data_11429 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11429 _Entry.Title ; SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF THE HMGB2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-02-22 _Entry.Accession_date 2011-02-23 _Entry.Last_release_date 2012-06-05 _Entry.Original_release_date 2012-06-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1.0.46 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 J. KURITA . . . 11429 2 J. UEWAKI . . . 11429 3 H. SHIMAHARA . . . 11429 4 M. YOSHIDA . . . 11429 5 S. TATE . . . 11429 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11429 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 220 11429 '15N chemical shifts' 77 11429 '1H chemical shifts' 483 11429 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 . . 2012-06-05 2011-02-22 original author . 11429 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 11430 'SOLUTION STRUCTURE OF THE C-TERMINAL DOMAIN OF THE HMGB2' 11429 BMRB 11431 'SOLUTION STRUCTURE OF THE C-TERMINAL DOMAIN OF THE HMGB2 (H22Y)' 11429 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11429 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'STRUCUTRAL COMPARISON OF TWO HMG-BOXES IN THE NON-HISTONE PROTEIN HMG-2 WITH IN THE HMG-1' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 J. KURITA . . . 11429 1 2 J. UEWAKI . . . 11429 1 3 H. SHIMAHARA . . . 11429 1 4 M. YOSHIDA . . . 11429 1 5 S. TATE . . . 11429 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11429 _Assembly.ID 1 _Assembly.Name 'HMGB2 A-domain' _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 yes _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 HMG2A 1 $HMG2A A . yes native no no . . . 11429 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HMG2A _Entity.Sf_category entity _Entity.Sf_framecode HMG2A _Entity.Entry_ID 11429 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HMG2A _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 ; MGKGDPNKPRGKMSSYAFFV QTSREEHKKKHPDSSVNFAE FSKKCSERWKTMSAKEKSKF EDMAKSDKARYDREMKN ; _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 77 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic yes _Entity.Thiol_state 'all free' _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 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1J3X . "Solution Structure Of The N-Terminal Domain Of The Hmgb2" . . . . . 100.00 77 100.00 100.00 5.73e-47 . . . . 11429 1 2 no REF XP_006040222 . "PREDICTED: high mobility group protein B2-like, partial [Bubalus bubalis]" . . . . . 100.00 165 98.70 98.70 5.68e-45 . . . . 11429 1 3 no REF XP_007083590 . "PREDICTED: high mobility group protein B2-like [Panthera tigris altaica]" . . . . . 98.70 325 98.68 98.68 3.26e-43 . . . . 11429 1 4 no REF XP_008582451 . "PREDICTED: high mobility group protein B2 isoform X1 [Galeopterus variegatus]" . . . . . 100.00 217 98.70 98.70 5.74e-45 . . . . 11429 1 5 no REF XP_008582452 . "PREDICTED: high mobility group protein B2 isoform X1 [Galeopterus variegatus]" . . . . . 100.00 217 98.70 98.70 5.74e-45 . . . . 11429 1 6 no REF XP_008582454 . "PREDICTED: high mobility group protein B2 isoform X2 [Galeopterus variegatus]" . . . . . 100.00 207 98.70 98.70 6.80e-45 . . . . 11429 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 . 11429 1 2 . GLY . 11429 1 3 . LYS . 11429 1 4 . GLY . 11429 1 5 . ASP . 11429 1 6 . PRO . 11429 1 7 . ASN . 11429 1 8 . LYS . 11429 1 9 . PRO . 11429 1 10 . ARG . 11429 1 11 . GLY . 11429 1 12 . LYS . 11429 1 13 . MET . 11429 1 14 . SER . 11429 1 15 . SER . 11429 1 16 . TYR . 11429 1 17 . ALA . 11429 1 18 . PHE . 11429 1 19 . PHE . 11429 1 20 . VAL . 11429 1 21 . GLN . 11429 1 22 . THR . 11429 1 23 . SER . 11429 1 24 . ARG . 11429 1 25 . GLU . 11429 1 26 . GLU . 11429 1 27 . HIS . 11429 1 28 . LYS . 11429 1 29 . LYS . 11429 1 30 . LYS . 11429 1 31 . HIS . 11429 1 32 . PRO . 11429 1 33 . ASP . 11429 1 34 . SER . 11429 1 35 . SER . 11429 1 36 . VAL . 11429 1 37 . ASN . 11429 1 38 . PHE . 11429 1 39 . ALA . 11429 1 40 . GLU . 11429 1 41 . PHE . 11429 1 42 . SER . 11429 1 43 . LYS . 11429 1 44 . LYS . 11429 1 45 . CYS . 11429 1 46 . SER . 11429 1 47 . GLU . 11429 1 48 . ARG . 11429 1 49 . TRP . 11429 1 50 . LYS . 11429 1 51 . THR . 11429 1 52 . MET . 11429 1 53 . SER . 11429 1 54 . ALA . 11429 1 55 . LYS . 11429 1 56 . GLU . 11429 1 57 . LYS . 11429 1 58 . SER . 11429 1 59 . LYS . 11429 1 60 . PHE . 11429 1 61 . GLU . 11429 1 62 . ASP . 11429 1 63 . MET . 11429 1 64 . ALA . 11429 1 65 . LYS . 11429 1 66 . SER . 11429 1 67 . ASP . 11429 1 68 . LYS . 11429 1 69 . ALA . 11429 1 70 . ARG . 11429 1 71 . TYR . 11429 1 72 . ASP . 11429 1 73 . ARG . 11429 1 74 . GLU . 11429 1 75 . MET . 11429 1 76 . LYS . 11429 1 77 . ASN . 11429 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 11429 1 . GLY 2 2 11429 1 . LYS 3 3 11429 1 . GLY 4 4 11429 1 . ASP 5 5 11429 1 . PRO 6 6 11429 1 . ASN 7 7 11429 1 . LYS 8 8 11429 1 . PRO 9 9 11429 1 . ARG 10 10 11429 1 . GLY 11 11 11429 1 . LYS 12 12 11429 1 . MET 13 13 11429 1 . SER 14 14 11429 1 . SER 15 15 11429 1 . TYR 16 16 11429 1 . ALA 17 17 11429 1 . PHE 18 18 11429 1 . PHE 19 19 11429 1 . VAL 20 20 11429 1 . GLN 21 21 11429 1 . THR 22 22 11429 1 . SER 23 23 11429 1 . ARG 24 24 11429 1 . GLU 25 25 11429 1 . GLU 26 26 11429 1 . HIS 27 27 11429 1 . LYS 28 28 11429 1 . LYS 29 29 11429 1 . LYS 30 30 11429 1 . HIS 31 31 11429 1 . PRO 32 32 11429 1 . ASP 33 33 11429 1 . SER 34 34 11429 1 . SER 35 35 11429 1 . VAL 36 36 11429 1 . ASN 37 37 11429 1 . PHE 38 38 11429 1 . ALA 39 39 11429 1 . GLU 40 40 11429 1 . PHE 41 41 11429 1 . SER 42 42 11429 1 . LYS 43 43 11429 1 . LYS 44 44 11429 1 . CYS 45 45 11429 1 . SER 46 46 11429 1 . GLU 47 47 11429 1 . ARG 48 48 11429 1 . TRP 49 49 11429 1 . LYS 50 50 11429 1 . THR 51 51 11429 1 . MET 52 52 11429 1 . SER 53 53 11429 1 . ALA 54 54 11429 1 . LYS 55 55 11429 1 . GLU 56 56 11429 1 . LYS 57 57 11429 1 . SER 58 58 11429 1 . LYS 59 59 11429 1 . PHE 60 60 11429 1 . GLU 61 61 11429 1 . ASP 62 62 11429 1 . MET 63 63 11429 1 . ALA 64 64 11429 1 . LYS 65 65 11429 1 . SER 66 66 11429 1 . ASP 67 67 11429 1 . LYS 68 68 11429 1 . ALA 69 69 11429 1 . ARG 70 70 11429 1 . TYR 71 71 11429 1 . ASP 72 72 11429 1 . ARG 73 73 11429 1 . GLU 74 74 11429 1 . MET 75 75 11429 1 . LYS 76 76 11429 1 . ASN 77 77 11429 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 11429 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $HMG2A . 9823 organism . 'Sus scrofa' pig . . Eukaryota Metazoa Sus scrofa . . . . . . . . . . . . . . . . . . . . . 11429 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 11429 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $HMG2A . 'recombinant technology' 'Escherichia coli' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . pET22b . . . . . . 11429 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11429 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HMG2A '[U-13C; U-15N]' . . 1 $HMG2A . protein 1 . . mM . . . . 11429 1 2 H2O . . . . . . solvent 95 . . % . . . . 11429 1 3 D2O . . . . . . solvent 5 . . % . . . . 11429 1 4 'sodium acetate' 'natural abundance' . . . . . buffer 50 . . mM . . . . 11429 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 11429 _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' 50 . mM 11429 1 pH 5.0 . pH 11429 1 pressure 1 . atm 11429 1 temperature 293 . K 11429 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11429 _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' . . 11429 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 11429 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 11429 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 11429 _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 Varian INOVA . 750 . . . 11429 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 11429 _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 $spectrometer_1 . . . . . . . . . . . . . . . . 11429 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11429 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11429 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 11429 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 11429 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 11429 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 11429 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 11429 _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 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11429 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11429 1 3 '2D 1H-1H NOESY' 1 $sample_1 isotropic 11429 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.29 . . 1 . . . . 1 MET HA . 11429 1 2 . 1 1 1 1 MET HB2 H 1 1.71 . . . . . . . 1 MET HB2 . 11429 1 3 . 1 1 1 1 MET HB3 H 1 1.86 . . . . . . . 1 MET HB3 . 11429 1 4 . 1 1 1 1 MET C C 13 177.19 . . 1 . . . . 1 MET C . 11429 1 5 . 1 1 1 1 MET CA C 13 56.36 . . 1 . . . . 1 MET CA . 11429 1 6 . 1 1 1 1 MET CB C 13 30.85 . . 1 . . . . 1 MET CB . 11429 1 7 . 1 1 2 2 GLY H H 1 8.50 . . 1 . . . . 2 GLY H . 11429 1 8 . 1 1 2 2 GLY HA2 H 1 3.84 . . . . . . . 2 GLY HA2 . 11429 1 9 . 1 1 2 2 GLY HA3 H 1 3.98 . . . . . . . 2 GLY HA3 . 11429 1 10 . 1 1 2 2 GLY C C 13 173.71 . . 1 . . . . 2 GLY C . 11429 1 11 . 1 1 2 2 GLY CA C 13 45.18 . . 1 . . . . 2 GLY CA . 11429 1 12 . 1 1 2 2 GLY N N 15 110.36 . . 1 . . . . 2 GLY N . 11429 1 13 . 1 1 3 3 LYS H H 1 8.12 . . 1 . . . . 3 LYS H . 11429 1 14 . 1 1 3 3 LYS HA H 1 4.25 . . 1 . . . . 3 LYS HA . 11429 1 15 . 1 1 3 3 LYS HB2 H 1 1.63 . . . . . . . 3 LYS HB2 . 11429 1 16 . 1 1 3 3 LYS HB3 H 1 1.74 . . . . . . . 3 LYS HB3 . 11429 1 17 . 1 1 3 3 LYS HD2 H 1 1.63 . . 2 . . . . 3 LYS HD2 . 11429 1 18 . 1 1 3 3 LYS HD3 H 1 1.63 . . 2 . . . . 3 LYS HD3 . 11429 1 19 . 1 1 3 3 LYS HE2 H 1 2.78 . . . . . . . 3 LYS HE2 . 11429 1 20 . 1 1 3 3 LYS HE3 H 1 2.92 . . . . . . . 3 LYS HE3 . 11429 1 21 . 1 1 3 3 LYS HG2 H 1 1.22 . . . . . . . 3 LYS HG2 . 11429 1 22 . 1 1 3 3 LYS HG3 H 1 1.28 . . . . . . . 3 LYS HG3 . 11429 1 23 . 1 1 3 3 LYS C C 13 177.26 . . 1 . . . . 3 LYS C . 11429 1 24 . 1 1 3 3 LYS CA C 13 57.13 . . 1 . . . . 3 LYS CA . 11429 1 25 . 1 1 3 3 LYS CB C 13 32.78 . . 1 . . . . 3 LYS CB . 11429 1 26 . 1 1 3 3 LYS N N 15 120.76 . . 1 . . . . 3 LYS N . 11429 1 27 . 1 1 4 4 GLY H H 1 8.67 . . 1 . . . . 4 GLY H . 11429 1 28 . 1 1 4 4 GLY HA2 H 1 3.92 . . . . . . . 4 GLY HA2 . 11429 1 29 . 1 1 4 4 GLY C C 13 173.58 . . 1 . . . . 4 GLY C . 11429 1 30 . 1 1 4 4 GLY N N 15 110.94 . . 1 . . . . 4 GLY N . 11429 1 31 . 1 1 5 5 ASP H H 1 8.13 . . 1 . . . . 5 ASP H . 11429 1 32 . 1 1 5 5 ASP HA H 1 4.82 . . 1 . . . . 5 ASP HA . 11429 1 33 . 1 1 5 5 ASP HB2 H 1 2.59 . . . . . . . 5 ASP HB2 . 11429 1 34 . 1 1 5 5 ASP HB3 H 1 2.75 . . . . . . . 5 ASP HB3 . 11429 1 35 . 1 1 5 5 ASP CA C 13 52.21 . . 1 . . . . 5 ASP CA . 11429 1 36 . 1 1 5 5 ASP CB C 13 41.07 . . 1 . . . . 5 ASP CB . 11429 1 37 . 1 1 5 5 ASP N N 15 121.75 . . 1 . . . . 5 ASP N . 11429 1 38 . 1 1 6 6 PRO HA H 1 4.43 . . 1 . . . . 6 PRO HA . 11429 1 39 . 1 1 6 6 PRO HB2 H 1 1.94 . . . . . . . 6 PRO HB2 . 11429 1 40 . 1 1 6 6 PRO HB3 H 1 2.27 . . . . . . . 6 PRO HB3 . 11429 1 41 . 1 1 6 6 PRO HD2 H 1 3.84 . . . . . . . 6 PRO HD2 . 11429 1 42 . 1 1 6 6 PRO HD3 H 1 3.89 . . . . . . . 6 PRO HD3 . 11429 1 43 . 1 1 6 6 PRO HG2 H 1 1.96 . . . . . . . 6 PRO HG2 . 11429 1 44 . 1 1 6 6 PRO HG3 H 1 2.05 . . . . . . . 6 PRO HG3 . 11429 1 45 . 1 1 6 6 PRO C C 13 176.93 . . 1 . . . . 6 PRO C . 11429 1 46 . 1 1 6 6 PRO CA C 13 63.56 . . 1 . . . . 6 PRO CA . 11429 1 47 . 1 1 6 6 PRO CB C 13 32.15 . . 1 . . . . 6 PRO CB . 11429 1 48 . 1 1 7 7 ASN H H 1 8.54 . . 1 . . . . 7 ASN H . 11429 1 49 . 1 1 7 7 ASN HA H 1 4.67 . . 1 . . . . 7 ASN HA . 11429 1 50 . 1 1 7 7 ASN HB2 H 1 2.74 . . . . . . . 7 ASN HB2 . 11429 1 51 . 1 1 7 7 ASN HB3 H 1 2.80 . . . . . . . 7 ASN HB3 . 11429 1 52 . 1 1 7 7 ASN HD21 H 1 6.99 . . . . . . . 7 ASN HD21 . 11429 1 53 . 1 1 7 7 ASN HD22 H 1 7.78 . . . . . . . 7 ASN HD22 . 11429 1 54 . 1 1 7 7 ASN C C 13 175.52 . . 1 . . . . 7 ASN C . 11429 1 55 . 1 1 7 7 ASN CA C 13 53.32 . . 1 . . . . 7 ASN CA . 11429 1 56 . 1 1 7 7 ASN CB C 13 38.95 . . 1 . . . . 7 ASN CB . 11429 1 57 . 1 1 7 7 ASN N N 15 118.06 . . 1 . . . . 7 ASN N . 11429 1 58 . 1 1 7 7 ASN ND2 N 15 114.23 . . 1 . . . . 7 ASN ND2 . 11429 1 59 . 1 1 8 8 LYS H H 1 7.94 . . 1 . . . . 8 LYS H . 11429 1 60 . 1 1 8 8 LYS HA H 1 4.60 . . 1 . . . . 8 LYS HA . 11429 1 61 . 1 1 8 8 LYS HB2 H 1 1.71 . . . . . . . 8 LYS HB2 . 11429 1 62 . 1 1 8 8 LYS HB3 H 1 1.82 . . . . . . . 8 LYS HB3 . 11429 1 63 . 1 1 8 8 LYS HD2 H 1 1.70 . . 2 . . . . 8 LYS HD2 . 11429 1 64 . 1 1 8 8 LYS HD3 H 1 1.70 . . 2 . . . . 8 LYS HD3 . 11429 1 65 . 1 1 8 8 LYS HE2 H 1 3.01 . . 2 . . . . 8 LYS HE2 . 11429 1 66 . 1 1 8 8 LYS HE3 H 1 3.01 . . 2 . . . . 8 LYS HE3 . 11429 1 67 . 1 1 8 8 LYS HG2 H 1 1.82 . . 2 . . . . 8 LYS HG2 . 11429 1 68 . 1 1 8 8 LYS HG3 H 1 1.82 . . 2 . . . . 8 LYS HG3 . 11429 1 69 . 1 1 8 8 LYS CA C 13 54.24 . . 1 . . . . 8 LYS CA . 11429 1 70 . 1 1 8 8 LYS CB C 13 32.74 . . 1 . . . . 8 LYS CB . 11429 1 71 . 1 1 8 8 LYS N N 15 122.50 . . 1 . . . . 8 LYS N . 11429 1 72 . 1 1 9 9 PRO HA H 1 4.42 . . 1 . . . . 9 PRO HA . 11429 1 73 . 1 1 9 9 PRO HB2 H 1 1.84 . . . . . . . 9 PRO HB2 . 11429 1 74 . 1 1 9 9 PRO HB3 H 1 2.32 . . . . . . . 9 PRO HB3 . 11429 1 75 . 1 1 9 9 PRO HD2 H 1 3.58 . . . . . . . 9 PRO HD2 . 11429 1 76 . 1 1 9 9 PRO HD3 H 1 3.81 . . . . . . . 9 PRO HD3 . 11429 1 77 . 1 1 9 9 PRO C C 13 176.83 . . 1 . . . . 9 PRO C . 11429 1 78 . 1 1 9 9 PRO CA C 13 63.02 . . 1 . . . . 9 PRO CA . 11429 1 79 . 1 1 9 9 PRO CB C 13 32.08 . . 1 . . . . 9 PRO CB . 11429 1 80 . 1 1 10 10 ARG H H 1 8.65 . . 1 . . . . 10 ARG H . 11429 1 81 . 1 1 10 10 ARG HA H 1 4.29 . . 1 . . . . 10 ARG HA . 11429 1 82 . 1 1 10 10 ARG HB2 H 1 1.73 . . . . . . . 10 ARG HB2 . 11429 1 83 . 1 1 10 10 ARG HB3 H 1 1.81 . . . . . . . 10 ARG HB3 . 11429 1 84 . 1 1 10 10 ARG HD2 H 1 3.19 . . 2 . . . . 10 ARG HD2 . 11429 1 85 . 1 1 10 10 ARG HD3 H 1 3.19 . . 2 . . . . 10 ARG HD3 . 11429 1 86 . 1 1 10 10 ARG HG2 H 1 1.70 . . 2 . . . . 10 ARG HG2 . 11429 1 87 . 1 1 10 10 ARG HG3 H 1 1.70 . . 2 . . . . 10 ARG HG3 . 11429 1 88 . 1 1 10 10 ARG C C 13 177.20 . . 1 . . . . 10 ARG C . 11429 1 89 . 1 1 10 10 ARG CA C 13 56.36 . . 1 . . . . 10 ARG CA . 11429 1 90 . 1 1 10 10 ARG CB C 13 30.83 . . 1 . . . . 10 ARG CB . 11429 1 91 . 1 1 10 10 ARG N N 15 122.38 . . 1 . . . . 10 ARG N . 11429 1 92 . 1 1 11 11 GLY H H 1 8.52 . . 1 . . . . 11 GLY H . 11429 1 93 . 1 1 11 11 GLY HA2 H 1 3.92 . . . . . . . 11 GLY HA2 . 11429 1 94 . 1 1 11 11 GLY C C 13 176.95 . . 1 . . . . 11 GLY C . 11429 1 95 . 1 1 11 11 GLY CA C 13 45.16 . . 1 . . . . 11 GLY CA . 11429 1 96 . 1 1 11 11 GLY N N 15 110.24 . . 1 . . . . 11 GLY N . 11429 1 97 . 1 1 12 12 LYS H H 1 8.50 . . 1 . . . . 12 LYS H . 11429 1 98 . 1 1 12 12 LYS HA H 1 4.29 . . 1 . . . . 12 LYS HA . 11429 1 99 . 1 1 12 12 LYS HB2 H 1 1.76 . . . . . . . 12 LYS HB2 . 11429 1 100 . 1 1 12 12 LYS HB3 H 1 1.86 . . . . . . . 12 LYS HB3 . 11429 1 101 . 1 1 12 12 LYS HD2 H 1 1.49 . . 2 . . . . 12 LYS HD2 . 11429 1 102 . 1 1 12 12 LYS HD3 H 1 1.49 . . 2 . . . . 12 LYS HD3 . 11429 1 103 . 1 1 12 12 LYS HE2 H 1 3.01 . . 2 . . . . 12 LYS HE2 . 11429 1 104 . 1 1 12 12 LYS HE3 H 1 3.01 . . 2 . . . . 12 LYS HE3 . 11429 1 105 . 1 1 12 12 LYS HG2 H 1 1.45 . . 2 . . . . 12 LYS HG2 . 11429 1 106 . 1 1 12 12 LYS HG3 H 1 1.45 . . 2 . . . . 12 LYS HG3 . 11429 1 107 . 1 1 12 12 LYS C C 13 176.90 . . 1 . . . . 12 LYS C . 11429 1 108 . 1 1 12 12 LYS CA C 13 56.61 . . 1 . . . . 12 LYS CA . 11429 1 109 . 1 1 12 12 LYS CB C 13 32.86 . . 1 . . . . 12 LYS CB . 11429 1 110 . 1 1 12 12 LYS N N 15 121.40 . . 1 . . . . 12 LYS N . 11429 1 111 . 1 1 13 13 MET H H 1 8.75 . . 1 . . . . 13 MET H . 11429 1 112 . 1 1 13 13 MET HA H 1 4.45 . . 1 . . . . 13 MET HA . 11429 1 113 . 1 1 13 13 MET HB2 H 1 1.71 . . . . . . . 13 MET HB2 . 11429 1 114 . 1 1 13 13 MET HB3 H 1 1.81 . . . . . . . 13 MET HB3 . 11429 1 115 . 1 1 13 13 MET HE1 H 1 1.71 . . 1 . . . . 13 MET ME . 11429 1 116 . 1 1 13 13 MET HE2 H 1 1.71 . . 1 . . . . 13 MET ME . 11429 1 117 . 1 1 13 13 MET HE3 H 1 1.71 . . 1 . . . . 13 MET ME . 11429 1 118 . 1 1 13 13 MET HG2 H 1 2.29 . . . . . . . 13 MET HG2 . 11429 1 119 . 1 1 13 13 MET HG3 H 1 2.35 . . . . . . . 13 MET HG3 . 11429 1 120 . 1 1 13 13 MET C C 13 175.53 . . 1 . . . . 13 MET C . 11429 1 121 . 1 1 13 13 MET CA C 13 55.15 . . 1 . . . . 13 MET CA . 11429 1 122 . 1 1 13 13 MET CB C 13 34.28 . . 1 . . . . 13 MET CB . 11429 1 123 . 1 1 13 13 MET N N 15 123.48 . . 1 . . . . 13 MET N . 11429 1 124 . 1 1 14 14 SER H H 1 8.14 . . 1 . . . . 14 SER H . 11429 1 125 . 1 1 14 14 SER HA H 1 4.64 . . 1 . . . . 14 SER HA . 11429 1 126 . 1 1 14 14 SER HB2 H 1 4.11 . . . . . . . 14 SER HB2 . 11429 1 127 . 1 1 14 14 SER HB3 H 1 4.51 . . . . . . . 14 SER HB3 . 11429 1 128 . 1 1 14 14 SER C C 13 176.83 . . 1 . . . . 14 SER C . 11429 1 129 . 1 1 14 14 SER CA C 13 57.26 . . 1 . . . . 14 SER CA . 11429 1 130 . 1 1 14 14 SER CB C 13 65.45 . . 1 . . . . 14 SER CB . 11429 1 131 . 1 1 14 14 SER N N 15 118.42 . . 1 . . . . 14 SER N . 11429 1 132 . 1 1 15 15 SER H H 1 9.26 . . 1 . . . . 15 SER H . 11429 1 133 . 1 1 15 15 SER HA H 1 4.35 . . 1 . . . . 15 SER HA . 11429 1 134 . 1 1 15 15 SER C C 13 176.17 . . 1 . . . . 15 SER C . 11429 1 135 . 1 1 15 15 SER CA C 13 61.50 . . 1 . . . . 15 SER CA . 11429 1 136 . 1 1 15 15 SER CB C 13 62.37 . . 1 . . . . 15 SER CB . 11429 1 137 . 1 1 15 15 SER N N 15 117.24 . . 1 . . . . 15 SER N . 11429 1 138 . 1 1 16 16 TYR H H 1 8.03 . . 1 . . . . 16 TYR H . 11429 1 139 . 1 1 16 16 TYR HA H 1 4.64 . . 1 . . . . 16 TYR HA . 11429 1 140 . 1 1 16 16 TYR HB2 H 1 2.75 . . . . . . . 16 TYR HB2 . 11429 1 141 . 1 1 16 16 TYR HB3 H 1 2.82 . . . . . . . 16 TYR HB3 . 11429 1 142 . 1 1 16 16 TYR HD1 H 1 6.42 . . 3 . . . . 16 TYR HD1 . 11429 1 143 . 1 1 16 16 TYR HD2 H 1 6.42 . . 3 . . . . 16 TYR HD2 . 11429 1 144 . 1 1 16 16 TYR HE1 H 1 5.90 . . 3 . . . . 16 TYR HE1 . 11429 1 145 . 1 1 16 16 TYR HE2 H 1 5.90 . . 3 . . . . 16 TYR HE2 . 11429 1 146 . 1 1 16 16 TYR C C 13 174.81 . . 1 . . . . 16 TYR C . 11429 1 147 . 1 1 16 16 TYR CA C 13 53.53 . . 1 . . . . 16 TYR CA . 11429 1 148 . 1 1 16 16 TYR CB C 13 39.04 . . 1 . . . . 16 TYR CB . 11429 1 149 . 1 1 16 16 TYR N N 15 122.34 . . 1 . . . . 16 TYR N . 11429 1 150 . 1 1 17 17 ALA H H 1 7.94 . . 1 . . . . 17 ALA H . 11429 1 151 . 1 1 17 17 ALA HA H 1 3.71 . . 1 . . . . 17 ALA HA . 11429 1 152 . 1 1 17 17 ALA HB1 H 1 1.43 . . 1 . . . . 17 ALA MB . 11429 1 153 . 1 1 17 17 ALA HB2 H 1 1.43 . . 1 . . . . 17 ALA MB . 11429 1 154 . 1 1 17 17 ALA HB3 H 1 1.43 . . 1 . . . . 17 ALA MB . 11429 1 155 . 1 1 17 17 ALA C C 13 169.54 . . 1 . . . . 17 ALA C . 11429 1 156 . 1 1 17 17 ALA CA C 13 55.22 . . 1 . . . . 17 ALA CA . 11429 1 157 . 1 1 17 17 ALA CB C 13 18.03 . . 1 . . . . 17 ALA CB . 11429 1 158 . 1 1 17 17 ALA N N 15 121.87 . . 1 . . . . 17 ALA N . 11429 1 159 . 1 1 18 18 PHE H H 1 8.28 . . 1 . . . . 18 PHE H . 11429 1 160 . 1 1 18 18 PHE HA H 1 4.23 . . 1 . . . . 18 PHE HA . 11429 1 161 . 1 1 18 18 PHE HB2 H 1 3.38 . . . . . . . 18 PHE HB2 . 11429 1 162 . 1 1 18 18 PHE HB3 H 1 3.63 . . . . . . . 18 PHE HB3 . 11429 1 163 . 1 1 18 18 PHE HD1 H 1 7.37 . . 3 . . . . 18 PHE HD1 . 11429 1 164 . 1 1 18 18 PHE HD2 H 1 7.37 . . 3 . . . . 18 PHE HD2 . 11429 1 165 . 1 1 18 18 PHE HE1 H 1 7.37 . . 3 . . . . 18 PHE HE1 . 11429 1 166 . 1 1 18 18 PHE HE2 H 1 7.25 . . . . . . . 18 PHE HE2 . 11429 1 167 . 1 1 18 18 PHE C C 13 176.89 . . 1 . . . . 18 PHE C . 11429 1 168 . 1 1 18 18 PHE CA C 13 63.16 . . 1 . . . . 18 PHE CA . 11429 1 169 . 1 1 18 18 PHE CB C 13 39.77 . . 1 . . . . 18 PHE CB . 11429 1 170 . 1 1 18 18 PHE N N 15 118.50 . . 1 . . . . 18 PHE N . 11429 1 171 . 1 1 19 19 PHE H H 1 8.83 . . 1 . . . . 19 PHE H . 11429 1 172 . 1 1 19 19 PHE HA H 1 4.27 . . 1 . . . . 19 PHE HA . 11429 1 173 . 1 1 19 19 PHE HB2 H 1 3.42 . . . . . . . 19 PHE HB2 . 11429 1 174 . 1 1 19 19 PHE HB3 H 1 3.66 . . . . . . . 19 PHE HB3 . 11429 1 175 . 1 1 19 19 PHE C C 13 177.53 . . 1 . . . . 19 PHE C . 11429 1 176 . 1 1 19 19 PHE CA C 13 63.34 . . 1 . . . . 19 PHE CA . 11429 1 177 . 1 1 19 19 PHE CB C 13 40.50 . . 1 . . . . 19 PHE CB . 11429 1 178 . 1 1 19 19 PHE N N 15 125.21 . . 1 . . . . 19 PHE N . 11429 1 179 . 1 1 20 20 VAL H H 1 7.98 . . 1 . . . . 20 VAL H . 11429 1 180 . 1 1 20 20 VAL HA H 1 3.10 . . 1 . . . . 20 VAL HA . 11429 1 181 . 1 1 20 20 VAL HB H 1 1.76 . . 1 . . . . 20 VAL HB . 11429 1 182 . 1 1 20 20 VAL HG11 H 1 0.27 . . . . . . . 20 VAL MG1 . 11429 1 183 . 1 1 20 20 VAL HG12 H 1 0.27 . . . . . . . 20 VAL MG1 . 11429 1 184 . 1 1 20 20 VAL HG13 H 1 0.27 . . . . . . . 20 VAL MG1 . 11429 1 185 . 1 1 20 20 VAL HG21 H 1 0.87 . . . . . . . 20 VAL MG2 . 11429 1 186 . 1 1 20 20 VAL HG22 H 1 0.87 . . . . . . . 20 VAL MG2 . 11429 1 187 . 1 1 20 20 VAL HG23 H 1 0.87 . . . . . . . 20 VAL MG2 . 11429 1 188 . 1 1 20 20 VAL C C 13 177.62 . . 1 . . . . 20 VAL C . 11429 1 189 . 1 1 20 20 VAL CA C 13 66.99 . . 1 . . . . 20 VAL CA . 11429 1 190 . 1 1 20 20 VAL CB C 13 31.38 . . 1 . . . . 20 VAL CB . 11429 1 191 . 1 1 20 20 VAL N N 15 120.36 . . 1 . . . . 20 VAL N . 11429 1 192 . 1 1 21 21 GLN H H 1 7.97 . . 1 . . . . 21 GLN H . 11429 1 193 . 1 1 21 21 GLN HA H 1 3.93 . . 1 . . . . 21 GLN HA . 11429 1 194 . 1 1 21 21 GLN HB2 H 1 2.12 . . . . . . . 21 GLN HB2 . 11429 1 195 . 1 1 21 21 GLN HE21 H 1 6.80 . . . . . . . 21 GLN HE21 . 11429 1 196 . 1 1 21 21 GLN HE22 H 1 7.74 . . . . . . . 21 GLN HE22 . 11429 1 197 . 1 1 21 21 GLN HG2 H 1 2.33 . . 2 . . . . 21 GLN HG2 . 11429 1 198 . 1 1 21 21 GLN HG3 H 1 2.33 . . 2 . . . . 21 GLN HG3 . 11429 1 199 . 1 1 21 21 GLN C C 13 178.81 . . 1 . . . . 21 GLN C . 11429 1 200 . 1 1 21 21 GLN CA C 13 59.52 . . 1 . . . . 21 GLN CA . 11429 1 201 . 1 1 21 21 GLN CB C 13 29.24 . . 1 . . . . 21 GLN CB . 11429 1 202 . 1 1 21 21 GLN N N 15 118.93 . . 1 . . . . 21 GLN N . 11429 1 203 . 1 1 21 21 GLN NE2 N 15 111.80 . . 1 . . . . 21 GLN NE2 . 11429 1 204 . 1 1 22 22 THR H H 1 8.52 . . 1 . . . . 22 THR H . 11429 1 205 . 1 1 22 22 THR HA H 1 4.09 . . 1 . . . . 22 THR HA . 11429 1 206 . 1 1 22 22 THR HB H 1 4.32 . . 1 . . . . 22 THR HB . 11429 1 207 . 1 1 22 22 THR HG21 H 1 1.55 . . 1 . . . . 22 THR HG2 . 11429 1 208 . 1 1 22 22 THR HG22 H 1 1.55 . . 1 . . . . 22 THR HG2 . 11429 1 209 . 1 1 22 22 THR HG23 H 1 1.55 . . 1 . . . . 22 THR HG2 . 11429 1 210 . 1 1 22 22 THR C C 13 177.00 . . 1 . . . . 22 THR C . 11429 1 211 . 1 1 22 22 THR CA C 13 66.54 . . 1 . . . . 22 THR CA . 11429 1 212 . 1 1 22 22 THR CB C 13 69.23 . . 1 . . . . 22 THR CB . 11429 1 213 . 1 1 22 22 THR N N 15 115.11 . . 1 . . . . 22 THR N . 11429 1 214 . 1 1 23 23 SER H H 1 8.26 . . 1 . . . . 23 SER H . 11429 1 215 . 1 1 23 23 SER HA H 1 4.29 . . 1 . . . . 23 SER HA . 11429 1 216 . 1 1 23 23 SER HB2 H 1 3.93 . . . . . . . 23 SER HB2 . 11429 1 217 . 1 1 23 23 SER C C 13 178.86 . . 1 . . . . 23 SER C . 11429 1 218 . 1 1 23 23 SER CA C 13 62.44 . . 1 . . . . 23 SER CA . 11429 1 219 . 1 1 23 23 SER CB C 13 64.23 . . 1 . . . . 23 SER CB . 11429 1 220 . 1 1 23 23 SER N N 15 119.01 . . 1 . . . . 23 SER N . 11429 1 221 . 1 1 24 24 ARG H H 1 8.39 . . 1 . . . . 24 ARG H . 11429 1 222 . 1 1 24 24 ARG HA H 1 4.22 . . 1 . . . . 24 ARG HA . 11429 1 223 . 1 1 24 24 ARG HB2 H 1 1.42 . . . . . . . 24 ARG HB2 . 11429 1 224 . 1 1 24 24 ARG HB3 H 1 1.73 . . . . . . . 24 ARG HB3 . 11429 1 225 . 1 1 24 24 ARG C C 13 179.46 . . 1 . . . . 24 ARG C . 11429 1 226 . 1 1 24 24 ARG CA C 13 66.94 . . 1 . . . . 24 ARG CA . 11429 1 227 . 1 1 24 24 ARG CB C 13 31.24 . . 1 . . . . 24 ARG CB . 11429 1 228 . 1 1 24 24 ARG N N 15 124.74 . . 1 . . . . 24 ARG N . 11429 1 229 . 1 1 25 25 GLU H H 1 8.18 . . 1 . . . . 25 GLU H . 11429 1 230 . 1 1 25 25 GLU HA H 1 3.73 . . 1 . . . . 25 GLU HA . 11429 1 231 . 1 1 25 25 GLU HB2 H 1 2.18 . . . . . . . 25 GLU HB2 . 11429 1 232 . 1 1 25 25 GLU HB3 H 1 2.61 . . . . . . . 25 GLU HB3 . 11429 1 233 . 1 1 25 25 GLU C C 13 178.27 . . 1 . . . . 25 GLU C . 11429 1 234 . 1 1 25 25 GLU CA C 13 60.76 . . 1 . . . . 25 GLU CA . 11429 1 235 . 1 1 25 25 GLU CB C 13 38.65 . . 1 . . . . 25 GLU CB . 11429 1 236 . 1 1 25 25 GLU N N 15 125.71 . . 1 . . . . 25 GLU N . 11429 1 237 . 1 1 26 26 GLU H H 1 8.32 . . 1 . . . . 26 GLU H . 11429 1 238 . 1 1 26 26 GLU HA H 1 4.07 . . 1 . . . . 26 GLU HA . 11429 1 239 . 1 1 26 26 GLU HB2 H 1 2.13 . . . . . . . 26 GLU HB2 . 11429 1 240 . 1 1 26 26 GLU HB3 H 1 2.37 . . . . . . . 26 GLU HB3 . 11429 1 241 . 1 1 26 26 GLU HG2 H 1 2.37 . . . . . . . 26 GLU HG2 . 11429 1 242 . 1 1 26 26 GLU HG3 H 1 2.50 . . . . . . . 26 GLU HG3 . 11429 1 243 . 1 1 26 26 GLU C C 13 178.69 . . 1 . . . . 26 GLU C . 11429 1 244 . 1 1 26 26 GLU CA C 13 59.17 . . 1 . . . . 26 GLU CA . 11429 1 245 . 1 1 26 26 GLU CB C 13 29.48 . . 1 . . . . 26 GLU CB . 11429 1 246 . 1 1 26 26 GLU N N 15 119.92 . . 1 . . . . 26 GLU N . 11429 1 247 . 1 1 27 27 HIS H H 1 8.24 . . 1 . . . . 27 HIS H . 11429 1 248 . 1 1 27 27 HIS HA H 1 4.30 . . 1 . . . . 27 HIS HA . 11429 1 249 . 1 1 27 27 HIS HB2 H 1 3.14 . . . . . . . 27 HIS HB2 . 11429 1 250 . 1 1 27 27 HIS HB3 H 1 3.32 . . . . . . . 27 HIS HB3 . 11429 1 251 . 1 1 27 27 HIS HD2 H 1 7.02 . . 1 . . . . 27 HIS HD2 . 11429 1 252 . 1 1 27 27 HIS HE1 H 1 8.00 . . 1 . . . . 27 HIS HE1 . 11429 1 253 . 1 1 27 27 HIS C C 13 176.77 . . 1 . . . . 27 HIS C . 11429 1 254 . 1 1 27 27 HIS CA C 13 60.15 . . 1 . . . . 27 HIS CA . 11429 1 255 . 1 1 27 27 HIS CB C 13 29.33 . . 1 . . . . 27 HIS CB . 11429 1 256 . 1 1 27 27 HIS N N 15 119.14 . . 1 . . . . 27 HIS N . 11429 1 257 . 1 1 28 28 LYS H H 1 7.95 . . 1 . . . . 28 LYS H . 11429 1 258 . 1 1 28 28 LYS HA H 1 3.96 . . 1 . . . . 28 LYS HA . 11429 1 259 . 1 1 28 28 LYS HB2 H 1 1.88 . . . . . . . 28 LYS HB2 . 11429 1 260 . 1 1 28 28 LYS HD2 H 1 1.76 . . 2 . . . . 28 LYS HD2 . 11429 1 261 . 1 1 28 28 LYS HD3 H 1 1.76 . . 2 . . . . 28 LYS HD3 . 11429 1 262 . 1 1 28 28 LYS HE2 H 1 2.98 . . 2 . . . . 28 LYS HE2 . 11429 1 263 . 1 1 28 28 LYS HE3 H 1 2.98 . . 2 . . . . 28 LYS HE3 . 11429 1 264 . 1 1 28 28 LYS HG2 H 1 1.42 . . . . . . . 28 LYS HG2 . 11429 1 265 . 1 1 28 28 LYS HG3 H 1 1.53 . . . . . . . 28 LYS HG3 . 11429 1 266 . 1 1 28 28 LYS C C 13 177.97 . . 1 . . . . 28 LYS C . 11429 1 267 . 1 1 28 28 LYS CA C 13 58.37 . . 1 . . . . 28 LYS CA . 11429 1 268 . 1 1 28 28 LYS CB C 13 32.24 . . 1 . . . . 28 LYS CB . 11429 1 269 . 1 1 28 28 LYS N N 15 118.87 . . 1 . . . . 28 LYS N . 11429 1 270 . 1 1 29 29 LYS H H 1 7.56 . . 1 . . . . 29 LYS H . 11429 1 271 . 1 1 29 29 LYS HA H 1 3.98 . . 1 . . . . 29 LYS HA . 11429 1 272 . 1 1 29 29 LYS HB2 H 1 1.88 . . . . . . . 29 LYS HB2 . 11429 1 273 . 1 1 29 29 LYS HD2 H 1 1.71 . . 2 . . . . 29 LYS HD2 . 11429 1 274 . 1 1 29 29 LYS HD3 H 1 1.71 . . 2 . . . . 29 LYS HD3 . 11429 1 275 . 1 1 29 29 LYS HE2 H 1 2.97 . . 2 . . . . 29 LYS HE2 . 11429 1 276 . 1 1 29 29 LYS HE3 H 1 2.97 . . 2 . . . . 29 LYS HE3 . 11429 1 277 . 1 1 29 29 LYS HG2 H 1 1.40 . . . . . . . 29 LYS HG2 . 11429 1 278 . 1 1 29 29 LYS HG3 H 1 1.56 . . . . . . . 29 LYS HG3 . 11429 1 279 . 1 1 29 29 LYS CA C 13 58.59 . . 1 . . . . 29 LYS CA . 11429 1 280 . 1 1 29 29 LYS CB C 13 32.60 . . 1 . . . . 29 LYS CB . 11429 1 281 . 1 1 29 29 LYS N N 15 117.38 . . 1 . . . . 29 LYS N . 11429 1 282 . 1 1 30 30 LYS H H 1 7.56 . . 1 . . . . 30 LYS H . 11429 1 283 . 1 1 30 30 LYS HA H 1 3.99 . . 1 . . . . 30 LYS HA . 11429 1 284 . 1 1 30 30 LYS HB2 H 1 1.38 . . . . . . . 30 LYS HB2 . 11429 1 285 . 1 1 30 30 LYS HB3 H 1 1.56 . . . . . . . 30 LYS HB3 . 11429 1 286 . 1 1 30 30 LYS HD2 H 1 1.65 . . 2 . . . . 30 LYS HD2 . 11429 1 287 . 1 1 30 30 LYS HD3 H 1 1.65 . . 2 . . . . 30 LYS HD3 . 11429 1 288 . 1 1 30 30 LYS HE2 H 1 2.96 . . 2 . . . . 30 LYS HE2 . 11429 1 289 . 1 1 30 30 LYS HE3 H 1 2.96 . . 2 . . . . 30 LYS HE3 . 11429 1 290 . 1 1 30 30 LYS HG2 H 1 1.15 . . . . . . . 30 LYS HG2 . 11429 1 291 . 1 1 30 30 LYS HG3 H 1 1.35 . . . . . . . 30 LYS HG3 . 11429 1 292 . 1 1 30 30 LYS C C 13 176.38 . . 1 . . . . 30 LYS C . 11429 1 293 . 1 1 30 30 LYS CA C 13 57.43 . . 1 . . . . 30 LYS CA . 11429 1 294 . 1 1 30 30 LYS CB C 13 33.82 . . 1 . . . . 30 LYS CB . 11429 1 295 . 1 1 30 30 LYS N N 15 116.32 . . 1 . . . . 30 LYS N . 11429 1 296 . 1 1 31 31 HIS H H 1 7.88 . . 1 . . . . 31 HIS H . 11429 1 297 . 1 1 31 31 HIS HA H 1 5.02 . . 1 . . . . 31 HIS HA . 11429 1 298 . 1 1 31 31 HIS HB2 H 1 2.66 . . . . . . . 31 HIS HB2 . 11429 1 299 . 1 1 31 31 HIS HB3 H 1 2.97 . . . . . . . 31 HIS HB3 . 11429 1 300 . 1 1 31 31 HIS HD2 H 1 6.76 . . 1 . . . . 31 HIS HD2 . 11429 1 301 . 1 1 31 31 HIS HE1 H 1 8.60 . . 1 . . . . 31 HIS HE1 . 11429 1 302 . 1 1 31 31 HIS CA C 13 52.29 . . 1 . . . . 31 HIS CA . 11429 1 303 . 1 1 31 31 HIS CB C 13 28.19 . . 1 . . . . 31 HIS CB . 11429 1 304 . 1 1 31 31 HIS N N 15 115.31 . . 1 . . . . 31 HIS N . 11429 1 305 . 1 1 32 32 PRO HA H 1 4.51 . . 1 . . . . 32 PRO HA . 11429 1 306 . 1 1 32 32 PRO HB2 H 1 1.95 . . . . . . . 32 PRO HB2 . 11429 1 307 . 1 1 32 32 PRO HB3 H 1 2.34 . . . . . . . 32 PRO HB3 . 11429 1 308 . 1 1 32 32 PRO HD2 H 1 3.32 . . . . . . . 32 PRO HD2 . 11429 1 309 . 1 1 32 32 PRO HD3 H 1 3.56 . . . . . . . 32 PRO HD3 . 11429 1 310 . 1 1 32 32 PRO HG2 H 1 1.98 . . 2 . . . . 32 PRO HG2 . 11429 1 311 . 1 1 32 32 PRO HG3 H 1 1.98 . . 2 . . . . 32 PRO HG3 . 11429 1 312 . 1 1 32 32 PRO C C 13 177.31 . . 1 . . . . 32 PRO C . 11429 1 313 . 1 1 32 32 PRO CA C 13 64.79 . . 1 . . . . 32 PRO CA . 11429 1 314 . 1 1 32 32 PRO CB C 13 31.89 . . 1 . . . . 32 PRO CB . 11429 1 315 . 1 1 33 33 ASP H H 1 8.57 . . 1 . . . . 33 ASP H . 11429 1 316 . 1 1 33 33 ASP HA H 1 4.68 . . 1 . . . . 33 ASP HA . 11429 1 317 . 1 1 33 33 ASP HB2 H 1 2.71 . . . . . . . 33 ASP HB2 . 11429 1 318 . 1 1 33 33 ASP C C 13 175.91 . . 1 . . . . 33 ASP C . 11429 1 319 . 1 1 33 33 ASP CA C 13 53.85 . . 1 . . . . 33 ASP CA . 11429 1 320 . 1 1 33 33 ASP CB C 13 40.63 . . 1 . . . . 33 ASP CB . 11429 1 321 . 1 1 33 33 ASP N N 15 116.76 . . 1 . . . . 33 ASP N . 11429 1 322 . 1 1 34 34 SER H H 1 7.61 . . 1 . . . . 34 SER H . 11429 1 323 . 1 1 34 34 SER HA H 1 4.55 . . 1 . . . . 34 SER HA . 11429 1 324 . 1 1 34 34 SER HB2 H 1 3.88 . . . . . . . 34 SER HB2 . 11429 1 325 . 1 1 34 34 SER C C 13 174.56 . . 1 . . . . 34 SER C . 11429 1 326 . 1 1 34 34 SER CA C 13 57.98 . . 1 . . . . 34 SER CA . 11429 1 327 . 1 1 34 34 SER CB C 13 64.33 . . 1 . . . . 34 SER CB . 11429 1 328 . 1 1 34 34 SER N N 15 114.59 . . 1 . . . . 34 SER N . 11429 1 329 . 1 1 35 35 SER H H 1 8.70 . . 1 . . . . 35 SER H . 11429 1 330 . 1 1 35 35 SER HA H 1 4.56 . . 1 . . . . 35 SER HA . 11429 1 331 . 1 1 35 35 SER HB2 H 1 3.86 . . . . . . . 35 SER HB2 . 11429 1 332 . 1 1 35 35 SER C C 13 175.08 . . 1 . . . . 35 SER C . 11429 1 333 . 1 1 35 35 SER CA C 13 57.99 . . 1 . . . . 35 SER CA . 11429 1 334 . 1 1 35 35 SER CB C 13 63.92 . . 1 . . . . 35 SER CB . 11429 1 335 . 1 1 35 35 SER N N 15 120.19 . . 1 . . . . 35 SER N . 11429 1 336 . 1 1 36 36 VAL H H 1 8.31 . . 1 . . . . 36 VAL H . 11429 1 337 . 1 1 36 36 VAL HA H 1 4.00 . . 1 . . . . 36 VAL HA . 11429 1 338 . 1 1 36 36 VAL HB H 1 1.81 . . 1 . . . . 36 VAL HB . 11429 1 339 . 1 1 36 36 VAL HG11 H 1 0.55 . . . . . . . 36 VAL MG1 . 11429 1 340 . 1 1 36 36 VAL HG12 H 1 0.55 . . . . . . . 36 VAL MG1 . 11429 1 341 . 1 1 36 36 VAL HG13 H 1 0.55 . . . . . . . 36 VAL MG1 . 11429 1 342 . 1 1 36 36 VAL HG21 H 1 0.68 . . . . . . . 36 VAL MG2 . 11429 1 343 . 1 1 36 36 VAL HG22 H 1 0.68 . . . . . . . 36 VAL MG2 . 11429 1 344 . 1 1 36 36 VAL HG23 H 1 0.68 . . . . . . . 36 VAL MG2 . 11429 1 345 . 1 1 36 36 VAL C C 13 175.38 . . 1 . . . . 36 VAL C . 11429 1 346 . 1 1 36 36 VAL CA C 13 61.81 . . 1 . . . . 36 VAL CA . 11429 1 347 . 1 1 36 36 VAL CB C 13 33.00 . . 1 . . . . 36 VAL CB . 11429 1 348 . 1 1 36 36 VAL N N 15 122.75 . . 1 . . . . 36 VAL N . 11429 1 349 . 1 1 37 37 ASN H H 1 8.72 . . 1 . . . . 37 ASN H . 11429 1 350 . 1 1 37 37 ASN HA H 1 4.74 . . 1 . . . . 37 ASN HA . 11429 1 351 . 1 1 37 37 ASN HB2 H 1 2.92 . . . . . . . 37 ASN HB2 . 11429 1 352 . 1 1 37 37 ASN HD21 H 1 7.02 . . . . . . . 37 ASN HD21 . 11429 1 353 . 1 1 37 37 ASN HD22 H 1 7.75 . . . . . . . 37 ASN HD22 . 11429 1 354 . 1 1 37 37 ASN C C 13 175.54 . . 1 . . . . 37 ASN C . 11429 1 355 . 1 1 37 37 ASN CA C 13 52.71 . . 1 . . . . 37 ASN CA . 11429 1 356 . 1 1 37 37 ASN CB C 13 38.58 . . 1 . . . . 37 ASN CB . 11429 1 357 . 1 1 37 37 ASN N N 15 125.73 . . 1 . . . . 37 ASN N . 11429 1 358 . 1 1 37 37 ASN ND2 N 15 113.10 . . 1 . . . . 37 ASN ND2 . 11429 1 359 . 1 1 38 38 PHE H H 1 8.98 . . 1 . . . . 38 PHE H . 11429 1 360 . 1 1 38 38 PHE HA H 1 4.13 . . 1 . . . . 38 PHE HA . 11429 1 361 . 1 1 38 38 PHE HB2 H 1 3.19 . . . . . . . 38 PHE HB2 . 11429 1 362 . 1 1 38 38 PHE HB3 H 1 3.23 . . . . . . . 38 PHE HB3 . 11429 1 363 . 1 1 38 38 PHE HD1 H 1 7.18 . . 3 . . . . 38 PHE HD1 . 11429 1 364 . 1 1 38 38 PHE HD2 H 1 7.18 . . 3 . . . . 38 PHE HD2 . 11429 1 365 . 1 1 38 38 PHE HE1 H 1 7.25 . . 3 . . . . 38 PHE HE1 . 11429 1 366 . 1 1 38 38 PHE HE2 H 1 7.25 . . 3 . . . . 38 PHE HE2 . 11429 1 367 . 1 1 38 38 PHE HZ H 1 7.25 . . 1 . . . . 38 PHE HZ . 11429 1 368 . 1 1 38 38 PHE C C 13 177.48 . . 1 . . . . 38 PHE C . 11429 1 369 . 1 1 38 38 PHE CA C 13 62.15 . . 1 . . . . 38 PHE CA . 11429 1 370 . 1 1 38 38 PHE CB C 13 39.11 . . 1 . . . . 38 PHE CB . 11429 1 371 . 1 1 38 38 PHE N N 15 125.72 . . 1 . . . . 38 PHE N . 11429 1 372 . 1 1 39 39 ALA H H 1 8.62 . . 1 . . . . 39 ALA H . 11429 1 373 . 1 1 39 39 ALA HA H 1 4.10 . . 1 . . . . 39 ALA HA . 11429 1 374 . 1 1 39 39 ALA HB1 H 1 1.52 . . 1 . . . . 39 ALA MB . 11429 1 375 . 1 1 39 39 ALA HB2 H 1 1.52 . . 1 . . . . 39 ALA MB . 11429 1 376 . 1 1 39 39 ALA HB3 H 1 1.52 . . 1 . . . . 39 ALA MB . 11429 1 377 . 1 1 39 39 ALA C C 13 180.69 . . 1 . . . . 39 ALA C . 11429 1 378 . 1 1 39 39 ALA CA C 13 55.52 . . 1 . . . . 39 ALA CA . 11429 1 379 . 1 1 39 39 ALA CB C 13 17.85 . . 1 . . . . 39 ALA CB . 11429 1 380 . 1 1 39 39 ALA N N 15 123.79 . . 1 . . . . 39 ALA N . 11429 1 381 . 1 1 40 40 GLU H H 1 8.02 . . 1 . . . . 40 GLU H . 11429 1 382 . 1 1 40 40 GLU HA H 1 4.03 . . 1 . . . . 40 GLU HA . 11429 1 383 . 1 1 40 40 GLU HB2 H 1 2.05 . . . . . . . 40 GLU HB2 . 11429 1 384 . 1 1 40 40 GLU HG2 H 1 2.24 . . . . . . . 40 GLU HG2 . 11429 1 385 . 1 1 40 40 GLU HG3 H 1 2.35 . . . . . . . 40 GLU HG3 . 11429 1 386 . 1 1 40 40 GLU C C 13 178.85 . . 1 . . . . 40 GLU C . 11429 1 387 . 1 1 40 40 GLU CA C 13 58.74 . . 1 . . . . 40 GLU CA . 11429 1 388 . 1 1 40 40 GLU CB C 13 29.65 . . 1 . . . . 40 GLU CB . 11429 1 389 . 1 1 40 40 GLU N N 15 119.24 . . 1 . . . . 40 GLU N . 11429 1 390 . 1 1 41 41 PHE H H 1 8.62 . . 1 . . . . 41 PHE H . 11429 1 391 . 1 1 41 41 PHE HA H 1 4.01 . . 1 . . . . 41 PHE HA . 11429 1 392 . 1 1 41 41 PHE HB2 H 1 2.79 . . . . . . . 41 PHE HB2 . 11429 1 393 . 1 1 41 41 PHE HB3 H 1 2.99 . . . . . . . 41 PHE HB3 . 11429 1 394 . 1 1 41 41 PHE HD1 H 1 6.86 . . 3 . . . . 41 PHE HD1 . 11429 1 395 . 1 1 41 41 PHE HD2 H 1 6.86 . . 3 . . . . 41 PHE HD2 . 11429 1 396 . 1 1 41 41 PHE HE1 H 1 6.91 . . 3 . . . . 41 PHE HE1 . 11429 1 397 . 1 1 41 41 PHE HE2 H 1 6.91 . . 3 . . . . 41 PHE HE2 . 11429 1 398 . 1 1 41 41 PHE HZ H 1 6.79 . . 1 . . . . 41 PHE HZ . 11429 1 399 . 1 1 41 41 PHE C C 13 177.87 . . 1 . . . . 41 PHE C . 11429 1 400 . 1 1 41 41 PHE CA C 13 61.80 . . 1 . . . . 41 PHE CA . 11429 1 401 . 1 1 41 41 PHE CB C 13 39.75 . . 1 . . . . 41 PHE CB . 11429 1 402 . 1 1 41 41 PHE N N 15 122.04 . . 1 . . . . 41 PHE N . 11429 1 403 . 1 1 42 42 SER H H 1 8.56 . . 1 . . . . 42 SER H . 11429 1 404 . 1 1 42 42 SER HA H 1 3.74 . . 1 . . . . 42 SER HA . 11429 1 405 . 1 1 42 42 SER HB2 H 1 3.67 . . . . . . . 42 SER HB2 . 11429 1 406 . 1 1 42 42 SER HB3 H 1 3.73 . . . . . . . 42 SER HB3 . 11429 1 407 . 1 1 42 42 SER C C 13 176.13 . . 1 . . . . 42 SER C . 11429 1 408 . 1 1 42 42 SER CA C 13 62.07 . . 1 . . . . 42 SER CA . 11429 1 409 . 1 1 42 42 SER N N 15 115.54 . . 1 . . . . 42 SER N . 11429 1 410 . 1 1 43 43 LYS H H 1 7.45 . . 1 . . . . 43 LYS H . 11429 1 411 . 1 1 43 43 LYS HA H 1 4.06 . . 1 . . . . 43 LYS HA . 11429 1 412 . 1 1 43 43 LYS HB2 H 1 1.91 . . . . . . . 43 LYS HB2 . 11429 1 413 . 1 1 43 43 LYS HB3 H 1 1.96 . . . . . . . 43 LYS HB3 . 11429 1 414 . 1 1 43 43 LYS HD2 H 1 1.64 . . 2 . . . . 43 LYS HD2 . 11429 1 415 . 1 1 43 43 LYS HD3 H 1 1.64 . . 2 . . . . 43 LYS HD3 . 11429 1 416 . 1 1 43 43 LYS HE2 H 1 2.99 . . 2 . . . . 43 LYS HE2 . 11429 1 417 . 1 1 43 43 LYS HE3 H 1 2.99 . . 2 . . . . 43 LYS HE3 . 11429 1 418 . 1 1 43 43 LYS HG2 H 1 1.39 . . . . . . . 43 LYS HG2 . 11429 1 419 . 1 1 43 43 LYS HG3 H 1 1.52 . . . . . . . 43 LYS HG3 . 11429 1 420 . 1 1 43 43 LYS C C 13 180.11 . . 1 . . . . 43 LYS C . 11429 1 421 . 1 1 43 43 LYS CA C 13 59.41 . . 1 . . . . 43 LYS CA . 11429 1 422 . 1 1 43 43 LYS CB C 13 32.18 . . 1 . . . . 43 LYS CB . 11429 1 423 . 1 1 43 43 LYS N N 15 122.40 . . 1 . . . . 43 LYS N . 11429 1 424 . 1 1 44 44 LYS H H 1 7.75 . . 1 . . . . 44 LYS H . 11429 1 425 . 1 1 44 44 LYS HA H 1 4.06 . . 1 . . . . 44 LYS HA . 11429 1 426 . 1 1 44 44 LYS HB2 H 1 1.79 . . . . . . . 44 LYS HB2 . 11429 1 427 . 1 1 44 44 LYS HD2 H 1 1.64 . . 2 . . . . 44 LYS HD2 . 11429 1 428 . 1 1 44 44 LYS HD3 H 1 1.64 . . 2 . . . . 44 LYS HD3 . 11429 1 429 . 1 1 44 44 LYS HE2 H 1 2.99 . . 2 . . . . 44 LYS HE2 . 11429 1 430 . 1 1 44 44 LYS HE3 H 1 2.99 . . 2 . . . . 44 LYS HE3 . 11429 1 431 . 1 1 44 44 LYS HG2 H 1 1.38 . . . . . . . 44 LYS HG2 . 11429 1 432 . 1 1 44 44 LYS HG3 H 1 1.51 . . . . . . . 44 LYS HG3 . 11429 1 433 . 1 1 44 44 LYS C C 13 180.11 . . 1 . . . . 44 LYS C . 11429 1 434 . 1 1 44 44 LYS CA C 13 59.25 . . 1 . . . . 44 LYS CA . 11429 1 435 . 1 1 44 44 LYS CB C 13 31.75 . . 1 . . . . 44 LYS CB . 11429 1 436 . 1 1 44 44 LYS N N 15 119.98 . . 1 . . . . 44 LYS N . 11429 1 437 . 1 1 45 45 CYS H H 1 8.05 . . 1 . . . . 45 CYS H . 11429 1 438 . 1 1 45 45 CYS HA H 1 4.09 . . 1 . . . . 45 CYS HA . 11429 1 439 . 1 1 45 45 CYS HB2 H 1 2.51 . . . . . . . 45 CYS HB2 . 11429 1 440 . 1 1 45 45 CYS HB3 H 1 3.07 . . . . . . . 45 CYS HB3 . 11429 1 441 . 1 1 45 45 CYS C C 13 176.68 . . 1 . . . . 45 CYS C . 11429 1 442 . 1 1 45 45 CYS CA C 13 64.57 . . 1 . . . . 45 CYS CA . 11429 1 443 . 1 1 45 45 CYS CB C 13 27.09 . . 1 . . . . 45 CYS CB . 11429 1 444 . 1 1 45 45 CYS N N 15 117.68 . . 1 . . . . 45 CYS N . 11429 1 445 . 1 1 46 46 SER H H 1 8.37 . . 1 . . . . 46 SER H . 11429 1 446 . 1 1 46 46 SER HA H 1 4.21 . . 1 . . . . 46 SER HA . 11429 1 447 . 1 1 46 46 SER HB2 H 1 4.00 . . . . . . . 46 SER HB2 . 11429 1 448 . 1 1 46 46 SER HB3 H 1 4.08 . . . . . . . 46 SER HB3 . 11429 1 449 . 1 1 46 46 SER C C 13 177.37 . . 1 . . . . 46 SER C . 11429 1 450 . 1 1 46 46 SER CA C 13 62.13 . . 1 . . . . 46 SER CA . 11429 1 451 . 1 1 46 46 SER CB C 13 63.70 . . 1 . . . . 46 SER CB . 11429 1 452 . 1 1 46 46 SER N N 15 117.37 . . 1 . . . . 46 SER N . 11429 1 453 . 1 1 47 47 GLU H H 1 7.91 . . 1 . . . . 47 GLU H . 11429 1 454 . 1 1 47 47 GLU HA H 1 4.08 . . 1 . . . . 47 GLU HA . 11429 1 455 . 1 1 47 47 GLU HB2 H 1 2.16 . . . . . . . 47 GLU HB2 . 11429 1 456 . 1 1 47 47 GLU HG2 H 1 2.34 . . . . . . . 47 GLU HG2 . 11429 1 457 . 1 1 47 47 GLU HG3 H 1 2.46 . . . . . . . 47 GLU HG3 . 11429 1 458 . 1 1 47 47 GLU C C 13 179.28 . . 1 . . . . 47 GLU C . 11429 1 459 . 1 1 47 47 GLU CA C 13 58.95 . . 1 . . . . 47 GLU CA . 11429 1 460 . 1 1 47 47 GLU CB C 13 29.47 . . 1 . . . . 47 GLU CB . 11429 1 461 . 1 1 47 47 GLU N N 15 121.04 . . 1 . . . . 47 GLU N . 11429 1 462 . 1 1 48 48 ARG H H 1 8.12 . . 1 . . . . 48 ARG H . 11429 1 463 . 1 1 48 48 ARG HA H 1 4.14 . . 1 . . . . 48 ARG HA . 11429 1 464 . 1 1 48 48 ARG HB2 H 1 2.15 . . . . . . . 48 ARG HB2 . 11429 1 465 . 1 1 48 48 ARG HD2 H 1 3.30 . . 2 . . . . 48 ARG HD2 . 11429 1 466 . 1 1 48 48 ARG HD3 H 1 3.30 . . 2 . . . . 48 ARG HD3 . 11429 1 467 . 1 1 48 48 ARG HG2 H 1 1.94 . . 2 . . . . 48 ARG HG2 . 11429 1 468 . 1 1 48 48 ARG HG3 H 1 1.94 . . 2 . . . . 48 ARG HG3 . 11429 1 469 . 1 1 48 48 ARG C C 13 179.02 . . 1 . . . . 48 ARG C . 11429 1 470 . 1 1 48 48 ARG CA C 13 58.81 . . 1 . . . . 48 ARG CA . 11429 1 471 . 1 1 48 48 ARG CB C 13 30.50 . . 1 . . . . 48 ARG CB . 11429 1 472 . 1 1 48 48 ARG N N 15 120.05 . . 1 . . . . 48 ARG N . 11429 1 473 . 1 1 49 49 TRP H H 1 8.76 . . 1 . . . . 49 TRP H . 11429 1 474 . 1 1 49 49 TRP HA H 1 4.38 . . 1 . . . . 49 TRP HA . 11429 1 475 . 1 1 49 49 TRP HB2 H 1 3.29 . . . . . . . 49 TRP HB2 . 11429 1 476 . 1 1 49 49 TRP HB3 H 1 3.40 . . . . . . . 49 TRP HB3 . 11429 1 477 . 1 1 49 49 TRP HD1 H 1 7.02 . . 1 . . . . 49 TRP HD1 . 11429 1 478 . 1 1 49 49 TRP HE1 H 1 10.20 . . 1 . . . . 49 TRP HE1 . 11429 1 479 . 1 1 49 49 TRP HE3 H 1 6.28 . . 1 . . . . 49 TRP HE3 . 11429 1 480 . 1 1 49 49 TRP HH2 H 1 7.12 . . 1 . . . . 49 TRP HH2 . 11429 1 481 . 1 1 49 49 TRP HZ2 H 1 7.62 . . 1 . . . . 49 TRP HZ2 . 11429 1 482 . 1 1 49 49 TRP HZ3 H 1 6.45 . . 1 . . . . 49 TRP HZ3 . 11429 1 483 . 1 1 49 49 TRP C C 13 177.97 . . 1 . . . . 49 TRP C . 11429 1 484 . 1 1 49 49 TRP CA C 13 59.67 . . 1 . . . . 49 TRP CA . 11429 1 485 . 1 1 49 49 TRP CB C 13 30.60 . . 1 . . . . 49 TRP CB . 11429 1 486 . 1 1 49 49 TRP N N 15 120.86 . . 1 . . . . 49 TRP N . 11429 1 487 . 1 1 50 50 LYS H H 1 7.47 . . 1 . . . . 50 LYS H . 11429 1 488 . 1 1 50 50 LYS HA H 1 4.05 . . 1 . . . . 50 LYS HA . 11429 1 489 . 1 1 50 50 LYS HB2 H 1 1.71 . . . . . . . 50 LYS HB2 . 11429 1 490 . 1 1 50 50 LYS HB3 H 1 1.98 . . . . . . . 50 LYS HB3 . 11429 1 491 . 1 1 50 50 LYS HD2 H 1 1.71 . . 2 . . . . 50 LYS HD2 . 11429 1 492 . 1 1 50 50 LYS HD3 H 1 1.71 . . 2 . . . . 50 LYS HD3 . 11429 1 493 . 1 1 50 50 LYS HE2 H 1 3.01 . . 2 . . . . 50 LYS HE2 . 11429 1 494 . 1 1 50 50 LYS HE3 H 1 3.01 . . 2 . . . . 50 LYS HE3 . 11429 1 495 . 1 1 50 50 LYS HG2 H 1 1.40 . . . . . . . 50 LYS HG2 . 11429 1 496 . 1 1 50 50 LYS HG3 H 1 1.48 . . . . . . . 50 LYS HG3 . 11429 1 497 . 1 1 50 50 LYS C C 13 178.15 . . 1 . . . . 50 LYS C . 11429 1 498 . 1 1 50 50 LYS CA C 13 58.88 . . 1 . . . . 50 LYS CA . 11429 1 499 . 1 1 50 50 LYS CB C 13 33.04 . . 1 . . . . 50 LYS CB . 11429 1 500 . 1 1 50 50 LYS N N 15 114.52 . . 1 . . . . 50 LYS N . 11429 1 501 . 1 1 51 51 THR H H 1 7.41 . . 1 . . . . 51 THR H . 11429 1 502 . 1 1 51 51 THR HA H 1 4.39 . . 1 . . . . 51 THR HA . 11429 1 503 . 1 1 51 51 THR HB H 1 4.17 . . 1 . . . . 51 THR HB . 11429 1 504 . 1 1 51 51 THR HG21 H 1 1.25 . . 1 . . . . 51 THR MG . 11429 1 505 . 1 1 51 51 THR HG22 H 1 1.25 . . 1 . . . . 51 THR MG . 11429 1 506 . 1 1 51 51 THR HG23 H 1 1.25 . . 1 . . . . 51 THR MG . 11429 1 507 . 1 1 51 51 THR C C 13 174.88 . . 1 . . . . 51 THR C . 11429 1 508 . 1 1 51 51 THR CA C 13 61.28 . . 1 . . . . 51 THR CA . 11429 1 509 . 1 1 51 51 THR CB C 13 69.71 . . 1 . . . . 51 THR CB . 11429 1 510 . 1 1 51 51 THR N N 15 106.59 . . 1 . . . . 51 THR N . 11429 1 511 . 1 1 52 52 MET H H 1 7.14 . . 1 . . . . 52 MET H . 11429 1 512 . 1 1 52 52 MET HA H 1 4.21 . . 1 . . . . 52 MET HA . 11429 1 513 . 1 1 52 52 MET HB2 H 1 1.59 . . . . . . . 52 MET HB2 . 11429 1 514 . 1 1 52 52 MET HB3 H 1 1.80 . . . . . . . 52 MET HB3 . 11429 1 515 . 1 1 52 52 MET HG2 H 1 2.52 . . 2 . . . . 52 MET HG2 . 11429 1 516 . 1 1 52 52 MET HG3 H 1 2.52 . . 2 . . . . 52 MET HG3 . 11429 1 517 . 1 1 52 52 MET C C 13 175.88 . . 1 . . . . 52 MET C . 11429 1 518 . 1 1 52 52 MET CA C 13 56.45 . . 1 . . . . 52 MET CA . 11429 1 519 . 1 1 52 52 MET CB C 13 35.15 . . 1 . . . . 52 MET CB . 11429 1 520 . 1 1 52 52 MET N N 15 124.02 . . 1 . . . . 52 MET N . 11429 1 521 . 1 1 53 53 SER H H 1 9.00 . . 1 . . . . 53 SER H . 11429 1 522 . 1 1 53 53 SER HA H 1 4.34 . . 1 . . . . 53 SER HA . 11429 1 523 . 1 1 53 53 SER HB2 H 1 4.07 . . . . . . . 53 SER HB2 . 11429 1 524 . 1 1 53 53 SER C C 13 174.63 . . 1 . . . . 53 SER C . 11429 1 525 . 1 1 53 53 SER CA C 13 57.13 . . 1 . . . . 53 SER CA . 11429 1 526 . 1 1 53 53 SER CB C 13 65.46 . . 1 . . . . 53 SER CB . 11429 1 527 . 1 1 53 53 SER N N 15 120.05 . . 1 . . . . 53 SER N . 11429 1 528 . 1 1 54 54 ALA H H 1 8.89 . . 1 . . . . 54 ALA H . 11429 1 529 . 1 1 54 54 ALA HA H 1 3.92 . . 1 . . . . 54 ALA HA . 11429 1 530 . 1 1 54 54 ALA HB1 H 1 1.43 . . 1 . . . . 54 ALA MB . 11429 1 531 . 1 1 54 54 ALA HB2 H 1 1.43 . . 1 . . . . 54 ALA MB . 11429 1 532 . 1 1 54 54 ALA HB3 H 1 1.43 . . 1 . . . . 54 ALA MB . 11429 1 533 . 1 1 54 54 ALA C C 13 181.07 . . 1 . . . . 54 ALA C . 11429 1 534 . 1 1 54 54 ALA CA C 13 55.58 . . 1 . . . . 54 ALA CA . 11429 1 535 . 1 1 54 54 ALA CB C 13 17.70 . . 1 . . . . 54 ALA CB . 11429 1 536 . 1 1 54 54 ALA N N 15 123.68 . . 1 . . . . 54 ALA N . 11429 1 537 . 1 1 55 55 LYS H H 1 8.31 . . 1 . . . . 55 LYS H . 11429 1 538 . 1 1 55 55 LYS HA H 1 4.07 . . 1 . . . . 55 LYS HA . 11429 1 539 . 1 1 55 55 LYS HB2 H 1 1.76 . . . . . . . 55 LYS HB2 . 11429 1 540 . 1 1 55 55 LYS HB3 H 1 1.86 . . . . . . . 55 LYS HB3 . 11429 1 541 . 1 1 55 55 LYS HD2 H 1 1.63 . . 2 . . . . 55 LYS HD2 . 11429 1 542 . 1 1 55 55 LYS HD3 H 1 1.63 . . 2 . . . . 55 LYS HD3 . 11429 1 543 . 1 1 55 55 LYS HE2 H 1 4.09 . . 2 . . . . 55 LYS HE2 . 11429 1 544 . 1 1 55 55 LYS HE3 H 1 4.09 . . 2 . . . . 55 LYS HE3 . 11429 1 545 . 1 1 55 55 LYS HG2 H 1 1.44 . . 2 . . . . 55 LYS HG2 . 11429 1 546 . 1 1 55 55 LYS HG3 H 1 1.44 . . 2 . . . . 55 LYS HG3 . 11429 1 547 . 1 1 55 55 LYS C C 13 179.81 . . 1 . . . . 55 LYS C . 11429 1 548 . 1 1 55 55 LYS CA C 13 59.27 . . 1 . . . . 55 LYS CA . 11429 1 549 . 1 1 55 55 LYS CB C 13 32.29 . . 1 . . . . 55 LYS CB . 11429 1 550 . 1 1 55 55 LYS N N 15 118.21 . . 1 . . . . 55 LYS N . 11429 1 551 . 1 1 56 56 GLU H H 1 7.76 . . 1 . . . . 56 GLU H . 11429 1 552 . 1 1 56 56 GLU HA H 1 4.07 . . 1 . . . . 56 GLU HA . 11429 1 553 . 1 1 56 56 GLU HB2 H 1 2.23 . . . . . . . 56 GLU HB2 . 11429 1 554 . 1 1 56 56 GLU HB3 H 1 2.37 . . . . . . . 56 GLU HB3 . 11429 1 555 . 1 1 56 56 GLU HG2 H 1 2.52 . . 2 . . . . 56 GLU HG2 . 11429 1 556 . 1 1 56 56 GLU HG3 H 1 2.52 . . 2 . . . . 56 GLU HG3 . 11429 1 557 . 1 1 56 56 GLU C C 13 178.99 . . 1 . . . . 56 GLU C . 11429 1 558 . 1 1 56 56 GLU CA C 13 59.13 . . 1 . . . . 56 GLU CA . 11429 1 559 . 1 1 56 56 GLU CB C 13 30.09 . . 1 . . . . 56 GLU CB . 11429 1 560 . 1 1 56 56 GLU N N 15 121.02 . . 1 . . . . 56 GLU N . 11429 1 561 . 1 1 57 57 LYS H H 1 8.17 . . 1 . . . . 57 LYS H . 11429 1 562 . 1 1 57 57 LYS HA H 1 4.09 . . 1 . . . . 57 LYS HA . 11429 1 563 . 1 1 57 57 LYS HB2 H 1 1.60 . . . . . . . 57 LYS HB2 . 11429 1 564 . 1 1 57 57 LYS HB3 H 1 1.75 . . . . . . . 57 LYS HB3 . 11429 1 565 . 1 1 57 57 LYS HD2 H 1 1.24 . . 2 . . . . 57 LYS HD2 . 11429 1 566 . 1 1 57 57 LYS HD3 H 1 1.24 . . 2 . . . . 57 LYS HD3 . 11429 1 567 . 1 1 57 57 LYS HE2 H 1 3.03 . . 2 . . . . 57 LYS HE2 . 11429 1 568 . 1 1 57 57 LYS HE3 H 1 3.03 . . 2 . . . . 57 LYS HE3 . 11429 1 569 . 1 1 57 57 LYS HG2 H 1 0.88 . . . . . . . 57 LYS HG2 . 11429 1 570 . 1 1 57 57 LYS HG3 H 1 0.98 . . . . . . . 57 LYS HG3 . 11429 1 571 . 1 1 57 57 LYS C C 13 179.40 . . 1 . . . . 57 LYS C . 11429 1 572 . 1 1 57 57 LYS CA C 13 59.76 . . 1 . . . . 57 LYS CA . 11429 1 573 . 1 1 57 57 LYS CB C 13 33.24 . . 1 . . . . 57 LYS CB . 11429 1 574 . 1 1 57 57 LYS NZ N 15 117.37 . . 1 . . . . 57 LYS NZ . 11429 1 575 . 1 1 58 58 SER H H 1 7.85 . . 1 . . . . 58 SER H . 11429 1 576 . 1 1 58 58 SER HA H 1 4.20 . . 1 . . . . 58 SER HA . 11429 1 577 . 1 1 58 58 SER HB2 H 1 4.01 . . . . . . . 58 SER HB2 . 11429 1 578 . 1 1 58 58 SER HB3 H 1 4.07 . . . . . . . 58 SER HB3 . 11429 1 579 . 1 1 58 58 SER C C 13 175.91 . . 1 . . . . 58 SER C . 11429 1 580 . 1 1 58 58 SER CA C 13 62.23 . . 1 . . . . 58 SER CA . 11429 1 581 . 1 1 58 58 SER N N 15 115.32 . . 1 . . . . 58 SER N . 11429 1 582 . 1 1 59 59 LYS H H 1 7.71 . . 1 . . . . 59 LYS H . 11429 1 583 . 1 1 59 59 LYS HA H 1 4.07 . . 1 . . . . 59 LYS HA . 11429 1 584 . 1 1 59 59 LYS HB2 H 1 1.39 . . . . . . . 59 LYS HB2 . 11429 1 585 . 1 1 59 59 LYS HB3 H 1 1.67 . . . . . . . 59 LYS HB3 . 11429 1 586 . 1 1 59 59 LYS HD2 H 1 1.52 . . 2 . . . . 59 LYS HD2 . 11429 1 587 . 1 1 59 59 LYS HD3 H 1 1.52 . . 2 . . . . 59 LYS HD3 . 11429 1 588 . 1 1 59 59 LYS HE2 H 1 2.82 . . 2 . . . . 59 LYS HE2 . 11429 1 589 . 1 1 59 59 LYS HE3 H 1 2.82 . . 2 . . . . 59 LYS HE3 . 11429 1 590 . 1 1 59 59 LYS HG2 H 1 0.90 . . 2 . . . . 59 LYS HG2 . 11429 1 591 . 1 1 59 59 LYS HG3 H 1 0.90 . . 2 . . . . 59 LYS HG3 . 11429 1 592 . 1 1 59 59 LYS C C 13 178.40 . . 1 . . . . 59 LYS C . 11429 1 593 . 1 1 59 59 LYS CA C 13 59.00 . . 1 . . . . 59 LYS CA . 11429 1 594 . 1 1 59 59 LYS CB C 13 31.74 . . 1 . . . . 59 LYS CB . 11429 1 595 . 1 1 59 59 LYS N N 15 120.67 . . 1 . . . . 59 LYS N . 11429 1 596 . 1 1 60 60 PHE H H 1 7.40 . . 1 . . . . 60 PHE H . 11429 1 597 . 1 1 60 60 PHE HA H 1 4.46 . . 1 . . . . 60 PHE HA . 11429 1 598 . 1 1 60 60 PHE HB2 H 1 3.37 . . . . . . . 60 PHE HB2 . 11429 1 599 . 1 1 60 60 PHE HD1 H 1 7.62 . . 3 . . . . 60 PHE HD1 . 11429 1 600 . 1 1 60 60 PHE HD2 H 1 7.62 . . 3 . . . . 60 PHE HD2 . 11429 1 601 . 1 1 60 60 PHE HE1 H 1 7.70 . . 3 . . . . 60 PHE HE1 . 11429 1 602 . 1 1 60 60 PHE HE2 H 1 7.70 . . 3 . . . . 60 PHE HE2 . 11429 1 603 . 1 1 60 60 PHE HZ H 1 7.82 . . 1 . . . . 60 PHE HZ . 11429 1 604 . 1 1 60 60 PHE C C 13 177.88 . . 1 . . . . 60 PHE C . 11429 1 605 . 1 1 60 60 PHE CA C 13 60.87 . . 1 . . . . 60 PHE CA . 11429 1 606 . 1 1 60 60 PHE CB C 13 39.04 . . 1 . . . . 60 PHE CB . 11429 1 607 . 1 1 60 60 PHE N N 15 119.39 . . 1 . . . . 60 PHE N . 11429 1 608 . 1 1 61 61 GLU H H 1 8.12 . . 1 . . . . 61 GLU H . 11429 1 609 . 1 1 61 61 GLU HA H 1 4.19 . . 1 . . . . 61 GLU HA . 11429 1 610 . 1 1 61 61 GLU HB2 H 1 2.22 . . . . . . . 61 GLU HB2 . 11429 1 611 . 1 1 61 61 GLU HB3 H 1 2.29 . . . . . . . 61 GLU HB3 . 11429 1 612 . 1 1 61 61 GLU HG2 H 1 2.51 . . 2 . . . . 61 GLU HG2 . 11429 1 613 . 1 1 61 61 GLU HG3 H 1 2.51 . . 2 . . . . 61 GLU HG3 . 11429 1 614 . 1 1 61 61 GLU C C 13 179.50 . . 1 . . . . 61 GLU C . 11429 1 615 . 1 1 61 61 GLU CA C 13 59.00 . . 1 . . . . 61 GLU CA . 11429 1 616 . 1 1 61 61 GLU CB C 13 29.07 . . 1 . . . . 61 GLU CB . 11429 1 617 . 1 1 61 61 GLU N N 15 121.49 . . 1 . . . . 61 GLU N . 11429 1 618 . 1 1 62 62 ASP H H 1 8.43 . . 1 . . . . 62 ASP H . 11429 1 619 . 1 1 62 62 ASP HA H 1 4.42 . . 1 . . . . 62 ASP HA . 11429 1 620 . 1 1 62 62 ASP HB2 H 1 2.64 . . . . . . . 62 ASP HB2 . 11429 1 621 . 1 1 62 62 ASP HB3 H 1 2.74 . . . . . . . 62 ASP HB3 . 11429 1 622 . 1 1 62 62 ASP C C 13 179.05 . . 1 . . . . 62 ASP C . 11429 1 623 . 1 1 62 62 ASP CA C 13 57.21 . . 1 . . . . 62 ASP CA . 11429 1 624 . 1 1 62 62 ASP CB C 13 39.94 . . 1 . . . . 62 ASP CB . 11429 1 625 . 1 1 62 62 ASP N N 15 120.41 . . 1 . . . . 62 ASP N . 11429 1 626 . 1 1 63 63 MET H H 1 7.48 . . 1 . . . . 63 MET H . 11429 1 627 . 1 1 63 63 MET HA H 1 3.83 . . 1 . . . . 63 MET HA . 11429 1 628 . 1 1 63 63 MET HB2 H 1 1.77 . . . . . . . 63 MET HB2 . 11429 1 629 . 1 1 63 63 MET HG2 H 1 2.31 . . . . . . . 63 MET HG2 . 11429 1 630 . 1 1 63 63 MET HG3 H 1 2.70 . . . . . . . 63 MET HG3 . 11429 1 631 . 1 1 63 63 MET C C 13 177.94 . . 1 . . . . 63 MET C . 11429 1 632 . 1 1 63 63 MET CA C 13 58.98 . . 1 . . . . 63 MET CA . 11429 1 633 . 1 1 63 63 MET CB C 13 32.22 . . 1 . . . . 63 MET CB . 11429 1 634 . 1 1 63 63 MET N N 15 120.01 . . 1 . . . . 63 MET N . 11429 1 635 . 1 1 64 64 ALA H H 1 7.79 . . 1 . . . . 64 ALA H . 11429 1 636 . 1 1 64 64 ALA HA H 1 4.15 . . 1 . . . . 64 ALA HA . 11429 1 637 . 1 1 64 64 ALA HB1 H 1 1.62 . . 1 . . . . 64 ALA MB . 11429 1 638 . 1 1 64 64 ALA HB2 H 1 1.62 . . 1 . . . . 64 ALA MB . 11429 1 639 . 1 1 64 64 ALA HB3 H 1 1.62 . . 1 . . . . 64 ALA MB . 11429 1 640 . 1 1 64 64 ALA C C 13 179.60 . . 1 . . . . 64 ALA C . 11429 1 641 . 1 1 64 64 ALA CA C 13 54.71 . . 1 . . . . 64 ALA CA . 11429 1 642 . 1 1 64 64 ALA CB C 13 18.36 . . 1 . . . . 64 ALA CB . 11429 1 643 . 1 1 64 64 ALA N N 15 122.01 . . 1 . . . . 64 ALA N . 11429 1 644 . 1 1 65 65 LYS H H 1 8.15 . . 1 . . . . 65 LYS H . 11429 1 645 . 1 1 65 65 LYS HA H 1 4.16 . . 1 . . . . 65 LYS HA . 11429 1 646 . 1 1 65 65 LYS HB2 H 1 1.89 . . . . . . . 65 LYS HB2 . 11429 1 647 . 1 1 65 65 LYS HB3 H 1 1.97 . . . . . . . 65 LYS HB3 . 11429 1 648 . 1 1 65 65 LYS HD2 H 1 1.62 . . . . . . . 65 LYS HD2 . 11429 1 649 . 1 1 65 65 LYS HD3 H 1 1.74 . . . . . . . 65 LYS HD3 . 11429 1 650 . 1 1 65 65 LYS HE2 H 1 3.08 . . 2 . . . . 65 LYS HE2 . 11429 1 651 . 1 1 65 65 LYS HE3 H 1 3.08 . . 2 . . . . 65 LYS HE3 . 11429 1 652 . 1 1 65 65 LYS HG2 H 1 0.89 . . . . . . . 65 LYS HG2 . 11429 1 653 . 1 1 65 65 LYS HG3 H 1 0.92 . . . . . . . 65 LYS HG3 . 11429 1 654 . 1 1 65 65 LYS C C 13 178.81 . . 1 . . . . 65 LYS C . 11429 1 655 . 1 1 65 65 LYS CA C 13 58.83 . . 1 . . . . 65 LYS CA . 11429 1 656 . 1 1 65 65 LYS CB C 13 32.63 . . 1 . . . . 65 LYS CB . 11429 1 657 . 1 1 65 65 LYS N N 15 119.93 . . 1 . . . . 65 LYS N . 11429 1 658 . 1 1 66 66 SER H H 1 8.01 . . 1 . . . . 66 SER H . 11429 1 659 . 1 1 66 66 SER HA H 1 4.37 . . 1 . . . . 66 SER HA . 11429 1 660 . 1 1 66 66 SER HB2 H 1 3.96 . . . . . . . 66 SER HB2 . 11429 1 661 . 1 1 66 66 SER HB3 H 1 3.99 . . . . . . . 66 SER HB3 . 11429 1 662 . 1 1 66 66 SER C C 13 175.98 . . 1 . . . . 66 SER C . 11429 1 663 . 1 1 66 66 SER CA C 13 60.36 . . 1 . . . . 66 SER CA . 11429 1 664 . 1 1 66 66 SER CB C 13 63.23 . . 1 . . . . 66 SER CB . 11429 1 665 . 1 1 66 66 SER N N 15 115.76 . . 1 . . . . 66 SER N . 11429 1 666 . 1 1 67 67 ASP H H 1 8.23 . . 1 . . . . 67 ASP H . 11429 1 667 . 1 1 67 67 ASP HA H 1 4.70 . . 1 . . . . 67 ASP HA . 11429 1 668 . 1 1 67 67 ASP HB2 H 1 2.91 . . . . . . . 67 ASP HB2 . 11429 1 669 . 1 1 67 67 ASP C C 13 177.19 . . 1 . . . . 67 ASP C . 11429 1 670 . 1 1 67 67 ASP CA C 13 56.28 . . 1 . . . . 67 ASP CA . 11429 1 671 . 1 1 67 67 ASP CB C 13 42.11 . . 1 . . . . 67 ASP CB . 11429 1 672 . 1 1 67 67 ASP N N 15 122.97 . . 1 . . . . 67 ASP N . 11429 1 673 . 1 1 68 68 LYS H H 1 8.15 . . 1 . . . . 68 LYS H . 11429 1 674 . 1 1 68 68 LYS HA H 1 4.15 . . 1 . . . . 68 LYS HA . 11429 1 675 . 1 1 68 68 LYS HB2 H 1 1.90 . . . . . . . 68 LYS HB2 . 11429 1 676 . 1 1 68 68 LYS HB3 H 1 1.98 . . . . . . . 68 LYS HB3 . 11429 1 677 . 1 1 68 68 LYS HD2 H 1 1.74 . . 2 . . . . 68 LYS HD2 . 11429 1 678 . 1 1 68 68 LYS HD3 H 1 1.74 . . 2 . . . . 68 LYS HD3 . 11429 1 679 . 1 1 68 68 LYS HE2 H 1 3.03 . . 2 . . . . 68 LYS HE2 . 11429 1 680 . 1 1 68 68 LYS HE3 H 1 3.03 . . 2 . . . . 68 LYS HE3 . 11429 1 681 . 1 1 68 68 LYS HG2 H 1 1.51 . . 2 . . . . 68 LYS HG2 . 11429 1 682 . 1 1 68 68 LYS HG3 H 1 1.51 . . 2 . . . . 68 LYS HG3 . 11429 1 683 . 1 1 68 68 LYS C C 13 177.30 . . 1 . . . . 68 LYS C . 11429 1 684 . 1 1 68 68 LYS CA C 13 58.40 . . 1 . . . . 68 LYS CA . 11429 1 685 . 1 1 68 68 LYS CB C 13 32.64 . . 1 . . . . 68 LYS CB . 11429 1 686 . 1 1 68 68 LYS N N 15 120.51 . . 1 . . . . 68 LYS N . 11429 1 687 . 1 1 69 69 ALA H H 1 7.88 . . 1 . . . . 69 ALA H . 11429 1 688 . 1 1 69 69 ALA HA H 1 4.27 . . 1 . . . . 69 ALA HA . 11429 1 689 . 1 1 69 69 ALA HB1 H 1 1.48 . . 1 . . . . 69 ALA MB . 11429 1 690 . 1 1 69 69 ALA HB2 H 1 1.48 . . 1 . . . . 69 ALA MB . 11429 1 691 . 1 1 69 69 ALA HB3 H 1 1.48 . . 1 . . . . 69 ALA MB . 11429 1 692 . 1 1 69 69 ALA C C 13 179.22 . . 1 . . . . 69 ALA C . 11429 1 693 . 1 1 69 69 ALA CA C 13 54.07 . . 1 . . . . 69 ALA CA . 11429 1 694 . 1 1 69 69 ALA CB C 13 18.23 . . 1 . . . . 69 ALA CB . 11429 1 695 . 1 1 69 69 ALA N N 15 122.39 . . 1 . . . . 69 ALA N . 11429 1 696 . 1 1 70 70 ARG H H 1 7.89 . . 1 . . . . 70 ARG H . 11429 1 697 . 1 1 70 70 ARG HA H 1 4.11 . . 1 . . . . 70 ARG HA . 11429 1 698 . 1 1 70 70 ARG HB2 H 1 1.87 . . . . . . . 70 ARG HB2 . 11429 1 699 . 1 1 70 70 ARG HB3 H 1 2.02 . . . . . . . 70 ARG HB3 . 11429 1 700 . 1 1 70 70 ARG HD2 H 1 3.08 . . 2 . . . . 70 ARG HD2 . 11429 1 701 . 1 1 70 70 ARG HD3 H 1 3.08 . . 2 . . . . 70 ARG HD3 . 11429 1 702 . 1 1 70 70 ARG HG2 H 1 1.57 . . . . . . . 70 ARG HG2 . 11429 1 703 . 1 1 70 70 ARG HG3 H 1 1.70 . . . . . . . 70 ARG HG3 . 11429 1 704 . 1 1 70 70 ARG C C 13 177.29 . . 1 . . . . 70 ARG C . 11429 1 705 . 1 1 70 70 ARG CA C 13 58.01 . . 1 . . . . 70 ARG CA . 11429 1 706 . 1 1 70 70 ARG CB C 13 29.65 . . 1 . . . . 70 ARG CB . 11429 1 707 . 1 1 70 70 ARG N N 15 119.39 . . 1 . . . . 70 ARG N . 11429 1 708 . 1 1 71 71 TYR H H 1 8.23 . . 1 . . . . 71 TYR H . 11429 1 709 . 1 1 71 71 TYR HA H 1 4.52 . . 1 . . . . 71 TYR HA . 11429 1 710 . 1 1 71 71 TYR HB2 H 1 2.97 . . . . . . . 71 TYR HB2 . 11429 1 711 . 1 1 71 71 TYR HB3 H 1 3.13 . . . . . . . 71 TYR HB3 . 11429 1 712 . 1 1 71 71 TYR HD1 H 1 7.22 . . 3 . . . . 71 TYR HD1 . 11429 1 713 . 1 1 71 71 TYR HD2 H 1 7.22 . . 3 . . . . 71 TYR HD2 . 11429 1 714 . 1 1 71 71 TYR HE1 H 1 6.83 . . 3 . . . . 71 TYR HE1 . 11429 1 715 . 1 1 71 71 TYR HE2 H 1 6.83 . . 3 . . . . 71 TYR HE2 . 11429 1 716 . 1 1 71 71 TYR C C 13 176.38 . . 1 . . . . 71 TYR C . 11429 1 717 . 1 1 71 71 TYR CA C 13 60.04 . . 1 . . . . 71 TYR CA . 11429 1 718 . 1 1 71 71 TYR CB C 13 38.86 . . 1 . . . . 71 TYR CB . 11429 1 719 . 1 1 71 71 TYR N N 15 121.06 . . 1 . . . . 71 TYR N . 11429 1 720 . 1 1 72 72 ASP H H 1 8.51 . . 1 . . . . 72 ASP H . 11429 1 721 . 1 1 72 72 ASP HA H 1 4.44 . . 1 . . . . 72 ASP HA . 11429 1 722 . 1 1 72 72 ASP HB2 H 1 2.70 . . . . . . . 72 ASP HB2 . 11429 1 723 . 1 1 72 72 ASP C C 13 177.53 . . 1 . . . . 72 ASP C . 11429 1 724 . 1 1 72 72 ASP CA C 13 55.73 . . 1 . . . . 72 ASP CA . 11429 1 725 . 1 1 72 72 ASP CB C 13 40.48 . . 1 . . . . 72 ASP CB . 11429 1 726 . 1 1 72 72 ASP N N 15 120.12 . . 1 . . . . 72 ASP N . 11429 1 727 . 1 1 73 73 ARG H H 1 7.97 . . 1 . . . . 73 ARG H . 11429 1 728 . 1 1 73 73 ARG HA H 1 4.22 . . 1 . . . . 73 ARG HA . 11429 1 729 . 1 1 73 73 ARG HB2 H 1 1.91 . . . . . . . 73 ARG HB2 . 11429 1 730 . 1 1 73 73 ARG HD2 H 1 3.22 . . 2 . . . . 73 ARG HD2 . 11429 1 731 . 1 1 73 73 ARG HD3 H 1 3.22 . . 2 . . . . 73 ARG HD3 . 11429 1 732 . 1 1 73 73 ARG HG2 H 1 1.67 . . . . . . . 73 ARG HG2 . 11429 1 733 . 1 1 73 73 ARG HG3 H 1 1.73 . . . . . . . 73 ARG HG3 . 11429 1 734 . 1 1 73 73 ARG C C 13 177.50 . . 1 . . . . 73 ARG C . 11429 1 735 . 1 1 73 73 ARG CA C 13 57.58 . . 1 . . . . 73 ARG CA . 11429 1 736 . 1 1 73 73 ARG CB C 13 30.56 . . 1 . . . . 73 ARG CB . 11429 1 737 . 1 1 73 73 ARG N N 15 119.94 . . 1 . . . . 73 ARG N . 11429 1 738 . 1 1 74 74 GLU H H 1 8.23 . . 1 . . . . 74 GLU H . 11429 1 739 . 1 1 74 74 GLU HA H 1 4.19 . . 1 . . . . 74 GLU HA . 11429 1 740 . 1 1 74 74 GLU HB2 H 1 1.99 . . . . . . . 74 GLU HB2 . 11429 1 741 . 1 1 74 74 GLU HG2 H 1 2.24 . . . . . . . 74 GLU HG2 . 11429 1 742 . 1 1 74 74 GLU HG3 H 1 2.43 . . . . . . . 74 GLU HG3 . 11429 1 743 . 1 1 74 74 GLU C C 13 177.20 . . 1 . . . . 74 GLU C . 11429 1 744 . 1 1 74 74 GLU CA C 13 57.46 . . 1 . . . . 74 GLU CA . 11429 1 745 . 1 1 74 74 GLU CB C 13 29.94 . . 1 . . . . 74 GLU CB . 11429 1 746 . 1 1 74 74 GLU N N 15 120.10 . . 1 . . . . 74 GLU N . 11429 1 747 . 1 1 75 75 MET H H 1 8.10 . . 1 . . . . 75 MET H . 11429 1 748 . 1 1 75 75 MET HA H 1 4.41 . . 1 . . . . 75 MET HA . 11429 1 749 . 1 1 75 75 MET HB2 H 1 1.95 . . . . . . . 75 MET HB2 . 11429 1 750 . 1 1 75 75 MET HB3 H 1 2.20 . . . . . . . 75 MET HB3 . 11429 1 751 . 1 1 75 75 MET HG2 H 1 2.32 . . . . . . . 75 MET HG2 . 11429 1 752 . 1 1 75 75 MET HG3 H 1 2.42 . . . . . . . 75 MET HG3 . 11429 1 753 . 1 1 75 75 MET C C 13 176.22 . . 1 . . . . 75 MET C . 11429 1 754 . 1 1 75 75 MET CA C 13 55.34 . . 1 . . . . 75 MET CA . 11429 1 755 . 1 1 75 75 MET CB C 13 32.36 . . 1 . . . . 75 MET CB . 11429 1 756 . 1 1 75 75 MET N N 15 119.67 . . 1 . . . . 75 MET N . 11429 1 757 . 1 1 76 76 LYS H H 1 7.89 . . 1 . . . . 76 LYS H . 11429 1 758 . 1 1 76 76 LYS HA H 1 4.31 . . 1 . . . . 76 LYS HA . 11429 1 759 . 1 1 76 76 LYS HB2 H 1 1.78 . . . . . . . 76 LYS HB2 . 11429 1 760 . 1 1 76 76 LYS HB3 H 1 1.89 . . . . . . . 76 LYS HB3 . 11429 1 761 . 1 1 76 76 LYS HD2 H 1 1.70 . . 2 . . . . 76 LYS HD2 . 11429 1 762 . 1 1 76 76 LYS HD3 H 1 1.70 . . 2 . . . . 76 LYS HD3 . 11429 1 763 . 1 1 76 76 LYS HE2 H 1 3.01 . . 2 . . . . 76 LYS HE2 . 11429 1 764 . 1 1 76 76 LYS HE3 H 1 3.01 . . 2 . . . . 76 LYS HE3 . 11429 1 765 . 1 1 76 76 LYS HG2 H 1 1.44 . . . . . . . 76 LYS HG2 . 11429 1 766 . 1 1 76 76 LYS HG3 H 1 1.49 . . . . . . . 76 LYS HG3 . 11429 1 767 . 1 1 76 76 LYS C C 13 175.48 . . 1 . . . . 76 LYS C . 11429 1 768 . 1 1 76 76 LYS CA C 13 56.36 . . 1 . . . . 76 LYS CA . 11429 1 769 . 1 1 76 76 LYS CB C 13 32.85 . . 1 . . . . 76 LYS CB . 11429 1 770 . 1 1 76 76 LYS N N 15 121.91 . . 1 . . . . 76 LYS N . 11429 1 771 . 1 1 77 77 ASN H H 1 7.98 . . 1 . . . . 77 ASN H . 11429 1 772 . 1 1 77 77 ASN HA H 1 4.46 . . 1 . . . . 77 ASN HA . 11429 1 773 . 1 1 77 77 ASN HB2 H 1 2.65 . . . . . . . 77 ASN HB2 . 11429 1 774 . 1 1 77 77 ASN HB3 H 1 2.77 . . . . . . . 77 ASN HB3 . 11429 1 775 . 1 1 77 77 ASN HD21 H 1 6.81 . . . . . . . 77 ASN HD21 . 11429 1 776 . 1 1 77 77 ASN HD22 H 1 7.54 . . . . . . . 77 ASN HD22 . 11429 1 777 . 1 1 77 77 ASN CA C 13 54.80 . . 1 . . . . 77 ASN CA . 11429 1 778 . 1 1 77 77 ASN CB C 13 40.40 . . 1 . . . . 77 ASN CB . 11429 1 779 . 1 1 77 77 ASN N N 15 125.21 . . 1 . . . . 77 ASN N . 11429 1 780 . 1 1 77 77 ASN ND2 N 15 112.72 . . 1 . . . . 77 ASN ND2 . 11429 1 stop_ save_