data_10075 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10075 _Entry.Title ; The fourth FN3 domain of human sidekick-2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-12-25 _Entry.Accession_date 2006-12-27 _Entry.Last_release_date 2008-08-14 _Entry.Original_release_date 2008-08-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 T. Nagashima . . . 10075 2 F. Hayashi . . . 10075 3 S. Yokoyama . . . 10075 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10075 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10075 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 479 10075 '15N chemical shifts' 113 10075 '1H chemical shifts' 757 10075 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 . . 2008-08-14 2006-12-25 original author . 10075 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WFN 'BMRB Entry Tracking System' 10075 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10075 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'The fourth FN3 domain of human sidekick-2' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 T. Nagashima . . . 10075 1 2 F. Hayashi . . . 10075 1 3 S. Yokoyama . . . 10075 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10075 _Assembly.ID 1 _Assembly.Name 'sidekick 2' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10075 1 stop_ 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 'sidekick 2' 1 $entity_1 . . yes native no no . . . 10075 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1WFN . . . . . . 10075 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10075 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'FN3 domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGPQLVRTHEDVPGP VGHLSFSEILDTSLKVSWQE PGEKNGILTGYRISWEEYNR TNTRVTHYLPNVTLEYRVTG LTALTTYTIEVAAMTSKGQG QVSASTISSGVPPSGPSSG ; _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 119 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 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 1WFN . "The Fourth Fn3 Domain Of Human Sidekick-2" . . . . . 100.00 119 100.00 100.00 6.32e-78 . . . . 10075 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'FN3 domain' . 10075 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 . GLY . 10075 1 2 . SER . 10075 1 3 . SER . 10075 1 4 . GLY . 10075 1 5 . SER . 10075 1 6 . SER . 10075 1 7 . GLY . 10075 1 8 . PRO . 10075 1 9 . GLN . 10075 1 10 . LEU . 10075 1 11 . VAL . 10075 1 12 . ARG . 10075 1 13 . THR . 10075 1 14 . HIS . 10075 1 15 . GLU . 10075 1 16 . ASP . 10075 1 17 . VAL . 10075 1 18 . PRO . 10075 1 19 . GLY . 10075 1 20 . PRO . 10075 1 21 . VAL . 10075 1 22 . GLY . 10075 1 23 . HIS . 10075 1 24 . LEU . 10075 1 25 . SER . 10075 1 26 . PHE . 10075 1 27 . SER . 10075 1 28 . GLU . 10075 1 29 . ILE . 10075 1 30 . LEU . 10075 1 31 . ASP . 10075 1 32 . THR . 10075 1 33 . SER . 10075 1 34 . LEU . 10075 1 35 . LYS . 10075 1 36 . VAL . 10075 1 37 . SER . 10075 1 38 . TRP . 10075 1 39 . GLN . 10075 1 40 . GLU . 10075 1 41 . PRO . 10075 1 42 . GLY . 10075 1 43 . GLU . 10075 1 44 . LYS . 10075 1 45 . ASN . 10075 1 46 . GLY . 10075 1 47 . ILE . 10075 1 48 . LEU . 10075 1 49 . THR . 10075 1 50 . GLY . 10075 1 51 . TYR . 10075 1 52 . ARG . 10075 1 53 . ILE . 10075 1 54 . SER . 10075 1 55 . TRP . 10075 1 56 . GLU . 10075 1 57 . GLU . 10075 1 58 . TYR . 10075 1 59 . ASN . 10075 1 60 . ARG . 10075 1 61 . THR . 10075 1 62 . ASN . 10075 1 63 . THR . 10075 1 64 . ARG . 10075 1 65 . VAL . 10075 1 66 . THR . 10075 1 67 . HIS . 10075 1 68 . TYR . 10075 1 69 . LEU . 10075 1 70 . PRO . 10075 1 71 . ASN . 10075 1 72 . VAL . 10075 1 73 . THR . 10075 1 74 . LEU . 10075 1 75 . GLU . 10075 1 76 . TYR . 10075 1 77 . ARG . 10075 1 78 . VAL . 10075 1 79 . THR . 10075 1 80 . GLY . 10075 1 81 . LEU . 10075 1 82 . THR . 10075 1 83 . ALA . 10075 1 84 . LEU . 10075 1 85 . THR . 10075 1 86 . THR . 10075 1 87 . TYR . 10075 1 88 . THR . 10075 1 89 . ILE . 10075 1 90 . GLU . 10075 1 91 . VAL . 10075 1 92 . ALA . 10075 1 93 . ALA . 10075 1 94 . MET . 10075 1 95 . THR . 10075 1 96 . SER . 10075 1 97 . LYS . 10075 1 98 . GLY . 10075 1 99 . GLN . 10075 1 100 . GLY . 10075 1 101 . GLN . 10075 1 102 . VAL . 10075 1 103 . SER . 10075 1 104 . ALA . 10075 1 105 . SER . 10075 1 106 . THR . 10075 1 107 . ILE . 10075 1 108 . SER . 10075 1 109 . SER . 10075 1 110 . GLY . 10075 1 111 . VAL . 10075 1 112 . PRO . 10075 1 113 . PRO . 10075 1 114 . SER . 10075 1 115 . GLY . 10075 1 116 . PRO . 10075 1 117 . SER . 10075 1 118 . SER . 10075 1 119 . GLY . 10075 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 10075 1 . SER 2 2 10075 1 . SER 3 3 10075 1 . GLY 4 4 10075 1 . SER 5 5 10075 1 . SER 6 6 10075 1 . GLY 7 7 10075 1 . PRO 8 8 10075 1 . GLN 9 9 10075 1 . LEU 10 10 10075 1 . VAL 11 11 10075 1 . ARG 12 12 10075 1 . THR 13 13 10075 1 . HIS 14 14 10075 1 . GLU 15 15 10075 1 . ASP 16 16 10075 1 . VAL 17 17 10075 1 . PRO 18 18 10075 1 . GLY 19 19 10075 1 . PRO 20 20 10075 1 . VAL 21 21 10075 1 . GLY 22 22 10075 1 . HIS 23 23 10075 1 . LEU 24 24 10075 1 . SER 25 25 10075 1 . PHE 26 26 10075 1 . SER 27 27 10075 1 . GLU 28 28 10075 1 . ILE 29 29 10075 1 . LEU 30 30 10075 1 . ASP 31 31 10075 1 . THR 32 32 10075 1 . SER 33 33 10075 1 . LEU 34 34 10075 1 . LYS 35 35 10075 1 . VAL 36 36 10075 1 . SER 37 37 10075 1 . TRP 38 38 10075 1 . GLN 39 39 10075 1 . GLU 40 40 10075 1 . PRO 41 41 10075 1 . GLY 42 42 10075 1 . GLU 43 43 10075 1 . LYS 44 44 10075 1 . ASN 45 45 10075 1 . GLY 46 46 10075 1 . ILE 47 47 10075 1 . LEU 48 48 10075 1 . THR 49 49 10075 1 . GLY 50 50 10075 1 . TYR 51 51 10075 1 . ARG 52 52 10075 1 . ILE 53 53 10075 1 . SER 54 54 10075 1 . TRP 55 55 10075 1 . GLU 56 56 10075 1 . GLU 57 57 10075 1 . TYR 58 58 10075 1 . ASN 59 59 10075 1 . ARG 60 60 10075 1 . THR 61 61 10075 1 . ASN 62 62 10075 1 . THR 63 63 10075 1 . ARG 64 64 10075 1 . VAL 65 65 10075 1 . THR 66 66 10075 1 . HIS 67 67 10075 1 . TYR 68 68 10075 1 . LEU 69 69 10075 1 . PRO 70 70 10075 1 . ASN 71 71 10075 1 . VAL 72 72 10075 1 . THR 73 73 10075 1 . LEU 74 74 10075 1 . GLU 75 75 10075 1 . TYR 76 76 10075 1 . ARG 77 77 10075 1 . VAL 78 78 10075 1 . THR 79 79 10075 1 . GLY 80 80 10075 1 . LEU 81 81 10075 1 . THR 82 82 10075 1 . ALA 83 83 10075 1 . LEU 84 84 10075 1 . THR 85 85 10075 1 . THR 86 86 10075 1 . TYR 87 87 10075 1 . THR 88 88 10075 1 . ILE 89 89 10075 1 . GLU 90 90 10075 1 . VAL 91 91 10075 1 . ALA 92 92 10075 1 . ALA 93 93 10075 1 . MET 94 94 10075 1 . THR 95 95 10075 1 . SER 96 96 10075 1 . LYS 97 97 10075 1 . GLY 98 98 10075 1 . GLN 99 99 10075 1 . GLY 100 100 10075 1 . GLN 101 101 10075 1 . VAL 102 102 10075 1 . SER 103 103 10075 1 . ALA 104 104 10075 1 . SER 105 105 10075 1 . THR 106 106 10075 1 . ILE 107 107 10075 1 . SER 108 108 10075 1 . SER 109 109 10075 1 . GLY 110 110 10075 1 . VAL 111 111 10075 1 . PRO 112 112 10075 1 . PRO 113 113 10075 1 . SER 114 114 10075 1 . GLY 115 115 10075 1 . PRO 116 116 10075 1 . SER 117 117 10075 1 . SER 118 118 10075 1 . GLY 119 119 10075 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 10075 _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 $entity_1 . 9606 . . . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 10075 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 10075 _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 $entity_1 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P040223-46 . . . . . . 10075 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10075 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'FN3 domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.21 . . mM . . . . 10075 1 2 d-TRIS . . . . . . buffer 20 . . mM . . . . 10075 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10075 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10075 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10075 1 6 H2O . . . . . . solvent 90 . . % . . . . 10075 1 7 D2O . . . . . . solvent 10 . . % . . . . 10075 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10075 _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' 120 0.1 mM 10075 1 pH 7.0 0.05 pH 10075 1 pressure 1 0.001 atm 10075 1 temperature 298 0.1 K 10075 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10075 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 10075 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10075 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10075 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10075 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10075 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10075 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 10075 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10075 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10075 _Software.ID 4 _Software.Name Kujira _Software.Version 0.8992 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10075 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10075 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10075 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10075 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10075 5 'structure solution' 10075 5 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 10075 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 10075 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10075 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10075 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10075 1 stop_ save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10075 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10075 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10075 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 0.0 . indirect 0.251449530 . . . . . . . . . 10075 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10075 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10075 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10075 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10075 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10075 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 8 8 PRO HA H 1 4.421 0.030 . 1 . . . . 8 PRO HA . 10075 1 2 . 1 1 8 8 PRO HB2 H 1 2.271 0.030 . 2 . . . . 8 PRO HB2 . 10075 1 3 . 1 1 8 8 PRO HB3 H 1 1.894 0.030 . 2 . . . . 8 PRO HB3 . 10075 1 4 . 1 1 8 8 PRO HG2 H 1 2.014 0.030 . 1 . . . . 8 PRO HG2 . 10075 1 5 . 1 1 8 8 PRO HG3 H 1 2.014 0.030 . 1 . . . . 8 PRO HG3 . 10075 1 6 . 1 1 8 8 PRO HD2 H 1 3.631 0.030 . 1 . . . . 8 PRO HD2 . 10075 1 7 . 1 1 8 8 PRO HD3 H 1 3.631 0.030 . 1 . . . . 8 PRO HD3 . 10075 1 8 . 1 1 8 8 PRO C C 13 177.012 0.300 . 1 . . . . 8 PRO C . 10075 1 9 . 1 1 8 8 PRO CA C 13 63.212 0.300 . 1 . . . . 8 PRO CA . 10075 1 10 . 1 1 8 8 PRO CB C 13 32.168 0.300 . 1 . . . . 8 PRO CB . 10075 1 11 . 1 1 8 8 PRO CG C 13 27.250 0.300 . 1 . . . . 8 PRO CG . 10075 1 12 . 1 1 8 8 PRO CD C 13 49.857 0.300 . 1 . . . . 8 PRO CD . 10075 1 13 . 1 1 9 9 GLN H H 1 8.495 0.030 . 1 . . . . 9 GLN H . 10075 1 14 . 1 1 9 9 GLN HA H 1 4.307 0.030 . 1 . . . . 9 GLN HA . 10075 1 15 . 1 1 9 9 GLN HB2 H 1 2.074 0.030 . 2 . . . . 9 GLN HB2 . 10075 1 16 . 1 1 9 9 GLN HB3 H 1 1.961 0.030 . 2 . . . . 9 GLN HB3 . 10075 1 17 . 1 1 9 9 GLN HG2 H 1 2.373 0.030 . 1 . . . . 9 GLN HG2 . 10075 1 18 . 1 1 9 9 GLN HG3 H 1 2.373 0.030 . 1 . . . . 9 GLN HG3 . 10075 1 19 . 1 1 9 9 GLN HE21 H 1 7.500 0.030 . 2 . . . . 9 GLN HE21 . 10075 1 20 . 1 1 9 9 GLN HE22 H 1 6.867 0.030 . 2 . . . . 9 GLN HE22 . 10075 1 21 . 1 1 9 9 GLN C C 13 175.794 0.300 . 1 . . . . 9 GLN C . 10075 1 22 . 1 1 9 9 GLN CA C 13 55.648 0.300 . 1 . . . . 9 GLN CA . 10075 1 23 . 1 1 9 9 GLN CB C 13 29.451 0.300 . 1 . . . . 9 GLN CB . 10075 1 24 . 1 1 9 9 GLN CG C 13 33.814 0.300 . 1 . . . . 9 GLN CG . 10075 1 25 . 1 1 9 9 GLN N N 15 120.704 0.300 . 1 . . . . 9 GLN N . 10075 1 26 . 1 1 9 9 GLN NE2 N 15 112.915 0.300 . 1 . . . . 9 GLN NE2 . 10075 1 27 . 1 1 10 10 LEU H H 1 8.268 0.030 . 1 . . . . 10 LEU H . 10075 1 28 . 1 1 10 10 LEU HA H 1 4.363 0.030 . 1 . . . . 10 LEU HA . 10075 1 29 . 1 1 10 10 LEU HB2 H 1 1.615 0.030 . 2 . . . . 10 LEU HB2 . 10075 1 30 . 1 1 10 10 LEU HB3 H 1 1.564 0.030 . 2 . . . . 10 LEU HB3 . 10075 1 31 . 1 1 10 10 LEU HG H 1 1.572 0.030 . 1 . . . . 10 LEU HG . 10075 1 32 . 1 1 10 10 LEU HD11 H 1 0.909 0.030 . 1 . . . . 10 LEU HD1 . 10075 1 33 . 1 1 10 10 LEU HD12 H 1 0.909 0.030 . 1 . . . . 10 LEU HD1 . 10075 1 34 . 1 1 10 10 LEU HD13 H 1 0.909 0.030 . 1 . . . . 10 LEU HD1 . 10075 1 35 . 1 1 10 10 LEU HD21 H 1 0.855 0.030 . 1 . . . . 10 LEU HD2 . 10075 1 36 . 1 1 10 10 LEU HD22 H 1 0.855 0.030 . 1 . . . . 10 LEU HD2 . 10075 1 37 . 1 1 10 10 LEU HD23 H 1 0.855 0.030 . 1 . . . . 10 LEU HD2 . 10075 1 38 . 1 1 10 10 LEU C C 13 177.013 0.300 . 1 . . . . 10 LEU C . 10075 1 39 . 1 1 10 10 LEU CA C 13 55.220 0.300 . 1 . . . . 10 LEU CA . 10075 1 40 . 1 1 10 10 LEU CB C 13 42.405 0.300 . 1 . . . . 10 LEU CB . 10075 1 41 . 1 1 10 10 LEU CG C 13 27.030 0.300 . 1 . . . . 10 LEU CG . 10075 1 42 . 1 1 10 10 LEU CD1 C 13 24.840 0.300 . 2 . . . . 10 LEU CD1 . 10075 1 43 . 1 1 10 10 LEU CD2 C 13 23.668 0.300 . 2 . . . . 10 LEU CD2 . 10075 1 44 . 1 1 10 10 LEU N N 15 124.171 0.300 . 1 . . . . 10 LEU N . 10075 1 45 . 1 1 11 11 VAL H H 1 8.149 0.030 . 1 . . . . 11 VAL H . 10075 1 46 . 1 1 11 11 VAL HA H 1 4.091 0.030 . 1 . . . . 11 VAL HA . 10075 1 47 . 1 1 11 11 VAL HB H 1 2.018 0.030 . 1 . . . . 11 VAL HB . 10075 1 48 . 1 1 11 11 VAL HG11 H 1 0.897 0.030 . 1 . . . . 11 VAL HG1 . 10075 1 49 . 1 1 11 11 VAL HG12 H 1 0.897 0.030 . 1 . . . . 11 VAL HG1 . 10075 1 50 . 1 1 11 11 VAL HG13 H 1 0.897 0.030 . 1 . . . . 11 VAL HG1 . 10075 1 51 . 1 1 11 11 VAL HG21 H 1 0.925 0.030 . 1 . . . . 11 VAL HG2 . 10075 1 52 . 1 1 11 11 VAL HG22 H 1 0.925 0.030 . 1 . . . . 11 VAL HG2 . 10075 1 53 . 1 1 11 11 VAL HG23 H 1 0.925 0.030 . 1 . . . . 11 VAL HG2 . 10075 1 54 . 1 1 11 11 VAL C C 13 175.867 0.300 . 1 . . . . 11 VAL C . 10075 1 55 . 1 1 11 11 VAL CA C 13 62.248 0.300 . 1 . . . . 11 VAL CA . 10075 1 56 . 1 1 11 11 VAL CB C 13 32.834 0.300 . 1 . . . . 11 VAL CB . 10075 1 57 . 1 1 11 11 VAL CG1 C 13 21.163 0.300 . 2 . . . . 11 VAL CG1 . 10075 1 58 . 1 1 11 11 VAL CG2 C 13 20.700 0.300 . 2 . . . . 11 VAL CG2 . 10075 1 59 . 1 1 11 11 VAL N N 15 122.017 0.300 . 1 . . . . 11 VAL N . 10075 1 60 . 1 1 12 12 ARG H H 1 8.482 0.030 . 1 . . . . 12 ARG H . 10075 1 61 . 1 1 12 12 ARG HA H 1 4.442 0.030 . 1 . . . . 12 ARG HA . 10075 1 62 . 1 1 12 12 ARG HB2 H 1 1.816 0.030 . 2 . . . . 12 ARG HB2 . 10075 1 63 . 1 1 12 12 ARG HB3 H 1 1.728 0.030 . 2 . . . . 12 ARG HB3 . 10075 1 64 . 1 1 12 12 ARG HG2 H 1 1.611 0.030 . 2 . . . . 12 ARG HG2 . 10075 1 65 . 1 1 12 12 ARG HG3 H 1 1.567 0.030 . 2 . . . . 12 ARG HG3 . 10075 1 66 . 1 1 12 12 ARG HD2 H 1 3.185 0.030 . 1 . . . . 12 ARG HD2 . 10075 1 67 . 1 1 12 12 ARG HD3 H 1 3.185 0.030 . 1 . . . . 12 ARG HD3 . 10075 1 68 . 1 1 12 12 ARG C C 13 176.250 0.300 . 1 . . . . 12 ARG C . 10075 1 69 . 1 1 12 12 ARG CA C 13 55.812 0.300 . 1 . . . . 12 ARG CA . 10075 1 70 . 1 1 12 12 ARG CB C 13 31.012 0.300 . 1 . . . . 12 ARG CB . 10075 1 71 . 1 1 12 12 ARG CG C 13 27.194 0.300 . 1 . . . . 12 ARG CG . 10075 1 72 . 1 1 12 12 ARG CD C 13 43.387 0.300 . 1 . . . . 12 ARG CD . 10075 1 73 . 1 1 12 12 ARG N N 15 125.694 0.300 . 1 . . . . 12 ARG N . 10075 1 74 . 1 1 13 13 THR H H 1 8.269 0.030 . 1 . . . . 13 THR H . 10075 1 75 . 1 1 13 13 THR HA H 1 4.294 0.030 . 1 . . . . 13 THR HA . 10075 1 76 . 1 1 13 13 THR HB H 1 4.178 0.030 . 1 . . . . 13 THR HB . 10075 1 77 . 1 1 13 13 THR HG21 H 1 1.141 0.030 . 1 . . . . 13 THR HG2 . 10075 1 78 . 1 1 13 13 THR HG22 H 1 1.141 0.030 . 1 . . . . 13 THR HG2 . 10075 1 79 . 1 1 13 13 THR HG23 H 1 1.141 0.030 . 1 . . . . 13 THR HG2 . 10075 1 80 . 1 1 13 13 THR C C 13 174.197 0.300 . 1 . . . . 13 THR C . 10075 1 81 . 1 1 13 13 THR CA C 13 61.872 0.300 . 1 . . . . 13 THR CA . 10075 1 82 . 1 1 13 13 THR CB C 13 69.838 0.300 . 1 . . . . 13 THR CB . 10075 1 83 . 1 1 13 13 THR CG2 C 13 21.638 0.300 . 1 . . . . 13 THR CG2 . 10075 1 84 . 1 1 13 13 THR N N 15 115.664 0.300 . 1 . . . . 13 THR N . 10075 1 85 . 1 1 14 14 HIS H H 1 8.286 0.030 . 1 . . . . 14 HIS H . 10075 1 86 . 1 1 14 14 HIS HA H 1 4.620 0.030 . 1 . . . . 14 HIS HA . 10075 1 87 . 1 1 14 14 HIS HB2 H 1 3.122 0.030 . 2 . . . . 14 HIS HB2 . 10075 1 88 . 1 1 14 14 HIS HB3 H 1 3.052 0.030 . 2 . . . . 14 HIS HB3 . 10075 1 89 . 1 1 14 14 HIS HD2 H 1 7.000 0.030 . 1 . . . . 14 HIS HD2 . 10075 1 90 . 1 1 14 14 HIS C C 13 175.010 0.300 . 1 . . . . 14 HIS C . 10075 1 91 . 1 1 14 14 HIS CA C 13 56.351 0.300 . 1 . . . . 14 HIS CA . 10075 1 92 . 1 1 14 14 HIS CB C 13 30.926 0.300 . 1 . . . . 14 HIS CB . 10075 1 93 . 1 1 14 14 HIS CD2 C 13 120.064 0.300 . 1 . . . . 14 HIS CD2 . 10075 1 94 . 1 1 14 14 HIS N N 15 121.055 0.300 . 1 . . . . 14 HIS N . 10075 1 95 . 1 1 15 15 GLU H H 1 8.282 0.030 . 1 . . . . 15 GLU H . 10075 1 96 . 1 1 15 15 GLU HA H 1 4.350 0.030 . 1 . . . . 15 GLU HA . 10075 1 97 . 1 1 15 15 GLU HB2 H 1 2.054 0.030 . 2 . . . . 15 GLU HB2 . 10075 1 98 . 1 1 15 15 GLU HB3 H 1 1.845 0.030 . 2 . . . . 15 GLU HB3 . 10075 1 99 . 1 1 15 15 GLU HG2 H 1 2.243 0.030 . 2 . . . . 15 GLU HG2 . 10075 1 100 . 1 1 15 15 GLU HG3 H 1 2.190 0.030 . 2 . . . . 15 GLU HG3 . 10075 1 101 . 1 1 15 15 GLU C C 13 175.573 0.300 . 1 . . . . 15 GLU C . 10075 1 102 . 1 1 15 15 GLU CA C 13 56.415 0.300 . 1 . . . . 15 GLU CA . 10075 1 103 . 1 1 15 15 GLU CB C 13 31.059 0.300 . 1 . . . . 15 GLU CB . 10075 1 104 . 1 1 15 15 GLU CG C 13 36.699 0.300 . 1 . . . . 15 GLU CG . 10075 1 105 . 1 1 15 15 GLU N N 15 121.513 0.300 . 1 . . . . 15 GLU N . 10075 1 106 . 1 1 16 16 ASP H H 1 8.624 0.030 . 1 . . . . 16 ASP H . 10075 1 107 . 1 1 16 16 ASP HA H 1 4.728 0.030 . 1 . . . . 16 ASP HA . 10075 1 108 . 1 1 16 16 ASP HB2 H 1 2.684 0.030 . 2 . . . . 16 ASP HB2 . 10075 1 109 . 1 1 16 16 ASP HB3 H 1 2.594 0.030 . 2 . . . . 16 ASP HB3 . 10075 1 110 . 1 1 16 16 ASP C C 13 175.192 0.300 . 1 . . . . 16 ASP C . 10075 1 111 . 1 1 16 16 ASP CA C 13 53.727 0.300 . 1 . . . . 16 ASP CA . 10075 1 112 . 1 1 16 16 ASP CB C 13 42.174 0.300 . 1 . . . . 16 ASP CB . 10075 1 113 . 1 1 16 16 ASP N N 15 120.827 0.300 . 1 . . . . 16 ASP N . 10075 1 114 . 1 1 17 17 VAL H H 1 8.002 0.030 . 1 . . . . 17 VAL H . 10075 1 115 . 1 1 17 17 VAL HA H 1 4.581 0.030 . 1 . . . . 17 VAL HA . 10075 1 116 . 1 1 17 17 VAL HB H 1 1.893 0.030 . 1 . . . . 17 VAL HB . 10075 1 117 . 1 1 17 17 VAL HG11 H 1 0.658 0.030 . 1 . . . . 17 VAL HG1 . 10075 1 118 . 1 1 17 17 VAL HG12 H 1 0.658 0.030 . 1 . . . . 17 VAL HG1 . 10075 1 119 . 1 1 17 17 VAL HG13 H 1 0.658 0.030 . 1 . . . . 17 VAL HG1 . 10075 1 120 . 1 1 17 17 VAL HG21 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 10075 1 121 . 1 1 17 17 VAL HG22 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 10075 1 122 . 1 1 17 17 VAL HG23 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 10075 1 123 . 1 1 17 17 VAL C C 13 174.024 0.300 . 1 . . . . 17 VAL C . 10075 1 124 . 1 1 17 17 VAL CA C 13 58.891 0.300 . 1 . . . . 17 VAL CA . 10075 1 125 . 1 1 17 17 VAL CB C 13 32.109 0.300 . 1 . . . . 17 VAL CB . 10075 1 126 . 1 1 17 17 VAL CG1 C 13 21.653 0.300 . 2 . . . . 17 VAL CG1 . 10075 1 127 . 1 1 17 17 VAL CG2 C 13 18.087 0.300 . 2 . . . . 17 VAL CG2 . 10075 1 128 . 1 1 17 17 VAL N N 15 113.973 0.300 . 1 . . . . 17 VAL N . 10075 1 129 . 1 1 18 18 PRO HA H 1 4.427 0.030 . 1 . . . . 18 PRO HA . 10075 1 130 . 1 1 18 18 PRO HB2 H 1 2.379 0.030 . 2 . . . . 18 PRO HB2 . 10075 1 131 . 1 1 18 18 PRO HB3 H 1 2.116 0.030 . 2 . . . . 18 PRO HB3 . 10075 1 132 . 1 1 18 18 PRO HG2 H 1 2.037 0.030 . 2 . . . . 18 PRO HG2 . 10075 1 133 . 1 1 18 18 PRO HG3 H 1 1.625 0.030 . 2 . . . . 18 PRO HG3 . 10075 1 134 . 1 1 18 18 PRO HD2 H 1 3.872 0.030 . 2 . . . . 18 PRO HD2 . 10075 1 135 . 1 1 18 18 PRO HD3 H 1 3.360 0.030 . 2 . . . . 18 PRO HD3 . 10075 1 136 . 1 1 18 18 PRO C C 13 177.055 0.300 . 1 . . . . 18 PRO C . 10075 1 137 . 1 1 18 18 PRO CA C 13 63.655 0.300 . 1 . . . . 18 PRO CA . 10075 1 138 . 1 1 18 18 PRO CB C 13 33.427 0.300 . 1 . . . . 18 PRO CB . 10075 1 139 . 1 1 18 18 PRO CG C 13 27.543 0.300 . 1 . . . . 18 PRO CG . 10075 1 140 . 1 1 18 18 PRO CD C 13 50.385 0.300 . 1 . . . . 18 PRO CD . 10075 1 141 . 1 1 19 19 GLY H H 1 8.647 0.030 . 1 . . . . 19 GLY H . 10075 1 142 . 1 1 19 19 GLY HA2 H 1 4.265 0.030 . 2 . . . . 19 GLY HA2 . 10075 1 143 . 1 1 19 19 GLY HA3 H 1 4.087 0.030 . 2 . . . . 19 GLY HA3 . 10075 1 144 . 1 1 19 19 GLY CA C 13 44.818 0.300 . 1 . . . . 19 GLY CA . 10075 1 145 . 1 1 19 19 GLY N N 15 106.192 0.300 . 1 . . . . 19 GLY N . 10075 1 146 . 1 1 20 20 PRO HA H 1 4.549 0.030 . 1 . . . . 20 PRO HA . 10075 1 147 . 1 1 20 20 PRO HB2 H 1 2.053 0.030 . 2 . . . . 20 PRO HB2 . 10075 1 148 . 1 1 20 20 PRO HB3 H 1 1.959 0.030 . 2 . . . . 20 PRO HB3 . 10075 1 149 . 1 1 20 20 PRO HG2 H 1 2.028 0.030 . 1 . . . . 20 PRO HG2 . 10075 1 150 . 1 1 20 20 PRO HG3 H 1 2.028 0.030 . 1 . . . . 20 PRO HG3 . 10075 1 151 . 1 1 20 20 PRO HD2 H 1 3.722 0.030 . 2 . . . . 20 PRO HD2 . 10075 1 152 . 1 1 20 20 PRO HD3 H 1 3.455 0.030 . 2 . . . . 20 PRO HD3 . 10075 1 153 . 1 1 20 20 PRO C C 13 178.544 0.300 . 1 . . . . 20 PRO C . 10075 1 154 . 1 1 20 20 PRO CA C 13 62.273 0.300 . 1 . . . . 20 PRO CA . 10075 1 155 . 1 1 20 20 PRO CB C 13 32.209 0.300 . 1 . . . . 20 PRO CB . 10075 1 156 . 1 1 20 20 PRO CG C 13 27.112 0.300 . 1 . . . . 20 PRO CG . 10075 1 157 . 1 1 20 20 PRO CD C 13 49.065 0.300 . 1 . . . . 20 PRO CD . 10075 1 158 . 1 1 21 21 VAL H H 1 8.712 0.030 . 1 . . . . 21 VAL H . 10075 1 159 . 1 1 21 21 VAL HA H 1 4.081 0.030 . 1 . . . . 21 VAL HA . 10075 1 160 . 1 1 21 21 VAL HB H 1 2.951 0.030 . 1 . . . . 21 VAL HB . 10075 1 161 . 1 1 21 21 VAL HG11 H 1 1.040 0.030 . 1 . . . . 21 VAL HG1 . 10075 1 162 . 1 1 21 21 VAL HG12 H 1 1.040 0.030 . 1 . . . . 21 VAL HG1 . 10075 1 163 . 1 1 21 21 VAL HG13 H 1 1.040 0.030 . 1 . . . . 21 VAL HG1 . 10075 1 164 . 1 1 21 21 VAL HG21 H 1 0.654 0.030 . 1 . . . . 21 VAL HG2 . 10075 1 165 . 1 1 21 21 VAL HG22 H 1 0.654 0.030 . 1 . . . . 21 VAL HG2 . 10075 1 166 . 1 1 21 21 VAL HG23 H 1 0.654 0.030 . 1 . . . . 21 VAL HG2 . 10075 1 167 . 1 1 21 21 VAL C C 13 176.017 0.300 . 1 . . . . 21 VAL C . 10075 1 168 . 1 1 21 21 VAL CA C 13 62.291 0.300 . 1 . . . . 21 VAL CA . 10075 1 169 . 1 1 21 21 VAL CB C 13 31.161 0.300 . 1 . . . . 21 VAL CB . 10075 1 170 . 1 1 21 21 VAL CG1 C 13 22.609 0.300 . 2 . . . . 21 VAL CG1 . 10075 1 171 . 1 1 21 21 VAL CG2 C 13 17.582 0.300 . 2 . . . . 21 VAL CG2 . 10075 1 172 . 1 1 21 21 VAL N N 15 113.303 0.300 . 1 . . . . 21 VAL N . 10075 1 173 . 1 1 22 22 GLY H H 1 7.906 0.030 . 1 . . . . 22 GLY H . 10075 1 174 . 1 1 22 22 GLY HA2 H 1 4.049 0.030 . 2 . . . . 22 GLY HA2 . 10075 1 175 . 1 1 22 22 GLY HA3 H 1 3.927 0.030 . 2 . . . . 22 GLY HA3 . 10075 1 176 . 1 1 22 22 GLY C C 13 173.110 0.300 . 1 . . . . 22 GLY C . 10075 1 177 . 1 1 22 22 GLY CA C 13 44.683 0.300 . 1 . . . . 22 GLY CA . 10075 1 178 . 1 1 22 22 GLY N N 15 108.218 0.300 . 1 . . . . 22 GLY N . 10075 1 179 . 1 1 23 23 HIS H H 1 8.432 0.030 . 1 . . . . 23 HIS H . 10075 1 180 . 1 1 23 23 HIS HA H 1 4.200 0.030 . 1 . . . . 23 HIS HA . 10075 1 181 . 1 1 23 23 HIS HB2 H 1 3.067 0.030 . 2 . . . . 23 HIS HB2 . 10075 1 182 . 1 1 23 23 HIS HB3 H 1 2.875 0.030 . 2 . . . . 23 HIS HB3 . 10075 1 183 . 1 1 23 23 HIS HD2 H 1 6.933 0.030 . 1 . . . . 23 HIS HD2 . 10075 1 184 . 1 1 23 23 HIS C C 13 175.002 0.300 . 1 . . . . 23 HIS C . 10075 1 185 . 1 1 23 23 HIS CA C 13 56.745 0.300 . 1 . . . . 23 HIS CA . 10075 1 186 . 1 1 23 23 HIS CB C 13 29.885 0.300 . 1 . . . . 23 HIS CB . 10075 1 187 . 1 1 23 23 HIS CD2 C 13 119.966 0.300 . 1 . . . . 23 HIS CD2 . 10075 1 188 . 1 1 23 23 HIS N N 15 118.279 0.300 . 1 . . . . 23 HIS N . 10075 1 189 . 1 1 24 24 LEU H H 1 8.172 0.030 . 1 . . . . 24 LEU H . 10075 1 190 . 1 1 24 24 LEU HA H 1 4.651 0.030 . 1 . . . . 24 LEU HA . 10075 1 191 . 1 1 24 24 LEU HB2 H 1 1.299 0.030 . 2 . . . . 24 LEU HB2 . 10075 1 192 . 1 1 24 24 LEU HB3 H 1 1.250 0.030 . 2 . . . . 24 LEU HB3 . 10075 1 193 . 1 1 24 24 LEU HG H 1 1.415 0.030 . 1 . . . . 24 LEU HG . 10075 1 194 . 1 1 24 24 LEU HD11 H 1 0.764 0.030 . 1 . . . . 24 LEU HD1 . 10075 1 195 . 1 1 24 24 LEU HD12 H 1 0.764 0.030 . 1 . . . . 24 LEU HD1 . 10075 1 196 . 1 1 24 24 LEU HD13 H 1 0.764 0.030 . 1 . . . . 24 LEU HD1 . 10075 1 197 . 1 1 24 24 LEU HD21 H 1 0.685 0.030 . 1 . . . . 24 LEU HD2 . 10075 1 198 . 1 1 24 24 LEU HD22 H 1 0.685 0.030 . 1 . . . . 24 LEU HD2 . 10075 1 199 . 1 1 24 24 LEU HD23 H 1 0.685 0.030 . 1 . . . . 24 LEU HD2 . 10075 1 200 . 1 1 24 24 LEU C C 13 176.677 0.300 . 1 . . . . 24 LEU C . 10075 1 201 . 1 1 24 24 LEU CA C 13 55.498 0.300 . 1 . . . . 24 LEU CA . 10075 1 202 . 1 1 24 24 LEU CB C 13 42.347 0.300 . 1 . . . . 24 LEU CB . 10075 1 203 . 1 1 24 24 LEU CG C 13 26.936 0.300 . 1 . . . . 24 LEU CG . 10075 1 204 . 1 1 24 24 LEU CD1 C 13 25.241 0.300 . 2 . . . . 24 LEU CD1 . 10075 1 205 . 1 1 24 24 LEU CD2 C 13 24.611 0.300 . 2 . . . . 24 LEU CD2 . 10075 1 206 . 1 1 24 24 LEU N N 15 123.982 0.300 . 1 . . . . 24 LEU N . 10075 1 207 . 1 1 25 25 SER H H 1 8.838 0.030 . 1 . . . . 25 SER H . 10075 1 208 . 1 1 25 25 SER HA H 1 4.625 0.030 . 1 . . . . 25 SER HA . 10075 1 209 . 1 1 25 25 SER HB2 H 1 3.649 0.030 . 2 . . . . 25 SER HB2 . 10075 1 210 . 1 1 25 25 SER HB3 H 1 3.597 0.030 . 2 . . . . 25 SER HB3 . 10075 1 211 . 1 1 25 25 SER C C 13 172.077 0.300 . 1 . . . . 25 SER C . 10075 1 212 . 1 1 25 25 SER CA C 13 57.305 0.300 . 1 . . . . 25 SER CA . 10075 1 213 . 1 1 25 25 SER CB C 13 65.544 0.300 . 1 . . . . 25 SER CB . 10075 1 214 . 1 1 25 25 SER N N 15 120.340 0.300 . 1 . . . . 25 SER N . 10075 1 215 . 1 1 26 26 PHE H H 1 8.646 0.030 . 1 . . . . 26 PHE H . 10075 1 216 . 1 1 26 26 PHE HA H 1 5.812 0.030 . 1 . . . . 26 PHE HA . 10075 1 217 . 1 1 26 26 PHE HB2 H 1 2.967 0.030 . 2 . . . . 26 PHE HB2 . 10075 1 218 . 1 1 26 26 PHE HB3 H 1 2.915 0.030 . 2 . . . . 26 PHE HB3 . 10075 1 219 . 1 1 26 26 PHE HD1 H 1 7.273 0.030 . 1 . . . . 26 PHE HD1 . 10075 1 220 . 1 1 26 26 PHE HD2 H 1 7.273 0.030 . 1 . . . . 26 PHE HD2 . 10075 1 221 . 1 1 26 26 PHE HE1 H 1 7.190 0.030 . 1 . . . . 26 PHE HE1 . 10075 1 222 . 1 1 26 26 PHE HE2 H 1 7.190 0.030 . 1 . . . . 26 PHE HE2 . 10075 1 223 . 1 1 26 26 PHE HZ H 1 6.958 0.030 . 1 . . . . 26 PHE HZ . 10075 1 224 . 1 1 26 26 PHE C C 13 175.352 0.300 . 1 . . . . 26 PHE C . 10075 1 225 . 1 1 26 26 PHE CA C 13 55.956 0.300 . 1 . . . . 26 PHE CA . 10075 1 226 . 1 1 26 26 PHE CB C 13 42.272 0.300 . 1 . . . . 26 PHE CB . 10075 1 227 . 1 1 26 26 PHE CD1 C 13 132.162 0.300 . 1 . . . . 26 PHE CD1 . 10075 1 228 . 1 1 26 26 PHE CD2 C 13 132.162 0.300 . 1 . . . . 26 PHE CD2 . 10075 1 229 . 1 1 26 26 PHE CE1 C 13 130.790 0.300 . 1 . . . . 26 PHE CE1 . 10075 1 230 . 1 1 26 26 PHE CE2 C 13 130.790 0.300 . 1 . . . . 26 PHE CE2 . 10075 1 231 . 1 1 26 26 PHE CZ C 13 128.415 0.300 . 1 . . . . 26 PHE CZ . 10075 1 232 . 1 1 26 26 PHE N N 15 122.044 0.300 . 1 . . . . 26 PHE N . 10075 1 233 . 1 1 27 27 SER H H 1 9.395 0.030 . 1 . . . . 27 SER H . 10075 1 234 . 1 1 27 27 SER HA H 1 4.717 0.030 . 1 . . . . 27 SER HA . 10075 1 235 . 1 1 27 27 SER HB2 H 1 3.963 0.030 . 2 . . . . 27 SER HB2 . 10075 1 236 . 1 1 27 27 SER HB3 H 1 3.919 0.030 . 2 . . . . 27 SER HB3 . 10075 1 237 . 1 1 27 27 SER C C 13 171.358 0.300 . 1 . . . . 27 SER C . 10075 1 238 . 1 1 27 27 SER CA C 13 57.334 0.300 . 1 . . . . 27 SER CA . 10075 1 239 . 1 1 27 27 SER CB C 13 65.854 0.300 . 1 . . . . 27 SER CB . 10075 1 240 . 1 1 27 27 SER N N 15 116.552 0.300 . 1 . . . . 27 SER N . 10075 1 241 . 1 1 28 28 GLU H H 1 8.977 0.030 . 1 . . . . 28 GLU H . 10075 1 242 . 1 1 28 28 GLU HA H 1 3.746 0.030 . 1 . . . . 28 GLU HA . 10075 1 243 . 1 1 28 28 GLU HB2 H 1 1.966 0.030 . 2 . . . . 28 GLU HB2 . 10075 1 244 . 1 1 28 28 GLU HB3 H 1 1.908 0.030 . 2 . . . . 28 GLU HB3 . 10075 1 245 . 1 1 28 28 GLU HG2 H 1 2.173 0.030 . 1 . . . . 28 GLU HG2 . 10075 1 246 . 1 1 28 28 GLU HG3 H 1 2.173 0.030 . 1 . . . . 28 GLU HG3 . 10075 1 247 . 1 1 28 28 GLU C C 13 174.780 0.300 . 1 . . . . 28 GLU C . 10075 1 248 . 1 1 28 28 GLU CA C 13 56.481 0.300 . 1 . . . . 28 GLU CA . 10075 1 249 . 1 1 28 28 GLU CB C 13 27.179 0.300 . 1 . . . . 28 GLU CB . 10075 1 250 . 1 1 28 28 GLU CG C 13 36.323 0.300 . 1 . . . . 28 GLU CG . 10075 1 251 . 1 1 28 28 GLU N N 15 116.625 0.300 . 1 . . . . 28 GLU N . 10075 1 252 . 1 1 29 29 ILE H H 1 8.158 0.030 . 1 . . . . 29 ILE H . 10075 1 253 . 1 1 29 29 ILE HA H 1 3.826 0.030 . 1 . . . . 29 ILE HA . 10075 1 254 . 1 1 29 29 ILE HB H 1 1.837 0.030 . 1 . . . . 29 ILE HB . 10075 1 255 . 1 1 29 29 ILE HG12 H 1 1.467 0.030 . 2 . . . . 29 ILE HG12 . 10075 1 256 . 1 1 29 29 ILE HG13 H 1 0.932 0.030 . 2 . . . . 29 ILE HG13 . 10075 1 257 . 1 1 29 29 ILE HG21 H 1 0.940 0.030 . 1 . . . . 29 ILE HG2 . 10075 1 258 . 1 1 29 29 ILE HG22 H 1 0.940 0.030 . 1 . . . . 29 ILE HG2 . 10075 1 259 . 1 1 29 29 ILE HG23 H 1 0.940 0.030 . 1 . . . . 29 ILE HG2 . 10075 1 260 . 1 1 29 29 ILE HD11 H 1 0.890 0.030 . 1 . . . . 29 ILE HD1 . 10075 1 261 . 1 1 29 29 ILE HD12 H 1 0.890 0.030 . 1 . . . . 29 ILE HD1 . 10075 1 262 . 1 1 29 29 ILE HD13 H 1 0.890 0.030 . 1 . . . . 29 ILE HD1 . 10075 1 263 . 1 1 29 29 ILE C C 13 176.118 0.300 . 1 . . . . 29 ILE C . 10075 1 264 . 1 1 29 29 ILE CA C 13 63.635 0.300 . 1 . . . . 29 ILE CA . 10075 1 265 . 1 1 29 29 ILE CB C 13 37.288 0.300 . 1 . . . . 29 ILE CB . 10075 1 266 . 1 1 29 29 ILE CG1 C 13 27.996 0.300 . 1 . . . . 29 ILE CG1 . 10075 1 267 . 1 1 29 29 ILE CG2 C 13 18.184 0.300 . 1 . . . . 29 ILE CG2 . 10075 1 268 . 1 1 29 29 ILE CD1 C 13 14.207 0.300 . 1 . . . . 29 ILE CD1 . 10075 1 269 . 1 1 29 29 ILE N N 15 117.230 0.300 . 1 . . . . 29 ILE N . 10075 1 270 . 1 1 30 30 LEU H H 1 8.880 0.030 . 1 . . . . 30 LEU H . 10075 1 271 . 1 1 30 30 LEU HA H 1 4.921 0.030 . 1 . . . . 30 LEU HA . 10075 1 272 . 1 1 30 30 LEU HB2 H 1 1.914 0.030 . 2 . . . . 30 LEU HB2 . 10075 1 273 . 1 1 30 30 LEU HB3 H 1 1.708 0.030 . 2 . . . . 30 LEU HB3 . 10075 1 274 . 1 1 30 30 LEU HG H 1 1.538 0.030 . 1 . . . . 30 LEU HG . 10075 1 275 . 1 1 30 30 LEU HD11 H 1 0.842 0.030 . 1 . . . . 30 LEU HD1 . 10075 1 276 . 1 1 30 30 LEU HD12 H 1 0.842 0.030 . 1 . . . . 30 LEU HD1 . 10075 1 277 . 1 1 30 30 LEU HD13 H 1 0.842 0.030 . 1 . . . . 30 LEU HD1 . 10075 1 278 . 1 1 30 30 LEU HD21 H 1 0.887 0.030 . 1 . . . . 30 LEU HD2 . 10075 1 279 . 1 1 30 30 LEU HD22 H 1 0.887 0.030 . 1 . . . . 30 LEU HD2 . 10075 1 280 . 1 1 30 30 LEU HD23 H 1 0.887 0.030 . 1 . . . . 30 LEU HD2 . 10075 1 281 . 1 1 30 30 LEU C C 13 175.623 0.300 . 1 . . . . 30 LEU C . 10075 1 282 . 1 1 30 30 LEU CA C 13 53.151 0.300 . 1 . . . . 30 LEU CA . 10075 1 283 . 1 1 30 30 LEU CB C 13 43.504 0.300 . 1 . . . . 30 LEU CB . 10075 1 284 . 1 1 30 30 LEU CG C 13 27.165 0.300 . 1 . . . . 30 LEU CG . 10075 1 285 . 1 1 30 30 LEU CD1 C 13 25.528 0.300 . 2 . . . . 30 LEU CD1 . 10075 1 286 . 1 1 30 30 LEU CD2 C 13 22.684 0.300 . 2 . . . . 30 LEU CD2 . 10075 1 287 . 1 1 30 30 LEU N N 15 133.364 0.300 . 1 . . . . 30 LEU N . 10075 1 288 . 1 1 31 31 ASP H H 1 9.253 0.030 . 1 . . . . 31 ASP H . 10075 1 289 . 1 1 31 31 ASP HA H 1 4.198 0.030 . 1 . . . . 31 ASP HA . 10075 1 290 . 1 1 31 31 ASP HB2 H 1 2.518 0.030 . 2 . . . . 31 ASP HB2 . 10075 1 291 . 1 1 31 31 ASP HB3 H 1 2.313 0.030 . 2 . . . . 31 ASP HB3 . 10075 1 292 . 1 1 31 31 ASP C C 13 176.114 0.300 . 1 . . . . 31 ASP C . 10075 1 293 . 1 1 31 31 ASP CA C 13 56.376 0.300 . 1 . . . . 31 ASP CA . 10075 1 294 . 1 1 31 31 ASP CB C 13 39.371 0.300 . 1 . . . . 31 ASP CB . 10075 1 295 . 1 1 31 31 ASP N N 15 117.211 0.300 . 1 . . . . 31 ASP N . 10075 1 296 . 1 1 32 32 THR H H 1 7.037 0.030 . 1 . . . . 32 THR H . 10075 1 297 . 1 1 32 32 THR HA H 1 4.475 0.030 . 1 . . . . 32 THR HA . 10075 1 298 . 1 1 32 32 THR HB H 1 4.602 0.030 . 1 . . . . 32 THR HB . 10075 1 299 . 1 1 32 32 THR HG21 H 1 1.118 0.030 . 1 . . . . 32 THR HG2 . 10075 1 300 . 1 1 32 32 THR HG22 H 1 1.118 0.030 . 1 . . . . 32 THR HG2 . 10075 1 301 . 1 1 32 32 THR HG23 H 1 1.118 0.030 . 1 . . . . 32 THR HG2 . 10075 1 302 . 1 1 32 32 THR C C 13 174.591 0.300 . 1 . . . . 32 THR C . 10075 1 303 . 1 1 32 32 THR CA C 13 59.492 0.300 . 1 . . . . 32 THR CA . 10075 1 304 . 1 1 32 32 THR CB C 13 70.828 0.300 . 1 . . . . 32 THR CB . 10075 1 305 . 1 1 32 32 THR CG2 C 13 20.668 0.300 . 1 . . . . 32 THR CG2 . 10075 1 306 . 1 1 32 32 THR N N 15 98.709 0.300 . 1 . . . . 32 THR N . 10075 1 307 . 1 1 33 33 SER H H 1 7.218 0.030 . 1 . . . . 33 SER H . 10075 1 308 . 1 1 33 33 SER HA H 1 5.072 0.030 . 1 . . . . 33 SER HA . 10075 1 309 . 1 1 33 33 SER HB2 H 1 3.827 0.030 . 2 . . . . 33 SER HB2 . 10075 1 310 . 1 1 33 33 SER HB3 H 1 3.717 0.030 . 2 . . . . 33 SER HB3 . 10075 1 311 . 1 1 33 33 SER C C 13 170.686 0.300 . 1 . . . . 33 SER C . 10075 1 312 . 1 1 33 33 SER CA C 13 56.622 0.300 . 1 . . . . 33 SER CA . 10075 1 313 . 1 1 33 33 SER CB C 13 66.808 0.300 . 1 . . . . 33 SER CB . 10075 1 314 . 1 1 33 33 SER N N 15 113.926 0.300 . 1 . . . . 33 SER N . 10075 1 315 . 1 1 34 34 LEU H H 1 8.309 0.030 . 1 . . . . 34 LEU H . 10075 1 316 . 1 1 34 34 LEU HA H 1 4.882 0.030 . 1 . . . . 34 LEU HA . 10075 1 317 . 1 1 34 34 LEU HB2 H 1 2.148 0.030 . 2 . . . . 34 LEU HB2 . 10075 1 318 . 1 1 34 34 LEU HB3 H 1 1.386 0.030 . 2 . . . . 34 LEU HB3 . 10075 1 319 . 1 1 34 34 LEU HG H 1 1.309 0.030 . 1 . . . . 34 LEU HG . 10075 1 320 . 1 1 34 34 LEU HD11 H 1 0.363 0.030 . 1 . . . . 34 LEU HD1 . 10075 1 321 . 1 1 34 34 LEU HD12 H 1 0.363 0.030 . 1 . . . . 34 LEU HD1 . 10075 1 322 . 1 1 34 34 LEU HD13 H 1 0.363 0.030 . 1 . . . . 34 LEU HD1 . 10075 1 323 . 1 1 34 34 LEU HD21 H 1 0.634 0.030 . 1 . . . . 34 LEU HD2 . 10075 1 324 . 1 1 34 34 LEU HD22 H 1 0.634 0.030 . 1 . . . . 34 LEU HD2 . 10075 1 325 . 1 1 34 34 LEU HD23 H 1 0.634 0.030 . 1 . . . . 34 LEU HD2 . 10075 1 326 . 1 1 34 34 LEU C C 13 173.437 0.300 . 1 . . . . 34 LEU C . 10075 1 327 . 1 1 34 34 LEU CA C 13 54.922 0.300 . 1 . . . . 34 LEU CA . 10075 1 328 . 1 1 34 34 LEU CB C 13 44.632 0.300 . 1 . . . . 34 LEU CB . 10075 1 329 . 1 1 34 34 LEU CG C 13 25.210 0.300 . 1 . . . . 34 LEU CG . 10075 1 330 . 1 1 34 34 LEU CD1 C 13 27.968 0.300 . 2 . . . . 34 LEU CD1 . 10075 1 331 . 1 1 34 34 LEU CD2 C 13 26.024 0.300 . 2 . . . . 34 LEU CD2 . 10075 1 332 . 1 1 34 34 LEU N N 15 112.562 0.300 . 1 . . . . 34 LEU N . 10075 1 333 . 1 1 35 35 LYS H H 1 8.798 0.030 . 1 . . . . 35 LYS H . 10075 1 334 . 1 1 35 35 LYS HA H 1 4.911 0.030 . 1 . . . . 35 LYS HA . 10075 1 335 . 1 1 35 35 LYS HB2 H 1 1.793 0.030 . 2 . . . . 35 LYS HB2 . 10075 1 336 . 1 1 35 35 LYS HB3 H 1 1.305 0.030 . 2 . . . . 35 LYS HB3 . 10075 1 337 . 1 1 35 35 LYS HG2 H 1 1.032 0.030 . 2 . . . . 35 LYS HG2 . 10075 1 338 . 1 1 35 35 LYS HG3 H 1 0.974 0.030 . 2 . . . . 35 LYS HG3 . 10075 1 339 . 1 1 35 35 LYS HD2 H 1 1.347 0.030 . 2 . . . . 35 LYS HD2 . 10075 1 340 . 1 1 35 35 LYS HD3 H 1 1.315 0.030 . 2 . . . . 35 LYS HD3 . 10075 1 341 . 1 1 35 35 LYS HE2 H 1 2.537 0.030 . 1 . . . . 35 LYS HE2 . 10075 1 342 . 1 1 35 35 LYS HE3 H 1 2.537 0.030 . 1 . . . . 35 LYS HE3 . 10075 1 343 . 1 1 35 35 LYS C C 13 174.100 0.300 . 1 . . . . 35 LYS C . 10075 1 344 . 1 1 35 35 LYS CA C 13 55.742 0.300 . 1 . . . . 35 LYS CA . 10075 1 345 . 1 1 35 35 LYS CB C 13 34.367 0.300 . 1 . . . . 35 LYS CB . 10075 1 346 . 1 1 35 35 LYS CG C 13 25.706 0.300 . 1 . . . . 35 LYS CG . 10075 1 347 . 1 1 35 35 LYS CD C 13 29.127 0.300 . 1 . . . . 35 LYS CD . 10075 1 348 . 1 1 35 35 LYS CE C 13 41.935 0.300 . 1 . . . . 35 LYS CE . 10075 1 349 . 1 1 35 35 LYS N N 15 121.677 0.300 . 1 . . . . 35 LYS N . 10075 1 350 . 1 1 36 36 VAL H H 1 8.916 0.030 . 1 . . . . 36 VAL H . 10075 1 351 . 1 1 36 36 VAL HA H 1 4.917 0.030 . 1 . . . . 36 VAL HA . 10075 1 352 . 1 1 36 36 VAL HB H 1 2.153 0.030 . 1 . . . . 36 VAL HB . 10075 1 353 . 1 1 36 36 VAL HG11 H 1 1.048 0.030 . 1 . . . . 36 VAL HG1 . 10075 1 354 . 1 1 36 36 VAL HG12 H 1 1.048 0.030 . 1 . . . . 36 VAL HG1 . 10075 1 355 . 1 1 36 36 VAL HG13 H 1 1.048 0.030 . 1 . . . . 36 VAL HG1 . 10075 1 356 . 1 1 36 36 VAL HG21 H 1 1.129 0.030 . 1 . . . . 36 VAL HG2 . 10075 1 357 . 1 1 36 36 VAL HG22 H 1 1.129 0.030 . 1 . . . . 36 VAL HG2 . 10075 1 358 . 1 1 36 36 VAL HG23 H 1 1.129 0.030 . 1 . . . . 36 VAL HG2 . 10075 1 359 . 1 1 36 36 VAL C C 13 173.922 0.300 . 1 . . . . 36 VAL C . 10075 1 360 . 1 1 36 36 VAL CA C 13 59.879 0.300 . 1 . . . . 36 VAL CA . 10075 1 361 . 1 1 36 36 VAL CB C 13 34.525 0.300 . 1 . . . . 36 VAL CB . 10075 1 362 . 1 1 36 36 VAL CG1 C 13 23.252 0.300 . 2 . . . . 36 VAL CG1 . 10075 1 363 . 1 1 36 36 VAL CG2 C 13 21.865 0.300 . 2 . . . . 36 VAL CG2 . 10075 1 364 . 1 1 36 36 VAL N N 15 128.169 0.300 . 1 . . . . 36 VAL N . 10075 1 365 . 1 1 37 37 SER H H 1 8.861 0.030 . 1 . . . . 37 SER H . 10075 1 366 . 1 1 37 37 SER HA H 1 4.955 0.030 . 1 . . . . 37 SER HA . 10075 1 367 . 1 1 37 37 SER HB2 H 1 3.626 0.030 . 1 . . . . 37 SER HB2 . 10075 1 368 . 1 1 37 37 SER HB3 H 1 3.626 0.030 . 1 . . . . 37 SER HB3 . 10075 1 369 . 1 1 37 37 SER C C 13 172.188 0.300 . 1 . . . . 37 SER C . 10075 1 370 . 1 1 37 37 SER CA C 13 57.645 0.300 . 1 . . . . 37 SER CA . 10075 1 371 . 1 1 37 37 SER CB C 13 66.056 0.300 . 1 . . . . 37 SER CB . 10075 1 372 . 1 1 37 37 SER N N 15 119.890 0.300 . 1 . . . . 37 SER N . 10075 1 373 . 1 1 38 38 TRP H H 1 7.892 0.030 . 1 . . . . 38 TRP H . 10075 1 374 . 1 1 38 38 TRP HA H 1 4.935 0.030 . 1 . . . . 38 TRP HA . 10075 1 375 . 1 1 38 38 TRP HB2 H 1 3.285 0.030 . 2 . . . . 38 TRP HB2 . 10075 1 376 . 1 1 38 38 TRP HB3 H 1 2.982 0.030 . 2 . . . . 38 TRP HB3 . 10075 1 377 . 1 1 38 38 TRP HD1 H 1 6.525 0.030 . 1 . . . . 38 TRP HD1 . 10075 1 378 . 1 1 38 38 TRP HE1 H 1 6.204 0.030 . 1 . . . . 38 TRP HE1 . 10075 1 379 . 1 1 38 38 TRP HE3 H 1 6.832 0.030 . 1 . . . . 38 TRP HE3 . 10075 1 380 . 1 1 38 38 TRP HZ2 H 1 6.662 0.030 . 1 . . . . 38 TRP HZ2 . 10075 1 381 . 1 1 38 38 TRP HZ3 H 1 6.509 0.030 . 1 . . . . 38 TRP HZ3 . 10075 1 382 . 1 1 38 38 TRP HH2 H 1 6.407 0.030 . 1 . . . . 38 TRP HH2 . 10075 1 383 . 1 1 38 38 TRP C C 13 172.620 0.300 . 1 . . . . 38 TRP C . 10075 1 384 . 1 1 38 38 TRP CA C 13 56.635 0.300 . 1 . . . . 38 TRP CA . 10075 1 385 . 1 1 38 38 TRP CB C 13 30.145 0.300 . 1 . . . . 38 TRP CB . 10075 1 386 . 1 1 38 38 TRP CD1 C 13 125.597 0.300 . 1 . . . . 38 TRP CD1 . 10075 1 387 . 1 1 38 38 TRP CE3 C 13 119.962 0.300 . 1 . . . . 38 TRP CE3 . 10075 1 388 . 1 1 38 38 TRP CZ2 C 13 114.022 0.300 . 1 . . . . 38 TRP CZ2 . 10075 1 389 . 1 1 38 38 TRP CZ3 C 13 120.834 0.300 . 1 . . . . 38 TRP CZ3 . 10075 1 390 . 1 1 38 38 TRP CH2 C 13 122.604 0.300 . 1 . . . . 38 TRP CH2 . 10075 1 391 . 1 1 38 38 TRP N N 15 119.188 0.300 . 1 . . . . 38 TRP N . 10075 1 392 . 1 1 38 38 TRP NE1 N 15 125.735 0.300 . 1 . . . . 38 TRP NE1 . 10075 1 393 . 1 1 39 39 GLN H H 1 8.404 0.030 . 1 . . . . 39 GLN H . 10075 1 394 . 1 1 39 39 GLN HA H 1 4.662 0.030 . 1 . . . . 39 GLN HA . 10075 1 395 . 1 1 39 39 GLN HB2 H 1 2.173 0.030 . 2 . . . . 39 GLN HB2 . 10075 1 396 . 1 1 39 39 GLN HB3 H 1 1.768 0.030 . 2 . . . . 39 GLN HB3 . 10075 1 397 . 1 1 39 39 GLN HG2 H 1 2.365 0.030 . 1 . . . . 39 GLN HG2 . 10075 1 398 . 1 1 39 39 GLN HG3 H 1 2.365 0.030 . 1 . . . . 39 GLN HG3 . 10075 1 399 . 1 1 39 39 GLN HE21 H 1 7.567 0.030 . 2 . . . . 39 GLN HE21 . 10075 1 400 . 1 1 39 39 GLN HE22 H 1 6.799 0.030 . 2 . . . . 39 GLN HE22 . 10075 1 401 . 1 1 39 39 GLN C C 13 175.464 0.300 . 1 . . . . 39 GLN C . 10075 1 402 . 1 1 39 39 GLN CA C 13 53.476 0.300 . 1 . . . . 39 GLN CA . 10075 1 403 . 1 1 39 39 GLN CB C 13 31.910 0.300 . 1 . . . . 39 GLN CB . 10075 1 404 . 1 1 39 39 GLN CG C 13 34.057 0.300 . 1 . . . . 39 GLN CG . 10075 1 405 . 1 1 39 39 GLN N N 15 114.968 0.300 . 1 . . . . 39 GLN N . 10075 1 406 . 1 1 39 39 GLN NE2 N 15 112.342 0.300 . 1 . . . . 39 GLN NE2 . 10075 1 407 . 1 1 40 40 GLU H H 1 8.582 0.030 . 1 . . . . 40 GLU H . 10075 1 408 . 1 1 40 40 GLU HA H 1 4.772 0.030 . 1 . . . . 40 GLU HA . 10075 1 409 . 1 1 40 40 GLU HB2 H 1 2.068 0.030 . 2 . . . . 40 GLU HB2 . 10075 1 410 . 1 1 40 40 GLU HB3 H 1 1.973 0.030 . 2 . . . . 40 GLU HB3 . 10075 1 411 . 1 1 40 40 GLU HG2 H 1 2.410 0.030 . 1 . . . . 40 GLU HG2 . 10075 1 412 . 1 1 40 40 GLU HG3 H 1 2.410 0.030 . 1 . . . . 40 GLU HG3 . 10075 1 413 . 1 1 40 40 GLU C C 13 175.090 0.300 . 1 . . . . 40 GLU C . 10075 1 414 . 1 1 40 40 GLU CA C 13 55.011 0.300 . 1 . . . . 40 GLU CA . 10075 1 415 . 1 1 40 40 GLU CB C 13 29.997 0.300 . 1 . . . . 40 GLU CB . 10075 1 416 . 1 1 40 40 GLU CG C 13 36.535 0.300 . 1 . . . . 40 GLU CG . 10075 1 417 . 1 1 40 40 GLU N N 15 121.337 0.300 . 1 . . . . 40 GLU N . 10075 1 418 . 1 1 41 41 PRO HA H 1 4.402 0.030 . 1 . . . . 41 PRO HA . 10075 1 419 . 1 1 41 41 PRO HB2 H 1 2.090 0.030 . 2 . . . . 41 PRO HB2 . 10075 1 420 . 1 1 41 41 PRO HB3 H 1 1.611 0.030 . 2 . . . . 41 PRO HB3 . 10075 1 421 . 1 1 41 41 PRO HG2 H 1 1.948 0.030 . 2 . . . . 41 PRO HG2 . 10075 1 422 . 1 1 41 41 PRO HG3 H 1 1.850 0.030 . 2 . . . . 41 PRO HG3 . 10075 1 423 . 1 1 41 41 PRO HD2 H 1 4.180 0.030 . 2 . . . . 41 PRO HD2 . 10075 1 424 . 1 1 41 41 PRO HD3 H 1 3.843 0.030 . 2 . . . . 41 PRO HD3 . 10075 1 425 . 1 1 41 41 PRO C C 13 176.636 0.300 . 1 . . . . 41 PRO C . 10075 1 426 . 1 1 41 41 PRO CA C 13 63.186 0.300 . 1 . . . . 41 PRO CA . 10075 1 427 . 1 1 41 41 PRO CB C 13 32.411 0.300 . 1 . . . . 41 PRO CB . 10075 1 428 . 1 1 41 41 PRO CG C 13 28.338 0.300 . 1 . . . . 41 PRO CG . 10075 1 429 . 1 1 41 41 PRO CD C 13 51.078 0.300 . 1 . . . . 41 PRO CD . 10075 1 430 . 1 1 42 42 GLY H H 1 8.459 0.030 . 1 . . . . 42 GLY H . 10075 1 431 . 1 1 42 42 GLY HA2 H 1 3.941 0.030 . 2 . . . . 42 GLY HA2 . 10075 1 432 . 1 1 42 42 GLY HA3 H 1 3.863 0.030 . 2 . . . . 42 GLY HA3 . 10075 1 433 . 1 1 42 42 GLY C C 13 174.722 0.300 . 1 . . . . 42 GLY C . 10075 1 434 . 1 1 42 42 GLY CA C 13 46.267 0.300 . 1 . . . . 42 GLY CA . 10075 1 435 . 1 1 42 42 GLY N N 15 111.036 0.300 . 1 . . . . 42 GLY N . 10075 1 436 . 1 1 43 43 GLU H H 1 8.071 0.030 . 1 . . . . 43 GLU H . 10075 1 437 . 1 1 43 43 GLU HA H 1 4.540 0.030 . 1 . . . . 43 GLU HA . 10075 1 438 . 1 1 43 43 GLU HB2 H 1 1.970 0.030 . 2 . . . . 43 GLU HB2 . 10075 1 439 . 1 1 43 43 GLU HB3 H 1 1.936 0.030 . 2 . . . . 43 GLU HB3 . 10075 1 440 . 1 1 43 43 GLU HG2 H 1 2.200 0.030 . 1 . . . . 43 GLU HG2 . 10075 1 441 . 1 1 43 43 GLU HG3 H 1 2.200 0.030 . 1 . . . . 43 GLU HG3 . 10075 1 442 . 1 1 43 43 GLU C C 13 174.707 0.300 . 1 . . . . 43 GLU C . 10075 1 443 . 1 1 43 43 GLU CA C 13 54.761 0.300 . 1 . . . . 43 GLU CA . 10075 1 444 . 1 1 43 43 GLU CB C 13 29.740 0.300 . 1 . . . . 43 GLU CB . 10075 1 445 . 1 1 43 43 GLU CG C 13 35.949 0.300 . 1 . . . . 43 GLU CG . 10075 1 446 . 1 1 43 43 GLU N N 15 120.680 0.300 . 1 . . . . 43 GLU N . 10075 1 447 . 1 1 44 44 LYS H H 1 8.403 0.030 . 1 . . . . 44 LYS H . 10075 1 448 . 1 1 44 44 LYS HA H 1 3.912 0.030 . 1 . . . . 44 LYS HA . 10075 1 449 . 1 1 44 44 LYS HB2 H 1 2.016 0.030 . 2 . . . . 44 LYS HB2 . 10075 1 450 . 1 1 44 44 LYS HB3 H 1 1.782 0.030 . 2 . . . . 44 LYS HB3 . 10075 1 451 . 1 1 44 44 LYS HG2 H 1 1.545 0.030 . 2 . . . . 44 LYS HG2 . 10075 1 452 . 1 1 44 44 LYS HG3 H 1 1.261 0.030 . 2 . . . . 44 LYS HG3 . 10075 1 453 . 1 1 44 44 LYS HD2 H 1 1.836 0.030 . 2 . . . . 44 LYS HD2 . 10075 1 454 . 1 1 44 44 LYS HD3 H 1 1.741 0.030 . 2 . . . . 44 LYS HD3 . 10075 1 455 . 1 1 44 44 LYS HE2 H 1 3.065 0.030 . 2 . . . . 44 LYS HE2 . 10075 1 456 . 1 1 44 44 LYS HE3 H 1 3.026 0.030 . 2 . . . . 44 LYS HE3 . 10075 1 457 . 1 1 44 44 LYS C C 13 174.774 0.300 . 1 . . . . 44 LYS C . 10075 1 458 . 1 1 44 44 LYS CA C 13 59.216 0.300 . 1 . . . . 44 LYS CA . 10075 1 459 . 1 1 44 44 LYS CB C 13 33.297 0.300 . 1 . . . . 44 LYS CB . 10075 1 460 . 1 1 44 44 LYS CG C 13 26.635 0.300 . 1 . . . . 44 LYS CG . 10075 1 461 . 1 1 44 44 LYS CD C 13 29.439 0.300 . 1 . . . . 44 LYS CD . 10075 1 462 . 1 1 44 44 LYS CE C 13 42.473 0.300 . 1 . . . . 44 LYS CE . 10075 1 463 . 1 1 44 44 LYS N N 15 124.271 0.300 . 1 . . . . 44 LYS N . 10075 1 464 . 1 1 45 45 ASN H H 1 8.054 0.030 . 1 . . . . 45 ASN H . 10075 1 465 . 1 1 45 45 ASN HA H 1 4.277 0.030 . 1 . . . . 45 ASN HA . 10075 1 466 . 1 1 45 45 ASN HB2 H 1 2.692 0.030 . 2 . . . . 45 ASN HB2 . 10075 1 467 . 1 1 45 45 ASN HB3 H 1 2.495 0.030 . 2 . . . . 45 ASN HB3 . 10075 1 468 . 1 1 45 45 ASN HD21 H 1 7.622 0.030 . 2 . . . . 45 ASN HD21 . 10075 1 469 . 1 1 45 45 ASN HD22 H 1 7.245 0.030 . 2 . . . . 45 ASN HD22 . 10075 1 470 . 1 1 45 45 ASN C C 13 173.715 0.300 . 1 . . . . 45 ASN C . 10075 1 471 . 1 1 45 45 ASN CA C 13 53.973 0.300 . 1 . . . . 45 ASN CA . 10075 1 472 . 1 1 45 45 ASN CB C 13 37.113 0.300 . 1 . . . . 45 ASN CB . 10075 1 473 . 1 1 45 45 ASN N N 15 108.693 0.300 . 1 . . . . 45 ASN N . 10075 1 474 . 1 1 45 45 ASN ND2 N 15 115.494 0.300 . 1 . . . . 45 ASN ND2 . 10075 1 475 . 1 1 46 46 GLY H H 1 7.482 0.030 . 1 . . . . 46 GLY H . 10075 1 476 . 1 1 46 46 GLY HA2 H 1 4.212 0.030 . 2 . . . . 46 GLY HA2 . 10075 1 477 . 1 1 46 46 GLY HA3 H 1 3.786 0.030 . 2 . . . . 46 GLY HA3 . 10075 1 478 . 1 1 46 46 GLY C C 13 172.175 0.300 . 1 . . . . 46 GLY C . 10075 1 479 . 1 1 46 46 GLY CA C 13 44.246 0.300 . 1 . . . . 46 GLY CA . 10075 1 480 . 1 1 46 46 GLY N N 15 103.908 0.300 . 1 . . . . 46 GLY N . 10075 1 481 . 1 1 47 47 ILE H H 1 8.270 0.030 . 1 . . . . 47 ILE H . 10075 1 482 . 1 1 47 47 ILE HA H 1 4.089 0.030 . 1 . . . . 47 ILE HA . 10075 1 483 . 1 1 47 47 ILE HB H 1 1.790 0.030 . 1 . . . . 47 ILE HB . 10075 1 484 . 1 1 47 47 ILE HG12 H 1 1.543 0.030 . 2 . . . . 47 ILE HG12 . 10075 1 485 . 1 1 47 47 ILE HG13 H 1 1.212 0.030 . 2 . . . . 47 ILE HG13 . 10075 1 486 . 1 1 47 47 ILE HG21 H 1 0.853 0.030 . 1 . . . . 47 ILE HG2 . 10075 1 487 . 1 1 47 47 ILE HG22 H 1 0.853 0.030 . 1 . . . . 47 ILE HG2 . 10075 1 488 . 1 1 47 47 ILE HG23 H 1 0.853 0.030 . 1 . . . . 47 ILE HG2 . 10075 1 489 . 1 1 47 47 ILE HD11 H 1 0.854 0.030 . 1 . . . . 47 ILE HD1 . 10075 1 490 . 1 1 47 47 ILE HD12 H 1 0.854 0.030 . 1 . . . . 47 ILE HD1 . 10075 1 491 . 1 1 47 47 ILE HD13 H 1 0.854 0.030 . 1 . . . . 47 ILE HD1 . 10075 1 492 . 1 1 47 47 ILE C C 13 176.723 0.300 . 1 . . . . 47 ILE C . 10075 1 493 . 1 1 47 47 ILE CA C 13 60.204 0.300 . 1 . . . . 47 ILE CA . 10075 1 494 . 1 1 47 47 ILE CB C 13 38.293 0.300 . 1 . . . . 47 ILE CB . 10075 1 495 . 1 1 47 47 ILE CG1 C 13 27.543 0.300 . 1 . . . . 47 ILE CG1 . 10075 1 496 . 1 1 47 47 ILE CG2 C 13 17.178 0.300 . 1 . . . . 47 ILE CG2 . 10075 1 497 . 1 1 47 47 ILE CD1 C 13 12.279 0.300 . 1 . . . . 47 ILE CD1 . 10075 1 498 . 1 1 47 47 ILE N N 15 120.537 0.300 . 1 . . . . 47 ILE N . 10075 1 499 . 1 1 48 48 LEU H H 1 8.696 0.030 . 1 . . . . 48 LEU H . 10075 1 500 . 1 1 48 48 LEU HA H 1 4.717 0.030 . 1 . . . . 48 LEU HA . 10075 1 501 . 1 1 48 48 LEU HB2 H 1 1.851 0.030 . 2 . . . . 48 LEU HB2 . 10075 1 502 . 1 1 48 48 LEU HB3 H 1 1.397 0.030 . 2 . . . . 48 LEU HB3 . 10075 1 503 . 1 1 48 48 LEU HG H 1 1.794 0.030 . 1 . . . . 48 LEU HG . 10075 1 504 . 1 1 48 48 LEU HD11 H 1 0.999 0.030 . 1 . . . . 48 LEU HD1 . 10075 1 505 . 1 1 48 48 LEU HD12 H 1 0.999 0.030 . 1 . . . . 48 LEU HD1 . 10075 1 506 . 1 1 48 48 LEU HD13 H 1 0.999 0.030 . 1 . . . . 48 LEU HD1 . 10075 1 507 . 1 1 48 48 LEU HD21 H 1 0.792 0.030 . 1 . . . . 48 LEU HD2 . 10075 1 508 . 1 1 48 48 LEU HD22 H 1 0.792 0.030 . 1 . . . . 48 LEU HD2 . 10075 1 509 . 1 1 48 48 LEU HD23 H 1 0.792 0.030 . 1 . . . . 48 LEU HD2 . 10075 1 510 . 1 1 48 48 LEU C C 13 178.644 0.300 . 1 . . . . 48 LEU C . 10075 1 511 . 1 1 48 48 LEU CA C 13 55.231 0.300 . 1 . . . . 48 LEU CA . 10075 1 512 . 1 1 48 48 LEU CB C 13 41.942 0.300 . 1 . . . . 48 LEU CB . 10075 1 513 . 1 1 48 48 LEU CG C 13 27.257 0.300 . 1 . . . . 48 LEU CG . 10075 1 514 . 1 1 48 48 LEU CD1 C 13 26.662 0.300 . 2 . . . . 48 LEU CD1 . 10075 1 515 . 1 1 48 48 LEU CD2 C 13 24.110 0.300 . 2 . . . . 48 LEU CD2 . 10075 1 516 . 1 1 48 48 LEU N N 15 127.330 0.300 . 1 . . . . 48 LEU N . 10075 1 517 . 1 1 49 49 THR H H 1 9.209 0.030 . 1 . . . . 49 THR H . 10075 1 518 . 1 1 49 49 THR HA H 1 4.427 0.030 . 1 . . . . 49 THR HA . 10075 1 519 . 1 1 49 49 THR HB H 1 4.258 0.030 . 1 . . . . 49 THR HB . 10075 1 520 . 1 1 49 49 THR HG21 H 1 1.091 0.030 . 1 . . . . 49 THR HG2 . 10075 1 521 . 1 1 49 49 THR HG22 H 1 1.091 0.030 . 1 . . . . 49 THR HG2 . 10075 1 522 . 1 1 49 49 THR HG23 H 1 1.091 0.030 . 1 . . . . 49 THR HG2 . 10075 1 523 . 1 1 49 49 THR C C 13 175.772 0.300 . 1 . . . . 49 THR C . 10075 1 524 . 1 1 49 49 THR CA C 13 61.439 0.300 . 1 . . . . 49 THR CA . 10075 1 525 . 1 1 49 49 THR CB C 13 68.589 0.300 . 1 . . . . 49 THR CB . 10075 1 526 . 1 1 49 49 THR CG2 C 13 22.650 0.300 . 1 . . . . 49 THR CG2 . 10075 1 527 . 1 1 49 49 THR N N 15 114.128 0.300 . 1 . . . . 49 THR N . 10075 1 528 . 1 1 50 50 GLY H H 1 7.199 0.030 . 1 . . . . 50 GLY H . 10075 1 529 . 1 1 50 50 GLY HA2 H 1 4.616 0.030 . 2 . . . . 50 GLY HA2 . 10075 1 530 . 1 1 50 50 GLY HA3 H 1 3.529 0.030 . 2 . . . . 50 GLY HA3 . 10075 1 531 . 1 1 50 50 GLY C C 13 169.575 0.300 . 1 . . . . 50 GLY C . 10075 1 532 . 1 1 50 50 GLY CA C 13 45.105 0.300 . 1 . . . . 50 GLY CA . 10075 1 533 . 1 1 50 50 GLY N N 15 107.831 0.300 . 1 . . . . 50 GLY N . 10075 1 534 . 1 1 51 51 TYR H H 1 8.450 0.030 . 1 . . . . 51 TYR H . 10075 1 535 . 1 1 51 51 TYR HA H 1 5.152 0.030 . 1 . . . . 51 TYR HA . 10075 1 536 . 1 1 51 51 TYR HB2 H 1 2.615 0.030 . 2 . . . . 51 TYR HB2 . 10075 1 537 . 1 1 51 51 TYR HB3 H 1 2.562 0.030 . 2 . . . . 51 TYR HB3 . 10075 1 538 . 1 1 51 51 TYR HD1 H 1 7.030 0.030 . 1 . . . . 51 TYR HD1 . 10075 1 539 . 1 1 51 51 TYR HD2 H 1 7.030 0.030 . 1 . . . . 51 TYR HD2 . 10075 1 540 . 1 1 51 51 TYR HE1 H 1 6.771 0.030 . 1 . . . . 51 TYR HE1 . 10075 1 541 . 1 1 51 51 TYR HE2 H 1 6.771 0.030 . 1 . . . . 51 TYR HE2 . 10075 1 542 . 1 1 51 51 TYR C C 13 173.451 0.300 . 1 . . . . 51 TYR C . 10075 1 543 . 1 1 51 51 TYR CA C 13 57.252 0.300 . 1 . . . . 51 TYR CA . 10075 1 544 . 1 1 51 51 TYR CB C 13 43.504 0.300 . 1 . . . . 51 TYR CB . 10075 1 545 . 1 1 51 51 TYR CD1 C 13 132.855 0.300 . 1 . . . . 51 TYR CD1 . 10075 1 546 . 1 1 51 51 TYR CD2 C 13 132.855 0.300 . 1 . . . . 51 TYR CD2 . 10075 1 547 . 1 1 51 51 TYR CE1 C 13 117.915 0.300 . 1 . . . . 51 TYR CE1 . 10075 1 548 . 1 1 51 51 TYR CE2 C 13 117.915 0.300 . 1 . . . . 51 TYR CE2 . 10075 1 549 . 1 1 51 51 TYR N N 15 114.552 0.300 . 1 . . . . 51 TYR N . 10075 1 550 . 1 1 52 52 ARG H H 1 9.511 0.030 . 1 . . . . 52 ARG H . 10075 1 551 . 1 1 52 52 ARG HA H 1 4.757 0.030 . 1 . . . . 52 ARG HA . 10075 1 552 . 1 1 52 52 ARG HB2 H 1 1.658 0.030 . 2 . . . . 52 ARG HB2 . 10075 1 553 . 1 1 52 52 ARG HB3 H 1 1.628 0.030 . 2 . . . . 52 ARG HB3 . 10075 1 554 . 1 1 52 52 ARG HG2 H 1 1.148 0.030 . 2 . . . . 52 ARG HG2 . 10075 1 555 . 1 1 52 52 ARG HG3 H 1 1.057 0.030 . 2 . . . . 52 ARG HG3 . 10075 1 556 . 1 1 52 52 ARG HD2 H 1 2.910 0.030 . 2 . . . . 52 ARG HD2 . 10075 1 557 . 1 1 52 52 ARG HD3 H 1 2.794 0.030 . 2 . . . . 52 ARG HD3 . 10075 1 558 . 1 1 52 52 ARG HE H 1 7.274 0.030 . 1 . . . . 52 ARG HE . 10075 1 559 . 1 1 52 52 ARG C C 13 173.999 0.300 . 1 . . . . 52 ARG C . 10075 1 560 . 1 1 52 52 ARG CA C 13 54.809 0.300 . 1 . . . . 52 ARG CA . 10075 1 561 . 1 1 52 52 ARG CB C 13 31.627 0.300 . 1 . . . . 52 ARG CB . 10075 1 562 . 1 1 52 52 ARG CG C 13 26.449 0.300 . 1 . . . . 52 ARG CG . 10075 1 563 . 1 1 52 52 ARG CD C 13 42.893 0.300 . 1 . . . . 52 ARG CD . 10075 1 564 . 1 1 52 52 ARG N N 15 123.844 0.300 . 1 . . . . 52 ARG N . 10075 1 565 . 1 1 52 52 ARG NE N 15 82.834 0.300 . 1 . . . . 52 ARG NE . 10075 1 566 . 1 1 53 53 ILE H H 1 8.875 0.030 . 1 . . . . 53 ILE H . 10075 1 567 . 1 1 53 53 ILE HA H 1 5.551 0.030 . 1 . . . . 53 ILE HA . 10075 1 568 . 1 1 53 53 ILE HB H 1 1.264 0.030 . 1 . . . . 53 ILE HB . 10075 1 569 . 1 1 53 53 ILE HG12 H 1 1.860 0.030 . 2 . . . . 53 ILE HG12 . 10075 1 570 . 1 1 53 53 ILE HG13 H 1 1.100 0.030 . 2 . . . . 53 ILE HG13 . 10075 1 571 . 1 1 53 53 ILE HG21 H 1 0.747 0.030 . 1 . . . . 53 ILE HG2 . 10075 1 572 . 1 1 53 53 ILE HG22 H 1 0.747 0.030 . 1 . . . . 53 ILE HG2 . 10075 1 573 . 1 1 53 53 ILE HG23 H 1 0.747 0.030 . 1 . . . . 53 ILE HG2 . 10075 1 574 . 1 1 53 53 ILE HD11 H 1 0.824 0.030 . 1 . . . . 53 ILE HD1 . 10075 1 575 . 1 1 53 53 ILE HD12 H 1 0.824 0.030 . 1 . . . . 53 ILE HD1 . 10075 1 576 . 1 1 53 53 ILE HD13 H 1 0.824 0.030 . 1 . . . . 53 ILE HD1 . 10075 1 577 . 1 1 53 53 ILE C C 13 172.627 0.300 . 1 . . . . 53 ILE C . 10075 1 578 . 1 1 53 53 ILE CA C 13 57.895 0.300 . 1 . . . . 53 ILE CA . 10075 1 579 . 1 1 53 53 ILE CB C 13 41.653 0.300 . 1 . . . . 53 ILE CB . 10075 1 580 . 1 1 53 53 ILE CG1 C 13 29.180 0.300 . 1 . . . . 53 ILE CG1 . 10075 1 581 . 1 1 53 53 ILE CG2 C 13 15.840 0.300 . 1 . . . . 53 ILE CG2 . 10075 1 582 . 1 1 53 53 ILE CD1 C 13 14.752 0.300 . 1 . . . . 53 ILE CD1 . 10075 1 583 . 1 1 53 53 ILE N N 15 125.357 0.300 . 1 . . . . 53 ILE N . 10075 1 584 . 1 1 54 54 SER H H 1 9.237 0.030 . 1 . . . . 54 SER H . 10075 1 585 . 1 1 54 54 SER HA H 1 5.870 0.030 . 1 . . . . 54 SER HA . 10075 1 586 . 1 1 54 54 SER HB2 H 1 3.546 0.030 . 2 . . . . 54 SER HB2 . 10075 1 587 . 1 1 54 54 SER HB3 H 1 3.330 0.030 . 2 . . . . 54 SER HB3 . 10075 1 588 . 1 1 54 54 SER C C 13 172.781 0.300 . 1 . . . . 54 SER C . 10075 1 589 . 1 1 54 54 SER CA C 13 56.638 0.300 . 1 . . . . 54 SER CA . 10075 1 590 . 1 1 54 54 SER CB C 13 67.531 0.300 . 1 . . . . 54 SER CB . 10075 1 591 . 1 1 54 54 SER N N 15 120.524 0.300 . 1 . . . . 54 SER N . 10075 1 592 . 1 1 55 55 TRP H H 1 8.655 0.030 . 1 . . . . 55 TRP H . 10075 1 593 . 1 1 55 55 TRP HA H 1 6.029 0.030 . 1 . . . . 55 TRP HA . 10075 1 594 . 1 1 55 55 TRP HB2 H 1 3.478 0.030 . 2 . . . . 55 TRP HB2 . 10075 1 595 . 1 1 55 55 TRP HB3 H 1 2.854 0.030 . 2 . . . . 55 TRP HB3 . 10075 1 596 . 1 1 55 55 TRP HD1 H 1 6.675 0.030 . 1 . . . . 55 TRP HD1 . 10075 1 597 . 1 1 55 55 TRP HE1 H 1 10.236 0.030 . 1 . . . . 55 TRP HE1 . 10075 1 598 . 1 1 55 55 TRP HE3 H 1 7.186 0.030 . 1 . . . . 55 TRP HE3 . 10075 1 599 . 1 1 55 55 TRP HZ2 H 1 7.661 0.030 . 1 . . . . 55 TRP HZ2 . 10075 1 600 . 1 1 55 55 TRP HZ3 H 1 6.792 0.030 . 1 . . . . 55 TRP HZ3 . 10075 1 601 . 1 1 55 55 TRP HH2 H 1 7.213 0.030 . 1 . . . . 55 TRP HH2 . 10075 1 602 . 1 1 55 55 TRP C C 13 173.452 0.300 . 1 . . . . 55 TRP C . 10075 1 603 . 1 1 55 55 TRP CA C 13 56.127 0.300 . 1 . . . . 55 TRP CA . 10075 1 604 . 1 1 55 55 TRP CB C 13 33.529 0.300 . 1 . . . . 55 TRP CB . 10075 1 605 . 1 1 55 55 TRP CD1 C 13 125.997 0.300 . 1 . . . . 55 TRP CD1 . 10075 1 606 . 1 1 55 55 TRP CE3 C 13 121.010 0.300 . 1 . . . . 55 TRP CE3 . 10075 1 607 . 1 1 55 55 TRP CZ2 C 13 115.205 0.300 . 1 . . . . 55 TRP CZ2 . 10075 1 608 . 1 1 55 55 TRP CZ3 C 13 121.022 0.300 . 1 . . . . 55 TRP CZ3 . 10075 1 609 . 1 1 55 55 TRP CH2 C 13 123.998 0.300 . 1 . . . . 55 TRP CH2 . 10075 1 610 . 1 1 55 55 TRP N N 15 118.665 0.300 . 1 . . . . 55 TRP N . 10075 1 611 . 1 1 55 55 TRP NE1 N 15 129.837 0.300 . 1 . . . . 55 TRP NE1 . 10075 1 612 . 1 1 56 56 GLU H H 1 8.561 0.030 . 1 . . . . 56 GLU H . 10075 1 613 . 1 1 56 56 GLU HA H 1 4.870 0.030 . 1 . . . . 56 GLU HA . 10075 1 614 . 1 1 56 56 GLU HB2 H 1 1.933 0.030 . 2 . . . . 56 GLU HB2 . 10075 1 615 . 1 1 56 56 GLU HB3 H 1 1.841 0.030 . 2 . . . . 56 GLU HB3 . 10075 1 616 . 1 1 56 56 GLU HG2 H 1 2.195 0.030 . 2 . . . . 56 GLU HG2 . 10075 1 617 . 1 1 56 56 GLU HG3 H 1 2.026 0.030 . 2 . . . . 56 GLU HG3 . 10075 1 618 . 1 1 56 56 GLU C C 13 175.450 0.300 . 1 . . . . 56 GLU C . 10075 1 619 . 1 1 56 56 GLU CA C 13 53.684 0.300 . 1 . . . . 56 GLU CA . 10075 1 620 . 1 1 56 56 GLU CB C 13 32.675 0.300 . 1 . . . . 56 GLU CB . 10075 1 621 . 1 1 56 56 GLU CG C 13 34.285 0.300 . 1 . . . . 56 GLU CG . 10075 1 622 . 1 1 56 56 GLU N N 15 115.987 0.300 . 1 . . . . 56 GLU N . 10075 1 623 . 1 1 57 57 GLU H H 1 8.812 0.030 . 1 . . . . 57 GLU H . 10075 1 624 . 1 1 57 57 GLU HA H 1 3.923 0.030 . 1 . . . . 57 GLU HA . 10075 1 625 . 1 1 57 57 GLU HB2 H 1 1.951 0.030 . 2 . . . . 57 GLU HB2 . 10075 1 626 . 1 1 57 57 GLU HB3 H 1 1.886 0.030 . 2 . . . . 57 GLU HB3 . 10075 1 627 . 1 1 57 57 GLU HG2 H 1 2.385 0.030 . 2 . . . . 57 GLU HG2 . 10075 1 628 . 1 1 57 57 GLU HG3 H 1 2.042 0.030 . 2 . . . . 57 GLU HG3 . 10075 1 629 . 1 1 57 57 GLU C C 13 176.879 0.300 . 1 . . . . 57 GLU C . 10075 1 630 . 1 1 57 57 GLU CA C 13 57.334 0.300 . 1 . . . . 57 GLU CA . 10075 1 631 . 1 1 57 57 GLU CB C 13 29.325 0.300 . 1 . . . . 57 GLU CB . 10075 1 632 . 1 1 57 57 GLU CG C 13 36.851 0.300 . 1 . . . . 57 GLU CG . 10075 1 633 . 1 1 57 57 GLU N N 15 124.727 0.300 . 1 . . . . 57 GLU N . 10075 1 634 . 1 1 58 58 TYR H H 1 8.417 0.030 . 1 . . . . 58 TYR H . 10075 1 635 . 1 1 58 58 TYR HA H 1 4.088 0.030 . 1 . . . . 58 TYR HA . 10075 1 636 . 1 1 58 58 TYR HB2 H 1 2.615 0.030 . 2 . . . . 58 TYR HB2 . 10075 1 637 . 1 1 58 58 TYR HB3 H 1 2.562 0.030 . 2 . . . . 58 TYR HB3 . 10075 1 638 . 1 1 58 58 TYR HD1 H 1 6.989 0.030 . 1 . . . . 58 TYR HD1 . 10075 1 639 . 1 1 58 58 TYR HD2 H 1 6.989 0.030 . 1 . . . . 58 TYR HD2 . 10075 1 640 . 1 1 58 58 TYR HE1 H 1 6.779 0.030 . 1 . . . . 58 TYR HE1 . 10075 1 641 . 1 1 58 58 TYR HE2 H 1 6.779 0.030 . 1 . . . . 58 TYR HE2 . 10075 1 642 . 1 1 58 58 TYR C C 13 176.075 0.300 . 1 . . . . 58 TYR C . 10075 1 643 . 1 1 58 58 TYR CA C 13 59.517 0.300 . 1 . . . . 58 TYR CA . 10075 1 644 . 1 1 58 58 TYR CB C 13 38.906 0.300 . 1 . . . . 58 TYR CB . 10075 1 645 . 1 1 58 58 TYR CD1 C 13 133.023 0.300 . 1 . . . . 58 TYR CD1 . 10075 1 646 . 1 1 58 58 TYR CD2 C 13 133.023 0.300 . 1 . . . . 58 TYR CD2 . 10075 1 647 . 1 1 58 58 TYR CE1 C 13 118.342 0.300 . 1 . . . . 58 TYR CE1 . 10075 1 648 . 1 1 58 58 TYR CE2 C 13 118.342 0.300 . 1 . . . . 58 TYR CE2 . 10075 1 649 . 1 1 58 58 TYR N N 15 124.419 0.300 . 1 . . . . 58 TYR N . 10075 1 650 . 1 1 59 59 ASN H H 1 8.978 0.030 . 1 . . . . 59 ASN H . 10075 1 651 . 1 1 59 59 ASN HA H 1 4.118 0.030 . 1 . . . . 59 ASN HA . 10075 1 652 . 1 1 59 59 ASN HB2 H 1 2.922 0.030 . 2 . . . . 59 ASN HB2 . 10075 1 653 . 1 1 59 59 ASN HB3 H 1 2.234 0.030 . 2 . . . . 59 ASN HB3 . 10075 1 654 . 1 1 59 59 ASN HD21 H 1 7.269 0.030 . 2 . . . . 59 ASN HD21 . 10075 1 655 . 1 1 59 59 ASN HD22 H 1 6.541 0.030 . 2 . . . . 59 ASN HD22 . 10075 1 656 . 1 1 59 59 ASN C C 13 175.124 0.300 . 1 . . . . 59 ASN C . 10075 1 657 . 1 1 59 59 ASN CA C 13 53.603 0.300 . 1 . . . . 59 ASN CA . 10075 1 658 . 1 1 59 59 ASN CB C 13 37.865 0.300 . 1 . . . . 59 ASN CB . 10075 1 659 . 1 1 59 59 ASN N N 15 121.321 0.300 . 1 . . . . 59 ASN N . 10075 1 660 . 1 1 59 59 ASN ND2 N 15 110.738 0.300 . 1 . . . . 59 ASN ND2 . 10075 1 661 . 1 1 60 60 ARG H H 1 8.197 0.030 . 1 . . . . 60 ARG H . 10075 1 662 . 1 1 60 60 ARG HA H 1 4.772 0.030 . 1 . . . . 60 ARG HA . 10075 1 663 . 1 1 60 60 ARG HB2 H 1 1.763 0.030 . 2 . . . . 60 ARG HB2 . 10075 1 664 . 1 1 60 60 ARG HB3 H 1 1.646 0.030 . 2 . . . . 60 ARG HB3 . 10075 1 665 . 1 1 60 60 ARG HG2 H 1 1.568 0.030 . 2 . . . . 60 ARG HG2 . 10075 1 666 . 1 1 60 60 ARG HG3 H 1 1.507 0.030 . 2 . . . . 60 ARG HG3 . 10075 1 667 . 1 1 60 60 ARG HD2 H 1 3.226 0.030 . 2 . . . . 60 ARG HD2 . 10075 1 668 . 1 1 60 60 ARG HD3 H 1 3.151 0.030 . 2 . . . . 60 ARG HD3 . 10075 1 669 . 1 1 60 60 ARG C C 13 176.649 0.300 . 1 . . . . 60 ARG C . 10075 1 670 . 1 1 60 60 ARG CA C 13 54.374 0.300 . 1 . . . . 60 ARG CA . 10075 1 671 . 1 1 60 60 ARG CB C 13 30.921 0.300 . 1 . . . . 60 ARG CB . 10075 1 672 . 1 1 60 60 ARG CG C 13 26.403 0.300 . 1 . . . . 60 ARG CG . 10075 1 673 . 1 1 60 60 ARG CD C 13 43.688 0.300 . 1 . . . . 60 ARG CD . 10075 1 674 . 1 1 60 60 ARG N N 15 119.697 0.300 . 1 . . . . 60 ARG N . 10075 1 675 . 1 1 61 61 THR H H 1 8.608 0.030 . 1 . . . . 61 THR H . 10075 1 676 . 1 1 61 61 THR HA H 1 4.063 0.030 . 1 . . . . 61 THR HA . 10075 1 677 . 1 1 61 61 THR HB H 1 4.128 0.030 . 1 . . . . 61 THR HB . 10075 1 678 . 1 1 61 61 THR HG21 H 1 1.215 0.030 . 1 . . . . 61 THR HG2 . 10075 1 679 . 1 1 61 61 THR HG22 H 1 1.215 0.030 . 1 . . . . 61 THR HG2 . 10075 1 680 . 1 1 61 61 THR HG23 H 1 1.215 0.030 . 1 . . . . 61 THR HG2 . 10075 1 681 . 1 1 61 61 THR C C 13 175.514 0.300 . 1 . . . . 61 THR C . 10075 1 682 . 1 1 61 61 THR CA C 13 64.907 0.300 . 1 . . . . 61 THR CA . 10075 1 683 . 1 1 61 61 THR CB C 13 69.059 0.300 . 1 . . . . 61 THR CB . 10075 1 684 . 1 1 61 61 THR CG2 C 13 21.584 0.300 . 1 . . . . 61 THR CG2 . 10075 1 685 . 1 1 62 62 ASN H H 1 8.780 0.030 . 1 . . . . 62 ASN H . 10075 1 686 . 1 1 62 62 ASN HA H 1 4.582 0.030 . 1 . . . . 62 ASN HA . 10075 1 687 . 1 1 62 62 ASN HB2 H 1 2.943 0.030 . 2 . . . . 62 ASN HB2 . 10075 1 688 . 1 1 62 62 ASN HB3 H 1 2.872 0.030 . 2 . . . . 62 ASN HB3 . 10075 1 689 . 1 1 62 62 ASN HD21 H 1 7.645 0.030 . 2 . . . . 62 ASN HD21 . 10075 1 690 . 1 1 62 62 ASN HD22 H 1 6.812 0.030 . 2 . . . . 62 ASN HD22 . 10075 1 691 . 1 1 62 62 ASN C C 13 175.869 0.300 . 1 . . . . 62 ASN C . 10075 1 692 . 1 1 62 62 ASN CA C 13 55.016 0.300 . 1 . . . . 62 ASN CA . 10075 1 693 . 1 1 62 62 ASN CB C 13 36.902 0.300 . 1 . . . . 62 ASN CB . 10075 1 694 . 1 1 62 62 ASN N N 15 117.831 0.300 . 1 . . . . 62 ASN N . 10075 1 695 . 1 1 62 62 ASN ND2 N 15 113.179 0.300 . 1 . . . . 62 ASN ND2 . 10075 1 696 . 1 1 63 63 THR H H 1 7.965 0.030 . 1 . . . . 63 THR H . 10075 1 697 . 1 1 63 63 THR HA H 1 4.514 0.030 . 1 . . . . 63 THR HA . 10075 1 698 . 1 1 63 63 THR HB H 1 4.700 0.030 . 1 . . . . 63 THR HB . 10075 1 699 . 1 1 63 63 THR HG21 H 1 1.197 0.030 . 1 . . . . 63 THR HG2 . 10075 1 700 . 1 1 63 63 THR HG22 H 1 1.197 0.030 . 1 . . . . 63 THR HG2 . 10075 1 701 . 1 1 63 63 THR HG23 H 1 1.197 0.030 . 1 . . . . 63 THR HG2 . 10075 1 702 . 1 1 63 63 THR C C 13 174.552 0.300 . 1 . . . . 63 THR C . 10075 1 703 . 1 1 63 63 THR CA C 13 61.732 0.300 . 1 . . . . 63 THR CA . 10075 1 704 . 1 1 63 63 THR CB C 13 71.377 0.300 . 1 . . . . 63 THR CB . 10075 1 705 . 1 1 63 63 THR CG2 C 13 21.773 0.300 . 1 . . . . 63 THR CG2 . 10075 1 706 . 1 1 63 63 THR N N 15 108.898 0.300 . 1 . . . . 63 THR N . 10075 1 707 . 1 1 64 64 ARG H H 1 7.434 0.030 . 1 . . . . 64 ARG H . 10075 1 708 . 1 1 64 64 ARG HA H 1 4.683 0.030 . 1 . . . . 64 ARG HA . 10075 1 709 . 1 1 64 64 ARG HB2 H 1 2.114 0.030 . 2 . . . . 64 ARG HB2 . 10075 1 710 . 1 1 64 64 ARG HB3 H 1 1.643 0.030 . 2 . . . . 64 ARG HB3 . 10075 1 711 . 1 1 64 64 ARG HG2 H 1 1.316 0.030 . 2 . . . . 64 ARG HG2 . 10075 1 712 . 1 1 64 64 ARG HG3 H 1 1.254 0.030 . 2 . . . . 64 ARG HG3 . 10075 1 713 . 1 1 64 64 ARG HD2 H 1 3.024 0.030 . 2 . . . . 64 ARG HD2 . 10075 1 714 . 1 1 64 64 ARG HD3 H 1 2.999 0.030 . 2 . . . . 64 ARG HD3 . 10075 1 715 . 1 1 64 64 ARG HE H 1 7.136 0.030 . 1 . . . . 64 ARG HE . 10075 1 716 . 1 1 64 64 ARG C C 13 175.778 0.300 . 1 . . . . 64 ARG C . 10075 1 717 . 1 1 64 64 ARG CA C 13 57.308 0.300 . 1 . . . . 64 ARG CA . 10075 1 718 . 1 1 64 64 ARG CB C 13 31.399 0.300 . 1 . . . . 64 ARG CB . 10075 1 719 . 1 1 64 64 ARG CG C 13 27.495 0.300 . 1 . . . . 64 ARG CG . 10075 1 720 . 1 1 64 64 ARG CD C 13 43.394 0.300 . 1 . . . . 64 ARG CD . 10075 1 721 . 1 1 64 64 ARG N N 15 123.980 0.300 . 1 . . . . 64 ARG N . 10075 1 722 . 1 1 64 64 ARG NE N 15 84.104 0.300 . 1 . . . . 64 ARG NE . 10075 1 723 . 1 1 65 65 VAL H H 1 8.703 0.030 . 1 . . . . 65 VAL H . 10075 1 724 . 1 1 65 65 VAL HA H 1 3.860 0.030 . 1 . . . . 65 VAL HA . 10075 1 725 . 1 1 65 65 VAL HB H 1 0.297 0.030 . 1 . . . . 65 VAL HB . 10075 1 726 . 1 1 65 65 VAL HG11 H 1 0.378 0.030 . 1 . . . . 65 VAL HG1 . 10075 1 727 . 1 1 65 65 VAL HG12 H 1 0.378 0.030 . 1 . . . . 65 VAL HG1 . 10075 1 728 . 1 1 65 65 VAL HG13 H 1 0.378 0.030 . 1 . . . . 65 VAL HG1 . 10075 1 729 . 1 1 65 65 VAL HG21 H 1 0.650 0.030 . 1 . . . . 65 VAL HG2 . 10075 1 730 . 1 1 65 65 VAL HG22 H 1 0.650 0.030 . 1 . . . . 65 VAL HG2 . 10075 1 731 . 1 1 65 65 VAL HG23 H 1 0.650 0.030 . 1 . . . . 65 VAL HG2 . 10075 1 732 . 1 1 65 65 VAL C C 13 173.743 0.300 . 1 . . . . 65 VAL C . 10075 1 733 . 1 1 65 65 VAL CA C 13 61.400 0.300 . 1 . . . . 65 VAL CA . 10075 1 734 . 1 1 65 65 VAL CB C 13 33.938 0.300 . 1 . . . . 65 VAL CB . 10075 1 735 . 1 1 65 65 VAL CG1 C 13 22.020 0.300 . 2 . . . . 65 VAL CG1 . 10075 1 736 . 1 1 65 65 VAL CG2 C 13 20.543 0.300 . 2 . . . . 65 VAL CG2 . 10075 1 737 . 1 1 65 65 VAL N N 15 130.520 0.300 . 1 . . . . 65 VAL N . 10075 1 738 . 1 1 66 66 THR H H 1 7.780 0.030 . 1 . . . . 66 THR H . 10075 1 739 . 1 1 66 66 THR HA H 1 4.847 0.030 . 1 . . . . 66 THR HA . 10075 1 740 . 1 1 66 66 THR HB H 1 3.569 0.030 . 1 . . . . 66 THR HB . 10075 1 741 . 1 1 66 66 THR HG21 H 1 0.676 0.030 . 1 . . . . 66 THR HG2 . 10075 1 742 . 1 1 66 66 THR HG22 H 1 0.676 0.030 . 1 . . . . 66 THR HG2 . 10075 1 743 . 1 1 66 66 THR HG23 H 1 0.676 0.030 . 1 . . . . 66 THR HG2 . 10075 1 744 . 1 1 66 66 THR C C 13 173.129 0.300 . 1 . . . . 66 THR C . 10075 1 745 . 1 1 66 66 THR CA C 13 61.332 0.300 . 1 . . . . 66 THR CA . 10075 1 746 . 1 1 66 66 THR CB C 13 71.721 0.300 . 1 . . . . 66 THR CB . 10075 1 747 . 1 1 66 66 THR CG2 C 13 21.714 0.300 . 1 . . . . 66 THR CG2 . 10075 1 748 . 1 1 66 66 THR N N 15 119.564 0.300 . 1 . . . . 66 THR N . 10075 1 749 . 1 1 67 67 HIS H H 1 9.340 0.030 . 1 . . . . 67 HIS H . 10075 1 750 . 1 1 67 67 HIS HA H 1 4.815 0.030 . 1 . . . . 67 HIS HA . 10075 1 751 . 1 1 67 67 HIS HB2 H 1 2.874 0.030 . 2 . . . . 67 HIS HB2 . 10075 1 752 . 1 1 67 67 HIS HB3 H 1 2.633 0.030 . 2 . . . . 67 HIS HB3 . 10075 1 753 . 1 1 67 67 HIS HD2 H 1 6.593 0.030 . 1 . . . . 67 HIS HD2 . 10075 1 754 . 1 1 67 67 HIS HE1 H 1 7.966 0.030 . 1 . . . . 67 HIS HE1 . 10075 1 755 . 1 1 67 67 HIS C C 13 172.558 0.300 . 1 . . . . 67 HIS C . 10075 1 756 . 1 1 67 67 HIS CA C 13 54.764 0.300 . 1 . . . . 67 HIS CA . 10075 1 757 . 1 1 67 67 HIS CB C 13 35.145 0.300 . 1 . . . . 67 HIS CB . 10075 1 758 . 1 1 67 67 HIS CD2 C 13 118.384 0.300 . 1 . . . . 67 HIS CD2 . 10075 1 759 . 1 1 67 67 HIS CE1 C 13 138.673 0.300 . 1 . . . . 67 HIS CE1 . 10075 1 760 . 1 1 67 67 HIS N N 15 126.046 0.300 . 1 . . . . 67 HIS N . 10075 1 761 . 1 1 68 68 TYR H H 1 8.384 0.030 . 1 . . . . 68 TYR H . 10075 1 762 . 1 1 68 68 TYR HA H 1 5.127 0.030 . 1 . . . . 68 TYR HA . 10075 1 763 . 1 1 68 68 TYR HB2 H 1 2.984 0.030 . 2 . . . . 68 TYR HB2 . 10075 1 764 . 1 1 68 68 TYR HB3 H 1 2.731 0.030 . 2 . . . . 68 TYR HB3 . 10075 1 765 . 1 1 68 68 TYR HD1 H 1 7.039 0.030 . 1 . . . . 68 TYR HD1 . 10075 1 766 . 1 1 68 68 TYR HD2 H 1 7.039 0.030 . 1 . . . . 68 TYR HD2 . 10075 1 767 . 1 1 68 68 TYR HE1 H 1 6.653 0.030 . 1 . . . . 68 TYR HE1 . 10075 1 768 . 1 1 68 68 TYR HE2 H 1 6.653 0.030 . 1 . . . . 68 TYR HE2 . 10075 1 769 . 1 1 68 68 TYR C C 13 175.277 0.300 . 1 . . . . 68 TYR C . 10075 1 770 . 1 1 68 68 TYR CA C 13 57.645 0.300 . 1 . . . . 68 TYR CA . 10075 1 771 . 1 1 68 68 TYR CB C 13 39.571 0.300 . 1 . . . . 68 TYR CB . 10075 1 772 . 1 1 68 68 TYR CD1 C 13 132.946 0.300 . 1 . . . . 68 TYR CD1 . 10075 1 773 . 1 1 68 68 TYR CD2 C 13 132.946 0.300 . 1 . . . . 68 TYR CD2 . 10075 1 774 . 1 1 68 68 TYR CE1 C 13 117.809 0.300 . 1 . . . . 68 TYR CE1 . 10075 1 775 . 1 1 68 68 TYR CE2 C 13 117.809 0.300 . 1 . . . . 68 TYR CE2 . 10075 1 776 . 1 1 68 68 TYR N N 15 120.321 0.300 . 1 . . . . 68 TYR N . 10075 1 777 . 1 1 69 69 LEU H H 1 9.589 0.030 . 1 . . . . 69 LEU H . 10075 1 778 . 1 1 69 69 LEU HA H 1 5.103 0.030 . 1 . . . . 69 LEU HA . 10075 1 779 . 1 1 69 69 LEU HB2 H 1 1.923 0.030 . 1 . . . . 69 LEU HB2 . 10075 1 780 . 1 1 69 69 LEU HB3 H 1 1.923 0.030 . 1 . . . . 69 LEU HB3 . 10075 1 781 . 1 1 69 69 LEU HG H 1 1.590 0.030 . 1 . . . . 69 LEU HG . 10075 1 782 . 1 1 69 69 LEU HD11 H 1 0.954 0.030 . 1 . . . . 69 LEU HD1 . 10075 1 783 . 1 1 69 69 LEU HD12 H 1 0.954 0.030 . 1 . . . . 69 LEU HD1 . 10075 1 784 . 1 1 69 69 LEU HD13 H 1 0.954 0.030 . 1 . . . . 69 LEU HD1 . 10075 1 785 . 1 1 69 69 LEU HD21 H 1 0.949 0.030 . 1 . . . . 69 LEU HD2 . 10075 1 786 . 1 1 69 69 LEU HD22 H 1 0.949 0.030 . 1 . . . . 69 LEU HD2 . 10075 1 787 . 1 1 69 69 LEU HD23 H 1 0.949 0.030 . 1 . . . . 69 LEU HD2 . 10075 1 788 . 1 1 69 69 LEU C C 13 175.522 0.300 . 1 . . . . 69 LEU C . 10075 1 789 . 1 1 69 69 LEU CA C 13 51.884 0.300 . 1 . . . . 69 LEU CA . 10075 1 790 . 1 1 69 69 LEU CB C 13 44.019 0.300 . 1 . . . . 69 LEU CB . 10075 1 791 . 1 1 69 69 LEU CG C 13 27.285 0.300 . 1 . . . . 69 LEU CG . 10075 1 792 . 1 1 69 69 LEU CD1 C 13 26.029 0.300 . 2 . . . . 69 LEU CD1 . 10075 1 793 . 1 1 69 69 LEU CD2 C 13 23.480 0.300 . 2 . . . . 69 LEU CD2 . 10075 1 794 . 1 1 69 69 LEU N N 15 124.171 0.300 . 1 . . . . 69 LEU N . 10075 1 795 . 1 1 70 70 PRO HA H 1 4.950 0.030 . 1 . . . . 70 PRO HA . 10075 1 796 . 1 1 70 70 PRO HB2 H 1 2.618 0.030 . 2 . . . . 70 PRO HB2 . 10075 1 797 . 1 1 70 70 PRO HB3 H 1 2.190 0.030 . 2 . . . . 70 PRO HB3 . 10075 1 798 . 1 1 70 70 PRO HG2 H 1 2.212 0.030 . 1 . . . . 70 PRO HG2 . 10075 1 799 . 1 1 70 70 PRO HG3 H 1 2.212 0.030 . 1 . . . . 70 PRO HG3 . 10075 1 800 . 1 1 70 70 PRO HD2 H 1 4.033 0.030 . 2 . . . . 70 PRO HD2 . 10075 1 801 . 1 1 70 70 PRO HD3 H 1 3.884 0.030 . 2 . . . . 70 PRO HD3 . 10075 1 802 . 1 1 70 70 PRO C C 13 176.547 0.300 . 1 . . . . 70 PRO C . 10075 1 803 . 1 1 70 70 PRO CA C 13 62.612 0.300 . 1 . . . . 70 PRO CA . 10075 1 804 . 1 1 70 70 PRO CB C 13 33.369 0.300 . 1 . . . . 70 PRO CB . 10075 1 805 . 1 1 70 70 PRO CG C 13 27.286 0.300 . 1 . . . . 70 PRO CG . 10075 1 806 . 1 1 70 70 PRO CD C 13 50.458 0.300 . 1 . . . . 70 PRO CD . 10075 1 807 . 1 1 71 71 ASN H H 1 8.790 0.030 . 1 . . . . 71 ASN H . 10075 1 808 . 1 1 71 71 ASN HA H 1 4.249 0.030 . 1 . . . . 71 ASN HA . 10075 1 809 . 1 1 71 71 ASN HB2 H 1 2.940 0.030 . 2 . . . . 71 ASN HB2 . 10075 1 810 . 1 1 71 71 ASN HB3 H 1 2.217 0.030 . 2 . . . . 71 ASN HB3 . 10075 1 811 . 1 1 71 71 ASN HD21 H 1 7.456 0.030 . 2 . . . . 71 ASN HD21 . 10075 1 812 . 1 1 71 71 ASN HD22 H 1 6.839 0.030 . 2 . . . . 71 ASN HD22 . 10075 1 813 . 1 1 71 71 ASN C C 13 175.122 0.300 . 1 . . . . 71 ASN C . 10075 1 814 . 1 1 71 71 ASN CA C 13 55.126 0.300 . 1 . . . . 71 ASN CA . 10075 1 815 . 1 1 71 71 ASN CB C 13 37.228 0.300 . 1 . . . . 71 ASN CB . 10075 1 816 . 1 1 71 71 ASN N N 15 115.380 0.300 . 1 . . . . 71 ASN N . 10075 1 817 . 1 1 71 71 ASN ND2 N 15 110.596 0.300 . 1 . . . . 71 ASN ND2 . 10075 1 818 . 1 1 72 72 VAL H H 1 6.763 0.030 . 1 . . . . 72 VAL H . 10075 1 819 . 1 1 72 72 VAL HA H 1 4.427 0.030 . 1 . . . . 72 VAL HA . 10075 1 820 . 1 1 72 72 VAL HB H 1 2.532 0.030 . 1 . . . . 72 VAL HB . 10075 1 821 . 1 1 72 72 VAL HG11 H 1 1.044 0.030 . 1 . . . . 72 VAL HG1 . 10075 1 822 . 1 1 72 72 VAL HG12 H 1 1.044 0.030 . 1 . . . . 72 VAL HG1 . 10075 1 823 . 1 1 72 72 VAL HG13 H 1 1.044 0.030 . 1 . . . . 72 VAL HG1 . 10075 1 824 . 1 1 72 72 VAL HG21 H 1 0.920 0.030 . 1 . . . . 72 VAL HG2 . 10075 1 825 . 1 1 72 72 VAL HG22 H 1 0.920 0.030 . 1 . . . . 72 VAL HG2 . 10075 1 826 . 1 1 72 72 VAL HG23 H 1 0.920 0.030 . 1 . . . . 72 VAL HG2 . 10075 1 827 . 1 1 72 72 VAL C C 13 175.476 0.300 . 1 . . . . 72 VAL C . 10075 1 828 . 1 1 72 72 VAL CA C 13 61.124 0.300 . 1 . . . . 72 VAL CA . 10075 1 829 . 1 1 72 72 VAL CB C 13 31.852 0.300 . 1 . . . . 72 VAL CB . 10075 1 830 . 1 1 72 72 VAL CG1 C 13 21.601 0.300 . 2 . . . . 72 VAL CG1 . 10075 1 831 . 1 1 72 72 VAL CG2 C 13 18.176 0.300 . 2 . . . . 72 VAL CG2 . 10075 1 832 . 1 1 72 72 VAL N N 15 109.129 0.300 . 1 . . . . 72 VAL N . 10075 1 833 . 1 1 73 73 THR H H 1 7.777 0.030 . 1 . . . . 73 THR H . 10075 1 834 . 1 1 73 73 THR HA H 1 4.171 0.030 . 1 . . . . 73 THR HA . 10075 1 835 . 1 1 73 73 THR HB H 1 4.266 0.030 . 1 . . . . 73 THR HB . 10075 1 836 . 1 1 73 73 THR HG21 H 1 1.570 0.030 . 1 . . . . 73 THR HG2 . 10075 1 837 . 1 1 73 73 THR HG22 H 1 1.570 0.030 . 1 . . . . 73 THR HG2 . 10075 1 838 . 1 1 73 73 THR HG23 H 1 1.570 0.030 . 1 . . . . 73 THR HG2 . 10075 1 839 . 1 1 73 73 THR C C 13 170.883 0.300 . 1 . . . . 73 THR C . 10075 1 840 . 1 1 73 73 THR CA C 13 63.683 0.300 . 1 . . . . 73 THR CA . 10075 1 841 . 1 1 73 73 THR CB C 13 69.700 0.300 . 1 . . . . 73 THR CB . 10075 1 842 . 1 1 73 73 THR CG2 C 13 24.226 0.300 . 1 . . . . 73 THR CG2 . 10075 1 843 . 1 1 73 73 THR N N 15 121.587 0.300 . 1 . . . . 73 THR N . 10075 1 844 . 1 1 74 74 LEU H H 1 7.764 0.030 . 1 . . . . 74 LEU H . 10075 1 845 . 1 1 74 74 LEU HA H 1 3.211 0.030 . 1 . . . . 74 LEU HA . 10075 1 846 . 1 1 74 74 LEU HB2 H 1 1.481 0.030 . 2 . . . . 74 LEU HB2 . 10075 1 847 . 1 1 74 74 LEU HB3 H 1 0.894 0.030 . 2 . . . . 74 LEU HB3 . 10075 1 848 . 1 1 74 74 LEU HG H 1 1.220 0.030 . 1 . . . . 74 LEU HG . 10075 1 849 . 1 1 74 74 LEU HD11 H 1 0.812 0.030 . 1 . . . . 74 LEU HD1 . 10075 1 850 . 1 1 74 74 LEU HD12 H 1 0.812 0.030 . 1 . . . . 74 LEU HD1 . 10075 1 851 . 1 1 74 74 LEU HD13 H 1 0.812 0.030 . 1 . . . . 74 LEU HD1 . 10075 1 852 . 1 1 74 74 LEU HD21 H 1 0.614 0.030 . 1 . . . . 74 LEU HD2 . 10075 1 853 . 1 1 74 74 LEU HD22 H 1 0.614 0.030 . 1 . . . . 74 LEU HD2 . 10075 1 854 . 1 1 74 74 LEU HD23 H 1 0.614 0.030 . 1 . . . . 74 LEU HD2 . 10075 1 855 . 1 1 74 74 LEU C C 13 173.906 0.300 . 1 . . . . 74 LEU C . 10075 1 856 . 1 1 74 74 LEU CA C 13 52.849 0.300 . 1 . . . . 74 LEU CA . 10075 1 857 . 1 1 74 74 LEU CB C 13 41.711 0.300 . 1 . . . . 74 LEU CB . 10075 1 858 . 1 1 74 74 LEU CG C 13 27.129 0.300 . 1 . . . . 74 LEU CG . 10075 1 859 . 1 1 74 74 LEU CD1 C 13 26.045 0.300 . 2 . . . . 74 LEU CD1 . 10075 1 860 . 1 1 74 74 LEU CD2 C 13 23.691 0.300 . 2 . . . . 74 LEU CD2 . 10075 1 861 . 1 1 74 74 LEU N N 15 123.778 0.300 . 1 . . . . 74 LEU N . 10075 1 862 . 1 1 75 75 GLU H H 1 6.685 0.030 . 1 . . . . 75 GLU H . 10075 1 863 . 1 1 75 75 GLU HA H 1 4.616 0.030 . 1 . . . . 75 GLU HA . 10075 1 864 . 1 1 75 75 GLU HB2 H 1 1.724 0.030 . 2 . . . . 75 GLU HB2 . 10075 1 865 . 1 1 75 75 GLU HB3 H 1 1.504 0.030 . 2 . . . . 75 GLU HB3 . 10075 1 866 . 1 1 75 75 GLU HG2 H 1 1.933 0.030 . 2 . . . . 75 GLU HG2 . 10075 1 867 . 1 1 75 75 GLU HG3 H 1 1.700 0.030 . 2 . . . . 75 GLU HG3 . 10075 1 868 . 1 1 75 75 GLU C C 13 174.853 0.300 . 1 . . . . 75 GLU C . 10075 1 869 . 1 1 75 75 GLU CA C 13 53.659 0.300 . 1 . . . . 75 GLU CA . 10075 1 870 . 1 1 75 75 GLU CB C 13 32.941 0.300 . 1 . . . . 75 GLU CB . 10075 1 871 . 1 1 75 75 GLU CG C 13 34.761 0.300 . 1 . . . . 75 GLU CG . 10075 1 872 . 1 1 75 75 GLU N N 15 112.013 0.300 . 1 . . . . 75 GLU N . 10075 1 873 . 1 1 76 76 TYR H H 1 9.289 0.030 . 1 . . . . 76 TYR H . 10075 1 874 . 1 1 76 76 TYR HA H 1 4.439 0.030 . 1 . . . . 76 TYR HA . 10075 1 875 . 1 1 76 76 TYR HB2 H 1 3.190 0.030 . 2 . . . . 76 TYR HB2 . 10075 1 876 . 1 1 76 76 TYR HB3 H 1 2.636 0.030 . 2 . . . . 76 TYR HB3 . 10075 1 877 . 1 1 76 76 TYR HD1 H 1 6.986 0.030 . 1 . . . . 76 TYR HD1 . 10075 1 878 . 1 1 76 76 TYR HD2 H 1 6.986 0.030 . 1 . . . . 76 TYR HD2 . 10075 1 879 . 1 1 76 76 TYR HE1 H 1 6.810 0.030 . 1 . . . . 76 TYR HE1 . 10075 1 880 . 1 1 76 76 TYR HE2 H 1 6.810 0.030 . 1 . . . . 76 TYR HE2 . 10075 1 881 . 1 1 76 76 TYR C C 13 172.661 0.300 . 1 . . . . 76 TYR C . 10075 1 882 . 1 1 76 76 TYR CA C 13 59.013 0.300 . 1 . . . . 76 TYR CA . 10075 1 883 . 1 1 76 76 TYR CB C 13 43.340 0.300 . 1 . . . . 76 TYR CB . 10075 1 884 . 1 1 76 76 TYR CD1 C 13 132.713 0.300 . 1 . . . . 76 TYR CD1 . 10075 1 885 . 1 1 76 76 TYR CD2 C 13 132.713 0.300 . 1 . . . . 76 TYR CD2 . 10075 1 886 . 1 1 76 76 TYR CE1 C 13 118.694 0.300 . 1 . . . . 76 TYR CE1 . 10075 1 887 . 1 1 76 76 TYR CE2 C 13 118.694 0.300 . 1 . . . . 76 TYR CE2 . 10075 1 888 . 1 1 76 76 TYR N N 15 120.617 0.300 . 1 . . . . 76 TYR N . 10075 1 889 . 1 1 77 77 ARG H H 1 7.711 0.030 . 1 . . . . 77 ARG H . 10075 1 890 . 1 1 77 77 ARG HA H 1 4.611 0.030 . 1 . . . . 77 ARG HA . 10075 1 891 . 1 1 77 77 ARG HB2 H 1 1.505 0.030 . 2 . . . . 77 ARG HB2 . 10075 1 892 . 1 1 77 77 ARG HB3 H 1 1.263 0.030 . 2 . . . . 77 ARG HB3 . 10075 1 893 . 1 1 77 77 ARG HG2 H 1 1.263 0.030 . 2 . . . . 77 ARG HG2 . 10075 1 894 . 1 1 77 77 ARG HG3 H 1 1.078 0.030 . 2 . . . . 77 ARG HG3 . 10075 1 895 . 1 1 77 77 ARG HD2 H 1 3.004 0.030 . 2 . . . . 77 ARG HD2 . 10075 1 896 . 1 1 77 77 ARG HD3 H 1 2.943 0.030 . 2 . . . . 77 ARG HD3 . 10075 1 897 . 1 1 77 77 ARG C C 13 173.592 0.300 . 1 . . . . 77 ARG C . 10075 1 898 . 1 1 77 77 ARG CA C 13 54.690 0.300 . 1 . . . . 77 ARG CA . 10075 1 899 . 1 1 77 77 ARG CB C 13 29.712 0.300 . 1 . . . . 77 ARG CB . 10075 1 900 . 1 1 77 77 ARG CG C 13 27.035 0.300 . 1 . . . . 77 ARG CG . 10075 1 901 . 1 1 77 77 ARG CD C 13 42.502 0.300 . 1 . . . . 77 ARG CD . 10075 1 902 . 1 1 77 77 ARG N N 15 128.516 0.300 . 1 . . . . 77 ARG N . 10075 1 903 . 1 1 78 78 VAL H H 1 8.540 0.030 . 1 . . . . 78 VAL H . 10075 1 904 . 1 1 78 78 VAL HA H 1 3.133 0.030 . 1 . . . . 78 VAL HA . 10075 1 905 . 1 1 78 78 VAL HB H 1 1.276 0.030 . 1 . . . . 78 VAL HB . 10075 1 906 . 1 1 78 78 VAL HG11 H 1 0.378 0.030 . 1 . . . . 78 VAL HG1 . 10075 1 907 . 1 1 78 78 VAL HG12 H 1 0.378 0.030 . 1 . . . . 78 VAL HG1 . 10075 1 908 . 1 1 78 78 VAL HG13 H 1 0.378 0.030 . 1 . . . . 78 VAL HG1 . 10075 1 909 . 1 1 78 78 VAL HG21 H 1 -0.684 0.030 . 1 . . . . 78 VAL HG2 . 10075 1 910 . 1 1 78 78 VAL HG22 H 1 -0.684 0.030 . 1 . . . . 78 VAL HG2 . 10075 1 911 . 1 1 78 78 VAL HG23 H 1 -0.684 0.030 . 1 . . . . 78 VAL HG2 . 10075 1 912 . 1 1 78 78 VAL C C 13 174.942 0.300 . 1 . . . . 78 VAL C . 10075 1 913 . 1 1 78 78 VAL CA C 13 62.825 0.300 . 1 . . . . 78 VAL CA . 10075 1 914 . 1 1 78 78 VAL CB C 13 31.558 0.300 . 1 . . . . 78 VAL CB . 10075 1 915 . 1 1 78 78 VAL CG1 C 13 21.598 0.300 . 2 . . . . 78 VAL CG1 . 10075 1 916 . 1 1 78 78 VAL CG2 C 13 20.404 0.300 . 2 . . . . 78 VAL CG2 . 10075 1 917 . 1 1 78 78 VAL N N 15 130.372 0.300 . 1 . . . . 78 VAL N . 10075 1 918 . 1 1 79 79 THR H H 1 7.121 0.030 . 1 . . . . 79 THR H . 10075 1 919 . 1 1 79 79 THR HA H 1 4.867 0.030 . 1 . . . . 79 THR HA . 10075 1 920 . 1 1 79 79 THR HB H 1 4.364 0.030 . 1 . . . . 79 THR HB . 10075 1 921 . 1 1 79 79 THR HG21 H 1 0.985 0.030 . 1 . . . . 79 THR HG2 . 10075 1 922 . 1 1 79 79 THR HG22 H 1 0.985 0.030 . 1 . . . . 79 THR HG2 . 10075 1 923 . 1 1 79 79 THR HG23 H 1 0.985 0.030 . 1 . . . . 79 THR HG2 . 10075 1 924 . 1 1 79 79 THR C C 13 173.970 0.300 . 1 . . . . 79 THR C . 10075 1 925 . 1 1 79 79 THR CA C 13 59.650 0.300 . 1 . . . . 79 THR CA . 10075 1 926 . 1 1 79 79 THR CB C 13 72.042 0.300 . 1 . . . . 79 THR CB . 10075 1 927 . 1 1 79 79 THR CG2 C 13 21.312 0.300 . 1 . . . . 79 THR CG2 . 10075 1 928 . 1 1 79 79 THR N N 15 114.090 0.300 . 1 . . . . 79 THR N . 10075 1 929 . 1 1 80 80 GLY H H 1 8.733 0.030 . 1 . . . . 80 GLY H . 10075 1 930 . 1 1 80 80 GLY HA2 H 1 4.139 0.030 . 2 . . . . 80 GLY HA2 . 10075 1 931 . 1 1 80 80 GLY HA3 H 1 3.937 0.030 . 2 . . . . 80 GLY HA3 . 10075 1 932 . 1 1 80 80 GLY C C 13 175.745 0.300 . 1 . . . . 80 GLY C . 10075 1 933 . 1 1 80 80 GLY CA C 13 46.177 0.300 . 1 . . . . 80 GLY CA . 10075 1 934 . 1 1 80 80 GLY N N 15 106.384 0.300 . 1 . . . . 80 GLY N . 10075 1 935 . 1 1 81 81 LEU H H 1 8.264 0.030 . 1 . . . . 81 LEU H . 10075 1 936 . 1 1 81 81 LEU HA H 1 4.375 0.030 . 1 . . . . 81 LEU HA . 10075 1 937 . 1 1 81 81 LEU HB2 H 1 1.425 0.030 . 2 . . . . 81 LEU HB2 . 10075 1 938 . 1 1 81 81 LEU HB3 H 1 1.175 0.030 . 2 . . . . 81 LEU HB3 . 10075 1 939 . 1 1 81 81 LEU HG H 1 0.806 0.030 . 1 . . . . 81 LEU HG . 10075 1 940 . 1 1 81 81 LEU HD11 H 1 -0.023 0.030 . 1 . . . . 81 LEU HD1 . 10075 1 941 . 1 1 81 81 LEU HD12 H 1 -0.023 0.030 . 1 . . . . 81 LEU HD1 . 10075 1 942 . 1 1 81 81 LEU HD13 H 1 -0.023 0.030 . 1 . . . . 81 LEU HD1 . 10075 1 943 . 1 1 81 81 LEU HD21 H 1 -0.329 0.030 . 1 . . . . 81 LEU HD2 . 10075 1 944 . 1 1 81 81 LEU HD22 H 1 -0.329 0.030 . 1 . . . . 81 LEU HD2 . 10075 1 945 . 1 1 81 81 LEU HD23 H 1 -0.329 0.030 . 1 . . . . 81 LEU HD2 . 10075 1 946 . 1 1 81 81 LEU C C 13 175.436 0.300 . 1 . . . . 81 LEU C . 10075 1 947 . 1 1 81 81 LEU CA C 13 53.510 0.300 . 1 . . . . 81 LEU CA . 10075 1 948 . 1 1 81 81 LEU CB C 13 40.120 0.300 . 1 . . . . 81 LEU CB . 10075 1 949 . 1 1 81 81 LEU CG C 13 26.012 0.300 . 1 . . . . 81 LEU CG . 10075 1 950 . 1 1 81 81 LEU CD1 C 13 24.351 0.300 . 2 . . . . 81 LEU CD1 . 10075 1 951 . 1 1 81 81 LEU CD2 C 13 18.370 0.300 . 2 . . . . 81 LEU CD2 . 10075 1 952 . 1 1 81 81 LEU N N 15 118.572 0.300 . 1 . . . . 81 LEU N . 10075 1 953 . 1 1 82 82 THR H H 1 8.311 0.030 . 1 . . . . 82 THR H . 10075 1 954 . 1 1 82 82 THR HA H 1 4.456 0.030 . 1 . . . . 82 THR HA . 10075 1 955 . 1 1 82 82 THR HB H 1 4.010 0.030 . 1 . . . . 82 THR HB . 10075 1 956 . 1 1 82 82 THR HG21 H 1 1.323 0.030 . 1 . . . . 82 THR HG2 . 10075 1 957 . 1 1 82 82 THR HG22 H 1 1.323 0.030 . 1 . . . . 82 THR HG2 . 10075 1 958 . 1 1 82 82 THR HG23 H 1 1.323 0.030 . 1 . . . . 82 THR HG2 . 10075 1 959 . 1 1 82 82 THR C C 13 174.029 0.300 . 1 . . . . 82 THR C . 10075 1 960 . 1 1 82 82 THR CA C 13 61.124 0.300 . 1 . . . . 82 THR CA . 10075 1 961 . 1 1 82 82 THR CB C 13 71.021 0.300 . 1 . . . . 82 THR CB . 10075 1 962 . 1 1 82 82 THR CG2 C 13 21.771 0.300 . 1 . . . . 82 THR CG2 . 10075 1 963 . 1 1 82 82 THR N N 15 115.229 0.300 . 1 . . . . 82 THR N . 10075 1 964 . 1 1 83 83 ALA H H 1 8.617 0.030 . 1 . . . . 83 ALA H . 10075 1 965 . 1 1 83 83 ALA HA H 1 4.506 0.030 . 1 . . . . 83 ALA HA . 10075 1 966 . 1 1 83 83 ALA HB1 H 1 1.464 0.030 . 1 . . . . 83 ALA HB . 10075 1 967 . 1 1 83 83 ALA HB2 H 1 1.464 0.030 . 1 . . . . 83 ALA HB . 10075 1 968 . 1 1 83 83 ALA HB3 H 1 1.464 0.030 . 1 . . . . 83 ALA HB . 10075 1 969 . 1 1 83 83 ALA C C 13 177.943 0.300 . 1 . . . . 83 ALA C . 10075 1 970 . 1 1 83 83 ALA CA C 13 53.467 0.300 . 1 . . . . 83 ALA CA . 10075 1 971 . 1 1 83 83 ALA CB C 13 19.761 0.300 . 1 . . . . 83 ALA CB . 10075 1 972 . 1 1 83 83 ALA N N 15 128.160 0.300 . 1 . . . . 83 ALA N . 10075 1 973 . 1 1 84 84 LEU H H 1 8.240 0.030 . 1 . . . . 84 LEU H . 10075 1 974 . 1 1 84 84 LEU HA H 1 3.677 0.030 . 1 . . . . 84 LEU HA . 10075 1 975 . 1 1 84 84 LEU HB2 H 1 1.688 0.030 . 2 . . . . 84 LEU HB2 . 10075 1 976 . 1 1 84 84 LEU HB3 H 1 1.550 0.030 . 2 . . . . 84 LEU HB3 . 10075 1 977 . 1 1 84 84 LEU HG H 1 1.553 0.030 . 1 . . . . 84 LEU HG . 10075 1 978 . 1 1 84 84 LEU HD11 H 1 0.897 0.030 . 1 . . . . 84 LEU HD1 . 10075 1 979 . 1 1 84 84 LEU HD12 H 1 0.897 0.030 . 1 . . . . 84 LEU HD1 . 10075 1 980 . 1 1 84 84 LEU HD13 H 1 0.897 0.030 . 1 . . . . 84 LEU HD1 . 10075 1 981 . 1 1 84 84 LEU HD21 H 1 0.820 0.030 . 1 . . . . 84 LEU HD2 . 10075 1 982 . 1 1 84 84 LEU HD22 H 1 0.820 0.030 . 1 . . . . 84 LEU HD2 . 10075 1 983 . 1 1 84 84 LEU HD23 H 1 0.820 0.030 . 1 . . . . 84 LEU HD2 . 10075 1 984 . 1 1 84 84 LEU C C 13 175.373 0.300 . 1 . . . . 84 LEU C . 10075 1 985 . 1 1 84 84 LEU CA C 13 55.262 0.300 . 1 . . . . 84 LEU CA . 10075 1 986 . 1 1 84 84 LEU CB C 13 40.641 0.300 . 1 . . . . 84 LEU CB . 10075 1 987 . 1 1 84 84 LEU CG C 13 26.788 0.300 . 1 . . . . 84 LEU CG . 10075 1 988 . 1 1 84 84 LEU CD1 C 13 25.418 0.300 . 2 . . . . 84 LEU CD1 . 10075 1 989 . 1 1 84 84 LEU CD2 C 13 23.192 0.300 . 2 . . . . 84 LEU CD2 . 10075 1 990 . 1 1 84 84 LEU N N 15 123.307 0.300 . 1 . . . . 84 LEU N . 10075 1 991 . 1 1 85 85 THR H H 1 8.295 0.030 . 1 . . . . 85 THR H . 10075 1 992 . 1 1 85 85 THR HA H 1 4.463 0.030 . 1 . . . . 85 THR HA . 10075 1 993 . 1 1 85 85 THR HB H 1 4.110 0.030 . 1 . . . . 85 THR HB . 10075 1 994 . 1 1 85 85 THR HG21 H 1 0.771 0.030 . 1 . . . . 85 THR HG2 . 10075 1 995 . 1 1 85 85 THR HG22 H 1 0.771 0.030 . 1 . . . . 85 THR HG2 . 10075 1 996 . 1 1 85 85 THR HG23 H 1 0.771 0.030 . 1 . . . . 85 THR HG2 . 10075 1 997 . 1 1 85 85 THR C C 13 171.884 0.300 . 1 . . . . 85 THR C . 10075 1 998 . 1 1 85 85 THR CA C 13 62.468 0.300 . 1 . . . . 85 THR CA . 10075 1 999 . 1 1 85 85 THR CB C 13 70.910 0.300 . 1 . . . . 85 THR CB . 10075 1 1000 . 1 1 85 85 THR CG2 C 13 19.423 0.300 . 1 . . . . 85 THR CG2 . 10075 1 1001 . 1 1 85 85 THR N N 15 116.007 0.300 . 1 . . . . 85 THR N . 10075 1 1002 . 1 1 86 86 THR H H 1 8.441 0.030 . 1 . . . . 86 THR H . 10075 1 1003 . 1 1 86 86 THR HA H 1 4.654 0.030 . 1 . . . . 86 THR HA . 10075 1 1004 . 1 1 86 86 THR HB H 1 3.797 0.030 . 1 . . . . 86 THR HB . 10075 1 1005 . 1 1 86 86 THR HG21 H 1 0.852 0.030 . 1 . . . . 86 THR HG2 . 10075 1 1006 . 1 1 86 86 THR HG22 H 1 0.852 0.030 . 1 . . . . 86 THR HG2 . 10075 1 1007 . 1 1 86 86 THR HG23 H 1 0.852 0.030 . 1 . . . . 86 THR HG2 . 10075 1 1008 . 1 1 86 86 THR C C 13 173.082 0.300 . 1 . . . . 86 THR C . 10075 1 1009 . 1 1 86 86 THR CA C 13 63.195 0.300 . 1 . . . . 86 THR CA . 10075 1 1010 . 1 1 86 86 THR CB C 13 68.728 0.300 . 1 . . . . 86 THR CB . 10075 1 1011 . 1 1 86 86 THR CG2 C 13 22.042 0.300 . 1 . . . . 86 THR CG2 . 10075 1 1012 . 1 1 86 86 THR N N 15 122.524 0.300 . 1 . . . . 86 THR N . 10075 1 1013 . 1 1 87 87 TYR H H 1 9.428 0.030 . 1 . . . . 87 TYR H . 10075 1 1014 . 1 1 87 87 TYR HA H 1 5.226 0.030 . 1 . . . . 87 TYR HA . 10075 1 1015 . 1 1 87 87 TYR HB2 H 1 2.847 0.030 . 2 . . . . 87 TYR HB2 . 10075 1 1016 . 1 1 87 87 TYR HB3 H 1 2.530 0.030 . 2 . . . . 87 TYR HB3 . 10075 1 1017 . 1 1 87 87 TYR HD1 H 1 6.936 0.030 . 1 . . . . 87 TYR HD1 . 10075 1 1018 . 1 1 87 87 TYR HD2 H 1 6.936 0.030 . 1 . . . . 87 TYR HD2 . 10075 1 1019 . 1 1 87 87 TYR HE1 H 1 6.901 0.030 . 1 . . . . 87 TYR HE1 . 10075 1 1020 . 1 1 87 87 TYR HE2 H 1 6.901 0.030 . 1 . . . . 87 TYR HE2 . 10075 1 1021 . 1 1 87 87 TYR C C 13 175.178 0.300 . 1 . . . . 87 TYR C . 10075 1 1022 . 1 1 87 87 TYR CA C 13 57.953 0.300 . 1 . . . . 87 TYR CA . 10075 1 1023 . 1 1 87 87 TYR CB C 13 42.686 0.300 . 1 . . . . 87 TYR CB . 10075 1 1024 . 1 1 87 87 TYR CD1 C 13 132.891 0.300 . 1 . . . . 87 TYR CD1 . 10075 1 1025 . 1 1 87 87 TYR CD2 C 13 132.891 0.300 . 1 . . . . 87 TYR CD2 . 10075 1 1026 . 1 1 87 87 TYR CE1 C 13 118.749 0.300 . 1 . . . . 87 TYR CE1 . 10075 1 1027 . 1 1 87 87 TYR CE2 C 13 118.749 0.300 . 1 . . . . 87 TYR CE2 . 10075 1 1028 . 1 1 87 87 TYR N N 15 126.620 0.300 . 1 . . . . 87 TYR N . 10075 1 1029 . 1 1 88 88 THR H H 1 9.218 0.030 . 1 . . . . 88 THR H . 10075 1 1030 . 1 1 88 88 THR HA H 1 4.962 0.030 . 1 . . . . 88 THR HA . 10075 1 1031 . 1 1 88 88 THR HB H 1 4.005 0.030 . 1 . . . . 88 THR HB . 10075 1 1032 . 1 1 88 88 THR HG21 H 1 1.187 0.030 . 1 . . . . 88 THR HG2 . 10075 1 1033 . 1 1 88 88 THR HG22 H 1 1.187 0.030 . 1 . . . . 88 THR HG2 . 10075 1 1034 . 1 1 88 88 THR HG23 H 1 1.187 0.030 . 1 . . . . 88 THR HG2 . 10075 1 1035 . 1 1 88 88 THR C C 13 174.368 0.300 . 1 . . . . 88 THR C . 10075 1 1036 . 1 1 88 88 THR CA C 13 62.523 0.300 . 1 . . . . 88 THR CA . 10075 1 1037 . 1 1 88 88 THR CB C 13 70.047 0.300 . 1 . . . . 88 THR CB . 10075 1 1038 . 1 1 88 88 THR CG2 C 13 22.771 0.300 . 1 . . . . 88 THR CG2 . 10075 1 1039 . 1 1 88 88 THR N N 15 118.054 0.300 . 1 . . . . 88 THR N . 10075 1 1040 . 1 1 89 89 ILE H H 1 9.070 0.030 . 1 . . . . 89 ILE H . 10075 1 1041 . 1 1 89 89 ILE HA H 1 5.272 0.030 . 1 . . . . 89 ILE HA . 10075 1 1042 . 1 1 89 89 ILE HB H 1 1.942 0.030 . 1 . . . . 89 ILE HB . 10075 1 1043 . 1 1 89 89 ILE HG12 H 1 1.642 0.030 . 2 . . . . 89 ILE HG12 . 10075 1 1044 . 1 1 89 89 ILE HG13 H 1 1.419 0.030 . 2 . . . . 89 ILE HG13 . 10075 1 1045 . 1 1 89 89 ILE HG21 H 1 1.144 0.030 . 1 . . . . 89 ILE HG2 . 10075 1 1046 . 1 1 89 89 ILE HG22 H 1 1.144 0.030 . 1 . . . . 89 ILE HG2 . 10075 1 1047 . 1 1 89 89 ILE HG23 H 1 1.144 0.030 . 1 . . . . 89 ILE HG2 . 10075 1 1048 . 1 1 89 89 ILE HD11 H 1 0.714 0.030 . 1 . . . . 89 ILE HD1 . 10075 1 1049 . 1 1 89 89 ILE HD12 H 1 0.714 0.030 . 1 . . . . 89 ILE HD1 . 10075 1 1050 . 1 1 89 89 ILE HD13 H 1 0.714 0.030 . 1 . . . . 89 ILE HD1 . 10075 1 1051 . 1 1 89 89 ILE C C 13 173.841 0.300 . 1 . . . . 89 ILE C . 10075 1 1052 . 1 1 89 89 ILE CA C 13 60.050 0.300 . 1 . . . . 89 ILE CA . 10075 1 1053 . 1 1 89 89 ILE CB C 13 39.910 0.300 . 1 . . . . 89 ILE CB . 10075 1 1054 . 1 1 89 89 ILE CG1 C 13 28.911 0.300 . 1 . . . . 89 ILE CG1 . 10075 1 1055 . 1 1 89 89 ILE CG2 C 13 17.706 0.300 . 1 . . . . 89 ILE CG2 . 10075 1 1056 . 1 1 89 89 ILE CD1 C 13 13.738 0.300 . 1 . . . . 89 ILE CD1 . 10075 1 1057 . 1 1 89 89 ILE N N 15 129.002 0.300 . 1 . . . . 89 ILE N . 10075 1 1058 . 1 1 90 90 GLU H H 1 9.075 0.030 . 1 . . . . 90 GLU H . 10075 1 1059 . 1 1 90 90 GLU HA H 1 5.448 0.030 . 1 . . . . 90 GLU HA . 10075 1 1060 . 1 1 90 90 GLU HB2 H 1 1.824 0.030 . 2 . . . . 90 GLU HB2 . 10075 1 1061 . 1 1 90 90 GLU HB3 H 1 1.727 0.030 . 2 . . . . 90 GLU HB3 . 10075 1 1062 . 1 1 90 90 GLU HG2 H 1 2.153 0.030 . 2 . . . . 90 GLU HG2 . 10075 1 1063 . 1 1 90 90 GLU HG3 H 1 2.033 0.030 . 2 . . . . 90 GLU HG3 . 10075 1 1064 . 1 1 90 90 GLU C C 13 175.459 0.300 . 1 . . . . 90 GLU C . 10075 1 1065 . 1 1 90 90 GLU CA C 13 53.960 0.300 . 1 . . . . 90 GLU CA . 10075 1 1066 . 1 1 90 90 GLU CB C 13 35.032 0.300 . 1 . . . . 90 GLU CB . 10075 1 1067 . 1 1 90 90 GLU CG C 13 36.543 0.300 . 1 . . . . 90 GLU CG . 10075 1 1068 . 1 1 90 90 GLU N N 15 124.253 0.300 . 1 . . . . 90 GLU N . 10075 1 1069 . 1 1 91 91 VAL H H 1 8.543 0.030 . 1 . . . . 91 VAL H . 10075 1 1070 . 1 1 91 91 VAL HA H 1 5.052 0.030 . 1 . . . . 91 VAL HA . 10075 1 1071 . 1 1 91 91 VAL HB H 1 1.213 0.030 . 1 . . . . 91 VAL HB . 10075 1 1072 . 1 1 91 91 VAL HG11 H 1 0.296 0.030 . 1 . . . . 91 VAL HG1 . 10075 1 1073 . 1 1 91 91 VAL HG12 H 1 0.296 0.030 . 1 . . . . 91 VAL HG1 . 10075 1 1074 . 1 1 91 91 VAL HG13 H 1 0.296 0.030 . 1 . . . . 91 VAL HG1 . 10075 1 1075 . 1 1 91 91 VAL HG21 H 1 -0.450 0.030 . 1 . . . . 91 VAL HG2 . 10075 1 1076 . 1 1 91 91 VAL HG22 H 1 -0.450 0.030 . 1 . . . . 91 VAL HG2 . 10075 1 1077 . 1 1 91 91 VAL HG23 H 1 -0.450 0.030 . 1 . . . . 91 VAL HG2 . 10075 1 1078 . 1 1 91 91 VAL C C 13 175.695 0.300 . 1 . . . . 91 VAL C . 10075 1 1079 . 1 1 91 91 VAL CA C 13 60.768 0.300 . 1 . . . . 91 VAL CA . 10075 1 1080 . 1 1 91 91 VAL CB C 13 35.668 0.300 . 1 . . . . 91 VAL CB . 10075 1 1081 . 1 1 91 91 VAL CG1 C 13 21.942 0.300 . 2 . . . . 91 VAL CG1 . 10075 1 1082 . 1 1 91 91 VAL CG2 C 13 19.942 0.300 . 2 . . . . 91 VAL CG2 . 10075 1 1083 . 1 1 91 91 VAL N N 15 118.555 0.300 . 1 . . . . 91 VAL N . 10075 1 1084 . 1 1 92 92 ALA H H 1 9.001 0.030 . 1 . . . . 92 ALA H . 10075 1 1085 . 1 1 92 92 ALA HA H 1 4.703 0.030 . 1 . . . . 92 ALA HA . 10075 1 1086 . 1 1 92 92 ALA HB1 H 1 1.282 0.030 . 1 . . . . 92 ALA HB . 10075 1 1087 . 1 1 92 92 ALA HB2 H 1 1.282 0.030 . 1 . . . . 92 ALA HB . 10075 1 1088 . 1 1 92 92 ALA HB3 H 1 1.282 0.030 . 1 . . . . 92 ALA HB . 10075 1 1089 . 1 1 92 92 ALA C C 13 175.048 0.300 . 1 . . . . 92 ALA C . 10075 1 1090 . 1 1 92 92 ALA CA C 13 51.093 0.300 . 1 . . . . 92 ALA CA . 10075 1 1091 . 1 1 92 92 ALA CB C 13 23.611 0.300 . 1 . . . . 92 ALA CB . 10075 1 1092 . 1 1 92 92 ALA N N 15 129.999 0.300 . 1 . . . . 92 ALA N . 10075 1 1093 . 1 1 93 93 ALA H H 1 9.558 0.030 . 1 . . . . 93 ALA H . 10075 1 1094 . 1 1 93 93 ALA HA H 1 4.705 0.030 . 1 . . . . 93 ALA HA . 10075 1 1095 . 1 1 93 93 ALA HB1 H 1 1.386 0.030 . 1 . . . . 93 ALA HB . 10075 1 1096 . 1 1 93 93 ALA HB2 H 1 1.386 0.030 . 1 . . . . 93 ALA HB . 10075 1 1097 . 1 1 93 93 ALA HB3 H 1 1.386 0.030 . 1 . . . . 93 ALA HB . 10075 1 1098 . 1 1 93 93 ALA C C 13 175.411 0.300 . 1 . . . . 93 ALA C . 10075 1 1099 . 1 1 93 93 ALA CA C 13 51.120 0.300 . 1 . . . . 93 ALA CA . 10075 1 1100 . 1 1 93 93 ALA CB C 13 21.355 0.300 . 1 . . . . 93 ALA CB . 10075 1 1101 . 1 1 93 93 ALA N N 15 124.562 0.300 . 1 . . . . 93 ALA N . 10075 1 1102 . 1 1 94 94 MET H H 1 7.981 0.030 . 1 . . . . 94 MET H . 10075 1 1103 . 1 1 94 94 MET HA H 1 5.144 0.030 . 1 . . . . 94 MET HA . 10075 1 1104 . 1 1 94 94 MET HB2 H 1 1.880 0.030 . 2 . . . . 94 MET HB2 . 10075 1 1105 . 1 1 94 94 MET HB3 H 1 1.600 0.030 . 2 . . . . 94 MET HB3 . 10075 1 1106 . 1 1 94 94 MET HG2 H 1 2.263 0.030 . 2 . . . . 94 MET HG2 . 10075 1 1107 . 1 1 94 94 MET HG3 H 1 2.162 0.030 . 2 . . . . 94 MET HG3 . 10075 1 1108 . 1 1 94 94 MET HE1 H 1 1.898 0.030 . 1 . . . . 94 MET HE . 10075 1 1109 . 1 1 94 94 MET HE2 H 1 1.898 0.030 . 1 . . . . 94 MET HE . 10075 1 1110 . 1 1 94 94 MET HE3 H 1 1.898 0.030 . 1 . . . . 94 MET HE . 10075 1 1111 . 1 1 94 94 MET C C 13 175.594 0.300 . 1 . . . . 94 MET C . 10075 1 1112 . 1 1 94 94 MET CA C 13 54.534 0.300 . 1 . . . . 94 MET CA . 10075 1 1113 . 1 1 94 94 MET CB C 13 35.957 0.300 . 1 . . . . 94 MET CB . 10075 1 1114 . 1 1 94 94 MET CG C 13 31.153 0.300 . 1 . . . . 94 MET CG . 10075 1 1115 . 1 1 94 94 MET CE C 13 16.247 0.300 . 1 . . . . 94 MET CE . 10075 1 1116 . 1 1 94 94 MET N N 15 116.249 0.300 . 1 . . . . 94 MET N . 10075 1 1117 . 1 1 95 95 THR H H 1 8.226 0.030 . 1 . . . . 95 THR H . 10075 1 1118 . 1 1 95 95 THR HA H 1 5.028 0.030 . 1 . . . . 95 THR HA . 10075 1 1119 . 1 1 95 95 THR HB H 1 4.653 0.030 . 1 . . . . 95 THR HB . 10075 1 1120 . 1 1 95 95 THR HG21 H 1 1.071 0.030 . 1 . . . . 95 THR HG2 . 10075 1 1121 . 1 1 95 95 THR HG22 H 1 1.071 0.030 . 1 . . . . 95 THR HG2 . 10075 1 1122 . 1 1 95 95 THR HG23 H 1 1.071 0.030 . 1 . . . . 95 THR HG2 . 10075 1 1123 . 1 1 95 95 THR C C 13 176.669 0.300 . 1 . . . . 95 THR C . 10075 1 1124 . 1 1 95 95 THR CA C 13 60.222 0.300 . 1 . . . . 95 THR CA . 10075 1 1125 . 1 1 95 95 THR CB C 13 73.200 0.300 . 1 . . . . 95 THR CB . 10075 1 1126 . 1 1 95 95 THR CG2 C 13 21.771 0.300 . 1 . . . . 95 THR CG2 . 10075 1 1127 . 1 1 95 95 THR N N 15 110.698 0.300 . 1 . . . . 95 THR N . 10075 1 1128 . 1 1 96 96 SER H H 1 9.674 0.030 . 1 . . . . 96 SER H . 10075 1 1129 . 1 1 96 96 SER HA H 1 4.178 0.030 . 1 . . . . 96 SER HA . 10075 1 1130 . 1 1 96 96 SER HB2 H 1 3.986 0.030 . 2 . . . . 96 SER HB2 . 10075 1 1131 . 1 1 96 96 SER HB3 H 1 3.935 0.030 . 2 . . . . 96 SER HB3 . 10075 1 1132 . 1 1 96 96 SER C C 13 175.462 0.300 . 1 . . . . 96 SER C . 10075 1 1133 . 1 1 96 96 SER CA C 13 61.160 0.300 . 1 . . . . 96 SER CA . 10075 1 1134 . 1 1 96 96 SER CB C 13 62.651 0.300 . 1 . . . . 96 SER CB . 10075 1 1135 . 1 1 96 96 SER N N 15 116.309 0.300 . 1 . . . . 96 SER N . 10075 1 1136 . 1 1 97 97 LYS H H 1 7.766 0.030 . 1 . . . . 97 LYS H . 10075 1 1137 . 1 1 97 97 LYS HA H 1 4.277 0.030 . 1 . . . . 97 LYS HA . 10075 1 1138 . 1 1 97 97 LYS HB2 H 1 1.769 0.030 . 2 . . . . 97 LYS HB2 . 10075 1 1139 . 1 1 97 97 LYS HB3 H 1 1.534 0.030 . 2 . . . . 97 LYS HB3 . 10075 1 1140 . 1 1 97 97 LYS HG2 H 1 1.425 0.030 . 2 . . . . 97 LYS HG2 . 10075 1 1141 . 1 1 97 97 LYS HG3 H 1 1.370 0.030 . 2 . . . . 97 LYS HG3 . 10075 1 1142 . 1 1 97 97 LYS HD2 H 1 1.647 0.030 . 1 . . . . 97 LYS HD2 . 10075 1 1143 . 1 1 97 97 LYS HD3 H 1 1.647 0.030 . 1 . . . . 97 LYS HD3 . 10075 1 1144 . 1 1 97 97 LYS HE2 H 1 2.977 0.030 . 1 . . . . 97 LYS HE2 . 10075 1 1145 . 1 1 97 97 LYS HE3 H 1 2.977 0.030 . 1 . . . . 97 LYS HE3 . 10075 1 1146 . 1 1 97 97 LYS C C 13 176.207 0.300 . 1 . . . . 97 LYS C . 10075 1 1147 . 1 1 97 97 LYS CA C 13 55.935 0.300 . 1 . . . . 97 LYS CA . 10075 1 1148 . 1 1 97 97 LYS CB C 13 32.645 0.300 . 1 . . . . 97 LYS CB . 10075 1 1149 . 1 1 97 97 LYS CG C 13 24.932 0.300 . 1 . . . . 97 LYS CG . 10075 1 1150 . 1 1 97 97 LYS CD C 13 28.338 0.300 . 1 . . . . 97 LYS CD . 10075 1 1151 . 1 1 97 97 LYS CE C 13 42.199 0.300 . 1 . . . . 97 LYS CE . 10075 1 1152 . 1 1 97 97 LYS N N 15 118.814 0.300 . 1 . . . . 97 LYS N . 10075 1 1153 . 1 1 98 98 GLY H H 1 7.522 0.030 . 1 . . . . 98 GLY H . 10075 1 1154 . 1 1 98 98 GLY HA2 H 1 4.427 0.030 . 2 . . . . 98 GLY HA2 . 10075 1 1155 . 1 1 98 98 GLY HA3 H 1 3.790 0.030 . 2 . . . . 98 GLY HA3 . 10075 1 1156 . 1 1 98 98 GLY C C 13 171.737 0.300 . 1 . . . . 98 GLY C . 10075 1 1157 . 1 1 98 98 GLY CA C 13 44.340 0.300 . 1 . . . . 98 GLY CA . 10075 1 1158 . 1 1 98 98 GLY N N 15 107.023 0.300 . 1 . . . . 98 GLY N . 10075 1 1159 . 1 1 99 99 GLN H H 1 8.322 0.030 . 1 . . . . 99 GLN H . 10075 1 1160 . 1 1 99 99 GLN HA H 1 4.750 0.030 . 1 . . . . 99 GLN HA . 10075 1 1161 . 1 1 99 99 GLN HB2 H 1 2.075 0.030 . 2 . . . . 99 GLN HB2 . 10075 1 1162 . 1 1 99 99 GLN HB3 H 1 1.930 0.030 . 2 . . . . 99 GLN HB3 . 10075 1 1163 . 1 1 99 99 GLN HG2 H 1 2.410 0.030 . 2 . . . . 99 GLN HG2 . 10075 1 1164 . 1 1 99 99 GLN HG3 H 1 2.357 0.030 . 2 . . . . 99 GLN HG3 . 10075 1 1165 . 1 1 99 99 GLN HE21 H 1 7.607 0.030 . 2 . . . . 99 GLN HE21 . 10075 1 1166 . 1 1 99 99 GLN HE22 H 1 6.991 0.030 . 2 . . . . 99 GLN HE22 . 10075 1 1167 . 1 1 99 99 GLN C C 13 176.821 0.300 . 1 . . . . 99 GLN C . 10075 1 1168 . 1 1 99 99 GLN CA C 13 55.537 0.300 . 1 . . . . 99 GLN CA . 10075 1 1169 . 1 1 99 99 GLN CB C 13 30.868 0.300 . 1 . . . . 99 GLN CB . 10075 1 1170 . 1 1 99 99 GLN CG C 13 34.512 0.300 . 1 . . . . 99 GLN CG . 10075 1 1171 . 1 1 99 99 GLN N N 15 117.880 0.300 . 1 . . . . 99 GLN N . 10075 1 1172 . 1 1 99 99 GLN NE2 N 15 111.929 0.300 . 1 . . . . 99 GLN NE2 . 10075 1 1173 . 1 1 100 100 GLY H H 1 8.858 0.030 . 1 . . . . 100 GLY H . 10075 1 1174 . 1 1 100 100 GLY HA2 H 1 4.230 0.030 . 2 . . . . 100 GLY HA2 . 10075 1 1175 . 1 1 100 100 GLY HA3 H 1 4.061 0.030 . 2 . . . . 100 GLY HA3 . 10075 1 1176 . 1 1 100 100 GLY C C 13 172.914 0.300 . 1 . . . . 100 GLY C . 10075 1 1177 . 1 1 100 100 GLY CA C 13 44.367 0.300 . 1 . . . . 100 GLY CA . 10075 1 1178 . 1 1 100 100 GLY N N 15 109.496 0.300 . 1 . . . . 100 GLY N . 10075 1 1179 . 1 1 101 101 GLN H H 1 7.616 0.030 . 1 . . . . 101 GLN H . 10075 1 1180 . 1 1 101 101 GLN HA H 1 4.130 0.030 . 1 . . . . 101 GLN HA . 10075 1 1181 . 1 1 101 101 GLN HB2 H 1 1.834 0.030 . 1 . . . . 101 GLN HB2 . 10075 1 1182 . 1 1 101 101 GLN HB3 H 1 1.834 0.030 . 1 . . . . 101 GLN HB3 . 10075 1 1183 . 1 1 101 101 GLN HG2 H 1 2.535 0.030 . 2 . . . . 101 GLN HG2 . 10075 1 1184 . 1 1 101 101 GLN HG3 H 1 2.451 0.030 . 2 . . . . 101 GLN HG3 . 10075 1 1185 . 1 1 101 101 GLN HE21 H 1 7.804 0.030 . 2 . . . . 101 GLN HE21 . 10075 1 1186 . 1 1 101 101 GLN HE22 H 1 7.006 0.030 . 2 . . . . 101 GLN HE22 . 10075 1 1187 . 1 1 101 101 GLN C C 13 177.488 0.300 . 1 . . . . 101 GLN C . 10075 1 1188 . 1 1 101 101 GLN CA C 13 56.441 0.300 . 1 . . . . 101 GLN CA . 10075 1 1189 . 1 1 101 101 GLN CB C 13 29.746 0.300 . 1 . . . . 101 GLN CB . 10075 1 1190 . 1 1 101 101 GLN CG C 13 33.880 0.300 . 1 . . . . 101 GLN CG . 10075 1 1191 . 1 1 101 101 GLN N N 15 116.498 0.300 . 1 . . . . 101 GLN N . 10075 1 1192 . 1 1 101 101 GLN NE2 N 15 113.076 0.300 . 1 . . . . 101 GLN NE2 . 10075 1 1193 . 1 1 102 102 VAL H H 1 8.859 0.030 . 1 . . . . 102 VAL H . 10075 1 1194 . 1 1 102 102 VAL HA H 1 4.029 0.030 . 1 . . . . 102 VAL HA . 10075 1 1195 . 1 1 102 102 VAL HB H 1 2.007 0.030 . 1 . . . . 102 VAL HB . 10075 1 1196 . 1 1 102 102 VAL HG11 H 1 0.952 0.030 . 1 . . . . 102 VAL HG1 . 10075 1 1197 . 1 1 102 102 VAL HG12 H 1 0.952 0.030 . 1 . . . . 102 VAL HG1 . 10075 1 1198 . 1 1 102 102 VAL HG13 H 1 0.952 0.030 . 1 . . . . 102 VAL HG1 . 10075 1 1199 . 1 1 102 102 VAL HG21 H 1 0.844 0.030 . 1 . . . . 102 VAL HG2 . 10075 1 1200 . 1 1 102 102 VAL HG22 H 1 0.844 0.030 . 1 . . . . 102 VAL HG2 . 10075 1 1201 . 1 1 102 102 VAL HG23 H 1 0.844 0.030 . 1 . . . . 102 VAL HG2 . 10075 1 1202 . 1 1 102 102 VAL C C 13 175.286 0.300 . 1 . . . . 102 VAL C . 10075 1 1203 . 1 1 102 102 VAL CA C 13 63.155 0.300 . 1 . . . . 102 VAL CA . 10075 1 1204 . 1 1 102 102 VAL CB C 13 33.521 0.300 . 1 . . . . 102 VAL CB . 10075 1 1205 . 1 1 102 102 VAL CG1 C 13 22.257 0.300 . 2 . . . . 102 VAL CG1 . 10075 1 1206 . 1 1 102 102 VAL CG2 C 13 21.606 0.300 . 2 . . . . 102 VAL CG2 . 10075 1 1207 . 1 1 102 102 VAL N N 15 126.741 0.300 . 1 . . . . 102 VAL N . 10075 1 1208 . 1 1 103 103 SER H H 1 8.016 0.030 . 1 . . . . 103 SER H . 10075 1 1209 . 1 1 103 103 SER HA H 1 4.840 0.030 . 1 . . . . 103 SER HA . 10075 1 1210 . 1 1 103 103 SER HB2 H 1 3.900 0.030 . 2 . . . . 103 SER HB2 . 10075 1 1211 . 1 1 103 103 SER HB3 H 1 3.710 0.030 . 2 . . . . 103 SER HB3 . 10075 1 1212 . 1 1 103 103 SER C C 13 171.560 0.300 . 1 . . . . 103 SER C . 10075 1 1213 . 1 1 103 103 SER CA C 13 57.814 0.300 . 1 . . . . 103 SER CA . 10075 1 1214 . 1 1 103 103 SER CB C 13 64.919 0.300 . 1 . . . . 103 SER CB . 10075 1 1215 . 1 1 103 103 SER N N 15 122.156 0.300 . 1 . . . . 103 SER N . 10075 1 1216 . 1 1 104 104 ALA H H 1 8.709 0.030 . 1 . . . . 104 ALA H . 10075 1 1217 . 1 1 104 104 ALA HA H 1 5.899 0.030 . 1 . . . . 104 ALA HA . 10075 1 1218 . 1 1 104 104 ALA HB1 H 1 1.351 0.030 . 1 . . . . 104 ALA HB . 10075 1 1219 . 1 1 104 104 ALA HB2 H 1 1.351 0.030 . 1 . . . . 104 ALA HB . 10075 1 1220 . 1 1 104 104 ALA HB3 H 1 1.351 0.030 . 1 . . . . 104 ALA HB . 10075 1 1221 . 1 1 104 104 ALA C C 13 177.503 0.300 . 1 . . . . 104 ALA C . 10075 1 1222 . 1 1 104 104 ALA CA C 13 50.338 0.300 . 1 . . . . 104 ALA CA . 10075 1 1223 . 1 1 104 104 ALA CB C 13 23.941 0.300 . 1 . . . . 104 ALA CB . 10075 1 1224 . 1 1 104 104 ALA N N 15 127.520 0.300 . 1 . . . . 104 ALA N . 10075 1 1225 . 1 1 105 105 SER H H 1 8.990 0.030 . 1 . . . . 105 SER H . 10075 1 1226 . 1 1 105 105 SER HA H 1 4.832 0.030 . 1 . . . . 105 SER HA . 10075 1 1227 . 1 1 105 105 SER HB2 H 1 3.939 0.030 . 2 . . . . 105 SER HB2 . 10075 1 1228 . 1 1 105 105 SER HB3 H 1 3.849 0.030 . 2 . . . . 105 SER HB3 . 10075 1 1229 . 1 1 105 105 SER C C 13 172.775 0.300 . 1 . . . . 105 SER C . 10075 1 1230 . 1 1 105 105 SER CA C 13 57.893 0.300 . 1 . . . . 105 SER CA . 10075 1 1231 . 1 1 105 105 SER CB C 13 66.808 0.300 . 1 . . . . 105 SER CB . 10075 1 1232 . 1 1 105 105 SER N N 15 115.154 0.300 . 1 . . . . 105 SER N . 10075 1 1233 . 1 1 106 106 THR H H 1 8.242 0.030 . 1 . . . . 106 THR H . 10075 1 1234 . 1 1 106 106 THR HA H 1 5.658 0.030 . 1 . . . . 106 THR HA . 10075 1 1235 . 1 1 106 106 THR HB H 1 3.831 0.030 . 1 . . . . 106 THR HB . 10075 1 1236 . 1 1 106 106 THR HG21 H 1 1.020 0.030 . 1 . . . . 106 THR HG2 . 10075 1 1237 . 1 1 106 106 THR HG22 H 1 1.020 0.030 . 1 . . . . 106 THR HG2 . 10075 1 1238 . 1 1 106 106 THR HG23 H 1 1.020 0.030 . 1 . . . . 106 THR HG2 . 10075 1 1239 . 1 1 106 106 THR C C 13 173.631 0.300 . 1 . . . . 106 THR C . 10075 1 1240 . 1 1 106 106 THR CA C 13 60.697 0.300 . 1 . . . . 106 THR CA . 10075 1 1241 . 1 1 106 106 THR CB C 13 71.145 0.300 . 1 . . . . 106 THR CB . 10075 1 1242 . 1 1 106 106 THR CG2 C 13 22.247 0.300 . 1 . . . . 106 THR CG2 . 10075 1 1243 . 1 1 106 106 THR N N 15 116.620 0.300 . 1 . . . . 106 THR N . 10075 1 1244 . 1 1 107 107 ILE H H 1 9.034 0.030 . 1 . . . . 107 ILE H . 10075 1 1245 . 1 1 107 107 ILE HA H 1 4.493 0.030 . 1 . . . . 107 ILE HA . 10075 1 1246 . 1 1 107 107 ILE HB H 1 1.117 0.030 . 1 . . . . 107 ILE HB . 10075 1 1247 . 1 1 107 107 ILE HG12 H 1 1.047 0.030 . 2 . . . . 107 ILE HG12 . 10075 1 1248 . 1 1 107 107 ILE HG13 H 1 0.622 0.030 . 2 . . . . 107 ILE HG13 . 10075 1 1249 . 1 1 107 107 ILE HG21 H 1 0.216 0.030 . 1 . . . . 107 ILE HG2 . 10075 1 1250 . 1 1 107 107 ILE HG22 H 1 0.216 0.030 . 1 . . . . 107 ILE HG2 . 10075 1 1251 . 1 1 107 107 ILE HG23 H 1 0.216 0.030 . 1 . . . . 107 ILE HG2 . 10075 1 1252 . 1 1 107 107 ILE HD11 H 1 0.699 0.030 . 1 . . . . 107 ILE HD1 . 10075 1 1253 . 1 1 107 107 ILE HD12 H 1 0.699 0.030 . 1 . . . . 107 ILE HD1 . 10075 1 1254 . 1 1 107 107 ILE HD13 H 1 0.699 0.030 . 1 . . . . 107 ILE HD1 . 10075 1 1255 . 1 1 107 107 ILE C C 13 172.151 0.300 . 1 . . . . 107 ILE C . 10075 1 1256 . 1 1 107 107 ILE CA C 13 57.377 0.300 . 1 . . . . 107 ILE CA . 10075 1 1257 . 1 1 107 107 ILE CB C 13 41.538 0.300 . 1 . . . . 107 ILE CB . 10075 1 1258 . 1 1 107 107 ILE CG1 C 13 27.998 0.300 . 1 . . . . 107 ILE CG1 . 10075 1 1259 . 1 1 107 107 ILE CG2 C 13 17.904 0.300 . 1 . . . . 107 ILE CG2 . 10075 1 1260 . 1 1 107 107 ILE CD1 C 13 14.009 0.300 . 1 . . . . 107 ILE CD1 . 10075 1 1261 . 1 1 107 107 ILE N N 15 122.535 0.300 . 1 . . . . 107 ILE N . 10075 1 1262 . 1 1 108 108 SER H H 1 7.676 0.030 . 1 . . . . 108 SER H . 10075 1 1263 . 1 1 108 108 SER HA H 1 5.614 0.030 . 1 . . . . 108 SER HA . 10075 1 1264 . 1 1 108 108 SER HB2 H 1 3.652 0.030 . 2 . . . . 108 SER HB2 . 10075 1 1265 . 1 1 108 108 SER HB3 H 1 3.535 0.030 . 2 . . . . 108 SER HB3 . 10075 1 1266 . 1 1 108 108 SER C C 13 174.778 0.300 . 1 . . . . 108 SER C . 10075 1 1267 . 1 1 108 108 SER CA C 13 56.081 0.300 . 1 . . . . 108 SER CA . 10075 1 1268 . 1 1 108 108 SER CB C 13 64.438 0.300 . 1 . . . . 108 SER CB . 10075 1 1269 . 1 1 108 108 SER N N 15 118.442 0.300 . 1 . . . . 108 SER N . 10075 1 1270 . 1 1 109 109 SER H H 1 9.184 0.030 . 1 . . . . 109 SER H . 10075 1 1271 . 1 1 109 109 SER HA H 1 4.215 0.030 . 1 . . . . 109 SER HA . 10075 1 1272 . 1 1 109 109 SER HB2 H 1 4.484 0.030 . 2 . . . . 109 SER HB2 . 10075 1 1273 . 1 1 109 109 SER HB3 H 1 3.790 0.030 . 2 . . . . 109 SER HB3 . 10075 1 1274 . 1 1 109 109 SER C C 13 174.952 0.300 . 1 . . . . 109 SER C . 10075 1 1275 . 1 1 109 109 SER CA C 13 58.118 0.300 . 1 . . . . 109 SER CA . 10075 1 1276 . 1 1 109 109 SER CB C 13 63.657 0.300 . 1 . . . . 109 SER CB . 10075 1 1277 . 1 1 109 109 SER N N 15 119.722 0.300 . 1 . . . . 109 SER N . 10075 1 1278 . 1 1 110 110 GLY H H 1 8.153 0.030 . 1 . . . . 110 GLY H . 10075 1 1279 . 1 1 110 110 GLY HA2 H 1 4.229 0.030 . 2 . . . . 110 GLY HA2 . 10075 1 1280 . 1 1 110 110 GLY HA3 H 1 3.530 0.030 . 2 . . . . 110 GLY HA3 . 10075 1 1281 . 1 1 110 110 GLY C C 13 172.517 0.300 . 1 . . . . 110 GLY C . 10075 1 1282 . 1 1 110 110 GLY CA C 13 44.286 0.300 . 1 . . . . 110 GLY CA . 10075 1 1283 . 1 1 110 110 GLY N N 15 106.369 0.300 . 1 . . . . 110 GLY N . 10075 1 1284 . 1 1 111 111 VAL H H 1 7.665 0.030 . 1 . . . . 111 VAL H . 10075 1 1285 . 1 1 111 111 VAL HA H 1 4.398 0.030 . 1 . . . . 111 VAL HA . 10075 1 1286 . 1 1 111 111 VAL HB H 1 2.162 0.030 . 1 . . . . 111 VAL HB . 10075 1 1287 . 1 1 111 111 VAL HG11 H 1 1.030 0.030 . 1 . . . . 111 VAL HG1 . 10075 1 1288 . 1 1 111 111 VAL HG12 H 1 1.030 0.030 . 1 . . . . 111 VAL HG1 . 10075 1 1289 . 1 1 111 111 VAL HG13 H 1 1.030 0.030 . 1 . . . . 111 VAL HG1 . 10075 1 1290 . 1 1 111 111 VAL HG21 H 1 0.924 0.030 . 1 . . . . 111 VAL HG2 . 10075 1 1291 . 1 1 111 111 VAL HG22 H 1 0.924 0.030 . 1 . . . . 111 VAL HG2 . 10075 1 1292 . 1 1 111 111 VAL HG23 H 1 0.924 0.030 . 1 . . . . 111 VAL HG2 . 10075 1 1293 . 1 1 111 111 VAL C C 13 173.947 0.300 . 1 . . . . 111 VAL C . 10075 1 1294 . 1 1 111 111 VAL CA C 13 59.132 0.300 . 1 . . . . 111 VAL CA . 10075 1 1295 . 1 1 111 111 VAL CB C 13 32.475 0.300 . 1 . . . . 111 VAL CB . 10075 1 1296 . 1 1 111 111 VAL CG1 C 13 21.665 0.300 . 2 . . . . 111 VAL CG1 . 10075 1 1297 . 1 1 111 111 VAL CG2 C 13 19.652 0.300 . 2 . . . . 111 VAL CG2 . 10075 1 1298 . 1 1 111 111 VAL N N 15 113.742 0.300 . 1 . . . . 111 VAL N . 10075 1 1299 . 1 1 112 112 PRO HA H 1 4.688 0.030 . 1 . . . . 112 PRO HA . 10075 1 1300 . 1 1 112 112 PRO HB2 H 1 2.326 0.030 . 2 . . . . 112 PRO HB2 . 10075 1 1301 . 1 1 112 112 PRO HB3 H 1 1.905 0.030 . 2 . . . . 112 PRO HB3 . 10075 1 1302 . 1 1 112 112 PRO HG2 H 1 2.065 0.030 . 2 . . . . 112 PRO HG2 . 10075 1 1303 . 1 1 112 112 PRO HG3 H 1 2.002 0.030 . 2 . . . . 112 PRO HG3 . 10075 1 1304 . 1 1 112 112 PRO HD2 H 1 3.720 0.030 . 2 . . . . 112 PRO HD2 . 10075 1 1305 . 1 1 112 112 PRO HD3 H 1 3.680 0.030 . 2 . . . . 112 PRO HD3 . 10075 1 1306 . 1 1 112 112 PRO CA C 13 61.472 0.300 . 1 . . . . 112 PRO CA . 10075 1 1307 . 1 1 112 112 PRO CB C 13 30.776 0.300 . 1 . . . . 112 PRO CB . 10075 1 1308 . 1 1 112 112 PRO CG C 13 27.420 0.300 . 1 . . . . 112 PRO CG . 10075 1 1309 . 1 1 112 112 PRO CD C 13 50.619 0.300 . 1 . . . . 112 PRO CD . 10075 1 1310 . 1 1 113 113 PRO HA H 1 4.471 0.030 . 1 . . . . 113 PRO HA . 10075 1 1311 . 1 1 113 113 PRO HB2 H 1 2.327 0.030 . 2 . . . . 113 PRO HB2 . 10075 1 1312 . 1 1 113 113 PRO HB3 H 1 1.968 0.030 . 2 . . . . 113 PRO HB3 . 10075 1 1313 . 1 1 113 113 PRO HG2 H 1 2.060 0.030 . 1 . . . . 113 PRO HG2 . 10075 1 1314 . 1 1 113 113 PRO HG3 H 1 2.060 0.030 . 1 . . . . 113 PRO HG3 . 10075 1 1315 . 1 1 113 113 PRO HD2 H 1 3.837 0.030 . 2 . . . . 113 PRO HD2 . 10075 1 1316 . 1 1 113 113 PRO HD3 H 1 3.662 0.030 . 2 . . . . 113 PRO HD3 . 10075 1 1317 . 1 1 113 113 PRO C C 13 177.056 0.300 . 1 . . . . 113 PRO C . 10075 1 1318 . 1 1 113 113 PRO CA C 13 63.106 0.300 . 1 . . . . 113 PRO CA . 10075 1 1319 . 1 1 113 113 PRO CB C 13 32.093 0.300 . 1 . . . . 113 PRO CB . 10075 1 1320 . 1 1 113 113 PRO CG C 13 27.465 0.300 . 1 . . . . 113 PRO CG . 10075 1 1321 . 1 1 113 113 PRO CD C 13 50.715 0.300 . 1 . . . . 113 PRO CD . 10075 1 1322 . 1 1 114 114 SER H H 1 8.349 0.030 . 1 . . . . 114 SER H . 10075 1 1323 . 1 1 114 114 SER HA H 1 4.472 0.030 . 1 . . . . 114 SER HA . 10075 1 1324 . 1 1 114 114 SER HB2 H 1 3.879 0.030 . 1 . . . . 114 SER HB2 . 10075 1 1325 . 1 1 114 114 SER HB3 H 1 3.879 0.030 . 1 . . . . 114 SER HB3 . 10075 1 1326 . 1 1 114 114 SER C C 13 174.639 0.300 . 1 . . . . 114 SER C . 10075 1 1327 . 1 1 114 114 SER CA C 13 58.296 0.300 . 1 . . . . 114 SER CA . 10075 1 1328 . 1 1 114 114 SER CB C 13 64.090 0.300 . 1 . . . . 114 SER CB . 10075 1 1329 . 1 1 114 114 SER N N 15 115.680 0.300 . 1 . . . . 114 SER N . 10075 1 1330 . 1 1 115 115 GLY H H 1 8.222 0.030 . 1 . . . . 115 GLY H . 10075 1 1331 . 1 1 115 115 GLY HA2 H 1 4.163 0.030 . 2 . . . . 115 GLY HA2 . 10075 1 1332 . 1 1 115 115 GLY HA3 H 1 4.107 0.030 . 2 . . . . 115 GLY HA3 . 10075 1 1333 . 1 1 115 115 GLY C C 13 171.754 0.300 . 1 . . . . 115 GLY C . 10075 1 1334 . 1 1 115 115 GLY CA C 13 44.682 0.300 . 1 . . . . 115 GLY CA . 10075 1 1335 . 1 1 115 115 GLY N N 15 110.564 0.300 . 1 . . . . 115 GLY N . 10075 1 1336 . 1 1 116 116 PRO HD2 H 1 3.630 0.030 . 1 . . . . 116 PRO HD2 . 10075 1 1337 . 1 1 116 116 PRO HD3 H 1 3.630 0.030 . 1 . . . . 116 PRO HD3 . 10075 1 1338 . 1 1 118 118 SER HA H 1 4.508 0.030 . 1 . . . . 118 SER HA . 10075 1 1339 . 1 1 118 118 SER HB2 H 1 3.900 0.030 . 1 . . . . 118 SER HB2 . 10075 1 1340 . 1 1 118 118 SER HB3 H 1 3.900 0.030 . 1 . . . . 118 SER HB3 . 10075 1 1341 . 1 1 118 118 SER C C 13 173.931 0.300 . 1 . . . . 118 SER C . 10075 1 1342 . 1 1 118 118 SER CA C 13 58.412 0.300 . 1 . . . . 118 SER CA . 10075 1 1343 . 1 1 118 118 SER CB C 13 64.208 0.300 . 1 . . . . 118 SER CB . 10075 1 1344 . 1 1 119 119 GLY H H 1 8.046 0.030 . 1 . . . . 119 GLY H . 10075 1 1345 . 1 1 119 119 GLY HA2 H 1 3.787 0.030 . 1 . . . . 119 GLY HA2 . 10075 1 1346 . 1 1 119 119 GLY HA3 H 1 3.787 0.030 . 1 . . . . 119 GLY HA3 . 10075 1 1347 . 1 1 119 119 GLY C C 13 178.997 0.300 . 1 . . . . 119 GLY C . 10075 1 1348 . 1 1 119 119 GLY CA C 13 46.266 0.300 . 1 . . . . 119 GLY CA . 10075 1 1349 . 1 1 119 119 GLY N N 15 116.876 0.300 . 1 . . . . 119 GLY N . 10075 1 stop_ save_