data_26649 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26649 _Entry.Title ; 1H, 13C, 15N chemical shift assignments of initiation factor 1 from Pseudomonas aeruginosa ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-09-04 _Entry.Accession_date 2015-09-04 _Entry.Last_release_date 2016-08-22 _Entry.Original_release_date 2016-08-22 _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 Yonghong Zhang . . . . 26649 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of Texas Rio Grande Valley' . 26649 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26649 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 269 26649 '15N chemical shifts' 70 26649 '1H chemical shifts' 460 26649 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 2 . . 2017-01-04 2015-09-04 update BMRB 'update entry citation' 26649 1 . . 2016-08-22 2015-09-04 original author 'original release' 26649 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2N78 'BMRB Entry Tracking System' 26649 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26649 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26983940 _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N resonance assignments and secondary structure analysis of translation initiation factor 1 from Pseudomonas aeruginosa ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 10 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 249 _Citation.Page_last 252 _Citation.Year 2016 _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 Alejandra Bernal . . . . 26649 1 2 Yanmei Hu . . . . 26649 1 3 Stephanie Palmer . O. . . 26649 1 4 Aaron Silva . . . . 26649 1 5 James Bullard . . . . 26649 1 6 Yonghong Zhang . . . . 26649 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26649 _Assembly.ID 1 _Assembly.Name 'IF1 monomer' _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 IF1 1 $Initiation_Factor_IF-1 A . yes native no no . . . 26649 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Initiation_Factor_IF-1 _Entity.Sf_category entity _Entity.Sf_framecode Initiation_Factor_IF-1 _Entity.Entry_ID 26649 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Initiation_Factor_IF-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MSKEDSFEMEGTVVDTLPNT MFRVELENGHVVTAHISGKM RKNYIRILTGDKVRVELTPY DLSKGRITYRARLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 80 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 26649 1 2 . SER . 26649 1 3 . LYS . 26649 1 4 . GLU . 26649 1 5 . ASP . 26649 1 6 . SER . 26649 1 7 . PHE . 26649 1 8 . GLU . 26649 1 9 . MET . 26649 1 10 . GLU . 26649 1 11 . GLY . 26649 1 12 . THR . 26649 1 13 . VAL . 26649 1 14 . VAL . 26649 1 15 . ASP . 26649 1 16 . THR . 26649 1 17 . LEU . 26649 1 18 . PRO . 26649 1 19 . ASN . 26649 1 20 . THR . 26649 1 21 . MET . 26649 1 22 . PHE . 26649 1 23 . ARG . 26649 1 24 . VAL . 26649 1 25 . GLU . 26649 1 26 . LEU . 26649 1 27 . GLU . 26649 1 28 . ASN . 26649 1 29 . GLY . 26649 1 30 . HIS . 26649 1 31 . VAL . 26649 1 32 . VAL . 26649 1 33 . THR . 26649 1 34 . ALA . 26649 1 35 . HIS . 26649 1 36 . ILE . 26649 1 37 . SER . 26649 1 38 . GLY . 26649 1 39 . LYS . 26649 1 40 . MET . 26649 1 41 . ARG . 26649 1 42 . LYS . 26649 1 43 . ASN . 26649 1 44 . TYR . 26649 1 45 . ILE . 26649 1 46 . ARG . 26649 1 47 . ILE . 26649 1 48 . LEU . 26649 1 49 . THR . 26649 1 50 . GLY . 26649 1 51 . ASP . 26649 1 52 . LYS . 26649 1 53 . VAL . 26649 1 54 . ARG . 26649 1 55 . VAL . 26649 1 56 . GLU . 26649 1 57 . LEU . 26649 1 58 . THR . 26649 1 59 . PRO . 26649 1 60 . TYR . 26649 1 61 . ASP . 26649 1 62 . LEU . 26649 1 63 . SER . 26649 1 64 . LYS . 26649 1 65 . GLY . 26649 1 66 . ARG . 26649 1 67 . ILE . 26649 1 68 . THR . 26649 1 69 . TYR . 26649 1 70 . ARG . 26649 1 71 . ALA . 26649 1 72 . ARG . 26649 1 73 . LEU . 26649 1 74 . GLU . 26649 1 75 . HIS . 26649 1 76 . HIS . 26649 1 77 . HIS . 26649 1 78 . HIS . 26649 1 79 . HIS . 26649 1 80 . HIS . 26649 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 26649 1 . SER 2 2 26649 1 . LYS 3 3 26649 1 . GLU 4 4 26649 1 . ASP 5 5 26649 1 . SER 6 6 26649 1 . PHE 7 7 26649 1 . GLU 8 8 26649 1 . MET 9 9 26649 1 . GLU 10 10 26649 1 . GLY 11 11 26649 1 . THR 12 12 26649 1 . VAL 13 13 26649 1 . VAL 14 14 26649 1 . ASP 15 15 26649 1 . THR 16 16 26649 1 . LEU 17 17 26649 1 . PRO 18 18 26649 1 . ASN 19 19 26649 1 . THR 20 20 26649 1 . MET 21 21 26649 1 . PHE 22 22 26649 1 . ARG 23 23 26649 1 . VAL 24 24 26649 1 . GLU 25 25 26649 1 . LEU 26 26 26649 1 . GLU 27 27 26649 1 . ASN 28 28 26649 1 . GLY 29 29 26649 1 . HIS 30 30 26649 1 . VAL 31 31 26649 1 . VAL 32 32 26649 1 . THR 33 33 26649 1 . ALA 34 34 26649 1 . HIS 35 35 26649 1 . ILE 36 36 26649 1 . SER 37 37 26649 1 . GLY 38 38 26649 1 . LYS 39 39 26649 1 . MET 40 40 26649 1 . ARG 41 41 26649 1 . LYS 42 42 26649 1 . ASN 43 43 26649 1 . TYR 44 44 26649 1 . ILE 45 45 26649 1 . ARG 46 46 26649 1 . ILE 47 47 26649 1 . LEU 48 48 26649 1 . THR 49 49 26649 1 . GLY 50 50 26649 1 . ASP 51 51 26649 1 . LYS 52 52 26649 1 . VAL 53 53 26649 1 . ARG 54 54 26649 1 . VAL 55 55 26649 1 . GLU 56 56 26649 1 . LEU 57 57 26649 1 . THR 58 58 26649 1 . PRO 59 59 26649 1 . TYR 60 60 26649 1 . ASP 61 61 26649 1 . LEU 62 62 26649 1 . SER 63 63 26649 1 . LYS 64 64 26649 1 . GLY 65 65 26649 1 . ARG 66 66 26649 1 . ILE 67 67 26649 1 . THR 68 68 26649 1 . TYR 69 69 26649 1 . ARG 70 70 26649 1 . ALA 71 71 26649 1 . ARG 72 72 26649 1 . LEU 73 73 26649 1 . GLU 74 74 26649 1 . HIS 75 75 26649 1 . HIS 76 76 26649 1 . HIS 77 77 26649 1 . HIS 78 78 26649 1 . HIS 79 79 26649 1 . HIS 80 80 26649 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 26649 _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 $Initiation_Factor_IF-1 . 287 organism . 'Pseudomonas aeruginosa' 'Pseudomonas aeruginosa' . . Bacteria . Pseudomonas aeruginosa . . . . . . . . . . . . . 26649 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 26649 _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 $Initiation_Factor_IF-1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET . . . 26649 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26649 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 'Initiation Factor IF-1' '[U-100% 13C; U-100% 15N]' . . 1 $Initiation_Factor_IF-1 . . 1 . . mM . . . . 26649 1 2 KPO4 'natural abundance' . . . . . . 25 . . mM . . . . 26649 1 3 KCl 'natural abundance' . . . . . . 100 . . mM . . . . 26649 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 26649 _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' 0.125 . M 26649 1 pH 5.1 . pH 26649 1 pressure 1 . atm 26649 1 temperature 298 . K 26649 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26649 _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' . . 26649 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26649 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26649 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 26649 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 26649 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 26649 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26649 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26649 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26649 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26649 1 5 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26649 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26649 _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 internal indirect 0.251449530 . . . . . 26649 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 26649 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . 26649 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26649 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26649 1 2 '3D CBCA(CO)NH' . . . 26649 1 3 '3D HNCACB' . . . 26649 1 4 '3D HNCO' . . . 26649 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 SER H H 1 8.756 0.04 . 1 . . . A 2 SER H . 26649 1 2 . 1 1 2 2 SER HA H 1 4.543 0.04 . 1 . . . A 2 SER HA . 26649 1 3 . 1 1 2 2 SER HB2 H 1 3.923 0.04 . 2 . . . A 2 SER HB2 . 26649 1 4 . 1 1 2 2 SER HB3 H 1 3.923 0.04 . 2 . . . A 2 SER HB3 . 26649 1 5 . 1 1 2 2 SER C C 13 174.500 0.1 . 1 . . . A 2 SER C . 26649 1 6 . 1 1 2 2 SER CA C 13 58.158 0.1 . 1 . . . A 2 SER CA . 26649 1 7 . 1 1 2 2 SER CB C 13 64.115 0.1 . 1 . . . A 2 SER CB . 26649 1 8 . 1 1 2 2 SER N N 15 116.344 0.1 . 1 . . . A 2 SER N . 26649 1 9 . 1 1 3 3 LYS H H 1 8.582 0.04 . 1 . . . A 3 LYS H . 26649 1 10 . 1 1 3 3 LYS HA H 1 4.325 0.04 . 1 . . . A 3 LYS HA . 26649 1 11 . 1 1 3 3 LYS HB2 H 1 1.872 0.04 . 2 . . . A 3 LYS HB2 . 26649 1 12 . 1 1 3 3 LYS HB3 H 1 1.872 0.04 . 2 . . . A 3 LYS HB3 . 26649 1 13 . 1 1 3 3 LYS C C 13 176.570 0.1 . 1 . . . A 3 LYS C . 26649 1 14 . 1 1 3 3 LYS CA C 13 56.790 0.1 . 1 . . . A 3 LYS CA . 26649 1 15 . 1 1 3 3 LYS CB C 13 32.951 0.1 . 1 . . . A 3 LYS CB . 26649 1 16 . 1 1 3 3 LYS N N 15 123.531 0.1 . 1 . . . A 3 LYS N . 26649 1 17 . 1 1 4 4 GLU H H 1 8.488 0.04 . 1 . . . A 4 GLU H . 26649 1 18 . 1 1 4 4 GLU HA H 1 4.342 0.04 . 1 . . . A 4 GLU HA . 26649 1 19 . 1 1 4 4 GLU HB2 H 1 2.074 0.04 . 2 . . . A 4 GLU HB2 . 26649 1 20 . 1 1 4 4 GLU HB3 H 1 1.980 0.04 . 2 . . . A 4 GLU HB3 . 26649 1 21 . 1 1 4 4 GLU C C 13 176.071 0.1 . 1 . . . A 4 GLU C . 26649 1 22 . 1 1 4 4 GLU CA C 13 56.516 0.1 . 1 . . . A 4 GLU CA . 26649 1 23 . 1 1 4 4 GLU CB C 13 29.878 0.1 . 1 . . . A 4 GLU CB . 26649 1 24 . 1 1 4 4 GLU N N 15 121.085 0.1 . 1 . . . A 4 GLU N . 26649 1 25 . 1 1 5 5 ASP H H 1 8.235 0.04 . 1 . . . A 5 ASP H . 26649 1 26 . 1 1 5 5 ASP HA H 1 4.654 0.04 . 1 . . . A 5 ASP HA . 26649 1 27 . 1 1 5 5 ASP HB2 H 1 2.716 0.04 . 2 . . . A 5 ASP HB2 . 26649 1 28 . 1 1 5 5 ASP HB3 H 1 2.716 0.04 . 2 . . . A 5 ASP HB3 . 26649 1 29 . 1 1 5 5 ASP C C 13 175.760 0.1 . 1 . . . A 5 ASP C . 26649 1 30 . 1 1 5 5 ASP CA C 13 54.234 0.1 . 1 . . . A 5 ASP CA . 26649 1 31 . 1 1 5 5 ASP CB C 13 41.063 0.1 . 1 . . . A 5 ASP CB . 26649 1 32 . 1 1 5 5 ASP N N 15 120.965 0.1 . 1 . . . A 5 ASP N . 26649 1 33 . 1 1 6 6 SER H H 1 8.018 0.04 . 1 . . . A 6 SER H . 26649 1 34 . 1 1 6 6 SER HA H 1 4.783 0.04 . 1 . . . A 6 SER HA . 26649 1 35 . 1 1 6 6 SER HB2 H 1 3.797 0.04 . 2 . . . A 6 SER HB2 . 26649 1 36 . 1 1 6 6 SER HB3 H 1 3.797 0.04 . 2 . . . A 6 SER HB3 . 26649 1 37 . 1 1 6 6 SER C C 13 173.417 0.1 . 1 . . . A 6 SER C . 26649 1 38 . 1 1 6 6 SER CA C 13 58.260 0.1 . 1 . . . A 6 SER CA . 26649 1 39 . 1 1 6 6 SER CB C 13 64.573 0.1 . 1 . . . A 6 SER CB . 26649 1 40 . 1 1 6 6 SER N N 15 114.678 0.1 . 1 . . . A 6 SER N . 26649 1 41 . 1 1 7 7 PHE H H 1 8.612 0.04 . 1 . . . A 7 PHE H . 26649 1 42 . 1 1 7 7 PHE HA H 1 4.861 0.04 . 1 . . . A 7 PHE HA . 26649 1 43 . 1 1 7 7 PHE HB2 H 1 3.262 0.04 . 2 . . . A 7 PHE HB2 . 26649 1 44 . 1 1 7 7 PHE HB3 H 1 3.060 0.04 . 2 . . . A 7 PHE HB3 . 26649 1 45 . 1 1 7 7 PHE HD1 H 1 7.173 0.04 . 3 . . . A 7 PHE HD1 . 26649 1 46 . 1 1 7 7 PHE HD2 H 1 7.173 0.04 . 3 . . . A 7 PHE HD2 . 26649 1 47 . 1 1 7 7 PHE C C 13 173.245 0.1 . 1 . . . A 7 PHE C . 26649 1 48 . 1 1 7 7 PHE CA C 13 56.616 0.1 . 1 . . . A 7 PHE CA . 26649 1 49 . 1 1 7 7 PHE CB C 13 40.188 0.1 . 1 . . . A 7 PHE CB . 26649 1 50 . 1 1 7 7 PHE N N 15 119.686 0.1 . 1 . . . A 7 PHE N . 26649 1 51 . 1 1 8 8 GLU H H 1 8.362 0.04 . 1 . . . A 8 GLU H . 26649 1 52 . 1 1 8 8 GLU HA H 1 5.395 0.04 . 1 . . . A 8 GLU HA . 26649 1 53 . 1 1 8 8 GLU HB2 H 1 1.890 0.04 . 2 . . . A 8 GLU HB2 . 26649 1 54 . 1 1 8 8 GLU HB3 H 1 1.890 0.04 . 2 . . . A 8 GLU HB3 . 26649 1 55 . 1 1 8 8 GLU HG2 H 1 2.026 0.04 . 2 . . . A 8 GLU HG2 . 26649 1 56 . 1 1 8 8 GLU HG3 H 1 2.257 0.04 . 2 . . . A 8 GLU HG3 . 26649 1 57 . 1 1 8 8 GLU C C 13 176.059 0.1 . 1 . . . A 8 GLU C . 26649 1 58 . 1 1 8 8 GLU CA C 13 54.535 0.1 . 1 . . . A 8 GLU CA . 26649 1 59 . 1 1 8 8 GLU CB C 13 32.867 0.1 . 1 . . . A 8 GLU CB . 26649 1 60 . 1 1 8 8 GLU CG C 13 35.599 0.1 . 1 . . . A 8 GLU CG . 26649 1 61 . 1 1 8 8 GLU N N 15 119.627 0.1 . 1 . . . A 8 GLU N . 26649 1 62 . 1 1 9 9 MET H H 1 8.895 0.04 . 1 . . . A 9 MET H . 26649 1 63 . 1 1 9 9 MET HA H 1 4.796 0.04 . 1 . . . A 9 MET HA . 26649 1 64 . 1 1 9 9 MET HB2 H 1 2.197 0.04 . 2 . . . A 9 MET HB2 . 26649 1 65 . 1 1 9 9 MET HB3 H 1 1.924 0.04 . 2 . . . A 9 MET HB3 . 26649 1 66 . 1 1 9 9 MET HG2 H 1 2.439 0.04 . 2 . . . A 9 MET HG2 . 26649 1 67 . 1 1 9 9 MET HG3 H 1 2.439 0.04 . 2 . . . A 9 MET HG3 . 26649 1 68 . 1 1 9 9 MET HE1 H 1 2.154 0.04 . 1 . . . A 9 MET HE1 . 26649 1 69 . 1 1 9 9 MET HE2 H 1 2.154 0.04 . 1 . . . A 9 MET HE2 . 26649 1 70 . 1 1 9 9 MET HE3 H 1 2.154 0.04 . 1 . . . A 9 MET HE3 . 26649 1 71 . 1 1 9 9 MET C C 13 174.247 0.1 . 1 . . . A 9 MET C . 26649 1 72 . 1 1 9 9 MET CA C 13 54.705 0.1 . 1 . . . A 9 MET CA . 26649 1 73 . 1 1 9 9 MET CB C 13 38.233 0.1 . 1 . . . A 9 MET CB . 26649 1 74 . 1 1 9 9 MET CE C 13 17.797 0.1 . 1 . . . A 9 MET CE . 26649 1 75 . 1 1 9 9 MET N N 15 121.547 0.1 . 1 . . . A 9 MET N . 26649 1 76 . 1 1 10 10 GLU H H 1 8.820 0.04 . 1 . . . A 10 GLU H . 26649 1 77 . 1 1 10 10 GLU HA H 1 4.988 0.04 . 1 . . . A 10 GLU HA . 26649 1 78 . 1 1 10 10 GLU HB2 H 1 2.103 0.04 . 2 . . . A 10 GLU HB2 . 26649 1 79 . 1 1 10 10 GLU HB3 H 1 1.976 0.04 . 2 . . . A 10 GLU HB3 . 26649 1 80 . 1 1 10 10 GLU HG2 H 1 2.335 0.04 . 2 . . . A 10 GLU HG2 . 26649 1 81 . 1 1 10 10 GLU HG3 H 1 2.423 0.04 . 2 . . . A 10 GLU HG3 . 26649 1 82 . 1 1 10 10 GLU C C 13 176.016 0.1 . 1 . . . A 10 GLU C . 26649 1 83 . 1 1 10 10 GLU CA C 13 55.549 0.1 . 1 . . . A 10 GLU CA . 26649 1 84 . 1 1 10 10 GLU CB C 13 31.250 0.1 . 1 . . . A 10 GLU CB . 26649 1 85 . 1 1 10 10 GLU CG C 13 39.621 0.1 . 1 . . . A 10 GLU CG . 26649 1 86 . 1 1 10 10 GLU N N 15 122.112 0.1 . 1 . . . A 10 GLU N . 26649 1 87 . 1 1 11 11 GLY H H 1 8.771 0.04 . 1 . . . A 11 GLY H . 26649 1 88 . 1 1 11 11 GLY HA2 H 1 4.739 0.04 . 2 . . . A 11 GLY HA2 . 26649 1 89 . 1 1 11 11 GLY HA3 H 1 3.543 0.04 . 2 . . . A 11 GLY HA3 . 26649 1 90 . 1 1 11 11 GLY C C 13 171.420 0.1 . 1 . . . A 11 GLY C . 26649 1 91 . 1 1 11 11 GLY CA C 13 46.193 0.1 . 1 . . . A 11 GLY CA . 26649 1 92 . 1 1 11 11 GLY N N 15 106.766 0.1 . 1 . . . A 11 GLY N . 26649 1 93 . 1 1 12 12 THR H H 1 8.434 0.04 . 1 . . . A 12 THR H . 26649 1 94 . 1 1 12 12 THR HA H 1 5.118 0.04 . 1 . . . A 12 THR HA . 26649 1 95 . 1 1 12 12 THR HB H 1 3.824 0.04 . 1 . . . A 12 THR HB . 26649 1 96 . 1 1 12 12 THR HG21 H 1 1.057 0.04 . 1 . . . A 12 THR HG21 . 26649 1 97 . 1 1 12 12 THR HG22 H 1 1.057 0.04 . 1 . . . A 12 THR HG22 . 26649 1 98 . 1 1 12 12 THR HG23 H 1 1.057 0.04 . 1 . . . A 12 THR HG23 . 26649 1 99 . 1 1 12 12 THR C C 13 174.240 0.1 . 1 . . . A 12 THR C . 26649 1 100 . 1 1 12 12 THR CA C 13 60.995 0.1 . 1 . . . A 12 THR CA . 26649 1 101 . 1 1 12 12 THR CB C 13 71.280 0.1 . 1 . . . A 12 THR CB . 26649 1 102 . 1 1 12 12 THR CG2 C 13 20.986 0.1 . 1 . . . A 12 THR CG2 . 26649 1 103 . 1 1 12 12 THR N N 15 116.018 0.1 . 1 . . . A 12 THR N . 26649 1 104 . 1 1 13 13 VAL H H 1 9.177 0.04 . 1 . . . A 13 VAL H . 26649 1 105 . 1 1 13 13 VAL HA H 1 4.019 0.04 . 1 . . . A 13 VAL HA . 26649 1 106 . 1 1 13 13 VAL HB H 1 2.302 0.04 . 1 . . . A 13 VAL HB . 26649 1 107 . 1 1 13 13 VAL HG11 H 1 0.976 0.04 . 2 . . . A 13 VAL HG11 . 26649 1 108 . 1 1 13 13 VAL HG12 H 1 0.976 0.04 . 2 . . . A 13 VAL HG12 . 26649 1 109 . 1 1 13 13 VAL HG13 H 1 0.976 0.04 . 2 . . . A 13 VAL HG13 . 26649 1 110 . 1 1 13 13 VAL HG21 H 1 0.726 0.04 . 2 . . . A 13 VAL HG21 . 26649 1 111 . 1 1 13 13 VAL HG22 H 1 0.726 0.04 . 2 . . . A 13 VAL HG22 . 26649 1 112 . 1 1 13 13 VAL HG23 H 1 0.726 0.04 . 2 . . . A 13 VAL HG23 . 26649 1 113 . 1 1 13 13 VAL C C 13 176.464 0.1 . 1 . . . A 13 VAL C . 26649 1 114 . 1 1 13 13 VAL CA C 13 64.639 0.1 . 1 . . . A 13 VAL CA . 26649 1 115 . 1 1 13 13 VAL CB C 13 31.459 0.1 . 1 . . . A 13 VAL CB . 26649 1 116 . 1 1 13 13 VAL CG1 C 13 22.607 0.1 . 1 . . . A 13 VAL CG1 . 26649 1 117 . 1 1 13 13 VAL CG2 C 13 22.275 0.1 . 1 . . . A 13 VAL CG2 . 26649 1 118 . 1 1 13 13 VAL N N 15 127.555 0.1 . 1 . . . A 13 VAL N . 26649 1 119 . 1 1 14 14 VAL H H 1 9.240 0.04 . 1 . . . A 14 VAL H . 26649 1 120 . 1 1 14 14 VAL HA H 1 4.659 0.04 . 1 . . . A 14 VAL HA . 26649 1 121 . 1 1 14 14 VAL HB H 1 2.331 0.04 . 1 . . . A 14 VAL HB . 26649 1 122 . 1 1 14 14 VAL HG11 H 1 0.973 0.04 . 2 . . . A 14 VAL HG11 . 26649 1 123 . 1 1 14 14 VAL HG12 H 1 0.973 0.04 . 2 . . . A 14 VAL HG12 . 26649 1 124 . 1 1 14 14 VAL HG13 H 1 0.973 0.04 . 2 . . . A 14 VAL HG13 . 26649 1 125 . 1 1 14 14 VAL HG21 H 1 0.820 0.04 . 2 . . . A 14 VAL HG21 . 26649 1 126 . 1 1 14 14 VAL HG22 H 1 0.820 0.04 . 2 . . . A 14 VAL HG22 . 26649 1 127 . 1 1 14 14 VAL HG23 H 1 0.820 0.04 . 2 . . . A 14 VAL HG23 . 26649 1 128 . 1 1 14 14 VAL C C 13 175.424 0.1 . 1 . . . A 14 VAL C . 26649 1 129 . 1 1 14 14 VAL CA C 13 61.746 0.1 . 1 . . . A 14 VAL CA . 26649 1 130 . 1 1 14 14 VAL CB C 13 33.227 0.1 . 1 . . . A 14 VAL CB . 26649 1 131 . 1 1 14 14 VAL CG1 C 13 21.892 0.1 . 1 . . . A 14 VAL CG1 . 26649 1 132 . 1 1 14 14 VAL CG2 C 13 18.915 0.1 . 1 . . . A 14 VAL CG2 . 26649 1 133 . 1 1 14 14 VAL N N 15 124.300 0.1 . 1 . . . A 14 VAL N . 26649 1 134 . 1 1 15 15 ASP H H 1 7.912 0.04 . 1 . . . A 15 ASP H . 26649 1 135 . 1 1 15 15 ASP HA H 1 5.000 0.04 . 1 . . . A 15 ASP HA . 26649 1 136 . 1 1 15 15 ASP HB2 H 1 2.676 0.04 . 2 . . . A 15 ASP HB2 . 26649 1 137 . 1 1 15 15 ASP HB3 H 1 2.390 0.04 . 2 . . . A 15 ASP HB3 . 26649 1 138 . 1 1 15 15 ASP C C 13 175.239 0.1 . 1 . . . A 15 ASP C . 26649 1 139 . 1 1 15 15 ASP CA C 13 54.214 0.1 . 1 . . . A 15 ASP CA . 26649 1 140 . 1 1 15 15 ASP CB C 13 44.170 0.1 . 1 . . . A 15 ASP CB . 26649 1 141 . 1 1 15 15 ASP N N 15 117.873 0.1 . 1 . . . A 15 ASP N . 26649 1 142 . 1 1 16 16 THR H H 1 8.666 0.04 . 1 . . . A 16 THR H . 26649 1 143 . 1 1 16 16 THR HA H 1 4.415 0.04 . 1 . . . A 16 THR HA . 26649 1 144 . 1 1 16 16 THR HB H 1 4.275 0.04 . 1 . . . A 16 THR HB . 26649 1 145 . 1 1 16 16 THR HG21 H 1 1.291 0.04 . 1 . . . A 16 THR HG21 . 26649 1 146 . 1 1 16 16 THR HG22 H 1 1.291 0.04 . 1 . . . A 16 THR HG22 . 26649 1 147 . 1 1 16 16 THR HG23 H 1 1.291 0.04 . 1 . . . A 16 THR HG23 . 26649 1 148 . 1 1 16 16 THR C C 13 172.752 0.1 . 1 . . . A 16 THR C . 26649 1 149 . 1 1 16 16 THR CA C 13 60.596 0.1 . 1 . . . A 16 THR CA . 26649 1 150 . 1 1 16 16 THR CB C 13 69.636 0.1 . 1 . . . A 16 THR CB . 26649 1 151 . 1 1 16 16 THR CG2 C 13 21.084 0.1 . 1 . . . A 16 THR CG2 . 26649 1 152 . 1 1 16 16 THR N N 15 115.850 0.1 . 1 . . . A 16 THR N . 26649 1 153 . 1 1 17 17 LEU H H 1 7.894 0.04 . 1 . . . A 17 LEU H . 26649 1 154 . 1 1 17 17 LEU HA H 1 4.697 0.04 . 1 . . . A 17 LEU HA . 26649 1 155 . 1 1 17 17 LEU HB2 H 1 1.485 0.04 . 2 . . . A 17 LEU HB2 . 26649 1 156 . 1 1 17 17 LEU HB3 H 1 1.485 0.04 . 2 . . . A 17 LEU HB3 . 26649 1 157 . 1 1 17 17 LEU HG H 1 1.478 0.04 . 1 . . . A 17 LEU HG . 26649 1 158 . 1 1 17 17 LEU HD11 H 1 0.817 0.04 . 2 . . . A 17 LEU HD11 . 26649 1 159 . 1 1 17 17 LEU HD12 H 1 0.817 0.04 . 2 . . . A 17 LEU HD12 . 26649 1 160 . 1 1 17 17 LEU HD13 H 1 0.817 0.04 . 2 . . . A 17 LEU HD13 . 26649 1 161 . 1 1 17 17 LEU HD21 H 1 0.716 0.04 . 2 . . . A 17 LEU HD21 . 26649 1 162 . 1 1 17 17 LEU HD22 H 1 0.716 0.04 . 2 . . . A 17 LEU HD22 . 26649 1 163 . 1 1 17 17 LEU HD23 H 1 0.716 0.04 . 2 . . . A 17 LEU HD23 . 26649 1 164 . 1 1 17 17 LEU CA C 13 52.497 0.04 . 1 . . . A 17 LEU CA . 26649 1 165 . 1 1 17 17 LEU CB C 13 42.366 0.04 . 1 . . . A 17 LEU CB . 26649 1 166 . 1 1 17 17 LEU CD1 C 13 25.231 0.04 . 1 . . . A 17 LEU CD1 . 26649 1 167 . 1 1 17 17 LEU CD2 C 13 25.606 0.04 . 1 . . . A 17 LEU CD2 . 26649 1 168 . 1 1 17 17 LEU N N 15 124.937 0.04 . 1 . . . A 17 LEU N . 26649 1 169 . 1 1 18 18 PRO HA H 1 4.372 0.04 . 1 . . . A 18 PRO HA . 26649 1 170 . 1 1 18 18 PRO HB2 H 1 2.384 0.04 . 2 . . . A 18 PRO HB2 . 26649 1 171 . 1 1 18 18 PRO HB3 H 1 1.864 0.04 . 2 . . . A 18 PRO HB3 . 26649 1 172 . 1 1 18 18 PRO C C 13 175.846 0.1 . 1 . . . A 18 PRO C . 26649 1 173 . 1 1 18 18 PRO CA C 13 62.956 0.1 . 1 . . . A 18 PRO CA . 26649 1 174 . 1 1 18 18 PRO CB C 13 32.411 0.1 . 1 . . . A 18 PRO CB . 26649 1 175 . 1 1 19 19 ASN H H 1 8.714 0.04 . 1 . . . A 19 ASN H . 26649 1 176 . 1 1 19 19 ASN HA H 1 4.345 0.04 . 1 . . . A 19 ASN HA . 26649 1 177 . 1 1 19 19 ASN HB2 H 1 2.979 0.04 . 2 . . . A 19 ASN HB2 . 26649 1 178 . 1 1 19 19 ASN HB3 H 1 2.869 0.04 . 2 . . . A 19 ASN HB3 . 26649 1 179 . 1 1 19 19 ASN C C 13 175.137 0.1 . 1 . . . A 19 ASN C . 26649 1 180 . 1 1 19 19 ASN CA C 13 53.753 0.1 . 1 . . . A 19 ASN CA . 26649 1 181 . 1 1 19 19 ASN CB C 13 36.790 0.1 . 1 . . . A 19 ASN CB . 26649 1 182 . 1 1 19 19 ASN N N 15 114.919 0.1 . 1 . . . A 19 ASN N . 26649 1 183 . 1 1 20 20 THR H H 1 8.579 0.04 . 1 . . . A 20 THR H . 26649 1 184 . 1 1 20 20 THR HA H 1 3.881 0.04 . 1 . . . A 20 THR HA . 26649 1 185 . 1 1 20 20 THR HB H 1 4.125 0.04 . 1 . . . A 20 THR HB . 26649 1 186 . 1 1 20 20 THR HG21 H 1 1.365 0.04 . 1 . . . A 20 THR HG21 . 26649 1 187 . 1 1 20 20 THR HG22 H 1 1.365 0.04 . 1 . . . A 20 THR HG22 . 26649 1 188 . 1 1 20 20 THR HG23 H 1 1.365 0.04 . 1 . . . A 20 THR HG23 . 26649 1 189 . 1 1 20 20 THR C C 13 172.384 0.1 . 1 . . . A 20 THR C . 26649 1 190 . 1 1 20 20 THR CA C 13 62.957 0.1 . 1 . . . A 20 THR CA . 26649 1 191 . 1 1 20 20 THR CB C 13 66.984 0.1 . 1 . . . A 20 THR CB . 26649 1 192 . 1 1 20 20 THR CG2 C 13 23.852 0.1 . 1 . . . A 20 THR CG2 . 26649 1 193 . 1 1 20 20 THR N N 15 110.616 0.1 . 1 . . . A 20 THR N . 26649 1 194 . 1 1 21 21 MET H H 1 6.314 0.04 . 1 . . . A 21 MET H . 26649 1 195 . 1 1 21 21 MET HA H 1 5.074 0.04 . 1 . . . A 21 MET HA . 26649 1 196 . 1 1 21 21 MET HB2 H 1 1.752 0.04 . 2 . . . A 21 MET HB2 . 26649 1 197 . 1 1 21 21 MET HB3 H 1 1.752 0.04 . 2 . . . A 21 MET HB3 . 26649 1 198 . 1 1 21 21 MET HG2 H 1 2.215 0.04 . 2 . . . A 21 MET HG2 . 26649 1 199 . 1 1 21 21 MET HG3 H 1 2.489 0.04 . 2 . . . A 21 MET HG3 . 26649 1 200 . 1 1 21 21 MET HE1 H 1 1.933 0.04 . 1 . . . A 21 MET HE1 . 26649 1 201 . 1 1 21 21 MET HE2 H 1 1.933 0.04 . 1 . . . A 21 MET HE2 . 26649 1 202 . 1 1 21 21 MET HE3 H 1 1.933 0.04 . 1 . . . A 21 MET HE3 . 26649 1 203 . 1 1 21 21 MET C C 13 175.080 0.1 . 1 . . . A 21 MET C . 26649 1 204 . 1 1 21 21 MET CA C 13 53.050 0.1 . 1 . . . A 21 MET CA . 26649 1 205 . 1 1 21 21 MET CB C 13 35.331 0.1 . 1 . . . A 21 MET CB . 26649 1 206 . 1 1 21 21 MET CG C 13 32.430 0.1 . 1 . . . A 21 MET CG . 26649 1 207 . 1 1 21 21 MET CE C 13 16.983 0.1 . 1 . . . A 21 MET CE . 26649 1 208 . 1 1 21 21 MET N N 15 115.910 0.1 . 1 . . . A 21 MET N . 26649 1 209 . 1 1 22 22 PHE H H 1 8.744 0.04 . 1 . . . A 22 PHE H . 26649 1 210 . 1 1 22 22 PHE HA H 1 4.997 0.04 . 1 . . . A 22 PHE HA . 26649 1 211 . 1 1 22 22 PHE HB2 H 1 3.048 0.04 . 2 . . . A 22 PHE HB2 . 26649 1 212 . 1 1 22 22 PHE HB3 H 1 2.428 0.04 . 2 . . . A 22 PHE HB3 . 26649 1 213 . 1 1 22 22 PHE HD1 H 1 7.056 0.04 . 3 . . . A 22 PHE HD1 . 26649 1 214 . 1 1 22 22 PHE HD2 H 1 7.056 0.04 . 3 . . . A 22 PHE HD2 . 26649 1 215 . 1 1 22 22 PHE C C 13 174.953 0.1 . 1 . . . A 22 PHE C . 26649 1 216 . 1 1 22 22 PHE CA C 13 57.220 0.1 . 1 . . . A 22 PHE CA . 26649 1 217 . 1 1 22 22 PHE CB C 13 43.675 0.1 . 1 . . . A 22 PHE CB . 26649 1 218 . 1 1 22 22 PHE N N 15 115.989 0.1 . 1 . . . A 22 PHE N . 26649 1 219 . 1 1 23 23 ARG H H 1 8.661 0.04 . 1 . . . A 23 ARG H . 26649 1 220 . 1 1 23 23 ARG HA H 1 5.236 0.04 . 1 . . . A 23 ARG HA . 26649 1 221 . 1 1 23 23 ARG HB2 H 1 1.680 0.04 . 2 . . . A 23 ARG HB2 . 26649 1 222 . 1 1 23 23 ARG HB3 H 1 1.680 0.04 . 2 . . . A 23 ARG HB3 . 26649 1 223 . 1 1 23 23 ARG HG2 H 1 1.478 0.04 . 2 . . . A 23 ARG HG2 . 26649 1 224 . 1 1 23 23 ARG HG3 H 1 1.621 0.04 . 2 . . . A 23 ARG HG3 . 26649 1 225 . 1 1 23 23 ARG HD2 H 1 3.144 0.04 . 2 . . . A 23 ARG HD2 . 26649 1 226 . 1 1 23 23 ARG HD3 H 1 3.144 0.04 . 2 . . . A 23 ARG HD3 . 26649 1 227 . 1 1 23 23 ARG C C 13 175.828 0.1 . 1 . . . A 23 ARG C . 26649 1 228 . 1 1 23 23 ARG CA C 13 54.933 0.1 . 1 . . . A 23 ARG CA . 26649 1 229 . 1 1 23 23 ARG CB C 13 31.297 0.1 . 1 . . . A 23 ARG CB . 26649 1 230 . 1 1 23 23 ARG CG C 13 27.345 0.1 . 1 . . . A 23 ARG CG . 26649 1 231 . 1 1 23 23 ARG CD C 13 42.629 0.1 . 1 . . . A 23 ARG CD . 26649 1 232 . 1 1 23 23 ARG N N 15 122.523 0.1 . 1 . . . A 23 ARG N . 26649 1 233 . 1 1 24 24 VAL H H 1 9.342 0.04 . 1 . . . A 24 VAL H . 26649 1 234 . 1 1 24 24 VAL HA H 1 4.684 0.04 . 1 . . . A 24 VAL HA . 26649 1 235 . 1 1 24 24 VAL HB H 1 1.745 0.04 . 1 . . . A 24 VAL HB . 26649 1 236 . 1 1 24 24 VAL HG11 H 1 0.671 0.04 . 2 . . . A 24 VAL HG11 . 26649 1 237 . 1 1 24 24 VAL HG12 H 1 0.671 0.04 . 2 . . . A 24 VAL HG12 . 26649 1 238 . 1 1 24 24 VAL HG13 H 1 0.671 0.04 . 2 . . . A 24 VAL HG13 . 26649 1 239 . 1 1 24 24 VAL HG21 H 1 0.476 0.04 . 2 . . . A 24 VAL HG21 . 26649 1 240 . 1 1 24 24 VAL HG22 H 1 0.476 0.04 . 2 . . . A 24 VAL HG22 . 26649 1 241 . 1 1 24 24 VAL HG23 H 1 0.476 0.04 . 2 . . . A 24 VAL HG23 . 26649 1 242 . 1 1 24 24 VAL C C 13 173.637 0.1 . 1 . . . A 24 VAL C . 26649 1 243 . 1 1 24 24 VAL CA C 13 60.500 0.1 . 1 . . . A 24 VAL CA . 26649 1 244 . 1 1 24 24 VAL CB C 13 34.987 0.1 . 1 . . . A 24 VAL CB . 26649 1 245 . 1 1 24 24 VAL CG1 C 13 21.521 0.1 . 1 . . . A 24 VAL CG1 . 26649 1 246 . 1 1 24 24 VAL CG2 C 13 21.297 0.1 . 1 . . . A 24 VAL CG2 . 26649 1 247 . 1 1 24 24 VAL N N 15 126.448 0.1 . 1 . . . A 24 VAL N . 26649 1 248 . 1 1 25 25 GLU H H 1 9.125 0.04 . 1 . . . A 25 GLU H . 26649 1 249 . 1 1 25 25 GLU HA H 1 4.713 0.04 . 1 . . . A 25 GLU HA . 26649 1 250 . 1 1 25 25 GLU HB2 H 1 2.095 0.04 . 2 . . . A 25 GLU HB2 . 26649 1 251 . 1 1 25 25 GLU HB3 H 1 1.906 0.04 . 2 . . . A 25 GLU HB3 . 26649 1 252 . 1 1 25 25 GLU HG2 H 1 2.410 0.04 . 2 . . . A 25 GLU HG2 . 26649 1 253 . 1 1 25 25 GLU HG3 H 1 2.410 0.04 . 2 . . . A 25 GLU HG3 . 26649 1 254 . 1 1 25 25 GLU C C 13 176.160 0.1 . 1 . . . A 25 GLU C . 26649 1 255 . 1 1 25 25 GLU CA C 13 54.867 0.1 . 1 . . . A 25 GLU CA . 26649 1 256 . 1 1 25 25 GLU CB C 13 30.628 0.1 . 1 . . . A 25 GLU CB . 26649 1 257 . 1 1 25 25 GLU N N 15 128.611 0.1 . 1 . . . A 25 GLU N . 26649 1 258 . 1 1 26 26 LEU H H 1 9.305 0.04 . 1 . . . A 26 LEU H . 26649 1 259 . 1 1 26 26 LEU HA H 1 4.829 0.04 . 1 . . . A 26 LEU HA . 26649 1 260 . 1 1 26 26 LEU HB2 H 1 2.446 0.04 . 2 . . . A 26 LEU HB2 . 26649 1 261 . 1 1 26 26 LEU HB3 H 1 1.582 0.04 . 2 . . . A 26 LEU HB3 . 26649 1 262 . 1 1 26 26 LEU HG H 1 1.809 0.04 . 1 . . . A 26 LEU HG . 26649 1 263 . 1 1 26 26 LEU HD11 H 1 0.550 0.04 . 2 . . . A 26 LEU HD11 . 26649 1 264 . 1 1 26 26 LEU HD12 H 1 0.550 0.04 . 2 . . . A 26 LEU HD12 . 26649 1 265 . 1 1 26 26 LEU HD13 H 1 0.550 0.04 . 2 . . . A 26 LEU HD13 . 26649 1 266 . 1 1 26 26 LEU HD21 H 1 0.977 0.04 . 2 . . . A 26 LEU HD21 . 26649 1 267 . 1 1 26 26 LEU HD22 H 1 0.977 0.04 . 2 . . . A 26 LEU HD22 . 26649 1 268 . 1 1 26 26 LEU HD23 H 1 0.977 0.04 . 2 . . . A 26 LEU HD23 . 26649 1 269 . 1 1 26 26 LEU C C 13 179.291 0.1 . 1 . . . A 26 LEU C . 26649 1 270 . 1 1 26 26 LEU CA C 13 54.867 0.1 . 1 . . . A 26 LEU CA . 26649 1 271 . 1 1 26 26 LEU CB C 13 42.752 0.1 . 1 . . . A 26 LEU CB . 26649 1 272 . 1 1 26 26 LEU CG C 13 26.923 0.1 . 1 . . . A 26 LEU CG . 26649 1 273 . 1 1 26 26 LEU CD1 C 13 22.178 0.1 . 1 . . . A 26 LEU CD1 . 26649 1 274 . 1 1 26 26 LEU CD2 C 13 26.767 0.1 . 1 . . . A 26 LEU CD2 . 26649 1 275 . 1 1 26 26 LEU N N 15 129.185 0.1 . 1 . . . A 26 LEU N . 26649 1 276 . 1 1 27 27 GLU H H 1 8.624 0.04 . 1 . . . A 27 GLU H . 26649 1 277 . 1 1 27 27 GLU HA H 1 4.138 0.04 . 1 . . . A 27 GLU HA . 26649 1 278 . 1 1 27 27 GLU HB2 H 1 2.141 0.04 . 2 . . . A 27 GLU HB2 . 26649 1 279 . 1 1 27 27 GLU HB3 H 1 2.141 0.04 . 2 . . . A 27 GLU HB3 . 26649 1 280 . 1 1 27 27 GLU HG2 H 1 2.442 0.04 . 2 . . . A 27 GLU HG2 . 26649 1 281 . 1 1 27 27 GLU HG3 H 1 2.442 0.04 . 2 . . . A 27 GLU HG3 . 26649 1 282 . 1 1 27 27 GLU C C 13 175.981 0.1 . 1 . . . A 27 GLU C . 26649 1 283 . 1 1 27 27 GLU CA C 13 58.528 0.1 . 1 . . . A 27 GLU CA . 26649 1 284 . 1 1 27 27 GLU CB C 13 29.480 0.1 . 1 . . . A 27 GLU CB . 26649 1 285 . 1 1 27 27 GLU CG C 13 34.713 0.1 . 1 . . . A 27 GLU CG . 26649 1 286 . 1 1 27 27 GLU N N 15 119.943 0.1 . 1 . . . A 27 GLU N . 26649 1 287 . 1 1 28 28 ASN H H 1 7.268 0.04 . 1 . . . A 28 ASN H . 26649 1 288 . 1 1 28 28 ASN HA H 1 4.636 0.04 . 1 . . . A 28 ASN HA . 26649 1 289 . 1 1 28 28 ASN HB2 H 1 3.267 0.04 . 2 . . . A 28 ASN HB2 . 26649 1 290 . 1 1 28 28 ASN HB3 H 1 2.753 0.04 . 2 . . . A 28 ASN HB3 . 26649 1 291 . 1 1 28 28 ASN HD21 H 1 7.545 0.04 . 2 . . . A 28 ASN HD21 . 26649 1 292 . 1 1 28 28 ASN HD22 H 1 6.498 0.04 . 2 . . . A 28 ASN HD22 . 26649 1 293 . 1 1 28 28 ASN C C 13 176.489 0.1 . 1 . . . A 28 ASN C . 26649 1 294 . 1 1 28 28 ASN CA C 13 52.281 0.1 . 1 . . . A 28 ASN CA . 26649 1 295 . 1 1 28 28 ASN CB C 13 37.645 0.1 . 1 . . . A 28 ASN CB . 26649 1 296 . 1 1 28 28 ASN N N 15 114.077 0.04 . 1 . . . A 28 ASN N . 26649 1 297 . 1 1 28 28 ASN ND2 N 15 107.976 0.04 . 1 . . . A 28 ASN ND2 . 26649 1 298 . 1 1 29 29 GLY H H 1 8.367 0.04 . 1 . . . A 29 GLY H . 26649 1 299 . 1 1 29 29 GLY HA2 H 1 4.279 0.04 . 2 . . . A 29 GLY HA2 . 26649 1 300 . 1 1 29 29 GLY HA3 H 1 3.721 0.04 . 2 . . . A 29 GLY HA3 . 26649 1 301 . 1 1 29 29 GLY C C 13 174.446 0.1 . 1 . . . A 29 GLY C . 26649 1 302 . 1 1 29 29 GLY CA C 13 45.051 0.1 . 1 . . . A 29 GLY CA . 26649 1 303 . 1 1 29 29 GLY N N 15 108.202 0.1 . 1 . . . A 29 GLY N . 26649 1 304 . 1 1 30 30 HIS H H 1 7.954 0.04 . 1 . . . A 30 HIS H . 26649 1 305 . 1 1 30 30 HIS HA H 1 4.715 0.04 . 1 . . . A 30 HIS HA . 26649 1 306 . 1 1 30 30 HIS HB2 H 1 3.245 0.04 . 2 . . . A 30 HIS HB2 . 26649 1 307 . 1 1 30 30 HIS HB3 H 1 3.245 0.04 . 2 . . . A 30 HIS HB3 . 26649 1 308 . 1 1 30 30 HIS C C 13 173.468 0.1 . 1 . . . A 30 HIS C . 26649 1 309 . 1 1 30 30 HIS CA C 13 55.025 0.1 . 1 . . . A 30 HIS CA . 26649 1 310 . 1 1 30 30 HIS CB C 13 29.166 0.1 . 1 . . . A 30 HIS CB . 26649 1 311 . 1 1 30 30 HIS N N 15 119.105 0.1 . 1 . . . A 30 HIS N . 26649 1 312 . 1 1 31 31 VAL H H 1 8.601 0.04 . 1 . . . A 31 VAL H . 26649 1 313 . 1 1 31 31 VAL HA H 1 5.051 0.04 . 1 . . . A 31 VAL HA . 26649 1 314 . 1 1 31 31 VAL HB H 1 1.903 0.04 . 1 . . . A 31 VAL HB . 26649 1 315 . 1 1 31 31 VAL HG11 H 1 0.904 0.04 . 2 . . . A 31 VAL HG11 . 26649 1 316 . 1 1 31 31 VAL HG12 H 1 0.904 0.04 . 2 . . . A 31 VAL HG12 . 26649 1 317 . 1 1 31 31 VAL HG13 H 1 0.904 0.04 . 2 . . . A 31 VAL HG13 . 26649 1 318 . 1 1 31 31 VAL HG21 H 1 0.759 0.04 . 2 . . . A 31 VAL HG21 . 26649 1 319 . 1 1 31 31 VAL HG22 H 1 0.759 0.04 . 2 . . . A 31 VAL HG22 . 26649 1 320 . 1 1 31 31 VAL HG23 H 1 0.759 0.04 . 2 . . . A 31 VAL HG23 . 26649 1 321 . 1 1 31 31 VAL C C 13 176.209 0.1 . 1 . . . A 31 VAL C . 26649 1 322 . 1 1 31 31 VAL CA C 13 61.271 0.1 . 1 . . . A 31 VAL CA . 26649 1 323 . 1 1 31 31 VAL CB C 13 32.782 0.1 . 1 . . . A 31 VAL CB . 26649 1 324 . 1 1 31 31 VAL CG1 C 13 21.419 0.1 . 1 . . . A 31 VAL CG1 . 26649 1 325 . 1 1 31 31 VAL CG2 C 13 21.759 0.1 . 1 . . . A 31 VAL CG2 . 26649 1 326 . 1 1 31 31 VAL N N 15 124.046 0.1 . 1 . . . A 31 VAL N . 26649 1 327 . 1 1 32 32 VAL H H 1 8.966 0.04 . 1 . . . A 32 VAL H . 26649 1 328 . 1 1 32 32 VAL HA H 1 4.786 0.04 . 1 . . . A 32 VAL HA . 26649 1 329 . 1 1 32 32 VAL HB H 1 1.835 0.04 . 1 . . . A 32 VAL HB . 26649 1 330 . 1 1 32 32 VAL HG11 H 1 0.810 0.04 . 2 . . . A 32 VAL HG11 . 26649 1 331 . 1 1 32 32 VAL HG12 H 1 0.810 0.04 . 2 . . . A 32 VAL HG12 . 26649 1 332 . 1 1 32 32 VAL HG13 H 1 0.810 0.04 . 2 . . . A 32 VAL HG13 . 26649 1 333 . 1 1 32 32 VAL HG21 H 1 0.655 0.04 . 2 . . . A 32 VAL HG21 . 26649 1 334 . 1 1 32 32 VAL HG22 H 1 0.655 0.04 . 2 . . . A 32 VAL HG22 . 26649 1 335 . 1 1 32 32 VAL HG23 H 1 0.655 0.04 . 2 . . . A 32 VAL HG23 . 26649 1 336 . 1 1 32 32 VAL C C 13 175.124 0.1 . 1 . . . A 32 VAL C . 26649 1 337 . 1 1 32 32 VAL CA C 13 58.565 0.1 . 1 . . . A 32 VAL CA . 26649 1 338 . 1 1 32 32 VAL CB C 13 35.287 0.1 . 1 . . . A 32 VAL CB . 26649 1 339 . 1 1 32 32 VAL CG1 C 13 21.874 0.1 . 1 . . . A 32 VAL CG1 . 26649 1 340 . 1 1 32 32 VAL CG2 C 13 18.881 0.1 . 1 . . . A 32 VAL CG2 . 26649 1 341 . 1 1 32 32 VAL N N 15 120.179 0.1 . 1 . . . A 32 VAL N . 26649 1 342 . 1 1 33 33 THR H H 1 8.235 0.04 . 1 . . . A 33 THR H . 26649 1 343 . 1 1 33 33 THR HA H 1 5.061 0.04 . 1 . . . A 33 THR HA . 26649 1 344 . 1 1 33 33 THR HB H 1 4.085 0.04 . 1 . . . A 33 THR HB . 26649 1 345 . 1 1 33 33 THR HG21 H 1 1.148 0.04 . 1 . . . A 33 THR HG21 . 26649 1 346 . 1 1 33 33 THR HG22 H 1 1.148 0.04 . 1 . . . A 33 THR HG22 . 26649 1 347 . 1 1 33 33 THR HG23 H 1 1.148 0.04 . 1 . . . A 33 THR HG23 . 26649 1 348 . 1 1 33 33 THR C C 13 174.171 0.1 . 1 . . . A 33 THR C . 26649 1 349 . 1 1 33 33 THR CA C 13 62.250 0.1 . 1 . . . A 33 THR CA . 26649 1 350 . 1 1 33 33 THR CB C 13 69.031 0.1 . 1 . . . A 33 THR CB . 26649 1 351 . 1 1 33 33 THR CG2 C 13 21.991 0.1 . 1 . . . A 33 THR CG2 . 26649 1 352 . 1 1 33 33 THR N N 15 118.645 0.1 . 1 . . . A 33 THR N . 26649 1 353 . 1 1 34 34 ALA H H 1 9.777 0.04 . 1 . . . A 34 ALA H . 26649 1 354 . 1 1 34 34 ALA HA H 1 5.572 0.04 . 1 . . . A 34 ALA HA . 26649 1 355 . 1 1 34 34 ALA HB1 H 1 1.151 0.04 . 1 . . . A 34 ALA HB1 . 26649 1 356 . 1 1 34 34 ALA HB2 H 1 1.151 0.04 . 1 . . . A 34 ALA HB2 . 26649 1 357 . 1 1 34 34 ALA HB3 H 1 1.151 0.04 . 1 . . . A 34 ALA HB3 . 26649 1 358 . 1 1 34 34 ALA C C 13 175.686 0.1 . 1 . . . A 34 ALA C . 26649 1 359 . 1 1 34 34 ALA CA C 13 50.028 0.1 . 1 . . . A 34 ALA CA . 26649 1 360 . 1 1 34 34 ALA CB C 13 23.217 0.1 . 1 . . . A 34 ALA CB . 26649 1 361 . 1 1 34 34 ALA N N 15 129.128 0.1 . 1 . . . A 34 ALA N . 26649 1 362 . 1 1 35 35 HIS H H 1 7.712 0.04 . 1 . . . A 35 HIS H . 26649 1 363 . 1 1 35 35 HIS HA H 1 5.511 0.04 . 1 . . . A 35 HIS HA . 26649 1 364 . 1 1 35 35 HIS HB2 H 1 3.583 0.04 . 2 . . . A 35 HIS HB2 . 26649 1 365 . 1 1 35 35 HIS HB3 H 1 3.421 0.04 . 2 . . . A 35 HIS HB3 . 26649 1 366 . 1 1 35 35 HIS C C 13 174.302 0.1 . 1 . . . A 35 HIS C . 26649 1 367 . 1 1 35 35 HIS CA C 13 53.644 0.1 . 1 . . . A 35 HIS CA . 26649 1 368 . 1 1 35 35 HIS CB C 13 32.144 0.1 . 1 . . . A 35 HIS CB . 26649 1 369 . 1 1 35 35 HIS N N 15 116.059 0.1 . 1 . . . A 35 HIS N . 26649 1 370 . 1 1 36 36 ILE H H 1 9.509 0.04 . 1 . . . A 36 ILE H . 26649 1 371 . 1 1 36 36 ILE HA H 1 4.509 0.04 . 1 . . . A 36 ILE HA . 26649 1 372 . 1 1 36 36 ILE HB H 1 1.993 0.04 . 1 . . . A 36 ILE HB . 26649 1 373 . 1 1 36 36 ILE HG12 H 1 1.283 0.04 . 2 . . . A 36 ILE HG12 . 26649 1 374 . 1 1 36 36 ILE HG13 H 1 1.650 0.04 . 2 . . . A 36 ILE HG13 . 26649 1 375 . 1 1 36 36 ILE HG21 H 1 1.026 0.04 . 1 . . . A 36 ILE HG21 . 26649 1 376 . 1 1 36 36 ILE HG22 H 1 1.026 0.04 . 1 . . . A 36 ILE HG22 . 26649 1 377 . 1 1 36 36 ILE HG23 H 1 1.026 0.04 . 1 . . . A 36 ILE HG23 . 26649 1 378 . 1 1 36 36 ILE HD11 H 1 0.794 0.04 . 1 . . . A 36 ILE HD11 . 26649 1 379 . 1 1 36 36 ILE HD12 H 1 0.794 0.04 . 1 . . . A 36 ILE HD12 . 26649 1 380 . 1 1 36 36 ILE HD13 H 1 0.794 0.04 . 1 . . . A 36 ILE HD13 . 26649 1 381 . 1 1 36 36 ILE C C 13 175.686 0.1 . 1 . . . A 36 ILE C . 26649 1 382 . 1 1 36 36 ILE CA C 13 61.536 0.1 . 1 . . . A 36 ILE CA . 26649 1 383 . 1 1 36 36 ILE CB C 13 39.661 0.1 . 1 . . . A 36 ILE CB . 26649 1 384 . 1 1 36 36 ILE CG1 C 13 27.137 0.1 . 1 . . . A 36 ILE CG1 . 26649 1 385 . 1 1 36 36 ILE CG2 C 13 18.370 0.1 . 1 . . . A 36 ILE CG2 . 26649 1 386 . 1 1 36 36 ILE CD1 C 13 13.974 0.1 . 1 . . . A 36 ILE CD1 . 26649 1 387 . 1 1 36 36 ILE N N 15 119.551 0.1 . 1 . . . A 36 ILE N . 26649 1 388 . 1 1 37 37 SER H H 1 8.427 0.04 . 1 . . . A 37 SER H . 26649 1 389 . 1 1 37 37 SER HA H 1 4.543 0.04 . 1 . . . A 37 SER HA . 26649 1 390 . 1 1 37 37 SER HB2 H 1 4.152 0.04 . 2 . . . A 37 SER HB2 . 26649 1 391 . 1 1 37 37 SER HB3 H 1 3.879 0.04 . 2 . . . A 37 SER HB3 . 26649 1 392 . 1 1 37 37 SER C C 13 175.073 0.1 . 1 . . . A 37 SER C . 26649 1 393 . 1 1 37 37 SER CA C 13 58.022 0.1 . 1 . . . A 37 SER CA . 26649 1 394 . 1 1 37 37 SER CB C 13 64.686 0.1 . 1 . . . A 37 SER CB . 26649 1 395 . 1 1 37 37 SER N N 15 120.084 0.1 . 1 . . . A 37 SER N . 26649 1 396 . 1 1 38 38 GLY H H 1 9.059 0.04 . 1 . . . A 38 GLY H . 26649 1 397 . 1 1 38 38 GLY HA2 H 1 4.091 0.04 . 2 . . . A 38 GLY HA2 . 26649 1 398 . 1 1 38 38 GLY HA3 H 1 3.857 0.04 . 2 . . . A 38 GLY HA3 . 26649 1 399 . 1 1 38 38 GLY C C 13 176.124 0.1 . 1 . . . A 38 GLY C . 26649 1 400 . 1 1 38 38 GLY CA C 13 47.023 0.1 . 1 . . . A 38 GLY CA . 26649 1 401 . 1 1 38 38 GLY N N 15 112.268 0.1 . 1 . . . A 38 GLY N . 26649 1 402 . 1 1 39 39 LYS H H 1 8.346 0.04 . 1 . . . A 39 LYS H . 26649 1 403 . 1 1 39 39 LYS HA H 1 4.111 0.04 . 1 . . . A 39 LYS HA . 26649 1 404 . 1 1 39 39 LYS HB2 H 1 1.856 0.04 . 2 . . . A 39 LYS HB2 . 26649 1 405 . 1 1 39 39 LYS HB3 H 1 1.856 0.04 . 2 . . . A 39 LYS HB3 . 26649 1 406 . 1 1 39 39 LYS C C 13 178.155 0.1 . 1 . . . A 39 LYS C . 26649 1 407 . 1 1 39 39 LYS CA C 13 58.525 0.1 . 1 . . . A 39 LYS CA . 26649 1 408 . 1 1 39 39 LYS CB C 13 32.681 0.1 . 1 . . . A 39 LYS CB . 26649 1 409 . 1 1 39 39 LYS N N 15 121.027 0.1 . 1 . . . A 39 LYS N . 26649 1 410 . 1 1 40 40 MET H H 1 7.741 0.04 . 1 . . . A 40 MET H . 26649 1 411 . 1 1 40 40 MET HA H 1 4.281 0.04 . 1 . . . A 40 MET HA . 26649 1 412 . 1 1 40 40 MET HB2 H 1 2.534 0.04 . 2 . . . A 40 MET HB2 . 26649 1 413 . 1 1 40 40 MET HB3 H 1 2.062 0.04 . 2 . . . A 40 MET HB3 . 26649 1 414 . 1 1 40 40 MET HG2 H 1 2.092 0.04 . 2 . . . A 40 MET HG2 . 26649 1 415 . 1 1 40 40 MET HG3 H 1 2.436 0.04 . 2 . . . A 40 MET HG3 . 26649 1 416 . 1 1 40 40 MET HE1 H 1 1.857 0.04 . 1 . . . A 40 MET HE1 . 26649 1 417 . 1 1 40 40 MET HE2 H 1 1.857 0.04 . 1 . . . A 40 MET HE2 . 26649 1 418 . 1 1 40 40 MET HE3 H 1 1.857 0.04 . 1 . . . A 40 MET HE3 . 26649 1 419 . 1 1 40 40 MET C C 13 177.179 0.1 . 1 . . . A 40 MET C . 26649 1 420 . 1 1 40 40 MET CA C 13 56.702 0.1 . 1 . . . A 40 MET CA . 26649 1 421 . 1 1 40 40 MET CB C 13 32.997 0.1 . 1 . . . A 40 MET CB . 26649 1 422 . 1 1 40 40 MET CG C 13 33.133 0.1 . 1 . . . A 40 MET CG . 26649 1 423 . 1 1 40 40 MET CE C 13 17.395 0.1 . 1 . . . A 40 MET CE . 26649 1 424 . 1 1 40 40 MET N N 15 118.288 0.1 . 1 . . . A 40 MET N . 26649 1 425 . 1 1 41 41 ARG H H 1 7.948 0.04 . 1 . . . A 41 ARG H . 26649 1 426 . 1 1 41 41 ARG HA H 1 4.061 0.04 . 1 . . . A 41 ARG HA . 26649 1 427 . 1 1 41 41 ARG HB2 H 1 1.882 0.04 . 2 . . . A 41 ARG HB2 . 26649 1 428 . 1 1 41 41 ARG HB3 H 1 1.882 0.04 . 2 . . . A 41 ARG HB3 . 26649 1 429 . 1 1 41 41 ARG HG2 H 1 1.637 0.04 . 2 . . . A 41 ARG HG2 . 26649 1 430 . 1 1 41 41 ARG HG3 H 1 1.812 0.04 . 2 . . . A 41 ARG HG3 . 26649 1 431 . 1 1 41 41 ARG HD2 H 1 3.217 0.04 . 2 . . . A 41 ARG HD2 . 26649 1 432 . 1 1 41 41 ARG HD3 H 1 3.217 0.04 . 2 . . . A 41 ARG HD3 . 26649 1 433 . 1 1 41 41 ARG C C 13 177.749 0.1 . 1 . . . A 41 ARG C . 26649 1 434 . 1 1 41 41 ARG CA C 13 58.023 0.1 . 1 . . . A 41 ARG CA . 26649 1 435 . 1 1 41 41 ARG CB C 13 30.279 0.1 . 1 . . . A 41 ARG CB . 26649 1 436 . 1 1 41 41 ARG CG C 13 27.412 0.1 . 1 . . . A 41 ARG CG . 26649 1 437 . 1 1 41 41 ARG CD C 13 43.249 0.1 . 1 . . . A 41 ARG CD . 26649 1 438 . 1 1 41 41 ARG N N 15 119.988 0.1 . 1 . . . A 41 ARG N . 26649 1 439 . 1 1 42 42 LYS H H 1 7.895 0.04 . 1 . . . A 42 LYS H . 26649 1 440 . 1 1 42 42 LYS HA H 1 4.078 0.04 . 1 . . . A 42 LYS HA . 26649 1 441 . 1 1 42 42 LYS HB2 H 1 1.813 0.04 . 2 . . . A 42 LYS HB2 . 26649 1 442 . 1 1 42 42 LYS HB3 H 1 1.813 0.04 . 2 . . . A 42 LYS HB3 . 26649 1 443 . 1 1 42 42 LYS HG2 H 1 1.448 0.04 . 2 . . . A 42 LYS HG2 . 26649 1 444 . 1 1 42 42 LYS HG3 H 1 1.448 0.04 . 2 . . . A 42 LYS HG3 . 26649 1 445 . 1 1 42 42 LYS HD2 H 1 1.660 0.04 . 2 . . . A 42 LYS HD2 . 26649 1 446 . 1 1 42 42 LYS HD3 H 1 1.660 0.04 . 2 . . . A 42 LYS HD3 . 26649 1 447 . 1 1 42 42 LYS HE2 H 1 2.965 0.04 . 2 . . . A 42 LYS HE2 . 26649 1 448 . 1 1 42 42 LYS HE3 H 1 2.965 0.04 . 2 . . . A 42 LYS HE3 . 26649 1 449 . 1 1 42 42 LYS C C 13 176.430 0.1 . 1 . . . A 42 LYS C . 26649 1 450 . 1 1 42 42 LYS CA C 13 57.508 0.1 . 1 . . . A 42 LYS CA . 26649 1 451 . 1 1 42 42 LYS CB C 13 32.547 0.1 . 1 . . . A 42 LYS CB . 26649 1 452 . 1 1 42 42 LYS N N 15 119.136 0.1 . 1 . . . A 42 LYS N . 26649 1 453 . 1 1 43 43 ASN H H 1 7.840 0.04 . 1 . . . A 43 ASN H . 26649 1 454 . 1 1 43 43 ASN HA H 1 4.666 0.04 . 1 . . . A 43 ASN HA . 26649 1 455 . 1 1 43 43 ASN HB2 H 1 2.769 0.04 . 2 . . . A 43 ASN HB2 . 26649 1 456 . 1 1 43 43 ASN HB3 H 1 2.647 0.04 . 2 . . . A 43 ASN HB3 . 26649 1 457 . 1 1 43 43 ASN C C 13 174.310 0.1 . 1 . . . A 43 ASN C . 26649 1 458 . 1 1 43 43 ASN CA C 13 53.145 0.1 . 1 . . . A 43 ASN CA . 26649 1 459 . 1 1 43 43 ASN CB C 13 38.829 0.1 . 1 . . . A 43 ASN CB . 26649 1 460 . 1 1 43 43 ASN N N 15 116.823 0.1 . 1 . . . A 43 ASN N . 26649 1 461 . 1 1 44 44 TYR H H 1 7.701 0.04 . 1 . . . A 44 TYR H . 26649 1 462 . 1 1 44 44 TYR HA H 1 4.357 0.04 . 1 . . . A 44 TYR HA . 26649 1 463 . 1 1 44 44 TYR HB2 H 1 3.028 0.04 . 2 . . . A 44 TYR HB2 . 26649 1 464 . 1 1 44 44 TYR HB3 H 1 3.028 0.04 . 2 . . . A 44 TYR HB3 . 26649 1 465 . 1 1 44 44 TYR HD1 H 1 7.011 0.04 . 3 . . . A 44 TYR HD1 . 26649 1 466 . 1 1 44 44 TYR HD2 H 1 7.011 0.04 . 3 . . . A 44 TYR HD2 . 26649 1 467 . 1 1 44 44 TYR C C 13 175.072 0.1 . 1 . . . A 44 TYR C . 26649 1 468 . 1 1 44 44 TYR CA C 13 58.494 0.1 . 1 . . . A 44 TYR CA . 26649 1 469 . 1 1 44 44 TYR CB C 13 37.680 0.1 . 1 . . . A 44 TYR CB . 26649 1 470 . 1 1 44 44 TYR N N 15 118.475 0.1 . 1 . . . A 44 TYR N . 26649 1 471 . 1 1 45 45 ILE H H 1 7.538 0.04 . 1 . . . A 45 ILE H . 26649 1 472 . 1 1 45 45 ILE HA H 1 3.912 0.04 . 1 . . . A 45 ILE HA . 26649 1 473 . 1 1 45 45 ILE HB H 1 1.690 0.04 . 1 . . . A 45 ILE HB . 26649 1 474 . 1 1 45 45 ILE HG12 H 1 1.384 0.04 . 2 . . . A 45 ILE HG12 . 26649 1 475 . 1 1 45 45 ILE HG13 H 1 1.110 0.04 . 2 . . . A 45 ILE HG13 . 26649 1 476 . 1 1 45 45 ILE HG21 H 1 0.753 0.04 . 1 . . . A 45 ILE HG21 . 26649 1 477 . 1 1 45 45 ILE HG22 H 1 0.753 0.04 . 1 . . . A 45 ILE HG22 . 26649 1 478 . 1 1 45 45 ILE HG23 H 1 0.753 0.04 . 1 . . . A 45 ILE HG23 . 26649 1 479 . 1 1 45 45 ILE HD11 H 1 0.759 0.04 . 1 . . . A 45 ILE HD11 . 26649 1 480 . 1 1 45 45 ILE HD12 H 1 0.759 0.04 . 1 . . . A 45 ILE HD12 . 26649 1 481 . 1 1 45 45 ILE HD13 H 1 0.759 0.04 . 1 . . . A 45 ILE HD13 . 26649 1 482 . 1 1 45 45 ILE C C 13 174.790 0.1 . 1 . . . A 45 ILE C . 26649 1 483 . 1 1 45 45 ILE CA C 13 60.664 0.1 . 1 . . . A 45 ILE CA . 26649 1 484 . 1 1 45 45 ILE CB C 13 38.447 0.1 . 1 . . . A 45 ILE CB . 26649 1 485 . 1 1 45 45 ILE CG1 C 13 27.296 0.1 . 1 . . . A 45 ILE CG1 . 26649 1 486 . 1 1 45 45 ILE CG2 C 13 17.236 0.1 . 1 . . . A 45 ILE CG2 . 26649 1 487 . 1 1 45 45 ILE CD1 C 13 12.314 0.1 . 1 . . . A 45 ILE CD1 . 26649 1 488 . 1 1 45 45 ILE N N 15 123.061 0.1 . 1 . . . A 45 ILE N . 26649 1 489 . 1 1 46 46 ARG H H 1 8.105 0.04 . 1 . . . A 46 ARG H . 26649 1 490 . 1 1 46 46 ARG HA H 1 4.188 0.04 . 1 . . . A 46 ARG HA . 26649 1 491 . 1 1 46 46 ARG HB2 H 1 1.729 0.04 . 2 . . . A 46 ARG HB2 . 26649 1 492 . 1 1 46 46 ARG HB3 H 1 1.729 0.04 . 2 . . . A 46 ARG HB3 . 26649 1 493 . 1 1 46 46 ARG HG2 H 1 1.531 0.04 . 2 . . . A 46 ARG HG2 . 26649 1 494 . 1 1 46 46 ARG HG3 H 1 1.608 0.04 . 2 . . . A 46 ARG HG3 . 26649 1 495 . 1 1 46 46 ARG HD2 H 1 3.188 0.04 . 2 . . . A 46 ARG HD2 . 26649 1 496 . 1 1 46 46 ARG HD3 H 1 3.188 0.04 . 2 . . . A 46 ARG HD3 . 26649 1 497 . 1 1 46 46 ARG C C 13 174.870 0.1 . 1 . . . A 46 ARG C . 26649 1 498 . 1 1 46 46 ARG CA C 13 55.975 0.1 . 1 . . . A 46 ARG CA . 26649 1 499 . 1 1 46 46 ARG CB C 13 31.105 0.1 . 1 . . . A 46 ARG CB . 26649 1 500 . 1 1 46 46 ARG CG C 13 27.004 0.1 . 1 . . . A 46 ARG CG . 26649 1 501 . 1 1 46 46 ARG CD C 13 43.395 0.1 . 1 . . . A 46 ARG CD . 26649 1 502 . 1 1 46 46 ARG N N 15 125.163 0.1 . 1 . . . A 46 ARG N . 26649 1 503 . 1 1 47 47 ILE H H 1 8.072 0.04 . 1 . . . A 47 ILE H . 26649 1 504 . 1 1 47 47 ILE HA H 1 3.974 0.04 . 1 . . . A 47 ILE HA . 26649 1 505 . 1 1 47 47 ILE HB H 1 1.429 0.04 . 1 . . . A 47 ILE HB . 26649 1 506 . 1 1 47 47 ILE HG12 H 1 1.269 0.04 . 2 . . . A 47 ILE HG12 . 26649 1 507 . 1 1 47 47 ILE HG13 H 1 0.683 0.04 . 2 . . . A 47 ILE HG13 . 26649 1 508 . 1 1 47 47 ILE HG21 H 1 0.217 0.04 . 1 . . . A 47 ILE HG21 . 26649 1 509 . 1 1 47 47 ILE HG22 H 1 0.217 0.04 . 1 . . . A 47 ILE HG22 . 26649 1 510 . 1 1 47 47 ILE HG23 H 1 0.217 0.04 . 1 . . . A 47 ILE HG23 . 26649 1 511 . 1 1 47 47 ILE HD11 H 1 0.349 0.04 . 1 . . . A 47 ILE HD11 . 26649 1 512 . 1 1 47 47 ILE HD12 H 1 0.349 0.04 . 1 . . . A 47 ILE HD12 . 26649 1 513 . 1 1 47 47 ILE HD13 H 1 0.349 0.04 . 1 . . . A 47 ILE HD13 . 26649 1 514 . 1 1 47 47 ILE C C 13 173.723 0.1 . 1 . . . A 47 ILE C . 26649 1 515 . 1 1 47 47 ILE CA C 13 60.416 0.1 . 1 . . . A 47 ILE CA . 26649 1 516 . 1 1 47 47 ILE CB C 13 37.751 0.1 . 1 . . . A 47 ILE CB . 26649 1 517 . 1 1 47 47 ILE CG1 C 13 27.654 0.1 . 1 . . . A 47 ILE CG1 . 26649 1 518 . 1 1 47 47 ILE CG2 C 13 18.599 0.1 . 1 . . . A 47 ILE CG2 . 26649 1 519 . 1 1 47 47 ILE CD1 C 13 12.705 0.1 . 1 . . . A 47 ILE CD1 . 26649 1 520 . 1 1 47 47 ILE N N 15 126.439 0.1 . 1 . . . A 47 ILE N . 26649 1 521 . 1 1 48 48 LEU H H 1 8.662 0.04 . 1 . . . A 48 LEU H . 26649 1 522 . 1 1 48 48 LEU HA H 1 4.721 0.04 . 1 . . . A 48 LEU HA . 26649 1 523 . 1 1 48 48 LEU HB2 H 1 1.534 0.04 . 2 . . . A 48 LEU HB2 . 26649 1 524 . 1 1 48 48 LEU HB3 H 1 1.534 0.04 . 2 . . . A 48 LEU HB3 . 26649 1 525 . 1 1 48 48 LEU HG H 1 1.409 0.04 . 1 . . . A 48 LEU HG . 26649 1 526 . 1 1 48 48 LEU HD11 H 1 0.821 0.04 . 2 . . . A 48 LEU HD11 . 26649 1 527 . 1 1 48 48 LEU HD12 H 1 0.821 0.04 . 2 . . . A 48 LEU HD12 . 26649 1 528 . 1 1 48 48 LEU HD13 H 1 0.821 0.04 . 2 . . . A 48 LEU HD13 . 26649 1 529 . 1 1 48 48 LEU HD21 H 1 1.081 0.04 . 2 . . . A 48 LEU HD21 . 26649 1 530 . 1 1 48 48 LEU HD22 H 1 1.081 0.04 . 2 . . . A 48 LEU HD22 . 26649 1 531 . 1 1 48 48 LEU HD23 H 1 1.081 0.04 . 2 . . . A 48 LEU HD23 . 26649 1 532 . 1 1 48 48 LEU C C 13 177.100 0.1 . 1 . . . A 48 LEU C . 26649 1 533 . 1 1 48 48 LEU CA C 13 52.614 0.1 . 1 . . . A 48 LEU CA . 26649 1 534 . 1 1 48 48 LEU CB C 13 44.980 0.1 . 1 . . . A 48 LEU CB . 26649 1 535 . 1 1 48 48 LEU CD1 C 13 26.247 0.1 . 1 . . . A 48 LEU CD1 . 26649 1 536 . 1 1 48 48 LEU N N 15 127.845 0.1 . 1 . . . A 48 LEU N . 26649 1 537 . 1 1 49 49 THR H H 1 8.281 0.04 . 1 . . . A 49 THR H . 26649 1 538 . 1 1 49 49 THR HA H 1 3.611 0.04 . 1 . . . A 49 THR HA . 26649 1 539 . 1 1 49 49 THR HB H 1 3.883 0.04 . 1 . . . A 49 THR HB . 26649 1 540 . 1 1 49 49 THR HG21 H 1 1.170 0.04 . 1 . . . A 49 THR HG21 . 26649 1 541 . 1 1 49 49 THR HG22 H 1 1.170 0.04 . 1 . . . A 49 THR HG22 . 26649 1 542 . 1 1 49 49 THR HG23 H 1 1.170 0.04 . 1 . . . A 49 THR HG23 . 26649 1 543 . 1 1 49 49 THR C C 13 175.507 0.1 . 1 . . . A 49 THR C . 26649 1 544 . 1 1 49 49 THR CA C 13 65.401 0.1 . 1 . . . A 49 THR CA . 26649 1 545 . 1 1 49 49 THR CB C 13 68.146 0.1 . 1 . . . A 49 THR CB . 26649 1 546 . 1 1 49 49 THR CG2 C 13 22.708 0.1 . 1 . . . A 49 THR CG2 . 26649 1 547 . 1 1 49 49 THR N N 15 115.775 0.1 . 1 . . . A 49 THR N . 26649 1 548 . 1 1 50 50 GLY H H 1 9.211 0.04 . 1 . . . A 50 GLY H . 26649 1 549 . 1 1 50 50 GLY HA2 H 1 4.464 0.04 . 2 . . . A 50 GLY HA2 . 26649 1 550 . 1 1 50 50 GLY HA3 H 1 3.491 0.04 . 2 . . . A 50 GLY HA3 . 26649 1 551 . 1 1 50 50 GLY C C 13 174.433 0.1 . 1 . . . A 50 GLY C . 26649 1 552 . 1 1 50 50 GLY CA C 13 44.608 0.1 . 1 . . . A 50 GLY CA . 26649 1 553 . 1 1 50 50 GLY N N 15 116.246 0.1 . 1 . . . A 50 GLY N . 26649 1 554 . 1 1 51 51 ASP H H 1 8.114 0.04 . 1 . . . A 51 ASP H . 26649 1 555 . 1 1 51 51 ASP HA H 1 4.575 0.04 . 1 . . . A 51 ASP HA . 26649 1 556 . 1 1 51 51 ASP HB2 H 1 2.773 0.04 . 2 . . . A 51 ASP HB2 . 26649 1 557 . 1 1 51 51 ASP HB3 H 1 2.355 0.04 . 2 . . . A 51 ASP HB3 . 26649 1 558 . 1 1 51 51 ASP C C 13 175.571 0.1 . 1 . . . A 51 ASP C . 26649 1 559 . 1 1 51 51 ASP CA C 13 55.423 0.1 . 1 . . . A 51 ASP CA . 26649 1 560 . 1 1 51 51 ASP CB C 13 40.927 0.1 . 1 . . . A 51 ASP CB . 26649 1 561 . 1 1 51 51 ASP N N 15 121.695 0.1 . 1 . . . A 51 ASP N . 26649 1 562 . 1 1 52 52 LYS H H 1 8.504 0.04 . 1 . . . A 52 LYS H . 26649 1 563 . 1 1 52 52 LYS HA H 1 5.094 0.04 . 1 . . . A 52 LYS HA . 26649 1 564 . 1 1 52 52 LYS HB2 H 1 1.896 0.04 . 2 . . . A 52 LYS HB2 . 26649 1 565 . 1 1 52 52 LYS HB3 H 1 1.896 0.04 . 2 . . . A 52 LYS HB3 . 26649 1 566 . 1 1 52 52 LYS C C 13 176.630 0.1 . 1 . . . A 52 LYS C . 26649 1 567 . 1 1 52 52 LYS CA C 13 54.821 0.1 . 1 . . . A 52 LYS CA . 26649 1 568 . 1 1 52 52 LYS CB C 13 32.365 0.1 . 1 . . . A 52 LYS CB . 26649 1 569 . 1 1 52 52 LYS N N 15 121.380 0.1 . 1 . . . A 52 LYS N . 26649 1 570 . 1 1 53 53 VAL H H 1 8.730 0.04 . 1 . . . A 53 VAL H . 26649 1 571 . 1 1 53 53 VAL HA H 1 5.183 0.04 . 1 . . . A 53 VAL HA . 26649 1 572 . 1 1 53 53 VAL HB H 1 2.234 0.04 . 1 . . . A 53 VAL HB . 26649 1 573 . 1 1 53 53 VAL HG11 H 1 0.624 0.04 . 2 . . . A 53 VAL HG11 . 26649 1 574 . 1 1 53 53 VAL HG12 H 1 0.624 0.04 . 2 . . . A 53 VAL HG12 . 26649 1 575 . 1 1 53 53 VAL HG13 H 1 0.624 0.04 . 2 . . . A 53 VAL HG13 . 26649 1 576 . 1 1 53 53 VAL HG21 H 1 0.367 0.04 . 2 . . . A 53 VAL HG21 . 26649 1 577 . 1 1 53 53 VAL HG22 H 1 0.367 0.04 . 2 . . . A 53 VAL HG22 . 26649 1 578 . 1 1 53 53 VAL HG23 H 1 0.367 0.04 . 2 . . . A 53 VAL HG23 . 26649 1 579 . 1 1 53 53 VAL C C 13 174.865 0.1 . 1 . . . A 53 VAL C . 26649 1 580 . 1 1 53 53 VAL CA C 13 57.916 0.1 . 1 . . . A 53 VAL CA . 26649 1 581 . 1 1 53 53 VAL CB C 13 36.252 0.1 . 1 . . . A 53 VAL CB . 26649 1 582 . 1 1 53 53 VAL CG1 C 13 22.006 0.1 . 1 . . . A 53 VAL CG1 . 26649 1 583 . 1 1 53 53 VAL CG2 C 13 18.410 0.1 . 1 . . . A 53 VAL CG2 . 26649 1 584 . 1 1 53 53 VAL N N 15 115.067 0.1 . 1 . . . A 53 VAL N . 26649 1 585 . 1 1 54 54 ARG H H 1 8.208 0.04 . 1 . . . A 54 ARG H . 26649 1 586 . 1 1 54 54 ARG HA H 1 4.894 0.04 . 1 . . . A 54 ARG HA . 26649 1 587 . 1 1 54 54 ARG HB2 H 1 1.630 0.04 . 2 . . . A 54 ARG HB2 . 26649 1 588 . 1 1 54 54 ARG HB3 H 1 1.630 0.04 . 2 . . . A 54 ARG HB3 . 26649 1 589 . 1 1 54 54 ARG HG2 H 1 1.457 0.04 . 2 . . . A 54 ARG HG2 . 26649 1 590 . 1 1 54 54 ARG HG3 H 1 1.406 0.04 . 2 . . . A 54 ARG HG3 . 26649 1 591 . 1 1 54 54 ARG HD2 H 1 2.961 0.04 . 2 . . . A 54 ARG HD2 . 26649 1 592 . 1 1 54 54 ARG HD3 H 1 2.847 0.04 . 2 . . . A 54 ARG HD3 . 26649 1 593 . 1 1 54 54 ARG C C 13 175.140 0.1 . 1 . . . A 54 ARG C . 26649 1 594 . 1 1 54 54 ARG CA C 13 55.500 0.1 . 1 . . . A 54 ARG CA . 26649 1 595 . 1 1 54 54 ARG CB C 13 33.001 0.1 . 1 . . . A 54 ARG CB . 26649 1 596 . 1 1 54 54 ARG CG C 13 28.073 0.1 . 1 . . . A 54 ARG CG . 26649 1 597 . 1 1 54 54 ARG CD C 13 43.237 0.1 . 1 . . . A 54 ARG CD . 26649 1 598 . 1 1 54 54 ARG N N 15 118.772 0.1 . 1 . . . A 54 ARG N . 26649 1 599 . 1 1 55 55 VAL H H 1 8.961 0.04 . 1 . . . A 55 VAL H . 26649 1 600 . 1 1 55 55 VAL HA H 1 4.742 0.04 . 1 . . . A 55 VAL HA . 26649 1 601 . 1 1 55 55 VAL HB H 1 1.716 0.04 . 1 . . . A 55 VAL HB . 26649 1 602 . 1 1 55 55 VAL HG11 H 1 0.555 0.04 . 2 . . . A 55 VAL HG11 . 26649 1 603 . 1 1 55 55 VAL HG12 H 1 0.555 0.04 . 2 . . . A 55 VAL HG12 . 26649 1 604 . 1 1 55 55 VAL HG13 H 1 0.555 0.04 . 2 . . . A 55 VAL HG13 . 26649 1 605 . 1 1 55 55 VAL HG21 H 1 0.596 0.04 . 2 . . . A 55 VAL HG21 . 26649 1 606 . 1 1 55 55 VAL HG22 H 1 0.596 0.04 . 2 . . . A 55 VAL HG22 . 26649 1 607 . 1 1 55 55 VAL HG23 H 1 0.596 0.04 . 2 . . . A 55 VAL HG23 . 26649 1 608 . 1 1 55 55 VAL C C 13 173.816 0.1 . 1 . . . A 55 VAL C . 26649 1 609 . 1 1 55 55 VAL CA C 13 59.506 0.1 . 1 . . . A 55 VAL CA . 26649 1 610 . 1 1 55 55 VAL CB C 13 34.904 0.1 . 1 . . . A 55 VAL CB . 26649 1 611 . 1 1 55 55 VAL CG1 C 13 22.328 0.1 . 1 . . . A 55 VAL CG1 . 26649 1 612 . 1 1 55 55 VAL CG2 C 13 22.079 0.1 . 1 . . . A 55 VAL CG2 . 26649 1 613 . 1 1 55 55 VAL N N 15 121.560 0.1 . 1 . . . A 55 VAL N . 26649 1 614 . 1 1 56 56 GLU H H 1 9.296 0.04 . 1 . . . A 56 GLU H . 26649 1 615 . 1 1 56 56 GLU HA H 1 4.903 0.04 . 1 . . . A 56 GLU HA . 26649 1 616 . 1 1 56 56 GLU HB2 H 1 1.937 0.04 . 2 . . . A 56 GLU HB2 . 26649 1 617 . 1 1 56 56 GLU HB3 H 1 2.028 0.04 . 2 . . . A 56 GLU HB3 . 26649 1 618 . 1 1 56 56 GLU HG2 H 1 2.154 0.04 . 2 . . . A 56 GLU HG2 . 26649 1 619 . 1 1 56 56 GLU HG3 H 1 2.250 0.04 . 2 . . . A 56 GLU HG3 . 26649 1 620 . 1 1 56 56 GLU C C 13 176.010 0.1 . 1 . . . A 56 GLU C . 26649 1 621 . 1 1 56 56 GLU CA C 13 54.631 0.1 . 1 . . . A 56 GLU CA . 26649 1 622 . 1 1 56 56 GLU CB C 13 31.688 0.1 . 1 . . . A 56 GLU CB . 26649 1 623 . 1 1 56 56 GLU N N 15 126.127 0.1 . 1 . . . A 56 GLU N . 26649 1 624 . 1 1 57 57 LEU H H 1 9.057 0.04 . 1 . . . A 57 LEU H . 26649 1 625 . 1 1 57 57 LEU HA H 1 4.731 0.04 . 1 . . . A 57 LEU HA . 26649 1 626 . 1 1 57 57 LEU HB2 H 1 1.415 0.04 . 2 . . . A 57 LEU HB2 . 26649 1 627 . 1 1 57 57 LEU HB3 H 1 1.009 0.04 . 2 . . . A 57 LEU HB3 . 26649 1 628 . 1 1 57 57 LEU HG H 1 1.513 0.04 . 1 . . . A 57 LEU HG . 26649 1 629 . 1 1 57 57 LEU HD11 H 1 0.788 0.04 . 2 . . . A 57 LEU HD11 . 26649 1 630 . 1 1 57 57 LEU HD12 H 1 0.788 0.04 . 2 . . . A 57 LEU HD12 . 26649 1 631 . 1 1 57 57 LEU HD13 H 1 0.788 0.04 . 2 . . . A 57 LEU HD13 . 26649 1 632 . 1 1 57 57 LEU HD21 H 1 0.817 0.04 . 2 . . . A 57 LEU HD21 . 26649 1 633 . 1 1 57 57 LEU HD22 H 1 0.817 0.04 . 2 . . . A 57 LEU HD22 . 26649 1 634 . 1 1 57 57 LEU HD23 H 1 0.817 0.04 . 2 . . . A 57 LEU HD23 . 26649 1 635 . 1 1 57 57 LEU C C 13 175.520 0.1 . 1 . . . A 57 LEU C . 26649 1 636 . 1 1 57 57 LEU CA C 13 54.370 0.1 . 1 . . . A 57 LEU CA . 26649 1 637 . 1 1 57 57 LEU CB C 13 43.769 0.1 . 1 . . . A 57 LEU CB . 26649 1 638 . 1 1 57 57 LEU CG C 13 27.470 0.1 . 1 . . . A 57 LEU CG . 26649 1 639 . 1 1 57 57 LEU CD1 C 13 24.385 0.1 . 1 . . . A 57 LEU CD1 . 26649 1 640 . 1 1 57 57 LEU CD2 C 13 25.207 0.1 . 1 . . . A 57 LEU CD2 . 26649 1 641 . 1 1 57 57 LEU N N 15 129.725 0.1 . 1 . . . A 57 LEU N . 26649 1 642 . 1 1 58 58 THR H H 1 8.645 0.04 . 1 . . . A 58 THR H . 26649 1 643 . 1 1 58 58 THR HA H 1 4.684 0.04 . 1 . . . A 58 THR HA . 26649 1 644 . 1 1 58 58 THR HB H 1 4.144 0.04 . 1 . . . A 58 THR HB . 26649 1 645 . 1 1 58 58 THR HG21 H 1 1.096 0.04 . 1 . . . A 58 THR HG21 . 26649 1 646 . 1 1 58 58 THR HG22 H 1 1.096 0.04 . 1 . . . A 58 THR HG22 . 26649 1 647 . 1 1 58 58 THR HG23 H 1 1.096 0.04 . 1 . . . A 58 THR HG23 . 26649 1 648 . 1 1 58 58 THR CA C 13 58.323 0.1 . 1 . . . A 58 THR CA . 26649 1 649 . 1 1 58 58 THR CB C 13 69.504 0.1 . 1 . . . A 58 THR CB . 26649 1 650 . 1 1 58 58 THR CG2 C 13 21.392 0.1 . 1 . . . A 58 THR CG2 . 26649 1 651 . 1 1 58 58 THR N N 15 114.373 0.1 . 1 . . . A 58 THR N . 26649 1 652 . 1 1 59 59 PRO HA H 1 4.116 0.04 . 1 . . . A 59 PRO HA . 26649 1 653 . 1 1 59 59 PRO HB2 H 1 2.190 0.04 . 2 . . . A 59 PRO HB2 . 26649 1 654 . 1 1 59 59 PRO HB3 H 1 1.719 0.04 . 2 . . . A 59 PRO HB3 . 26649 1 655 . 1 1 59 59 PRO C C 13 176.717 0.1 . 1 . . . A 59 PRO C . 26649 1 656 . 1 1 59 59 PRO CA C 13 64.301 0.1 . 1 . . . A 59 PRO CA . 26649 1 657 . 1 1 59 59 PRO CB C 13 31.854 0.1 . 1 . . . A 59 PRO CB . 26649 1 658 . 1 1 60 60 TYR H H 1 7.057 0.04 . 1 . . . A 60 TYR H . 26649 1 659 . 1 1 60 60 TYR HA H 1 4.433 0.04 . 1 . . . A 60 TYR HA . 26649 1 660 . 1 1 60 60 TYR HB2 H 1 3.079 0.04 . 2 . . . A 60 TYR HB2 . 26649 1 661 . 1 1 60 60 TYR HB3 H 1 3.079 0.04 . 2 . . . A 60 TYR HB3 . 26649 1 662 . 1 1 60 60 TYR C C 13 175.684 0.1 . 1 . . . A 60 TYR C . 26649 1 663 . 1 1 60 60 TYR CA C 13 57.302 0.1 . 1 . . . A 60 TYR CA . 26649 1 664 . 1 1 60 60 TYR CB C 13 37.803 0.1 . 1 . . . A 60 TYR CB . 26649 1 665 . 1 1 60 60 TYR N N 15 113.100 0.1 . 1 . . . A 60 TYR N . 26649 1 666 . 1 1 61 61 ASP H H 1 7.349 0.04 . 1 . . . A 61 ASP H . 26649 1 667 . 1 1 61 61 ASP HA H 1 4.707 0.04 . 1 . . . A 61 ASP HA . 26649 1 668 . 1 1 61 61 ASP HB2 H 1 2.701 0.04 . 2 . . . A 61 ASP HB2 . 26649 1 669 . 1 1 61 61 ASP HB3 H 1 2.701 0.04 . 2 . . . A 61 ASP HB3 . 26649 1 670 . 1 1 61 61 ASP C C 13 175.155 0.1 . 1 . . . A 61 ASP C . 26649 1 671 . 1 1 61 61 ASP CA C 13 54.208 0.1 . 1 . . . A 61 ASP CA . 26649 1 672 . 1 1 61 61 ASP CB C 13 40.576 0.1 . 1 . . . A 61 ASP CB . 26649 1 673 . 1 1 61 61 ASP N N 15 118.239 0.1 . 1 . . . A 61 ASP N . 26649 1 674 . 1 1 62 62 LEU H H 1 8.713 0.04 . 1 . . . A 62 LEU H . 26649 1 675 . 1 1 62 62 LEU HA H 1 4.400 0.04 . 1 . . . A 62 LEU HA . 26649 1 676 . 1 1 62 62 LEU HB2 H 1 1.729 0.04 . 2 . . . A 62 LEU HB2 . 26649 1 677 . 1 1 62 62 LEU HB3 H 1 1.729 0.04 . 2 . . . A 62 LEU HB3 . 26649 1 678 . 1 1 62 62 LEU HG H 1 1.698 0.04 . 1 . . . A 62 LEU HG . 26649 1 679 . 1 1 62 62 LEU HD11 H 1 0.903 0.04 . 2 . . . A 62 LEU HD11 . 26649 1 680 . 1 1 62 62 LEU HD12 H 1 0.903 0.04 . 2 . . . A 62 LEU HD12 . 26649 1 681 . 1 1 62 62 LEU HD13 H 1 0.903 0.04 . 2 . . . A 62 LEU HD13 . 26649 1 682 . 1 1 62 62 LEU HD21 H 1 0.873 0.04 . 2 . . . A 62 LEU HD21 . 26649 1 683 . 1 1 62 62 LEU HD22 H 1 0.873 0.04 . 2 . . . A 62 LEU HD22 . 26649 1 684 . 1 1 62 62 LEU HD23 H 1 0.873 0.04 . 2 . . . A 62 LEU HD23 . 26649 1 685 . 1 1 62 62 LEU C C 13 176.534 0.1 . 1 . . . A 62 LEU C . 26649 1 686 . 1 1 62 62 LEU CA C 13 55.764 0.1 . 1 . . . A 62 LEU CA . 26649 1 687 . 1 1 62 62 LEU CB C 13 40.924 0.1 . 1 . . . A 62 LEU CB . 26649 1 688 . 1 1 62 62 LEU CG C 13 27.190 0.1 . 1 . . . A 62 LEU CG . 26649 1 689 . 1 1 62 62 LEU CD1 C 13 25.447 0.1 . 1 . . . A 62 LEU CD1 . 26649 1 690 . 1 1 62 62 LEU CD2 C 13 23.744 0.1 . 1 . . . A 62 LEU CD2 . 26649 1 691 . 1 1 62 62 LEU N N 15 124.571 0.1 . 1 . . . A 62 LEU N . 26649 1 692 . 1 1 63 63 SER H H 1 8.515 0.04 . 1 . . . A 63 SER H . 26649 1 693 . 1 1 63 63 SER HA H 1 4.672 0.04 . 1 . . . A 63 SER HA . 26649 1 694 . 1 1 63 63 SER HB2 H 1 4.234 0.04 . 2 . . . A 63 SER HB2 . 26649 1 695 . 1 1 63 63 SER HB3 H 1 3.958 0.04 . 2 . . . A 63 SER HB3 . 26649 1 696 . 1 1 63 63 SER C C 13 174.199 0.1 . 1 . . . A 63 SER C . 26649 1 697 . 1 1 63 63 SER CA C 13 59.501 0.1 . 1 . . . A 63 SER CA . 26649 1 698 . 1 1 63 63 SER CB C 13 64.691 0.1 . 1 . . . A 63 SER CB . 26649 1 699 . 1 1 63 63 SER N N 15 113.199 0.1 . 1 . . . A 63 SER N . 26649 1 700 . 1 1 64 64 LYS H H 1 7.646 0.04 . 1 . . . A 64 LYS H . 26649 1 701 . 1 1 64 64 LYS HA H 1 5.463 0.04 . 1 . . . A 64 LYS HA . 26649 1 702 . 1 1 64 64 LYS HB2 H 1 2.005 0.04 . 2 . . . A 64 LYS HB2 . 26649 1 703 . 1 1 64 64 LYS HB3 H 1 1.826 0.04 . 2 . . . A 64 LYS HB3 . 26649 1 704 . 1 1 64 64 LYS HG2 H 1 1.384 0.04 . 2 . . . A 64 LYS HG2 . 26649 1 705 . 1 1 64 64 LYS HG3 H 1 1.451 0.04 . 2 . . . A 64 LYS HG3 . 26649 1 706 . 1 1 64 64 LYS HD2 H 1 1.797 0.04 . 2 . . . A 64 LYS HD2 . 26649 1 707 . 1 1 64 64 LYS HD3 H 1 1.797 0.04 . 2 . . . A 64 LYS HD3 . 26649 1 708 . 1 1 64 64 LYS HE2 H 1 2.992 0.04 . 2 . . . A 64 LYS HE2 . 26649 1 709 . 1 1 64 64 LYS HE3 H 1 2.992 0.04 . 2 . . . A 64 LYS HE3 . 26649 1 710 . 1 1 64 64 LYS C C 13 174.870 0.1 . 1 . . . A 64 LYS C . 26649 1 711 . 1 1 64 64 LYS CA C 13 54.453 0.1 . 1 . . . A 64 LYS CA . 26649 1 712 . 1 1 64 64 LYS CB C 13 36.617 0.1 . 1 . . . A 64 LYS CB . 26649 1 713 . 1 1 64 64 LYS N N 15 122.388 0.1 . 1 . . . A 64 LYS N . 26649 1 714 . 1 1 65 65 GLY H H 1 7.803 0.04 . 1 . . . A 65 GLY H . 26649 1 715 . 1 1 65 65 GLY HA2 H 1 4.660 0.04 . 2 . . . A 65 GLY HA2 . 26649 1 716 . 1 1 65 65 GLY HA3 H 1 3.639 0.04 . 2 . . . A 65 GLY HA3 . 26649 1 717 . 1 1 65 65 GLY C C 13 171.434 0.1 . 1 . . . A 65 GLY C . 26649 1 718 . 1 1 65 65 GLY CA C 13 45.560 0.1 . 1 . . . A 65 GLY CA . 26649 1 719 . 1 1 65 65 GLY N N 15 103.185 0.1 . 1 . . . A 65 GLY N . 26649 1 720 . 1 1 66 66 ARG H H 1 8.468 0.04 . 1 . . . A 66 ARG H . 26649 1 721 . 1 1 66 66 ARG HA H 1 4.966 0.04 . 1 . . . A 66 ARG HA . 26649 1 722 . 1 1 66 66 ARG HB2 H 1 1.523 0.04 . 2 . . . A 66 ARG HB2 . 26649 1 723 . 1 1 66 66 ARG HB3 H 1 1.523 0.04 . 2 . . . A 66 ARG HB3 . 26649 1 724 . 1 1 66 66 ARG HG2 H 1 1.344 0.04 . 2 . . . A 66 ARG HG2 . 26649 1 725 . 1 1 66 66 ARG HG3 H 1 1.393 0.04 . 2 . . . A 66 ARG HG3 . 26649 1 726 . 1 1 66 66 ARG HD2 H 1 3.176 0.04 . 2 . . . A 66 ARG HD2 . 26649 1 727 . 1 1 66 66 ARG HD3 H 1 3.176 0.04 . 2 . . . A 66 ARG HD3 . 26649 1 728 . 1 1 66 66 ARG C C 13 175.315 0.1 . 1 . . . A 66 ARG C . 26649 1 729 . 1 1 66 66 ARG CA C 13 53.231 0.1 . 1 . . . A 66 ARG CA . 26649 1 730 . 1 1 66 66 ARG CB C 13 33.613 0.1 . 1 . . . A 66 ARG CB . 26649 1 731 . 1 1 66 66 ARG CG C 13 27.152 0.1 . 1 . . . A 66 ARG CG . 26649 1 732 . 1 1 66 66 ARG CD C 13 43.643 0.1 . 1 . . . A 66 ARG CD . 26649 1 733 . 1 1 66 66 ARG N N 15 118.652 0.1 . 1 . . . A 66 ARG N . 26649 1 734 . 1 1 67 67 ILE H H 1 9.078 0.04 . 1 . . . A 67 ILE H . 26649 1 735 . 1 1 67 67 ILE HA H 1 4.523 0.04 . 1 . . . A 67 ILE HA . 26649 1 736 . 1 1 67 67 ILE HB H 1 1.555 0.04 . 1 . . . A 67 ILE HB . 26649 1 737 . 1 1 67 67 ILE HG12 H 1 1.445 0.04 . 2 . . . A 67 ILE HG12 . 26649 1 738 . 1 1 67 67 ILE HG13 H 1 0.624 0.04 . 2 . . . A 67 ILE HG13 . 26649 1 739 . 1 1 67 67 ILE HG21 H 1 0.774 0.04 . 1 . . . A 67 ILE HG21 . 26649 1 740 . 1 1 67 67 ILE HG22 H 1 0.774 0.04 . 1 . . . A 67 ILE HG22 . 26649 1 741 . 1 1 67 67 ILE HG23 H 1 0.774 0.04 . 1 . . . A 67 ILE HG23 . 26649 1 742 . 1 1 67 67 ILE HD11 H 1 0.376 0.04 . 1 . . . A 67 ILE HD11 . 26649 1 743 . 1 1 67 67 ILE HD12 H 1 0.376 0.04 . 1 . . . A 67 ILE HD12 . 26649 1 744 . 1 1 67 67 ILE HD13 H 1 0.376 0.04 . 1 . . . A 67 ILE HD13 . 26649 1 745 . 1 1 67 67 ILE C C 13 175.888 0.1 . 1 . . . A 67 ILE C . 26649 1 746 . 1 1 67 67 ILE CA C 13 61.950 0.1 . 1 . . . A 67 ILE CA . 26649 1 747 . 1 1 67 67 ILE CB C 13 39.131 0.1 . 1 . . . A 67 ILE CB . 26649 1 748 . 1 1 67 67 ILE CG1 C 13 29.024 0.1 . 1 . . . A 67 ILE CG1 . 26649 1 749 . 1 1 67 67 ILE CG2 C 13 16.998 0.1 . 1 . . . A 67 ILE CG2 . 26649 1 750 . 1 1 67 67 ILE CD1 C 13 14.020 0.1 . 1 . . . A 67 ILE CD1 . 26649 1 751 . 1 1 67 67 ILE N N 15 125.685 0.1 . 1 . . . A 67 ILE N . 26649 1 752 . 1 1 68 68 THR H H 1 8.649 0.04 . 1 . . . A 68 THR H . 26649 1 753 . 1 1 68 68 THR HA H 1 4.485 0.04 . 1 . . . A 68 THR HA . 26649 1 754 . 1 1 68 68 THR HB H 1 4.277 0.04 . 1 . . . A 68 THR HB . 26649 1 755 . 1 1 68 68 THR HG21 H 1 1.113 0.04 . 1 . . . A 68 THR HG21 . 26649 1 756 . 1 1 68 68 THR HG22 H 1 1.113 0.04 . 1 . . . A 68 THR HG22 . 26649 1 757 . 1 1 68 68 THR HG23 H 1 1.113 0.04 . 1 . . . A 68 THR HG23 . 26649 1 758 . 1 1 68 68 THR C C 13 174.989 0.1 . 1 . . . A 68 THR C . 26649 1 759 . 1 1 68 68 THR CA C 13 61.146 0.1 . 1 . . . A 68 THR CA . 26649 1 760 . 1 1 68 68 THR CB C 13 69.513 0.1 . 1 . . . A 68 THR CB . 26649 1 761 . 1 1 68 68 THR CG2 C 13 22.469 0.1 . 1 . . . A 68 THR CG2 . 26649 1 762 . 1 1 68 68 THR N N 15 117.575 0.1 . 1 . . . A 68 THR N . 26649 1 763 . 1 1 69 69 TYR H H 1 7.538 0.04 . 1 . . . A 69 TYR H . 26649 1 764 . 1 1 69 69 TYR HA H 1 4.591 0.04 . 1 . . . A 69 TYR HA . 26649 1 765 . 1 1 69 69 TYR HB2 H 1 3.181 0.04 . 2 . . . A 69 TYR HB2 . 26649 1 766 . 1 1 69 69 TYR HB3 H 1 2.513 0.04 . 2 . . . A 69 TYR HB3 . 26649 1 767 . 1 1 69 69 TYR HD1 H 1 7.002 0.04 . 3 . . . A 69 TYR HD1 . 26649 1 768 . 1 1 69 69 TYR HD2 H 1 7.002 0.04 . 3 . . . A 69 TYR HD2 . 26649 1 769 . 1 1 69 69 TYR HE1 H 1 6.727 0.04 . 3 . . . A 69 TYR HE1 . 26649 1 770 . 1 1 69 69 TYR HE2 H 1 6.727 0.04 . 3 . . . A 69 TYR HE2 . 26649 1 771 . 1 1 69 69 TYR C C 13 172.880 0.1 . 1 . . . A 69 TYR C . 26649 1 772 . 1 1 69 69 TYR CA C 13 58.262 0.1 . 1 . . . A 69 TYR CA . 26649 1 773 . 1 1 69 69 TYR CB C 13 42.003 0.1 . 1 . . . A 69 TYR CB . 26649 1 774 . 1 1 69 69 TYR N N 15 122.143 0.1 . 1 . . . A 69 TYR N . 26649 1 775 . 1 1 70 70 ARG H H 1 7.716 0.04 . 1 . . . A 70 ARG H . 26649 1 776 . 1 1 70 70 ARG HA H 1 4.616 0.04 . 1 . . . A 70 ARG HA . 26649 1 777 . 1 1 70 70 ARG HB2 H 1 1.440 0.04 . 2 . . . A 70 ARG HB2 . 26649 1 778 . 1 1 70 70 ARG HB3 H 1 1.344 0.04 . 2 . . . A 70 ARG HB3 . 26649 1 779 . 1 1 70 70 ARG C C 13 173.644 0.1 . 1 . . . A 70 ARG C . 26649 1 780 . 1 1 70 70 ARG CA C 13 54.843 0.1 . 1 . . . A 70 ARG CA . 26649 1 781 . 1 1 70 70 ARG CB C 13 31.844 0.1 . 1 . . . A 70 ARG CB . 26649 1 782 . 1 1 70 70 ARG N N 15 126.202 0.1 . 1 . . . A 70 ARG N . 26649 1 783 . 1 1 71 71 ALA H H 1 8.456 0.04 . 1 . . . A 71 ALA H . 26649 1 784 . 1 1 71 71 ALA HA H 1 4.096 0.04 . 1 . . . A 71 ALA HA . 26649 1 785 . 1 1 71 71 ALA HB1 H 1 1.377 0.04 . 1 . . . A 71 ALA HB1 . 26649 1 786 . 1 1 71 71 ALA HB2 H 1 1.377 0.04 . 1 . . . A 71 ALA HB2 . 26649 1 787 . 1 1 71 71 ALA HB3 H 1 1.377 0.04 . 1 . . . A 71 ALA HB3 . 26649 1 788 . 1 1 71 71 ALA C C 13 176.753 0.1 . 1 . . . A 71 ALA C . 26649 1 789 . 1 1 71 71 ALA CA C 13 52.238 0.1 . 1 . . . A 71 ALA CA . 26649 1 790 . 1 1 71 71 ALA CB C 13 19.934 0.1 . 1 . . . A 71 ALA CB . 26649 1 791 . 1 1 71 71 ALA N N 15 128.442 0.1 . 1 . . . A 71 ALA N . 26649 1 792 . 1 1 72 72 ARG H H 1 8.341 0.04 . 1 . . . A 72 ARG H . 26649 1 793 . 1 1 72 72 ARG HA H 1 4.274 0.04 . 1 . . . A 72 ARG HA . 26649 1 794 . 1 1 72 72 ARG HB2 H 1 1.768 0.04 . 2 . . . A 72 ARG HB2 . 26649 1 795 . 1 1 72 72 ARG HB3 H 1 1.768 0.04 . 2 . . . A 72 ARG HB3 . 26649 1 796 . 1 1 72 72 ARG C C 13 175.867 0.1 . 1 . . . A 72 ARG C . 26649 1 797 . 1 1 72 72 ARG CA C 13 55.800 0.1 . 1 . . . A 72 ARG CA . 26649 1 798 . 1 1 72 72 ARG CB C 13 31.036 0.1 . 1 . . . A 72 ARG CB . 26649 1 799 . 1 1 72 72 ARG N N 15 121.083 0.1 . 1 . . . A 72 ARG N . 26649 1 stop_ save_