data_36185 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36185 _Entry.Title ; Solution structure of RRM domian of La protein from Trypanosoma brucei ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-05-07 _Entry.Accession_date 2018-06-13 _Entry.Last_release_date 2018-06-13 _Entry.Original_release_date 2018-06-13 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 36185 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 F. Shan F. Z. . . 36185 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'La motif' . 36185 'RNA BINDING PROTEIN' . 36185 RNA-binding . 36185 'RRM domian' . 36185 'Trypanosoma brucei' . 36185 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36185 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 195 36185 '15N chemical shifts' 91 36185 '1H chemical shifts' 611 36185 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2019-05-13 . original BMRB . 36185 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5ZUH . 36185 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36185 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30993866 _Citation.Full_citation . _Citation.Title ; A telomerase subunit homolog La protein from Trypanosoma brucei plays an essential role in ribosomal biogenesis ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Fangzhen Shan F. . . . 36185 1 2 Song Mei S. . . . 36185 1 3 Jiahai Zhang J. . . . 36185 1 4 Xuecheng Zhang X. . . . 36185 1 5 Chao Xu C. . . . 36185 1 6 Shanhui Liao S. . . . 36185 1 7 Xiaoming Tu X. . . . 36185 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36185 _Assembly.ID 1 _Assembly.Name 'RNA binding protein La-like protein' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 36185 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36185 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RNA binding protein La-like protein' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; TDHQTVYVKPVPPTATLEQL TEFFSKHGTVQAVWRRYFAG KKDAPPESRTKPSVFVVFNS SEEAEAFQKAPPMYDDVQLT AEMKTTYLERKAEEIAAKK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 99 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment RRM _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11282.726 _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 12 THR . 36185 1 2 13 ASP . 36185 1 3 14 HIS . 36185 1 4 15 GLN . 36185 1 5 16 THR . 36185 1 6 17 VAL . 36185 1 7 18 TYR . 36185 1 8 19 VAL . 36185 1 9 20 LYS . 36185 1 10 21 PRO . 36185 1 11 22 VAL . 36185 1 12 23 PRO . 36185 1 13 24 PRO . 36185 1 14 25 THR . 36185 1 15 26 ALA . 36185 1 16 27 THR . 36185 1 17 28 LEU . 36185 1 18 29 GLU . 36185 1 19 30 GLN . 36185 1 20 31 LEU . 36185 1 21 32 THR . 36185 1 22 33 GLU . 36185 1 23 34 PHE . 36185 1 24 35 PHE . 36185 1 25 36 SER . 36185 1 26 37 LYS . 36185 1 27 38 HIS . 36185 1 28 39 GLY . 36185 1 29 40 THR . 36185 1 30 41 VAL . 36185 1 31 42 GLN . 36185 1 32 43 ALA . 36185 1 33 44 VAL . 36185 1 34 45 TRP . 36185 1 35 46 ARG . 36185 1 36 47 ARG . 36185 1 37 48 TYR . 36185 1 38 49 PHE . 36185 1 39 50 ALA . 36185 1 40 51 GLY . 36185 1 41 52 LYS . 36185 1 42 53 LYS . 36185 1 43 54 ASP . 36185 1 44 55 ALA . 36185 1 45 56 PRO . 36185 1 46 57 PRO . 36185 1 47 58 GLU . 36185 1 48 59 SER . 36185 1 49 60 ARG . 36185 1 50 61 THR . 36185 1 51 62 LYS . 36185 1 52 63 PRO . 36185 1 53 64 SER . 36185 1 54 65 VAL . 36185 1 55 66 PHE . 36185 1 56 67 VAL . 36185 1 57 68 VAL . 36185 1 58 69 PHE . 36185 1 59 70 ASN . 36185 1 60 71 SER . 36185 1 61 72 SER . 36185 1 62 73 GLU . 36185 1 63 74 GLU . 36185 1 64 75 ALA . 36185 1 65 76 GLU . 36185 1 66 77 ALA . 36185 1 67 78 PHE . 36185 1 68 79 GLN . 36185 1 69 80 LYS . 36185 1 70 81 ALA . 36185 1 71 82 PRO . 36185 1 72 83 PRO . 36185 1 73 84 MET . 36185 1 74 85 TYR . 36185 1 75 86 ASP . 36185 1 76 87 ASP . 36185 1 77 88 VAL . 36185 1 78 89 GLN . 36185 1 79 90 LEU . 36185 1 80 91 THR . 36185 1 81 92 ALA . 36185 1 82 93 GLU . 36185 1 83 94 MET . 36185 1 84 95 LYS . 36185 1 85 96 THR . 36185 1 86 97 THR . 36185 1 87 98 TYR . 36185 1 88 99 LEU . 36185 1 89 100 GLU . 36185 1 90 101 ARG . 36185 1 91 102 LYS . 36185 1 92 103 ALA . 36185 1 93 104 GLU . 36185 1 94 105 GLU . 36185 1 95 106 ILE . 36185 1 96 107 ALA . 36185 1 97 108 ALA . 36185 1 98 109 LYS . 36185 1 99 110 LYS . 36185 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 . THR 1 1 36185 1 . ASP 2 2 36185 1 . HIS 3 3 36185 1 . GLN 4 4 36185 1 . THR 5 5 36185 1 . VAL 6 6 36185 1 . TYR 7 7 36185 1 . VAL 8 8 36185 1 . LYS 9 9 36185 1 . PRO 10 10 36185 1 . VAL 11 11 36185 1 . PRO 12 12 36185 1 . PRO 13 13 36185 1 . THR 14 14 36185 1 . ALA 15 15 36185 1 . THR 16 16 36185 1 . LEU 17 17 36185 1 . GLU 18 18 36185 1 . GLN 19 19 36185 1 . LEU 20 20 36185 1 . THR 21 21 36185 1 . GLU 22 22 36185 1 . PHE 23 23 36185 1 . PHE 24 24 36185 1 . SER 25 25 36185 1 . LYS 26 26 36185 1 . HIS 27 27 36185 1 . GLY 28 28 36185 1 . THR 29 29 36185 1 . VAL 30 30 36185 1 . GLN 31 31 36185 1 . ALA 32 32 36185 1 . VAL 33 33 36185 1 . TRP 34 34 36185 1 . ARG 35 35 36185 1 . ARG 36 36 36185 1 . TYR 37 37 36185 1 . PHE 38 38 36185 1 . ALA 39 39 36185 1 . GLY 40 40 36185 1 . LYS 41 41 36185 1 . LYS 42 42 36185 1 . ASP 43 43 36185 1 . ALA 44 44 36185 1 . PRO 45 45 36185 1 . PRO 46 46 36185 1 . GLU 47 47 36185 1 . SER 48 48 36185 1 . ARG 49 49 36185 1 . THR 50 50 36185 1 . LYS 51 51 36185 1 . PRO 52 52 36185 1 . SER 53 53 36185 1 . VAL 54 54 36185 1 . PHE 55 55 36185 1 . VAL 56 56 36185 1 . VAL 57 57 36185 1 . PHE 58 58 36185 1 . ASN 59 59 36185 1 . SER 60 60 36185 1 . SER 61 61 36185 1 . GLU 62 62 36185 1 . GLU 63 63 36185 1 . ALA 64 64 36185 1 . GLU 65 65 36185 1 . ALA 66 66 36185 1 . PHE 67 67 36185 1 . GLN 68 68 36185 1 . LYS 69 69 36185 1 . ALA 70 70 36185 1 . PRO 71 71 36185 1 . PRO 72 72 36185 1 . MET 73 73 36185 1 . TYR 74 74 36185 1 . ASP 75 75 36185 1 . ASP 76 76 36185 1 . VAL 77 77 36185 1 . GLN 78 78 36185 1 . LEU 79 79 36185 1 . THR 80 80 36185 1 . ALA 81 81 36185 1 . GLU 82 82 36185 1 . MET 83 83 36185 1 . LYS 84 84 36185 1 . THR 85 85 36185 1 . THR 86 86 36185 1 . TYR 87 87 36185 1 . LEU 88 88 36185 1 . GLU 89 89 36185 1 . ARG 90 90 36185 1 . LYS 91 91 36185 1 . ALA 92 92 36185 1 . GLU 93 93 36185 1 . GLU 94 94 36185 1 . ILE 95 95 36185 1 . ALA 96 96 36185 1 . ALA 97 97 36185 1 . LYS 98 98 36185 1 . LYS 99 99 36185 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 36185 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 5691 organism . 'Trypanosoma brucei' 'Trypanosoma brucei' . . Eukaryota . Trypanosoma brucei . . . . . . . . . . . . . 36185 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 36185 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 36185 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36185 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.5 mM [U-13C; U-15N] RRM, 200 mM sodium chloride, 20 mM sodium phosphate, 2 mM DTT, 2 mM EDTA, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 RRM '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein 0.5 . . mM . . . . 36185 1 2 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 36185 1 3 EDTA 'natural abundance' . . . . . . 2 . . mM . . . . 36185 1 4 'sodium chloride' 'natural abundance' . . . . . salt 200 . . mM . . . . 36185 1 5 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 36185 1 6 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36185 1 7 D2O [U-2H] . . . . . solvent 10 . . % . . . . 36185 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 36185 _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' 200 . mM 36185 1 pH 6.8 . pH 36185 1 pressure 1 . atm 36185 1 temperature 298 . K 36185 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36185 _Software.ID 1 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert P.' . . 36185 1 'Guntert, Mumenthaler and Wuthrich' . . 36185 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 36185 1 'structure calculation' 36185 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36185 _Software.ID 2 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 36185 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 36185 2 'peak picking' 36185 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36185 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 36185 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker DMX . 600 . . . 36185 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 36185 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36185 1 2 '2D NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36185 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 36185 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 36185 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 36185 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 36185 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36185 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36185 1 2 '2D NOESY' 1 $sample_1 isotropic 36185 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 1 1 THR H H 1 8.2543 0.003 . . 9 . . . A 12 THR H1 . 36185 1 2 . 1 1 1 1 THR HA H 1 4.626 0.007 . . 3 . . . A 12 THR HA . 36185 1 3 . 1 1 1 1 THR HB H 1 4.351 0.513 . . 2 . . . A 12 THR HB . 36185 1 4 . 1 1 1 1 THR HG21 H 1 1.221 0.213 . . 2 . . . A 12 THR HG21 . 36185 1 5 . 1 1 1 1 THR HG22 H 1 1.221 0.213 . . 2 . . . A 12 THR HG22 . 36185 1 6 . 1 1 1 1 THR HG23 H 1 1.221 0.213 . . 2 . . . A 12 THR HG23 . 36185 1 7 . 1 1 1 1 THR CA C 13 58.349 0.070 . . 3 . . . A 12 THR CA . 36185 1 8 . 1 1 1 1 THR CB C 13 66.609 0.082 . . 3 . . . A 12 THR CB . 36185 1 9 . 1 1 1 1 THR N N 15 115.072 0.027 . . 9 . . . A 12 THR N . 36185 1 10 . 1 1 2 2 ASP H H 1 8.984 0.005 . . 8 . . . A 13 ASP H . 36185 1 11 . 1 1 2 2 ASP HA H 1 4.321 0.000 . . 1 . . . A 13 ASP HA . 36185 1 12 . 1 1 2 2 ASP HB2 H 1 2.847 0.000 . . 1 . . . A 13 ASP HB2 . 36185 1 13 . 1 1 2 2 ASP HB3 H 1 2.547 0.000 . . 1 . . . A 13 ASP HB3 . 36185 1 14 . 1 1 2 2 ASP CA C 13 52.016 0.002 . . 2 . . . A 13 ASP CA . 36185 1 15 . 1 1 2 2 ASP CB C 13 36.316 0.002 . . 2 . . . A 13 ASP CB . 36185 1 16 . 1 1 2 2 ASP N N 15 127.275 0.042 . . 8 . . . A 13 ASP N . 36185 1 17 . 1 1 3 3 HIS H H 1 7.834 0.005 . . 4 . . . A 14 HIS H . 36185 1 18 . 1 1 3 3 HIS HA H 1 4.477 0.008 . . 2 . . . A 14 HIS HA . 36185 1 19 . 1 1 3 3 HIS HB2 H 1 3.285 0.069 . . 5 . . . A 14 HIS HB2 . 36185 1 20 . 1 1 3 3 HIS HB3 H 1 3.200 0.016 . . 2 . . . A 14 HIS HB3 . 36185 1 21 . 1 1 3 3 HIS CA C 13 54.805 0.031 . . 2 . . . A 14 HIS CA . 36185 1 22 . 1 1 3 3 HIS CB C 13 26.223 0.063 . . 2 . . . A 14 HIS CB . 36185 1 23 . 1 1 3 3 HIS N N 15 121.040 0.033 . . 4 . . . A 14 HIS N . 36185 1 24 . 1 1 4 4 GLN H H 1 7.474 0.005 . . 17 . . . A 15 GLN H . 36185 1 25 . 1 1 4 4 GLN HA H 1 4.480 0.035 . . 4 . . . A 15 GLN HA . 36185 1 26 . 1 1 4 4 GLN HB2 H 1 2.058 0.020 . . 5 . . . A 15 GLN HB2 . 36185 1 27 . 1 1 4 4 GLN HB3 H 1 2.031 0.010 . . 2 . . . A 15 GLN HB3 . 36185 1 28 . 1 1 4 4 GLN HG2 H 1 2.368 0.000 . . 1 . . . A 15 GLN HG2 . 36185 1 29 . 1 1 4 4 GLN HG3 H 1 2.368 0.000 . . 1 . . . A 15 GLN HG3 . 36185 1 30 . 1 1 4 4 GLN CA C 13 51.355 0.059 . . 3 . . . A 15 GLN CA . 36185 1 31 . 1 1 4 4 GLN CB C 13 26.481 0.046 . . 2 . . . A 15 GLN CB . 36185 1 32 . 1 1 4 4 GLN N N 15 114.599 0.051 . . 17 . . . A 15 GLN N . 36185 1 33 . 1 1 5 5 THR H H 1 7.449 0.054 . . 30 . . . A 16 THR H . 36185 1 34 . 1 1 5 5 THR HA H 1 3.994 0.018 . . 3 . . . A 16 THR HA . 36185 1 35 . 1 1 5 5 THR HB H 1 3.927 0.000 . . 1 . . . A 16 THR HB . 36185 1 36 . 1 1 5 5 THR HG21 H 1 0.997 0.057 . . 5 . . . A 16 THR HG21 . 36185 1 37 . 1 1 5 5 THR HG22 H 1 0.997 0.057 . . 4 . . . A 16 THR HG22 . 36185 1 38 . 1 1 5 5 THR HG23 H 1 0.997 0.057 . . 4 . . . A 16 THR HG23 . 36185 1 39 . 1 1 5 5 THR CA C 13 58.885 0.025 . . 3 . . . A 16 THR CA . 36185 1 40 . 1 1 5 5 THR CB C 13 66.201 0.036 . . 2 . . . A 16 THR CB . 36185 1 41 . 1 1 5 5 THR N N 15 116.553 0.068 . . 25 . . . A 16 THR N . 36185 1 42 . 1 1 6 6 VAL H H 1 9.306 0.023 . . 27 . . . A 17 VAL H . 36185 1 43 . 1 1 6 6 VAL HA H 1 4.830 0.023 . . 5 . . . A 17 VAL HA . 36185 1 44 . 1 1 6 6 VAL HB H 1 2.006 0.017 . . 4 . . . A 17 VAL HB . 36185 1 45 . 1 1 6 6 VAL HG11 H 1 1.180 0.011 . . 4 . . . A 17 VAL HG11 . 36185 1 46 . 1 1 6 6 VAL HG12 H 1 1.180 0.011 . . 3 . . . A 17 VAL HG12 . 36185 1 47 . 1 1 6 6 VAL HG13 H 1 1.180 0.011 . . 1 . . . A 17 VAL HG13 . 36185 1 48 . 1 1 6 6 VAL HG21 H 1 0.940 0.020 . . 2 . . . A 17 VAL HG21 . 36185 1 49 . 1 1 6 6 VAL HG22 H 1 0.940 0.020 . . 2 . . . A 17 VAL HG22 . 36185 1 50 . 1 1 6 6 VAL HG23 H 1 0.940 0.020 . . 2 . . . A 17 VAL HG23 . 36185 1 51 . 1 1 6 6 VAL CA C 13 57.299 0.019 . . 3 . . . A 17 VAL CA . 36185 1 52 . 1 1 6 6 VAL CB C 13 32.279 0.064 . . 3 . . . A 17 VAL CB . 36185 1 53 . 1 1 6 6 VAL N N 15 124.509 0.049 . . 23 . . . A 17 VAL N . 36185 1 54 . 1 1 7 7 TYR H H 1 9.719 0.059 . . 32 . . . A 18 TYR H . 36185 1 55 . 1 1 7 7 TYR HA H 1 4.942 0.046 . . 4 . . . A 18 TYR HA . 36185 1 56 . 1 1 7 7 TYR HB2 H 1 2.995 0.024 . . 7 . . . A 18 TYR HB2 . 36185 1 57 . 1 1 7 7 TYR HB3 H 1 2.482 0.008 . . 4 . . . A 18 TYR HB3 . 36185 1 58 . 1 1 7 7 TYR CA C 13 54.201 0.033 . . 3 . . . A 18 TYR CA . 36185 1 59 . 1 1 7 7 TYR CB C 13 36.510 0.084 . . 3 . . . A 18 TYR CB . 36185 1 60 . 1 1 7 7 TYR N N 15 129.093 0.052 . . 25 . . . A 18 TYR N . 36185 1 61 . 1 1 8 8 VAL H H 1 8.365 0.008 . . 27 . . . A 19 VAL H . 36185 1 62 . 1 1 8 8 VAL HA H 1 5.039 0.027 . . 5 . . . A 19 VAL HA . 36185 1 63 . 1 1 8 8 VAL HB H 1 1.650 0.014 . . 5 . . . A 19 VAL HB . 36185 1 64 . 1 1 8 8 VAL HG11 H 1 1.143 0.006 . . 2 . . . A 19 VAL HG11 . 36185 1 65 . 1 1 8 8 VAL HG12 H 1 1.143 0.006 . . 2 . . . A 19 VAL HG12 . 36185 1 66 . 1 1 8 8 VAL HG13 H 1 1.143 0.006 . . 2 . . . A 19 VAL HG13 . 36185 1 67 . 1 1 8 8 VAL HG21 H 1 0.935 0.015 . . 2 . . . A 19 VAL HG21 . 36185 1 68 . 1 1 8 8 VAL HG22 H 1 0.935 0.015 . . 2 . . . A 19 VAL HG22 . 36185 1 69 . 1 1 8 8 VAL HG23 H 1 0.935 0.015 . . 2 . . . A 19 VAL HG23 . 36185 1 70 . 1 1 8 8 VAL CA C 13 57.466 0.030 . . 3 . . . A 19 VAL CA . 36185 1 71 . 1 1 8 8 VAL CB C 13 32.089 0.027 . . 3 . . . A 19 VAL CB . 36185 1 72 . 1 1 8 8 VAL N N 15 127.368 0.053 . . 25 . . . A 19 VAL N . 36185 1 73 . 1 1 9 9 LYS H H 1 8.244 0.013 . . 24 . . . A 20 LYS H . 36185 1 74 . 1 1 9 9 LYS HA H 1 4.857 0.010 . . 2 . . . A 20 LYS HA . 36185 1 75 . 1 1 9 9 LYS HB2 H 1 1.457 0.012 . . 3 . . . A 20 LYS HB2 . 36185 1 76 . 1 1 9 9 LYS HB3 H 1 1.457 0.012 . . 3 . . . A 20 LYS HB3 . 36185 1 77 . 1 1 9 9 LYS HG2 H 1 1.043 0.002 . . 2 . . . A 20 LYS HG2 . 36185 1 78 . 1 1 9 9 LYS HG3 H 1 1.043 0.002 . . 2 . . . A 20 LYS HG3 . 36185 1 79 . 1 1 9 9 LYS HD2 H 1 1.208 0.002 . . 2 . . . A 20 LYS HD2 . 36185 1 80 . 1 1 9 9 LYS HD3 H 1 1.208 0.002 . . 2 . . . A 20 LYS HD3 . 36185 1 81 . 1 1 9 9 LYS HE2 H 1 2.985 0.003 . . 2 . . . A 20 LYS HE2 . 36185 1 82 . 1 1 9 9 LYS HE3 H 1 2.985 0.003 . . 2 . . . A 20 LYS HE3 . 36185 1 83 . 1 1 9 9 LYS CA C 13 50.700 0.013 . . 2 . . . A 20 LYS CA . 36185 1 84 . 1 1 9 9 LYS CB C 13 29.752 0.015 . . 2 . . . A 20 LYS CB . 36185 1 85 . 1 1 9 9 LYS N N 15 122.322 0.076 . . 23 . . . A 20 LYS N . 36185 1 86 . 1 1 10 10 PRO HA H 1 4.357 0.139 . . 2 . . . A 21 PRO HA . 36185 1 87 . 1 1 10 10 PRO HB2 H 1 2.752 0.000 . . 1 . . . A 21 PRO HB2 . 36185 1 88 . 1 1 10 10 PRO HB3 H 1 2.005 0.002 . . 2 . . . A 21 PRO HB3 . 36185 1 89 . 1 1 10 10 PRO HG2 H 1 1.868 0.021 . . 2 . . . A 21 PRO HG2 . 36185 1 90 . 1 1 10 10 PRO HG3 H 1 1.868 0.021 . . 2 . . . A 21 PRO HG3 . 36185 1 91 . 1 1 10 10 PRO HD2 H 1 3.024 0.010 . . 2 . . . A 21 PRO HD2 . 36185 1 92 . 1 1 10 10 PRO HD3 H 1 3.024 0.010 . . 2 . . . A 21 PRO HD3 . 36185 1 93 . 1 1 10 10 PRO CA C 13 62.779 0.006 . . 2 . . . A 21 PRO CA . 36185 1 94 . 1 1 10 10 PRO CB C 13 35.465 0.075 . . 2 . . . A 21 PRO CB . 36185 1 95 . 1 1 10 10 PRO CG C 13 27.218 0.002 . . 2 . . . A 21 PRO CG . 36185 1 96 . 1 1 10 10 PRO CD C 13 49.545 0.002 . . 2 . . . A 21 PRO CD . 36185 1 97 . 1 1 11 11 VAL H H 1 8.232 0.013 . . 18 . . . A 22 VAL H . 36185 1 98 . 1 1 11 11 VAL HA H 1 4.430 0.030 . . 3 . . . A 22 VAL HA . 36185 1 99 . 1 1 11 11 VAL HB H 1 2.106 0.021 . . 4 . . . A 22 VAL HB . 36185 1 100 . 1 1 11 11 VAL HG11 H 1 1.122 0.018 . . 3 . . . A 22 VAL HG11 . 36185 1 101 . 1 1 11 11 VAL HG12 H 1 1.122 0.018 . . 3 . . . A 22 VAL HG12 . 36185 1 102 . 1 1 11 11 VAL HG13 H 1 1.122 0.018 . . 1 . . . A 22 VAL HG13 . 36185 1 103 . 1 1 11 11 VAL HG21 H 1 0.963 0.025 . . 2 . . . A 22 VAL HG21 . 36185 1 104 . 1 1 11 11 VAL HG22 H 1 0.963 0.025 . . 1 . . . A 22 VAL HG22 . 36185 1 105 . 1 1 11 11 VAL HG23 H 1 0.963 0.025 . . 2 . . . A 22 VAL HG23 . 36185 1 106 . 1 1 11 11 VAL CA C 13 58.352 0.002 . . 2 . . . A 22 VAL CA . 36185 1 107 . 1 1 11 11 VAL CB C 13 29.279 0.002 . . 2 . . . A 22 VAL CB . 36185 1 108 . 1 1 11 11 VAL N N 15 127.592 0.173 . . 9 . . . A 22 VAL N . 36185 1 109 . 1 1 13 13 PRO HA H 1 4.337 0.001 . . 2 . . . A 24 PRO HA . 36185 1 110 . 1 1 13 13 PRO HB2 H 1 2.302 0.052 . . 3 . . . A 24 PRO HB2 . 36185 1 111 . 1 1 13 13 PRO HB3 H 1 2.022 0.023 . . 4 . . . A 24 PRO HB3 . 36185 1 112 . 1 1 13 13 PRO HG2 H 1 1.974 0.169 . . 2 . . . A 24 PRO HG2 . 36185 1 113 . 1 1 13 13 PRO HG3 H 1 1.857 0.000 . . 1 . . . A 24 PRO HG3 . 36185 1 114 . 1 1 13 13 PRO HD2 H 1 3.946 0.018 . . 2 . . . A 24 PRO HD2 . 36185 1 115 . 1 1 13 13 PRO HD3 H 1 3.946 0.018 . . 2 . . . A 24 PRO HD3 . 36185 1 116 . 1 1 13 13 PRO CA C 13 61.566 0.061 . . 2 . . . A 24 PRO CA . 36185 1 117 . 1 1 13 13 PRO CB C 13 29.622 0.018 . . 2 . . . A 24 PRO CB . 36185 1 118 . 1 1 14 14 THR H H 1 7.060 0.034 . . 20 . . . A 25 THR H . 36185 1 119 . 1 1 14 14 THR HA H 1 4.457 0.000 . . 1 . . . A 25 THR HA . 36185 1 120 . 1 1 14 14 THR HB H 1 4.147 0.010 . . 4 . . . A 25 THR HB . 36185 1 121 . 1 1 14 14 THR HG21 H 1 1.231 0.012 . . 3 . . . A 25 THR HG21 . 36185 1 122 . 1 1 14 14 THR HG22 H 1 1.231 0.012 . . 3 . . . A 25 THR HG22 . 36185 1 123 . 1 1 14 14 THR HG23 H 1 1.231 0.012 . . 1 . . . A 25 THR HG23 . 36185 1 124 . 1 1 14 14 THR CA C 13 57.953 0.025 . . 3 . . . A 25 THR CA . 36185 1 125 . 1 1 14 14 THR CB C 13 66.043 0.036 . . 2 . . . A 25 THR CB . 36185 1 126 . 1 1 14 14 THR N N 15 101.667 0.070 . . 15 . . . A 25 THR N . 36185 1 127 . 1 1 15 15 ALA H H 1 7.295 0.031 . . 27 . . . A 26 ALA H . 36185 1 128 . 1 1 15 15 ALA HA H 1 4.513 0.008 . . 6 . . . A 26 ALA HA . 36185 1 129 . 1 1 15 15 ALA HB1 H 1 1.272 0.011 . . 3 . . . A 26 ALA HB1 . 36185 1 130 . 1 1 15 15 ALA HB2 H 1 1.232 0.012 . . 3 . . . A 26 ALA HB2 . 36185 1 131 . 1 1 15 15 ALA HB3 H 1 1.175 0.010 . . 3 . . . A 26 ALA HB3 . 36185 1 132 . 1 1 15 15 ALA CA C 13 49.428 0.012 . . 3 . . . A 26 ALA CA . 36185 1 133 . 1 1 15 15 ALA CB C 13 15.459 0.067 . . 3 . . . A 26 ALA CB . 36185 1 134 . 1 1 15 15 ALA N N 15 125.479 0.049 . . 22 . . . A 26 ALA N . 36185 1 135 . 1 1 16 16 THR H H 1 8.695 0.020 . . 27 . . . A 27 THR H . 36185 1 136 . 1 1 16 16 THR HA H 1 4.857 0.011 . . 8 . . . A 27 THR HA . 36185 1 137 . 1 1 16 16 THR HB H 1 4.479 0.012 . . 4 . . . A 27 THR HB . 36185 1 138 . 1 1 16 16 THR HG21 H 1 1.386 0.011 . . 4 . . . A 27 THR HG21 . 36185 1 139 . 1 1 16 16 THR HG22 H 1 1.386 0.011 . . 3 . . . A 27 THR HG22 . 36185 1 140 . 1 1 16 16 THR HG23 H 1 1.386 0.011 . . 3 . . . A 27 THR HG23 . 36185 1 141 . 1 1 16 16 THR CA C 13 57.103 0.024 . . 2 . . . A 27 THR CA . 36185 1 142 . 1 1 16 16 THR CB C 13 67.940 0.001 . . 2 . . . A 27 THR CB . 36185 1 143 . 1 1 16 16 THR N N 15 114.804 0.059 . . 24 . . . A 27 THR N . 36185 1 144 . 1 1 17 17 LEU H H 1 9.010 0.015 . . 25 . . . A 28 LEU H . 36185 1 145 . 1 1 17 17 LEU HA H 1 4.002 0.025 . . 3 . . . A 28 LEU HA . 36185 1 146 . 1 1 17 17 LEU HB2 H 1 1.749 0.009 . . 6 . . . A 28 LEU HB2 . 36185 1 147 . 1 1 17 17 LEU HB3 H 1 1.868 0.012 . . 5 . . . A 28 LEU HB3 . 36185 1 148 . 1 1 17 17 LEU HG H 1 1.717 0.000 . . 2 . . . A 28 LEU HG . 36185 1 149 . 1 1 17 17 LEU HD11 H 1 0.968 0.016 . . 3 . . . A 28 LEU HD11 . 36185 1 150 . 1 1 17 17 LEU HD12 H 1 0.968 0.016 . . 3 . . . A 28 LEU HD12 . 36185 1 151 . 1 1 17 17 LEU HD13 H 1 0.968 0.016 . . 3 . . . A 28 LEU HD13 . 36185 1 152 . 1 1 17 17 LEU HD21 H 1 0.991 0.011 . . 3 . . . A 28 LEU HD21 . 36185 1 153 . 1 1 17 17 LEU HD22 H 1 0.991 0.011 . . 3 . . . A 28 LEU HD22 . 36185 1 154 . 1 1 17 17 LEU HD23 H 1 0.991 0.011 . . 3 . . . A 28 LEU HD23 . 36185 1 155 . 1 1 17 17 LEU CA C 13 55.272 0.022 . . 3 . . . A 28 LEU CA . 36185 1 156 . 1 1 17 17 LEU CB C 13 38.136 0.057 . . 3 . . . A 28 LEU CB . 36185 1 157 . 1 1 17 17 LEU N N 15 122.651 0.069 . . 24 . . . A 28 LEU N . 36185 1 158 . 1 1 18 18 GLU H H 1 9.054 0.011 . . 27 . . . A 29 GLU H . 36185 1 159 . 1 1 18 18 GLU HA H 1 4.034 0.003 . . 2 . . . A 29 GLU HA . 36185 1 160 . 1 1 18 18 GLU HB2 H 1 2.117 0.021 . . 6 . . . A 29 GLU HB2 . 36185 1 161 . 1 1 18 18 GLU HB3 H 1 1.977 0.024 . . 3 . . . A 29 GLU HB3 . 36185 1 162 . 1 1 18 18 GLU HG2 H 1 2.401 0.020 . . 4 . . . A 29 GLU HG2 . 36185 1 163 . 1 1 18 18 GLU HG3 H 1 2.300 0.020 . . 4 . . . A 29 GLU HG3 . 36185 1 164 . 1 1 18 18 GLU CA C 13 57.595 0.046 . . 3 . . . A 29 GLU CA . 36185 1 165 . 1 1 18 18 GLU CB C 13 25.863 0.000 . . 2 . . . A 29 GLU CB . 36185 1 166 . 1 1 18 18 GLU N N 15 121.337 0.057 . . 26 . . . A 29 GLU N . 36185 1 167 . 1 1 19 19 GLN H H 1 7.925 0.021 . . 32 . . . A 30 GLN H . 36185 1 168 . 1 1 19 19 GLN HA H 1 4.123 0.001 . . 3 . . . A 30 GLN HA . 36185 1 169 . 1 1 19 19 GLN HB2 H 1 2.102 0.194 . . 4 . . . A 30 GLN HB2 . 36185 1 170 . 1 1 19 19 GLN HB3 H 1 1.987 0.034 . . 4 . . . A 30 GLN HB3 . 36185 1 171 . 1 1 19 19 GLN HG2 H 1 2.498 0.012 . . 4 . . . A 30 GLN HG2 . 36185 1 172 . 1 1 19 19 GLN HG3 H 1 2.398 0.020 . . 4 . . . A 30 GLN HG3 . 36185 1 173 . 1 1 19 19 GLN CA C 13 55.824 0.106 . . 3 . . . A 30 GLN CA . 36185 1 174 . 1 1 19 19 GLN CB C 13 25.214 0.100 . . 3 . . . A 30 GLN CB . 36185 1 175 . 1 1 19 19 GLN N N 15 120.556 0.064 . . 27 . . . A 30 GLN N . 36185 1 176 . 1 1 20 20 LEU H H 1 8.563 0.025 . . 33 . . . A 31 LEU H . 36185 1 177 . 1 1 20 20 LEU HA H 1 4.115 0.032 . . 3 . . . A 31 LEU HA . 36185 1 178 . 1 1 20 20 LEU HB2 H 1 1.429 0.014 . . 6 . . . A 31 LEU HB2 . 36185 1 179 . 1 1 20 20 LEU HG H 1 1.387 0.003 . . 2 . . . A 31 LEU HG . 36185 1 180 . 1 1 20 20 LEU HD11 H 1 0.666 0.016 . . 9 . . . A 31 LEU HD11 . 36185 1 181 . 1 1 20 20 LEU HD12 H 1 0.666 0.016 . . 3 . . . A 31 LEU HD12 . 36185 1 182 . 1 1 20 20 LEU HD13 H 1 0.666 0.016 . . 2 . . . A 31 LEU HD13 . 36185 1 183 . 1 1 20 20 LEU HD21 H 1 0.548 0.021 . . 4 . . . A 31 LEU HD21 . 36185 1 184 . 1 1 20 20 LEU HD22 H 1 0.548 0.021 . . 2 . . . A 31 LEU HD22 . 36185 1 185 . 1 1 20 20 LEU HD23 H 1 0.548 0.021 . . 2 . . . A 31 LEU HD23 . 36185 1 186 . 1 1 20 20 LEU CA C 13 54.691 0.036 . . 3 . . . A 31 LEU CA . 36185 1 187 . 1 1 20 20 LEU CB C 13 39.112 0.036 . . 3 . . . A 31 LEU CB . 36185 1 188 . 1 1 20 20 LEU N N 15 119.216 0.048 . . 28 . . . A 31 LEU N . 36185 1 189 . 1 1 21 21 THR H H 1 8.890 0.017 . . 27 . . . A 32 THR H . 36185 1 190 . 1 1 21 21 THR HA H 1 4.301 0.006 . . 4 . . . A 32 THR HA . 36185 1 191 . 1 1 21 21 THR HB H 1 3.742 0.025 . . 7 . . . A 32 THR HB . 36185 1 192 . 1 1 21 21 THR HG21 H 1 1.141 0.014 . . 5 . . . A 32 THR HG21 . 36185 1 193 . 1 1 21 21 THR HG22 H 1 1.141 0.014 . . 3 . . . A 32 THR HG22 . 36185 1 194 . 1 1 21 21 THR HG23 H 1 1.141 0.014 . . 4 . . . A 32 THR HG23 . 36185 1 195 . 1 1 21 21 THR CA C 13 58.160 0.000 . . 1 . . . A 32 THR CA . 36185 1 196 . 1 1 21 21 THR CB C 13 65.099 0.017 . . 2 . . . A 32 THR CB . 36185 1 197 . 1 1 21 21 THR N N 15 117.639 0.056 . . 24 . . . A 32 THR N . 36185 1 198 . 1 1 22 22 GLU H H 1 8.145 0.021 . . 26 . . . A 33 GLU H . 36185 1 199 . 1 1 22 22 GLU HA H 1 3.987 0.016 . . 3 . . . A 33 GLU HA . 36185 1 200 . 1 1 22 22 GLU HB2 H 1 2.166 0.015 . . 5 . . . A 33 GLU HB2 . 36185 1 201 . 1 1 22 22 GLU HB3 H 1 2.091 0.003 . . 2 . . . A 33 GLU HB3 . 36185 1 202 . 1 1 22 22 GLU HG2 H 1 2.368 0.004 . . 3 . . . A 33 GLU HG2 . 36185 1 203 . 1 1 22 22 GLU HG3 H 1 2.230 0.002 . . 2 . . . A 33 GLU HG3 . 36185 1 204 . 1 1 22 22 GLU CA C 13 56.658 0.026 . . 3 . . . A 33 GLU CA . 36185 1 205 . 1 1 22 22 GLU CB C 13 26.302 0.062 . . 3 . . . A 33 GLU CB . 36185 1 206 . 1 1 22 22 GLU N N 15 123.482 0.061 . . 22 . . . A 33 GLU N . 36185 1 207 . 1 1 23 23 PHE H H 1 7.882 0.016 . . 24 . . . A 34 PHE H . 36185 1 208 . 1 1 23 23 PHE HA H 1 4.148 0.006 . . 3 . . . A 34 PHE HA . 36185 1 209 . 1 1 23 23 PHE HB2 H 1 3.194 0.019 . . 8 . . . A 34 PHE HB2 . 36185 1 210 . 1 1 23 23 PHE HB3 H 1 2.853 0.021 . . 6 . . . A 34 PHE HB3 . 36185 1 211 . 1 1 23 23 PHE CA C 13 58.867 0.007 . . 2 . . . A 34 PHE CA . 36185 1 212 . 1 1 23 23 PHE CB C 13 35.821 0.072 . . 3 . . . A 34 PHE CB . 36185 1 213 . 1 1 23 23 PHE N N 15 119.130 0.056 . . 22 . . . A 34 PHE N . 36185 1 214 . 1 1 24 24 PHE H H 1 8.843 0.018 . . 24 . . . A 35 PHE H . 36185 1 215 . 1 1 24 24 PHE HA H 1 4.136 0.014 . . 3 . . . A 35 PHE HA . 36185 1 216 . 1 1 24 24 PHE HB2 H 1 2.873 0.018 . . 5 . . . A 35 PHE HB2 . 36185 1 217 . 1 1 24 24 PHE HB3 H 1 2.620 0.014 . . 6 . . . A 35 PHE HB3 . 36185 1 218 . 1 1 24 24 PHE CA C 13 60.283 0.000 . . 1 . . . A 35 PHE CA . 36185 1 219 . 1 1 24 24 PHE CB C 13 35.748 0.076 . . 2 . . . A 35 PHE CB . 36185 1 220 . 1 1 24 24 PHE N N 15 116.389 0.071 . . 22 . . . A 35 PHE N . 36185 1 221 . 1 1 25 25 SER H H 1 8.061 0.025 . . 23 . . . A 36 SER H . 36185 1 222 . 1 1 25 25 SER HA H 1 5.078 0.010 . . 7 . . . A 36 SER HA . 36185 1 223 . 1 1 25 25 SER HB2 H 1 3.880 0.185 . . 5 . . . A 36 SER HB2 . 36185 1 224 . 1 1 25 25 SER HB3 H 1 4.047 0.074 . . 6 . . . A 36 SER HB3 . 36185 1 225 . 1 1 25 25 SER CA C 13 57.920 0.029 . . 3 . . . A 36 SER CA . 36185 1 226 . 1 1 25 25 SER CB C 13 60.008 0.196 . . 3 . . . A 36 SER CB . 36185 1 227 . 1 1 25 25 SER N N 15 114.287 0.095 . . 21 . . . A 36 SER N . 36185 1 228 . 1 1 26 26 LYS H H 1 7.273 0.048 . . 28 . . . A 37 LYS H . 36185 1 229 . 1 1 26 26 LYS HA H 1 4.101 0.024 . . 5 . . . A 37 LYS HA . 36185 1 230 . 1 1 26 26 LYS HB2 H 1 1.398 0.006 . . 5 . . . A 37 LYS HB2 . 36185 1 231 . 1 1 26 26 LYS HB3 H 1 1.398 0.006 . . 3 . . . A 37 LYS HB3 . 36185 1 232 . 1 1 26 26 LYS HG2 H 1 1.343 0.020 . . 3 . . . A 37 LYS HG2 . 36185 1 233 . 1 1 26 26 LYS HD2 H 1 1.568 0.016 . . 5 . . . A 37 LYS HD2 . 36185 1 234 . 1 1 26 26 LYS HE2 H 1 2.920 0.011 . . 3 . . . A 37 LYS HE2 . 36185 1 235 . 1 1 26 26 LYS CA C 13 54.472 0.030 . . 3 . . . A 37 LYS CA . 36185 1 236 . 1 1 26 26 LYS CB C 13 28.308 0.020 . . 3 . . . A 37 LYS CB . 36185 1 237 . 1 1 26 26 LYS N N 15 119.839 0.042 . . 22 . . . A 37 LYS N . 36185 1 238 . 1 1 27 27 HIS H H 1 7.924 0.012 . . 24 . . . A 38 HIS H . 36185 1 239 . 1 1 27 27 HIS HA H 1 4.679 0.024 . . 6 . . . A 38 HIS HA . 36185 1 240 . 1 1 27 27 HIS HB2 H 1 3.739 0.008 . . 6 . . . A 38 HIS HB2 . 36185 1 241 . 1 1 27 27 HIS HB3 H 1 3.063 0.007 . . 5 . . . A 38 HIS HB3 . 36185 1 242 . 1 1 27 27 HIS CA C 13 52.906 0.008 . . 3 . . . A 38 HIS CA . 36185 1 243 . 1 1 27 27 HIS CB C 13 29.321 0.088 . . 3 . . . A 38 HIS CB . 36185 1 244 . 1 1 27 27 HIS N N 15 116.395 0.054 . . 23 . . . A 38 HIS N . 36185 1 245 . 1 1 28 28 GLY H H 1 7.565 0.023 . . 26 . . . A 39 GLY H . 36185 1 246 . 1 1 28 28 GLY HA2 H 1 3.949 0.024 . . 4 . . . A 39 GLY HA2 . 36185 1 247 . 1 1 28 28 GLY HA3 H 1 3.975 0.019 . . 3 . . . A 39 GLY HA3 . 36185 1 248 . 1 1 28 28 GLY CA C 13 41.417 0.068 . . 4 . . . A 39 GLY CA . 36185 1 249 . 1 1 28 28 GLY N N 15 107.725 0.053 . . 22 . . . A 39 GLY N . 36185 1 250 . 1 1 29 29 THR H H 1 8.838 0.022 . . 15 . . . A 40 THR H . 36185 1 251 . 1 1 29 29 THR HA H 1 4.405 0.029 . . 4 . . . A 40 THR HA . 36185 1 252 . 1 1 29 29 THR HB H 1 4.314 0.000 . . 1 . . . A 40 THR HB . 36185 1 253 . 1 1 29 29 THR HG21 H 1 1.186 0.010 . . 6 . . . A 40 THR HG21 . 36185 1 254 . 1 1 29 29 THR HG22 H 1 1.186 0.010 . . 2 . . . A 40 THR HG22 . 36185 1 255 . 1 1 29 29 THR HG23 H 1 1.186 0.010 . . 3 . . . A 40 THR HG23 . 36185 1 256 . 1 1 29 29 THR CA C 13 59.762 0.210 . . 3 . . . A 40 THR CA . 36185 1 257 . 1 1 29 29 THR CB C 13 64.821 0.085 . . 3 . . . A 40 THR CB . 36185 1 258 . 1 1 29 29 THR N N 15 116.486 0.043 . . 13 . . . A 40 THR N . 36185 1 259 . 1 1 30 30 VAL H H 1 8.814 0.046 . . 17 . . . A 41 VAL H . 36185 1 260 . 1 1 30 30 VAL HA H 1 3.660 0.016 . . 6 . . . A 41 VAL HA . 36185 1 261 . 1 1 30 30 VAL HB H 1 1.762 0.016 . . 4 . . . A 41 VAL HB . 36185 1 262 . 1 1 30 30 VAL HG11 H 1 0.470 0.015 . . 6 . . . A 41 VAL HG11 . 36185 1 263 . 1 1 30 30 VAL HG12 H 1 0.470 0.015 . . 5 . . . A 41 VAL HG12 . 36185 1 264 . 1 1 30 30 VAL HG13 H 1 0.470 0.015 . . 3 . . . A 41 VAL HG13 . 36185 1 265 . 1 1 30 30 VAL HG21 H 1 0.437 0.021 . . 3 . . . A 41 VAL HG21 . 36185 1 266 . 1 1 30 30 VAL HG22 H 1 0.437 0.021 . . 2 . . . A 41 VAL HG22 . 36185 1 267 . 1 1 30 30 VAL HG23 H 1 0.437 0.021 . . 3 . . . A 41 VAL HG23 . 36185 1 268 . 1 1 30 30 VAL CA C 13 59.339 0.063 . . 2 . . . A 41 VAL CA . 36185 1 269 . 1 1 30 30 VAL CB C 13 30.041 0.029 . . 2 . . . A 41 VAL CB . 36185 1 270 . 1 1 30 30 VAL N N 15 129.449 0.061 . . 16 . . . A 41 VAL N . 36185 1 271 . 1 1 31 31 GLN H H 1 9.152 0.017 . . 29 . . . A 42 GLN H . 36185 1 272 . 1 1 31 31 GLN HA H 1 4.218 0.008 . . 3 . . . A 42 GLN HA . 36185 1 273 . 1 1 31 31 GLN HB2 H 1 1.783 0.163 . . 5 . . . A 42 GLN HB2 . 36185 1 274 . 1 1 31 31 GLN HB3 H 1 1.627 0.020 . . 5 . . . A 42 GLN HB3 . 36185 1 275 . 1 1 31 31 GLN HG2 H 1 2.118 0.019 . . 3 . . . A 42 GLN HG2 . 36185 1 276 . 1 1 31 31 GLN HG3 H 1 1.986 0.021 . . 3 . . . A 42 GLN HG3 . 36185 1 277 . 1 1 31 31 GLN CA C 13 53.824 0.032 . . 3 . . . A 42 GLN CA . 36185 1 278 . 1 1 31 31 GLN CB C 13 26.771 0.100 . . 3 . . . A 42 GLN CB . 36185 1 279 . 1 1 31 31 GLN N N 15 126.853 0.065 . . 27 . . . A 42 GLN N . 36185 1 280 . 1 1 32 32 ALA H H 1 7.436 0.027 . . 24 . . . A 43 ALA H . 36185 1 281 . 1 1 32 32 ALA HA H 1 4.136 0.014 . . 3 . . . A 43 ALA HA . 36185 1 282 . 1 1 32 32 ALA HB1 H 1 0.921 0.016 . . 5 . . . A 43 ALA HB1 . 36185 1 283 . 1 1 32 32 ALA HB2 H 1 0.901 0.012 . . 2 . . . A 43 ALA HB2 . 36185 1 284 . 1 1 32 32 ALA HB3 H 1 0.882 0.021 . . 5 . . . A 43 ALA HB3 . 36185 1 285 . 1 1 32 32 ALA CA C 13 49.063 0.027 . . 3 . . . A 43 ALA CA . 36185 1 286 . 1 1 32 32 ALA CB C 13 18.749 0.009 . . 3 . . . A 43 ALA CB . 36185 1 287 . 1 1 32 32 ALA N N 15 118.573 0.091 . . 23 . . . A 43 ALA N . 36185 1 288 . 1 1 33 33 VAL H H 1 7.600 0.045 . . 24 . . . A 44 VAL H . 36185 1 289 . 1 1 33 33 VAL HA H 1 4.266 0.007 . . 3 . . . A 44 VAL HA . 36185 1 290 . 1 1 33 33 VAL HB H 1 1.701 0.041 . . 6 . . . A 44 VAL HB . 36185 1 291 . 1 1 33 33 VAL HG11 H 1 0.634 0.101 . . 4 . . . A 44 VAL HG11 . 36185 1 292 . 1 1 33 33 VAL HG12 H 1 0.634 0.101 . . 4 . . . A 44 VAL HG12 . 36185 1 293 . 1 1 33 33 VAL HG13 H 1 0.634 0.101 . . 4 . . . A 44 VAL HG13 . 36185 1 294 . 1 1 33 33 VAL HG21 H 1 0.468 0.055 . . 3 . . . A 44 VAL HG21 . 36185 1 295 . 1 1 33 33 VAL HG22 H 1 0.468 0.055 . . 1 . . . A 44 VAL HG22 . 36185 1 296 . 1 1 33 33 VAL HG23 H 1 0.468 0.055 . . 3 . . . A 44 VAL HG23 . 36185 1 297 . 1 1 33 33 VAL CA C 13 58.345 0.062 . . 3 . . . A 44 VAL CA . 36185 1 298 . 1 1 33 33 VAL CB C 13 30.676 0.056 . . 3 . . . A 44 VAL CB . 36185 1 299 . 1 1 33 33 VAL N N 15 119.178 0.053 . . 19 . . . A 44 VAL N . 36185 1 300 . 1 1 34 34 TRP H H 1 9.219 0.015 . . 31 . . . A 45 TRP H . 36185 1 301 . 1 1 34 34 TRP HA H 1 4.528 0.060 . . 3 . . . A 45 TRP HA . 36185 1 302 . 1 1 34 34 TRP HB2 H 1 3.405 0.017 . . 8 . . . A 45 TRP HB2 . 36185 1 303 . 1 1 34 34 TRP HB3 H 1 3.212 0.003 . . 7 . . . A 45 TRP HB3 . 36185 1 304 . 1 1 34 34 TRP CA C 13 57.082 0.064 . . 3 . . . A 45 TRP CA . 36185 1 305 . 1 1 34 34 TRP CB C 13 28.240 0.053 . . 3 . . . A 45 TRP CB . 36185 1 306 . 1 1 34 34 TRP N N 15 125.799 0.050 . . 28 . . . A 45 TRP N . 36185 1 307 . 1 1 35 35 ARG H H 1 8.662 0.010 . . 26 . . . A 46 ARG H . 36185 1 308 . 1 1 35 35 ARG HA H 1 4.257 0.014 . . 5 . . . A 46 ARG HA . 36185 1 309 . 1 1 35 35 ARG HB2 H 1 1.869 0.006 . . 3 . . . A 46 ARG HB2 . 36185 1 310 . 1 1 35 35 ARG HB3 H 1 1.803 0.005 . . 4 . . . A 46 ARG HB3 . 36185 1 311 . 1 1 35 35 ARG HG2 H 1 0.934 1.108 . . 6 . . . A 46 ARG HG2 . 36185 1 312 . 1 1 35 35 ARG HG3 H 1 1.422 0.000 . . 1 . . . A 46 ARG HG3 . 36185 1 313 . 1 1 35 35 ARG HD2 H 1 2.970 0.046 . . 4 . . . A 46 ARG HD2 . 36185 1 314 . 1 1 35 35 ARG CA C 13 51.237 0.000 . . 1 . . . A 46 ARG CA . 36185 1 315 . 1 1 35 35 ARG CB C 13 27.118 0.092 . . 3 . . . A 46 ARG CB . 36185 1 316 . 1 1 35 35 ARG N N 15 120.805 0.071 . . 25 . . . A 46 ARG N . 36185 1 317 . 1 1 36 36 ARG H H 1 8.362 0.026 . . 26 . . . A 47 ARG H . 36185 1 318 . 1 1 36 36 ARG HA H 1 4.510 0.015 . . 4 . . . A 47 ARG HA . 36185 1 319 . 1 1 36 36 ARG HB2 H 1 1.925 0.002 . . 5 . . . A 47 ARG HB2 . 36185 1 320 . 1 1 36 36 ARG HB3 H 1 1.837 0.005 . . 4 . . . A 47 ARG HB3 . 36185 1 321 . 1 1 36 36 ARG HG2 H 1 1.684 0.039 . . 4 . . . A 47 ARG HG2 . 36185 1 322 . 1 1 36 36 ARG HG3 H 1 1.684 0.039 . . 2 . . . A 47 ARG HG3 . 36185 1 323 . 1 1 36 36 ARG HD2 H 1 2.764 0.026 . . 3 . . . A 47 ARG HD2 . 36185 1 324 . 1 1 36 36 ARG HD3 H 1 2.764 0.026 . . 2 . . . A 47 ARG HD3 . 36185 1 325 . 1 1 36 36 ARG CA C 13 51.810 0.023 . . 3 . . . A 47 ARG CA . 36185 1 326 . 1 1 36 36 ARG CB C 13 29.571 0.032 . . 2 . . . A 47 ARG CB . 36185 1 327 . 1 1 36 36 ARG N N 15 119.372 0.128 . . 22 . . . A 47 ARG N . 36185 1 328 . 1 1 37 37 TYR H H 1 8.696 0.016 . . 19 . . . A 48 TYR H . 36185 1 329 . 1 1 37 37 TYR HA H 1 5.113 0.180 . . 6 . . . A 48 TYR HA . 36185 1 330 . 1 1 37 37 TYR HB2 H 1 3.198 0.017 . . 3 . . . A 48 TYR HB2 . 36185 1 331 . 1 1 37 37 TYR HB3 H 1 2.601 0.011 . . 4 . . . A 48 TYR HB3 . 36185 1 332 . 1 1 37 37 TYR CA C 13 54.200 0.023 . . 2 . . . A 48 TYR CA . 36185 1 333 . 1 1 37 37 TYR CB C 13 38.767 0.041 . . 4 . . . A 48 TYR CB . 36185 1 334 . 1 1 37 37 TYR N N 15 119.784 0.042 . . 17 . . . A 48 TYR N . 36185 1 335 . 1 1 38 38 PHE H H 1 8.852 0.015 . . 24 . . . A 49 PHE H . 36185 1 336 . 1 1 38 38 PHE HA H 1 4.637 0.013 . . 7 . . . A 49 PHE HA . 36185 1 337 . 1 1 38 38 PHE HB2 H 1 3.315 0.024 . . 6 . . . A 49 PHE HB2 . 36185 1 338 . 1 1 38 38 PHE HB3 H 1 2.809 0.006 . . 5 . . . A 49 PHE HB3 . 36185 1 339 . 1 1 38 38 PHE CA C 13 55.221 0.005 . . 2 . . . A 49 PHE CA . 36185 1 340 . 1 1 38 38 PHE CB C 13 37.172 0.009 . . 3 . . . A 49 PHE CB . 36185 1 341 . 1 1 38 38 PHE N N 15 121.345 0.045 . . 23 . . . A 49 PHE N . 36185 1 342 . 1 1 39 39 ALA H H 1 8.821 0.005 . . 17 . . . A 50 ALA H . 36185 1 343 . 1 1 39 39 ALA HA H 1 4.380 0.011 . . 5 . . . A 50 ALA HA . 36185 1 344 . 1 1 39 39 ALA HB1 H 1 1.506 0.012 . . 4 . . . A 50 ALA HB1 . 36185 1 345 . 1 1 39 39 ALA HB2 H 1 1.506 0.012 . . 4 . . . A 50 ALA HB2 . 36185 1 346 . 1 1 39 39 ALA HB3 H 1 1.506 0.012 . . 4 . . . A 50 ALA HB3 . 36185 1 347 . 1 1 39 39 ALA CA C 13 49.748 0.024 . . 3 . . . A 50 ALA CA . 36185 1 348 . 1 1 39 39 ALA CB C 13 16.127 0.026 . . 3 . . . A 50 ALA CB . 36185 1 349 . 1 1 39 39 ALA N N 15 126.277 0.062 . . 17 . . . A 50 ALA N . 36185 1 350 . 1 1 40 40 GLY H H 1 8.453 0.006 . . 15 . . . A 51 GLY H . 36185 1 351 . 1 1 40 40 GLY HA2 H 1 4.040 0.004 . . 4 . . . A 51 GLY HA2 . 36185 1 352 . 1 1 40 40 GLY HA3 H 1 3.904 0.044 . . 4 . . . A 51 GLY HA3 . 36185 1 353 . 1 1 40 40 GLY CA C 13 42.286 0.029 . . 3 . . . A 51 GLY CA . 36185 1 354 . 1 1 40 40 GLY N N 15 108.057 0.049 . . 14 . . . A 51 GLY N . 36185 1 355 . 1 1 41 41 LYS H H 1 8.164 0.017 . . 19 . . . A 52 LYS H . 36185 1 356 . 1 1 41 41 LYS HA H 1 4.425 0.011 . . 4 . . . A 52 LYS HA . 36185 1 357 . 1 1 41 41 LYS HB2 H 1 1.944 0.034 . . 4 . . . A 52 LYS HB2 . 36185 1 358 . 1 1 41 41 LYS HB3 H 1 1.731 0.013 . . 3 . . . A 52 LYS HB3 . 36185 1 359 . 1 1 41 41 LYS HG2 H 1 1.423 0.011 . . 2 . . . A 52 LYS HG2 . 36185 1 360 . 1 1 41 41 LYS HG3 H 1 1.423 0.011 . . 2 . . . A 52 LYS HG3 . 36185 1 361 . 1 1 41 41 LYS HD2 H 1 1.617 0.000 . . 2 . . . A 52 LYS HD2 . 36185 1 362 . 1 1 41 41 LYS HD3 H 1 1.617 0.000 . . 2 . . . A 52 LYS HD3 . 36185 1 363 . 1 1 41 41 LYS HE2 H 1 3.206 0.021 . . 4 . . . A 52 LYS HE2 . 36185 1 364 . 1 1 41 41 LYS HE3 H 1 3.079 0.000 . . 1 . . . A 52 LYS HE3 . 36185 1 365 . 1 1 41 41 LYS CA C 13 52.636 0.033 . . 3 . . . A 52 LYS CA . 36185 1 366 . 1 1 41 41 LYS CB C 13 29.879 0.007 . . 2 . . . A 52 LYS CB . 36185 1 367 . 1 1 41 41 LYS N N 15 120.636 0.048 . . 17 . . . A 52 LYS N . 36185 1 368 . 1 1 42 42 LYS H H 1 8.329 0.009 . . 26 . . . A 53 LYS H . 36185 1 369 . 1 1 42 42 LYS HA H 1 4.005 0.013 . . 5 . . . A 53 LYS HA . 36185 1 370 . 1 1 42 42 LYS HB2 H 1 1.796 0.019 . . 5 . . . A 53 LYS HB2 . 36185 1 371 . 1 1 42 42 LYS HB3 H 1 1.654 0.004 . . 2 . . . A 53 LYS HB3 . 36185 1 372 . 1 1 42 42 LYS HG2 H 1 1.404 0.023 . . 4 . . . A 53 LYS HG2 . 36185 1 373 . 1 1 42 42 LYS HG3 H 1 1.386 0.013 . . 3 . . . A 53 LYS HG3 . 36185 1 374 . 1 1 42 42 LYS HE2 H 1 2.984 0.004 . . 3 . . . A 53 LYS HE2 . 36185 1 375 . 1 1 42 42 LYS HE3 H 1 2.984 0.004 . . 3 . . . A 53 LYS HE3 . 36185 1 376 . 1 1 42 42 LYS CA C 13 55.375 0.032 . . 3 . . . A 53 LYS CA . 36185 1 377 . 1 1 42 42 LYS CB C 13 29.274 0.029 . . 3 . . . A 53 LYS CB . 36185 1 378 . 1 1 42 42 LYS N N 15 120.967 0.803 . . 25 . . . A 53 LYS N . 36185 1 379 . 1 1 43 43 ASP H H 1 8.426 0.013 . . 22 . . . A 54 ASP H . 36185 1 380 . 1 1 43 43 ASP HA H 1 4.548 0.011 . . 3 . . . A 54 ASP HA . 36185 1 381 . 1 1 43 43 ASP HB2 H 1 2.725 0.012 . . 4 . . . A 54 ASP HB2 . 36185 1 382 . 1 1 43 43 ASP HB3 H 1 2.632 0.015 . . 4 . . . A 54 ASP HB3 . 36185 1 383 . 1 1 43 43 ASP CA C 13 51.027 0.023 . . 3 . . . A 54 ASP CA . 36185 1 384 . 1 1 43 43 ASP CB C 13 37.043 0.049 . . 3 . . . A 54 ASP CB . 36185 1 385 . 1 1 43 43 ASP N N 15 117.278 0.061 . . 21 . . . A 54 ASP N . 36185 1 386 . 1 1 44 44 ALA H H 1 7.539 0.019 . . 20 . . . A 55 ALA H . 36185 1 387 . 1 1 44 44 ALA HA H 1 4.592 0.000 . . 1 . . . A 55 ALA HA . 36185 1 388 . 1 1 44 44 ALA HB1 H 1 1.422 0.013 . . 2 . . . A 55 ALA HB1 . 36185 1 389 . 1 1 44 44 ALA HB2 H 1 1.422 0.013 . . 3 . . . A 55 ALA HB2 . 36185 1 390 . 1 1 44 44 ALA HB3 H 1 1.422 0.013 . . 2 . . . A 55 ALA HB3 . 36185 1 391 . 1 1 44 44 ALA CA C 13 47.315 0.000 . . 1 . . . A 55 ALA CA . 36185 1 392 . 1 1 44 44 ALA CB C 13 15.626 0.000 . . 1 . . . A 55 ALA CB . 36185 1 393 . 1 1 44 44 ALA N N 15 124.154 0.040 . . 18 . . . A 55 ALA N . 36185 1 394 . 1 1 46 46 PRO HA H 1 4.153 0.002 . . 3 . . . A 57 PRO HA . 36185 1 395 . 1 1 46 46 PRO HB2 H 1 2.260 0.005 . . 3 . . . A 57 PRO HB2 . 36185 1 396 . 1 1 46 46 PRO HB3 H 1 1.942 0.003 . . 2 . . . A 57 PRO HB3 . 36185 1 397 . 1 1 46 46 PRO HG2 H 1 2.158 0.000 . . 1 . . . A 57 PRO HG2 . 36185 1 398 . 1 1 46 46 PRO HG3 H 1 2.023 0.000 . . 1 . . . A 57 PRO HG3 . 36185 1 399 . 1 1 46 46 PRO HD2 H 1 3.846 0.027 . . 2 . . . A 57 PRO HD2 . 36185 1 400 . 1 1 46 46 PRO HD3 H 1 3.846 0.027 . . 2 . . . A 57 PRO HD3 . 36185 1 401 . 1 1 46 46 PRO CA C 13 62.487 0.021 . . 2 . . . A 57 PRO CA . 36185 1 402 . 1 1 46 46 PRO CB C 13 28.756 0.036 . . 2 . . . A 57 PRO CB . 36185 1 403 . 1 1 46 46 PRO CG C 13 25.452 0.025 . . 2 . . . A 57 PRO CG . 36185 1 404 . 1 1 47 47 GLU H H 1 9.551 0.015 . . 21 . . . A 58 GLU H . 36185 1 405 . 1 1 47 47 GLU HA H 1 4.127 0.012 . . 3 . . . A 58 GLU HA . 36185 1 406 . 1 1 47 47 GLU HB2 H 1 2.045 0.011 . . 5 . . . A 58 GLU HB2 . 36185 1 407 . 1 1 47 47 GLU HB3 H 1 1.876 0.012 . . 4 . . . A 58 GLU HB3 . 36185 1 408 . 1 1 47 47 GLU HG2 H 1 2.309 0.016 . . 5 . . . A 58 GLU HG2 . 36185 1 409 . 1 1 47 47 GLU HG3 H 1 2.220 0.012 . . 4 . . . A 58 GLU HG3 . 36185 1 410 . 1 1 47 47 GLU CA C 13 56.008 0.083 . . 3 . . . A 58 GLU CA . 36185 1 411 . 1 1 47 47 GLU CB C 13 25.326 0.059 . . 3 . . . A 58 GLU CB . 36185 1 412 . 1 1 47 47 GLU N N 15 117.660 0.053 . . 21 . . . A 58 GLU N . 36185 1 413 . 1 1 48 48 SER H H 1 7.936 0.016 . . 18 . . . A 59 SER H . 36185 1 414 . 1 1 48 48 SER HA H 1 4.597 0.013 . . 3 . . . A 59 SER HA . 36185 1 415 . 1 1 48 48 SER HB2 H 1 3.952 0.009 . . 4 . . . A 59 SER HB2 . 36185 1 416 . 1 1 48 48 SER HB3 H 1 3.786 0.007 . . 3 . . . A 59 SER HB3 . 36185 1 417 . 1 1 48 48 SER CA C 13 61.224 0.106 . . 3 . . . A 59 SER CA . 36185 1 418 . 1 1 48 48 SER CB C 13 62.390 0.065 . . 3 . . . A 59 SER CB . 36185 1 419 . 1 1 48 48 SER N N 15 114.708 0.066 . . 17 . . . A 59 SER N . 36185 1 420 . 1 1 49 49 ARG H H 1 7.984 0.009 . . 14 . . . A 60 ARG H . 36185 1 421 . 1 1 49 49 ARG HA H 1 4.676 0.014 . . 5 . . . A 60 ARG HA . 36185 1 422 . 1 1 49 49 ARG HB2 H 1 2.077 0.019 . . 3 . . . A 60 ARG HB2 . 36185 1 423 . 1 1 49 49 ARG HB3 H 1 1.938 0.132 . . 3 . . . A 60 ARG HB3 . 36185 1 424 . 1 1 49 49 ARG HG2 H 1 1.739 0.011 . . 3 . . . A 60 ARG HG2 . 36185 1 425 . 1 1 49 49 ARG HG3 H 1 1.739 0.011 . . 3 . . . A 60 ARG HG3 . 36185 1 426 . 1 1 49 49 ARG HD2 H 1 3.206 0.009 . . 4 . . . A 60 ARG HD2 . 36185 1 427 . 1 1 49 49 ARG HD3 H 1 3.206 0.009 . . 3 . . . A 60 ARG HD3 . 36185 1 428 . 1 1 49 49 ARG CA C 13 53.319 0.019 . . 3 . . . A 60 ARG CA . 36185 1 429 . 1 1 49 49 ARG CB C 13 28.346 0.030 . . 3 . . . A 60 ARG CB . 36185 1 430 . 1 1 49 49 ARG N N 15 119.933 0.059 . . 12 . . . A 60 ARG N . 36185 1 431 . 1 1 50 50 THR H H 1 7.919 0.005 . . 22 . . . A 61 THR H . 36185 1 432 . 1 1 50 50 THR HA H 1 4.348 0.014 . . 5 . . . A 61 THR HA . 36185 1 433 . 1 1 50 50 THR HB H 1 4.155 0.023 . . 4 . . . A 61 THR HB . 36185 1 434 . 1 1 50 50 THR HG21 H 1 1.299 0.018 . . 6 . . . A 61 THR HG21 . 36185 1 435 . 1 1 50 50 THR HG22 H 1 1.299 0.018 . . 2 . . . A 61 THR HG22 . 36185 1 436 . 1 1 50 50 THR HG23 H 1 1.299 0.018 . . 2 . . . A 61 THR HG23 . 36185 1 437 . 1 1 50 50 THR CA C 13 60.483 0.032 . . 2 . . . A 61 THR CA . 36185 1 438 . 1 1 50 50 THR CB C 13 66.415 0.001 . . 2 . . . A 61 THR CB . 36185 1 439 . 1 1 50 50 THR N N 15 117.678 0.068 . . 21 . . . A 61 THR N . 36185 1 440 . 1 1 51 51 LYS H H 1 8.656 0.015 . . 23 . . . A 62 LYS H . 36185 1 441 . 1 1 51 51 LYS HA H 1 4.562 0.012 . . 2 . . . A 62 LYS HA . 36185 1 442 . 1 1 51 51 LYS HB2 H 1 1.635 0.018 . . 3 . . . A 62 LYS HB2 . 36185 1 443 . 1 1 51 51 LYS HB3 H 1 1.635 0.018 . . 3 . . . A 62 LYS HB3 . 36185 1 444 . 1 1 51 51 LYS HG2 H 1 1.343 0.021 . . 3 . . . A 62 LYS HG2 . 36185 1 445 . 1 1 51 51 LYS HG3 H 1 1.343 0.021 . . 3 . . . A 62 LYS HG3 . 36185 1 446 . 1 1 51 51 LYS HD2 H 1 1.468 0.012 . . 3 . . . A 62 LYS HD2 . 36185 1 447 . 1 1 51 51 LYS HD3 H 1 1.468 0.012 . . 2 . . . A 62 LYS HD3 . 36185 1 448 . 1 1 51 51 LYS HE2 H 1 2.875 0.003 . . 2 . . . A 62 LYS HE2 . 36185 1 449 . 1 1 51 51 LYS HE3 H 1 2.875 0.003 . . 2 . . . A 62 LYS HE3 . 36185 1 450 . 1 1 51 51 LYS CA C 13 52.277 0.000 . . 1 . . . A 62 LYS CA . 36185 1 451 . 1 1 51 51 LYS CB C 13 29.787 0.000 . . 1 . . . A 62 LYS CB . 36185 1 452 . 1 1 51 51 LYS N N 15 125.400 0.060 . . 22 . . . A 62 LYS N . 36185 1 453 . 1 1 52 52 PRO HA H 1 4.776 0.062 . . 3 . . . A 63 PRO HA . 36185 1 454 . 1 1 52 52 PRO HB2 H 1 2.169 0.009 . . 3 . . . A 63 PRO HB2 . 36185 1 455 . 1 1 52 52 PRO HG2 H 1 1.897 0.017 . . 2 . . . A 63 PRO HG2 . 36185 1 456 . 1 1 52 52 PRO HD2 H 1 3.737 0.025 . . 5 . . . A 63 PRO HD2 . 36185 1 457 . 1 1 52 52 PRO CA C 13 60.317 0.031 . . 2 . . . A 63 PRO CA . 36185 1 458 . 1 1 52 52 PRO CB C 13 28.076 0.000 . . 1 . . . A 63 PRO CB . 36185 1 459 . 1 1 52 52 PRO CG C 13 25.142 0.000 . . 1 . . . A 63 PRO CG . 36185 1 460 . 1 1 53 53 SER H H 1 6.958 0.085 . . 30 . . . A 64 SER H . 36185 1 461 . 1 1 53 53 SER HA H 1 3.886 0.693 . . 6 . . . A 64 SER HA . 36185 1 462 . 1 1 53 53 SER HB2 H 1 3.089 0.015 . . 4 . . . A 64 SER HB2 . 36185 1 463 . 1 1 53 53 SER HB3 H 1 3.089 0.015 . . 4 . . . A 64 SER HB3 . 36185 1 464 . 1 1 53 53 SER CA C 13 51.633 0.010 . . 3 . . . A 64 SER CA . 36185 1 465 . 1 1 53 53 SER CB C 13 62.981 0.087 . . 3 . . . A 64 SER CB . 36185 1 466 . 1 1 53 53 SER N N 15 110.767 0.059 . . 23 . . . A 64 SER N . 36185 1 467 . 1 1 54 54 VAL H H 1 8.260 0.011 . . 22 . . . A 65 VAL H . 36185 1 468 . 1 1 54 54 VAL HA H 1 4.579 0.016 . . 7 . . . A 65 VAL HA . 36185 1 469 . 1 1 54 54 VAL HB H 1 1.962 0.020 . . 6 . . . A 65 VAL HB . 36185 1 470 . 1 1 54 54 VAL HG11 H 1 0.464 0.020 . . 3 . . . A 65 VAL HG11 . 36185 1 471 . 1 1 54 54 VAL HG12 H 1 0.464 0.020 . . 2 . . . A 65 VAL HG12 . 36185 1 472 . 1 1 54 54 VAL HG13 H 1 0.464 0.020 . . 3 . . . A 65 VAL HG13 . 36185 1 473 . 1 1 54 54 VAL HG21 H 1 0.655 0.026 . . 5 . . . A 65 VAL HG21 . 36185 1 474 . 1 1 54 54 VAL HG22 H 1 0.655 0.026 . . 3 . . . A 65 VAL HG22 . 36185 1 475 . 1 1 54 54 VAL HG23 H 1 0.655 0.026 . . 2 . . . A 65 VAL HG23 . 36185 1 476 . 1 1 54 54 VAL CA C 13 55.252 0.042 . . 2 . . . A 65 VAL CA . 36185 1 477 . 1 1 54 54 VAL CB C 13 32.781 0.259 . . 2 . . . A 65 VAL CB . 36185 1 478 . 1 1 54 54 VAL N N 15 110.515 0.054 . . 21 . . . A 65 VAL N . 36185 1 479 . 1 1 55 55 PHE H H 1 8.241 0.030 . . 25 . . . A 66 PHE H . 36185 1 480 . 1 1 55 55 PHE HA H 1 5.728 0.188 . . 9 . . . A 66 PHE HA . 36185 1 481 . 1 1 55 55 PHE HB2 H 1 2.807 0.018 . . 8 . . . A 66 PHE HB2 . 36185 1 482 . 1 1 55 55 PHE HB3 H 1 2.758 0.025 . . 3 . . . A 66 PHE HB3 . 36185 1 483 . 1 1 55 55 PHE CA C 13 57.604 0.111 . . 3 . . . A 66 PHE CA . 36185 1 484 . 1 1 55 55 PHE CB C 13 38.374 0.030 . . 3 . . . A 66 PHE CB . 36185 1 485 . 1 1 55 55 PHE N N 15 115.655 0.059 . . 24 . . . A 66 PHE N . 36185 1 486 . 1 1 56 56 VAL H H 1 9.144 0.027 . . 28 . . . A 67 VAL H . 36185 1 487 . 1 1 56 56 VAL HA H 1 4.071 0.006 . . 4 . . . A 67 VAL HA . 36185 1 488 . 1 1 56 56 VAL HB H 1 1.103 0.033 . . 7 . . . A 67 VAL HB . 36185 1 489 . 1 1 56 56 VAL HG11 H 1 0.712 0.015 . . 3 . . . A 67 VAL HG11 . 36185 1 490 . 1 1 56 56 VAL HG12 H 1 0.712 0.015 . . 2 . . . A 67 VAL HG12 . 36185 1 491 . 1 1 56 56 VAL HG13 H 1 0.712 0.015 . . 3 . . . A 67 VAL HG13 . 36185 1 492 . 1 1 56 56 VAL HG21 H 1 0.584 0.024 . . 3 . . . A 67 VAL HG21 . 36185 1 493 . 1 1 56 56 VAL HG22 H 1 0.584 0.024 . . 2 . . . A 67 VAL HG22 . 36185 1 494 . 1 1 56 56 VAL HG23 H 1 0.584 0.024 . . 3 . . . A 67 VAL HG23 . 36185 1 495 . 1 1 56 56 VAL CA C 13 57.923 0.030 . . 3 . . . A 67 VAL CA . 36185 1 496 . 1 1 56 56 VAL CB C 13 29.866 0.019 . . 2 . . . A 67 VAL CB . 36185 1 497 . 1 1 56 56 VAL N N 15 121.936 0.047 . . 26 . . . A 67 VAL N . 36185 1 498 . 1 1 57 57 VAL H H 1 8.633 0.015 . . 22 . . . A 68 VAL H . 36185 1 499 . 1 1 57 57 VAL HA H 1 4.358 0.044 . . 4 . . . A 68 VAL HA . 36185 1 500 . 1 1 57 57 VAL HB H 1 1.936 0.066 . . 5 . . . A 68 VAL HB . 36185 1 501 . 1 1 57 57 VAL HG11 H 1 0.925 0.009 . . 3 . . . A 68 VAL HG11 . 36185 1 502 . 1 1 57 57 VAL HG12 H 1 0.925 0.009 . . 3 . . . A 68 VAL HG12 . 36185 1 503 . 1 1 57 57 VAL HG13 H 1 0.925 0.009 . . 3 . . . A 68 VAL HG13 . 36185 1 504 . 1 1 57 57 VAL HG21 H 1 0.828 0.007 . . 2 . . . A 68 VAL HG21 . 36185 1 505 . 1 1 57 57 VAL HG22 H 1 0.828 0.007 . . 2 . . . A 68 VAL HG22 . 36185 1 506 . 1 1 57 57 VAL HG23 H 1 0.828 0.007 . . 2 . . . A 68 VAL HG23 . 36185 1 507 . 1 1 57 57 VAL CA C 13 57.945 0.110 . . 2 . . . A 68 VAL CA . 36185 1 508 . 1 1 57 57 VAL CB C 13 28.834 0.053 . . 3 . . . A 68 VAL CB . 36185 1 509 . 1 1 57 57 VAL N N 15 128.008 0.058 . . 20 . . . A 68 VAL N . 36185 1 510 . 1 1 58 58 PHE H H 1 8.825 0.019 . . 22 . . . A 69 PHE H . 36185 1 511 . 1 1 58 58 PHE HA H 1 5.131 0.014 . . 7 . . . A 69 PHE HA . 36185 1 512 . 1 1 58 58 PHE HB2 H 1 3.610 0.036 . . 6 . . . A 69 PHE HB2 . 36185 1 513 . 1 1 58 58 PHE HB3 H 1 2.932 0.020 . . 6 . . . A 69 PHE HB3 . 36185 1 514 . 1 1 58 58 PHE CA C 13 58.493 0.010 . . 3 . . . A 69 PHE CA . 36185 1 515 . 1 1 58 58 PHE CB C 13 38.437 0.021 . . 3 . . . A 69 PHE CB . 36185 1 516 . 1 1 58 58 PHE N N 15 126.059 0.061 . . 20 . . . A 69 PHE N . 36185 1 517 . 1 1 59 59 ASN H H 1 8.530 0.012 . . 30 . . . A 70 ASN H . 36185 1 518 . 1 1 59 59 ASN HA H 1 4.601 0.013 . . 5 . . . A 70 ASN HA . 36185 1 519 . 1 1 59 59 ASN HB2 H 1 2.967 0.003 . . 5 . . . A 70 ASN HB2 . 36185 1 520 . 1 1 59 59 ASN HB3 H 1 2.643 0.012 . . 6 . . . A 70 ASN HB3 . 36185 1 521 . 1 1 59 59 ASN CA C 13 51.499 0.019 . . 3 . . . A 70 ASN CA . 36185 1 522 . 1 1 59 59 ASN CB C 13 37.117 0.031 . . 3 . . . A 70 ASN CB . 36185 1 523 . 1 1 59 59 ASN N N 15 116.074 0.046 . . 29 . . . A 70 ASN N . 36185 1 524 . 1 1 60 60 SER H H 1 7.608 0.013 . . 27 . . . A 71 SER H . 36185 1 525 . 1 1 60 60 SER HA H 1 4.840 0.021 . . 6 . . . A 71 SER HA . 36185 1 526 . 1 1 60 60 SER HB2 H 1 4.289 0.137 . . 5 . . . A 71 SER HB2 . 36185 1 527 . 1 1 60 60 SER HB3 H 1 4.007 0.008 . . 4 . . . A 71 SER HB3 . 36185 1 528 . 1 1 60 60 SER CA C 13 53.449 0.028 . . 3 . . . A 71 SER CA . 36185 1 529 . 1 1 60 60 SER CB C 13 63.595 0.056 . . 3 . . . A 71 SER CB . 36185 1 530 . 1 1 60 60 SER N N 15 108.047 0.053 . . 25 . . . A 71 SER N . 36185 1 531 . 1 1 61 61 SER H H 1 9.495 0.034 . . 23 . . . A 72 SER H . 36185 1 532 . 1 1 61 61 SER HA H 1 4.261 0.005 . . 3 . . . A 72 SER HA . 36185 1 533 . 1 1 61 61 SER HB2 H 1 3.990 0.030 . . 6 . . . A 72 SER HB2 . 36185 1 534 . 1 1 61 61 SER HB3 H 1 3.766 0.025 . . 5 . . . A 72 SER HB3 . 36185 1 535 . 1 1 61 61 SER CA C 13 58.268 0.024 . . 2 . . . A 72 SER CA . 36185 1 536 . 1 1 61 61 SER CB C 13 59.440 0.022 . . 2 . . . A 72 SER CB . 36185 1 537 . 1 1 61 61 SER N N 15 120.588 0.082 . . 21 . . . A 72 SER N . 36185 1 538 . 1 1 62 62 GLU H H 1 9.034 0.033 . . 20 . . . A 73 GLU H . 36185 1 539 . 1 1 62 62 GLU HA H 1 3.883 0.024 . . 2 . . . A 73 GLU HA . 36185 1 540 . 1 1 62 62 GLU HB2 H 1 2.083 0.036 . . 5 . . . A 73 GLU HB2 . 36185 1 541 . 1 1 62 62 GLU HB3 H 1 1.942 0.018 . . 4 . . . A 73 GLU HB3 . 36185 1 542 . 1 1 62 62 GLU HG2 H 1 2.346 0.007 . . 3 . . . A 73 GLU HG2 . 36185 1 543 . 1 1 62 62 GLU HG3 H 1 2.139 0.015 . . 3 . . . A 73 GLU HG3 . 36185 1 544 . 1 1 62 62 GLU CA C 13 57.567 0.033 . . 3 . . . A 73 GLU CA . 36185 1 545 . 1 1 62 62 GLU CB C 13 25.712 0.186 . . 2 . . . A 73 GLU CB . 36185 1 546 . 1 1 62 62 GLU N N 15 122.754 0.044 . . 18 . . . A 73 GLU N . 36185 1 547 . 1 1 63 63 GLU H H 1 7.810 0.006 . . 21 . . . A 74 GLU H . 36185 1 548 . 1 1 63 63 GLU HA H 1 3.979 0.019 . . 3 . . . A 74 GLU HA . 36185 1 549 . 1 1 63 63 GLU HB2 H 1 2.141 0.007 . . 5 . . . A 74 GLU HB2 . 36185 1 550 . 1 1 63 63 GLU HB3 H 1 1.901 0.019 . . 4 . . . A 74 GLU HB3 . 36185 1 551 . 1 1 63 63 GLU HG2 H 1 2.365 0.012 . . 4 . . . A 74 GLU HG2 . 36185 1 552 . 1 1 63 63 GLU HG3 H 1 2.157 0.016 . . 4 . . . A 74 GLU HG3 . 36185 1 553 . 1 1 63 63 GLU CA C 13 55.717 0.152 . . 3 . . . A 74 GLU CA . 36185 1 554 . 1 1 63 63 GLU CB C 13 27.761 0.079 . . 3 . . . A 74 GLU CB . 36185 1 555 . 1 1 63 63 GLU N N 15 118.951 0.090 . . 19 . . . A 74 GLU N . 36185 1 556 . 1 1 64 64 ALA H H 1 7.459 0.015 . . 29 . . . A 75 ALA H . 36185 1 557 . 1 1 64 64 ALA HA H 1 3.560 0.026 . . 6 . . . A 75 ALA HA . 36185 1 558 . 1 1 64 64 ALA HB1 H 1 1.556 0.012 . . 5 . . . A 75 ALA HB1 . 36185 1 559 . 1 1 64 64 ALA HB2 H 1 1.556 0.012 . . 5 . . . A 75 ALA HB2 . 36185 1 560 . 1 1 64 64 ALA HB3 H 1 1.556 0.012 . . 3 . . . A 75 ALA HB3 . 36185 1 561 . 1 1 64 64 ALA CA C 13 52.121 0.105 . . 3 . . . A 75 ALA CA . 36185 1 562 . 1 1 64 64 ALA CB C 13 15.898 0.027 . . 3 . . . A 75 ALA CB . 36185 1 563 . 1 1 64 64 ALA N N 15 122.556 0.095 . . 27 . . . A 75 ALA N . 36185 1 564 . 1 1 65 65 GLU H H 1 8.670 0.019 . . 23 . . . A 76 GLU H . 36185 1 565 . 1 1 65 65 GLU HA H 1 4.350 0.093 . . 4 . . . A 76 GLU HA . 36185 1 566 . 1 1 65 65 GLU HB2 H 1 2.101 0.033 . . 6 . . . A 76 GLU HB2 . 36185 1 567 . 1 1 65 65 GLU HB3 H 1 2.040 0.008 . . 5 . . . A 76 GLU HB3 . 36185 1 568 . 1 1 65 65 GLU HG2 H 1 2.657 0.050 . . 5 . . . A 76 GLU HG2 . 36185 1 569 . 1 1 65 65 GLU HG3 H 1 2.477 0.010 . . 4 . . . A 76 GLU HG3 . 36185 1 570 . 1 1 65 65 GLU CA C 13 56.032 0.023 . . 3 . . . A 76 GLU CA . 36185 1 571 . 1 1 65 65 GLU CB C 13 26.563 0.081 . . 3 . . . A 76 GLU CB . 36185 1 572 . 1 1 65 65 GLU N N 15 116.535 0.064 . . 21 . . . A 76 GLU N . 36185 1 573 . 1 1 66 66 ALA H H 1 7.831 0.026 . . 25 . . . A 77 ALA H . 36185 1 574 . 1 1 66 66 ALA HA H 1 4.042 0.008 . . 3 . . . A 77 ALA HA . 36185 1 575 . 1 1 66 66 ALA HB1 H 1 1.473 0.014 . . 5 . . . A 77 ALA HB1 . 36185 1 576 . 1 1 66 66 ALA HB2 H 1 1.473 0.014 . . 4 . . . A 77 ALA HB2 . 36185 1 577 . 1 1 66 66 ALA HB3 H 1 1.473 0.014 . . 5 . . . A 77 ALA HB3 . 36185 1 578 . 1 1 66 66 ALA CA C 13 51.907 0.063 . . 3 . . . A 77 ALA CA . 36185 1 579 . 1 1 66 66 ALA CB C 13 15.010 0.069 . . 3 . . . A 77 ALA CB . 36185 1 580 . 1 1 66 66 ALA N N 15 120.791 0.153 . . 21 . . . A 77 ALA N . 36185 1 581 . 1 1 67 67 PHE H H 1 7.434 0.054 . . 23 . . . A 78 PHE H . 36185 1 582 . 1 1 67 67 PHE HA H 1 3.955 0.018 . . 3 . . . A 78 PHE HA . 36185 1 583 . 1 1 67 67 PHE HB2 H 1 2.945 0.016 . . 6 . . . A 78 PHE HB2 . 36185 1 584 . 1 1 67 67 PHE HB3 H 1 2.736 0.013 . . 5 . . . A 78 PHE HB3 . 36185 1 585 . 1 1 67 67 PHE CA C 13 57.923 0.057 . . 3 . . . A 78 PHE CA . 36185 1 586 . 1 1 67 67 PHE CB C 13 36.397 0.157 . . 3 . . . A 78 PHE CB . 36185 1 587 . 1 1 67 67 PHE N N 15 119.057 0.036 . . 19 . . . A 78 PHE N . 36185 1 588 . 1 1 68 68 GLN H H 1 8.305 0.026 . . 26 . . . A 79 GLN H . 36185 1 589 . 1 1 68 68 GLN HA H 1 3.554 0.011 . . 7 . . . A 79 GLN HA . 36185 1 590 . 1 1 68 68 GLN HB2 H 1 2.060 0.015 . . 6 . . . A 79 GLN HB2 . 36185 1 591 . 1 1 68 68 GLN HB3 H 1 1.876 0.018 . . 4 . . . A 79 GLN HB3 . 36185 1 592 . 1 1 68 68 GLN HG2 H 1 2.502 0.025 . . 5 . . . A 79 GLN HG2 . 36185 1 593 . 1 1 68 68 GLN HG3 H 1 2.502 0.025 . . 5 . . . A 79 GLN HG3 . 36185 1 594 . 1 1 68 68 GLN CA C 13 55.932 0.015 . . 3 . . . A 79 GLN CA . 36185 1 595 . 1 1 68 68 GLN CB C 13 24.319 0.017 . . 2 . . . A 79 GLN CB . 36185 1 596 . 1 1 68 68 GLN N N 15 116.449 0.098 . . 21 . . . A 79 GLN N . 36185 1 597 . 1 1 69 69 LYS H H 1 7.518 0.012 . . 26 . . . A 80 LYS H . 36185 1 598 . 1 1 69 69 LYS HA H 1 3.919 0.012 . . 5 . . . A 80 LYS HA . 36185 1 599 . 1 1 69 69 LYS HB2 H 1 1.838 0.015 . . 4 . . . A 80 LYS HB2 . 36185 1 600 . 1 1 69 69 LYS HB3 H 1 1.745 0.013 . . 4 . . . A 80 LYS HB3 . 36185 1 601 . 1 1 69 69 LYS HG2 H 1 1.538 0.009 . . 3 . . . A 80 LYS HG2 . 36185 1 602 . 1 1 69 69 LYS HG3 H 1 1.538 0.009 . . 3 . . . A 80 LYS HG3 . 36185 1 603 . 1 1 69 69 LYS HD2 H 1 1.684 0.003 . . 3 . . . A 80 LYS HD2 . 36185 1 604 . 1 1 69 69 LYS HD3 H 1 1.684 0.003 . . 3 . . . A 80 LYS HD3 . 36185 1 605 . 1 1 69 69 LYS HE2 H 1 2.995 0.014 . . 3 . . . A 80 LYS HE2 . 36185 1 606 . 1 1 69 69 LYS HE3 H 1 2.995 0.014 . . 3 . . . A 80 LYS HE3 . 36185 1 607 . 1 1 69 69 LYS CA C 13 54.620 0.015 . . 3 . . . A 80 LYS CA . 36185 1 608 . 1 1 69 69 LYS CB C 13 30.091 0.023 . . 3 . . . A 80 LYS CB . 36185 1 609 . 1 1 69 69 LYS N N 15 113.582 0.059 . . 24 . . . A 80 LYS N . 36185 1 610 . 1 1 70 70 ALA H H 1 6.992 0.027 . . 27 . . . A 81 ALA H . 36185 1 611 . 1 1 70 70 ALA HA H 1 3.518 0.002 . . 2 . . . A 81 ALA HA . 36185 1 612 . 1 1 70 70 ALA HB1 H 1 1.186 0.002 . . 2 . . . A 81 ALA HB1 . 36185 1 613 . 1 1 70 70 ALA HB2 H 1 1.186 0.002 . . 2 . . . A 81 ALA HB2 . 36185 1 614 . 1 1 70 70 ALA HB3 H 1 1.186 0.002 . . 2 . . . A 81 ALA HB3 . 36185 1 615 . 1 1 70 70 ALA CA C 13 46.791 0.000 . . 1 . . . A 81 ALA CA . 36185 1 616 . 1 1 70 70 ALA CB C 13 15.574 0.000 . . 1 . . . A 81 ALA CB . 36185 1 617 . 1 1 70 70 ALA N N 15 120.727 0.068 . . 25 . . . A 81 ALA N . 36185 1 618 . 1 1 72 72 PRO HA H 1 4.808 0.004 . . 2 . . . A 83 PRO HA . 36185 1 619 . 1 1 72 72 PRO HB2 H 1 2.303 0.015 . . 4 . . . A 83 PRO HB2 . 36185 1 620 . 1 1 72 72 PRO HG2 H 1 1.966 0.012 . . 2 . . . A 83 PRO HG2 . 36185 1 621 . 1 1 72 72 PRO HD2 H 1 3.871 0.003 . . 2 . . . A 83 PRO HD2 . 36185 1 622 . 1 1 72 72 PRO CA C 13 58.944 0.003 . . 2 . . . A 83 PRO CA . 36185 1 623 . 1 1 72 72 PRO CB C 13 30.091 0.000 . . 1 . . . A 83 PRO CB . 36185 1 624 . 1 1 72 72 PRO CG C 13 27.452 0.000 . . 1 . . . A 83 PRO CG . 36185 1 625 . 1 1 73 73 MET H H 1 8.047 0.027 . . 22 . . . A 84 MET H . 36185 1 626 . 1 1 73 73 MET HA H 1 4.850 0.010 . . 5 . . . A 84 MET HA . 36185 1 627 . 1 1 73 73 MET HB2 H 1 2.233 0.347 . . 5 . . . A 84 MET HB2 . 36185 1 628 . 1 1 73 73 MET HB3 H 1 1.736 0.022 . . 4 . . . A 84 MET HB3 . 36185 1 629 . 1 1 73 73 MET HG2 H 1 2.586 0.012 . . 3 . . . A 84 MET HG2 . 36185 1 630 . 1 1 73 73 MET HG3 H 1 2.410 0.004 . . 2 . . . A 84 MET HG3 . 36185 1 631 . 1 1 73 73 MET HE1 H 1 2.164 0.000 . . 1 . . . A 84 MET HE1 . 36185 1 632 . 1 1 73 73 MET HE2 H 1 2.164 0.000 . . 1 . . . A 84 MET HE2 . 36185 1 633 . 1 1 73 73 MET HE3 H 1 2.164 0.000 . . 1 . . . A 84 MET HE3 . 36185 1 634 . 1 1 73 73 MET CA C 13 51.799 0.066 . . 3 . . . A 84 MET CA . 36185 1 635 . 1 1 73 73 MET CB C 13 30.683 0.165 . . 3 . . . A 84 MET CB . 36185 1 636 . 1 1 73 73 MET N N 15 113.962 0.054 . . 20 . . . A 84 MET N . 36185 1 637 . 1 1 74 74 TYR H H 1 9.033 0.023 . . 27 . . . A 85 TYR H . 36185 1 638 . 1 1 74 74 TYR HA H 1 4.394 0.033 . . 5 . . . A 85 TYR HA . 36185 1 639 . 1 1 74 74 TYR HB2 H 1 2.911 0.024 . . 5 . . . A 85 TYR HB2 . 36185 1 640 . 1 1 74 74 TYR HB3 H 1 2.011 0.009 . . 4 . . . A 85 TYR HB3 . 36185 1 641 . 1 1 74 74 TYR HE1 H 1 6.811 0.004 . . 2 . . . A 85 TYR HE1 . 36185 1 642 . 1 1 74 74 TYR HE2 H 1 6.811 0.004 . . 2 . . . A 85 TYR HE2 . 36185 1 643 . 1 1 74 74 TYR CA C 13 53.611 0.005 . . 3 . . . A 85 TYR CA . 36185 1 644 . 1 1 74 74 TYR CB C 13 36.882 0.073 . . 3 . . . A 85 TYR CB . 36185 1 645 . 1 1 74 74 TYR N N 15 124.010 0.057 . . 24 . . . A 85 TYR N . 36185 1 646 . 1 1 75 75 ASP H H 1 8.542 0.047 . . 23 . . . A 86 ASP H . 36185 1 647 . 1 1 75 75 ASP HA H 1 4.011 0.012 . . 3 . . . A 86 ASP HA . 36185 1 648 . 1 1 75 75 ASP HB2 H 1 2.562 0.028 . . 5 . . . A 86 ASP HB2 . 36185 1 649 . 1 1 75 75 ASP HB3 H 1 2.465 0.020 . . 4 . . . A 86 ASP HB3 . 36185 1 650 . 1 1 75 75 ASP CA C 13 53.353 0.003 . . 2 . . . A 86 ASP CA . 36185 1 651 . 1 1 75 75 ASP CB C 13 35.865 0.004 . . 2 . . . A 86 ASP CB . 36185 1 652 . 1 1 75 75 ASP N N 15 129.401 0.090 . . 22 . . . A 86 ASP N . 36185 1 653 . 1 1 76 76 ASP H H 1 8.602 0.057 . . 21 . . . A 87 ASP H . 36185 1 654 . 1 1 76 76 ASP HA H 1 4.402 0.010 . . 3 . . . A 87 ASP HA . 36185 1 655 . 1 1 76 76 ASP HB2 H 1 2.821 0.018 . . 5 . . . A 87 ASP HB2 . 36185 1 656 . 1 1 76 76 ASP HB3 H 1 2.712 0.013 . . 5 . . . A 87 ASP HB3 . 36185 1 657 . 1 1 76 76 ASP CA C 13 52.056 0.044 . . 2 . . . A 87 ASP CA . 36185 1 658 . 1 1 76 76 ASP CB C 13 36.842 0.012 . . 2 . . . A 87 ASP CB . 36185 1 659 . 1 1 76 76 ASP N N 15 113.301 0.078 . . 20 . . . A 87 ASP N . 36185 1 660 . 1 1 77 77 VAL H H 1 7.846 0.019 . . 23 . . . A 88 VAL H . 36185 1 661 . 1 1 77 77 VAL HA H 1 4.180 0.009 . . 3 . . . A 88 VAL HA . 36185 1 662 . 1 1 77 77 VAL HB H 1 2.164 0.006 . . 3 . . . A 88 VAL HB . 36185 1 663 . 1 1 77 77 VAL HG11 H 1 0.968 0.024 . . 5 . . . A 88 VAL HG11 . 36185 1 664 . 1 1 77 77 VAL HG12 H 1 0.968 0.024 . . 3 . . . A 88 VAL HG12 . 36185 1 665 . 1 1 77 77 VAL HG13 H 1 0.968 0.024 . . 5 . . . A 88 VAL HG13 . 36185 1 666 . 1 1 77 77 VAL HG21 H 1 0.912 0.028 . . 5 . . . A 88 VAL HG21 . 36185 1 667 . 1 1 77 77 VAL HG22 H 1 0.912 0.028 . . 3 . . . A 88 VAL HG22 . 36185 1 668 . 1 1 77 77 VAL HG23 H 1 0.912 0.028 . . 5 . . . A 88 VAL HG23 . 36185 1 669 . 1 1 77 77 VAL CA C 13 58.329 0.084 . . 3 . . . A 88 VAL CA . 36185 1 670 . 1 1 77 77 VAL CB C 13 31.093 0.045 . . 3 . . . A 88 VAL CB . 36185 1 671 . 1 1 77 77 VAL N N 15 121.110 0.126 . . 21 . . . A 88 VAL N . 36185 1 672 . 1 1 78 78 GLN H H 1 8.738 0.016 . . 16 . . . A 89 GLN H . 36185 1 673 . 1 1 78 78 GLN HA H 1 4.049 0.012 . . 3 . . . A 89 GLN HA . 36185 1 674 . 1 1 78 78 GLN HB2 H 1 1.989 0.006 . . 3 . . . A 89 GLN HB2 . 36185 1 675 . 1 1 78 78 GLN HB3 H 1 1.989 0.006 . . 3 . . . A 89 GLN HB3 . 36185 1 676 . 1 1 78 78 GLN HG2 H 1 2.278 0.012 . . 3 . . . A 89 GLN HG2 . 36185 1 677 . 1 1 78 78 GLN HG3 H 1 2.278 0.012 . . 3 . . . A 89 GLN HG3 . 36185 1 678 . 1 1 78 78 GLN CA C 13 53.007 0.046 . . 2 . . . A 89 GLN CA . 36185 1 679 . 1 1 78 78 GLN CB C 13 25.903 0.034 . . 3 . . . A 89 GLN CB . 36185 1 680 . 1 1 78 78 GLN N N 15 127.267 0.055 . . 15 . . . A 89 GLN N . 36185 1 681 . 1 1 79 79 LEU H H 1 7.578 0.026 . . 28 . . . A 90 LEU H . 36185 1 682 . 1 1 79 79 LEU HA H 1 4.794 0.050 . . 4 . . . A 90 LEU HA . 36185 1 683 . 1 1 79 79 LEU HB2 H 1 2.005 0.035 . . 5 . . . A 90 LEU HB2 . 36185 1 684 . 1 1 79 79 LEU HB3 H 1 1.905 0.024 . . 4 . . . A 90 LEU HB3 . 36185 1 685 . 1 1 79 79 LEU HG H 1 1.864 0.002 . . 2 . . . A 90 LEU HG . 36185 1 686 . 1 1 79 79 LEU HD11 H 1 0.988 0.009 . . 3 . . . A 90 LEU HD11 . 36185 1 687 . 1 1 79 79 LEU HD12 H 1 0.988 0.009 . . 3 . . . A 90 LEU HD12 . 36185 1 688 . 1 1 79 79 LEU HD13 H 1 0.988 0.009 . . 3 . . . A 90 LEU HD13 . 36185 1 689 . 1 1 79 79 LEU HD21 H 1 0.669 0.013 . . 3 . . . A 90 LEU HD21 . 36185 1 690 . 1 1 79 79 LEU HD22 H 1 0.669 0.013 . . 3 . . . A 90 LEU HD22 . 36185 1 691 . 1 1 79 79 LEU HD23 H 1 0.669 0.013 . . 3 . . . A 90 LEU HD23 . 36185 1 692 . 1 1 79 79 LEU CA C 13 52.318 0.081 . . 3 . . . A 90 LEU CA . 36185 1 693 . 1 1 79 79 LEU CB C 13 39.360 0.049 . . 3 . . . A 90 LEU CB . 36185 1 694 . 1 1 79 79 LEU N N 15 128.061 0.061 . . 23 . . . A 90 LEU N . 36185 1 695 . 1 1 80 80 THR H H 1 9.483 0.017 . . 25 . . . A 91 THR H . 36185 1 696 . 1 1 80 80 THR HA H 1 4.581 0.018 . . 5 . . . A 91 THR HA . 36185 1 697 . 1 1 80 80 THR HB H 1 4.205 0.010 . . 3 . . . A 91 THR HB . 36185 1 698 . 1 1 80 80 THR HG21 H 1 1.257 0.033 . . 5 . . . A 91 THR HG21 . 36185 1 699 . 1 1 80 80 THR HG22 H 1 1.257 0.033 . . 5 . . . A 91 THR HG22 . 36185 1 700 . 1 1 80 80 THR HG23 H 1 1.257 0.033 . . 5 . . . A 91 THR HG23 . 36185 1 701 . 1 1 80 80 THR CA C 13 58.214 0.091 . . 3 . . . A 91 THR CA . 36185 1 702 . 1 1 80 80 THR CB C 13 67.770 0.025 . . 3 . . . A 91 THR CB . 36185 1 703 . 1 1 80 80 THR N N 15 115.883 0.047 . . 23 . . . A 91 THR N . 36185 1 704 . 1 1 81 81 ALA H H 1 8.760 0.019 . . 30 . . . A 92 ALA H . 36185 1 705 . 1 1 81 81 ALA HA H 1 4.436 0.000 . . 1 . . . A 92 ALA HA . 36185 1 706 . 1 1 81 81 ALA HB1 H 1 1.467 0.021 . . 6 . . . A 92 ALA HB1 . 36185 1 707 . 1 1 81 81 ALA HB2 H 1 0.936 0.016 . . 3 . . . A 92 ALA HB2 . 36185 1 708 . 1 1 81 81 ALA HB3 H 1 0.758 0.015 . . 3 . . . A 92 ALA HB3 . 36185 1 709 . 1 1 81 81 ALA CA C 13 47.214 0.030 . . 3 . . . A 92 ALA CA . 36185 1 710 . 1 1 81 81 ALA CB C 13 21.094 0.016 . . 3 . . . A 92 ALA CB . 36185 1 711 . 1 1 81 81 ALA N N 15 123.608 0.052 . . 25 . . . A 92 ALA N . 36185 1 712 . 1 1 82 82 GLU H H 1 9.285 0.038 . . 29 . . . A 93 GLU H . 36185 1 713 . 1 1 82 82 GLU HA H 1 4.787 0.021 . . 3 . . . A 93 GLU HA . 36185 1 714 . 1 1 82 82 GLU HB2 H 1 2.337 0.024 . . 5 . . . A 93 GLU HB2 . 36185 1 715 . 1 1 82 82 GLU HB3 H 1 2.292 0.020 . . 4 . . . A 93 GLU HB3 . 36185 1 716 . 1 1 82 82 GLU HG2 H 1 2.461 0.004 . . 4 . . . A 93 GLU HG2 . 36185 1 717 . 1 1 82 82 GLU HG3 H 1 2.461 0.004 . . 4 . . . A 93 GLU HG3 . 36185 1 718 . 1 1 82 82 GLU CA C 13 51.691 0.050 . . 3 . . . A 93 GLU CA . 36185 1 719 . 1 1 82 82 GLU CB C 13 32.467 0.044 . . 3 . . . A 93 GLU CB . 36185 1 720 . 1 1 82 82 GLU N N 15 122.636 0.070 . . 26 . . . A 93 GLU N . 36185 1 721 . 1 1 83 83 MET H H 1 9.579 0.021 . . 28 . . . A 94 MET H . 36185 1 722 . 1 1 83 83 MET HA H 1 4.899 0.068 . . 5 . . . A 94 MET HA . 36185 1 723 . 1 1 83 83 MET HB2 H 1 2.126 0.027 . . 4 . . . A 94 MET HB2 . 36185 1 724 . 1 1 83 83 MET HB3 H 1 1.962 0.022 . . 4 . . . A 94 MET HB3 . 36185 1 725 . 1 1 83 83 MET HG2 H 1 3.112 0.012 . . 3 . . . A 94 MET HG2 . 36185 1 726 . 1 1 83 83 MET HG3 H 1 3.072 0.010 . . 3 . . . A 94 MET HG3 . 36185 1 727 . 1 1 83 83 MET HE1 H 1 2.119 0.000 . . 1 . . . A 94 MET HE1 . 36185 1 728 . 1 1 83 83 MET HE2 H 1 2.503 0.006 . . 4 . . . A 94 MET HE2 . 36185 1 729 . 1 1 83 83 MET HE3 H 1 2.119 0.000 . . 1 . . . A 94 MET HE3 . 36185 1 730 . 1 1 83 83 MET CA C 13 51.642 0.012 . . 2 . . . A 94 MET CA . 36185 1 731 . 1 1 83 83 MET CB C 13 30.564 0.028 . . 3 . . . A 94 MET CB . 36185 1 732 . 1 1 83 83 MET N N 15 124.333 0.082 . . 23 . . . A 94 MET N . 36185 1 733 . 1 1 84 84 LYS H H 1 8.996 0.012 . . 24 . . . A 95 LYS H . 36185 1 734 . 1 1 84 84 LYS HA H 1 4.027 0.020 . . 4 . . . A 95 LYS HA . 36185 1 735 . 1 1 84 84 LYS HB2 H 1 1.501 0.023 . . 5 . . . A 95 LYS HB2 . 36185 1 736 . 1 1 84 84 LYS HB3 H 1 1.477 0.016 . . 4 . . . A 95 LYS HB3 . 36185 1 737 . 1 1 84 84 LYS HG2 H 1 1.200 0.008 . . 3 . . . A 95 LYS HG2 . 36185 1 738 . 1 1 84 84 LYS HG3 H 1 1.200 0.008 . . 3 . . . A 95 LYS HG3 . 36185 1 739 . 1 1 84 84 LYS HD2 H 1 1.556 0.003 . . 3 . . . A 95 LYS HD2 . 36185 1 740 . 1 1 84 84 LYS HD3 H 1 1.556 0.003 . . 3 . . . A 95 LYS HD3 . 36185 1 741 . 1 1 84 84 LYS HE2 H 1 3.119 0.007 . . 3 . . . A 95 LYS HE2 . 36185 1 742 . 1 1 84 84 LYS HE3 H 1 3.119 0.007 . . 3 . . . A 95 LYS HE3 . 36185 1 743 . 1 1 84 84 LYS CA C 13 57.979 0.015 . . 4 . . . A 95 LYS CA . 36185 1 744 . 1 1 84 84 LYS CB C 13 29.857 0.100 . . 3 . . . A 95 LYS CB . 36185 1 745 . 1 1 84 84 LYS N N 15 124.264 0.086 . . 23 . . . A 95 LYS N . 36185 1 746 . 1 1 85 85 THR H H 1 9.131 0.022 . . 29 . . . A 96 THR H . 36185 1 747 . 1 1 85 85 THR HA H 1 4.085 0.002 . . 5 . . . A 96 THR HA . 36185 1 748 . 1 1 85 85 THR HB H 1 3.875 0.016 . . 4 . . . A 96 THR HB . 36185 1 749 . 1 1 85 85 THR HG21 H 1 1.146 0.016 . . 5 . . . A 96 THR HG21 . 36185 1 750 . 1 1 85 85 THR HG22 H 1 1.146 0.016 . . 5 . . . A 96 THR HG22 . 36185 1 751 . 1 1 85 85 THR HG23 H 1 1.146 0.016 . . 5 . . . A 96 THR HG23 . 36185 1 752 . 1 1 85 85 THR CA C 13 63.030 0.013 . . 2 . . . A 96 THR CA . 36185 1 753 . 1 1 85 85 THR CB C 13 64.727 0.004 . . 2 . . . A 96 THR CB . 36185 1 754 . 1 1 85 85 THR N N 15 110.387 0.100 . . 25 . . . A 96 THR N . 36185 1 755 . 1 1 86 86 THR H H 1 6.904 0.064 . . 25 . . . A 97 THR H . 36185 1 756 . 1 1 86 86 THR HA H 1 4.418 0.020 . . 6 . . . A 97 THR HA . 36185 1 757 . 1 1 86 86 THR HB H 1 4.012 0.001 . . 5 . . . A 97 THR HB . 36185 1 758 . 1 1 86 86 THR HG21 H 1 1.391 0.011 . . 4 . . . A 97 THR HG21 . 36185 1 759 . 1 1 86 86 THR HG22 H 1 1.391 0.011 . . 4 . . . A 97 THR HG22 . 36185 1 760 . 1 1 86 86 THR HG23 H 1 1.391 0.011 . . 4 . . . A 97 THR HG23 . 36185 1 761 . 1 1 86 86 THR CA C 13 62.628 0.072 . . 3 . . . A 97 THR CA . 36185 1 762 . 1 1 86 86 THR CB C 13 65.219 0.374 . . 4 . . . A 97 THR CB . 36185 1 763 . 1 1 86 86 THR N N 15 118.645 0.043 . . 22 . . . A 97 THR N . 36185 1 764 . 1 1 87 87 TYR H H 1 8.380 0.016 . . 25 . . . A 98 TYR H . 36185 1 765 . 1 1 87 87 TYR HA H 1 4.060 0.005 . . 5 . . . A 98 TYR HA . 36185 1 766 . 1 1 87 87 TYR HB2 H 1 3.128 0.022 . . 6 . . . A 98 TYR HB2 . 36185 1 767 . 1 1 87 87 TYR HB3 H 1 2.780 0.023 . . 9 . . . A 98 TYR HB3 . 36185 1 768 . 1 1 87 87 TYR CA C 13 58.284 0.070 . . 3 . . . A 98 TYR CA . 36185 1 769 . 1 1 87 87 TYR CB C 13 34.781 0.068 . . 3 . . . A 98 TYR CB . 36185 1 770 . 1 1 87 87 TYR N N 15 124.790 0.069 . . 23 . . . A 98 TYR N . 36185 1 771 . 1 1 88 88 LEU H H 1 8.498 0.016 . . 28 . . . A 99 LEU H . 36185 1 772 . 1 1 88 88 LEU HA H 1 3.907 0.464 . . 3 . . . A 99 LEU HA . 36185 1 773 . 1 1 88 88 LEU HB2 H 1 1.910 0.035 . . 3 . . . A 99 LEU HB2 . 36185 1 774 . 1 1 88 88 LEU HG H 1 1.683 0.002 . . 2 . . . A 99 LEU HG . 36185 1 775 . 1 1 88 88 LEU HD11 H 1 0.889 0.013 . . 4 . . . A 99 LEU HD11 . 36185 1 776 . 1 1 88 88 LEU HD12 H 1 0.889 0.013 . . 4 . . . A 99 LEU HD12 . 36185 1 777 . 1 1 88 88 LEU HD13 H 1 0.889 0.013 . . 4 . . . A 99 LEU HD13 . 36185 1 778 . 1 1 88 88 LEU HD21 H 1 0.762 0.015 . . 4 . . . A 99 LEU HD21 . 36185 1 779 . 1 1 88 88 LEU HD22 H 1 0.762 0.015 . . 2 . . . A 99 LEU HD22 . 36185 1 780 . 1 1 88 88 LEU HD23 H 1 0.762 0.015 . . 4 . . . A 99 LEU HD23 . 36185 1 781 . 1 1 88 88 LEU CA C 13 54.574 0.108 . . 3 . . . A 99 LEU CA . 36185 1 782 . 1 1 88 88 LEU CB C 13 38.259 0.041 . . 3 . . . A 99 LEU CB . 36185 1 783 . 1 1 88 88 LEU N N 15 118.091 0.062 . . 25 . . . A 99 LEU N . 36185 1 784 . 1 1 89 89 GLU H H 1 7.826 0.021 . . 22 . . . A 100 GLU H . 36185 1 785 . 1 1 89 89 GLU HA H 1 3.984 0.004 . . 2 . . . A 100 GLU HA . 36185 1 786 . 1 1 89 89 GLU HB2 H 1 2.185 0.038 . . 4 . . . A 100 GLU HB2 . 36185 1 787 . 1 1 89 89 GLU HB3 H 1 2.037 0.017 . . 3 . . . A 100 GLU HB3 . 36185 1 788 . 1 1 89 89 GLU HG2 H 1 2.484 0.016 . . 6 . . . A 100 GLU HG2 . 36185 1 789 . 1 1 89 89 GLU HG3 H 1 2.358 0.022 . . 6 . . . A 100 GLU HG3 . 36185 1 790 . 1 1 89 89 GLU CA C 13 56.147 0.051 . . 3 . . . A 100 GLU CA . 36185 1 791 . 1 1 89 89 GLU CB C 13 26.315 0.034 . . 3 . . . A 100 GLU CB . 36185 1 792 . 1 1 89 89 GLU N N 15 120.138 0.164 . . 20 . . . A 100 GLU N . 36185 1 793 . 1 1 90 90 ARG H H 1 8.117 0.021 . . 25 . . . A 101 ARG H . 36185 1 794 . 1 1 90 90 ARG HA H 1 4.127 0.003 . . 4 . . . A 101 ARG HA . 36185 1 795 . 1 1 90 90 ARG HB2 H 1 1.777 0.028 . . 5 . . . A 101 ARG HB2 . 36185 1 796 . 1 1 90 90 ARG HB3 H 1 1.744 0.027 . . 4 . . . A 101 ARG HB3 . 36185 1 797 . 1 1 90 90 ARG HG2 H 1 1.664 0.003 . . 2 . . . A 101 ARG HG2 . 36185 1 798 . 1 1 90 90 ARG HG3 H 1 1.550 0.002 . . 2 . . . A 101 ARG HG3 . 36185 1 799 . 1 1 90 90 ARG HD2 H 1 3.228 0.061 . . 4 . . . A 101 ARG HD2 . 36185 1 800 . 1 1 90 90 ARG HD3 H 1 3.228 0.061 . . 4 . . . A 101 ARG HD3 . 36185 1 801 . 1 1 90 90 ARG CA C 13 56.052 0.010 . . 3 . . . A 101 ARG CA . 36185 1 802 . 1 1 90 90 ARG CB C 13 26.222 0.012 . . 3 . . . A 101 ARG CB . 36185 1 803 . 1 1 90 90 ARG N N 15 121.335 0.065 . . 22 . . . A 101 ARG N . 36185 1 804 . 1 1 91 91 LYS H H 1 8.081 0.022 . . 23 . . . A 102 LYS H . 36185 1 805 . 1 1 91 91 LYS HA H 1 3.884 0.015 . . 4 . . . A 102 LYS HA . 36185 1 806 . 1 1 91 91 LYS HB2 H 1 1.578 0.016 . . 4 . . . A 102 LYS HB2 . 36185 1 807 . 1 1 91 91 LYS HB3 H 1 1.516 0.012 . . 4 . . . A 102 LYS HB3 . 36185 1 808 . 1 1 91 91 LYS HG2 H 1 0.939 0.011 . . 4 . . . A 102 LYS HG2 . 36185 1 809 . 1 1 91 91 LYS HG3 H 1 0.884 0.004 . . 3 . . . A 102 LYS HG3 . 36185 1 810 . 1 1 91 91 LYS HD2 H 1 1.409 0.002 . . 2 . . . A 102 LYS HD2 . 36185 1 811 . 1 1 91 91 LYS HD3 H 1 1.409 0.002 . . 2 . . . A 102 LYS HD3 . 36185 1 812 . 1 1 91 91 LYS HE2 H 1 2.935 0.008 . . 4 . . . A 102 LYS HE2 . 36185 1 813 . 1 1 91 91 LYS HE3 H 1 2.935 0.008 . . 4 . . . A 102 LYS HE3 . 36185 1 814 . 1 1 91 91 LYS CA C 13 53.780 0.042 . . 3 . . . A 102 LYS CA . 36185 1 815 . 1 1 91 91 LYS CB C 13 26.755 0.047 . . 3 . . . A 102 LYS CB . 36185 1 816 . 1 1 91 91 LYS N N 15 119.320 0.073 . . 21 . . . A 102 LYS N . 36185 1 817 . 1 1 92 92 ALA H H 1 7.689 0.019 . . 25 . . . A 103 ALA H . 36185 1 818 . 1 1 92 92 ALA HA H 1 4.099 0.015 . . 2 . . . A 103 ALA HA . 36185 1 819 . 1 1 92 92 ALA HB1 H 1 1.468 0.012 . . 4 . . . A 103 ALA HB1 . 36185 1 820 . 1 1 92 92 ALA HB2 H 1 1.468 0.012 . . 4 . . . A 103 ALA HB2 . 36185 1 821 . 1 1 92 92 ALA HB3 H 1 1.468 0.012 . . 4 . . . A 103 ALA HB3 . 36185 1 822 . 1 1 92 92 ALA CA C 13 51.470 0.097 . . 3 . . . A 103 ALA CA . 36185 1 823 . 1 1 92 92 ALA CB C 13 14.898 0.031 . . 3 . . . A 103 ALA CB . 36185 1 824 . 1 1 92 92 ALA N N 15 121.103 0.075 . . 24 . . . A 103 ALA N . 36185 1 825 . 1 1 93 93 GLU H H 1 7.814 0.003 . . 14 . . . A 104 GLU H . 36185 1 826 . 1 1 93 93 GLU HA H 1 4.101 0.004 . . 4 . . . A 104 GLU HA . 36185 1 827 . 1 1 93 93 GLU HB2 H 1 2.127 0.013 . . 5 . . . A 104 GLU HB2 . 36185 1 828 . 1 1 93 93 GLU HB3 H 1 2.003 0.004 . . 4 . . . A 104 GLU HB3 . 36185 1 829 . 1 1 93 93 GLU HG2 H 1 2.406 0.010 . . 3 . . . A 104 GLU HG2 . 36185 1 830 . 1 1 93 93 GLU HG3 H 1 2.267 0.012 . . 3 . . . A 104 GLU HG3 . 36185 1 831 . 1 1 93 93 GLU CA C 13 55.331 0.049 . . 3 . . . A 104 GLU CA . 36185 1 832 . 1 1 93 93 GLU CB C 13 26.544 0.103 . . 3 . . . A 104 GLU CB . 36185 1 833 . 1 1 93 93 GLU N N 15 119.205 0.057 . . 14 . . . A 104 GLU N . 36185 1 834 . 1 1 94 94 GLU H H 1 7.981 0.025 . . 17 . . . A 105 GLU H . 36185 1 835 . 1 1 94 94 GLU HA H 1 4.064 0.000 . . 3 . . . A 105 GLU HA . 36185 1 836 . 1 1 94 94 GLU HB2 H 1 2.110 0.019 . . 5 . . . A 105 GLU HB2 . 36185 1 837 . 1 1 94 94 GLU HB3 H 1 1.993 0.025 . . 4 . . . A 105 GLU HB3 . 36185 1 838 . 1 1 94 94 GLU HG2 H 1 2.471 0.020 . . 3 . . . A 105 GLU HG2 . 36185 1 839 . 1 1 94 94 GLU HG3 H 1 2.192 0.012 . . 3 . . . A 105 GLU HG3 . 36185 1 840 . 1 1 94 94 GLU CA C 13 55.333 0.026 . . 3 . . . A 105 GLU CA . 36185 1 841 . 1 1 94 94 GLU CB C 13 26.644 0.083 . . 2 . . . A 105 GLU CB . 36185 1 842 . 1 1 94 94 GLU N N 15 120.222 0.060 . . 16 . . . A 105 GLU N . 36185 1 843 . 1 1 95 95 ILE H H 1 7.793 0.006 . . 24 . . . A 106 ILE H . 36185 1 844 . 1 1 95 95 ILE HA H 1 3.971 0.017 . . 3 . . . A 106 ILE HA . 36185 1 845 . 1 1 95 95 ILE HB H 1 1.918 0.013 . . 4 . . . A 106 ILE HB . 36185 1 846 . 1 1 95 95 ILE HG12 H 1 1.584 0.003 . . 2 . . . A 106 ILE HG12 . 36185 1 847 . 1 1 95 95 ILE HG13 H 1 1.252 0.008 . . 3 . . . A 106 ILE HG13 . 36185 1 848 . 1 1 95 95 ILE HG21 H 1 0.926 0.007 . . 3 . . . A 106 ILE HG21 . 36185 1 849 . 1 1 95 95 ILE HG22 H 1 0.926 0.007 . . 3 . . . A 106 ILE HG22 . 36185 1 850 . 1 1 95 95 ILE HG23 H 1 0.926 0.007 . . 3 . . . A 106 ILE HG23 . 36185 1 851 . 1 1 95 95 ILE HD11 H 1 0.857 0.000 . . 1 . . . A 106 ILE HD11 . 36185 1 852 . 1 1 95 95 ILE HD12 H 1 0.857 0.000 . . 1 . . . A 106 ILE HD12 . 36185 1 853 . 1 1 95 95 ILE HD13 H 1 0.857 0.000 . . 1 . . . A 106 ILE HD13 . 36185 1 854 . 1 1 95 95 ILE CA C 13 59.731 0.028 . . 3 . . . A 106 ILE CA . 36185 1 855 . 1 1 95 95 ILE CB C 13 35.159 0.000 . . 2 . . . A 106 ILE CB . 36185 1 856 . 1 1 95 95 ILE N N 15 118.930 0.094 . . 22 . . . A 106 ILE N . 36185 1 857 . 1 1 96 96 ALA H H 1 7.816 0.003 . . 23 . . . A 107 ALA H . 36185 1 858 . 1 1 96 96 ALA HA H 1 4.213 0.011 . . 4 . . . A 107 ALA HA . 36185 1 859 . 1 1 96 96 ALA HB1 H 1 1.450 0.010 . . 2 . . . A 107 ALA HB1 . 36185 1 860 . 1 1 96 96 ALA HB2 H 1 1.450 0.010 . . 2 . . . A 107 ALA HB2 . 36185 1 861 . 1 1 96 96 ALA HB3 H 1 1.450 0.010 . . 2 . . . A 107 ALA HB3 . 36185 1 862 . 1 1 96 96 ALA CA C 13 50.311 0.024 . . 3 . . . A 107 ALA CA . 36185 1 863 . 1 1 96 96 ALA CB C 13 15.709 0.057 . . 3 . . . A 107 ALA CB . 36185 1 864 . 1 1 96 96 ALA N N 15 124.444 0.064 . . 22 . . . A 107 ALA N . 36185 1 865 . 1 1 97 97 ALA H H 1 7.811 0.034 . . 18 . . . A 108 ALA H . 36185 1 866 . 1 1 97 97 ALA HA H 1 4.267 0.004 . . 4 . . . A 108 ALA HA . 36185 1 867 . 1 1 97 97 ALA HB1 H 1 1.539 0.143 . . 3 . . . A 108 ALA HB1 . 36185 1 868 . 1 1 97 97 ALA HB2 H 1 1.436 0.000 . . 1 . . . A 108 ALA HB2 . 36185 1 869 . 1 1 97 97 ALA HB3 H 1 1.322 0.000 . . 1 . . . A 108 ALA HB3 . 36185 1 870 . 1 1 97 97 ALA CA C 13 49.694 0.096 . . 3 . . . A 108 ALA CA . 36185 1 871 . 1 1 97 97 ALA CB C 13 15.928 0.054 . . 2 . . . A 108 ALA CB . 36185 1 872 . 1 1 97 97 ALA N N 15 120.903 0.084 . . 16 . . . A 108 ALA N . 36185 1 873 . 1 1 98 98 LYS H H 1 7.844 0.003 . . 20 . . . A 109 LYS H . 36185 1 874 . 1 1 98 98 LYS HA H 1 4.291 0.007 . . 4 . . . A 109 LYS HA . 36185 1 875 . 1 1 98 98 LYS HB2 H 1 1.866 0.063 . . 4 . . . A 109 LYS HB2 . 36185 1 876 . 1 1 98 98 LYS HB3 H 1 1.823 0.028 . . 4 . . . A 109 LYS HB3 . 36185 1 877 . 1 1 98 98 LYS HG2 H 1 1.482 0.021 . . 2 . . . A 109 LYS HG2 . 36185 1 878 . 1 1 98 98 LYS HG3 H 1 1.482 0.021 . . 2 . . . A 109 LYS HG3 . 36185 1 879 . 1 1 98 98 LYS HD2 H 1 1.695 0.000 . . 1 . . . A 109 LYS HD2 . 36185 1 880 . 1 1 98 98 LYS HD3 H 1 1.695 0.000 . . 1 . . . A 109 LYS HD3 . 36185 1 881 . 1 1 98 98 LYS HE2 H 1 3.017 0.014 . . 2 . . . A 109 LYS HE2 . 36185 1 882 . 1 1 98 98 LYS HE3 H 1 3.017 0.014 . . 2 . . . A 109 LYS HE3 . 36185 1 883 . 1 1 98 98 LYS CA C 13 53.407 0.057 . . 2 . . . A 109 LYS CA . 36185 1 884 . 1 1 98 98 LYS CB C 13 29.638 0.043 . . 2 . . . A 109 LYS CB . 36185 1 885 . 1 1 98 98 LYS N N 15 120.228 0.057 . . 18 . . . A 109 LYS N . 36185 1 886 . 1 1 99 99 LYS H H 1 7.845 0.003 . . 18 . . . A 110 LYS H . 36185 1 887 . 1 1 99 99 LYS HB2 H 1 1.940 0.026 . . 3 . . . A 110 LYS HB2 . 36185 1 888 . 1 1 99 99 LYS HB3 H 1 1.912 0.022 . . 3 . . . A 110 LYS HB3 . 36185 1 889 . 1 1 99 99 LYS HG2 H 1 1.456 0.011 . . 2 . . . A 110 LYS HG2 . 36185 1 890 . 1 1 99 99 LYS HG3 H 1 1.456 0.011 . . 2 . . . A 110 LYS HG3 . 36185 1 891 . 1 1 99 99 LYS HD2 H 1 1.695 0.002 . . 2 . . . A 110 LYS HD2 . 36185 1 892 . 1 1 99 99 LYS HD3 H 1 1.695 0.002 . . 2 . . . A 110 LYS HD3 . 36185 1 893 . 1 1 99 99 LYS HE2 H 1 3.052 0.006 . . 2 . . . A 110 LYS HE2 . 36185 1 894 . 1 1 99 99 LYS HE3 H 1 3.052 0.006 . . 2 . . . A 110 LYS HE3 . 36185 1 895 . 1 1 99 99 LYS CA C 13 54.742 0.000 . . 2 . . . A 110 LYS CA . 36185 1 896 . 1 1 99 99 LYS CB C 13 30.372 0.000 . . 2 . . . A 110 LYS CB . 36185 1 897 . 1 1 99 99 LYS N N 15 127.920 0.065 . . 18 . . . A 110 LYS N . 36185 1 stop_ save_