data_18657 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18657 _Entry.Title ; 1H,13C,15N assignments for an isoform of the type III antifreeze protein from notched-fin eelpout ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-08-12 _Entry.Accession_date 2012-08-12 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Hiroyuki Kumeta . . . 18657 2 Kenji Ogura . . . 18657 3 Yoshiyuki Nishimiya . . . 18657 4 Ai Miura . . . 18657 5 Fuyuhiko Inagaki . . . 18657 6 Sakae Tsuda . . . 18657 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18657 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'anchored clathrate waters' . 18657 'antifreeze protein' . 18657 ice-binding . 18657 'thermal hysteresis' . 18657 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18657 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 292 18657 '15N chemical shifts' 67 18657 '1H chemical shifts' 511 18657 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2013-02-18 2012-08-12 update BMRB 'update entry citation' 18657 1 . . 2013-02-13 2012-08-12 original author 'original release' 18657 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LX2 'BMRB Entry Tracking System' 18657 PDB 2LX3 'BMRB Entry Tracking System' 18657 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18657 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23288342 _Citation.Full_citation . _Citation.Title 'NMR structure note: a defective isoform and its activity-improved variant of a type III antifreeze protein from Zoarces elongates Kner.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of biomolecular NMR' _Citation.Journal_volume 55 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 225 _Citation.Page_last 230 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Hiroyuki Kumeta . . . 18657 1 2 Kenji Ogura . . . 18657 1 3 Yoshiyuki Nishimiya . . . 18657 1 4 Ai Miura . . . 18657 1 5 Fuyuhiko Inagaki . . . 18657 1 6 Sakae Tsuda . . . 18657 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18657 _Assembly.ID 1 _Assembly.Name nfeAFP11 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 nfeAFP11 1 $nfeAFP11 A . yes native no no . . . 18657 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_nfeAFP11 _Entity.Sf_category entity _Entity.Sf_framecode nfeAFP11 _Entity.Entry_ID 18657 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name nfeAFP11 _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 ; MNQESVVAAQLIPINTALTL VMMTTRVVSPTGIPAEDIPR LISMQVNQVVPMGTTLMPDM VKGYAPA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 67 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 7071.434 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2014-05-12 loop_ _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID no PDB 2LX3 . "1h,13c,15n Assignments For An Isoform Of The Type Iii Antifreeze Protein From Notched-fin Eelpout" . . . . . 100.00 67 100.00 100.00 8.98e-38 . . . . 18657 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 0 MET . 18657 1 2 1 ASN . 18657 1 3 2 GLN . 18657 1 4 3 GLU . 18657 1 5 4 SER . 18657 1 6 5 VAL . 18657 1 7 6 VAL . 18657 1 8 7 ALA . 18657 1 9 8 ALA . 18657 1 10 9 GLN . 18657 1 11 10 LEU . 18657 1 12 11 ILE . 18657 1 13 12 PRO . 18657 1 14 13 ILE . 18657 1 15 14 ASN . 18657 1 16 15 THR . 18657 1 17 16 ALA . 18657 1 18 17 LEU . 18657 1 19 18 THR . 18657 1 20 19 LEU . 18657 1 21 20 VAL . 18657 1 22 21 MET . 18657 1 23 22 MET . 18657 1 24 23 THR . 18657 1 25 24 THR . 18657 1 26 25 ARG . 18657 1 27 26 VAL . 18657 1 28 27 VAL . 18657 1 29 28 SER . 18657 1 30 29 PRO . 18657 1 31 30 THR . 18657 1 32 31 GLY . 18657 1 33 32 ILE . 18657 1 34 33 PRO . 18657 1 35 34 ALA . 18657 1 36 35 GLU . 18657 1 37 36 ASP . 18657 1 38 37 ILE . 18657 1 39 38 PRO . 18657 1 40 39 ARG . 18657 1 41 40 LEU . 18657 1 42 41 ILE . 18657 1 43 42 SER . 18657 1 44 43 MET . 18657 1 45 44 GLN . 18657 1 46 45 VAL . 18657 1 47 46 ASN . 18657 1 48 47 GLN . 18657 1 49 48 VAL . 18657 1 50 49 VAL . 18657 1 51 50 PRO . 18657 1 52 51 MET . 18657 1 53 52 GLY . 18657 1 54 53 THR . 18657 1 55 54 THR . 18657 1 56 55 LEU . 18657 1 57 56 MET . 18657 1 58 57 PRO . 18657 1 59 58 ASP . 18657 1 60 59 MET . 18657 1 61 60 VAL . 18657 1 62 61 LYS . 18657 1 63 62 GLY . 18657 1 64 63 TYR . 18657 1 65 64 ALA . 18657 1 66 65 PRO . 18657 1 67 66 ALA . 18657 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 18657 1 . ASN 2 2 18657 1 . GLN 3 3 18657 1 . GLU 4 4 18657 1 . SER 5 5 18657 1 . VAL 6 6 18657 1 . VAL 7 7 18657 1 . ALA 8 8 18657 1 . ALA 9 9 18657 1 . GLN 10 10 18657 1 . LEU 11 11 18657 1 . ILE 12 12 18657 1 . PRO 13 13 18657 1 . ILE 14 14 18657 1 . ASN 15 15 18657 1 . THR 16 16 18657 1 . ALA 17 17 18657 1 . LEU 18 18 18657 1 . THR 19 19 18657 1 . LEU 20 20 18657 1 . VAL 21 21 18657 1 . MET 22 22 18657 1 . MET 23 23 18657 1 . THR 24 24 18657 1 . THR 25 25 18657 1 . ARG 26 26 18657 1 . VAL 27 27 18657 1 . VAL 28 28 18657 1 . SER 29 29 18657 1 . PRO 30 30 18657 1 . THR 31 31 18657 1 . GLY 32 32 18657 1 . ILE 33 33 18657 1 . PRO 34 34 18657 1 . ALA 35 35 18657 1 . GLU 36 36 18657 1 . ASP 37 37 18657 1 . ILE 38 38 18657 1 . PRO 39 39 18657 1 . ARG 40 40 18657 1 . LEU 41 41 18657 1 . ILE 42 42 18657 1 . SER 43 43 18657 1 . MET 44 44 18657 1 . GLN 45 45 18657 1 . VAL 46 46 18657 1 . ASN 47 47 18657 1 . GLN 48 48 18657 1 . VAL 49 49 18657 1 . VAL 50 50 18657 1 . PRO 51 51 18657 1 . MET 52 52 18657 1 . GLY 53 53 18657 1 . THR 54 54 18657 1 . THR 55 55 18657 1 . LEU 56 56 18657 1 . MET 57 57 18657 1 . PRO 58 58 18657 1 . ASP 59 59 18657 1 . MET 60 60 18657 1 . VAL 61 61 18657 1 . LYS 62 62 18657 1 . GLY 63 63 18657 1 . TYR 64 64 18657 1 . ALA 65 65 18657 1 . PRO 66 66 18657 1 . ALA 67 67 18657 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 18657 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $nfeAFP11 . 291231 organism . 'Zoarces elongatus' . . . Eukaryota Metazoa Zoarces elongatus . . . . . . . . . . . . . . . . . . 'A fish living off the northern east coast of Japan.' . . 18657 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 18657 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $nfeAFP11 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pKK223-3UC . . . . . . 18657 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18657 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 nfeAFP11 '[U-100% 13C; U-100% 15N]' . . 1 $nfeAFP11 . . 2 . . mM . . . . 18657 1 2 'potassium chloride' 'natural abundance' . . . . . . 20 . . mM . . . . 18657 1 3 DSS 'natural abundance' . . . . . . 0.1 . . mM . . . . 18657 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18657 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18657 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 18657 _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' 20 . mM 18657 1 pH 6.8 . pH 18657 1 pressure 1 . atm 18657 1 temperature 273 . K 18657 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18657 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 18657 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18657 1 'structure solution' 18657 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18657 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18657 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 18657 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 18657 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 8 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 11 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 12 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18657 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18657 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18657 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18657 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18657 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18657 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '3D HNCO' . . . 18657 1 4 '3D HN(CO)CA' . . . 18657 1 5 '3D HNCA' . . . 18657 1 7 '3D CBCA(CO)NH' . . . 18657 1 8 '3D C(CO)NH' . . . 18657 1 9 '3D HCCH-TOCSY' . . . 18657 1 11 '3D 1H-13C NOESY aliphatic' . . . 18657 1 12 '3D 1H-13C NOESY aromatic' . . . 18657 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.042 . . 1 . . . A 0 MET HA . 18657 1 2 . 1 1 1 1 MET HB2 H 1 2.115 . . 2 . . . A 0 MET HB2 . 18657 1 3 . 1 1 1 1 MET HB3 H 1 2.115 . . 2 . . . A 0 MET HB3 . 18657 1 4 . 1 1 1 1 MET HG2 H 1 2.574 . . 2 . . . A 0 MET HG2 . 18657 1 5 . 1 1 1 1 MET HG3 H 1 2.574 . . 2 . . . A 0 MET HG3 . 18657 1 6 . 1 1 1 1 MET HE1 H 1 2.076 . . 1 . . . A 0 MET HE1 . 18657 1 7 . 1 1 1 1 MET HE2 H 1 2.076 . . 1 . . . A 0 MET HE2 . 18657 1 8 . 1 1 1 1 MET HE3 H 1 2.076 . . 1 . . . A 0 MET HE3 . 18657 1 9 . 1 1 1 1 MET CA C 13 55.069 . . 1 . . . A 0 MET CA . 18657 1 10 . 1 1 1 1 MET CB C 13 32.983 . . 1 . . . A 0 MET CB . 18657 1 11 . 1 1 1 1 MET CG C 13 30.894 . . 1 . . . A 0 MET CG . 18657 1 12 . 1 1 1 1 MET CE C 13 16.777 . . 1 . . . A 0 MET CE . 18657 1 13 . 1 1 2 2 ASN HA H 1 4.703 . . 1 . . . A 1 ASN HA . 18657 1 14 . 1 1 2 2 ASN HB2 H 1 2.728 . . 2 . . . A 1 ASN HB2 . 18657 1 15 . 1 1 2 2 ASN HB3 H 1 2.763 . . 2 . . . A 1 ASN HB3 . 18657 1 16 . 1 1 2 2 ASN HD21 H 1 7.717 . . 2 . . . A 1 ASN HD21 . 18657 1 17 . 1 1 2 2 ASN HD22 H 1 7.069 . . 2 . . . A 1 ASN HD22 . 18657 1 18 . 1 1 2 2 ASN C C 13 174.258 . . 1 . . . A 1 ASN C . 18657 1 19 . 1 1 2 2 ASN CA C 13 53.192 . . 1 . . . A 1 ASN CA . 18657 1 20 . 1 1 2 2 ASN CB C 13 38.954 . . 1 . . . A 1 ASN CB . 18657 1 21 . 1 1 2 2 ASN CG C 13 176.744 . . 1 . . . A 1 ASN CG . 18657 1 22 . 1 1 2 2 ASN ND2 N 15 113.477 . . 1 . . . A 1 ASN ND2 . 18657 1 23 . 1 1 3 3 GLN H H 1 8.597 . . 1 . . . A 2 GLN H . 18657 1 24 . 1 1 3 3 GLN HA H 1 4.323 . . 1 . . . A 2 GLN HA . 18657 1 25 . 1 1 3 3 GLN HB2 H 1 2.100 . . 2 . . . A 2 GLN HB2 . 18657 1 26 . 1 1 3 3 GLN HB3 H 1 2.154 . . 2 . . . A 2 GLN HB3 . 18657 1 27 . 1 1 3 3 GLN HG2 H 1 2.236 . . 2 . . . A 2 GLN HG2 . 18657 1 28 . 1 1 3 3 GLN HG3 H 1 2.384 . . 2 . . . A 2 GLN HG3 . 18657 1 29 . 1 1 3 3 GLN HE21 H 1 7.937 . . 2 . . . A 2 GLN HE21 . 18657 1 30 . 1 1 3 3 GLN HE22 H 1 7.502 . . 2 . . . A 2 GLN HE22 . 18657 1 31 . 1 1 3 3 GLN C C 13 176.004 . . 1 . . . A 2 GLN C . 18657 1 32 . 1 1 3 3 GLN CA C 13 55.835 . . 1 . . . A 2 GLN CA . 18657 1 33 . 1 1 3 3 GLN CB C 13 29.640 . . 1 . . . A 2 GLN CB . 18657 1 34 . 1 1 3 3 GLN CG C 13 34.023 . . 1 . . . A 2 GLN CG . 18657 1 35 . 1 1 3 3 GLN CD C 13 180.287 . . 1 . . . A 2 GLN CD . 18657 1 36 . 1 1 3 3 GLN N N 15 120.041 . . 1 . . . A 2 GLN N . 18657 1 37 . 1 1 3 3 GLN NE2 N 15 115.472 . . 1 . . . A 2 GLN NE2 . 18657 1 38 . 1 1 4 4 GLU H H 1 9.025 . . 1 . . . A 3 GLU H . 18657 1 39 . 1 1 4 4 GLU HA H 1 4.294 . . 1 . . . A 3 GLU HA . 18657 1 40 . 1 1 4 4 GLU HB2 H 1 1.798 . . 2 . . . A 3 GLU HB2 . 18657 1 41 . 1 1 4 4 GLU HB3 H 1 2.009 . . 2 . . . A 3 GLU HB3 . 18657 1 42 . 1 1 4 4 GLU HG2 H 1 2.007 . . 2 . . . A 3 GLU HG2 . 18657 1 43 . 1 1 4 4 GLU HG3 H 1 2.321 . . 2 . . . A 3 GLU HG3 . 18657 1 44 . 1 1 4 4 GLU C C 13 177.305 . . 1 . . . A 3 GLU C . 18657 1 45 . 1 1 4 4 GLU CA C 13 56.597 . . 1 . . . A 3 GLU CA . 18657 1 46 . 1 1 4 4 GLU CB C 13 32.196 . . 1 . . . A 3 GLU CB . 18657 1 47 . 1 1 4 4 GLU CG C 13 37.559 . . 1 . . . A 3 GLU CG . 18657 1 48 . 1 1 4 4 GLU N N 15 124.166 . . 1 . . . A 3 GLU N . 18657 1 49 . 1 1 5 5 SER H H 1 8.925 . . 1 . . . A 4 SER H . 18657 1 50 . 1 1 5 5 SER HA H 1 5.412 . . 1 . . . A 4 SER HA . 18657 1 51 . 1 1 5 5 SER HB2 H 1 3.594 . . 2 . . . A 4 SER HB2 . 18657 1 52 . 1 1 5 5 SER HB3 H 1 3.594 . . 2 . . . A 4 SER HB3 . 18657 1 53 . 1 1 5 5 SER HG H 1 6.985 . . 1 . . . A 4 SER HG . 18657 1 54 . 1 1 5 5 SER C C 13 171.713 . . 1 . . . A 4 SER C . 18657 1 55 . 1 1 5 5 SER CA C 13 57.271 . . 1 . . . A 4 SER CA . 18657 1 56 . 1 1 5 5 SER CB C 13 66.319 . . 1 . . . A 4 SER CB . 18657 1 57 . 1 1 5 5 SER N N 15 118.222 . . 1 . . . A 4 SER N . 18657 1 58 . 1 1 6 6 VAL H H 1 8.506 . . 1 . . . A 5 VAL H . 18657 1 59 . 1 1 6 6 VAL HA H 1 4.156 . . 1 . . . A 5 VAL HA . 18657 1 60 . 1 1 6 6 VAL HB H 1 1.719 . . 1 . . . A 5 VAL HB . 18657 1 61 . 1 1 6 6 VAL HG11 H 1 0.842 . . 1 . . . A 5 VAL HG11 . 18657 1 62 . 1 1 6 6 VAL HG12 H 1 0.842 . . 1 . . . A 5 VAL HG12 . 18657 1 63 . 1 1 6 6 VAL HG13 H 1 0.842 . . 1 . . . A 5 VAL HG13 . 18657 1 64 . 1 1 6 6 VAL HG21 H 1 0.746 . . 1 . . . A 5 VAL HG21 . 18657 1 65 . 1 1 6 6 VAL HG22 H 1 0.746 . . 1 . . . A 5 VAL HG22 . 18657 1 66 . 1 1 6 6 VAL HG23 H 1 0.746 . . 1 . . . A 5 VAL HG23 . 18657 1 67 . 1 1 6 6 VAL C C 13 174.325 . . 1 . . . A 5 VAL C . 18657 1 68 . 1 1 6 6 VAL CA C 13 63.408 . . 1 . . . A 5 VAL CA . 18657 1 69 . 1 1 6 6 VAL CB C 13 31.916 . . 1 . . . A 5 VAL CB . 18657 1 70 . 1 1 6 6 VAL CG1 C 13 23.010 . . 2 . . . A 5 VAL CG1 . 18657 1 71 . 1 1 6 6 VAL CG2 C 13 23.444 . . 2 . . . A 5 VAL CG2 . 18657 1 72 . 1 1 6 6 VAL N N 15 122.304 . . 1 . . . A 5 VAL N . 18657 1 73 . 1 1 7 7 VAL H H 1 8.637 . . 1 . . . A 6 VAL H . 18657 1 74 . 1 1 7 7 VAL HA H 1 4.512 . . 1 . . . A 6 VAL HA . 18657 1 75 . 1 1 7 7 VAL HB H 1 1.332 . . 1 . . . A 6 VAL HB . 18657 1 76 . 1 1 7 7 VAL HG11 H 1 0.559 . . 1 . . . A 6 VAL HG11 . 18657 1 77 . 1 1 7 7 VAL HG12 H 1 0.559 . . 1 . . . A 6 VAL HG12 . 18657 1 78 . 1 1 7 7 VAL HG13 H 1 0.559 . . 1 . . . A 6 VAL HG13 . 18657 1 79 . 1 1 7 7 VAL HG21 H 1 0.659 . . 1 . . . A 6 VAL HG21 . 18657 1 80 . 1 1 7 7 VAL HG22 H 1 0.659 . . 1 . . . A 6 VAL HG22 . 18657 1 81 . 1 1 7 7 VAL HG23 H 1 0.659 . . 1 . . . A 6 VAL HG23 . 18657 1 82 . 1 1 7 7 VAL C C 13 174.958 . . 1 . . . A 6 VAL C . 18657 1 83 . 1 1 7 7 VAL CA C 13 59.365 . . 1 . . . A 6 VAL CA . 18657 1 84 . 1 1 7 7 VAL CB C 13 36.189 . . 1 . . . A 6 VAL CB . 18657 1 85 . 1 1 7 7 VAL CG1 C 13 20.870 . . 2 . . . A 6 VAL CG1 . 18657 1 86 . 1 1 7 7 VAL CG2 C 13 21.914 . . 2 . . . A 6 VAL CG2 . 18657 1 87 . 1 1 7 7 VAL N N 15 126.068 . . 1 . . . A 6 VAL N . 18657 1 88 . 1 1 8 8 ALA H H 1 8.318 . . 1 . . . A 7 ALA H . 18657 1 89 . 1 1 8 8 ALA HA H 1 4.441 . . 1 . . . A 7 ALA HA . 18657 1 90 . 1 1 8 8 ALA HB1 H 1 1.634 . . 1 . . . A 7 ALA HB1 . 18657 1 91 . 1 1 8 8 ALA HB2 H 1 1.634 . . 1 . . . A 7 ALA HB2 . 18657 1 92 . 1 1 8 8 ALA HB3 H 1 1.634 . . 1 . . . A 7 ALA HB3 . 18657 1 93 . 1 1 8 8 ALA C C 13 178.642 . . 1 . . . A 7 ALA C . 18657 1 94 . 1 1 8 8 ALA CA C 13 53.079 . . 1 . . . A 7 ALA CA . 18657 1 95 . 1 1 8 8 ALA CB C 13 19.055 . . 1 . . . A 7 ALA CB . 18657 1 96 . 1 1 8 8 ALA N N 15 126.887 . . 1 . . . A 7 ALA N . 18657 1 97 . 1 1 9 9 ALA H H 1 9.248 . . 1 . . . A 8 ALA H . 18657 1 98 . 1 1 9 9 ALA HA H 1 4.162 . . 1 . . . A 8 ALA HA . 18657 1 99 . 1 1 9 9 ALA HB1 H 1 1.216 . . 1 . . . A 8 ALA HB1 . 18657 1 100 . 1 1 9 9 ALA HB2 H 1 1.216 . . 1 . . . A 8 ALA HB2 . 18657 1 101 . 1 1 9 9 ALA HB3 H 1 1.216 . . 1 . . . A 8 ALA HB3 . 18657 1 102 . 1 1 9 9 ALA C C 13 174.975 . . 1 . . . A 8 ALA C . 18657 1 103 . 1 1 9 9 ALA CA C 13 52.229 . . 1 . . . A 8 ALA CA . 18657 1 104 . 1 1 9 9 ALA CB C 13 19.350 . . 1 . . . A 8 ALA CB . 18657 1 105 . 1 1 9 9 ALA N N 15 129.962 . . 1 . . . A 8 ALA N . 18657 1 106 . 1 1 10 10 GLN H H 1 7.709 . . 1 . . . A 9 GLN H . 18657 1 107 . 1 1 10 10 GLN HA H 1 4.510 . . 1 . . . A 9 GLN HA . 18657 1 108 . 1 1 10 10 GLN HB2 H 1 1.871 . . 2 . . . A 9 GLN HB2 . 18657 1 109 . 1 1 10 10 GLN HB3 H 1 2.256 . . 2 . . . A 9 GLN HB3 . 18657 1 110 . 1 1 10 10 GLN HG2 H 1 1.953 . . 2 . . . A 9 GLN HG2 . 18657 1 111 . 1 1 10 10 GLN HG3 H 1 2.029 . . 2 . . . A 9 GLN HG3 . 18657 1 112 . 1 1 10 10 GLN HE21 H 1 7.505 . . 2 . . . A 9 GLN HE21 . 18657 1 113 . 1 1 10 10 GLN HE22 H 1 6.925 . . 2 . . . A 9 GLN HE22 . 18657 1 114 . 1 1 10 10 GLN C C 13 172.373 . . 1 . . . A 9 GLN C . 18657 1 115 . 1 1 10 10 GLN CA C 13 52.613 . . 1 . . . A 9 GLN CA . 18657 1 116 . 1 1 10 10 GLN CB C 13 32.673 . . 1 . . . A 9 GLN CB . 18657 1 117 . 1 1 10 10 GLN CG C 13 32.708 . . 1 . . . A 9 GLN CG . 18657 1 118 . 1 1 10 10 GLN N N 15 111.285 . . 1 . . . A 9 GLN N . 18657 1 119 . 1 1 10 10 GLN NE2 N 15 111.143 . . 1 . . . A 9 GLN NE2 . 18657 1 120 . 1 1 11 11 LEU H H 1 8.501 . . 1 . . . A 10 LEU H . 18657 1 121 . 1 1 11 11 LEU HA H 1 4.541 . . 1 . . . A 10 LEU HA . 18657 1 122 . 1 1 11 11 LEU HB2 H 1 1.615 . . 2 . . . A 10 LEU HB2 . 18657 1 123 . 1 1 11 11 LEU HB3 H 1 1.679 . . 2 . . . A 10 LEU HB3 . 18657 1 124 . 1 1 11 11 LEU HG H 1 1.239 . . 1 . . . A 10 LEU HG . 18657 1 125 . 1 1 11 11 LEU HD11 H 1 0.792 . . 1 . . . A 10 LEU HD11 . 18657 1 126 . 1 1 11 11 LEU HD12 H 1 0.792 . . 1 . . . A 10 LEU HD12 . 18657 1 127 . 1 1 11 11 LEU HD13 H 1 0.792 . . 1 . . . A 10 LEU HD13 . 18657 1 128 . 1 1 11 11 LEU HD21 H 1 0.764 . . 1 . . . A 10 LEU HD21 . 18657 1 129 . 1 1 11 11 LEU HD22 H 1 0.764 . . 1 . . . A 10 LEU HD22 . 18657 1 130 . 1 1 11 11 LEU HD23 H 1 0.764 . . 1 . . . A 10 LEU HD23 . 18657 1 131 . 1 1 11 11 LEU C C 13 177.120 . . 1 . . . A 10 LEU C . 18657 1 132 . 1 1 11 11 LEU CA C 13 56.329 . . 1 . . . A 10 LEU CA . 18657 1 133 . 1 1 11 11 LEU CB C 13 41.176 . . 1 . . . A 10 LEU CB . 18657 1 134 . 1 1 11 11 LEU CG C 13 27.819 . . 1 . . . A 10 LEU CG . 18657 1 135 . 1 1 11 11 LEU CD1 C 13 24.701 . . 2 . . . A 10 LEU CD1 . 18657 1 136 . 1 1 11 11 LEU CD2 C 13 25.183 . . 2 . . . A 10 LEU CD2 . 18657 1 137 . 1 1 11 11 LEU N N 15 120.553 . . 1 . . . A 10 LEU N . 18657 1 138 . 1 1 12 12 ILE H H 1 9.329 . . 1 . . . A 11 ILE H . 18657 1 139 . 1 1 12 12 ILE HA H 1 4.604 . . 1 . . . A 11 ILE HA . 18657 1 140 . 1 1 12 12 ILE HB H 1 2.000 . . 1 . . . A 11 ILE HB . 18657 1 141 . 1 1 12 12 ILE HG12 H 1 0.838 . . 2 . . . A 11 ILE HG12 . 18657 1 142 . 1 1 12 12 ILE HG13 H 1 2.213 . . 2 . . . A 11 ILE HG13 . 18657 1 143 . 1 1 12 12 ILE HG21 H 1 1.049 . . 1 . . . A 11 ILE HG21 . 18657 1 144 . 1 1 12 12 ILE HG22 H 1 1.049 . . 1 . . . A 11 ILE HG22 . 18657 1 145 . 1 1 12 12 ILE HG23 H 1 1.049 . . 1 . . . A 11 ILE HG23 . 18657 1 146 . 1 1 12 12 ILE HD11 H 1 0.864 . . 1 . . . A 11 ILE HD11 . 18657 1 147 . 1 1 12 12 ILE HD12 H 1 0.864 . . 1 . . . A 11 ILE HD12 . 18657 1 148 . 1 1 12 12 ILE HD13 H 1 0.864 . . 1 . . . A 11 ILE HD13 . 18657 1 149 . 1 1 12 12 ILE CA C 13 59.247 . . 1 . . . A 11 ILE CA . 18657 1 150 . 1 1 12 12 ILE CB C 13 39.630 . . 1 . . . A 11 ILE CB . 18657 1 151 . 1 1 12 12 ILE CG1 C 13 26.504 . . 1 . . . A 11 ILE CG1 . 18657 1 152 . 1 1 12 12 ILE CG2 C 13 19.068 . . 1 . . . A 11 ILE CG2 . 18657 1 153 . 1 1 12 12 ILE CD1 C 13 13.514 . . 1 . . . A 11 ILE CD1 . 18657 1 154 . 1 1 12 12 ILE N N 15 132.775 . . 1 . . . A 11 ILE N . 18657 1 155 . 1 1 13 13 PRO HA H 1 4.392 . . 1 . . . A 12 PRO HA . 18657 1 156 . 1 1 13 13 PRO HB2 H 1 2.364 . . 2 . . . A 12 PRO HB2 . 18657 1 157 . 1 1 13 13 PRO HB3 H 1 1.614 . . 2 . . . A 12 PRO HB3 . 18657 1 158 . 1 1 13 13 PRO HG2 H 1 1.737 . . 2 . . . A 12 PRO HG2 . 18657 1 159 . 1 1 13 13 PRO HG3 H 1 1.989 . . 2 . . . A 12 PRO HG3 . 18657 1 160 . 1 1 13 13 PRO HD2 H 1 3.631 . . 2 . . . A 12 PRO HD2 . 18657 1 161 . 1 1 13 13 PRO HD3 H 1 4.035 . . 2 . . . A 12 PRO HD3 . 18657 1 162 . 1 1 13 13 PRO C C 13 176.644 . . 1 . . . A 12 PRO C . 18657 1 163 . 1 1 13 13 PRO CA C 13 61.904 . . 1 . . . A 12 PRO CA . 18657 1 164 . 1 1 13 13 PRO CB C 13 32.576 . . 1 . . . A 12 PRO CB . 18657 1 165 . 1 1 13 13 PRO CG C 13 27.369 . . 1 . . . A 12 PRO CG . 18657 1 166 . 1 1 13 13 PRO CD C 13 51.402 . . 1 . . . A 12 PRO CD . 18657 1 167 . 1 1 14 14 ILE H H 1 7.938 . . 1 . . . A 13 ILE H . 18657 1 168 . 1 1 14 14 ILE HA H 1 3.380 . . 1 . . . A 13 ILE HA . 18657 1 169 . 1 1 14 14 ILE HB H 1 1.562 . . 1 . . . A 13 ILE HB . 18657 1 170 . 1 1 14 14 ILE HG12 H 1 0.913 . . 2 . . . A 13 ILE HG12 . 18657 1 171 . 1 1 14 14 ILE HG13 H 1 1.090 . . 2 . . . A 13 ILE HG13 . 18657 1 172 . 1 1 14 14 ILE HG21 H 1 0.814 . . 1 . . . A 13 ILE HG21 . 18657 1 173 . 1 1 14 14 ILE HG22 H 1 0.814 . . 1 . . . A 13 ILE HG22 . 18657 1 174 . 1 1 14 14 ILE HG23 H 1 0.814 . . 1 . . . A 13 ILE HG23 . 18657 1 175 . 1 1 14 14 ILE HD11 H 1 0.903 . . 1 . . . A 13 ILE HD11 . 18657 1 176 . 1 1 14 14 ILE HD12 H 1 0.903 . . 1 . . . A 13 ILE HD12 . 18657 1 177 . 1 1 14 14 ILE HD13 H 1 0.903 . . 1 . . . A 13 ILE HD13 . 18657 1 178 . 1 1 14 14 ILE C C 13 173.621 . . 1 . . . A 13 ILE C . 18657 1 179 . 1 1 14 14 ILE CA C 13 63.705 . . 1 . . . A 13 ILE CA . 18657 1 180 . 1 1 14 14 ILE CB C 13 38.836 . . 1 . . . A 13 ILE CB . 18657 1 181 . 1 1 14 14 ILE CG1 C 13 29.352 . . 1 . . . A 13 ILE CG1 . 18657 1 182 . 1 1 14 14 ILE CG2 C 13 15.041 . . 1 . . . A 13 ILE CG2 . 18657 1 183 . 1 1 14 14 ILE CD1 C 13 14.771 . . 1 . . . A 13 ILE CD1 . 18657 1 184 . 1 1 14 14 ILE N N 15 121.774 . . 1 . . . A 13 ILE N . 18657 1 185 . 1 1 15 15 ASN H H 1 7.240 . . 1 . . . A 14 ASN H . 18657 1 186 . 1 1 15 15 ASN HA H 1 4.565 . . 1 . . . A 14 ASN HA . 18657 1 187 . 1 1 15 15 ASN HB2 H 1 2.961 . . 2 . . . A 14 ASN HB2 . 18657 1 188 . 1 1 15 15 ASN HB3 H 1 3.059 . . 2 . . . A 14 ASN HB3 . 18657 1 189 . 1 1 15 15 ASN HD21 H 1 7.838 . . 2 . . . A 14 ASN HD21 . 18657 1 190 . 1 1 15 15 ASN HD22 H 1 7.103 . . 2 . . . A 14 ASN HD22 . 18657 1 191 . 1 1 15 15 ASN C C 13 173.943 . . 1 . . . A 14 ASN C . 18657 1 192 . 1 1 15 15 ASN CA C 13 55.344 . . 1 . . . A 14 ASN CA . 18657 1 193 . 1 1 15 15 ASN CB C 13 37.014 . . 1 . . . A 14 ASN CB . 18657 1 194 . 1 1 15 15 ASN CG C 13 177.911 . . 1 . . . A 14 ASN CG . 18657 1 195 . 1 1 15 15 ASN N N 15 117.013 . . 1 . . . A 14 ASN N . 18657 1 196 . 1 1 15 15 ASN ND2 N 15 115.762 . . 1 . . . A 14 ASN ND2 . 18657 1 197 . 1 1 16 16 THR H H 1 7.313 . . 1 . . . A 15 THR H . 18657 1 198 . 1 1 16 16 THR HA H 1 3.966 . . 1 . . . A 15 THR HA . 18657 1 199 . 1 1 16 16 THR HB H 1 3.882 . . 1 . . . A 15 THR HB . 18657 1 200 . 1 1 16 16 THR HG1 H 1 5.507 . . 1 . . . A 15 THR HG1 . 18657 1 201 . 1 1 16 16 THR HG21 H 1 1.164 . . 1 . . . A 15 THR HG21 . 18657 1 202 . 1 1 16 16 THR HG22 H 1 1.164 . . 1 . . . A 15 THR HG22 . 18657 1 203 . 1 1 16 16 THR HG23 H 1 1.164 . . 1 . . . A 15 THR HG23 . 18657 1 204 . 1 1 16 16 THR C C 13 172.956 . . 1 . . . A 15 THR C . 18657 1 205 . 1 1 16 16 THR CA C 13 64.332 . . 1 . . . A 15 THR CA . 18657 1 206 . 1 1 16 16 THR CB C 13 69.532 . . 1 . . . A 15 THR CB . 18657 1 207 . 1 1 16 16 THR CG2 C 13 22.144 . . 1 . . . A 15 THR CG2 . 18657 1 208 . 1 1 16 16 THR N N 15 116.580 . . 1 . . . A 15 THR N . 18657 1 209 . 1 1 17 17 ALA H H 1 8.545 . . 1 . . . A 16 ALA H . 18657 1 210 . 1 1 17 17 ALA HA H 1 4.246 . . 1 . . . A 16 ALA HA . 18657 1 211 . 1 1 17 17 ALA HB1 H 1 1.221 . . 1 . . . A 16 ALA HB1 . 18657 1 212 . 1 1 17 17 ALA HB2 H 1 1.221 . . 1 . . . A 16 ALA HB2 . 18657 1 213 . 1 1 17 17 ALA HB3 H 1 1.221 . . 1 . . . A 16 ALA HB3 . 18657 1 214 . 1 1 17 17 ALA C C 13 176.643 . . 1 . . . A 16 ALA C . 18657 1 215 . 1 1 17 17 ALA CA C 13 50.750 . . 1 . . . A 16 ALA CA . 18657 1 216 . 1 1 17 17 ALA CB C 13 18.653 . . 1 . . . A 16 ALA CB . 18657 1 217 . 1 1 17 17 ALA N N 15 128.035 . . 1 . . . A 16 ALA N . 18657 1 218 . 1 1 18 18 LEU H H 1 9.114 . . 1 . . . A 17 LEU H . 18657 1 219 . 1 1 18 18 LEU HA H 1 4.505 . . 1 . . . A 17 LEU HA . 18657 1 220 . 1 1 18 18 LEU HB2 H 1 0.963 . . 2 . . . A 17 LEU HB2 . 18657 1 221 . 1 1 18 18 LEU HB3 H 1 2.246 . . 2 . . . A 17 LEU HB3 . 18657 1 222 . 1 1 18 18 LEU HG H 1 1.920 . . 1 . . . A 17 LEU HG . 18657 1 223 . 1 1 18 18 LEU HD11 H 1 0.804 . . 1 . . . A 17 LEU HD11 . 18657 1 224 . 1 1 18 18 LEU HD12 H 1 0.804 . . 1 . . . A 17 LEU HD12 . 18657 1 225 . 1 1 18 18 LEU HD13 H 1 0.804 . . 1 . . . A 17 LEU HD13 . 18657 1 226 . 1 1 18 18 LEU HD21 H 1 0.893 . . 1 . . . A 17 LEU HD21 . 18657 1 227 . 1 1 18 18 LEU HD22 H 1 0.893 . . 1 . . . A 17 LEU HD22 . 18657 1 228 . 1 1 18 18 LEU HD23 H 1 0.893 . . 1 . . . A 17 LEU HD23 . 18657 1 229 . 1 1 18 18 LEU C C 13 178.848 . . 1 . . . A 17 LEU C . 18657 1 230 . 1 1 18 18 LEU CA C 13 56.127 . . 1 . . . A 17 LEU CA . 18657 1 231 . 1 1 18 18 LEU CB C 13 42.573 . . 1 . . . A 17 LEU CB . 18657 1 232 . 1 1 18 18 LEU CG C 13 27.709 . . 1 . . . A 17 LEU CG . 18657 1 233 . 1 1 18 18 LEU CD1 C 13 25.845 . . 2 . . . A 17 LEU CD1 . 18657 1 234 . 1 1 18 18 LEU CD2 C 13 24.790 . . 2 . . . A 17 LEU CD2 . 18657 1 235 . 1 1 18 18 LEU N N 15 125.094 . . 1 . . . A 17 LEU N . 18657 1 236 . 1 1 19 19 THR H H 1 7.980 . . 1 . . . A 18 THR H . 18657 1 237 . 1 1 19 19 THR HA H 1 4.623 . . 1 . . . A 18 THR HA . 18657 1 238 . 1 1 19 19 THR HB H 1 4.483 . . 1 . . . A 18 THR HB . 18657 1 239 . 1 1 19 19 THR HG1 H 1 5.080 . . 1 . . . A 18 THR HG1 . 18657 1 240 . 1 1 19 19 THR HG21 H 1 1.219 . . 1 . . . A 18 THR HG21 . 18657 1 241 . 1 1 19 19 THR HG22 H 1 1.219 . . 1 . . . A 18 THR HG22 . 18657 1 242 . 1 1 19 19 THR HG23 H 1 1.219 . . 1 . . . A 18 THR HG23 . 18657 1 243 . 1 1 19 19 THR C C 13 175.028 . . 1 . . . A 18 THR C . 18657 1 244 . 1 1 19 19 THR CA C 13 58.935 . . 1 . . . A 18 THR CA . 18657 1 245 . 1 1 19 19 THR CB C 13 71.185 . . 1 . . . A 18 THR CB . 18657 1 246 . 1 1 19 19 THR CG2 C 13 21.651 . . 1 . . . A 18 THR CG2 . 18657 1 247 . 1 1 19 19 THR N N 15 113.568 . . 1 . . . A 18 THR N . 18657 1 248 . 1 1 20 20 LEU H H 1 8.882 . . 1 . . . A 19 LEU H . 18657 1 249 . 1 1 20 20 LEU HA H 1 3.817 . . 1 . . . A 19 LEU HA . 18657 1 250 . 1 1 20 20 LEU HB2 H 1 1.587 . . 2 . . . A 19 LEU HB2 . 18657 1 251 . 1 1 20 20 LEU HB3 H 1 1.677 . . 2 . . . A 19 LEU HB3 . 18657 1 252 . 1 1 20 20 LEU HG H 1 1.595 . . 1 . . . A 19 LEU HG . 18657 1 253 . 1 1 20 20 LEU HD11 H 1 0.859 . . 1 . . . A 19 LEU HD11 . 18657 1 254 . 1 1 20 20 LEU HD12 H 1 0.859 . . 1 . . . A 19 LEU HD12 . 18657 1 255 . 1 1 20 20 LEU HD13 H 1 0.859 . . 1 . . . A 19 LEU HD13 . 18657 1 256 . 1 1 20 20 LEU HD21 H 1 0.906 . . 1 . . . A 19 LEU HD21 . 18657 1 257 . 1 1 20 20 LEU HD22 H 1 0.906 . . 1 . . . A 19 LEU HD22 . 18657 1 258 . 1 1 20 20 LEU HD23 H 1 0.906 . . 1 . . . A 19 LEU HD23 . 18657 1 259 . 1 1 20 20 LEU C C 13 179.309 . . 1 . . . A 19 LEU C . 18657 1 260 . 1 1 20 20 LEU CA C 13 58.710 . . 1 . . . A 19 LEU CA . 18657 1 261 . 1 1 20 20 LEU CB C 13 42.213 . . 1 . . . A 19 LEU CB . 18657 1 262 . 1 1 20 20 LEU CG C 13 26.727 . . 1 . . . A 19 LEU CG . 18657 1 263 . 1 1 20 20 LEU CD1 C 13 24.778 . . 2 . . . A 19 LEU CD1 . 18657 1 264 . 1 1 20 20 LEU CD2 C 13 24.277 . . 2 . . . A 19 LEU CD2 . 18657 1 265 . 1 1 20 20 LEU N N 15 121.118 . . 1 . . . A 19 LEU N . 18657 1 266 . 1 1 21 21 VAL H H 1 7.528 . . 1 . . . A 20 VAL H . 18657 1 267 . 1 1 21 21 VAL HA H 1 4.021 . . 1 . . . A 20 VAL HA . 18657 1 268 . 1 1 21 21 VAL HB H 1 2.160 . . 1 . . . A 20 VAL HB . 18657 1 269 . 1 1 21 21 VAL HG11 H 1 0.941 . . 1 . . . A 20 VAL HG11 . 18657 1 270 . 1 1 21 21 VAL HG12 H 1 0.941 . . 1 . . . A 20 VAL HG12 . 18657 1 271 . 1 1 21 21 VAL HG13 H 1 0.941 . . 1 . . . A 20 VAL HG13 . 18657 1 272 . 1 1 21 21 VAL HG21 H 1 0.926 . . 1 . . . A 20 VAL HG21 . 18657 1 273 . 1 1 21 21 VAL HG22 H 1 0.926 . . 1 . . . A 20 VAL HG22 . 18657 1 274 . 1 1 21 21 VAL HG23 H 1 0.926 . . 1 . . . A 20 VAL HG23 . 18657 1 275 . 1 1 21 21 VAL C C 13 176.778 . . 1 . . . A 20 VAL C . 18657 1 276 . 1 1 21 21 VAL CA C 13 63.377 . . 1 . . . A 20 VAL CA . 18657 1 277 . 1 1 21 21 VAL CB C 13 31.558 . . 1 . . . A 20 VAL CB . 18657 1 278 . 1 1 21 21 VAL CG1 C 13 20.549 . . 2 . . . A 20 VAL CG1 . 18657 1 279 . 1 1 21 21 VAL CG2 C 13 20.467 . . 2 . . . A 20 VAL CG2 . 18657 1 280 . 1 1 21 21 VAL N N 15 110.454 . . 1 . . . A 20 VAL N . 18657 1 281 . 1 1 22 22 MET H H 1 7.518 . . 1 . . . A 21 MET H . 18657 1 282 . 1 1 22 22 MET HA H 1 3.940 . . 1 . . . A 21 MET HA . 18657 1 283 . 1 1 22 22 MET HB2 H 1 2.120 . . 2 . . . A 21 MET HB2 . 18657 1 284 . 1 1 22 22 MET HB3 H 1 2.172 . . 2 . . . A 21 MET HB3 . 18657 1 285 . 1 1 22 22 MET HG2 H 1 2.460 . . 2 . . . A 21 MET HG2 . 18657 1 286 . 1 1 22 22 MET HG3 H 1 2.778 . . 2 . . . A 21 MET HG3 . 18657 1 287 . 1 1 22 22 MET HE1 H 1 2.182 . . 1 . . . A 21 MET HE1 . 18657 1 288 . 1 1 22 22 MET HE2 H 1 2.182 . . 1 . . . A 21 MET HE2 . 18657 1 289 . 1 1 22 22 MET HE3 H 1 2.182 . . 1 . . . A 21 MET HE3 . 18657 1 290 . 1 1 22 22 MET C C 13 175.514 . . 1 . . . A 21 MET C . 18657 1 291 . 1 1 22 22 MET CA C 13 57.965 . . 1 . . . A 21 MET CA . 18657 1 292 . 1 1 22 22 MET CB C 13 32.889 . . 1 . . . A 21 MET CB . 18657 1 293 . 1 1 22 22 MET CG C 13 33.297 . . 1 . . . A 21 MET CG . 18657 1 294 . 1 1 22 22 MET CE C 13 18.521 . . 1 . . . A 21 MET CE . 18657 1 295 . 1 1 22 22 MET N N 15 116.848 . . 1 . . . A 21 MET N . 18657 1 296 . 1 1 23 23 MET H H 1 7.709 . . 1 . . . A 22 MET H . 18657 1 297 . 1 1 23 23 MET HA H 1 4.893 . . 1 . . . A 22 MET HA . 18657 1 298 . 1 1 23 23 MET HB2 H 1 1.754 . . 2 . . . A 22 MET HB2 . 18657 1 299 . 1 1 23 23 MET HB3 H 1 2.082 . . 2 . . . A 22 MET HB3 . 18657 1 300 . 1 1 23 23 MET HG2 H 1 1.947 . . 2 . . . A 22 MET HG2 . 18657 1 301 . 1 1 23 23 MET HG3 H 1 2.309 . . 2 . . . A 22 MET HG3 . 18657 1 302 . 1 1 23 23 MET HE1 H 1 1.803 . . 1 . . . A 22 MET HE1 . 18657 1 303 . 1 1 23 23 MET HE2 H 1 1.803 . . 1 . . . A 22 MET HE2 . 18657 1 304 . 1 1 23 23 MET HE3 H 1 1.803 . . 1 . . . A 22 MET HE3 . 18657 1 305 . 1 1 23 23 MET C C 13 173.981 . . 1 . . . A 22 MET C . 18657 1 306 . 1 1 23 23 MET CA C 13 55.373 . . 1 . . . A 22 MET CA . 18657 1 307 . 1 1 23 23 MET CB C 13 37.383 . . 1 . . . A 22 MET CB . 18657 1 308 . 1 1 23 23 MET CG C 13 31.675 . . 1 . . . A 22 MET CG . 18657 1 309 . 1 1 23 23 MET CE C 13 17.394 . . 1 . . . A 22 MET CE . 18657 1 310 . 1 1 23 23 MET N N 15 116.986 . . 1 . . . A 22 MET N . 18657 1 311 . 1 1 24 24 THR H H 1 9.041 . . 1 . . . A 23 THR H . 18657 1 312 . 1 1 24 24 THR HA H 1 4.788 . . 1 . . . A 23 THR HA . 18657 1 313 . 1 1 24 24 THR HB H 1 4.072 . . 1 . . . A 23 THR HB . 18657 1 314 . 1 1 24 24 THR HG21 H 1 0.904 . . 1 . . . A 23 THR HG21 . 18657 1 315 . 1 1 24 24 THR HG22 H 1 0.904 . . 1 . . . A 23 THR HG22 . 18657 1 316 . 1 1 24 24 THR HG23 H 1 0.904 . . 1 . . . A 23 THR HG23 . 18657 1 317 . 1 1 24 24 THR C C 13 172.307 . . 1 . . . A 23 THR C . 18657 1 318 . 1 1 24 24 THR CA C 13 58.678 . . 1 . . . A 23 THR CA . 18657 1 319 . 1 1 24 24 THR CB C 13 69.836 . . 1 . . . A 23 THR CB . 18657 1 320 . 1 1 24 24 THR CG2 C 13 18.049 . . 1 . . . A 23 THR CG2 . 18657 1 321 . 1 1 24 24 THR N N 15 118.163 . . 1 . . . A 23 THR N . 18657 1 322 . 1 1 25 25 THR H H 1 8.139 . . 1 . . . A 24 THR H . 18657 1 323 . 1 1 25 25 THR HA H 1 5.691 . . 1 . . . A 24 THR HA . 18657 1 324 . 1 1 25 25 THR HB H 1 3.972 . . 1 . . . A 24 THR HB . 18657 1 325 . 1 1 25 25 THR HG21 H 1 0.999 . . 1 . . . A 24 THR HG21 . 18657 1 326 . 1 1 25 25 THR HG22 H 1 0.999 . . 1 . . . A 24 THR HG22 . 18657 1 327 . 1 1 25 25 THR HG23 H 1 0.999 . . 1 . . . A 24 THR HG23 . 18657 1 328 . 1 1 25 25 THR C C 13 174.035 . . 1 . . . A 24 THR C . 18657 1 329 . 1 1 25 25 THR CA C 13 58.843 . . 1 . . . A 24 THR CA . 18657 1 330 . 1 1 25 25 THR CB C 13 71.456 . . 1 . . . A 24 THR CB . 18657 1 331 . 1 1 25 25 THR CG2 C 13 22.851 . . 1 . . . A 24 THR CG2 . 18657 1 332 . 1 1 25 25 THR N N 15 111.374 . . 1 . . . A 24 THR N . 18657 1 333 . 1 1 26 26 ARG H H 1 8.626 . . 1 . . . A 25 ARG H . 18657 1 334 . 1 1 26 26 ARG HA H 1 4.575 . . 1 . . . A 25 ARG HA . 18657 1 335 . 1 1 26 26 ARG HB2 H 1 1.615 . . 2 . . . A 25 ARG HB2 . 18657 1 336 . 1 1 26 26 ARG HB3 H 1 1.690 . . 2 . . . A 25 ARG HB3 . 18657 1 337 . 1 1 26 26 ARG HG2 H 1 1.518 . . 2 . . . A 25 ARG HG2 . 18657 1 338 . 1 1 26 26 ARG HG3 H 1 1.518 . . 2 . . . A 25 ARG HG3 . 18657 1 339 . 1 1 26 26 ARG HD2 H 1 3.038 . . 2 . . . A 25 ARG HD2 . 18657 1 340 . 1 1 26 26 ARG HD3 H 1 3.218 . . 2 . . . A 25 ARG HD3 . 18657 1 341 . 1 1 26 26 ARG HE H 1 7.239 . . 1 . . . A 25 ARG HE . 18657 1 342 . 1 1 26 26 ARG HH11 H 1 6.912 . . 2 . . . A 25 ARG HH1 . 18657 1 343 . 1 1 26 26 ARG HH12 H 1 6.492 . . 1 . . . A 25 ARG HH12 . 18657 1 344 . 1 1 26 26 ARG HH22 H 1 6.912 . . 2 . . . A 25 ARG HH22 . 18657 1 345 . 1 1 26 26 ARG C C 13 174.979 . . 1 . . . A 25 ARG C . 18657 1 346 . 1 1 26 26 ARG CA C 13 55.085 . . 1 . . . A 25 ARG CA . 18657 1 347 . 1 1 26 26 ARG CB C 13 35.806 . . 1 . . . A 25 ARG CB . 18657 1 348 . 1 1 26 26 ARG CG C 13 27.334 . . 1 . . . A 25 ARG CG . 18657 1 349 . 1 1 26 26 ARG CD C 13 43.346 . . 1 . . . A 25 ARG CD . 18657 1 350 . 1 1 26 26 ARG N N 15 119.402 . . 1 . . . A 25 ARG N . 18657 1 351 . 1 1 26 26 ARG NE N 15 84.249 . . 1 . . . A 25 ARG NE . 18657 1 352 . 1 1 27 27 VAL H H 1 9.050 . . 1 . . . A 26 VAL H . 18657 1 353 . 1 1 27 27 VAL HA H 1 4.132 . . 1 . . . A 26 VAL HA . 18657 1 354 . 1 1 27 27 VAL HB H 1 2.035 . . 1 . . . A 26 VAL HB . 18657 1 355 . 1 1 27 27 VAL HG11 H 1 0.812 . . 1 . . . A 26 VAL HG11 . 18657 1 356 . 1 1 27 27 VAL HG12 H 1 0.812 . . 1 . . . A 26 VAL HG12 . 18657 1 357 . 1 1 27 27 VAL HG13 H 1 0.812 . . 1 . . . A 26 VAL HG13 . 18657 1 358 . 1 1 27 27 VAL HG21 H 1 0.896 . . 1 . . . A 26 VAL HG21 . 18657 1 359 . 1 1 27 27 VAL HG22 H 1 0.896 . . 1 . . . A 26 VAL HG22 . 18657 1 360 . 1 1 27 27 VAL HG23 H 1 0.896 . . 1 . . . A 26 VAL HG23 . 18657 1 361 . 1 1 27 27 VAL C C 13 174.893 . . 1 . . . A 26 VAL C . 18657 1 362 . 1 1 27 27 VAL CA C 13 64.085 . . 1 . . . A 26 VAL CA . 18657 1 363 . 1 1 27 27 VAL CB C 13 30.450 . . 1 . . . A 26 VAL CB . 18657 1 364 . 1 1 27 27 VAL CG1 C 13 21.211 . . 2 . . . A 26 VAL CG1 . 18657 1 365 . 1 1 27 27 VAL CG2 C 13 22.070 . . 2 . . . A 26 VAL CG2 . 18657 1 366 . 1 1 27 27 VAL N N 15 124.668 . . 1 . . . A 26 VAL N . 18657 1 367 . 1 1 28 28 VAL H H 1 8.266 . . 1 . . . A 27 VAL H . 18657 1 368 . 1 1 28 28 VAL HA H 1 4.649 . . 1 . . . A 27 VAL HA . 18657 1 369 . 1 1 28 28 VAL HB H 1 1.962 . . 1 . . . A 27 VAL HB . 18657 1 370 . 1 1 28 28 VAL HG11 H 1 0.706 . . 1 . . . A 27 VAL HG11 . 18657 1 371 . 1 1 28 28 VAL HG12 H 1 0.706 . . 1 . . . A 27 VAL HG12 . 18657 1 372 . 1 1 28 28 VAL HG13 H 1 0.706 . . 1 . . . A 27 VAL HG13 . 18657 1 373 . 1 1 28 28 VAL HG21 H 1 0.833 . . 1 . . . A 27 VAL HG21 . 18657 1 374 . 1 1 28 28 VAL HG22 H 1 0.833 . . 1 . . . A 27 VAL HG22 . 18657 1 375 . 1 1 28 28 VAL HG23 H 1 0.833 . . 1 . . . A 27 VAL HG23 . 18657 1 376 . 1 1 28 28 VAL C C 13 174.747 . . 1 . . . A 27 VAL C . 18657 1 377 . 1 1 28 28 VAL CA C 13 59.232 . . 1 . . . A 27 VAL CA . 18657 1 378 . 1 1 28 28 VAL CB C 13 36.205 . . 1 . . . A 27 VAL CB . 18657 1 379 . 1 1 28 28 VAL CG1 C 13 21.961 . . 2 . . . A 27 VAL CG1 . 18657 1 380 . 1 1 28 28 VAL CG2 C 13 18.472 . . 2 . . . A 27 VAL CG2 . 18657 1 381 . 1 1 28 28 VAL N N 15 123.136 . . 1 . . . A 27 VAL N . 18657 1 382 . 1 1 29 29 SER H H 1 8.302 . . 1 . . . A 28 SER H . 18657 1 383 . 1 1 29 29 SER HA H 1 4.535 . . 1 . . . A 28 SER HA . 18657 1 384 . 1 1 29 29 SER HB2 H 1 3.561 . . 2 . . . A 28 SER HB2 . 18657 1 385 . 1 1 29 29 SER HB3 H 1 3.642 . . 2 . . . A 28 SER HB3 . 18657 1 386 . 1 1 29 29 SER CA C 13 54.880 . . 1 . . . A 28 SER CA . 18657 1 387 . 1 1 29 29 SER CB C 13 64.922 . . 1 . . . A 28 SER CB . 18657 1 388 . 1 1 29 29 SER N N 15 116.564 . . 1 . . . A 28 SER N . 18657 1 389 . 1 1 30 30 PRO HA H 1 4.774 . . 1 . . . A 29 PRO HA . 18657 1 390 . 1 1 30 30 PRO HB2 H 1 2.452 . . 2 . . . A 29 PRO HB2 . 18657 1 391 . 1 1 30 30 PRO HB3 H 1 2.074 . . 2 . . . A 29 PRO HB3 . 18657 1 392 . 1 1 30 30 PRO HG2 H 1 1.765 . . 2 . . . A 29 PRO HG2 . 18657 1 393 . 1 1 30 30 PRO HG3 H 1 1.926 . . 2 . . . A 29 PRO HG3 . 18657 1 394 . 1 1 30 30 PRO HD2 H 1 3.487 . . 2 . . . A 29 PRO HD2 . 18657 1 395 . 1 1 30 30 PRO HD3 H 1 3.587 . . 2 . . . A 29 PRO HD3 . 18657 1 396 . 1 1 30 30 PRO C C 13 176.324 . . 1 . . . A 29 PRO C . 18657 1 397 . 1 1 30 30 PRO CA C 13 62.543 . . 1 . . . A 29 PRO CA . 18657 1 398 . 1 1 30 30 PRO CB C 13 34.561 . . 1 . . . A 29 PRO CB . 18657 1 399 . 1 1 30 30 PRO CG C 13 25.294 . . 1 . . . A 29 PRO CG . 18657 1 400 . 1 1 30 30 PRO CD C 13 50.338 . . 1 . . . A 29 PRO CD . 18657 1 401 . 1 1 31 31 THR H H 1 8.492 . . 1 . . . A 30 THR H . 18657 1 402 . 1 1 31 31 THR HA H 1 3.830 . . 1 . . . A 30 THR HA . 18657 1 403 . 1 1 31 31 THR HB H 1 4.251 . . 1 . . . A 30 THR HB . 18657 1 404 . 1 1 31 31 THR HG21 H 1 1.354 . . 1 . . . A 30 THR HG21 . 18657 1 405 . 1 1 31 31 THR HG22 H 1 1.354 . . 1 . . . A 30 THR HG22 . 18657 1 406 . 1 1 31 31 THR HG23 H 1 1.354 . . 1 . . . A 30 THR HG23 . 18657 1 407 . 1 1 31 31 THR C C 13 174.556 . . 1 . . . A 30 THR C . 18657 1 408 . 1 1 31 31 THR CA C 13 62.846 . . 1 . . . A 30 THR CA . 18657 1 409 . 1 1 31 31 THR CB C 13 69.384 . . 1 . . . A 30 THR CB . 18657 1 410 . 1 1 31 31 THR CG2 C 13 22.152 . . 1 . . . A 30 THR CG2 . 18657 1 411 . 1 1 31 31 THR N N 15 113.418 . . 1 . . . A 30 THR N . 18657 1 412 . 1 1 32 32 GLY H H 1 8.054 . . 1 . . . A 31 GLY H . 18657 1 413 . 1 1 32 32 GLY HA2 H 1 5.002 . . 2 . . . A 31 GLY HA2 . 18657 1 414 . 1 1 32 32 GLY HA3 H 1 3.469 . . 1 . . . A 31 GLY HA3 . 18657 1 415 . 1 1 32 32 GLY C C 13 174.722 . . 1 . . . A 31 GLY C . 18657 1 416 . 1 1 32 32 GLY CA C 13 44.844 . . 1 . . . A 31 GLY CA . 18657 1 417 . 1 1 32 32 GLY N N 15 109.224 . . 1 . . . A 31 GLY N . 18657 1 418 . 1 1 33 33 ILE H H 1 8.820 . . 1 . . . A 32 ILE H . 18657 1 419 . 1 1 33 33 ILE HA H 1 3.959 . . 1 . . . A 32 ILE HA . 18657 1 420 . 1 1 33 33 ILE HB H 1 1.262 . . 1 . . . A 32 ILE HB . 18657 1 421 . 1 1 33 33 ILE HG12 H 1 0.329 . . 2 . . . A 32 ILE HG12 . 18657 1 422 . 1 1 33 33 ILE HG13 H 1 1.199 . . 2 . . . A 32 ILE HG13 . 18657 1 423 . 1 1 33 33 ILE HG21 H 1 0.993 . . 1 . . . A 32 ILE HG21 . 18657 1 424 . 1 1 33 33 ILE HG22 H 1 0.993 . . 1 . . . A 32 ILE HG22 . 18657 1 425 . 1 1 33 33 ILE HG23 H 1 0.993 . . 1 . . . A 32 ILE HG23 . 18657 1 426 . 1 1 33 33 ILE HD11 H 1 -0.008 . . 1 . . . A 32 ILE HD11 . 18657 1 427 . 1 1 33 33 ILE HD12 H 1 -0.008 . . 1 . . . A 32 ILE HD12 . 18657 1 428 . 1 1 33 33 ILE HD13 H 1 -0.008 . . 1 . . . A 32 ILE HD13 . 18657 1 429 . 1 1 33 33 ILE CA C 13 61.251 . . 1 . . . A 32 ILE CA . 18657 1 430 . 1 1 33 33 ILE CB C 13 39.665 . . 1 . . . A 32 ILE CB . 18657 1 431 . 1 1 33 33 ILE CG1 C 13 28.851 . . 1 . . . A 32 ILE CG1 . 18657 1 432 . 1 1 33 33 ILE CG2 C 13 16.035 . . 1 . . . A 32 ILE CG2 . 18657 1 433 . 1 1 33 33 ILE CD1 C 13 13.539 . . 1 . . . A 32 ILE CD1 . 18657 1 434 . 1 1 33 33 ILE N N 15 128.549 . . 1 . . . A 32 ILE N . 18657 1 435 . 1 1 34 34 PRO HA H 1 4.777 . . 1 . . . A 33 PRO HA . 18657 1 436 . 1 1 34 34 PRO HB2 H 1 2.420 . . 2 . . . A 33 PRO HB2 . 18657 1 437 . 1 1 34 34 PRO HB3 H 1 2.051 . . 2 . . . A 33 PRO HB3 . 18657 1 438 . 1 1 34 34 PRO HG2 H 1 2.037 . . 2 . . . A 33 PRO HG2 . 18657 1 439 . 1 1 34 34 PRO HG3 H 1 2.037 . . 2 . . . A 33 PRO HG3 . 18657 1 440 . 1 1 34 34 PRO HD2 H 1 3.883 . . 2 . . . A 33 PRO HD2 . 18657 1 441 . 1 1 34 34 PRO HD3 H 1 3.883 . . 2 . . . A 33 PRO HD3 . 18657 1 442 . 1 1 34 34 PRO C C 13 177.878 . . 1 . . . A 33 PRO C . 18657 1 443 . 1 1 34 34 PRO CA C 13 63.110 . . 1 . . . A 33 PRO CA . 18657 1 444 . 1 1 34 34 PRO CB C 13 32.793 . . 1 . . . A 33 PRO CB . 18657 1 445 . 1 1 34 34 PRO CG C 13 27.859 . . 1 . . . A 33 PRO CG . 18657 1 446 . 1 1 34 34 PRO CD C 13 51.351 . . 1 . . . A 33 PRO CD . 18657 1 447 . 1 1 35 35 ALA H H 1 7.973 . . 1 . . . A 34 ALA H . 18657 1 448 . 1 1 35 35 ALA HA H 1 3.722 . . 1 . . . A 34 ALA HA . 18657 1 449 . 1 1 35 35 ALA HB1 H 1 1.279 . . 1 . . . A 34 ALA HB1 . 18657 1 450 . 1 1 35 35 ALA HB2 H 1 1.279 . . 1 . . . A 34 ALA HB2 . 18657 1 451 . 1 1 35 35 ALA HB3 H 1 1.279 . . 1 . . . A 34 ALA HB3 . 18657 1 452 . 1 1 35 35 ALA C C 13 179.547 . . 1 . . . A 34 ALA C . 18657 1 453 . 1 1 35 35 ALA CA C 13 54.835 . . 1 . . . A 34 ALA CA . 18657 1 454 . 1 1 35 35 ALA CB C 13 19.974 . . 1 . . . A 34 ALA CB . 18657 1 455 . 1 1 35 35 ALA N N 15 123.151 . . 1 . . . A 34 ALA N . 18657 1 456 . 1 1 36 36 GLU H H 1 9.247 . . 1 . . . A 35 GLU H . 18657 1 457 . 1 1 36 36 GLU HA H 1 4.022 . . 1 . . . A 35 GLU HA . 18657 1 458 . 1 1 36 36 GLU HB2 H 1 2.067 . . 2 . . . A 35 GLU HB2 . 18657 1 459 . 1 1 36 36 GLU HB3 H 1 2.067 . . 2 . . . A 35 GLU HB3 . 18657 1 460 . 1 1 36 36 GLU HG2 H 1 2.277 . . 2 . . . A 35 GLU HG2 . 18657 1 461 . 1 1 36 36 GLU HG3 H 1 2.401 . . 2 . . . A 35 GLU HG3 . 18657 1 462 . 1 1 36 36 GLU C C 13 176.479 . . 1 . . . A 35 GLU C . 18657 1 463 . 1 1 36 36 GLU CA C 13 58.966 . . 1 . . . A 35 GLU CA . 18657 1 464 . 1 1 36 36 GLU CB C 13 28.642 . . 1 . . . A 35 GLU CB . 18657 1 465 . 1 1 36 36 GLU CG C 13 36.655 . . 1 . . . A 35 GLU CG . 18657 1 466 . 1 1 36 36 GLU N N 15 116.421 . . 1 . . . A 35 GLU N . 18657 1 467 . 1 1 37 37 ASP H H 1 8.146 . . 1 . . . A 36 ASP H . 18657 1 468 . 1 1 37 37 ASP HA H 1 4.955 . . 1 . . . A 36 ASP HA . 18657 1 469 . 1 1 37 37 ASP HB2 H 1 2.750 . . 2 . . . A 36 ASP HB2 . 18657 1 470 . 1 1 37 37 ASP HB3 H 1 2.900 . . 2 . . . A 36 ASP HB3 . 18657 1 471 . 1 1 37 37 ASP C C 13 176.823 . . 1 . . . A 36 ASP C . 18657 1 472 . 1 1 37 37 ASP CA C 13 54.568 . . 1 . . . A 36 ASP CA . 18657 1 473 . 1 1 37 37 ASP CB C 13 40.971 . . 1 . . . A 36 ASP CB . 18657 1 474 . 1 1 37 37 ASP N N 15 118.097 . . 1 . . . A 36 ASP N . 18657 1 475 . 1 1 38 38 ILE H H 1 7.520 . . 1 . . . A 37 ILE H . 18657 1 476 . 1 1 38 38 ILE HA H 1 3.636 . . 1 . . . A 37 ILE HA . 18657 1 477 . 1 1 38 38 ILE HB H 1 1.880 . . 1 . . . A 37 ILE HB . 18657 1 478 . 1 1 38 38 ILE HG12 H 1 1.174 . . 2 . . . A 37 ILE HG12 . 18657 1 479 . 1 1 38 38 ILE HG13 H 1 1.782 . . 2 . . . A 37 ILE HG13 . 18657 1 480 . 1 1 38 38 ILE HG21 H 1 0.793 . . 1 . . . A 37 ILE HG21 . 18657 1 481 . 1 1 38 38 ILE HG22 H 1 0.793 . . 1 . . . A 37 ILE HG22 . 18657 1 482 . 1 1 38 38 ILE HG23 H 1 0.793 . . 1 . . . A 37 ILE HG23 . 18657 1 483 . 1 1 38 38 ILE HD11 H 1 0.786 . . 1 . . . A 37 ILE HD11 . 18657 1 484 . 1 1 38 38 ILE HD12 H 1 0.786 . . 1 . . . A 37 ILE HD12 . 18657 1 485 . 1 1 38 38 ILE HD13 H 1 0.786 . . 1 . . . A 37 ILE HD13 . 18657 1 486 . 1 1 38 38 ILE CA C 13 68.859 . . 1 . . . A 37 ILE CA . 18657 1 487 . 1 1 38 38 ILE CB C 13 35.859 . . 1 . . . A 37 ILE CB . 18657 1 488 . 1 1 38 38 ILE CG1 C 13 32.369 . . 1 . . . A 37 ILE CG1 . 18657 1 489 . 1 1 38 38 ILE CG2 C 13 16.907 . . 1 . . . A 37 ILE CG2 . 18657 1 490 . 1 1 38 38 ILE CD1 C 13 12.952 . . 1 . . . A 37 ILE CD1 . 18657 1 491 . 1 1 38 38 ILE N N 15 121.429 . . 1 . . . A 37 ILE N . 18657 1 492 . 1 1 39 39 PRO HA H 1 4.183 . . 1 . . . A 38 PRO HA . 18657 1 493 . 1 1 39 39 PRO HB2 H 1 2.314 . . 2 . . . A 38 PRO HB2 . 18657 1 494 . 1 1 39 39 PRO HB3 H 1 1.826 . . 2 . . . A 38 PRO HB3 . 18657 1 495 . 1 1 39 39 PRO HG2 H 1 1.918 . . 2 . . . A 38 PRO HG2 . 18657 1 496 . 1 1 39 39 PRO HG3 H 1 2.078 . . 2 . . . A 38 PRO HG3 . 18657 1 497 . 1 1 39 39 PRO HD2 H 1 3.497 . . 2 . . . A 38 PRO HD2 . 18657 1 498 . 1 1 39 39 PRO HD3 H 1 3.681 . . 2 . . . A 38 PRO HD3 . 18657 1 499 . 1 1 39 39 PRO C C 13 179.052 . . 1 . . . A 38 PRO C . 18657 1 500 . 1 1 39 39 PRO CA C 13 65.906 . . 1 . . . A 38 PRO CA . 18657 1 501 . 1 1 39 39 PRO CB C 13 31.030 . . 1 . . . A 38 PRO CB . 18657 1 502 . 1 1 39 39 PRO CG C 13 28.396 . . 1 . . . A 38 PRO CG . 18657 1 503 . 1 1 39 39 PRO CD C 13 49.105 . . 1 . . . A 38 PRO CD . 18657 1 504 . 1 1 40 40 ARG H H 1 7.367 . . 1 . . . A 39 ARG H . 18657 1 505 . 1 1 40 40 ARG HA H 1 4.237 . . 1 . . . A 39 ARG HA . 18657 1 506 . 1 1 40 40 ARG HB2 H 1 1.907 . . 2 . . . A 39 ARG HB2 . 18657 1 507 . 1 1 40 40 ARG HB3 H 1 1.907 . . 2 . . . A 39 ARG HB3 . 18657 1 508 . 1 1 40 40 ARG HG2 H 1 1.642 . . 2 . . . A 39 ARG HG2 . 18657 1 509 . 1 1 40 40 ARG HG3 H 1 1.726 . . 2 . . . A 39 ARG HG3 . 18657 1 510 . 1 1 40 40 ARG HD2 H 1 3.156 . . 2 . . . A 39 ARG HD2 . 18657 1 511 . 1 1 40 40 ARG HD3 H 1 3.265 . . 2 . . . A 39 ARG HD3 . 18657 1 512 . 1 1 40 40 ARG HE H 1 7.254 . . 1 . . . A 39 ARG HE . 18657 1 513 . 1 1 40 40 ARG HH11 H 1 6.692 . . 2 . . . A 39 ARG HH1 . 18657 1 514 . 1 1 40 40 ARG HH12 H 1 6.423 . . 1 . . . A 39 ARG HH12 . 18657 1 515 . 1 1 40 40 ARG HH22 H 1 6.692 . . 2 . . . A 39 ARG HH22 . 18657 1 516 . 1 1 40 40 ARG C C 13 176.002 . . 1 . . . A 39 ARG C . 18657 1 517 . 1 1 40 40 ARG CA C 13 57.362 . . 1 . . . A 39 ARG CA . 18657 1 518 . 1 1 40 40 ARG CB C 13 30.510 . . 1 . . . A 39 ARG CB . 18657 1 519 . 1 1 40 40 ARG CG C 13 28.017 . . 1 . . . A 39 ARG CG . 18657 1 520 . 1 1 40 40 ARG CD C 13 44.011 . . 1 . . . A 39 ARG CD . 18657 1 521 . 1 1 40 40 ARG N N 15 115.064 . . 1 . . . A 39 ARG N . 18657 1 522 . 1 1 40 40 ARG NE N 15 84.249 . . 1 . . . A 39 ARG NE . 18657 1 523 . 1 1 41 41 LEU H H 1 7.782 . . 1 . . . A 40 LEU H . 18657 1 524 . 1 1 41 41 LEU HA H 1 4.080 . . 1 . . . A 40 LEU HA . 18657 1 525 . 1 1 41 41 LEU HB2 H 1 1.339 . . 2 . . . A 40 LEU HB2 . 18657 1 526 . 1 1 41 41 LEU HB3 H 1 1.809 . . 2 . . . A 40 LEU HB3 . 18657 1 527 . 1 1 41 41 LEU HG H 1 1.679 . . 1 . . . A 40 LEU HG . 18657 1 528 . 1 1 41 41 LEU HD11 H 1 0.729 . . 1 . . . A 40 LEU HD11 . 18657 1 529 . 1 1 41 41 LEU HD12 H 1 0.729 . . 1 . . . A 40 LEU HD12 . 18657 1 530 . 1 1 41 41 LEU HD13 H 1 0.729 . . 1 . . . A 40 LEU HD13 . 18657 1 531 . 1 1 41 41 LEU HD21 H 1 0.736 . . 1 . . . A 40 LEU HD21 . 18657 1 532 . 1 1 41 41 LEU HD22 H 1 0.736 . . 1 . . . A 40 LEU HD22 . 18657 1 533 . 1 1 41 41 LEU HD23 H 1 0.736 . . 1 . . . A 40 LEU HD23 . 18657 1 534 . 1 1 41 41 LEU C C 13 177.804 . . 1 . . . A 40 LEU C . 18657 1 535 . 1 1 41 41 LEU CA C 13 55.770 . . 1 . . . A 40 LEU CA . 18657 1 536 . 1 1 41 41 LEU CB C 13 42.782 . . 1 . . . A 40 LEU CB . 18657 1 537 . 1 1 41 41 LEU CG C 13 27.021 . . 1 . . . A 40 LEU CG . 18657 1 538 . 1 1 41 41 LEU CD1 C 13 26.652 . . 2 . . . A 40 LEU CD1 . 18657 1 539 . 1 1 41 41 LEU CD2 C 13 24.089 . . 2 . . . A 40 LEU CD2 . 18657 1 540 . 1 1 41 41 LEU N N 15 118.158 . . 1 . . . A 40 LEU N . 18657 1 541 . 1 1 42 42 ILE H H 1 6.799 . . 1 . . . A 41 ILE H . 18657 1 542 . 1 1 42 42 ILE HA H 1 3.345 . . 1 . . . A 41 ILE HA . 18657 1 543 . 1 1 42 42 ILE HB H 1 1.819 . . 1 . . . A 41 ILE HB . 18657 1 544 . 1 1 42 42 ILE HG12 H 1 1.138 . . 2 . . . A 41 ILE HG12 . 18657 1 545 . 1 1 42 42 ILE HG13 H 1 1.709 . . 2 . . . A 41 ILE HG13 . 18657 1 546 . 1 1 42 42 ILE HG21 H 1 0.994 . . 1 . . . A 41 ILE HG21 . 18657 1 547 . 1 1 42 42 ILE HG22 H 1 0.994 . . 1 . . . A 41 ILE HG22 . 18657 1 548 . 1 1 42 42 ILE HG23 H 1 0.994 . . 1 . . . A 41 ILE HG23 . 18657 1 549 . 1 1 42 42 ILE HD11 H 1 0.755 . . 1 . . . A 41 ILE HD11 . 18657 1 550 . 1 1 42 42 ILE HD12 H 1 0.755 . . 1 . . . A 41 ILE HD12 . 18657 1 551 . 1 1 42 42 ILE HD13 H 1 0.755 . . 1 . . . A 41 ILE HD13 . 18657 1 552 . 1 1 42 42 ILE C C 13 178.078 . . 1 . . . A 41 ILE C . 18657 1 553 . 1 1 42 42 ILE CA C 13 62.606 . . 1 . . . A 41 ILE CA . 18657 1 554 . 1 1 42 42 ILE CB C 13 36.606 . . 1 . . . A 41 ILE CB . 18657 1 555 . 1 1 42 42 ILE CG1 C 13 27.398 . . 1 . . . A 41 ILE CG1 . 18657 1 556 . 1 1 42 42 ILE CG2 C 13 17.344 . . 1 . . . A 41 ILE CG2 . 18657 1 557 . 1 1 42 42 ILE CD1 C 13 11.937 . . 1 . . . A 41 ILE CD1 . 18657 1 558 . 1 1 42 42 ILE N N 15 115.608 . . 1 . . . A 41 ILE N . 18657 1 559 . 1 1 43 43 SER H H 1 9.328 . . 1 . . . A 42 SER H . 18657 1 560 . 1 1 43 43 SER HA H 1 3.991 . . 1 . . . A 42 SER HA . 18657 1 561 . 1 1 43 43 SER HB2 H 1 3.977 . . 2 . . . A 42 SER HB2 . 18657 1 562 . 1 1 43 43 SER HB3 H 1 4.282 . . 2 . . . A 42 SER HB3 . 18657 1 563 . 1 1 43 43 SER C C 13 173.816 . . 1 . . . A 42 SER C . 18657 1 564 . 1 1 43 43 SER CA C 13 62.348 . . 1 . . . A 42 SER CA . 18657 1 565 . 1 1 43 43 SER CB C 13 62.947 . . 1 . . . A 42 SER CB . 18657 1 566 . 1 1 43 43 SER N N 15 121.395 . . 1 . . . A 42 SER N . 18657 1 567 . 1 1 44 44 MET H H 1 8.806 . . 1 . . . A 43 MET H . 18657 1 568 . 1 1 44 44 MET HA H 1 4.449 . . 1 . . . A 43 MET HA . 18657 1 569 . 1 1 44 44 MET HB2 H 1 2.031 . . 2 . . . A 43 MET HB2 . 18657 1 570 . 1 1 44 44 MET HB3 H 1 2.168 . . 2 . . . A 43 MET HB3 . 18657 1 571 . 1 1 44 44 MET HG2 H 1 2.357 . . 2 . . . A 43 MET HG2 . 18657 1 572 . 1 1 44 44 MET HG3 H 1 2.797 . . 2 . . . A 43 MET HG3 . 18657 1 573 . 1 1 44 44 MET HE1 H 1 2.061 . . 1 . . . A 43 MET HE1 . 18657 1 574 . 1 1 44 44 MET HE2 H 1 2.061 . . 1 . . . A 43 MET HE2 . 18657 1 575 . 1 1 44 44 MET HE3 H 1 2.061 . . 1 . . . A 43 MET HE3 . 18657 1 576 . 1 1 44 44 MET C C 13 175.128 . . 1 . . . A 43 MET C . 18657 1 577 . 1 1 44 44 MET CA C 13 57.119 . . 1 . . . A 43 MET CA . 18657 1 578 . 1 1 44 44 MET CB C 13 32.831 . . 1 . . . A 43 MET CB . 18657 1 579 . 1 1 44 44 MET CG C 13 34.029 . . 1 . . . A 43 MET CG . 18657 1 580 . 1 1 44 44 MET CE C 13 17.645 . . 1 . . . A 43 MET CE . 18657 1 581 . 1 1 44 44 MET N N 15 123.672 . . 1 . . . A 43 MET N . 18657 1 582 . 1 1 45 45 GLN H H 1 8.947 . . 1 . . . A 44 GLN H . 18657 1 583 . 1 1 45 45 GLN HA H 1 5.256 . . 1 . . . A 44 GLN HA . 18657 1 584 . 1 1 45 45 GLN HB2 H 1 1.718 . . 2 . . . A 44 GLN HB2 . 18657 1 585 . 1 1 45 45 GLN HB3 H 1 1.718 . . 2 . . . A 44 GLN HB3 . 18657 1 586 . 1 1 45 45 GLN HG2 H 1 2.005 . . 2 . . . A 44 GLN HG2 . 18657 1 587 . 1 1 45 45 GLN HG3 H 1 2.226 . . 2 . . . A 44 GLN HG3 . 18657 1 588 . 1 1 45 45 GLN HE21 H 1 7.510 . . 2 . . . A 44 GLN HE21 . 18657 1 589 . 1 1 45 45 GLN HE22 H 1 6.895 . . 2 . . . A 44 GLN HE22 . 18657 1 590 . 1 1 45 45 GLN C C 13 177.035 . . 1 . . . A 44 GLN C . 18657 1 591 . 1 1 45 45 GLN CA C 13 54.304 . . 1 . . . A 44 GLN CA . 18657 1 592 . 1 1 45 45 GLN CB C 13 32.083 . . 1 . . . A 44 GLN CB . 18657 1 593 . 1 1 45 45 GLN CG C 13 34.046 . . 1 . . . A 44 GLN CG . 18657 1 594 . 1 1 45 45 GLN N N 15 118.463 . . 1 . . . A 44 GLN N . 18657 1 595 . 1 1 45 45 GLN NE2 N 15 111.288 . . 1 . . . A 44 GLN NE2 . 18657 1 596 . 1 1 46 46 VAL H H 1 7.564 . . 1 . . . A 45 VAL H . 18657 1 597 . 1 1 46 46 VAL HA H 1 5.297 . . 1 . . . A 45 VAL HA . 18657 1 598 . 1 1 46 46 VAL HB H 1 2.414 . . 1 . . . A 45 VAL HB . 18657 1 599 . 1 1 46 46 VAL HG11 H 1 1.001 . . 1 . . . A 45 VAL HG11 . 18657 1 600 . 1 1 46 46 VAL HG12 H 1 1.001 . . 1 . . . A 45 VAL HG12 . 18657 1 601 . 1 1 46 46 VAL HG13 H 1 1.001 . . 1 . . . A 45 VAL HG13 . 18657 1 602 . 1 1 46 46 VAL HG21 H 1 1.142 . . 1 . . . A 45 VAL HG21 . 18657 1 603 . 1 1 46 46 VAL HG22 H 1 1.142 . . 1 . . . A 45 VAL HG22 . 18657 1 604 . 1 1 46 46 VAL HG23 H 1 1.142 . . 1 . . . A 45 VAL HG23 . 18657 1 605 . 1 1 46 46 VAL C C 13 177.962 . . 1 . . . A 45 VAL C . 18657 1 606 . 1 1 46 46 VAL CA C 13 59.950 . . 1 . . . A 45 VAL CA . 18657 1 607 . 1 1 46 46 VAL CB C 13 33.437 . . 1 . . . A 45 VAL CB . 18657 1 608 . 1 1 46 46 VAL CG1 C 13 22.456 . . 2 . . . A 45 VAL CG1 . 18657 1 609 . 1 1 46 46 VAL CG2 C 13 20.876 . . 2 . . . A 45 VAL CG2 . 18657 1 610 . 1 1 46 46 VAL N N 15 111.238 . . 1 . . . A 45 VAL N . 18657 1 611 . 1 1 47 47 ASN H H 1 8.556 . . 1 . . . A 46 ASN H . 18657 1 612 . 1 1 47 47 ASN HA H 1 4.716 . . 1 . . . A 46 ASN HA . 18657 1 613 . 1 1 47 47 ASN HB2 H 1 2.373 . . 2 . . . A 46 ASN HB2 . 18657 1 614 . 1 1 47 47 ASN HB3 H 1 3.276 . . 2 . . . A 46 ASN HB3 . 18657 1 615 . 1 1 47 47 ASN HD21 H 1 7.245 . . 1 . . . A 46 ASN HD21 . 18657 1 616 . 1 1 47 47 ASN HD22 H 1 7.245 . . 1 . . . A 46 ASN HD22 . 18657 1 617 . 1 1 47 47 ASN C C 13 174.812 . . 1 . . . A 46 ASN C . 18657 1 618 . 1 1 47 47 ASN CA C 13 51.680 . . 1 . . . A 46 ASN CA . 18657 1 619 . 1 1 47 47 ASN CB C 13 39.469 . . 1 . . . A 46 ASN CB . 18657 1 620 . 1 1 47 47 ASN CG C 13 175.465 . . 1 . . . A 46 ASN CG . 18657 1 621 . 1 1 47 47 ASN N N 15 118.782 . . 1 . . . A 46 ASN N . 18657 1 622 . 1 1 47 47 ASN ND2 N 15 110.245 . . 1 . . . A 46 ASN ND2 . 18657 1 623 . 1 1 48 48 GLN H H 1 7.663 . . 1 . . . A 47 GLN H . 18657 1 624 . 1 1 48 48 GLN HA H 1 4.549 . . 1 . . . A 47 GLN HA . 18657 1 625 . 1 1 48 48 GLN HB2 H 1 2.064 . . 2 . . . A 47 GLN HB2 . 18657 1 626 . 1 1 48 48 GLN HB3 H 1 2.283 . . 2 . . . A 47 GLN HB3 . 18657 1 627 . 1 1 48 48 GLN HG2 H 1 1.796 . . 2 . . . A 47 GLN HG2 . 18657 1 628 . 1 1 48 48 GLN HG3 H 1 2.291 . . 2 . . . A 47 GLN HG3 . 18657 1 629 . 1 1 48 48 GLN HE21 H 1 7.896 . . 2 . . . A 47 GLN HE21 . 18657 1 630 . 1 1 48 48 GLN HE22 H 1 7.256 . . 2 . . . A 47 GLN HE22 . 18657 1 631 . 1 1 48 48 GLN C C 13 172.365 . . 1 . . . A 47 GLN C . 18657 1 632 . 1 1 48 48 GLN CA C 13 53.013 . . 1 . . . A 47 GLN CA . 18657 1 633 . 1 1 48 48 GLN CB C 13 32.841 . . 1 . . . A 47 GLN CB . 18657 1 634 . 1 1 48 48 GLN CG C 13 32.453 . . 1 . . . A 47 GLN CG . 18657 1 635 . 1 1 48 48 GLN CD C 13 181.631 . . 1 . . . A 47 GLN CD . 18657 1 636 . 1 1 48 48 GLN N N 15 112.810 . . 1 . . . A 47 GLN N . 18657 1 637 . 1 1 48 48 GLN NE2 N 15 111.949 . . 1 . . . A 47 GLN NE2 . 18657 1 638 . 1 1 49 49 VAL H H 1 8.407 . . 1 . . . A 48 VAL H . 18657 1 639 . 1 1 49 49 VAL HA H 1 4.184 . . 1 . . . A 48 VAL HA . 18657 1 640 . 1 1 49 49 VAL HB H 1 1.912 . . 1 . . . A 48 VAL HB . 18657 1 641 . 1 1 49 49 VAL HG11 H 1 1.045 . . 1 . . . A 48 VAL HG11 . 18657 1 642 . 1 1 49 49 VAL HG12 H 1 1.045 . . 1 . . . A 48 VAL HG12 . 18657 1 643 . 1 1 49 49 VAL HG13 H 1 1.045 . . 1 . . . A 48 VAL HG13 . 18657 1 644 . 1 1 49 49 VAL HG21 H 1 0.787 . . 1 . . . A 48 VAL HG21 . 18657 1 645 . 1 1 49 49 VAL HG22 H 1 0.787 . . 1 . . . A 48 VAL HG22 . 18657 1 646 . 1 1 49 49 VAL HG23 H 1 0.787 . . 1 . . . A 48 VAL HG23 . 18657 1 647 . 1 1 49 49 VAL C C 13 176.865 . . 1 . . . A 48 VAL C . 18657 1 648 . 1 1 49 49 VAL CA C 13 62.932 . . 1 . . . A 48 VAL CA . 18657 1 649 . 1 1 49 49 VAL CB C 13 31.788 . . 1 . . . A 48 VAL CB . 18657 1 650 . 1 1 49 49 VAL CG1 C 13 23.358 . . 2 . . . A 48 VAL CG1 . 18657 1 651 . 1 1 49 49 VAL CG2 C 13 20.917 . . 2 . . . A 48 VAL CG2 . 18657 1 652 . 1 1 49 49 VAL N N 15 118.841 . . 1 . . . A 48 VAL N . 18657 1 653 . 1 1 50 50 VAL H H 1 9.165 . . 1 . . . A 49 VAL H . 18657 1 654 . 1 1 50 50 VAL HA H 1 4.547 . . 1 . . . A 49 VAL HA . 18657 1 655 . 1 1 50 50 VAL HB H 1 2.264 . . 1 . . . A 49 VAL HB . 18657 1 656 . 1 1 50 50 VAL HG11 H 1 0.847 . . 1 . . . A 49 VAL HG11 . 18657 1 657 . 1 1 50 50 VAL HG12 H 1 0.847 . . 1 . . . A 49 VAL HG12 . 18657 1 658 . 1 1 50 50 VAL HG13 H 1 0.847 . . 1 . . . A 49 VAL HG13 . 18657 1 659 . 1 1 50 50 VAL HG21 H 1 0.968 . . 1 . . . A 49 VAL HG21 . 18657 1 660 . 1 1 50 50 VAL HG22 H 1 0.968 . . 1 . . . A 49 VAL HG22 . 18657 1 661 . 1 1 50 50 VAL HG23 H 1 0.968 . . 1 . . . A 49 VAL HG23 . 18657 1 662 . 1 1 50 50 VAL CA C 13 59.419 . . 1 . . . A 49 VAL CA . 18657 1 663 . 1 1 50 50 VAL CB C 13 33.236 . . 1 . . . A 49 VAL CB . 18657 1 664 . 1 1 50 50 VAL CG1 C 13 22.385 . . 2 . . . A 49 VAL CG1 . 18657 1 665 . 1 1 50 50 VAL CG2 C 13 20.093 . . 2 . . . A 49 VAL CG2 . 18657 1 666 . 1 1 50 50 VAL N N 15 130.600 . . 1 . . . A 49 VAL N . 18657 1 667 . 1 1 51 51 PRO HA H 1 4.227 . . 1 . . . A 50 PRO HA . 18657 1 668 . 1 1 51 51 PRO HB2 H 1 2.328 . . 2 . . . A 50 PRO HB2 . 18657 1 669 . 1 1 51 51 PRO HB3 H 1 1.628 . . 2 . . . A 50 PRO HB3 . 18657 1 670 . 1 1 51 51 PRO HG2 H 1 1.748 . . 2 . . . A 50 PRO HG2 . 18657 1 671 . 1 1 51 51 PRO HG3 H 1 2.019 . . 2 . . . A 50 PRO HG3 . 18657 1 672 . 1 1 51 51 PRO HD2 H 1 3.623 . . 2 . . . A 50 PRO HD2 . 18657 1 673 . 1 1 51 51 PRO HD3 H 1 3.880 . . 2 . . . A 50 PRO HD3 . 18657 1 674 . 1 1 51 51 PRO C C 13 176.512 . . 1 . . . A 50 PRO C . 18657 1 675 . 1 1 51 51 PRO CA C 13 62.220 . . 1 . . . A 50 PRO CA . 18657 1 676 . 1 1 51 51 PRO CB C 13 32.282 . . 1 . . . A 50 PRO CB . 18657 1 677 . 1 1 51 51 PRO CG C 13 27.706 . . 1 . . . A 50 PRO CG . 18657 1 678 . 1 1 51 51 PRO CD C 13 51.183 . . 1 . . . A 50 PRO CD . 18657 1 679 . 1 1 52 52 MET H H 1 8.598 . . 1 . . . A 51 MET H . 18657 1 680 . 1 1 52 52 MET HA H 1 3.322 . . 1 . . . A 51 MET HA . 18657 1 681 . 1 1 52 52 MET HB2 H 1 1.621 . . 2 . . . A 51 MET HB2 . 18657 1 682 . 1 1 52 52 MET HB3 H 1 1.911 . . 2 . . . A 51 MET HB3 . 18657 1 683 . 1 1 52 52 MET HG2 H 1 1.995 . . 2 . . . A 51 MET HG2 . 18657 1 684 . 1 1 52 52 MET HG3 H 1 2.269 . . 2 . . . A 51 MET HG3 . 18657 1 685 . 1 1 52 52 MET HE1 H 1 2.038 . . 1 . . . A 51 MET HE1 . 18657 1 686 . 1 1 52 52 MET HE2 H 1 2.038 . . 1 . . . A 51 MET HE2 . 18657 1 687 . 1 1 52 52 MET HE3 H 1 2.038 . . 1 . . . A 51 MET HE3 . 18657 1 688 . 1 1 52 52 MET C C 13 176.953 . . 1 . . . A 51 MET C . 18657 1 689 . 1 1 52 52 MET CA C 13 58.534 . . 1 . . . A 51 MET CA . 18657 1 690 . 1 1 52 52 MET CB C 13 32.593 . . 1 . . . A 51 MET CB . 18657 1 691 . 1 1 52 52 MET CG C 13 31.060 . . 1 . . . A 51 MET CG . 18657 1 692 . 1 1 52 52 MET CE C 13 17.082 . . 1 . . . A 51 MET CE . 18657 1 693 . 1 1 52 52 MET N N 15 123.146 . . 1 . . . A 51 MET N . 18657 1 694 . 1 1 53 53 GLY H H 1 8.852 . . 1 . . . A 52 GLY H . 18657 1 695 . 1 1 53 53 GLY HA2 H 1 4.256 . . 2 . . . A 52 GLY HA2 . 18657 1 696 . 1 1 53 53 GLY HA3 H 1 3.373 . . 1 . . . A 52 GLY HA3 . 18657 1 697 . 1 1 53 53 GLY C C 13 173.693 . . 1 . . . A 52 GLY C . 18657 1 698 . 1 1 53 53 GLY CA C 13 45.046 . . 1 . . . A 52 GLY CA . 18657 1 699 . 1 1 53 53 GLY N N 15 114.707 . . 1 . . . A 52 GLY N . 18657 1 700 . 1 1 54 54 THR H H 1 7.706 . . 1 . . . A 53 THR H . 18657 1 701 . 1 1 54 54 THR HA H 1 4.143 . . 1 . . . A 53 THR HA . 18657 1 702 . 1 1 54 54 THR HB H 1 4.042 . . 1 . . . A 53 THR HB . 18657 1 703 . 1 1 54 54 THR HG1 H 1 5.746 . . 1 . . . A 53 THR HG1 . 18657 1 704 . 1 1 54 54 THR HG21 H 1 1.255 . . 1 . . . A 53 THR HG21 . 18657 1 705 . 1 1 54 54 THR HG22 H 1 1.255 . . 1 . . . A 53 THR HG22 . 18657 1 706 . 1 1 54 54 THR HG23 H 1 1.255 . . 1 . . . A 53 THR HG23 . 18657 1 707 . 1 1 54 54 THR C C 13 173.482 . . 1 . . . A 53 THR C . 18657 1 708 . 1 1 54 54 THR CA C 13 63.363 . . 1 . . . A 53 THR CA . 18657 1 709 . 1 1 54 54 THR CB C 13 69.448 . . 1 . . . A 53 THR CB . 18657 1 710 . 1 1 54 54 THR CG2 C 13 21.516 . . 1 . . . A 53 THR CG2 . 18657 1 711 . 1 1 54 54 THR N N 15 119.372 . . 1 . . . A 53 THR N . 18657 1 712 . 1 1 55 55 THR H H 1 8.914 . . 1 . . . A 54 THR H . 18657 1 713 . 1 1 55 55 THR HA H 1 4.137 . . 1 . . . A 54 THR HA . 18657 1 714 . 1 1 55 55 THR HB H 1 3.920 . . 1 . . . A 54 THR HB . 18657 1 715 . 1 1 55 55 THR HG1 H 1 6.074 . . 1 . . . A 54 THR HG1 . 18657 1 716 . 1 1 55 55 THR HG21 H 1 1.070 . . 1 . . . A 54 THR HG21 . 18657 1 717 . 1 1 55 55 THR HG22 H 1 1.070 . . 1 . . . A 54 THR HG22 . 18657 1 718 . 1 1 55 55 THR HG23 H 1 1.070 . . 1 . . . A 54 THR HG23 . 18657 1 719 . 1 1 55 55 THR C C 13 173.018 . . 1 . . . A 54 THR C . 18657 1 720 . 1 1 55 55 THR CA C 13 63.314 . . 1 . . . A 54 THR CA . 18657 1 721 . 1 1 55 55 THR CB C 13 68.846 . . 1 . . . A 54 THR CB . 18657 1 722 . 1 1 55 55 THR CG2 C 13 23.049 . . 1 . . . A 54 THR CG2 . 18657 1 723 . 1 1 55 55 THR N N 15 125.168 . . 1 . . . A 54 THR N . 18657 1 724 . 1 1 56 56 LEU H H 1 9.006 . . 1 . . . A 55 LEU H . 18657 1 725 . 1 1 56 56 LEU HA H 1 4.298 . . 1 . . . A 55 LEU HA . 18657 1 726 . 1 1 56 56 LEU HB2 H 1 0.999 . . 2 . . . A 55 LEU HB2 . 18657 1 727 . 1 1 56 56 LEU HB3 H 1 1.443 . . 2 . . . A 55 LEU HB3 . 18657 1 728 . 1 1 56 56 LEU HG H 1 1.308 . . 1 . . . A 55 LEU HG . 18657 1 729 . 1 1 56 56 LEU HD11 H 1 0.730 . . 1 . . . A 55 LEU HD11 . 18657 1 730 . 1 1 56 56 LEU HD12 H 1 0.730 . . 1 . . . A 55 LEU HD12 . 18657 1 731 . 1 1 56 56 LEU HD13 H 1 0.730 . . 1 . . . A 55 LEU HD13 . 18657 1 732 . 1 1 56 56 LEU HD21 H 1 0.594 . . 1 . . . A 55 LEU HD21 . 18657 1 733 . 1 1 56 56 LEU HD22 H 1 0.594 . . 1 . . . A 55 LEU HD22 . 18657 1 734 . 1 1 56 56 LEU HD23 H 1 0.594 . . 1 . . . A 55 LEU HD23 . 18657 1 735 . 1 1 56 56 LEU C C 13 174.234 . . 1 . . . A 55 LEU C . 18657 1 736 . 1 1 56 56 LEU CA C 13 55.132 . . 1 . . . A 55 LEU CA . 18657 1 737 . 1 1 56 56 LEU CB C 13 42.317 . . 1 . . . A 55 LEU CB . 18657 1 738 . 1 1 56 56 LEU CG C 13 28.038 . . 1 . . . A 55 LEU CG . 18657 1 739 . 1 1 56 56 LEU CD1 C 13 25.098 . . 2 . . . A 55 LEU CD1 . 18657 1 740 . 1 1 56 56 LEU CD2 C 13 26.487 . . 2 . . . A 55 LEU CD2 . 18657 1 741 . 1 1 56 56 LEU N N 15 131.166 . . 1 . . . A 55 LEU N . 18657 1 742 . 1 1 57 57 MET H H 1 8.028 . . 1 . . . A 56 MET H . 18657 1 743 . 1 1 57 57 MET HA H 1 5.043 . . 1 . . . A 56 MET HA . 18657 1 744 . 1 1 57 57 MET HB2 H 1 1.802 . . 2 . . . A 56 MET HB2 . 18657 1 745 . 1 1 57 57 MET HB3 H 1 2.230 . . 2 . . . A 56 MET HB3 . 18657 1 746 . 1 1 57 57 MET HG2 H 1 2.559 . . 2 . . . A 56 MET HG2 . 18657 1 747 . 1 1 57 57 MET HG3 H 1 2.843 . . 2 . . . A 56 MET HG3 . 18657 1 748 . 1 1 57 57 MET HE1 H 1 2.010 . . 1 . . . A 56 MET HE1 . 18657 1 749 . 1 1 57 57 MET HE2 H 1 2.010 . . 1 . . . A 56 MET HE2 . 18657 1 750 . 1 1 57 57 MET HE3 H 1 2.010 . . 1 . . . A 56 MET HE3 . 18657 1 751 . 1 1 57 57 MET CA C 13 51.058 . . 1 . . . A 56 MET CA . 18657 1 752 . 1 1 57 57 MET CB C 13 31.593 . . 1 . . . A 56 MET CB . 18657 1 753 . 1 1 57 57 MET CG C 13 31.977 . . 1 . . . A 56 MET CG . 18657 1 754 . 1 1 57 57 MET CE C 13 16.679 . . 1 . . . A 56 MET CE . 18657 1 755 . 1 1 57 57 MET N N 15 126.627 . . 1 . . . A 56 MET N . 18657 1 756 . 1 1 58 58 PRO HA H 1 3.695 . . 1 . . . A 57 PRO HA . 18657 1 757 . 1 1 58 58 PRO HB2 H 1 2.428 . . 2 . . . A 57 PRO HB2 . 18657 1 758 . 1 1 58 58 PRO HB3 H 1 2.076 . . 2 . . . A 57 PRO HB3 . 18657 1 759 . 1 1 58 58 PRO HG2 H 1 1.883 . . 2 . . . A 57 PRO HG2 . 18657 1 760 . 1 1 58 58 PRO HG3 H 1 2.279 . . 2 . . . A 57 PRO HG3 . 18657 1 761 . 1 1 58 58 PRO HD2 H 1 3.569 . . 2 . . . A 57 PRO HD2 . 18657 1 762 . 1 1 58 58 PRO HD3 H 1 3.875 . . 2 . . . A 57 PRO HD3 . 18657 1 763 . 1 1 58 58 PRO C C 13 176.780 . . 1 . . . A 57 PRO C . 18657 1 764 . 1 1 58 58 PRO CA C 13 66.142 . . 1 . . . A 57 PRO CA . 18657 1 765 . 1 1 58 58 PRO CB C 13 32.795 . . 1 . . . A 57 PRO CB . 18657 1 766 . 1 1 58 58 PRO CG C 13 27.867 . . 1 . . . A 57 PRO CG . 18657 1 767 . 1 1 58 58 PRO CD C 13 50.453 . . 1 . . . A 57 PRO CD . 18657 1 768 . 1 1 59 59 ASP H H 1 8.036 . . 1 . . . A 58 ASP H . 18657 1 769 . 1 1 59 59 ASP HA H 1 4.436 . . 1 . . . A 58 ASP HA . 18657 1 770 . 1 1 59 59 ASP HB2 H 1 2.641 . . 2 . . . A 58 ASP HB2 . 18657 1 771 . 1 1 59 59 ASP HB3 H 1 2.764 . . 2 . . . A 58 ASP HB3 . 18657 1 772 . 1 1 59 59 ASP C C 13 176.945 . . 1 . . . A 58 ASP C . 18657 1 773 . 1 1 59 59 ASP CA C 13 54.660 . . 1 . . . A 58 ASP CA . 18657 1 774 . 1 1 59 59 ASP CB C 13 39.716 . . 1 . . . A 58 ASP CB . 18657 1 775 . 1 1 59 59 ASP N N 15 110.360 . . 1 . . . A 58 ASP N . 18657 1 776 . 1 1 60 60 MET H H 1 8.066 . . 1 . . . A 59 MET H . 18657 1 777 . 1 1 60 60 MET HA H 1 4.642 . . 1 . . . A 59 MET HA . 18657 1 778 . 1 1 60 60 MET HB2 H 1 2.030 . . 2 . . . A 59 MET HB2 . 18657 1 779 . 1 1 60 60 MET HB3 H 1 2.087 . . 2 . . . A 59 MET HB3 . 18657 1 780 . 1 1 60 60 MET HG2 H 1 2.407 . . 2 . . . A 59 MET HG2 . 18657 1 781 . 1 1 60 60 MET HG3 H 1 2.558 . . 2 . . . A 59 MET HG3 . 18657 1 782 . 1 1 60 60 MET HE1 H 1 2.136 . . 1 . . . A 59 MET HE1 . 18657 1 783 . 1 1 60 60 MET HE2 H 1 2.136 . . 1 . . . A 59 MET HE2 . 18657 1 784 . 1 1 60 60 MET HE3 H 1 2.136 . . 1 . . . A 59 MET HE3 . 18657 1 785 . 1 1 60 60 MET C C 13 174.817 . . 1 . . . A 59 MET C . 18657 1 786 . 1 1 60 60 MET CA C 13 56.757 . . 1 . . . A 59 MET CA . 18657 1 787 . 1 1 60 60 MET CB C 13 33.587 . . 1 . . . A 59 MET CB . 18657 1 788 . 1 1 60 60 MET CG C 13 32.807 . . 1 . . . A 59 MET CG . 18657 1 789 . 1 1 60 60 MET CE C 13 17.600 . . 1 . . . A 59 MET CE . 18657 1 790 . 1 1 60 60 MET N N 15 116.951 . . 1 . . . A 59 MET N . 18657 1 791 . 1 1 61 61 VAL H H 1 7.109 . . 1 . . . A 60 VAL H . 18657 1 792 . 1 1 61 61 VAL HA H 1 4.351 . . 1 . . . A 60 VAL HA . 18657 1 793 . 1 1 61 61 VAL HB H 1 1.753 . . 1 . . . A 60 VAL HB . 18657 1 794 . 1 1 61 61 VAL HG11 H 1 0.837 . . 1 . . . A 60 VAL HG11 . 18657 1 795 . 1 1 61 61 VAL HG12 H 1 0.837 . . 1 . . . A 60 VAL HG12 . 18657 1 796 . 1 1 61 61 VAL HG13 H 1 0.837 . . 1 . . . A 60 VAL HG13 . 18657 1 797 . 1 1 61 61 VAL HG21 H 1 0.538 . . 1 . . . A 60 VAL HG21 . 18657 1 798 . 1 1 61 61 VAL HG22 H 1 0.538 . . 1 . . . A 60 VAL HG22 . 18657 1 799 . 1 1 61 61 VAL HG23 H 1 0.538 . . 1 . . . A 60 VAL HG23 . 18657 1 800 . 1 1 61 61 VAL C C 13 176.067 . . 1 . . . A 60 VAL C . 18657 1 801 . 1 1 61 61 VAL CA C 13 61.229 . . 1 . . . A 60 VAL CA . 18657 1 802 . 1 1 61 61 VAL CB C 13 33.146 . . 1 . . . A 60 VAL CB . 18657 1 803 . 1 1 61 61 VAL CG1 C 13 22.448 . . 2 . . . A 60 VAL CG1 . 18657 1 804 . 1 1 61 61 VAL CG2 C 13 20.958 . . 2 . . . A 60 VAL CG2 . 18657 1 805 . 1 1 61 61 VAL N N 15 117.470 . . 1 . . . A 60 VAL N . 18657 1 806 . 1 1 62 62 LYS H H 1 9.069 . . 1 . . . A 61 LYS H . 18657 1 807 . 1 1 62 62 LYS HA H 1 4.122 . . 1 . . . A 61 LYS HA . 18657 1 808 . 1 1 62 62 LYS HB2 H 1 1.806 . . 2 . . . A 61 LYS HB2 . 18657 1 809 . 1 1 62 62 LYS HB3 H 1 1.806 . . 2 . . . A 61 LYS HB3 . 18657 1 810 . 1 1 62 62 LYS HG2 H 1 1.283 . . 2 . . . A 61 LYS HG2 . 18657 1 811 . 1 1 62 62 LYS HG3 H 1 1.434 . . 2 . . . A 61 LYS HG3 . 18657 1 812 . 1 1 62 62 LYS HD2 H 1 1.575 . . 2 . . . A 61 LYS HD2 . 18657 1 813 . 1 1 62 62 LYS HD3 H 1 1.699 . . 2 . . . A 61 LYS HD3 . 18657 1 814 . 1 1 62 62 LYS HE2 H 1 2.855 . . 2 . . . A 61 LYS HE2 . 18657 1 815 . 1 1 62 62 LYS HE3 H 1 2.938 . . 2 . . . A 61 LYS HE3 . 18657 1 816 . 1 1 62 62 LYS C C 13 177.652 . . 1 . . . A 61 LYS C . 18657 1 817 . 1 1 62 62 LYS CA C 13 58.146 . . 1 . . . A 61 LYS CA . 18657 1 818 . 1 1 62 62 LYS CB C 13 32.336 . . 1 . . . A 61 LYS CB . 18657 1 819 . 1 1 62 62 LYS CG C 13 25.646 . . 1 . . . A 61 LYS CG . 18657 1 820 . 1 1 62 62 LYS CD C 13 29.855 . . 1 . . . A 61 LYS CD . 18657 1 821 . 1 1 62 62 LYS CE C 13 42.200 . . 1 . . . A 61 LYS CE . 18657 1 822 . 1 1 62 62 LYS N N 15 128.839 . . 1 . . . A 61 LYS N . 18657 1 823 . 1 1 63 63 GLY H H 1 9.094 . . 1 . . . A 62 GLY H . 18657 1 824 . 1 1 63 63 GLY HA2 H 1 4.083 . . 2 . . . A 62 GLY HA2 . 18657 1 825 . 1 1 63 63 GLY HA3 H 1 3.692 . . 1 . . . A 62 GLY HA3 . 18657 1 826 . 1 1 63 63 GLY C C 13 174.621 . . 1 . . . A 62 GLY C . 18657 1 827 . 1 1 63 63 GLY CA C 13 45.506 . . 1 . . . A 62 GLY CA . 18657 1 828 . 1 1 63 63 GLY N N 15 113.363 . . 1 . . . A 62 GLY N . 18657 1 829 . 1 1 64 64 TYR H H 1 7.564 . . 1 . . . A 63 TYR H . 18657 1 830 . 1 1 64 64 TYR HA H 1 3.971 . . 1 . . . A 63 TYR HA . 18657 1 831 . 1 1 64 64 TYR HB2 H 1 2.705 . . 2 . . . A 63 TYR HB2 . 18657 1 832 . 1 1 64 64 TYR HB3 H 1 3.035 . . 2 . . . A 63 TYR HB3 . 18657 1 833 . 1 1 64 64 TYR HD1 H 1 6.838 . . 3 . . . A 63 TYR HD1 . 18657 1 834 . 1 1 64 64 TYR HD2 H 1 6.838 . . 3 . . . A 63 TYR HD2 . 18657 1 835 . 1 1 64 64 TYR HE1 H 1 6.511 . . 3 . . . A 63 TYR HE1 . 18657 1 836 . 1 1 64 64 TYR HE2 H 1 6.511 . . 3 . . . A 63 TYR HE2 . 18657 1 837 . 1 1 64 64 TYR C C 13 174.228 . . 1 . . . A 63 TYR C . 18657 1 838 . 1 1 64 64 TYR CA C 13 60.374 . . 1 . . . A 63 TYR CA . 18657 1 839 . 1 1 64 64 TYR CB C 13 39.040 . . 1 . . . A 63 TYR CB . 18657 1 840 . 1 1 64 64 TYR CD2 C 13 132.668 . . 3 . . . A 63 TYR CD2 . 18657 1 841 . 1 1 64 64 TYR CE2 C 13 117.288 . . 3 . . . A 63 TYR CE2 . 18657 1 842 . 1 1 64 64 TYR N N 15 120.959 . . 1 . . . A 63 TYR N . 18657 1 843 . 1 1 65 65 ALA H H 1 7.546 . . 1 . . . A 64 ALA H . 18657 1 844 . 1 1 65 65 ALA HA H 1 4.425 . . 1 . . . A 64 ALA HA . 18657 1 845 . 1 1 65 65 ALA HB1 H 1 1.191 . . 1 . . . A 64 ALA HB1 . 18657 1 846 . 1 1 65 65 ALA HB2 H 1 1.191 . . 1 . . . A 64 ALA HB2 . 18657 1 847 . 1 1 65 65 ALA HB3 H 1 1.191 . . 1 . . . A 64 ALA HB3 . 18657 1 848 . 1 1 65 65 ALA CA C 13 49.480 . . 1 . . . A 64 ALA CA . 18657 1 849 . 1 1 65 65 ALA CB C 13 19.620 . . 1 . . . A 64 ALA CB . 18657 1 850 . 1 1 65 65 ALA N N 15 129.533 . . 1 . . . A 64 ALA N . 18657 1 851 . 1 1 66 66 PRO HA H 1 4.250 . . 1 . . . A 65 PRO HA . 18657 1 852 . 1 1 66 66 PRO HB2 H 1 2.354 . . 2 . . . A 65 PRO HB2 . 18657 1 853 . 1 1 66 66 PRO HB3 H 1 1.910 . . 2 . . . A 65 PRO HB3 . 18657 1 854 . 1 1 66 66 PRO HG2 H 1 1.996 . . 2 . . . A 65 PRO HG2 . 18657 1 855 . 1 1 66 66 PRO HG3 H 1 1.996 . . 2 . . . A 65 PRO HG3 . 18657 1 856 . 1 1 66 66 PRO HD2 H 1 3.531 . . 2 . . . A 65 PRO HD2 . 18657 1 857 . 1 1 66 66 PRO HD3 H 1 3.583 . . 2 . . . A 65 PRO HD3 . 18657 1 858 . 1 1 66 66 PRO C C 13 175.380 . . 1 . . . A 65 PRO C . 18657 1 859 . 1 1 66 66 PRO CA C 13 62.712 . . 1 . . . A 65 PRO CA . 18657 1 860 . 1 1 66 66 PRO CB C 13 32.210 . . 1 . . . A 65 PRO CB . 18657 1 861 . 1 1 66 66 PRO CG C 13 27.312 . . 1 . . . A 65 PRO CG . 18657 1 862 . 1 1 66 66 PRO CD C 13 50.579 . . 1 . . . A 65 PRO CD . 18657 1 863 . 1 1 67 67 ALA H H 1 8.450 . . 1 . . . A 66 ALA H . 18657 1 864 . 1 1 67 67 ALA HA H 1 3.967 . . 1 . . . A 66 ALA HA . 18657 1 865 . 1 1 67 67 ALA HB1 H 1 1.274 . . 1 . . . A 66 ALA HB1 . 18657 1 866 . 1 1 67 67 ALA HB2 H 1 1.274 . . 1 . . . A 66 ALA HB2 . 18657 1 867 . 1 1 67 67 ALA HB3 H 1 1.274 . . 1 . . . A 66 ALA HB3 . 18657 1 868 . 1 1 67 67 ALA CA C 13 53.922 . . 1 . . . A 66 ALA CA . 18657 1 869 . 1 1 67 67 ALA CB C 13 19.707 . . 1 . . . A 66 ALA CB . 18657 1 870 . 1 1 67 67 ALA N N 15 130.797 . . 1 . . . A 66 ALA N . 18657 1 stop_ save_