data_27055 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27055 _Entry.Title ; NMR structure of the RNA recognition motif 2 (RRM2) of the splicing factor RBM10 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-03-23 _Entry.Accession_date 2017-03-23 _Entry.Last_release_date 2017-03-23 _Entry.Original_release_date 2017-03-23 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Haina Qin . . . . 27055 2 Pedro Serrano . . . . 27055 3 Kurt Wuthrich . . . . 27055 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'The Scripps Research Institute' . 27055 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27055 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 291 27055 '15N chemical shifts' 91 27055 '1H chemical shifts' 606 27055 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 . . 2018-07-20 2017-03-23 update BMRB 'update entry citation' 27055 1 . . 2017-04-25 2017-03-23 original author 'original release' 27055 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27055 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29450990 _Citation.Full_citation . _Citation.Title ; Splicing Site Recognition by Synergy of Three Domains in Splicing Factor RBM10 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 57 _Citation.Journal_issue 10 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-4995 _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 1563 _Citation.Page_last 1567 _Citation.Year 2018 _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 Pedro Serrano P. . . . 27055 1 2 John Hammond J. A. . . 27055 1 3 Michael Geralt M. . . . 27055 1 4 Kurt Wuthrich K. . . . 27055 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27055 _Assembly.ID 1 _Assembly.Name RBM10_RRM2 _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 RBM10RRM2 1 $RBM_10RRM2 A . yes native no no . . . 27055 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RBM_10RRM2 _Entity.Sf_category entity _Entity.Sf_framecode RBM_10RRM2 _Entity.Entry_ID 27055 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RBM_10RRM2 _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 ; GHMDTIILRNLNPHSTMDSI LGALAPYAVLSSSNVRVIKD KQTQLNRGFAFIQLSTIVEA AQLLQILQALHPPLTIDGKT INVEFAKGS ; _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 89 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _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 . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 27055 1 2 . HIS . 27055 1 3 . MET . 27055 1 4 . ASP . 27055 1 5 . THR . 27055 1 6 . ILE . 27055 1 7 . ILE . 27055 1 8 . LEU . 27055 1 9 . ARG . 27055 1 10 . ASN . 27055 1 11 . LEU . 27055 1 12 . ASN . 27055 1 13 . PRO . 27055 1 14 . HIS . 27055 1 15 . SER . 27055 1 16 . THR . 27055 1 17 . MET . 27055 1 18 . ASP . 27055 1 19 . SER . 27055 1 20 . ILE . 27055 1 21 . LEU . 27055 1 22 . GLY . 27055 1 23 . ALA . 27055 1 24 . LEU . 27055 1 25 . ALA . 27055 1 26 . PRO . 27055 1 27 . TYR . 27055 1 28 . ALA . 27055 1 29 . VAL . 27055 1 30 . LEU . 27055 1 31 . SER . 27055 1 32 . SER . 27055 1 33 . SER . 27055 1 34 . ASN . 27055 1 35 . VAL . 27055 1 36 . ARG . 27055 1 37 . VAL . 27055 1 38 . ILE . 27055 1 39 . LYS . 27055 1 40 . ASP . 27055 1 41 . LYS . 27055 1 42 . GLN . 27055 1 43 . THR . 27055 1 44 . GLN . 27055 1 45 . LEU . 27055 1 46 . ASN . 27055 1 47 . ARG . 27055 1 48 . GLY . 27055 1 49 . PHE . 27055 1 50 . ALA . 27055 1 51 . PHE . 27055 1 52 . ILE . 27055 1 53 . GLN . 27055 1 54 . LEU . 27055 1 55 . SER . 27055 1 56 . THR . 27055 1 57 . ILE . 27055 1 58 . VAL . 27055 1 59 . GLU . 27055 1 60 . ALA . 27055 1 61 . ALA . 27055 1 62 . GLN . 27055 1 63 . LEU . 27055 1 64 . LEU . 27055 1 65 . GLN . 27055 1 66 . ILE . 27055 1 67 . LEU . 27055 1 68 . GLN . 27055 1 69 . ALA . 27055 1 70 . LEU . 27055 1 71 . HIS . 27055 1 72 . PRO . 27055 1 73 . PRO . 27055 1 74 . LEU . 27055 1 75 . THR . 27055 1 76 . ILE . 27055 1 77 . ASP . 27055 1 78 . GLY . 27055 1 79 . LYS . 27055 1 80 . THR . 27055 1 81 . ILE . 27055 1 82 . ASN . 27055 1 83 . VAL . 27055 1 84 . GLU . 27055 1 85 . PHE . 27055 1 86 . ALA . 27055 1 87 . LYS . 27055 1 88 . GLY . 27055 1 89 . SER . 27055 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 27055 1 . HIS 2 2 27055 1 . MET 3 3 27055 1 . ASP 4 4 27055 1 . THR 5 5 27055 1 . ILE 6 6 27055 1 . ILE 7 7 27055 1 . LEU 8 8 27055 1 . ARG 9 9 27055 1 . ASN 10 10 27055 1 . LEU 11 11 27055 1 . ASN 12 12 27055 1 . PRO 13 13 27055 1 . HIS 14 14 27055 1 . SER 15 15 27055 1 . THR 16 16 27055 1 . MET 17 17 27055 1 . ASP 18 18 27055 1 . SER 19 19 27055 1 . ILE 20 20 27055 1 . LEU 21 21 27055 1 . GLY 22 22 27055 1 . ALA 23 23 27055 1 . LEU 24 24 27055 1 . ALA 25 25 27055 1 . PRO 26 26 27055 1 . TYR 27 27 27055 1 . ALA 28 28 27055 1 . VAL 29 29 27055 1 . LEU 30 30 27055 1 . SER 31 31 27055 1 . SER 32 32 27055 1 . SER 33 33 27055 1 . ASN 34 34 27055 1 . VAL 35 35 27055 1 . ARG 36 36 27055 1 . VAL 37 37 27055 1 . ILE 38 38 27055 1 . LYS 39 39 27055 1 . ASP 40 40 27055 1 . LYS 41 41 27055 1 . GLN 42 42 27055 1 . THR 43 43 27055 1 . GLN 44 44 27055 1 . LEU 45 45 27055 1 . ASN 46 46 27055 1 . ARG 47 47 27055 1 . GLY 48 48 27055 1 . PHE 49 49 27055 1 . ALA 50 50 27055 1 . PHE 51 51 27055 1 . ILE 52 52 27055 1 . GLN 53 53 27055 1 . LEU 54 54 27055 1 . SER 55 55 27055 1 . THR 56 56 27055 1 . ILE 57 57 27055 1 . VAL 58 58 27055 1 . GLU 59 59 27055 1 . ALA 60 60 27055 1 . ALA 61 61 27055 1 . GLN 62 62 27055 1 . LEU 63 63 27055 1 . LEU 64 64 27055 1 . GLN 65 65 27055 1 . ILE 66 66 27055 1 . LEU 67 67 27055 1 . GLN 68 68 27055 1 . ALA 69 69 27055 1 . LEU 70 70 27055 1 . HIS 71 71 27055 1 . PRO 72 72 27055 1 . PRO 73 73 27055 1 . LEU 74 74 27055 1 . THR 75 75 27055 1 . ILE 76 76 27055 1 . ASP 77 77 27055 1 . GLY 78 78 27055 1 . LYS 79 79 27055 1 . THR 80 80 27055 1 . ILE 81 81 27055 1 . ASN 82 82 27055 1 . VAL 83 83 27055 1 . GLU 84 84 27055 1 . PHE 85 85 27055 1 . ALA 86 86 27055 1 . LYS 87 87 27055 1 . GLY 88 88 27055 1 . SER 89 89 27055 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 27055 _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 $RBM_10RRM2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27055 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 27055 _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 $RBM_10RRM2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21DE3 . . . . . pET28b . . . 27055 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27055 _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 'RBM 10RRM2' '[U-100% 13C]' . . 1 $RBM_10RRM2 . . 1.1 . . mM . . . . 27055 1 2 'sodium azide' 'natural abundance' . . . . . . 5 . . uM . . . . 27055 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 27055 1 4 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27055 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 27055 _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' 0.220 . M 27055 1 pH 6.5 . pH 27055 1 pressure 1 . atm 27055 1 temperature 298 . K 27055 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 27055 _Software.ID 1 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Braun and Wuthrich' . . 27055 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 27055 1 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27055 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27055 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 27055 2 'data analysis' 27055 2 processing 27055 2 stop_ save_ save_UNIO _Software.Sf_category software _Software.Sf_framecode UNIO _Software.Entry_ID 27055 _Software.ID 3 _Software.Type . _Software.Name UNIO _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Herrmann . . 27055 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27055 3 'structure solution' 27055 3 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 27055 _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_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 27055 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 27055 _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 . . . 27055 1 2 spectrometer_2 Bruker Avance . 800 . . . 27055 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 27055 _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 . . . . . . . . . . . . . . . . 27055 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 27055 1 3 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 27055 1 4 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 27055 1 5 'APSY 4D ZANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27055 1 6 'APSY 4D ZAONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27055 1 7 'APSY 4D BAONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27055 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 27055 _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 0.00 na indirect 0.251449530 . . . . . 27055 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27055 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27055 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 27055 _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' . . . 27055 1 2 '3D 1H-15N NOESY' . . . 27055 1 3 '3D 1H-13C NOESY aliphatic' . . . 27055 1 4 '2D 1H-13C HSQC aromatic' . . . 27055 1 5 'APSY 4D ZANH' . . . 27055 1 6 'APSY 4D ZAONH' . . . 27055 1 7 'APSY 4D BAONH' . . . 27055 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 HIS HA H 1 4.450 0.000 . . . . . . . 2 HIS HA . 27055 1 2 . 1 1 2 2 HIS HB2 H 1 2.874 0.000 . . . . . . . 2 HIS HB2 . 27055 1 3 . 1 1 2 2 HIS HB3 H 1 2.952 0.000 . . . . . . . 2 HIS HB3 . 27055 1 4 . 1 1 2 2 HIS HD2 H 1 7.023 0.000 . . . . . . . 2 HIS HD2 . 27055 1 5 . 1 1 2 2 HIS CA C 13 52.913 0.000 . . . . . . . 2 HIS CA . 27055 1 6 . 1 1 2 2 HIS CB C 13 27.919 0.000 . . . . . . . 2 HIS CB . 27055 1 7 . 1 1 2 2 HIS CD2 C 13 122.248 0.000 . . . . . . . 2 HIS CD2 . 27055 1 8 . 1 1 4 4 ASP H H 1 7.851 0.000 . . . . . . . 4 ASP H . 27055 1 9 . 1 1 4 4 ASP HA H 1 4.349 0.000 . . . . . . . 4 ASP HA . 27055 1 10 . 1 1 4 4 ASP HB2 H 1 2.078 0.000 . . . . . . . 4 ASP HB2 . 27055 1 11 . 1 1 4 4 ASP HB3 H 1 3.132 0.000 . . . . . . . 4 ASP HB3 . 27055 1 12 . 1 1 4 4 ASP CA C 13 50.583 0.000 . . . . . . . 4 ASP CA . 27055 1 13 . 1 1 4 4 ASP CB C 13 38.262 0.000 . . . . . . . 4 ASP CB . 27055 1 14 . 1 1 4 4 ASP N N 15 117.706 0.000 . . . . . . . 4 ASP N . 27055 1 15 . 1 1 5 5 THR H H 1 7.720 0.000 . . . . . . . 5 THR H . 27055 1 16 . 1 1 5 5 THR HA H 1 5.471 0.000 . . . . . . . 5 THR HA . 27055 1 17 . 1 1 5 5 THR HB H 1 4.005 0.000 . . . . . . . 5 THR HB . 27055 1 18 . 1 1 5 5 THR HG21 H 1 1.079 0.000 . . . . . . . 5 THR QG2 . 27055 1 19 . 1 1 5 5 THR HG22 H 1 1.079 0.000 . . . . . . . 5 THR QG2 . 27055 1 20 . 1 1 5 5 THR HG23 H 1 1.079 0.000 . . . . . . . 5 THR QG2 . 27055 1 21 . 1 1 5 5 THR CA C 13 59.007 0.000 . . . . . . . 5 THR CA . 27055 1 22 . 1 1 5 5 THR CB C 13 69.334 0.000 . . . . . . . 5 THR CB . 27055 1 23 . 1 1 5 5 THR CG2 C 13 18.836 0.000 . . . . . . . 5 THR CG2 . 27055 1 24 . 1 1 5 5 THR N N 15 115.993 0.000 . . . . . . . 5 THR N . 27055 1 25 . 1 1 6 6 ILE H H 1 9.264 0.000 . . . . . . . 6 ILE H . 27055 1 26 . 1 1 6 6 ILE HA H 1 4.799 0.000 . . . . . . . 6 ILE HA . 27055 1 27 . 1 1 6 6 ILE HB H 1 1.597 0.000 . . . . . . . 6 ILE HB . 27055 1 28 . 1 1 6 6 ILE HG12 H 1 1.334 0.000 . . . . . . . 6 ILE HG12 . 27055 1 29 . 1 1 6 6 ILE HG13 H 1 0.890 0.000 . . . . . . . 6 ILE HG13 . 27055 1 30 . 1 1 6 6 ILE HG21 H 1 0.588 0.000 . . . . . . . 6 ILE QG2 . 27055 1 31 . 1 1 6 6 ILE HG22 H 1 0.588 0.000 . . . . . . . 6 ILE QG2 . 27055 1 32 . 1 1 6 6 ILE HG23 H 1 0.588 0.000 . . . . . . . 6 ILE QG2 . 27055 1 33 . 1 1 6 6 ILE HD11 H 1 0.594 0.000 . . . . . . . 6 ILE QD1 . 27055 1 34 . 1 1 6 6 ILE HD12 H 1 0.594 0.000 . . . . . . . 6 ILE QD1 . 27055 1 35 . 1 1 6 6 ILE HD13 H 1 0.594 0.000 . . . . . . . 6 ILE QD1 . 27055 1 36 . 1 1 6 6 ILE CA C 13 56.809 0.000 . . . . . . . 6 ILE CA . 27055 1 37 . 1 1 6 6 ILE CB C 13 38.886 0.000 . . . . . . . 6 ILE CB . 27055 1 38 . 1 1 6 6 ILE CG1 C 13 24.819 0.000 . . . . . . . 6 ILE CG1 . 27055 1 39 . 1 1 6 6 ILE CG2 C 13 15.300 0.000 . . . . . . . 6 ILE CG2 . 27055 1 40 . 1 1 6 6 ILE CD1 C 13 11.390 0.000 . . . . . . . 6 ILE CD1 . 27055 1 41 . 1 1 6 6 ILE N N 15 126.403 0.000 . . . . . . . 6 ILE N . 27055 1 42 . 1 1 7 7 ILE H H 1 9.398 0.000 . . . . . . . 7 ILE H . 27055 1 43 . 1 1 7 7 ILE HA H 1 5.040 0.000 . . . . . . . 7 ILE HA . 27055 1 44 . 1 1 7 7 ILE HB H 1 1.444 0.000 . . . . . . . 7 ILE HB . 27055 1 45 . 1 1 7 7 ILE HG12 H 1 1.133 0.000 . . . . . . . 7 ILE HG12 . 27055 1 46 . 1 1 7 7 ILE HG13 H 1 0.625 0.000 . . . . . . . 7 ILE HG13 . 27055 1 47 . 1 1 7 7 ILE HG21 H 1 0.634 0.000 . . . . . . . 7 ILE QG2 . 27055 1 48 . 1 1 7 7 ILE HG22 H 1 0.634 0.000 . . . . . . . 7 ILE QG2 . 27055 1 49 . 1 1 7 7 ILE HG23 H 1 0.634 0.000 . . . . . . . 7 ILE QG2 . 27055 1 50 . 1 1 7 7 ILE HD11 H 1 0.495 0.000 . . . . . . . 7 ILE QD1 . 27055 1 51 . 1 1 7 7 ILE HD12 H 1 0.495 0.000 . . . . . . . 7 ILE QD1 . 27055 1 52 . 1 1 7 7 ILE HD13 H 1 0.495 0.000 . . . . . . . 7 ILE QD1 . 27055 1 53 . 1 1 7 7 ILE CA C 13 56.320 0.000 . . . . . . . 7 ILE CA . 27055 1 54 . 1 1 7 7 ILE CB C 13 39.233 0.000 . . . . . . . 7 ILE CB . 27055 1 55 . 1 1 7 7 ILE CG1 C 13 25.758 0.000 . . . . . . . 7 ILE CG1 . 27055 1 56 . 1 1 7 7 ILE CG2 C 13 13.677 0.000 . . . . . . . 7 ILE CG2 . 27055 1 57 . 1 1 7 7 ILE CD1 C 13 11.477 0.000 . . . . . . . 7 ILE CD1 . 27055 1 58 . 1 1 7 7 ILE N N 15 125.477 0.000 . . . . . . . 7 ILE N . 27055 1 59 . 1 1 8 8 LEU H H 1 8.688 0.000 . . . . . . . 8 LEU H . 27055 1 60 . 1 1 8 8 LEU HA H 1 4.797 0.000 . . . . . . . 8 LEU HA . 27055 1 61 . 1 1 8 8 LEU HB2 H 1 1.128 0.000 . . . . . . . 8 LEU HB2 . 27055 1 62 . 1 1 8 8 LEU HB3 H 1 1.518 0.000 . . . . . . . 8 LEU HB3 . 27055 1 63 . 1 1 8 8 LEU HD11 H 1 0.598 0.000 . . . . . . . 8 LEU QD1 . 27055 1 64 . 1 1 8 8 LEU HD12 H 1 0.598 0.000 . . . . . . . 8 LEU QD1 . 27055 1 65 . 1 1 8 8 LEU HD13 H 1 0.598 0.000 . . . . . . . 8 LEU QD1 . 27055 1 66 . 1 1 8 8 LEU HD21 H 1 0.593 0.000 . . . . . . . 8 LEU QD2 . 27055 1 67 . 1 1 8 8 LEU HD22 H 1 0.593 0.000 . . . . . . . 8 LEU QD2 . 27055 1 68 . 1 1 8 8 LEU HD23 H 1 0.593 0.000 . . . . . . . 8 LEU QD2 . 27055 1 69 . 1 1 8 8 LEU CA C 13 50.293 0.000 . . . . . . . 8 LEU CA . 27055 1 70 . 1 1 8 8 LEU CB C 13 40.290 0.000 . . . . . . . 8 LEU CB . 27055 1 71 . 1 1 8 8 LEU CD1 C 13 24.711 0.000 . . . . . . . 8 LEU CD1 . 27055 1 72 . 1 1 8 8 LEU CD2 C 13 23.231 0.000 . . . . . . . 8 LEU CD2 . 27055 1 73 . 1 1 8 8 LEU N N 15 127.093 0.000 . . . . . . . 8 LEU N . 27055 1 74 . 1 1 9 9 ARG H H 1 8.740 0.000 . . . . . . . 9 ARG H . 27055 1 75 . 1 1 9 9 ARG HA H 1 4.965 0.000 . . . . . . . 9 ARG HA . 27055 1 76 . 1 1 9 9 ARG HB2 H 1 1.560 0.000 . . . . . . . 9 ARG HB2 . 27055 1 77 . 1 1 9 9 ARG HB3 H 1 1.743 0.000 . . . . . . . 9 ARG HB3 . 27055 1 78 . 1 1 9 9 ARG HG3 H 1 1.379 0.000 . . . . . . . 9 ARG HG3 . 27055 1 79 . 1 1 9 9 ARG HD2 H 1 2.926 0.000 . . . . . . . 9 ARG HD2 . 27055 1 80 . 1 1 9 9 ARG HD3 H 1 2.952 0.000 . . . . . . . 9 ARG HD3 . 27055 1 81 . 1 1 9 9 ARG CA C 13 52.168 0.000 . . . . . . . 9 ARG CA . 27055 1 82 . 1 1 9 9 ARG CB C 13 31.582 0.000 . . . . . . . 9 ARG CB . 27055 1 83 . 1 1 9 9 ARG CG C 13 26.519 0.000 . . . . . . . 9 ARG CG . 27055 1 84 . 1 1 9 9 ARG CD C 13 40.942 0.000 . . . . . . . 9 ARG CD . 27055 1 85 . 1 1 9 9 ARG N N 15 121.046 0.000 . . . . . . . 9 ARG N . 27055 1 86 . 1 1 10 10 ASN H H 1 8.226 0.000 . . . . . . . 10 ASN H . 27055 1 87 . 1 1 10 10 ASN HA H 1 4.288 0.000 . . . . . . . 10 ASN HA . 27055 1 88 . 1 1 10 10 ASN HB2 H 1 3.515 0.000 . . . . . . . 10 ASN HB2 . 27055 1 89 . 1 1 10 10 ASN HB3 H 1 2.768 0.000 . . . . . . . 10 ASN HB3 . 27055 1 90 . 1 1 10 10 ASN HD21 H 1 6.735 0.000 . . . . . . . 10 ASN HD21 . 27055 1 91 . 1 1 10 10 ASN HD22 H 1 8.015 0.000 . . . . . . . 10 ASN HD22 . 27055 1 92 . 1 1 10 10 ASN CA C 13 51.678 0.000 . . . . . . . 10 ASN CA . 27055 1 93 . 1 1 10 10 ASN CB C 13 35.774 0.000 . . . . . . . 10 ASN CB . 27055 1 94 . 1 1 10 10 ASN N N 15 116.292 0.000 . . . . . . . 10 ASN N . 27055 1 95 . 1 1 10 10 ASN ND2 N 15 114.264 0.000 . . . . . . . 10 ASN ND2 . 27055 1 96 . 1 1 11 11 LEU H H 1 7.623 0.000 . . . . . . . 11 LEU H . 27055 1 97 . 1 1 11 11 LEU HA H 1 3.880 0.000 . . . . . . . 11 LEU HA . 27055 1 98 . 1 1 11 11 LEU HB2 H 1 0.987 0.000 . . . . . . . 11 LEU HB2 . 27055 1 99 . 1 1 11 11 LEU HB3 H 1 1.076 0.000 . . . . . . . 11 LEU HB3 . 27055 1 100 . 1 1 11 11 LEU HG H 1 1.289 0.000 . . . . . . . 11 LEU HG . 27055 1 101 . 1 1 11 11 LEU HD11 H 1 0.540 0.000 . . . . . . . 11 LEU QD1 . 27055 1 102 . 1 1 11 11 LEU HD12 H 1 0.540 0.000 . . . . . . . 11 LEU QD1 . 27055 1 103 . 1 1 11 11 LEU HD13 H 1 0.540 0.000 . . . . . . . 11 LEU QD1 . 27055 1 104 . 1 1 11 11 LEU CA C 13 52.120 0.000 . . . . . . . 11 LEU CA . 27055 1 105 . 1 1 11 11 LEU CB C 13 40.099 0.000 . . . . . . . 11 LEU CB . 27055 1 106 . 1 1 11 11 LEU CG C 13 24.617 0.000 . . . . . . . 11 LEU CG . 27055 1 107 . 1 1 11 11 LEU CD1 C 13 21.394 0.000 . . . . . . . 11 LEU CD1 . 27055 1 108 . 1 1 11 11 LEU CD2 C 13 11.810 0.000 . . . . . . . 11 LEU CD2 . 27055 1 109 . 1 1 11 11 LEU N N 15 115.150 0.000 . . . . . . . 11 LEU N . 27055 1 110 . 1 1 12 12 ASN H H 1 9.777 0.000 . . . . . . . 12 ASN H . 27055 1 111 . 1 1 12 12 ASN HA H 1 4.435 0.000 . . . . . . . 12 ASN HA . 27055 1 112 . 1 1 12 12 ASN HB2 H 1 3.599 0.000 . . . . . . . 12 ASN HB2 . 27055 1 113 . 1 1 12 12 ASN HB3 H 1 2.446 0.000 . . . . . . . 12 ASN HB3 . 27055 1 114 . 1 1 12 12 ASN HD21 H 1 7.286 0.000 . . . . . . . 12 ASN HD21 . 27055 1 115 . 1 1 12 12 ASN HD22 H 1 7.855 0.000 . . . . . . . 12 ASN HD22 . 27055 1 116 . 1 1 12 12 ASN CA C 13 48.890 0.000 . . . . . . . 12 ASN CA . 27055 1 117 . 1 1 12 12 ASN CB C 13 36.475 0.000 . . . . . . . 12 ASN CB . 27055 1 118 . 1 1 12 12 ASN N N 15 125.015 0.000 . . . . . . . 12 ASN N . 27055 1 119 . 1 1 12 12 ASN ND2 N 15 114.949 0.000 . . . . . . . 12 ASN ND2 . 27055 1 120 . 1 1 13 13 PRO HA H 1 4.294 0.000 . . . . . . . 13 PRO HA . 27055 1 121 . 1 1 13 13 PRO HB2 H 1 1.510 0.000 . . . . . . . 13 PRO HB2 . 27055 1 122 . 1 1 13 13 PRO HB3 H 1 2.296 0.000 . . . . . . . 13 PRO HB3 . 27055 1 123 . 1 1 13 13 PRO HG3 H 1 1.841 0.000 . . . . . . . 13 PRO HG3 . 27055 1 124 . 1 1 13 13 PRO HD2 H 1 3.888 0.000 . . . . . . . 13 PRO HD2 . 27055 1 125 . 1 1 13 13 PRO HD3 H 1 3.741 0.000 . . . . . . . 13 PRO HD3 . 27055 1 126 . 1 1 13 13 PRO CA C 13 61.762 0.000 . . . . . . . 13 PRO CA . 27055 1 127 . 1 1 13 13 PRO CB C 13 30.487 0.000 . . . . . . . 13 PRO CB . 27055 1 128 . 1 1 13 13 PRO CG C 13 24.938 0.000 . . . . . . . 13 PRO CG . 27055 1 129 . 1 1 13 13 PRO CD C 13 48.869 0.000 . . . . . . . 13 PRO CD . 27055 1 130 . 1 1 14 14 HIS H H 1 8.639 0.000 . . . . . . . 14 HIS H . 27055 1 131 . 1 1 14 14 HIS HA H 1 4.357 0.000 . . . . . . . 14 HIS HA . 27055 1 132 . 1 1 14 14 HIS HB2 H 1 2.780 0.000 . . . . . . . 14 HIS HB2 . 27055 1 133 . 1 1 14 14 HIS HB3 H 1 3.182 0.000 . . . . . . . 14 HIS HB3 . 27055 1 134 . 1 1 14 14 HIS HD2 H 1 7.145 0.000 . . . . . . . 14 HIS HD2 . 27055 1 135 . 1 1 14 14 HIS CA C 13 53.693 0.000 . . . . . . . 14 HIS CA . 27055 1 136 . 1 1 14 14 HIS CB C 13 27.139 0.000 . . . . . . . 14 HIS CB . 27055 1 137 . 1 1 14 14 HIS CD2 C 13 122.979 0.000 . . . . . . . 14 HIS CD2 . 27055 1 138 . 1 1 14 14 HIS N N 15 113.682 0.000 . . . . . . . 14 HIS N . 27055 1 139 . 1 1 15 15 SER H H 1 8.172 0.000 . . . . . . . 15 SER H . 27055 1 140 . 1 1 15 15 SER HA H 1 4.338 0.000 . . . . . . . 15 SER HA . 27055 1 141 . 1 1 15 15 SER HB2 H 1 3.505 0.000 . . . . . . . 15 SER HB2 . 27055 1 142 . 1 1 15 15 SER HB3 H 1 3.717 0.000 . . . . . . . 15 SER HB3 . 27055 1 143 . 1 1 15 15 SER CA C 13 59.045 0.000 . . . . . . . 15 SER CA . 27055 1 144 . 1 1 15 15 SER CB C 13 60.529 0.000 . . . . . . . 15 SER CB . 27055 1 145 . 1 1 15 15 SER N N 15 119.746 0.000 . . . . . . . 15 SER N . 27055 1 146 . 1 1 16 16 THR H H 1 8.415 0.000 . . . . . . . 16 THR H . 27055 1 147 . 1 1 16 16 THR HA H 1 4.502 0.000 . . . . . . . 16 THR HA . 27055 1 148 . 1 1 16 16 THR HG21 H 1 1.263 0.000 . . . . . . . 16 THR QG2 . 27055 1 149 . 1 1 16 16 THR HG22 H 1 1.263 0.000 . . . . . . . 16 THR QG2 . 27055 1 150 . 1 1 16 16 THR HG23 H 1 1.263 0.000 . . . . . . . 16 THR QG2 . 27055 1 151 . 1 1 16 16 THR CA C 13 56.640 0.000 . . . . . . . 16 THR CA . 27055 1 152 . 1 1 16 16 THR CB C 13 70.105 0.000 . . . . . . . 16 THR CB . 27055 1 153 . 1 1 16 16 THR CG2 C 13 19.290 0.000 . . . . . . . 16 THR CG2 . 27055 1 154 . 1 1 16 16 THR N N 15 115.545 0.000 . . . . . . . 16 THR N . 27055 1 155 . 1 1 17 17 MET H H 1 8.901 0.000 . . . . . . . 17 MET H . 27055 1 156 . 1 1 17 17 MET HA H 1 3.887 0.000 . . . . . . . 17 MET HA . 27055 1 157 . 1 1 17 17 MET HB2 H 1 2.022 0.000 . . . . . . . 17 MET HB2 . 27055 1 158 . 1 1 17 17 MET HB3 H 1 2.087 0.000 . . . . . . . 17 MET HB3 . 27055 1 159 . 1 1 17 17 MET HG2 H 1 2.453 0.000 . . . . . . . 17 MET HG2 . 27055 1 160 . 1 1 17 17 MET HG3 H 1 2.336 0.000 . . . . . . . 17 MET HG3 . 27055 1 161 . 1 1 17 17 MET CA C 13 56.291 0.000 . . . . . . . 17 MET CA . 27055 1 162 . 1 1 17 17 MET CB C 13 29.103 0.000 . . . . . . . 17 MET CB . 27055 1 163 . 1 1 17 17 MET CG C 13 28.921 0.000 . . . . . . . 17 MET CG . 27055 1 164 . 1 1 17 17 MET N N 15 121.252 0.000 . . . . . . . 17 MET N . 27055 1 165 . 1 1 18 18 ASP H H 1 8.057 0.000 . . . . . . . 18 ASP H . 27055 1 166 . 1 1 18 18 ASP HA H 1 4.272 0.000 . . . . . . . 18 ASP HA . 27055 1 167 . 1 1 18 18 ASP HB2 H 1 2.516 0.000 . . . . . . . 18 ASP HB2 . 27055 1 168 . 1 1 18 18 ASP HB3 H 1 2.446 0.000 . . . . . . . 18 ASP HB3 . 27055 1 169 . 1 1 18 18 ASP CA C 13 54.969 0.000 . . . . . . . 18 ASP CA . 27055 1 170 . 1 1 18 18 ASP CB C 13 38.087 0.000 . . . . . . . 18 ASP CB . 27055 1 171 . 1 1 18 18 ASP N N 15 117.058 0.000 . . . . . . . 18 ASP N . 27055 1 172 . 1 1 19 19 SER H H 1 8.049 0.000 . . . . . . . 19 SER H . 27055 1 173 . 1 1 19 19 SER HA H 1 4.213 0.000 . . . . . . . 19 SER HA . 27055 1 174 . 1 1 19 19 SER HB2 H 1 3.828 0.000 . . . . . . . 19 SER HB2 . 27055 1 175 . 1 1 19 19 SER HB3 H 1 4.103 0.000 . . . . . . . 19 SER HB3 . 27055 1 176 . 1 1 19 19 SER CA C 13 58.697 0.000 . . . . . . . 19 SER CA . 27055 1 177 . 1 1 19 19 SER CB C 13 59.528 0.000 . . . . . . . 19 SER CB . 27055 1 178 . 1 1 19 19 SER N N 15 120.449 0.000 . . . . . . . 19 SER N . 27055 1 179 . 1 1 20 20 ILE H H 1 7.930 0.000 . . . . . . . 20 ILE H . 27055 1 180 . 1 1 20 20 ILE HA H 1 3.509 0.000 . . . . . . . 20 ILE HA . 27055 1 181 . 1 1 20 20 ILE HB H 1 1.740 0.000 . . . . . . . 20 ILE HB . 27055 1 182 . 1 1 20 20 ILE HG12 H 1 1.651 0.000 . . . . . . . 20 ILE HG12 . 27055 1 183 . 1 1 20 20 ILE HG13 H 1 0.642 0.000 . . . . . . . 20 ILE HG13 . 27055 1 184 . 1 1 20 20 ILE HG21 H 1 0.428 0.000 . . . . . . . 20 ILE QG2 . 27055 1 185 . 1 1 20 20 ILE HG22 H 1 0.428 0.000 . . . . . . . 20 ILE QG2 . 27055 1 186 . 1 1 20 20 ILE HG23 H 1 0.428 0.000 . . . . . . . 20 ILE QG2 . 27055 1 187 . 1 1 20 20 ILE HD11 H 1 0.544 0.000 . . . . . . . 20 ILE QD1 . 27055 1 188 . 1 1 20 20 ILE HD12 H 1 0.544 0.000 . . . . . . . 20 ILE QD1 . 27055 1 189 . 1 1 20 20 ILE HD13 H 1 0.544 0.000 . . . . . . . 20 ILE QD1 . 27055 1 190 . 1 1 20 20 ILE CA C 13 63.114 0.000 . . . . . . . 20 ILE CA . 27055 1 191 . 1 1 20 20 ILE CB C 13 35.905 0.000 . . . . . . . 20 ILE CB . 27055 1 192 . 1 1 20 20 ILE CG1 C 13 26.548 0.000 . . . . . . . 20 ILE CG1 . 27055 1 193 . 1 1 20 20 ILE CG2 C 13 11.794 0.000 . . . . . . . 20 ILE CG2 . 27055 1 194 . 1 1 20 20 ILE CD1 C 13 14.481 0.000 . . . . . . . 20 ILE CD1 . 27055 1 195 . 1 1 20 20 ILE N N 15 125.719 0.000 . . . . . . . 20 ILE N . 27055 1 196 . 1 1 21 21 LEU H H 1 8.521 0.000 . . . . . . . 21 LEU H . 27055 1 197 . 1 1 21 21 LEU HA H 1 3.780 0.000 . . . . . . . 21 LEU HA . 27055 1 198 . 1 1 21 21 LEU HB2 H 1 1.370 0.000 . . . . . . . 21 LEU HB2 . 27055 1 199 . 1 1 21 21 LEU HB3 H 1 1.776 0.000 . . . . . . . 21 LEU HB3 . 27055 1 200 . 1 1 21 21 LEU HG H 1 1.607 0.000 . . . . . . . 21 LEU HG . 27055 1 201 . 1 1 21 21 LEU HD11 H 1 0.557 0.000 . . . . . . . 21 LEU QD1 . 27055 1 202 . 1 1 21 21 LEU HD12 H 1 0.557 0.000 . . . . . . . 21 LEU QD1 . 27055 1 203 . 1 1 21 21 LEU HD13 H 1 0.557 0.000 . . . . . . . 21 LEU QD1 . 27055 1 204 . 1 1 21 21 LEU HD21 H 1 0.712 0.000 . . . . . . . 21 LEU QD2 . 27055 1 205 . 1 1 21 21 LEU HD22 H 1 0.712 0.000 . . . . . . . 21 LEU QD2 . 27055 1 206 . 1 1 21 21 LEU HD23 H 1 0.712 0.000 . . . . . . . 21 LEU QD2 . 27055 1 207 . 1 1 21 21 LEU CA C 13 55.645 0.000 . . . . . . . 21 LEU CA . 27055 1 208 . 1 1 21 21 LEU CB C 13 38.802 0.000 . . . . . . . 21 LEU CB . 27055 1 209 . 1 1 21 21 LEU CG C 13 24.391 0.000 . . . . . . . 21 LEU CG . 27055 1 210 . 1 1 21 21 LEU CD1 C 13 20.989 0.000 . . . . . . . 21 LEU CD1 . 27055 1 211 . 1 1 21 21 LEU CD2 C 13 23.134 0.000 . . . . . . . 21 LEU CD2 . 27055 1 212 . 1 1 21 21 LEU N N 15 119.551 0.000 . . . . . . . 21 LEU N . 27055 1 213 . 1 1 22 22 GLY H H 1 8.179 0.000 . . . . . . . 22 GLY H . 27055 1 214 . 1 1 22 22 GLY HA2 H 1 3.799 0.000 . . . . . . . 22 GLY QA . 27055 1 215 . 1 1 22 22 GLY HA3 H 1 3.799 0.000 . . . . . . . 22 GLY QA . 27055 1 216 . 1 1 22 22 GLY CA C 13 44.469 0.000 . . . . . . . 22 GLY CA . 27055 1 217 . 1 1 22 22 GLY N N 15 106.604 0.000 . . . . . . . 22 GLY N . 27055 1 218 . 1 1 23 23 ALA H H 1 7.511 0.000 . . . . . . . 23 ALA H . 27055 1 219 . 1 1 23 23 ALA HA H 1 4.213 0.000 . . . . . . . 23 ALA HA . 27055 1 220 . 1 1 23 23 ALA HB1 H 1 1.491 0.000 . . . . . . . 23 ALA HB . 27055 1 221 . 1 1 23 23 ALA HB2 H 1 1.491 0.000 . . . . . . . 23 ALA HB . 27055 1 222 . 1 1 23 23 ALA HB3 H 1 1.491 0.000 . . . . . . . 23 ALA HB . 27055 1 223 . 1 1 23 23 ALA CA C 13 51.098 0.000 . . . . . . . 23 ALA CA . 27055 1 224 . 1 1 23 23 ALA CB C 13 17.433 0.000 . . . . . . . 23 ALA CB . 27055 1 225 . 1 1 23 23 ALA N N 15 123.850 0.000 . . . . . . . 23 ALA N . 27055 1 226 . 1 1 24 24 LEU H H 1 7.498 0.000 . . . . . . . 24 LEU H . 27055 1 227 . 1 1 24 24 LEU HA H 1 4.478 0.000 . . . . . . . 24 LEU HA . 27055 1 228 . 1 1 24 24 LEU HB2 H 1 1.542 0.000 . . . . . . . 24 LEU HB2 . 27055 1 229 . 1 1 24 24 LEU HB3 H 1 1.733 0.000 . . . . . . . 24 LEU HB3 . 27055 1 230 . 1 1 24 24 LEU HG H 1 1.831 0.000 . . . . . . . 24 LEU HG . 27055 1 231 . 1 1 24 24 LEU HD11 H 1 0.648 0.000 . . . . . . . 24 LEU QD1 . 27055 1 232 . 1 1 24 24 LEU HD12 H 1 0.648 0.000 . . . . . . . 24 LEU QD1 . 27055 1 233 . 1 1 24 24 LEU HD13 H 1 0.648 0.000 . . . . . . . 24 LEU QD1 . 27055 1 234 . 1 1 24 24 LEU HD21 H 1 0.752 0.000 . . . . . . . 24 LEU QD2 . 27055 1 235 . 1 1 24 24 LEU HD22 H 1 0.752 0.000 . . . . . . . 24 LEU QD2 . 27055 1 236 . 1 1 24 24 LEU HD23 H 1 0.752 0.000 . . . . . . . 24 LEU QD2 . 27055 1 237 . 1 1 24 24 LEU CA C 13 52.245 0.000 . . . . . . . 24 LEU CA . 27055 1 238 . 1 1 24 24 LEU CB C 13 40.277 0.000 . . . . . . . 24 LEU CB . 27055 1 239 . 1 1 24 24 LEU CG C 13 25.110 0.000 . . . . . . . 24 LEU CG . 27055 1 240 . 1 1 24 24 LEU CD1 C 13 23.915 0.000 . . . . . . . 24 LEU CD1 . 27055 1 241 . 1 1 24 24 LEU CD2 C 13 21.565 0.000 . . . . . . . 24 LEU CD2 . 27055 1 242 . 1 1 24 24 LEU N N 15 114.679 0.000 . . . . . . . 24 LEU N . 27055 1 243 . 1 1 25 25 ALA H H 1 7.366 0.000 . . . . . . . 25 ALA H . 27055 1 244 . 1 1 25 25 ALA HA H 1 4.294 0.000 . . . . . . . 25 ALA HA . 27055 1 245 . 1 1 25 25 ALA HB1 H 1 1.450 0.000 . . . . . . . 25 ALA HB . 27055 1 246 . 1 1 25 25 ALA HB2 H 1 1.450 0.000 . . . . . . . 25 ALA HB . 27055 1 247 . 1 1 25 25 ALA HB3 H 1 1.450 0.000 . . . . . . . 25 ALA HB . 27055 1 248 . 1 1 25 25 ALA CA C 13 53.248 0.000 . . . . . . . 25 ALA CA . 27055 1 249 . 1 1 25 25 ALA CB C 13 14.293 0.000 . . . . . . . 25 ALA CB . 27055 1 250 . 1 1 25 25 ALA N N 15 125.037 0.000 . . . . . . . 25 ALA N . 27055 1 251 . 1 1 26 26 PRO HA H 1 4.020 0.000 . . . . . . . 26 PRO HA . 27055 1 252 . 1 1 26 26 PRO HB2 H 1 1.841 0.000 . . . . . . . 26 PRO HB2 . 27055 1 253 . 1 1 26 26 PRO HB3 H 1 0.061 0.000 . . . . . . . 26 PRO HB3 . 27055 1 254 . 1 1 26 26 PRO HG2 H 1 1.453 0.000 . . . . . . . 26 PRO HG2 . 27055 1 255 . 1 1 26 26 PRO HG3 H 1 1.567 0.000 . . . . . . . 26 PRO HG3 . 27055 1 256 . 1 1 26 26 PRO HD2 H 1 3.436 0.000 . . . . . . . 26 PRO HD2 . 27055 1 257 . 1 1 26 26 PRO HD3 H 1 2.978 0.000 . . . . . . . 26 PRO HD3 . 27055 1 258 . 1 1 26 26 PRO CA C 13 61.866 0.000 . . . . . . . 26 PRO CA . 27055 1 259 . 1 1 26 26 PRO CB C 13 28.128 0.000 . . . . . . . 26 PRO CB . 27055 1 260 . 1 1 26 26 PRO CG C 13 25.413 0.000 . . . . . . . 26 PRO CG . 27055 1 261 . 1 1 26 26 PRO CD C 13 48.155 0.000 . . . . . . . 26 PRO CD . 27055 1 262 . 1 1 27 27 TYR H H 1 7.847 0.000 . . . . . . . 27 TYR H . 27055 1 263 . 1 1 27 27 TYR HA H 1 4.493 0.000 . . . . . . . 27 TYR HA . 27055 1 264 . 1 1 27 27 TYR HB2 H 1 3.083 0.000 . . . . . . . 27 TYR HB2 . 27055 1 265 . 1 1 27 27 TYR HB3 H 1 2.502 0.000 . . . . . . . 27 TYR HB3 . 27055 1 266 . 1 1 27 27 TYR HD1 H 1 6.912 0.000 . . . . . . . 27 TYR HD1 . 27055 1 267 . 1 1 27 27 TYR HE1 H 1 6.684 0.000 . . . . . . . 27 TYR HE1 . 27055 1 268 . 1 1 27 27 TYR CA C 13 54.584 0.000 . . . . . . . 27 TYR CA . 27055 1 269 . 1 1 27 27 TYR CB C 13 37.730 0.000 . . . . . . . 27 TYR CB . 27055 1 270 . 1 1 27 27 TYR CD1 C 13 134.897 0.000 . . . . . . . 27 TYR CD1 . 27055 1 271 . 1 1 27 27 TYR CE1 C 13 120.579 0.000 . . . . . . . 27 TYR CE1 . 27055 1 272 . 1 1 27 27 TYR N N 15 115.612 0.000 . . . . . . . 27 TYR N . 27055 1 273 . 1 1 28 28 ALA H H 1 8.009 0.000 . . . . . . . 28 ALA H . 27055 1 274 . 1 1 28 28 ALA HA H 1 4.339 0.000 . . . . . . . 28 ALA HA . 27055 1 275 . 1 1 28 28 ALA HB1 H 1 1.156 0.000 . . . . . . . 28 ALA HB . 27055 1 276 . 1 1 28 28 ALA HB2 H 1 1.156 0.000 . . . . . . . 28 ALA HB . 27055 1 277 . 1 1 28 28 ALA HB3 H 1 1.156 0.000 . . . . . . . 28 ALA HB . 27055 1 278 . 1 1 28 28 ALA CA C 13 49.164 0.000 . . . . . . . 28 ALA CA . 27055 1 279 . 1 1 28 28 ALA CB C 13 19.526 0.000 . . . . . . . 28 ALA CB . 27055 1 280 . 1 1 28 28 ALA N N 15 121.645 0.000 . . . . . . . 28 ALA N . 27055 1 281 . 1 1 29 29 VAL H H 1 8.429 0.000 . . . . . . . 29 VAL H . 27055 1 282 . 1 1 29 29 VAL HA H 1 3.884 0.000 . . . . . . . 29 VAL HA . 27055 1 283 . 1 1 29 29 VAL HB H 1 1.916 0.000 . . . . . . . 29 VAL HB . 27055 1 284 . 1 1 29 29 VAL HG11 H 1 0.794 0.000 . . . . . . . 29 VAL QG1 . 27055 1 285 . 1 1 29 29 VAL HG12 H 1 0.794 0.000 . . . . . . . 29 VAL QG1 . 27055 1 286 . 1 1 29 29 VAL HG13 H 1 0.794 0.000 . . . . . . . 29 VAL QG1 . 27055 1 287 . 1 1 29 29 VAL HG21 H 1 0.859 0.000 . . . . . . . 29 VAL QG2 . 27055 1 288 . 1 1 29 29 VAL HG22 H 1 0.859 0.000 . . . . . . . 29 VAL QG2 . 27055 1 289 . 1 1 29 29 VAL HG23 H 1 0.859 0.000 . . . . . . . 29 VAL QG2 . 27055 1 290 . 1 1 29 29 VAL CA C 13 60.325 0.000 . . . . . . . 29 VAL CA . 27055 1 291 . 1 1 29 29 VAL CB C 13 28.357 0.000 . . . . . . . 29 VAL CB . 27055 1 292 . 1 1 29 29 VAL CG1 C 13 18.744 0.000 . . . . . . . 29 VAL CG1 . 27055 1 293 . 1 1 29 29 VAL CG2 C 13 18.637 0.000 . . . . . . . 29 VAL CG2 . 27055 1 294 . 1 1 29 29 VAL N N 15 124.236 0.000 . . . . . . . 29 VAL N . 27055 1 295 . 1 1 30 30 LEU H H 1 7.906 0.000 . . . . . . . 30 LEU H . 27055 1 296 . 1 1 30 30 LEU HA H 1 4.612 0.000 . . . . . . . 30 LEU HA . 27055 1 297 . 1 1 30 30 LEU HB2 H 1 1.553 0.000 . . . . . . . 30 LEU HB2 . 27055 1 298 . 1 1 30 30 LEU HB3 H 1 1.185 0.000 . . . . . . . 30 LEU HB3 . 27055 1 299 . 1 1 30 30 LEU HG H 1 1.271 0.000 . . . . . . . 30 LEU HG . 27055 1 300 . 1 1 30 30 LEU HD11 H 1 0.619 0.000 . . . . . . . 30 LEU QD1 . 27055 1 301 . 1 1 30 30 LEU HD12 H 1 0.619 0.000 . . . . . . . 30 LEU QD1 . 27055 1 302 . 1 1 30 30 LEU HD13 H 1 0.619 0.000 . . . . . . . 30 LEU QD1 . 27055 1 303 . 1 1 30 30 LEU HD21 H 1 0.601 0.000 . . . . . . . 30 LEU QD2 . 27055 1 304 . 1 1 30 30 LEU HD22 H 1 0.601 0.000 . . . . . . . 30 LEU QD2 . 27055 1 305 . 1 1 30 30 LEU HD23 H 1 0.601 0.000 . . . . . . . 30 LEU QD2 . 27055 1 306 . 1 1 30 30 LEU CA C 13 50.341 0.000 . . . . . . . 30 LEU CA . 27055 1 307 . 1 1 30 30 LEU CB C 13 43.411 0.000 . . . . . . . 30 LEU CB . 27055 1 308 . 1 1 30 30 LEU CG C 13 23.995 0.000 . . . . . . . 30 LEU CG . 27055 1 309 . 1 1 30 30 LEU CD1 C 13 20.872 0.000 . . . . . . . 30 LEU CD1 . 27055 1 310 . 1 1 30 30 LEU CD2 C 13 24.609 0.000 . . . . . . . 30 LEU CD2 . 27055 1 311 . 1 1 30 30 LEU N N 15 129.567 0.000 . . . . . . . 30 LEU N . 27055 1 312 . 1 1 31 31 SER H H 1 8.688 0.000 . . . . . . . 31 SER H . 27055 1 313 . 1 1 31 31 SER HA H 1 4.755 0.000 . . . . . . . 31 SER HA . 27055 1 314 . 1 1 31 31 SER HB2 H 1 3.772 0.000 . . . . . . . 31 SER HB2 . 27055 1 315 . 1 1 31 31 SER HB3 H 1 3.826 0.000 . . . . . . . 31 SER HB3 . 27055 1 316 . 1 1 31 31 SER CA C 13 53.957 0.000 . . . . . . . 31 SER CA . 27055 1 317 . 1 1 31 31 SER CB C 13 63.698 0.000 . . . . . . . 31 SER CB . 27055 1 318 . 1 1 31 31 SER N N 15 116.785 0.000 . . . . . . . 31 SER N . 27055 1 319 . 1 1 32 32 SER H H 1 9.064 0.000 . . . . . . . 32 SER H . 27055 1 320 . 1 1 32 32 SER HA H 1 4.258 0.000 . . . . . . . 32 SER HA . 27055 1 321 . 1 1 32 32 SER HB2 H 1 3.993 0.000 . . . . . . . 32 SER HB2 . 27055 1 322 . 1 1 32 32 SER HB3 H 1 3.873 0.000 . . . . . . . 32 SER HB3 . 27055 1 323 . 1 1 32 32 SER CA C 13 58.837 0.000 . . . . . . . 32 SER CA . 27055 1 324 . 1 1 32 32 SER CB C 13 60.060 0.000 . . . . . . . 32 SER CB . 27055 1 325 . 1 1 32 32 SER N N 15 119.566 0.000 . . . . . . . 32 SER N . 27055 1 326 . 1 1 33 33 SER H H 1 7.942 0.000 . . . . . . . 33 SER H . 27055 1 327 . 1 1 33 33 SER HA H 1 4.246 0.000 . . . . . . . 33 SER HA . 27055 1 328 . 1 1 33 33 SER HB2 H 1 3.775 0.000 . . . . . . . 33 SER HB2 . 27055 1 329 . 1 1 33 33 SER HB3 H 1 3.735 0.000 . . . . . . . 33 SER HB3 . 27055 1 330 . 1 1 33 33 SER CA C 13 57.890 0.000 . . . . . . . 33 SER CA . 27055 1 331 . 1 1 33 33 SER CB C 13 60.307 0.000 . . . . . . . 33 SER CB . 27055 1 332 . 1 1 33 33 SER N N 15 116.407 0.000 . . . . . . . 33 SER N . 27055 1 333 . 1 1 34 34 ASN H H 1 8.009 0.000 . . . . . . . 34 ASN H . 27055 1 334 . 1 1 34 34 ASN HA H 1 4.845 0.000 . . . . . . . 34 ASN HA . 27055 1 335 . 1 1 34 34 ASN HB2 H 1 3.226 0.000 . . . . . . . 34 ASN HB2 . 27055 1 336 . 1 1 34 34 ASN HB3 H 1 2.709 0.000 . . . . . . . 34 ASN HB3 . 27055 1 337 . 1 1 34 34 ASN HD21 H 1 8.005 0.000 . . . . . . . 34 ASN HD21 . 27055 1 338 . 1 1 34 34 ASN HD22 H 1 7.090 0.000 . . . . . . . 34 ASN HD22 . 27055 1 339 . 1 1 34 34 ASN CA C 13 52.705 0.000 . . . . . . . 34 ASN CA . 27055 1 340 . 1 1 34 34 ASN CB C 13 39.269 0.000 . . . . . . . 34 ASN CB . 27055 1 341 . 1 1 34 34 ASN N N 15 117.969 0.000 . . . . . . . 34 ASN N . 27055 1 342 . 1 1 34 34 ASN ND2 N 15 111.803 0.000 . . . . . . . 34 ASN ND2 . 27055 1 343 . 1 1 35 35 VAL H H 1 7.405 0.000 . . . . . . . 35 VAL H . 27055 1 344 . 1 1 35 35 VAL HA H 1 4.840 0.000 . . . . . . . 35 VAL HA . 27055 1 345 . 1 1 35 35 VAL HB H 1 1.930 0.000 . . . . . . . 35 VAL HB . 27055 1 346 . 1 1 35 35 VAL HG11 H 1 0.773 0.000 . . . . . . . 35 VAL QG1 . 27055 1 347 . 1 1 35 35 VAL HG12 H 1 0.773 0.000 . . . . . . . 35 VAL QG1 . 27055 1 348 . 1 1 35 35 VAL HG13 H 1 0.773 0.000 . . . . . . . 35 VAL QG1 . 27055 1 349 . 1 1 35 35 VAL HG21 H 1 0.680 0.000 . . . . . . . 35 VAL QG2 . 27055 1 350 . 1 1 35 35 VAL HG22 H 1 0.680 0.000 . . . . . . . 35 VAL QG2 . 27055 1 351 . 1 1 35 35 VAL HG23 H 1 0.680 0.000 . . . . . . . 35 VAL QG2 . 27055 1 352 . 1 1 35 35 VAL CA C 13 58.804 0.000 . . . . . . . 35 VAL CA . 27055 1 353 . 1 1 35 35 VAL CB C 13 31.699 0.000 . . . . . . . 35 VAL CB . 27055 1 354 . 1 1 35 35 VAL CG1 C 13 19.106 0.000 . . . . . . . 35 VAL CG1 . 27055 1 355 . 1 1 35 35 VAL CG2 C 13 18.976 0.000 . . . . . . . 35 VAL CG2 . 27055 1 356 . 1 1 35 35 VAL N N 15 120.346 0.000 . . . . . . . 35 VAL N . 27055 1 357 . 1 1 36 36 ARG H H 1 8.996 0.000 . . . . . . . 36 ARG H . 27055 1 358 . 1 1 36 36 ARG HA H 1 4.700 0.000 . . . . . . . 36 ARG HA . 27055 1 359 . 1 1 36 36 ARG HB2 H 1 1.783 0.000 . . . . . . . 36 ARG QB . 27055 1 360 . 1 1 36 36 ARG HB3 H 1 1.783 0.000 . . . . . . . 36 ARG QB . 27055 1 361 . 1 1 36 36 ARG HG2 H 1 1.552 0.000 . . . . . . . 36 ARG HG2 . 27055 1 362 . 1 1 36 36 ARG HG3 H 1 1.478 0.000 . . . . . . . 36 ARG HG3 . 27055 1 363 . 1 1 36 36 ARG HD2 H 1 2.816 0.000 . . . . . . . 36 ARG HD2 . 27055 1 364 . 1 1 36 36 ARG CA C 13 52.145 0.000 . . . . . . . 36 ARG CA . 27055 1 365 . 1 1 36 36 ARG CB C 13 30.329 0.000 . . . . . . . 36 ARG CB . 27055 1 366 . 1 1 36 36 ARG CG C 13 24.910 0.000 . . . . . . . 36 ARG CG . 27055 1 367 . 1 1 36 36 ARG CD C 13 39.377 0.000 . . . . . . . 36 ARG CD . 27055 1 368 . 1 1 36 36 ARG N N 15 127.685 0.000 . . . . . . . 36 ARG N . 27055 1 369 . 1 1 37 37 VAL H H 1 8.796 0.000 . . . . . . . 37 VAL H . 27055 1 370 . 1 1 37 37 VAL HA H 1 3.837 0.000 . . . . . . . 37 VAL HA . 27055 1 371 . 1 1 37 37 VAL HB H 1 1.821 0.000 . . . . . . . 37 VAL HB . 27055 1 372 . 1 1 37 37 VAL HG21 H 1 0.609 0.000 . . . . . . . 37 VAL QG2 . 27055 1 373 . 1 1 37 37 VAL HG22 H 1 0.609 0.000 . . . . . . . 37 VAL QG2 . 27055 1 374 . 1 1 37 37 VAL HG23 H 1 0.609 0.000 . . . . . . . 37 VAL QG2 . 27055 1 375 . 1 1 37 37 VAL CA C 13 59.185 0.000 . . . . . . . 37 VAL CA . 27055 1 376 . 1 1 37 37 VAL CB C 13 30.060 0.000 . . . . . . . 37 VAL CB . 27055 1 377 . 1 1 37 37 VAL CG1 C 13 21.340 0.000 . . . . . . . 37 VAL CG1 . 27055 1 378 . 1 1 37 37 VAL CG2 C 13 19.111 0.000 . . . . . . . 37 VAL CG2 . 27055 1 379 . 1 1 37 37 VAL N N 15 127.117 0.000 . . . . . . . 37 VAL N . 27055 1 380 . 1 1 38 38 ILE H H 1 7.218 0.000 . . . . . . . 38 ILE H . 27055 1 381 . 1 1 38 38 ILE HA H 1 4.048 0.000 . . . . . . . 38 ILE HA . 27055 1 382 . 1 1 38 38 ILE HB H 1 1.213 0.000 . . . . . . . 38 ILE HB . 27055 1 383 . 1 1 38 38 ILE HG12 H 1 1.231 0.000 . . . . . . . 38 ILE QG1 . 27055 1 384 . 1 1 38 38 ILE HG13 H 1 1.231 0.000 . . . . . . . 38 ILE QG1 . 27055 1 385 . 1 1 38 38 ILE HG21 H 1 0.690 0.000 . . . . . . . 38 ILE QG2 . 27055 1 386 . 1 1 38 38 ILE HG22 H 1 0.690 0.000 . . . . . . . 38 ILE QG2 . 27055 1 387 . 1 1 38 38 ILE HG23 H 1 0.690 0.000 . . . . . . . 38 ILE QG2 . 27055 1 388 . 1 1 38 38 ILE HD11 H 1 0.698 0.000 . . . . . . . 38 ILE QD1 . 27055 1 389 . 1 1 38 38 ILE HD12 H 1 0.698 0.000 . . . . . . . 38 ILE QD1 . 27055 1 390 . 1 1 38 38 ILE HD13 H 1 0.698 0.000 . . . . . . . 38 ILE QD1 . 27055 1 391 . 1 1 38 38 ILE CA C 13 57.000 0.000 . . . . . . . 38 ILE CA . 27055 1 392 . 1 1 38 38 ILE CB C 13 32.813 0.000 . . . . . . . 38 ILE CB . 27055 1 393 . 1 1 38 38 ILE CG1 C 13 24.724 0.000 . . . . . . . 38 ILE CG1 . 27055 1 394 . 1 1 38 38 ILE CG2 C 13 15.147 0.000 . . . . . . . 38 ILE CG2 . 27055 1 395 . 1 1 38 38 ILE CD1 C 13 7.421 0.000 . . . . . . . 38 ILE CD1 . 27055 1 396 . 1 1 38 38 ILE N N 15 129.281 0.000 . . . . . . . 38 ILE N . 27055 1 397 . 1 1 39 39 LYS H H 1 8.580 0.000 . . . . . . . 39 LYS H . 27055 1 398 . 1 1 39 39 LYS HA H 1 4.512 0.000 . . . . . . . 39 LYS HA . 27055 1 399 . 1 1 39 39 LYS HB2 H 1 1.486 0.000 . . . . . . . 39 LYS HB2 . 27055 1 400 . 1 1 39 39 LYS HB3 H 1 1.383 0.000 . . . . . . . 39 LYS HB3 . 27055 1 401 . 1 1 39 39 LYS HG2 H 1 1.092 0.000 . . . . . . . 39 LYS HG2 . 27055 1 402 . 1 1 39 39 LYS HG3 H 1 1.181 0.000 . . . . . . . 39 LYS HG3 . 27055 1 403 . 1 1 39 39 LYS HD2 H 1 1.382 0.000 . . . . . . . 39 LYS HD2 . 27055 1 404 . 1 1 39 39 LYS HD3 H 1 1.438 0.000 . . . . . . . 39 LYS HD3 . 27055 1 405 . 1 1 39 39 LYS CA C 13 52.389 0.000 . . . . . . . 39 LYS CA . 27055 1 406 . 1 1 39 39 LYS CB C 13 32.493 0.000 . . . . . . . 39 LYS CB . 27055 1 407 . 1 1 39 39 LYS CG C 13 21.907 0.000 . . . . . . . 39 LYS CG . 27055 1 408 . 1 1 39 39 LYS CD C 13 26.563 0.000 . . . . . . . 39 LYS CD . 27055 1 409 . 1 1 39 39 LYS N N 15 129.015 0.000 . . . . . . . 39 LYS N . 27055 1 410 . 1 1 40 40 ASP H H 1 8.520 0.000 . . . . . . . 40 ASP H . 27055 1 411 . 1 1 40 40 ASP HA H 1 4.460 0.000 . . . . . . . 40 ASP HA . 27055 1 412 . 1 1 40 40 ASP HB2 H 1 2.161 0.000 . . . . . . . 40 ASP HB2 . 27055 1 413 . 1 1 40 40 ASP HB3 H 1 2.914 0.000 . . . . . . . 40 ASP HB3 . 27055 1 414 . 1 1 40 40 ASP CA C 13 51.048 0.000 . . . . . . . 40 ASP CA . 27055 1 415 . 1 1 40 40 ASP CB C 13 40.271 0.000 . . . . . . . 40 ASP CB . 27055 1 416 . 1 1 40 40 ASP N N 15 124.865 0.000 . . . . . . . 40 ASP N . 27055 1 417 . 1 1 41 41 LYS H H 1 8.745 0.000 . . . . . . . 41 LYS H . 27055 1 418 . 1 1 41 41 LYS HA H 1 3.887 0.000 . . . . . . . 41 LYS HA . 27055 1 419 . 1 1 41 41 LYS HB2 H 1 1.781 0.000 . . . . . . . 41 LYS HB2 . 27055 1 420 . 1 1 41 41 LYS HG2 H 1 1.374 0.000 . . . . . . . 41 LYS HG2 . 27055 1 421 . 1 1 41 41 LYS HG3 H 1 1.410 0.000 . . . . . . . 41 LYS HG3 . 27055 1 422 . 1 1 41 41 LYS HD2 H 1 1.616 0.000 . . . . . . . 41 LYS HD2 . 27055 1 423 . 1 1 41 41 LYS HE2 H 1 2.946 0.000 . . . . . . . 41 LYS HE2 . 27055 1 424 . 1 1 41 41 LYS HE3 H 1 3.085 0.000 . . . . . . . 41 LYS HE3 . 27055 1 425 . 1 1 41 41 LYS CA C 13 56.147 0.000 . . . . . . . 41 LYS CA . 27055 1 426 . 1 1 41 41 LYS CB C 13 30.052 0.000 . . . . . . . 41 LYS CB . 27055 1 427 . 1 1 41 41 LYS CG C 13 22.635 0.000 . . . . . . . 41 LYS CG . 27055 1 428 . 1 1 41 41 LYS CD C 13 26.715 0.000 . . . . . . . 41 LYS CD . 27055 1 429 . 1 1 41 41 LYS CE C 13 40.957 0.000 . . . . . . . 41 LYS CE . 27055 1 430 . 1 1 41 41 LYS N N 15 127.565 0.000 . . . . . . . 41 LYS N . 27055 1 431 . 1 1 42 42 GLN H H 1 8.532 0.000 . . . . . . . 42 GLN H . 27055 1 432 . 1 1 42 42 GLN HA H 1 4.229 0.000 . . . . . . . 42 GLN HA . 27055 1 433 . 1 1 42 42 GLN HB2 H 1 2.101 0.000 . . . . . . . 42 GLN QB . 27055 1 434 . 1 1 42 42 GLN HB3 H 1 2.101 0.000 . . . . . . . 42 GLN QB . 27055 1 435 . 1 1 42 42 GLN HG2 H 1 2.306 0.000 . . . . . . . 42 GLN HG2 . 27055 1 436 . 1 1 42 42 GLN HG3 H 1 2.269 0.000 . . . . . . . 42 GLN HG3 . 27055 1 437 . 1 1 42 42 GLN HE21 H 1 6.675 0.000 . . . . . . . 42 GLN HE21 . 27055 1 438 . 1 1 42 42 GLN HE22 H 1 7.225 0.000 . . . . . . . 42 GLN HE22 . 27055 1 439 . 1 1 42 42 GLN CA C 13 55.063 0.000 . . . . . . . 42 GLN CA . 27055 1 440 . 1 1 42 42 GLN CB C 13 26.822 0.000 . . . . . . . 42 GLN CB . 27055 1 441 . 1 1 42 42 GLN CG C 13 31.913 0.000 . . . . . . . 42 GLN CG . 27055 1 442 . 1 1 42 42 GLN N N 15 118.253 0.000 . . . . . . . 42 GLN N . 27055 1 443 . 1 1 42 42 GLN NE2 N 15 112.689 0.000 . . . . . . . 42 GLN NE2 . 27055 1 444 . 1 1 43 43 THR H H 1 7.879 0.000 . . . . . . . 43 THR H . 27055 1 445 . 1 1 43 43 THR HA H 1 4.229 0.000 . . . . . . . 43 THR HA . 27055 1 446 . 1 1 43 43 THR HB H 1 4.188 0.000 . . . . . . . 43 THR HB . 27055 1 447 . 1 1 43 43 THR HG21 H 1 1.096 0.000 . . . . . . . 43 THR QG2 . 27055 1 448 . 1 1 43 43 THR HG22 H 1 1.096 0.000 . . . . . . . 43 THR QG2 . 27055 1 449 . 1 1 43 43 THR HG23 H 1 1.096 0.000 . . . . . . . 43 THR QG2 . 27055 1 450 . 1 1 43 43 THR CA C 13 59.309 0.000 . . . . . . . 43 THR CA . 27055 1 451 . 1 1 43 43 THR CB C 13 67.949 0.000 . . . . . . . 43 THR CB . 27055 1 452 . 1 1 43 43 THR CG2 C 13 18.716 0.000 . . . . . . . 43 THR CG2 . 27055 1 453 . 1 1 43 43 THR N N 15 110.112 0.000 . . . . . . . 43 THR N . 27055 1 454 . 1 1 44 44 GLN H H 1 8.156 0.000 . . . . . . . 44 GLN H . 27055 1 455 . 1 1 44 44 GLN HA H 1 3.808 0.000 . . . . . . . 44 GLN HA . 27055 1 456 . 1 1 44 44 GLN HB2 H 1 2.267 0.000 . . . . . . . 44 GLN HB2 . 27055 1 457 . 1 1 44 44 GLN HB3 H 1 2.204 0.000 . . . . . . . 44 GLN HB3 . 27055 1 458 . 1 1 44 44 GLN HG2 H 1 2.124 0.000 . . . . . . . 44 GLN HG2 . 27055 1 459 . 1 1 44 44 GLN HG3 H 1 2.253 0.000 . . . . . . . 44 GLN HG3 . 27055 1 460 . 1 1 44 44 GLN HE21 H 1 6.764 0.000 . . . . . . . 44 GLN HE21 . 27055 1 461 . 1 1 44 44 GLN HE22 H 1 7.382 0.000 . . . . . . . 44 GLN HE22 . 27055 1 462 . 1 1 44 44 GLN CA C 13 54.713 0.000 . . . . . . . 44 GLN CA . 27055 1 463 . 1 1 44 44 GLN CB C 13 23.997 0.000 . . . . . . . 44 GLN CB . 27055 1 464 . 1 1 44 44 GLN CG C 13 31.516 0.000 . . . . . . . 44 GLN CG . 27055 1 465 . 1 1 44 44 GLN N N 15 115.372 0.000 . . . . . . . 44 GLN N . 27055 1 466 . 1 1 44 44 GLN NE2 N 15 114.975 0.000 . . . . . . . 44 GLN NE2 . 27055 1 467 . 1 1 45 45 LEU H H 1 7.652 0.000 . . . . . . . 45 LEU H . 27055 1 468 . 1 1 45 45 LEU HA H 1 4.426 0.000 . . . . . . . 45 LEU HA . 27055 1 469 . 1 1 45 45 LEU HB2 H 1 1.273 0.000 . . . . . . . 45 LEU HB2 . 27055 1 470 . 1 1 45 45 LEU HB3 H 1 1.444 0.000 . . . . . . . 45 LEU HB3 . 27055 1 471 . 1 1 45 45 LEU HG H 1 1.376 0.000 . . . . . . . 45 LEU HG . 27055 1 472 . 1 1 45 45 LEU HD11 H 1 0.628 0.000 . . . . . . . 45 LEU QD1 . 27055 1 473 . 1 1 45 45 LEU HD12 H 1 0.628 0.000 . . . . . . . 45 LEU QD1 . 27055 1 474 . 1 1 45 45 LEU HD13 H 1 0.628 0.000 . . . . . . . 45 LEU QD1 . 27055 1 475 . 1 1 45 45 LEU HD21 H 1 0.393 0.000 . . . . . . . 45 LEU QD2 . 27055 1 476 . 1 1 45 45 LEU HD22 H 1 0.393 0.000 . . . . . . . 45 LEU QD2 . 27055 1 477 . 1 1 45 45 LEU HD23 H 1 0.393 0.000 . . . . . . . 45 LEU QD2 . 27055 1 478 . 1 1 45 45 LEU CA C 13 51.056 0.000 . . . . . . . 45 LEU CA . 27055 1 479 . 1 1 45 45 LEU CB C 13 39.793 0.000 . . . . . . . 45 LEU CB . 27055 1 480 . 1 1 45 45 LEU CG C 13 24.118 0.000 . . . . . . . 45 LEU CG . 27055 1 481 . 1 1 45 45 LEU CD1 C 13 22.583 0.000 . . . . . . . 45 LEU CD1 . 27055 1 482 . 1 1 45 45 LEU CD2 C 13 19.689 0.000 . . . . . . . 45 LEU CD2 . 27055 1 483 . 1 1 45 45 LEU N N 15 121.044 0.000 . . . . . . . 45 LEU N . 27055 1 484 . 1 1 46 46 ASN H H 1 8.726 0.000 . . . . . . . 46 ASN H . 27055 1 485 . 1 1 46 46 ASN HA H 1 4.901 0.000 . . . . . . . 46 ASN HA . 27055 1 486 . 1 1 46 46 ASN HB2 H 1 2.667 0.000 . . . . . . . 46 ASN HB2 . 27055 1 487 . 1 1 46 46 ASN HB3 H 1 2.517 0.000 . . . . . . . 46 ASN HB3 . 27055 1 488 . 1 1 46 46 ASN HD21 H 1 7.198 0.000 . . . . . . . 46 ASN HD21 . 27055 1 489 . 1 1 46 46 ASN HD22 H 1 7.033 0.000 . . . . . . . 46 ASN HD22 . 27055 1 490 . 1 1 46 46 ASN CA C 13 50.686 0.000 . . . . . . . 46 ASN CA . 27055 1 491 . 1 1 46 46 ASN CB C 13 36.805 0.000 . . . . . . . 46 ASN CB . 27055 1 492 . 1 1 46 46 ASN N N 15 119.367 0.000 . . . . . . . 46 ASN N . 27055 1 493 . 1 1 46 46 ASN ND2 N 15 116.094 0.000 . . . . . . . 46 ASN ND2 . 27055 1 494 . 1 1 47 47 ARG H H 1 8.323 0.000 . . . . . . . 47 ARG H . 27055 1 495 . 1 1 47 47 ARG HA H 1 4.161 0.000 . . . . . . . 47 ARG HA . 27055 1 496 . 1 1 47 47 ARG HB2 H 1 1.073 0.000 . . . . . . . 47 ARG HB2 . 27055 1 497 . 1 1 47 47 ARG HB3 H 1 2.007 0.000 . . . . . . . 47 ARG HB3 . 27055 1 498 . 1 1 47 47 ARG HG3 H 1 1.453 0.000 . . . . . . . 47 ARG HG3 . 27055 1 499 . 1 1 47 47 ARG HD2 H 1 3.066 0.000 . . . . . . . 47 ARG HD2 . 27055 1 500 . 1 1 47 47 ARG HD3 H 1 3.087 0.000 . . . . . . . 47 ARG HD3 . 27055 1 501 . 1 1 47 47 ARG CA C 13 53.779 0.000 . . . . . . . 47 ARG CA . 27055 1 502 . 1 1 47 47 ARG CB C 13 28.165 0.000 . . . . . . . 47 ARG CB . 27055 1 503 . 1 1 47 47 ARG CG C 13 25.477 0.000 . . . . . . . 47 ARG CG . 27055 1 504 . 1 1 47 47 ARG CD C 13 40.813 0.000 . . . . . . . 47 ARG CD . 27055 1 505 . 1 1 47 47 ARG N N 15 119.392 0.000 . . . . . . . 47 ARG N . 27055 1 506 . 1 1 48 48 GLY H H 1 9.384 0.000 . . . . . . . 48 GLY H . 27055 1 507 . 1 1 48 48 GLY HA2 H 1 4.422 0.000 . . . . . . . 48 GLY HA2 . 27055 1 508 . 1 1 48 48 GLY HA3 H 1 3.564 0.000 . . . . . . . 48 GLY HA3 . 27055 1 509 . 1 1 48 48 GLY CA C 13 42.959 0.000 . . . . . . . 48 GLY CA . 27055 1 510 . 1 1 48 48 GLY N N 15 109.251 0.000 . . . . . . . 48 GLY N . 27055 1 511 . 1 1 49 49 PHE H H 1 6.760 0.000 . . . . . . . 49 PHE H . 27055 1 512 . 1 1 49 49 PHE HA H 1 5.739 0.000 . . . . . . . 49 PHE HA . 27055 1 513 . 1 1 49 49 PHE HB2 H 1 2.984 0.000 . . . . . . . 49 PHE HB2 . 27055 1 514 . 1 1 49 49 PHE HB3 H 1 2.637 0.000 . . . . . . . 49 PHE HB3 . 27055 1 515 . 1 1 49 49 PHE HD1 H 1 6.578 0.000 . . . . . . . 49 PHE HD1 . 27055 1 516 . 1 1 49 49 PHE HE1 H 1 7.216 0.000 . . . . . . . 49 PHE HE1 . 27055 1 517 . 1 1 49 49 PHE HZ H 1 7.251 0.000 . . . . . . . 49 PHE HZ . 27055 1 518 . 1 1 49 49 PHE CA C 13 51.621 0.000 . . . . . . . 49 PHE CA . 27055 1 519 . 1 1 49 49 PHE CB C 13 39.482 0.000 . . . . . . . 49 PHE CB . 27055 1 520 . 1 1 49 49 PHE CD1 C 13 134.393 0.000 . . . . . . . 49 PHE CD1 . 27055 1 521 . 1 1 49 49 PHE CE1 C 13 133.820 0.000 . . . . . . . 49 PHE CE1 . 27055 1 522 . 1 1 49 49 PHE CZ C 13 131.930 0.000 . . . . . . . 49 PHE CZ . 27055 1 523 . 1 1 49 49 PHE N N 15 115.379 0.000 . . . . . . . 49 PHE N . 27055 1 524 . 1 1 50 50 ALA H H 1 8.426 0.000 . . . . . . . 50 ALA H . 27055 1 525 . 1 1 50 50 ALA HA H 1 4.824 0.000 . . . . . . . 50 ALA HA . 27055 1 526 . 1 1 50 50 ALA HB1 H 1 1.012 0.000 . . . . . . . 50 ALA HB . 27055 1 527 . 1 1 50 50 ALA HB2 H 1 1.012 0.000 . . . . . . . 50 ALA HB . 27055 1 528 . 1 1 50 50 ALA HB3 H 1 1.012 0.000 . . . . . . . 50 ALA HB . 27055 1 529 . 1 1 50 50 ALA CA C 13 47.300 0.000 . . . . . . . 50 ALA CA . 27055 1 530 . 1 1 50 50 ALA CB C 13 21.346 0.000 . . . . . . . 50 ALA CB . 27055 1 531 . 1 1 50 50 ALA N N 15 120.405 0.000 . . . . . . . 50 ALA N . 27055 1 532 . 1 1 51 51 PHE H H 1 8.820 0.000 . . . . . . . 51 PHE H . 27055 1 533 . 1 1 51 51 PHE HA H 1 5.419 0.000 . . . . . . . 51 PHE HA . 27055 1 534 . 1 1 51 51 PHE HB2 H 1 2.786 0.000 . . . . . . . 51 PHE HB2 . 27055 1 535 . 1 1 51 51 PHE HB3 H 1 2.828 0.000 . . . . . . . 51 PHE HB3 . 27055 1 536 . 1 1 51 51 PHE HD2 H 1 7.025 0.000 . . . . . . . 51 PHE HD2 . 27055 1 537 . 1 1 51 51 PHE HE1 H 1 7.338 0.000 . . . . . . . 51 PHE HE1 . 27055 1 538 . 1 1 51 51 PHE HZ H 1 7.292 0.000 . . . . . . . 51 PHE HZ . 27055 1 539 . 1 1 51 51 PHE CA C 13 53.637 0.000 . . . . . . . 51 PHE CA . 27055 1 540 . 1 1 51 51 PHE CB C 13 39.685 0.000 . . . . . . . 51 PHE CB . 27055 1 541 . 1 1 51 51 PHE CD2 C 13 133.562 0.000 . . . . . . . 51 PHE CD2 . 27055 1 542 . 1 1 51 51 PHE CE1 C 13 133.637 0.000 . . . . . . . 51 PHE CE1 . 27055 1 543 . 1 1 51 51 PHE CZ C 13 132.092 0.000 . . . . . . . 51 PHE CZ . 27055 1 544 . 1 1 51 51 PHE N N 15 119.343 0.000 . . . . . . . 51 PHE N . 27055 1 545 . 1 1 52 52 ILE H H 1 9.402 0.000 . . . . . . . 52 ILE H . 27055 1 546 . 1 1 52 52 ILE HA H 1 4.956 0.000 . . . . . . . 52 ILE HA . 27055 1 547 . 1 1 52 52 ILE HB H 1 1.789 0.000 . . . . . . . 52 ILE HB . 27055 1 548 . 1 1 52 52 ILE HG12 H 1 1.032 0.000 . . . . . . . 52 ILE HG12 . 27055 1 549 . 1 1 52 52 ILE HG13 H 1 1.195 0.000 . . . . . . . 52 ILE HG13 . 27055 1 550 . 1 1 52 52 ILE HG21 H 1 0.544 0.000 . . . . . . . 52 ILE QG2 . 27055 1 551 . 1 1 52 52 ILE HG22 H 1 0.544 0.000 . . . . . . . 52 ILE QG2 . 27055 1 552 . 1 1 52 52 ILE HG23 H 1 0.544 0.000 . . . . . . . 52 ILE QG2 . 27055 1 553 . 1 1 52 52 ILE HD11 H 1 0.635 0.000 . . . . . . . 52 ILE QD1 . 27055 1 554 . 1 1 52 52 ILE HD12 H 1 0.635 0.000 . . . . . . . 52 ILE QD1 . 27055 1 555 . 1 1 52 52 ILE HD13 H 1 0.635 0.000 . . . . . . . 52 ILE QD1 . 27055 1 556 . 1 1 52 52 ILE CA C 13 56.579 0.000 . . . . . . . 52 ILE CA . 27055 1 557 . 1 1 52 52 ILE CB C 13 36.191 0.000 . . . . . . . 52 ILE CB . 27055 1 558 . 1 1 52 52 ILE CG1 C 13 24.378 0.000 . . . . . . . 52 ILE CG1 . 27055 1 559 . 1 1 52 52 ILE CG2 C 13 10.776 0.000 . . . . . . . 52 ILE CG2 . 27055 1 560 . 1 1 52 52 ILE CD1 C 13 15.673 0.000 . . . . . . . 52 ILE CD1 . 27055 1 561 . 1 1 52 52 ILE N N 15 123.453 0.000 . . . . . . . 52 ILE N . 27055 1 562 . 1 1 53 53 GLN H H 1 9.116 0.000 . . . . . . . 53 GLN H . 27055 1 563 . 1 1 53 53 GLN HA H 1 4.927 0.000 . . . . . . . 53 GLN HA . 27055 1 564 . 1 1 53 53 GLN HB2 H 1 1.696 0.000 . . . . . . . 53 GLN HB2 . 27055 1 565 . 1 1 53 53 GLN HB3 H 1 2.015 0.000 . . . . . . . 53 GLN HB3 . 27055 1 566 . 1 1 53 53 GLN HG2 H 1 2.123 0.000 . . . . . . . 53 GLN HG2 . 27055 1 567 . 1 1 53 53 GLN HE21 H 1 6.493 0.000 . . . . . . . 53 GLN HE21 . 27055 1 568 . 1 1 53 53 GLN HE22 H 1 7.603 0.000 . . . . . . . 53 GLN HE22 . 27055 1 569 . 1 1 53 53 GLN CA C 13 52.327 0.000 . . . . . . . 53 GLN CA . 27055 1 570 . 1 1 53 53 GLN CB C 13 28.162 0.000 . . . . . . . 53 GLN CB . 27055 1 571 . 1 1 53 53 GLN CG C 13 31.097 0.000 . . . . . . . 53 GLN CG . 27055 1 572 . 1 1 53 53 GLN N N 15 130.640 0.000 . . . . . . . 53 GLN N . 27055 1 573 . 1 1 53 53 GLN NE2 N 15 113.763 0.000 . . . . . . . 53 GLN NE2 . 27055 1 574 . 1 1 54 54 LEU H H 1 8.765 0.000 . . . . . . . 54 LEU H . 27055 1 575 . 1 1 54 54 LEU HA H 1 4.730 0.000 . . . . . . . 54 LEU HA . 27055 1 576 . 1 1 54 54 LEU HB2 H 1 1.758 0.000 . . . . . . . 54 LEU HB2 . 27055 1 577 . 1 1 54 54 LEU HB3 H 1 2.015 0.000 . . . . . . . 54 LEU HB3 . 27055 1 578 . 1 1 54 54 LEU HG H 1 1.559 0.000 . . . . . . . 54 LEU HG . 27055 1 579 . 1 1 54 54 LEU HD11 H 1 0.813 0.000 . . . . . . . 54 LEU QD1 . 27055 1 580 . 1 1 54 54 LEU HD12 H 1 0.813 0.000 . . . . . . . 54 LEU QD1 . 27055 1 581 . 1 1 54 54 LEU HD13 H 1 0.813 0.000 . . . . . . . 54 LEU QD1 . 27055 1 582 . 1 1 54 54 LEU HD21 H 1 0.873 0.000 . . . . . . . 54 LEU QD2 . 27055 1 583 . 1 1 54 54 LEU HD22 H 1 0.873 0.000 . . . . . . . 54 LEU QD2 . 27055 1 584 . 1 1 54 54 LEU HD23 H 1 0.873 0.000 . . . . . . . 54 LEU QD2 . 27055 1 585 . 1 1 54 54 LEU CA C 13 50.091 0.000 . . . . . . . 54 LEU CA . 27055 1 586 . 1 1 54 54 LEU CB C 13 39.395 0.000 . . . . . . . 54 LEU CB . 27055 1 587 . 1 1 54 54 LEU CG C 13 26.464 0.000 . . . . . . . 54 LEU CG . 27055 1 588 . 1 1 54 54 LEU CD1 C 13 21.136 0.000 . . . . . . . 54 LEU CD1 . 27055 1 589 . 1 1 54 54 LEU CD2 C 13 22.482 0.000 . . . . . . . 54 LEU CD2 . 27055 1 590 . 1 1 54 54 LEU N N 15 130.468 0.000 . . . . . . . 54 LEU N . 27055 1 591 . 1 1 55 55 SER H H 1 8.644 0.000 . . . . . . . 55 SER H . 27055 1 592 . 1 1 55 55 SER HA H 1 4.126 0.000 . . . . . . . 55 SER HA . 27055 1 593 . 1 1 55 55 SER HB2 H 1 3.909 0.000 . . . . . . . 55 SER HB2 . 27055 1 594 . 1 1 55 55 SER HB3 H 1 3.967 0.000 . . . . . . . 55 SER HB3 . 27055 1 595 . 1 1 55 55 SER CA C 13 59.034 0.000 . . . . . . . 55 SER CA . 27055 1 596 . 1 1 55 55 SER CB C 13 61.144 0.000 . . . . . . . 55 SER CB . 27055 1 597 . 1 1 55 55 SER N N 15 114.464 0.000 . . . . . . . 55 SER N . 27055 1 598 . 1 1 56 56 THR H H 1 7.204 0.000 . . . . . . . 56 THR H . 27055 1 599 . 1 1 56 56 THR HA H 1 4.834 0.000 . . . . . . . 56 THR HA . 27055 1 600 . 1 1 56 56 THR HB H 1 4.528 0.000 . . . . . . . 56 THR HB . 27055 1 601 . 1 1 56 56 THR HG21 H 1 1.156 0.000 . . . . . . . 56 THR QG2 . 27055 1 602 . 1 1 56 56 THR HG22 H 1 1.156 0.000 . . . . . . . 56 THR QG2 . 27055 1 603 . 1 1 56 56 THR HG23 H 1 1.156 0.000 . . . . . . . 56 THR QG2 . 27055 1 604 . 1 1 56 56 THR CA C 13 56.306 0.000 . . . . . . . 56 THR CA . 27055 1 605 . 1 1 56 56 THR CB C 13 71.536 0.000 . . . . . . . 56 THR CB . 27055 1 606 . 1 1 56 56 THR CG2 C 13 19.557 0.000 . . . . . . . 56 THR CG2 . 27055 1 607 . 1 1 56 56 THR N N 15 107.759 0.000 . . . . . . . 56 THR N . 27055 1 608 . 1 1 57 57 ILE H H 1 8.568 0.000 . . . . . . . 57 ILE H . 27055 1 609 . 1 1 57 57 ILE HA H 1 3.935 0.000 . . . . . . . 57 ILE HA . 27055 1 610 . 1 1 57 57 ILE HB H 1 1.811 0.000 . . . . . . . 57 ILE HB . 27055 1 611 . 1 1 57 57 ILE HG12 H 1 1.550 0.000 . . . . . . . 57 ILE HG12 . 27055 1 612 . 1 1 57 57 ILE HG13 H 1 0.993 0.000 . . . . . . . 57 ILE HG13 . 27055 1 613 . 1 1 57 57 ILE HG21 H 1 0.800 0.000 . . . . . . . 57 ILE QG2 . 27055 1 614 . 1 1 57 57 ILE HG22 H 1 0.800 0.000 . . . . . . . 57 ILE QG2 . 27055 1 615 . 1 1 57 57 ILE HG23 H 1 0.800 0.000 . . . . . . . 57 ILE QG2 . 27055 1 616 . 1 1 57 57 ILE HD11 H 1 0.750 0.000 . . . . . . . 57 ILE QD1 . 27055 1 617 . 1 1 57 57 ILE HD12 H 1 0.750 0.000 . . . . . . . 57 ILE QD1 . 27055 1 618 . 1 1 57 57 ILE HD13 H 1 0.750 0.000 . . . . . . . 57 ILE QD1 . 27055 1 619 . 1 1 57 57 ILE CA C 13 61.607 0.000 . . . . . . . 57 ILE CA . 27055 1 620 . 1 1 57 57 ILE CB C 13 35.337 0.000 . . . . . . . 57 ILE CB . 27055 1 621 . 1 1 57 57 ILE CG1 C 13 25.308 0.000 . . . . . . . 57 ILE CG1 . 27055 1 622 . 1 1 57 57 ILE CG2 C 13 14.926 0.000 . . . . . . . 57 ILE CG2 . 27055 1 623 . 1 1 57 57 ILE CD1 C 13 11.788 0.000 . . . . . . . 57 ILE CD1 . 27055 1 624 . 1 1 57 57 ILE N N 15 120.698 0.000 . . . . . . . 57 ILE N . 27055 1 625 . 1 1 58 58 VAL H H 1 7.475 0.000 . . . . . . . 58 VAL H . 27055 1 626 . 1 1 58 58 VAL HA H 1 3.729 0.000 . . . . . . . 58 VAL HA . 27055 1 627 . 1 1 58 58 VAL HB H 1 1.872 0.000 . . . . . . . 58 VAL HB . 27055 1 628 . 1 1 58 58 VAL HG11 H 1 0.840 0.000 . . . . . . . 58 VAL QG1 . 27055 1 629 . 1 1 58 58 VAL HG12 H 1 0.840 0.000 . . . . . . . 58 VAL QG1 . 27055 1 630 . 1 1 58 58 VAL HG13 H 1 0.840 0.000 . . . . . . . 58 VAL QG1 . 27055 1 631 . 1 1 58 58 VAL HG21 H 1 0.958 0.000 . . . . . . . 58 VAL QG2 . 27055 1 632 . 1 1 58 58 VAL HG22 H 1 0.958 0.000 . . . . . . . 58 VAL QG2 . 27055 1 633 . 1 1 58 58 VAL HG23 H 1 0.958 0.000 . . . . . . . 58 VAL QG2 . 27055 1 634 . 1 1 58 58 VAL CA C 13 63.403 0.000 . . . . . . . 58 VAL CA . 27055 1 635 . 1 1 58 58 VAL CB C 13 29.529 0.000 . . . . . . . 58 VAL CB . 27055 1 636 . 1 1 58 58 VAL CG1 C 13 18.315 0.000 . . . . . . . 58 VAL CG1 . 27055 1 637 . 1 1 58 58 VAL CG2 C 13 20.111 0.000 . . . . . . . 58 VAL CG2 . 27055 1 638 . 1 1 58 58 VAL N N 15 122.374 0.000 . . . . . . . 58 VAL N . 27055 1 639 . 1 1 59 59 GLU H H 1 7.757 0.000 . . . . . . . 59 GLU H . 27055 1 640 . 1 1 59 59 GLU HA H 1 3.967 0.000 . . . . . . . 59 GLU HA . 27055 1 641 . 1 1 59 59 GLU HB2 H 1 2.006 0.000 . . . . . . . 59 GLU QB . 27055 1 642 . 1 1 59 59 GLU HB3 H 1 2.006 0.000 . . . . . . . 59 GLU QB . 27055 1 643 . 1 1 59 59 GLU HG2 H 1 2.216 0.000 . . . . . . . 59 GLU QG . 27055 1 644 . 1 1 59 59 GLU HG3 H 1 2.216 0.000 . . . . . . . 59 GLU QG . 27055 1 645 . 1 1 59 59 GLU CA C 13 56.674 0.000 . . . . . . . 59 GLU CA . 27055 1 646 . 1 1 59 59 GLU CB C 13 28.303 0.000 . . . . . . . 59 GLU CB . 27055 1 647 . 1 1 59 59 GLU CG C 13 35.000 0.000 . . . . . . . 59 GLU CG . 27055 1 648 . 1 1 59 59 GLU N N 15 121.345 0.000 . . . . . . . 59 GLU N . 27055 1 649 . 1 1 60 60 ALA H H 1 7.731 0.000 . . . . . . . 60 ALA H . 27055 1 650 . 1 1 60 60 ALA HA H 1 3.920 0.000 . . . . . . . 60 ALA HA . 27055 1 651 . 1 1 60 60 ALA HB1 H 1 1.555 0.000 . . . . . . . 60 ALA HB . 27055 1 652 . 1 1 60 60 ALA HB2 H 1 1.555 0.000 . . . . . . . 60 ALA HB . 27055 1 653 . 1 1 60 60 ALA HB3 H 1 1.555 0.000 . . . . . . . 60 ALA HB . 27055 1 654 . 1 1 60 60 ALA CA C 13 53.067 0.000 . . . . . . . 60 ALA CA . 27055 1 655 . 1 1 60 60 ALA CB C 13 14.020 0.000 . . . . . . . 60 ALA CB . 27055 1 656 . 1 1 60 60 ALA N N 15 123.368 0.000 . . . . . . . 60 ALA N . 27055 1 657 . 1 1 61 61 ALA H H 1 8.362 0.000 . . . . . . . 61 ALA H . 27055 1 658 . 1 1 61 61 ALA HA H 1 4.059 0.000 . . . . . . . 61 ALA HA . 27055 1 659 . 1 1 61 61 ALA HB1 H 1 1.488 0.000 . . . . . . . 61 ALA HB . 27055 1 660 . 1 1 61 61 ALA HB2 H 1 1.488 0.000 . . . . . . . 61 ALA HB . 27055 1 661 . 1 1 61 61 ALA HB3 H 1 1.488 0.000 . . . . . . . 61 ALA HB . 27055 1 662 . 1 1 61 61 ALA CA C 13 52.698 0.000 . . . . . . . 61 ALA CA . 27055 1 663 . 1 1 61 61 ALA CB C 13 15.653 0.000 . . . . . . . 61 ALA CB . 27055 1 664 . 1 1 61 61 ALA N N 15 120.957 0.000 . . . . . . . 61 ALA N . 27055 1 665 . 1 1 62 62 GLN H H 1 8.127 0.000 . . . . . . . 62 GLN H . 27055 1 666 . 1 1 62 62 GLN HA H 1 3.939 0.000 . . . . . . . 62 GLN HA . 27055 1 667 . 1 1 62 62 GLN HB2 H 1 2.121 0.000 . . . . . . . 62 GLN HB2 . 27055 1 668 . 1 1 62 62 GLN HB3 H 1 1.996 0.000 . . . . . . . 62 GLN HB3 . 27055 1 669 . 1 1 62 62 GLN HG2 H 1 2.302 0.000 . . . . . . . 62 GLN HG2 . 27055 1 670 . 1 1 62 62 GLN HG3 H 1 2.490 0.000 . . . . . . . 62 GLN HG3 . 27055 1 671 . 1 1 62 62 GLN HE21 H 1 7.305 0.000 . . . . . . . 62 GLN HE21 . 27055 1 672 . 1 1 62 62 GLN HE22 H 1 6.732 0.000 . . . . . . . 62 GLN HE22 . 27055 1 673 . 1 1 62 62 GLN CA C 13 56.169 0.000 . . . . . . . 62 GLN CA . 27055 1 674 . 1 1 62 62 GLN CB C 13 26.110 0.000 . . . . . . . 62 GLN CB . 27055 1 675 . 1 1 62 62 GLN CG C 13 31.923 0.000 . . . . . . . 62 GLN CG . 27055 1 676 . 1 1 62 62 GLN N N 15 118.478 0.000 . . . . . . . 62 GLN N . 27055 1 677 . 1 1 62 62 GLN NE2 N 15 112.708 0.000 . . . . . . . 62 GLN NE2 . 27055 1 678 . 1 1 63 63 LEU H H 1 7.869 0.000 . . . . . . . 63 LEU H . 27055 1 679 . 1 1 63 63 LEU HA H 1 4.127 0.000 . . . . . . . 63 LEU HA . 27055 1 680 . 1 1 63 63 LEU HB2 H 1 1.729 0.000 . . . . . . . 63 LEU HB2 . 27055 1 681 . 1 1 63 63 LEU HB3 H 1 1.529 0.000 . . . . . . . 63 LEU HB3 . 27055 1 682 . 1 1 63 63 LEU HG H 1 0.757 0.000 . . . . . . . 63 LEU HG . 27055 1 683 . 1 1 63 63 LEU HD21 H 1 0.846 0.000 . . . . . . . 63 LEU QD2 . 27055 1 684 . 1 1 63 63 LEU HD22 H 1 0.846 0.000 . . . . . . . 63 LEU QD2 . 27055 1 685 . 1 1 63 63 LEU HD23 H 1 0.846 0.000 . . . . . . . 63 LEU QD2 . 27055 1 686 . 1 1 63 63 LEU CA C 13 54.812 0.000 . . . . . . . 63 LEU CA . 27055 1 687 . 1 1 63 63 LEU CB C 13 38.153 0.000 . . . . . . . 63 LEU CB . 27055 1 688 . 1 1 63 63 LEU CG C 13 24.163 0.000 . . . . . . . 63 LEU CG . 27055 1 689 . 1 1 63 63 LEU CD2 C 13 20.729 0.000 . . . . . . . 63 LEU CD2 . 27055 1 690 . 1 1 63 63 LEU N N 15 121.347 0.000 . . . . . . . 63 LEU N . 27055 1 691 . 1 1 64 64 LEU H H 1 8.291 0.000 . . . . . . . 64 LEU H . 27055 1 692 . 1 1 64 64 LEU HA H 1 3.456 0.000 . . . . . . . 64 LEU HA . 27055 1 693 . 1 1 64 64 LEU HB2 H 1 1.460 0.000 . . . . . . . 64 LEU HB2 . 27055 1 694 . 1 1 64 64 LEU HB3 H 1 1.101 0.000 . . . . . . . 64 LEU HB3 . 27055 1 695 . 1 1 64 64 LEU HG H 1 1.452 0.000 . . . . . . . 64 LEU HG . 27055 1 696 . 1 1 64 64 LEU HD11 H 1 0.072 0.000 . . . . . . . 64 LEU QD1 . 27055 1 697 . 1 1 64 64 LEU HD12 H 1 0.072 0.000 . . . . . . . 64 LEU QD1 . 27055 1 698 . 1 1 64 64 LEU HD13 H 1 0.072 0.000 . . . . . . . 64 LEU QD1 . 27055 1 699 . 1 1 64 64 LEU HD21 H 1 0.684 0.000 . . . . . . . 64 LEU QD2 . 27055 1 700 . 1 1 64 64 LEU HD22 H 1 0.684 0.000 . . . . . . . 64 LEU QD2 . 27055 1 701 . 1 1 64 64 LEU HD23 H 1 0.684 0.000 . . . . . . . 64 LEU QD2 . 27055 1 702 . 1 1 64 64 LEU CA C 13 56.708 0.000 . . . . . . . 64 LEU CA . 27055 1 703 . 1 1 64 64 LEU CB C 13 38.817 0.000 . . . . . . . 64 LEU CB . 27055 1 704 . 1 1 64 64 LEU CG C 13 25.372 0.000 . . . . . . . 64 LEU CG . 27055 1 705 . 1 1 64 64 LEU CD1 C 13 22.591 0.000 . . . . . . . 64 LEU CD1 . 27055 1 706 . 1 1 64 64 LEU CD2 C 13 19.738 0.000 . . . . . . . 64 LEU CD2 . 27055 1 707 . 1 1 64 64 LEU N N 15 121.255 0.000 . . . . . . . 64 LEU N . 27055 1 708 . 1 1 65 65 GLN H H 1 8.229 0.000 . . . . . . . 65 GLN H . 27055 1 709 . 1 1 65 65 GLN HA H 1 4.470 0.000 . . . . . . . 65 GLN HA . 27055 1 710 . 1 1 65 65 GLN HB2 H 1 1.657 0.000 . . . . . . . 65 GLN HB2 . 27055 1 711 . 1 1 65 65 GLN HB3 H 1 1.797 0.000 . . . . . . . 65 GLN HB3 . 27055 1 712 . 1 1 65 65 GLN HG2 H 1 2.095 0.000 . . . . . . . 65 GLN HG2 . 27055 1 713 . 1 1 65 65 GLN HG3 H 1 2.257 0.000 . . . . . . . 65 GLN HG3 . 27055 1 714 . 1 1 65 65 GLN HE22 H 1 7.820 0.000 . . . . . . . 65 GLN HE22 . 27055 1 715 . 1 1 65 65 GLN CA C 13 51.211 0.000 . . . . . . . 65 GLN CA . 27055 1 716 . 1 1 65 65 GLN CB C 13 28.867 0.000 . . . . . . . 65 GLN CB . 27055 1 717 . 1 1 65 65 GLN CG C 13 29.661 0.000 . . . . . . . 65 GLN CG . 27055 1 718 . 1 1 65 65 GLN N N 15 122.419 0.000 . . . . . . . 65 GLN N . 27055 1 719 . 1 1 66 66 ILE H H 1 7.720 0.000 . . . . . . . 66 ILE H . 27055 1 720 . 1 1 66 66 ILE HA H 1 3.547 0.000 . . . . . . . 66 ILE HA . 27055 1 721 . 1 1 66 66 ILE HB H 1 1.890 0.000 . . . . . . . 66 ILE HB . 27055 1 722 . 1 1 66 66 ILE HG12 H 1 1.743 0.000 . . . . . . . 66 ILE HG12 . 27055 1 723 . 1 1 66 66 ILE HG13 H 1 1.100 0.000 . . . . . . . 66 ILE HG13 . 27055 1 724 . 1 1 66 66 ILE HG21 H 1 0.728 0.000 . . . . . . . 66 ILE QG2 . 27055 1 725 . 1 1 66 66 ILE HG22 H 1 0.728 0.000 . . . . . . . 66 ILE QG2 . 27055 1 726 . 1 1 66 66 ILE HG23 H 1 0.728 0.000 . . . . . . . 66 ILE QG2 . 27055 1 727 . 1 1 66 66 ILE HD11 H 1 0.890 0.000 . . . . . . . 66 ILE QD1 . 27055 1 728 . 1 1 66 66 ILE HD12 H 1 0.890 0.000 . . . . . . . 66 ILE QD1 . 27055 1 729 . 1 1 66 66 ILE HD13 H 1 0.890 0.000 . . . . . . . 66 ILE QD1 . 27055 1 730 . 1 1 66 66 ILE CA C 13 61.948 0.000 . . . . . . . 66 ILE CA . 27055 1 731 . 1 1 66 66 ILE CB C 13 36.005 0.000 . . . . . . . 66 ILE CB . 27055 1 732 . 1 1 66 66 ILE CG1 C 13 26.914 0.000 . . . . . . . 66 ILE CG1 . 27055 1 733 . 1 1 66 66 ILE CG2 C 13 14.590 0.000 . . . . . . . 66 ILE CG2 . 27055 1 734 . 1 1 66 66 ILE CD1 C 13 11.097 0.000 . . . . . . . 66 ILE CD1 . 27055 1 735 . 1 1 66 66 ILE N N 15 121.334 0.000 . . . . . . . 66 ILE N . 27055 1 736 . 1 1 67 67 LEU H H 1 8.281 0.000 . . . . . . . 67 LEU H . 27055 1 737 . 1 1 67 67 LEU HA H 1 3.724 0.000 . . . . . . . 67 LEU HA . 27055 1 738 . 1 1 67 67 LEU HB2 H 1 1.078 0.000 . . . . . . . 67 LEU HB2 . 27055 1 739 . 1 1 67 67 LEU HB3 H 1 1.702 0.000 . . . . . . . 67 LEU HB3 . 27055 1 740 . 1 1 67 67 LEU HG H 1 0.511 0.000 . . . . . . . 67 LEU HG . 27055 1 741 . 1 1 67 67 LEU HD11 H 1 0.728 0.000 . . . . . . . 67 LEU QD1 . 27055 1 742 . 1 1 67 67 LEU HD12 H 1 0.728 0.000 . . . . . . . 67 LEU QD1 . 27055 1 743 . 1 1 67 67 LEU HD13 H 1 0.728 0.000 . . . . . . . 67 LEU QD1 . 27055 1 744 . 1 1 67 67 LEU HD21 H 1 0.372 0.000 . . . . . . . 67 LEU QD2 . 27055 1 745 . 1 1 67 67 LEU HD22 H 1 0.372 0.000 . . . . . . . 67 LEU QD2 . 27055 1 746 . 1 1 67 67 LEU HD23 H 1 0.372 0.000 . . . . . . . 67 LEU QD2 . 27055 1 747 . 1 1 67 67 LEU CA C 13 54.433 0.000 . . . . . . . 67 LEU CA . 27055 1 748 . 1 1 67 67 LEU CB C 13 39.348 0.000 . . . . . . . 67 LEU CB . 27055 1 749 . 1 1 67 67 LEU CG C 13 23.142 0.000 . . . . . . . 67 LEU CG . 27055 1 750 . 1 1 67 67 LEU CD1 C 13 14.555 0.000 . . . . . . . 67 LEU CD1 . 27055 1 751 . 1 1 67 67 LEU CD2 C 13 19.701 0.000 . . . . . . . 67 LEU CD2 . 27055 1 752 . 1 1 67 67 LEU N N 15 117.947 0.000 . . . . . . . 67 LEU N . 27055 1 753 . 1 1 68 68 GLN H H 1 8.492 0.000 . . . . . . . 68 GLN H . 27055 1 754 . 1 1 68 68 GLN HA H 1 3.935 0.000 . . . . . . . 68 GLN HA . 27055 1 755 . 1 1 68 68 GLN HB2 H 1 1.921 0.000 . . . . . . . 68 GLN HB2 . 27055 1 756 . 1 1 68 68 GLN HB3 H 1 1.992 0.000 . . . . . . . 68 GLN HB3 . 27055 1 757 . 1 1 68 68 GLN HG2 H 1 2.273 0.000 . . . . . . . 68 GLN QG . 27055 1 758 . 1 1 68 68 GLN HG3 H 1 2.273 0.000 . . . . . . . 68 GLN QG . 27055 1 759 . 1 1 68 68 GLN HE22 H 1 7.124 0.000 . . . . . . . 68 GLN HE22 . 27055 1 760 . 1 1 68 68 GLN CA C 13 55.959 0.000 . . . . . . . 68 GLN CA . 27055 1 761 . 1 1 68 68 GLN CB C 13 25.555 0.000 . . . . . . . 68 GLN CB . 27055 1 762 . 1 1 68 68 GLN CG C 13 32.410 0.000 . . . . . . . 68 GLN CG . 27055 1 763 . 1 1 68 68 GLN N N 15 117.605 0.000 . . . . . . . 68 GLN N . 27055 1 764 . 1 1 68 68 GLN NE2 N 15 111.939 0.000 . . . . . . . 68 GLN NE2 . 27055 1 765 . 1 1 69 69 ALA H H 1 7.163 0.000 . . . . . . . 69 ALA H . 27055 1 766 . 1 1 69 69 ALA HA H 1 4.321 0.000 . . . . . . . 69 ALA HA . 27055 1 767 . 1 1 69 69 ALA HB1 H 1 1.371 0.000 . . . . . . . 69 ALA HB . 27055 1 768 . 1 1 69 69 ALA HB2 H 1 1.371 0.000 . . . . . . . 69 ALA HB . 27055 1 769 . 1 1 69 69 ALA HB3 H 1 1.371 0.000 . . . . . . . 69 ALA HB . 27055 1 770 . 1 1 69 69 ALA CA C 13 49.218 0.000 . . . . . . . 69 ALA CA . 27055 1 771 . 1 1 69 69 ALA CB C 13 16.854 0.000 . . . . . . . 69 ALA CB . 27055 1 772 . 1 1 69 69 ALA N N 15 121.649 0.000 . . . . . . . 69 ALA N . 27055 1 773 . 1 1 70 70 LEU H H 1 6.653 0.000 . . . . . . . 70 LEU H . 27055 1 774 . 1 1 70 70 LEU HA H 1 3.877 0.000 . . . . . . . 70 LEU HA . 27055 1 775 . 1 1 70 70 LEU HB2 H 1 1.545 0.000 . . . . . . . 70 LEU HB2 . 27055 1 776 . 1 1 70 70 LEU HB3 H 1 1.439 0.000 . . . . . . . 70 LEU HB3 . 27055 1 777 . 1 1 70 70 LEU HG H 1 1.870 0.000 . . . . . . . 70 LEU HG . 27055 1 778 . 1 1 70 70 LEU HD11 H 1 0.510 0.000 . . . . . . . 70 LEU QD1 . 27055 1 779 . 1 1 70 70 LEU HD12 H 1 0.510 0.000 . . . . . . . 70 LEU QD1 . 27055 1 780 . 1 1 70 70 LEU HD13 H 1 0.510 0.000 . . . . . . . 70 LEU QD1 . 27055 1 781 . 1 1 70 70 LEU HD21 H 1 0.594 0.000 . . . . . . . 70 LEU QD2 . 27055 1 782 . 1 1 70 70 LEU HD22 H 1 0.594 0.000 . . . . . . . 70 LEU QD2 . 27055 1 783 . 1 1 70 70 LEU HD23 H 1 0.594 0.000 . . . . . . . 70 LEU QD2 . 27055 1 784 . 1 1 70 70 LEU CA C 13 53.565 0.000 . . . . . . . 70 LEU CA . 27055 1 785 . 1 1 70 70 LEU CB C 13 40.040 0.000 . . . . . . . 70 LEU CB . 27055 1 786 . 1 1 70 70 LEU CG C 13 23.220 0.000 . . . . . . . 70 LEU CG . 27055 1 787 . 1 1 70 70 LEU CD1 C 13 23.059 0.000 . . . . . . . 70 LEU CD1 . 27055 1 788 . 1 1 70 70 LEU CD2 C 13 19.877 0.000 . . . . . . . 70 LEU CD2 . 27055 1 789 . 1 1 70 70 LEU N N 15 121.010 0.000 . . . . . . . 70 LEU N . 27055 1 790 . 1 1 71 71 HIS H H 1 8.211 0.000 . . . . . . . 71 HIS H . 27055 1 791 . 1 1 71 71 HIS HA H 1 4.333 0.000 . . . . . . . 71 HIS HA . 27055 1 792 . 1 1 71 71 HIS HB2 H 1 2.965 0.000 . . . . . . . 71 HIS HB2 . 27055 1 793 . 1 1 71 71 HIS HB3 H 1 2.885 0.000 . . . . . . . 71 HIS HB3 . 27055 1 794 . 1 1 71 71 HIS HD2 H 1 6.893 0.000 . . . . . . . 71 HIS HD2 . 27055 1 795 . 1 1 71 71 HIS CA C 13 51.254 0.000 . . . . . . . 71 HIS CA . 27055 1 796 . 1 1 71 71 HIS CB C 13 29.119 0.000 . . . . . . . 71 HIS CB . 27055 1 797 . 1 1 71 71 HIS CD2 C 13 122.000 0.000 . . . . . . . 71 HIS CD2 . 27055 1 798 . 1 1 71 71 HIS N N 15 122.123 0.000 . . . . . . . 71 HIS N . 27055 1 799 . 1 1 72 72 PRO HA H 1 4.498 0.000 . . . . . . . 72 PRO HA . 27055 1 800 . 1 1 72 72 PRO HB2 H 1 2.301 0.000 . . . . . . . 72 PRO HB2 . 27055 1 801 . 1 1 72 72 PRO HB3 H 1 1.931 0.000 . . . . . . . 72 PRO HB3 . 27055 1 802 . 1 1 72 72 PRO HG2 H 1 1.896 0.000 . . . . . . . 72 PRO HG2 . 27055 1 803 . 1 1 72 72 PRO HG3 H 1 1.813 0.000 . . . . . . . 72 PRO HG3 . 27055 1 804 . 1 1 72 72 PRO HD2 H 1 3.396 0.000 . . . . . . . 72 PRO HD2 . 27055 1 805 . 1 1 72 72 PRO HD3 H 1 3.625 0.000 . . . . . . . 72 PRO HD3 . 27055 1 806 . 1 1 72 72 PRO CA C 13 59.938 0.000 . . . . . . . 72 PRO CA . 27055 1 807 . 1 1 72 72 PRO CB C 13 30.138 0.000 . . . . . . . 72 PRO CB . 27055 1 808 . 1 1 72 72 PRO CG C 13 25.175 0.000 . . . . . . . 72 PRO CG . 27055 1 809 . 1 1 72 72 PRO CD C 13 47.463 0.000 . . . . . . . 72 PRO CD . 27055 1 810 . 1 1 73 73 PRO HA H 1 4.493 0.000 . . . . . . . 73 PRO HA . 27055 1 811 . 1 1 73 73 PRO HB2 H 1 2.303 0.000 . . . . . . . 73 PRO QB . 27055 1 812 . 1 1 73 73 PRO HB3 H 1 2.303 0.000 . . . . . . . 73 PRO QB . 27055 1 813 . 1 1 73 73 PRO HG2 H 1 1.780 0.000 . . . . . . . 73 PRO HG2 . 27055 1 814 . 1 1 73 73 PRO HG3 H 1 1.715 0.000 . . . . . . . 73 PRO HG3 . 27055 1 815 . 1 1 73 73 PRO HD2 H 1 3.441 0.000 . . . . . . . 73 PRO HD2 . 27055 1 816 . 1 1 73 73 PRO HD3 H 1 3.379 0.000 . . . . . . . 73 PRO HD3 . 27055 1 817 . 1 1 73 73 PRO CA C 13 59.878 0.000 . . . . . . . 73 PRO CA . 27055 1 818 . 1 1 73 73 PRO CB C 13 30.147 0.000 . . . . . . . 73 PRO CB . 27055 1 819 . 1 1 73 73 PRO CG C 13 22.954 0.000 . . . . . . . 73 PRO CG . 27055 1 820 . 1 1 73 73 PRO CD C 13 47.471 0.000 . . . . . . . 73 PRO CD . 27055 1 821 . 1 1 74 74 LEU H H 1 8.386 0.000 . . . . . . . 74 LEU H . 27055 1 822 . 1 1 74 74 LEU HA H 1 3.928 0.000 . . . . . . . 74 LEU HA . 27055 1 823 . 1 1 74 74 LEU HB2 H 1 1.165 0.000 . . . . . . . 74 LEU HB2 . 27055 1 824 . 1 1 74 74 LEU HB3 H 1 1.704 0.000 . . . . . . . 74 LEU HB3 . 27055 1 825 . 1 1 74 74 LEU HG H 1 1.178 0.000 . . . . . . . 74 LEU HG . 27055 1 826 . 1 1 74 74 LEU HD11 H 1 0.599 0.000 . . . . . . . 74 LEU QD1 . 27055 1 827 . 1 1 74 74 LEU HD12 H 1 0.599 0.000 . . . . . . . 74 LEU QD1 . 27055 1 828 . 1 1 74 74 LEU HD13 H 1 0.599 0.000 . . . . . . . 74 LEU QD1 . 27055 1 829 . 1 1 74 74 LEU HD21 H 1 0.776 0.000 . . . . . . . 74 LEU QD2 . 27055 1 830 . 1 1 74 74 LEU HD22 H 1 0.776 0.000 . . . . . . . 74 LEU QD2 . 27055 1 831 . 1 1 74 74 LEU HD23 H 1 0.776 0.000 . . . . . . . 74 LEU QD2 . 27055 1 832 . 1 1 74 74 LEU CA C 13 53.584 0.000 . . . . . . . 74 LEU CA . 27055 1 833 . 1 1 74 74 LEU CB C 13 39.648 0.000 . . . . . . . 74 LEU CB . 27055 1 834 . 1 1 74 74 LEU CG C 13 24.682 0.000 . . . . . . . 74 LEU CG . 27055 1 835 . 1 1 74 74 LEU CD1 C 13 24.465 0.000 . . . . . . . 74 LEU CD1 . 27055 1 836 . 1 1 74 74 LEU CD2 C 13 20.116 0.000 . . . . . . . 74 LEU CD2 . 27055 1 837 . 1 1 74 74 LEU N N 15 123.286 0.000 . . . . . . . 74 LEU N . 27055 1 838 . 1 1 75 75 THR H H 1 8.123 0.000 . . . . . . . 75 THR H . 27055 1 839 . 1 1 75 75 THR HA H 1 5.255 0.000 . . . . . . . 75 THR HA . 27055 1 840 . 1 1 75 75 THR HB H 1 3.699 0.000 . . . . . . . 75 THR HB . 27055 1 841 . 1 1 75 75 THR HG21 H 1 0.859 0.000 . . . . . . . 75 THR QG2 . 27055 1 842 . 1 1 75 75 THR HG22 H 1 0.859 0.000 . . . . . . . 75 THR QG2 . 27055 1 843 . 1 1 75 75 THR HG23 H 1 0.859 0.000 . . . . . . . 75 THR QG2 . 27055 1 844 . 1 1 75 75 THR CA C 13 57.334 0.000 . . . . . . . 75 THR CA . 27055 1 845 . 1 1 75 75 THR CB C 13 69.231 0.000 . . . . . . . 75 THR CB . 27055 1 846 . 1 1 75 75 THR CG2 C 13 17.812 0.000 . . . . . . . 75 THR CG2 . 27055 1 847 . 1 1 75 75 THR N N 15 123.191 0.000 . . . . . . . 75 THR N . 27055 1 848 . 1 1 76 76 ILE H H 1 8.282 0.000 . . . . . . . 76 ILE H . 27055 1 849 . 1 1 76 76 ILE HA H 1 4.151 0.000 . . . . . . . 76 ILE HA . 27055 1 850 . 1 1 76 76 ILE HB H 1 1.553 0.000 . . . . . . . 76 ILE HB . 27055 1 851 . 1 1 76 76 ILE HG12 H 1 0.759 0.000 . . . . . . . 76 ILE HG12 . 27055 1 852 . 1 1 76 76 ILE HG13 H 1 1.285 0.000 . . . . . . . 76 ILE HG13 . 27055 1 853 . 1 1 76 76 ILE HG21 H 1 0.561 0.000 . . . . . . . 76 ILE QG2 . 27055 1 854 . 1 1 76 76 ILE HG22 H 1 0.561 0.000 . . . . . . . 76 ILE QG2 . 27055 1 855 . 1 1 76 76 ILE HG23 H 1 0.561 0.000 . . . . . . . 76 ILE QG2 . 27055 1 856 . 1 1 76 76 ILE HD11 H 1 0.586 0.000 . . . . . . . 76 ILE QD1 . 27055 1 857 . 1 1 76 76 ILE HD12 H 1 0.586 0.000 . . . . . . . 76 ILE QD1 . 27055 1 858 . 1 1 76 76 ILE HD13 H 1 0.586 0.000 . . . . . . . 76 ILE QD1 . 27055 1 859 . 1 1 76 76 ILE CA C 13 58.189 0.000 . . . . . . . 76 ILE CA . 27055 1 860 . 1 1 76 76 ILE CB C 13 37.750 0.000 . . . . . . . 76 ILE CB . 27055 1 861 . 1 1 76 76 ILE CG1 C 13 24.152 0.000 . . . . . . . 76 ILE CG1 . 27055 1 862 . 1 1 76 76 ILE CG2 C 13 14.108 0.000 . . . . . . . 76 ILE CG2 . 27055 1 863 . 1 1 76 76 ILE CD1 C 13 11.421 0.000 . . . . . . . 76 ILE CD1 . 27055 1 864 . 1 1 76 76 ILE N N 15 123.188 0.000 . . . . . . . 76 ILE N . 27055 1 865 . 1 1 77 77 ASP H H 1 9.795 0.000 . . . . . . . 77 ASP H . 27055 1 866 . 1 1 77 77 ASP HA H 1 4.263 0.000 . . . . . . . 77 ASP HA . 27055 1 867 . 1 1 77 77 ASP HB2 H 1 2.777 0.000 . . . . . . . 77 ASP HB2 . 27055 1 868 . 1 1 77 77 ASP HB3 H 1 2.401 0.000 . . . . . . . 77 ASP HB3 . 27055 1 869 . 1 1 77 77 ASP CA C 13 53.210 0.000 . . . . . . . 77 ASP CA . 27055 1 870 . 1 1 77 77 ASP CB C 13 37.365 0.000 . . . . . . . 77 ASP CB . 27055 1 871 . 1 1 77 77 ASP N N 15 132.395 0.000 . . . . . . . 77 ASP N . 27055 1 872 . 1 1 78 78 GLY H H 1 8.586 0.000 . . . . . . . 78 GLY H . 27055 1 873 . 1 1 78 78 GLY HA2 H 1 3.488 0.000 . . . . . . . 78 GLY HA2 . 27055 1 874 . 1 1 78 78 GLY HA3 H 1 4.019 0.000 . . . . . . . 78 GLY HA3 . 27055 1 875 . 1 1 78 78 GLY CA C 13 42.978 0.000 . . . . . . . 78 GLY CA . 27055 1 876 . 1 1 78 78 GLY N N 15 104.027 0.000 . . . . . . . 78 GLY N . 27055 1 877 . 1 1 79 79 LYS H H 1 7.398 0.000 . . . . . . . 79 LYS H . 27055 1 878 . 1 1 79 79 LYS HA H 1 4.597 0.000 . . . . . . . 79 LYS HA . 27055 1 879 . 1 1 79 79 LYS HB2 H 1 1.715 0.000 . . . . . . . 79 LYS HB2 . 27055 1 880 . 1 1 79 79 LYS HB3 H 1 1.933 0.000 . . . . . . . 79 LYS HB3 . 27055 1 881 . 1 1 79 79 LYS HG3 H 1 1.365 0.000 . . . . . . . 79 LYS HG3 . 27055 1 882 . 1 1 79 79 LYS CA C 13 50.356 0.000 . . . . . . . 79 LYS CA . 27055 1 883 . 1 1 79 79 LYS CB C 13 31.245 0.000 . . . . . . . 79 LYS CB . 27055 1 884 . 1 1 79 79 LYS CG C 13 21.148 0.000 . . . . . . . 79 LYS CG . 27055 1 885 . 1 1 79 79 LYS N N 15 121.799 0.000 . . . . . . . 79 LYS N . 27055 1 886 . 1 1 80 80 THR H H 1 8.556 0.000 . . . . . . . 80 THR H . 27055 1 887 . 1 1 80 80 THR HA H 1 4.362 0.000 . . . . . . . 80 THR HA . 27055 1 888 . 1 1 80 80 THR HB H 1 3.921 0.000 . . . . . . . 80 THR HB . 27055 1 889 . 1 1 80 80 THR HG21 H 1 1.046 0.000 . . . . . . . 80 THR QG2 . 27055 1 890 . 1 1 80 80 THR HG22 H 1 1.046 0.000 . . . . . . . 80 THR QG2 . 27055 1 891 . 1 1 80 80 THR HG23 H 1 1.046 0.000 . . . . . . . 80 THR QG2 . 27055 1 892 . 1 1 80 80 THR CA C 13 60.405 0.000 . . . . . . . 80 THR CA . 27055 1 893 . 1 1 80 80 THR CB C 13 66.146 0.000 . . . . . . . 80 THR CB . 27055 1 894 . 1 1 80 80 THR CG2 C 13 19.870 0.000 . . . . . . . 80 THR CG2 . 27055 1 895 . 1 1 80 80 THR N N 15 120.724 0.000 . . . . . . . 80 THR N . 27055 1 896 . 1 1 81 81 ILE H H 1 8.468 0.000 . . . . . . . 81 ILE H . 27055 1 897 . 1 1 81 81 ILE HA H 1 4.379 0.000 . . . . . . . 81 ILE HA . 27055 1 898 . 1 1 81 81 ILE HB H 1 1.722 0.000 . . . . . . . 81 ILE HB . 27055 1 899 . 1 1 81 81 ILE HG12 H 1 1.682 0.000 . . . . . . . 81 ILE QG1 . 27055 1 900 . 1 1 81 81 ILE HG13 H 1 1.682 0.000 . . . . . . . 81 ILE QG1 . 27055 1 901 . 1 1 81 81 ILE HG21 H 1 0.785 0.000 . . . . . . . 81 ILE QG2 . 27055 1 902 . 1 1 81 81 ILE HG22 H 1 0.785 0.000 . . . . . . . 81 ILE QG2 . 27055 1 903 . 1 1 81 81 ILE HG23 H 1 0.785 0.000 . . . . . . . 81 ILE QG2 . 27055 1 904 . 1 1 81 81 ILE HD11 H 1 0.457 0.000 . . . . . . . 81 ILE QD1 . 27055 1 905 . 1 1 81 81 ILE HD12 H 1 0.457 0.000 . . . . . . . 81 ILE QD1 . 27055 1 906 . 1 1 81 81 ILE HD13 H 1 0.457 0.000 . . . . . . . 81 ILE QD1 . 27055 1 907 . 1 1 81 81 ILE CA C 13 55.016 0.000 . . . . . . . 81 ILE CA . 27055 1 908 . 1 1 81 81 ILE CB C 13 35.109 0.000 . . . . . . . 81 ILE CB . 27055 1 909 . 1 1 81 81 ILE CG1 C 13 25.054 0.000 . . . . . . . 81 ILE CG1 . 27055 1 910 . 1 1 81 81 ILE CG2 C 13 16.814 0.000 . . . . . . . 81 ILE CG2 . 27055 1 911 . 1 1 81 81 ILE CD1 C 13 8.091 0.000 . . . . . . . 81 ILE CD1 . 27055 1 912 . 1 1 81 81 ILE N N 15 131.108 0.000 . . . . . . . 81 ILE N . 27055 1 913 . 1 1 82 82 ASN H H 1 7.801 0.000 . . . . . . . 82 ASN H . 27055 1 914 . 1 1 82 82 ASN HA H 1 4.882 0.000 . . . . . . . 82 ASN HA . 27055 1 915 . 1 1 82 82 ASN HB2 H 1 2.593 0.000 . . . . . . . 82 ASN HB2 . 27055 1 916 . 1 1 82 82 ASN HB3 H 1 2.389 0.000 . . . . . . . 82 ASN HB3 . 27055 1 917 . 1 1 82 82 ASN HD21 H 1 6.841 0.000 . . . . . . . 82 ASN HD21 . 27055 1 918 . 1 1 82 82 ASN HD22 H 1 7.529 0.000 . . . . . . . 82 ASN HD22 . 27055 1 919 . 1 1 82 82 ASN CA C 13 49.877 0.000 . . . . . . . 82 ASN CA . 27055 1 920 . 1 1 82 82 ASN CB C 13 38.823 0.000 . . . . . . . 82 ASN CB . 27055 1 921 . 1 1 82 82 ASN N N 15 125.297 0.000 . . . . . . . 82 ASN N . 27055 1 922 . 1 1 82 82 ASN ND2 N 15 113.682 0.000 . . . . . . . 82 ASN ND2 . 27055 1 923 . 1 1 83 83 VAL H H 1 8.586 0.000 . . . . . . . 83 VAL H . 27055 1 924 . 1 1 83 83 VAL HA H 1 5.039 0.000 . . . . . . . 83 VAL HA . 27055 1 925 . 1 1 83 83 VAL HB H 1 1.725 0.000 . . . . . . . 83 VAL HB . 27055 1 926 . 1 1 83 83 VAL HG11 H 1 0.680 0.000 . . . . . . . 83 VAL QG1 . 27055 1 927 . 1 1 83 83 VAL HG12 H 1 0.680 0.000 . . . . . . . 83 VAL QG1 . 27055 1 928 . 1 1 83 83 VAL HG13 H 1 0.680 0.000 . . . . . . . 83 VAL QG1 . 27055 1 929 . 1 1 83 83 VAL HG21 H 1 0.685 0.000 . . . . . . . 83 VAL QG2 . 27055 1 930 . 1 1 83 83 VAL HG22 H 1 0.685 0.000 . . . . . . . 83 VAL QG2 . 27055 1 931 . 1 1 83 83 VAL HG23 H 1 0.685 0.000 . . . . . . . 83 VAL QG2 . 27055 1 932 . 1 1 83 83 VAL CA C 13 57.659 0.000 . . . . . . . 83 VAL CA . 27055 1 933 . 1 1 83 83 VAL CB C 13 31.676 0.000 . . . . . . . 83 VAL CB . 27055 1 934 . 1 1 83 83 VAL CG1 C 13 19.677 0.000 . . . . . . . 83 VAL CG1 . 27055 1 935 . 1 1 83 83 VAL CG2 C 13 18.451 0.000 . . . . . . . 83 VAL CG2 . 27055 1 936 . 1 1 83 83 VAL N N 15 123.058 0.000 . . . . . . . 83 VAL N . 27055 1 937 . 1 1 84 84 GLU H H 1 8.250 0.000 . . . . . . . 84 GLU H . 27055 1 938 . 1 1 84 84 GLU HA H 1 4.478 0.000 . . . . . . . 84 GLU HA . 27055 1 939 . 1 1 84 84 GLU HB2 H 1 1.745 0.000 . . . . . . . 84 GLU HB2 . 27055 1 940 . 1 1 84 84 GLU HB3 H 1 2.083 0.000 . . . . . . . 84 GLU HB3 . 27055 1 941 . 1 1 84 84 GLU HG2 H 1 2.091 0.000 . . . . . . . 84 GLU HG2 . 27055 1 942 . 1 1 84 84 GLU HG3 H 1 2.008 0.000 . . . . . . . 84 GLU HG3 . 27055 1 943 . 1 1 84 84 GLU CA C 13 51.985 0.000 . . . . . . . 84 GLU CA . 27055 1 944 . 1 1 84 84 GLU CB C 13 31.665 0.000 . . . . . . . 84 GLU CB . 27055 1 945 . 1 1 84 84 GLU CG C 13 33.363 0.000 . . . . . . . 84 GLU CG . 27055 1 946 . 1 1 84 84 GLU N N 15 124.050 0.000 . . . . . . . 84 GLU N . 27055 1 947 . 1 1 85 85 PHE H H 1 8.435 0.000 . . . . . . . 85 PHE H . 27055 1 948 . 1 1 85 85 PHE HA H 1 4.778 0.000 . . . . . . . 85 PHE HA . 27055 1 949 . 1 1 85 85 PHE HB2 H 1 3.188 0.000 . . . . . . . 85 PHE HB2 . 27055 1 950 . 1 1 85 85 PHE HB3 H 1 2.700 0.000 . . . . . . . 85 PHE HB3 . 27055 1 951 . 1 1 85 85 PHE HD1 H 1 7.155 0.000 . . . . . . . 85 PHE HD1 . 27055 1 952 . 1 1 85 85 PHE HD2 H 1 7.202 0.000 . . . . . . . 85 PHE HD2 . 27055 1 953 . 1 1 85 85 PHE HE1 H 1 7.065 0.000 . . . . . . . 85 PHE HE1 . 27055 1 954 . 1 1 85 85 PHE CA C 13 57.236 0.000 . . . . . . . 85 PHE CA . 27055 1 955 . 1 1 85 85 PHE CB C 13 37.656 0.000 . . . . . . . 85 PHE CB . 27055 1 956 . 1 1 85 85 PHE CD1 C 13 133.871 0.000 . . . . . . . 85 PHE CD1 . 27055 1 957 . 1 1 85 85 PHE CD2 C 13 133.820 0.000 . . . . . . . 85 PHE CD2 . 27055 1 958 . 1 1 85 85 PHE CE1 C 13 131.537 0.000 . . . . . . . 85 PHE CE1 . 27055 1 959 . 1 1 86 86 ALA H H 1 8.435 0.000 . . . . . . . 86 ALA H . 27055 1 960 . 1 1 86 86 ALA HA H 1 4.272 0.000 . . . . . . . 86 ALA HA . 27055 1 961 . 1 1 86 86 ALA HB1 H 1 1.304 0.000 . . . . . . . 86 ALA HB . 27055 1 962 . 1 1 86 86 ALA HB2 H 1 1.304 0.000 . . . . . . . 86 ALA HB . 27055 1 963 . 1 1 86 86 ALA HB3 H 1 1.304 0.000 . . . . . . . 86 ALA HB . 27055 1 964 . 1 1 86 86 ALA CA C 13 49.457 0.000 . . . . . . . 86 ALA CA . 27055 1 965 . 1 1 86 86 ALA CB C 13 17.032 0.000 . . . . . . . 86 ALA CB . 27055 1 966 . 1 1 86 86 ALA N N 15 125.809 0.000 . . . . . . . 86 ALA N . 27055 1 967 . 1 1 87 87 LYS H H 1 8.421 0.000 . . . . . . . 87 LYS H . 27055 1 968 . 1 1 87 87 LYS HA H 1 4.183 0.000 . . . . . . . 87 LYS HA . 27055 1 969 . 1 1 87 87 LYS HB2 H 1 1.637 0.000 . . . . . . . 87 LYS HB2 . 27055 1 970 . 1 1 87 87 LYS HB3 H 1 1.727 0.000 . . . . . . . 87 LYS HB3 . 27055 1 971 . 1 1 87 87 LYS HG2 H 1 1.315 0.000 . . . . . . . 87 LYS HG2 . 27055 1 972 . 1 1 87 87 LYS HG3 H 1 1.355 0.000 . . . . . . . 87 LYS HG3 . 27055 1 973 . 1 1 87 87 LYS CA C 13 53.759 0.000 . . . . . . . 87 LYS CA . 27055 1 974 . 1 1 87 87 LYS CB C 13 31.065 0.000 . . . . . . . 87 LYS CB . 27055 1 975 . 1 1 87 87 LYS CG C 13 22.383 0.000 . . . . . . . 87 LYS CG . 27055 1 976 . 1 1 87 87 LYS N N 15 122.635 0.000 . . . . . . . 87 LYS N . 27055 1 977 . 1 1 88 88 GLY H H 1 8.308 0.000 . . . . . . . 88 GLY H . 27055 1 978 . 1 1 88 88 GLY HA2 H 1 3.721 0.000 . . . . . . . 88 GLY HA2 . 27055 1 979 . 1 1 88 88 GLY HA3 H 1 3.836 0.000 . . . . . . . 88 GLY HA3 . 27055 1 980 . 1 1 88 88 GLY CA C 13 42.782 0.000 . . . . . . . 88 GLY CA . 27055 1 981 . 1 1 88 88 GLY N N 15 112.045 0.000 . . . . . . . 88 GLY N . 27055 1 982 . 1 1 89 89 SER H H 1 7.786 0.000 . . . . . . . 89 SER H . 27055 1 983 . 1 1 89 89 SER HA H 1 4.114 0.000 . . . . . . . 89 SER HA . 27055 1 984 . 1 1 89 89 SER HB2 H 1 3.693 0.000 . . . . . . . 89 SER QB . 27055 1 985 . 1 1 89 89 SER HB3 H 1 3.693 0.000 . . . . . . . 89 SER QB . 27055 1 986 . 1 1 89 89 SER CA C 13 57.151 0.000 . . . . . . . 89 SER CA . 27055 1 987 . 1 1 89 89 SER CB C 13 62.160 0.000 . . . . . . . 89 SER CB . 27055 1 988 . 1 1 89 89 SER N N 15 122.523 0.000 . . . . . . . 89 SER N . 27055 1 stop_ save_