 52 LEU H H 1 7.3568 . . . . . . A 52 LEU H . 30157 1 501 . 1 1 52 52 LEU HA H 1 3.9678 . . . . . . A 52 LEU HA . 30157 1 502 . 1 1 52 52 LEU HB2 H 1 1.6280 . . . . . . A 52 LEU HB2 . 30157 1 503 . 1 1 52 52 LEU HB3 H 1 1.9370 . . . . . . A 52 LEU HB3 . 30157 1 504 . 1 1 52 52 LEU C C 13 179.4500 . . . . . . A 52 LEU C . 30157 1 505 . 1 1 52 52 LEU CA C 13 57.7899 . . . . . . A 52 LEU CA . 30157 1 506 . 1 1 52 52 LEU CB C 13 41.3703 . . . . . . A 52 LEU CB . 30157 1 507 . 1 1 52 52 LEU CD1 C 13 25.2914 . . . . . . A 52 LEU CD1 . 30157 1 508 . 1 1 52 52 LEU CD2 C 13 23.4875 . . . . . . A 52 LEU CD2 . 30157 1 509 . 1 1 52 52 LEU N N 15 115.9025 . . . . . . A 52 LEU N . 30157 1 510 . 1 1 53 53 LEU H H 1 7.6450 . . . . . . A 53 LEU H . 30157 1 511 . 1 1 53 53 LEU HA H 1 4.1159 . . . . . . A 53 LEU HA . 30157 1 512 . 1 1 53 53 LEU HB2 H 1 1.6260 . . . . . . A 53 LEU HB2 . 30157 1 513 . 1 1 53 53 LEU HB3 H 1 1.8470 . . . . . . A 53 LEU HB3 . 30157 1 514 . 1 1 53 53 LEU C C 13 179.5600 . . . . . . A 53 LEU C . 30157 1 515 . 1 1 53 53 LEU CA C 13 57.6114 . . . . . . A 53 LEU CA . 30157 1 516 . 1 1 53 53 LEU CB C 13 42.0495 . . . . . . A 53 LEU CB . 30157 1 517 . 1 1 53 53 LEU N N 15 118.8754 . . . . . . A 53 LEU N . 30157 1 518 . 1 1 54 54 MET H H 1 7.9188 . . . . . . A 54 MET H . 30157 1 519 . 1 1 54 54 MET HA H 1 4.4900 . . . . . . A 54 MET HA . 30157 1 520 . 1 1 54 54 MET C C 13 178.2950 . . . . . . A 54 MET C . 30157 1 521 . 1 1 54 54 MET CA C 13 58.2835 . . . . . . A 54 MET CA . 30157 1 522 . 1 1 54 54 MET CB C 13 33.1842 . . . . . . A 54 MET CB . 30157 1 523 . 1 1 54 54 MET CG C 13 31.8471 . . . . . . A 54 MET CG . 30157 1 524 . 1 1 54 54 MET N N 15 115.0536 . . . . . . A 54 MET N . 30157 1 525 . 1 1 55 55 LEU H H 1 7.8536 . . . . . . A 55 LEU H . 30157 1 526 . 1 1 55 55 LEU HA H 1 4.0059 . . . . . . A 55 LEU HA . 30157 1 527 . 1 1 55 55 LEU HB2 H 1 1.8150 . . . . . . A 55 LEU HB2 . 30157 1 528 . 1 1 55 55 LEU HB3 H 1 1.8150 . . . . . . A 55 LEU HB3 . 30157 1 529 . 1 1 55 55 LEU HG H 1 1.4530 . . . . . . A 55 LEU HG . 30157 1 530 . 1 1 55 55 LEU CB C 13 41.9364 . . . . . . A 55 LEU CB . 30157 1 531 . 1 1 55 55 LEU N N 15 119.0956 . . . . . . A 55 LEU N . 30157 1 532 . 1 1 56 56 ASP H H 1 7.8601 . . . . . . A 56 ASP H . 30157 1 533 . 1 1 56 56 ASP HA H 1 4.4960 . . . . . . A 56 ASP HA . 30157 1 534 . 1 1 56 56 ASP HB2 H 1 2.7120 . . . . . . A 56 ASP HB2 . 30157 1 535 . 1 1 56 56 ASP C C 13 177.6290 . . . . . . A 56 ASP C . 30157 1 536 . 1 1 56 56 ASP CA C 13 56.3530 . . . . . . A 56 ASP CA . 30157 1 537 . 1 1 56 56 ASP CB C 13 41.5692 . . . . . . A 56 ASP CB . 30157 1 538 . 1 1 56 56 ASP N N 15 119.2282 . . . . . . A 56 ASP N . 30157 1 539 . 1 1 57 57 SER H H 1 7.7371 . . . . . . A 57 SER H . 30157 1 540 . 1 1 57 57 SER HA H 1 4.4580 . . . . . . A 57 SER HA . 30157 1 541 . 1 1 57 57 SER HB2 H 1 3.9400 . . . . . . A 57 SER HB2 . 30157 1 542 . 1 1 57 57 SER HB3 H 1 3.9400 . . . . . . A 57 SER HB3 . 30157 1 543 . 1 1 57 57 SER C C 13 174.5230 . . . . . . A 57 SER C . 30157 1 544 . 1 1 57 57 SER CA C 13 59.0452 . . . . . . A 57 SER CA . 30157 1 545 . 1 1 57 57 SER CB C 13 63.8639 . . . . . . A 57 SER CB . 30157 1 546 . 1 1 57 57 SER N N 15 113.0061 . . . . . . A 57 SER N . 30157 1 547 . 1 1 58 58 ALA H H 1 7.7263 . . . . . . A 58 ALA H . 30157 1 548 . 1 1 58 58 ALA HA H 1 4.3150 . . . . . . A 58 ALA HA . 30157 1 549 . 1 1 58 58 ALA HB1 H 1 1.4090 . . . . . . A 58 ALA HB1 . 30157 1 550 . 1 1 58 58 ALA HB2 H 1 1.4090 . . . . . . A 58 ALA HB2 . 30157 1 551 . 1 1 58 58 ALA HB3 H 1 1.4090 . . . . . . A 58 ALA HB3 . 30157 1 552 . 1 1 58 58 ALA C C 13 176.3680 . . . . . . A 58 ALA C . 30157 1 553 . 1 1 58 58 ALA CA C 13 52.5466 . . . . . . A 58 ALA CA . 30157 1 554 . 1 1 58 58 ALA CB C 13 19.4440 . . . . . . A 58 ALA CB . 30157 1 555 . 1 1 58 58 ALA N N 15 124.0284 . . . . . . A 58 ALA N . 30157 1 556 . 1 1 59 59 LYS H H 1 7.5739 . . . . . . A 59 LYS H . 30157 1 557 . 1 1 59 59 LYS HA H 1 3.9990 . . . . . . A 59 LYS HA . 30157 1 558 . 1 1 59 59 LYS HB2 H 1 1.7980 . . . . . . A 59 LYS HB2 . 30157 1 559 . 1 1 59 59 LYS HB3 H 1 1.7980 . . . . . . A 59 LYS HB3 . 30157 1 560 . 1 1 59 59 LYS C C 13 177.5350 . . . . . . A 59 LYS C . 30157 1 561 . 1 1 59 59 LYS CA C 13 57.8989 . . . . . . A 59 LYS CA . 30157 1 562 . 1 1 59 59 LYS CB C 13 32.5073 . . . . . . A 59 LYS CB . 30157 1 563 . 1 1 59 59 LYS CG C 13 24.6917 . . . . . . A 59 LYS CG . 30157 1 564 . 1 1 59 59 LYS CD C 13 29.2026 . . . . . . A 59 LYS CD . 30157 1 565 . 1 1 59 59 LYS CE C 13 42.3002 . . . . . . A 59 LYS CE . 30157 1 566 . 1 1 59 59 LYS N N 15 118.1635 . . . . . . A 59 LYS N . 30157 1 567 . 1 1 60 60 GLY H H 1 8.5948 . . . . . . A 60 GLY H . 30157 1 568 . 1 1 60 60 GLY HA2 H 1 4.1320 . . . . . . A 60 GLY HA2 . 30157 1 569 . 1 1 60 60 GLY HA3 H 1 3.9190 . . . . . . A 60 GLY HA3 . 30157 1 570 . 1 1 60 60 GLY C C 13 173.8390 . . . . . . A 60 GLY C . 30157 1 571 . 1 1 60 60 GLY CA C 13 45.5503 . . . . . . A 60 GLY CA . 30157 1 572 . 1 1 60 60 GLY N N 15 111.8953 . . . . . . A 60 GLY N . 30157 1 573 . 1 1 61 61 ARG H H 1 8.4372 . . . . . . A 61 ARG H . 30157 1 574 . 1 1 61 61 ARG HA H 1 4.5878 . . . . . . A 61 ARG HA . 30157 1 575 . 1 1 61 61 ARG HB2 H 1 1.7830 . . . . . . A 61 ARG HB2 . 30157 1 576 . 1 1 61 61 ARG HB3 H 1 2.0030 . . . . . . A 61 ARG HB3 . 30157 1 577 . 1 1 61 61 ARG HG2 H 1 1.5980 . . . . . . A 61 ARG HG2 . 30157 1 578 . 1 1 61 61 ARG HG3 H 1 1.5980 . . . . . . A 61 ARG HG3 . 30157 1 579 . 1 1 61 61 ARG HD2 H 1 3.2080 . . . . . . A 61 ARG HD2 . 30157 1 580 . 1 1 61 61 ARG HD3 H 1 3.2080 . . . . . . A 61 ARG HD3 . 30157 1 581 . 1 1 61 61 ARG C C 13 174.6900 . . . . . . A 61 ARG C . 30157 1 582 . 1 1 61 61 ARG CA C 13 55.1289 . . . . . . A 61 ARG CA . 30157 1 583 . 1 1 61 61 ARG CB C 13 31.8877 . . . . . . A 61 ARG CB . 30157 1 584 . 1 1 61 61 ARG CG C 13 27.0526 . . . . . . A 61 ARG CG . 30157 1 585 . 1 1 61 61 ARG CD C 13 43.4826 . . . . . . A 61 ARG CD . 30157 1 586 . 1 1 61 61 ARG N N 15 120.0982 . . . . . . A 61 ARG N . 30157 1 587 . 1 1 62 62 GLN H H 1 8.1686 . . . . . . A 62 GLN H . 30157 1 588 . 1 1 62 62 GLN HA H 1 5.0948 . . . . . . A 62 GLN HA . 30157 1 589 . 1 1 62 62 GLN HB2 H 1 1.8950 . . . . . . A 62 GLN HB2 . 30157 1 590 . 1 1 62 62 GLN HB3 H 1 1.8950 . . . . . . A 62 GLN HB3 . 30157 1 591 . 1 1 62 62 GLN HG2 H 1 2.0950 . . . . . . A 62 GLN HG2 . 30157 1 592 . 1 1 62 62 GLN HG3 H 1 2.2840 . . . . . . A 62 GLN HG3 . 30157 1 593 . 1 1 62 62 GLN HE21 H 1 7.5910 . . . . . . A 62 GLN HE21 . 30157 1 594 . 1 1 62 62 GLN HE22 H 1 6.6810 . . . . . . A 62 GLN HE22 . 30157 1 595 . 1 1 62 62 GLN C C 13 175.6095 . . . . . . A 62 GLN C . 30157 1 596 . 1 1 62 62 GLN CA C 13 54.9303 . . . . . . A 62 GLN CA . 30157 1 597 . 1 1 62 62 GLN CB C 13 31.2250 . . . . . . A 62 GLN CB . 30157 1 598 . 1 1 62 62 GLN CG C 13 34.0408 . . . . . . A 62 GLN CG . 30157 1 599 . 1 1 62 62 GLN N N 15 117.5037 . . . . . . A 62 GLN N . 30157 1 600 . 1 1 62 62 GLN NE2 N 15 110.9460 . . . . . . A 62 GLN NE2 . 30157 1 601 . 1 1 63 63 ILE H H 1 8.7948 . . . . . . A 63 ILE H . 30157 1 602 . 1 1 63 63 ILE HA H 1 4.6235 . . . . . . A 63 ILE HA . 30157 1 603 . 1 1 63 63 ILE HB H 1 1.6210 . . . . . . A 63 ILE HB . 30157 1 604 . 1 1 63 63 ILE HG12 H 1 1.0600 . . . . . . A 63 ILE HG12 . 30157 1 605 . 1 1 63 63 ILE HG21 H 1 0.6880 . . . . . . A 63 ILE HG21 . 30157 1 606 . 1 1 63 63 ILE HG22 H 1 0.6880 . . . . . . A 63 ILE HG22 . 30157 1 607 . 1 1 63 63 ILE HG23 H 1 0.6880 . . . . . . A 63 ILE HG23 . 30157 1 608 . 1 1 63 63 ILE C C 13 173.4190 . . . . . . A 63 ILE C . 30157 1 609 . 1 1 63 63 ILE CA C 13 58.6036 . . . . . . A 63 ILE CA . 30157 1 610 . 1 1 63 63 ILE CB C 13 41.6904 . . . . . . A 63 ILE CB . 30157 1 611 . 1 1 63 63 ILE CG1 C 13 27.2102 . . . . . . A 63 ILE CG1 . 30157 1 612 . 1 1 63 63 ILE CG2 C 13 17.7944 . . . . . . A 63 ILE CG2 . 30157 1 613 . 1 1 63 63 ILE CD1 C 13 12.9591 . . . . . . A 63 ILE CD1 . 30157 1 614 . 1 1 63 63 ILE N N 15 121.2626 . . . . . . A 63 ILE N . 30157 1 615 . 1 1 64 64 GLU H H 1 8.8621 . . . . . . A 64 GLU H . 30157 1 616 . 1 1 64 64 GLU HA H 1 4.8106 . . . . . . A 64 GLU HA . 30157 1 617 . 1 1 64 64 GLU HG2 H 1 1.8610 . . . . . . A 64 GLU HG2 . 30157 1 618 . 1 1 64 64 GLU HG3 H 1 1.9960 . . . . . . A 64 GLU HG3 . 30157 1 619 . 1 1 64 64 GLU C C 13 174.0990 . . . . . . A 64 GLU C . 30157 1 620 . 1 1 64 64 GLU CA C 13 55.4186 . . . . . . A 64 GLU CA . 30157 1 621 . 1 1 64 64 GLU CB C 13 32.4232 . . . . . . A 64 GLU CB . 30157 1 622 . 1 1 64 64 GLU CG C 13 37.4236 . . . . . . A 64 GLU CG . 30157 1 623 . 1 1 64 64 GLU N N 15 125.0646 . . . . . . A 64 GLU N . 30157 1 624 . 1 1 65 65 VAL H H 1 8.7343 . . . . . . A 65 VAL H . 30157 1 625 . 1 1 65 65 VAL HA H 1 4.6895 . . . . . . A 65 VAL HA . 30157 1 626 . 1 1 65 65 VAL C C 13 173.7680 . . . . . . A 65 VAL C . 30157 1 627 . 1 1 65 65 VAL CA C 13 60.7498 . . . . . . A 65 VAL CA . 30157 1 628 . 1 1 65 65 VAL CB C 13 33.0129 . . . . . . A 65 VAL CB . 30157 1 629 . 1 1 65 65 VAL CG1 C 13 22.0790 . . . . . . A 65 VAL CG1 . 30157 1 630 . 1 1 65 65 VAL CG2 C 13 21.2935 . . . . . . A 65 VAL CG2 . 30157 1 631 . 1 1 65 65 VAL N N 15 125.7867 . . . . . . A 65 VAL N . 30157 1 632 . 1 1 66 66 GLU H H 1 9.0018 . . . . . . A 66 GLU H . 30157 1 633 . 1 1 66 66 GLU HA H 1 5.2677 . . . . . . A 66 GLU HA . 30157 1 634 . 1 1 66 66 GLU HB2 H 1 1.7835 . . . . . . A 66 GLU HB2 . 30157 1 635 . 1 1 66 66 GLU HB3 H 1 1.7835 . . . . . . A 66 GLU HB3 . 30157 1 636 . 1 1 66 66 GLU HG2 H 1 1.9400 . . . . . . A 66 GLU HG2 . 30157 1 637 . 1 1 66 66 GLU HG3 H 1 1.9400 . . . . . . A 66 GLU HG3 . 30157 1 638 . 1 1 66 66 GLU C C 13 174.0330 . . . . . . A 66 GLU C . 30157 1 639 . 1 1 66 66 GLU CA C 13 54.0957 . . . . . . A 66 GLU CA . 30157 1 640 . 1 1 66 66 GLU CB C 13 34.0290 . . . . . . A 66 GLU CB . 30157 1 641 . 1 1 66 66 GLU CG C 13 37.0024 . . . . . . A 66 GLU CG . 30157 1 642 . 1 1 66 66 GLU N N 15 126.5888 . . . . . . A 66 GLU N . 30157 1 643 . 1 1 67 67 ALA H H 1 9.1944 . . . . . . A 67 ALA H . 30157 1 644 . 1 1 67 67 ALA HA H 1 5.7278 . . . . . . A 67 ALA HA . 30157 1 645 . 1 1 67 67 ALA HB1 H 1 1.1620 . . . . . . A 67 ALA HB1 . 30157 1 646 . 1 1 67 67 ALA HB2 H 1 1.1620 . . . . . . A 67 ALA HB2 . 30157 1 647 . 1 1 67 67 ALA HB3 H 1 1.1620 . . . . . . A 67 ALA HB3 . 30157 1 648 . 1 1 67 67 ALA C C 13 175.6990 . . . . . . A 67 ALA C . 30157 1 649 . 1 1 67 67 ALA CA C 13 50.1409 . . . . . . A 67 ALA CA . 30157 1 650 . 1 1 67 67 ALA CB C 13 24.2710 . . . . . . A 67 ALA CB . 30157 1 651 . 1 1 67 67 ALA N N 15 127.4173 . . . . . . A 67 ALA N . 30157 1 652 . 1 1 68 68 THR H H 1 8.6601 . . . . . . A 68 THR H . 30157 1 653 . 1 1 68 68 THR HA H 1 5.2649 . . . . . . A 68 THR HA . 30157 1 654 . 1 1 68 68 THR HB H 1 3.9310 . . . . . . A 68 THR HB . 30157 1 655 . 1 1 68 68 THR HG21 H 1 1.2370 . . . . . . A 68 THR HG21 . 30157 1 656 . 1 1 68 68 THR HG22 H 1 1.2370 . . . . . . A 68 THR HG22 . 30157 1 657 . 1 1 68 68 THR HG23 H 1 1.2370 . . . . . . A 68 THR HG23 . 30157 1 658 . 1 1 68 68 THR C C 13 174.2680 . . . . . . A 68 THR C . 30157 1 659 . 1 1 68 68 THR CA C 13 61.3926 . . . . . . A 68 THR CA . 30157 1 660 . 1 1 68 68 THR CB C 13 72.1991 . . . . . . A 68 THR CB . 30157 1 661 . 1 1 68 68 THR CG2 C 13 21.6482 . . . . . . A 68 THR CG2 . 30157 1 662 . 1 1 68 68 THR N N 15 116.1798 . . . . . . A 68 THR N . 30157 1 663 . 1 1 69 69 GLY H H 1 10.1069 . . . . . . A 69 GLY H . 30157 1 664 . 1 1 69 69 GLY HA2 H 1 4.0780 . . . . . . A 69 GLY HA2 . 30157 1 665 . 1 1 69 69 GLY HA3 H 1 4.8314 . . . . . . A 69 GLY HA3 . 30157 1 666 . 1 1 69 69 GLY CA C 13 45.0408 . . . . . . A 69 GLY CA . 30157 1 667 . 1 1 69 69 GLY N N 15 119.1774 . . . . . . A 69 GLY N . 30157 1 668 . 1 1 70 70 PRO C C 13 178.7990 . . . . . . A 70 PRO C . 30157 1 669 . 1 1 70 70 PRO CA C 13 65.9474 . . . . . . A 70 PRO CA . 30157 1 670 . 1 1 70 70 PRO CB C 13 33.0491 . . . . . . A 70 PRO CB . 30157 1 671 . 1 1 70 70 PRO CG C 13 27.9666 . . . . . . A 70 PRO CG . 30157 1 672 . 1 1 71 71 GLN H H 1 8.1833 . . . . . . A 71 GLN H . 30157 1 673 . 1 1 71 71 GLN HA H 1 5.0903 . . . . . . A 71 GLN HA . 30157 1 674 . 1 1 71 71 GLN HB2 H 1 1.6970 . . . . . . A 71 GLN HB2 . 30157 1 675 . 1 1 71 71 GLN HB3 H 1 1.6970 . . . . . . A 71 GLN HB3 . 30157 1 676 . 1 1 71 71 GLN HG2 H 1 2.4480 . . . . . . A 71 GLN HG2 . 30157 1 677 . 1 1 71 71 GLN HG3 H 1 2.4480 . . . . . . A 71 GLN HG3 . 30157 1 678 . 1 1 71 71 GLN HE21 H 1 7.8100 . . . . . . A 71 GLN HE21 . 30157 1 679 . 1 1 71 71 GLN HE22 H 1 7.0660 . . . . . . A 71 GLN HE22 . 30157 1 680 . 1 1 71 71 GLN C C 13 175.9080 . . . . . . A 71 GLN C . 30157 1 681 . 1 1 71 71 GLN CA C 13 54.2973 . . . . . . A 71 GLN CA . 30157 1 682 . 1 1 71 71 GLN CB C 13 29.0351 . . . . . . A 71 GLN CB . 30157 1 683 . 1 1 71 71 GLN CG C 13 35.3886 . . . . . . A 71 GLN CG . 30157 1 684 . 1 1 71 71 GLN N N 15 112.2195 . . . . . . A 71 GLN N . 30157 1 685 . 1 1 71 71 GLN NE2 N 15 112.3675 . . . . . . A 71 GLN NE2 . 30157 1 686 . 1 1 72 72 GLU H H 1 7.7897 . . . . . . A 72 GLU H . 30157 1 687 . 1 1 72 72 GLU HA H 1 3.5240 . . . . . . A 72 GLU HA . 30157 1 688 . 1 1 72 72 GLU C C 13 176.0560 . . . . . . A 72 GLU C . 30157 1 689 . 1 1 72 72 GLU CA C 13 59.7613 . . . . . . A 72 GLU CA . 30157 1 690 . 1 1 72 72 GLU CB C 13 27.0344 . . . . . . A 72 GLU CB . 30157 1 691 . 1 1 72 72 GLU CG C 13 34.7006 . . . . . . A 72 GLU CG . 30157 1 692 . 1 1 72 72 GLU N N 15 117.9637 . . . . . . A 72 GLU N . 30157 1 693 . 1 1 73 73 GLU H H 1 8.3702 . . . . . . A 73 GLU H . 30157 1 694 . 1 1 73 73 GLU HA H 1 3.8418 . . . . . . A 73 GLU HA . 30157 1 695 . 1 1 73 73 GLU HB2 H 1 1.9630 . . . . . . A 73 GLU HB2 . 30157 1 696 . 1 1 73 73 GLU HB3 H 1 1.9630 . . . . . . A 73 GLU HB3 . 30157 1 697 . 1 1 73 73 GLU HG2 H 1 2.1870 . . . . . . A 73 GLU HG2 . 30157 1 698 . 1 1 73 73 GLU HG3 H 1 2.3800 . . . . . . A 73 GLU HG3 . 30157 1 699 . 1 1 73 73 GLU C C 13 179.4510 . . . . . . A 73 GLU C . 30157 1 700 . 1 1 73 73 GLU CA C 13 60.5671 . . . . . . A 73 GLU CA . 30157 1 701 . 1 1 73 73 GLU CB C 13 29.2461 . . . . . . A 73 GLU CB . 30157 1 702 . 1 1 73 73 GLU CG C 13 37.2565 . . . . . . A 73 GLU CG . 30157 1 703 . 1 1 73 73 GLU N N 15 119.3598 . . . . . . A 73 GLU N . 30157 1 704 . 1 1 74 74 GLU H H 1 8.8409 . . . . . . A 74 GLU H . 30157 1 705 . 1 1 74 74 GLU HA H 1 3.8188 . . . . . . A 74 GLU HA . 30157 1 706 . 1 1 74 74 GLU C C 13 178.7300 . . . . . . A 74 GLU C . 30157 1 707 . 1 1 74 74 GLU CA C 13 59.6495 . . . . . . A 74 GLU CA . 30157 1 708 . 1 1 74 74 GLU CB C 13 29.3300 . . . . . . A 74 GLU CB . 30157 1 709 . 1 1 74 74 GLU CG C 13 37.2195 . . . . . . A 74 GLU CG . 30157 1 710 . 1 1 74 74 GLU N N 15 121.3741 . . . . . . A 74 GLU N . 30157 1 711 . 1 1 75 75 ALA H H 1 8.1958 . . . . . . A 75 ALA H . 30157 1 712 . 1 1 75 75 ALA HA H 1 2.5819 . . . . . . A 75 ALA HA . 30157 1 713 . 1 1 75 75 ALA HB1 H 1 0.6690 . . . . . . A 75 ALA HB1 . 30157 1 714 . 1 1 75 75 ALA HB2 H 1 0.6690 . . . . . . A 75 ALA HB2 . 30157 1 715 . 1 1 75 75 ALA HB3 H 1 0.6690 . . . . . . A 75 ALA HB3 . 30157 1 716 . 1 1 75 75 ALA C C 13 178.2500 . . . . . . A 75 ALA C . 30157 1 717 . 1 1 75 75 ALA CA C 13 54.2808 . . . . . . A 75 ALA CA . 30157 1 718 . 1 1 75 75 ALA CB C 13 18.2795 . . . . . . A 75 ALA CB . 30157 1 719 . 1 1 75 75 ALA N N 15 122.4409 . . . . . . A 75 ALA N . 30157 1 720 . 1 1 76 76 LEU H H 1 7.7413 . . . . . . A 76 LEU H . 30157 1 721 . 1 1 76 76 LEU HA H 1 3.5917 . . . . . . A 76 LEU HA . 30157 1 722 . 1 1 76 76 LEU HB2 H 1 1.3660 . . . . . . A 76 LEU HB2 . 30157 1 723 . 1 1 76 76 LEU HB3 H 1 1.7510 . . . . . . A 76 LEU HB3 . 30157 1 724 . 1 1 76 76 LEU C C 13 177.9720 . . . . . . A 76 LEU C . 30157 1 725 . 1 1 76 76 LEU CA C 13 58.4689 . . . . . . A 76 LEU CA . 30157 1 726 . 1 1 76 76 LEU CB C 13 41.8420 . . . . . . A 76 LEU CB . 30157 1 727 . 1 1 76 76 LEU CD1 C 13 26.1134 . . . . . . A 76 LEU CD1 . 30157 1 728 . 1 1 76 76 LEU CD2 C 13 24.3151 . . . . . . A 76 LEU CD2 . 30157 1 729 . 1 1 76 76 LEU N N 15 116.5898 . . . . . . A 76 LEU N . 30157 1 730 . 1 1 77 77 ALA H H 1 7.4155 . . . . . . A 77 ALA H . 30157 1 731 . 1 1 77 77 ALA HA H 1 3.8727 . . . . . . A 77 ALA HA . 30157 1 732 . 1 1 77 77 ALA HB1 H 1 1.3630 . . . . . . A 77 ALA HB1 . 30157 1 733 . 1 1 77 77 ALA HB2 H 1 1.3630 . . . . . . A 77 ALA HB2 . 30157 1 734 . 1 1 77 77 ALA HB3 H 1 1.3630 . . . . . . A 77 ALA HB3 . 30157 1 735 . 1 1 77 77 ALA C C 13 180.4440 . . . . . . A 77 ALA C . 30157 1 736 . 1 1 77 77 ALA CA C 13 54.9641 . . . . . . A 77 ALA CA . 30157 1 737 . 1 1 77 77 ALA CB C 13 17.8123 . . . . . . A 77 ALA CB . 30157 1 738 . 1 1 77 77 ALA N N 15 117.3819 . . . . . . A 77 ALA N . 30157 1 739 . 1 1 78 78 ALA H H 1 7.6183 . . . . . . A 78 ALA H . 30157 1 740 . 1 1 78 78 ALA HA H 1 4.0838 . . . . . . A 78 ALA HA . 30157 1 741 . 1 1 78 78 ALA HB1 H 1 1.4350 . . . . . . A 78 ALA HB1 . 30157 1 742 . 1 1 78 78 ALA HB2 H 1 1.4350 . . . . . . A 78 ALA HB2 . 30157 1 743 . 1 1 78 78 ALA HB3 H 1 1.4350 . . . . . . A 78 ALA HB3 . 30157 1 744 . 1 1 78 78 ALA C C 13 179.9650 . . . . . . A 78 ALA C . 30157 1 745 . 1 1 78 78 ALA CA C 13 54.7984 . . . . . . A 78 ALA CA . 30157 1 746 . 1 1 78 78 ALA CB C 13 19.1700 . . . . . . A 78 ALA CB . 30157 1 747 . 1 1 78 78 ALA N N 15 120.4504 . . . . . . A 78 ALA N . 30157 1 748 . 1 1 79 79 VAL H H 1 7.9919 . . . . . . A 79 VAL H . 30157 1 749 . 1 1 79 79 VAL HA H 1 3.3045 . . . . . . A 79 VAL HA . 30157 1 750 . 1 1 79 79 VAL HB H 1 1.9710 . . . . . . A 79 VAL HB . 30157 1 751 . 1 1 79 79 VAL HG11 H 1 0.8720 . . . . . . A 79 VAL HG11 . 30157 1 752 . 1 1 79 79 VAL HG12 H 1 0.8720 . . . . . . A 79 VAL HG12 . 30157 1 753 . 1 1 79 79 VAL HG13 H 1 0.8720 . . . . . . A 79 VAL HG13 . 30157 1 754 . 1 1 79 79 VAL HG21 H 1 0.6480 . . . . . . A 79 VAL HG21 . 30157 1 755 . 1 1 79 79 VAL HG22 H 1 0.6480 . . . . . . A 79 VAL HG22 . 30157 1 756 . 1 1 79 79 VAL HG23 H 1 0.6480 . . . . . . A 79 VAL HG23 . 30157 1 757 . 1 1 79 79 VAL C C 13 177.2060 . . . . . . A 79 VAL C . 30157 1 758 . 1 1 79 79 VAL CA C 13 66.6762 . . . . . . A 79 VAL CA . 30157 1 759 . 1 1 79 79 VAL CB C 13 31.4038 . . . . . . A 79 VAL CB . 30157 1 760 . 1 1 79 79 VAL CG1 C 13 22.6935 . . . . . . A 79 VAL CG1 . 30157 1 761 . 1 1 79 79 VAL CG2 C 13 22.6935 . . . . . . A 79 VAL CG2 . 30157 1 762 . 1 1 79 79 VAL N N 15 119.7159 . . . . . . A 79 VAL N . 30157 1 763 . 1 1 80 80 ILE H H 1 8.2521 . . . . . . A 80 ILE H . 30157 1 764 . 1 1 80 80 ILE HA H 1 3.5541 . . . . . . A 80 ILE HA . 30157 1 765 . 1 1 80 80 ILE HB H 1 1.9020 . . . . . . A 80 ILE HB . 30157 1 766 . 1 1 80 80 ILE HG21 H 1 0.8570 . . . . . . A 80 ILE HG21 . 30157 1 767 . 1 1 80 80 ILE HG22 H 1 0.8570 . . . . . . A 80 ILE HG22 . 30157 1 768 . 1 1 80 80 ILE HG23 H 1 0.8570 . . . . . . A 80 ILE HG23 . 30157 1 769 . 1 1 80 80 ILE C C 13 178.5010 . . . . . . A 80 ILE C . 30157 1 770 . 1 1 80 80 ILE CA C 13 64.5557 . . . . . . A 80 ILE CA . 30157 1 771 . 1 1 80 80 ILE CB C 13 36.5846 . . . . . . A 80 ILE CB . 30157 1 772 . 1 1 80 80 ILE CG1 C 13 28.1534 . . . . . . A 80 ILE CG1 . 30157 1 773 . 1 1 80 80 ILE CG2 C 13 17.3669 . . . . . . A 80 ILE CG2 . 30157 1 774 . 1 1 80 80 ILE N N 15 118.6959 . . . . . . A 80 ILE N . 30157 1 775 . 1 1 81 81 ALA H H 1 7.7181 . . . . . . A 81 ALA H . 30157 1 776 . 1 1 81 81 ALA HA H 1 4.1486 . . . . . . A 81 ALA HA . 30157 1 777 . 1 1 81 81 ALA HB1 H 1 1.4350 . . . . . . A 81 ALA HB1 . 30157 1 778 . 1 1 81 81 ALA HB2 H 1 1.4350 . . . . . . A 81 ALA HB2 . 30157 1 779 . 1 1 81 81 ALA HB3 H 1 1.4350 . . . . . . A 81 ALA HB3 . 30157 1 780 . 1 1 81 81 ALA C C 13 180.4620 . . . . . . A 81 ALA C . 30157 1 781 . 1 1 81 81 ALA CA C 13 54.7651 . . . . . . A 81 ALA CA . 30157 1 782 . 1 1 81 81 ALA CB C 13 17.9209 . . . . . . A 81 ALA CB . 30157 1 783 . 1 1 81 81 ALA N N 15 120.1501 . . . . . . A 81 ALA N . 30157 1 784 . 1 1 82 82 LEU H H 1 7.5772 . . . . . . A 82 LEU H . 30157 1 785 . 1 1 82 82 LEU HA H 1 4.0259 . . . . . . A 82 LEU HA . 30157 1 786 . 1 1 82 82 LEU HB3 H 1 1.6810 . . . . . . A 82 LEU HB3 . 30157 1 787 . 1 1 82 82 LEU C C 13 179.1630 . . . . . . A 82 LEU C . 30157 1 788 . 1 1 82 82 LEU CA C 13 57.6238 . . . . . . A 82 LEU CA . 30157 1 789 . 1 1 82 82 LEU CB C 13 41.4787 . . . . . . A 82 LEU CB . 30157 1 790 . 1 1 82 82 LEU CD2 C 13 24.6215 . . . . . . A 82 LEU CD2 . 30157 1 791 . 1 1 82 82 LEU N N 15 119.4728 . . . . . . A 82 LEU N . 30157 1 792 . 1 1 83 83 PHE H H 1 7.8449 . . . . . . A 83 PHE H . 30157 1 793 . 1 1 83 83 PHE HA H 1 4.5314 . . . . . . A 83 PHE HA . 30157 1 794 . 1 1 83 83 PHE HB2 H 1 3.0270 . . . . . . A 83 PHE HB2 . 30157 1 795 . 1 1 83 83 PHE HB3 H 1 3.2990 . . . . . . A 83 PHE HB3 . 30157 1 796 . 1 1 83 83 PHE C C 13 176.3250 . . . . . . A 83 PHE C . 30157 1 797 . 1 1 83 83 PHE CA C 13 58.5530 . . . . . . A 83 PHE CA . 30157 1 798 . 1 1 83 83 PHE CB C 13 38.6458 . . . . . . A 83 PHE CB . 30157 1 799 . 1 1 83 83 PHE N N 15 116.1996 . . . . . . A 83 PHE N . 30157 1 800 . 1 1 84 84 ASN H H 1 7.9354 . . . . . . A 84 ASN H . 30157 1 801 . 1 1 84 84 ASN HA H 1 5.0004 . . . . . . A 84 ASN HA . 30157 1 802 . 1 1 84 84 ASN HB2 H 1 2.7830 . . . . . . A 84 ASN HB2 . 30157 1 803 . 1 1 84 84 ASN HB3 H 1 2.9610 . . . . . . A 84 ASN HB3 . 30157 1 804 . 1 1 84 84 ASN HD21 H 1 7.4790 . . . . . . A 84 ASN HD21 . 30157 1 805 . 1 1 84 84 ASN HD22 H 1 6.8600 . . . . . . A 84 ASN HD22 . 30157 1 806 . 1 1 84 84 ASN C C 13 174.4840 . . . . . . A 84 ASN C . 30157 1 807 . 1 1 84 84 ASN CA C 13 53.3801 . . . . . . A 84 ASN CA . 30157 1 808 . 1 1 84 84 ASN CB C 13 39.8112 . . . . . . A 84 ASN CB . 30157 1 809 . 1 1 84 84 ASN N N 15 117.9653 . . . . . . A 84 ASN N . 30157 1 810 . 1 1 84 84 ASN ND2 N 15 111.2460 . . . . . . A 84 ASN ND2 . 30157 1 811 . 1 1 85 85 SER H H 1 7.6083 . . . . . . A 85 SER H . 30157 1 812 . 1 1 85 85 SER HA H 1 4.3068 . . . . . . A 85 SER HA . 30157 1 813 . 1 1 85 85 SER HB2 H 1 3.9610 . . . . . . A 85 SER HB2 . 30157 1 814 . 1 1 85 85 SER HB3 H 1 3.9610 . . . . . . A 85 SER HB3 . 30157 1 815 . 1 1 85 85 SER CA C 13 60.7118 . . . . . . A 85 SER CA . 30157 1 816 . 1 1 85 85 SER CB C 13 65.1670 . . . . . . A 85 SER CB . 30157 1 817 . 1 1 85 85 SER N N 15 121.2008 . . . . . . A 85 SER N . 30157 1 stop_ save_