data_11189 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11189 _Entry.Title ; Solution structure of the second PDZ domain of human InaD-like protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-21 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-20 _Entry.Original_release_date 2011-07-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 K. Inoue . . . 11189 2 C. Kurosaki . . . 11189 3 K. Izumi . . . 11189 4 M. Yoshida . . . 11189 5 F. Hayashi . . . 11189 6 S. Yokoyama . . . 11189 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11189 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11189 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 416 11189 '15N chemical shifts' 106 11189 '1H chemical shifts' 673 11189 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 . . 2011-07-20 2010-07-21 original author . 11189 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DLU 'BMRB Entry Tracking System' 11189 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11189 _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 'Solution structure of the second PDZ domain of human InaD-like protein' _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 K. Inoue . . . 11189 1 2 C. Kurosaki . . . 11189 1 3 K. Izumi . . . 11189 1 4 M. Yoshida . . . 11189 1 5 F. Hayashi . . . 11189 1 6 S. Yokoyama . . . 11189 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11189 _Assembly.ID 1 _Assembly.Name 'InaD-like protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PDZ domain' 1 $entity_1 A . yes native no no . . . 11189 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 yes PDB 2dlu . . . . . . 11189 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11189 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PDZ domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGPETVCWGHVEEVE LINDGSGLGFGIVGGKTSGV VVRTIVPGGLADRDGRLQTG DHILKIGGTNVQGMTSEQVA QVLRNCGNSVRMLVARDPAG DISVTSGPSSG ; _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 111 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 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 2DLU . "Solution Structure Of The Second Pdz Domain Of Human Inad- Like Protein" . . . . . 100.00 111 100.00 100.00 5.14e-70 . . . . 11189 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 11189 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 . 11189 1 2 . SER . 11189 1 3 . SER . 11189 1 4 . GLY . 11189 1 5 . SER . 11189 1 6 . SER . 11189 1 7 . GLY . 11189 1 8 . PRO . 11189 1 9 . GLU . 11189 1 10 . THR . 11189 1 11 . VAL . 11189 1 12 . CYS . 11189 1 13 . TRP . 11189 1 14 . GLY . 11189 1 15 . HIS . 11189 1 16 . VAL . 11189 1 17 . GLU . 11189 1 18 . GLU . 11189 1 19 . VAL . 11189 1 20 . GLU . 11189 1 21 . LEU . 11189 1 22 . ILE . 11189 1 23 . ASN . 11189 1 24 . ASP . 11189 1 25 . GLY . 11189 1 26 . SER . 11189 1 27 . GLY . 11189 1 28 . LEU . 11189 1 29 . GLY . 11189 1 30 . PHE . 11189 1 31 . GLY . 11189 1 32 . ILE . 11189 1 33 . VAL . 11189 1 34 . GLY . 11189 1 35 . GLY . 11189 1 36 . LYS . 11189 1 37 . THR . 11189 1 38 . SER . 11189 1 39 . GLY . 11189 1 40 . VAL . 11189 1 41 . VAL . 11189 1 42 . VAL . 11189 1 43 . ARG . 11189 1 44 . THR . 11189 1 45 . ILE . 11189 1 46 . VAL . 11189 1 47 . PRO . 11189 1 48 . GLY . 11189 1 49 . GLY . 11189 1 50 . LEU . 11189 1 51 . ALA . 11189 1 52 . ASP . 11189 1 53 . ARG . 11189 1 54 . ASP . 11189 1 55 . GLY . 11189 1 56 . ARG . 11189 1 57 . LEU . 11189 1 58 . GLN . 11189 1 59 . THR . 11189 1 60 . GLY . 11189 1 61 . ASP . 11189 1 62 . HIS . 11189 1 63 . ILE . 11189 1 64 . LEU . 11189 1 65 . LYS . 11189 1 66 . ILE . 11189 1 67 . GLY . 11189 1 68 . GLY . 11189 1 69 . THR . 11189 1 70 . ASN . 11189 1 71 . VAL . 11189 1 72 . GLN . 11189 1 73 . GLY . 11189 1 74 . MET . 11189 1 75 . THR . 11189 1 76 . SER . 11189 1 77 . GLU . 11189 1 78 . GLN . 11189 1 79 . VAL . 11189 1 80 . ALA . 11189 1 81 . GLN . 11189 1 82 . VAL . 11189 1 83 . LEU . 11189 1 84 . ARG . 11189 1 85 . ASN . 11189 1 86 . CYS . 11189 1 87 . GLY . 11189 1 88 . ASN . 11189 1 89 . SER . 11189 1 90 . VAL . 11189 1 91 . ARG . 11189 1 92 . MET . 11189 1 93 . LEU . 11189 1 94 . VAL . 11189 1 95 . ALA . 11189 1 96 . ARG . 11189 1 97 . ASP . 11189 1 98 . PRO . 11189 1 99 . ALA . 11189 1 100 . GLY . 11189 1 101 . ASP . 11189 1 102 . ILE . 11189 1 103 . SER . 11189 1 104 . VAL . 11189 1 105 . THR . 11189 1 106 . SER . 11189 1 107 . GLY . 11189 1 108 . PRO . 11189 1 109 . SER . 11189 1 110 . SER . 11189 1 111 . GLY . 11189 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 11189 1 . SER 2 2 11189 1 . SER 3 3 11189 1 . GLY 4 4 11189 1 . SER 5 5 11189 1 . SER 6 6 11189 1 . GLY 7 7 11189 1 . PRO 8 8 11189 1 . GLU 9 9 11189 1 . THR 10 10 11189 1 . VAL 11 11 11189 1 . CYS 12 12 11189 1 . TRP 13 13 11189 1 . GLY 14 14 11189 1 . HIS 15 15 11189 1 . VAL 16 16 11189 1 . GLU 17 17 11189 1 . GLU 18 18 11189 1 . VAL 19 19 11189 1 . GLU 20 20 11189 1 . LEU 21 21 11189 1 . ILE 22 22 11189 1 . ASN 23 23 11189 1 . ASP 24 24 11189 1 . GLY 25 25 11189 1 . SER 26 26 11189 1 . GLY 27 27 11189 1 . LEU 28 28 11189 1 . GLY 29 29 11189 1 . PHE 30 30 11189 1 . GLY 31 31 11189 1 . ILE 32 32 11189 1 . VAL 33 33 11189 1 . GLY 34 34 11189 1 . GLY 35 35 11189 1 . LYS 36 36 11189 1 . THR 37 37 11189 1 . SER 38 38 11189 1 . GLY 39 39 11189 1 . VAL 40 40 11189 1 . VAL 41 41 11189 1 . VAL 42 42 11189 1 . ARG 43 43 11189 1 . THR 44 44 11189 1 . ILE 45 45 11189 1 . VAL 46 46 11189 1 . PRO 47 47 11189 1 . GLY 48 48 11189 1 . GLY 49 49 11189 1 . LEU 50 50 11189 1 . ALA 51 51 11189 1 . ASP 52 52 11189 1 . ARG 53 53 11189 1 . ASP 54 54 11189 1 . GLY 55 55 11189 1 . ARG 56 56 11189 1 . LEU 57 57 11189 1 . GLN 58 58 11189 1 . THR 59 59 11189 1 . GLY 60 60 11189 1 . ASP 61 61 11189 1 . HIS 62 62 11189 1 . ILE 63 63 11189 1 . LEU 64 64 11189 1 . LYS 65 65 11189 1 . ILE 66 66 11189 1 . GLY 67 67 11189 1 . GLY 68 68 11189 1 . THR 69 69 11189 1 . ASN 70 70 11189 1 . VAL 71 71 11189 1 . GLN 72 72 11189 1 . GLY 73 73 11189 1 . MET 74 74 11189 1 . THR 75 75 11189 1 . SER 76 76 11189 1 . GLU 77 77 11189 1 . GLN 78 78 11189 1 . VAL 79 79 11189 1 . ALA 80 80 11189 1 . GLN 81 81 11189 1 . VAL 82 82 11189 1 . LEU 83 83 11189 1 . ARG 84 84 11189 1 . ASN 85 85 11189 1 . CYS 86 86 11189 1 . GLY 87 87 11189 1 . ASN 88 88 11189 1 . SER 89 89 11189 1 . VAL 90 90 11189 1 . ARG 91 91 11189 1 . MET 92 92 11189 1 . LEU 93 93 11189 1 . VAL 94 94 11189 1 . ALA 95 95 11189 1 . ARG 96 96 11189 1 . ASP 97 97 11189 1 . PRO 98 98 11189 1 . ALA 99 99 11189 1 . GLY 100 100 11189 1 . ASP 101 101 11189 1 . ILE 102 102 11189 1 . SER 103 103 11189 1 . VAL 104 104 11189 1 . THR 105 105 11189 1 . SER 106 106 11189 1 . GLY 107 107 11189 1 . PRO 108 108 11189 1 . SER 109 109 11189 1 . SER 110 110 11189 1 . GLY 111 111 11189 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 11189 _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 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11189 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 11189 _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' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P050627-16 . . . . . . 11189 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11189 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.11mM U-15N, 13C-labeled {protein;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 90% H2O, 10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.11 . . mM . . . . 11189 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11189 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11189 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11189 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11189 1 6 H2O . . . . . . solvent 90 . . % . . . . 11189 1 7 D2O . . . . . . solvent 10 . . % . . . . 11189 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 11189 _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 11189 1 pH 7.0 0.05 pH 11189 1 pressure 1 0.001 atm 11189 1 temperature 298 0.1 K 11189 1 stop_ save_ ############################ # Computer software used # ############################ save_Delta_NMR _Software.Sf_category software _Software.Sf_framecode Delta_NMR _Software.Entry_ID 11189 _Software.ID 1 _Software.Name 'Delta NMR' _Software.Version 4.3.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID JEOL . . 11189 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11189 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11189 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11189 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11189 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11189 _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.' . . 11189 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11189 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11189 _Software.ID 4 _Software.Name Kujira _Software.Version 0.93191 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11189 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11189 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11189 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11189 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11189 5 'structure solution' 11189 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 11189 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer JEOL _NMR_spectrometer.Model ECA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11189 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 JEOL ECA . 800 . . . 11189 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 11189 _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 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11189 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11189 1 stop_ 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 11189 _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 . . . . . . . . . 11189 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11189 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11189 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 11189 _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 15N-separated NOESY' 1 $sample_1 isotropic 11189 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11189 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $Delta_NMR . . 11189 1 2 $NMRPipe . . 11189 1 3 $NMRView . . 11189 1 4 $Kujira . . 11189 1 5 $CYANA . . 11189 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 4.417 0.030 . 1 . . . . 8 PRO HA . 11189 1 2 . 1 1 8 8 PRO HB2 H 1 2.280 0.030 . 2 . . . . 8 PRO HB2 . 11189 1 3 . 1 1 8 8 PRO HB3 H 1 1.944 0.030 . 2 . . . . 8 PRO HB3 . 11189 1 4 . 1 1 8 8 PRO HD2 H 1 3.628 0.030 . 1 . . . . 8 PRO HD2 . 11189 1 5 . 1 1 8 8 PRO HD3 H 1 3.628 0.030 . 1 . . . . 8 PRO HD3 . 11189 1 6 . 1 1 8 8 PRO HG2 H 1 2.009 0.030 . 1 . . . . 8 PRO HG2 . 11189 1 7 . 1 1 8 8 PRO HG3 H 1 2.009 0.030 . 1 . . . . 8 PRO HG3 . 11189 1 8 . 1 1 8 8 PRO C C 13 177.117 0.300 . 1 . . . . 8 PRO C . 11189 1 9 . 1 1 8 8 PRO CA C 13 63.328 0.300 . 1 . . . . 8 PRO CA . 11189 1 10 . 1 1 8 8 PRO CB C 13 31.965 0.300 . 1 . . . . 8 PRO CB . 11189 1 11 . 1 1 8 8 PRO CD C 13 49.589 0.300 . 1 . . . . 8 PRO CD . 11189 1 12 . 1 1 8 8 PRO CG C 13 26.968 0.300 . 1 . . . . 8 PRO CG . 11189 1 13 . 1 1 9 9 GLU H H 1 8.770 0.030 . 1 . . . . 9 GLU H . 11189 1 14 . 1 1 9 9 GLU HA H 1 4.306 0.030 . 1 . . . . 9 GLU HA . 11189 1 15 . 1 1 9 9 GLU HB2 H 1 1.965 0.030 . 2 . . . . 9 GLU HB2 . 11189 1 16 . 1 1 9 9 GLU HB3 H 1 2.058 0.030 . 2 . . . . 9 GLU HB3 . 11189 1 17 . 1 1 9 9 GLU HG2 H 1 2.249 0.030 . 2 . . . . 9 GLU HG2 . 11189 1 18 . 1 1 9 9 GLU HG3 H 1 2.301 0.030 . 2 . . . . 9 GLU HG3 . 11189 1 19 . 1 1 9 9 GLU C C 13 176.601 0.300 . 1 . . . . 9 GLU C . 11189 1 20 . 1 1 9 9 GLU CA C 13 56.892 0.300 . 1 . . . . 9 GLU CA . 11189 1 21 . 1 1 9 9 GLU CB C 13 29.631 0.300 . 1 . . . . 9 GLU CB . 11189 1 22 . 1 1 9 9 GLU CG C 13 36.166 0.300 . 1 . . . . 9 GLU CG . 11189 1 23 . 1 1 9 9 GLU N N 15 120.372 0.300 . 1 . . . . 9 GLU N . 11189 1 24 . 1 1 10 10 THR H H 1 8.103 0.030 . 1 . . . . 10 THR H . 11189 1 25 . 1 1 10 10 THR HA H 1 4.296 0.030 . 1 . . . . 10 THR HA . 11189 1 26 . 1 1 10 10 THR HB H 1 4.158 0.030 . 1 . . . . 10 THR HB . 11189 1 27 . 1 1 10 10 THR HG21 H 1 1.095 0.030 . 1 . . . . 10 THR HG2 . 11189 1 28 . 1 1 10 10 THR HG22 H 1 1.095 0.030 . 1 . . . . 10 THR HG2 . 11189 1 29 . 1 1 10 10 THR HG23 H 1 1.095 0.030 . 1 . . . . 10 THR HG2 . 11189 1 30 . 1 1 10 10 THR C C 13 174.210 0.300 . 1 . . . . 10 THR C . 11189 1 31 . 1 1 10 10 THR CA C 13 61.958 0.300 . 1 . . . . 10 THR CA . 11189 1 32 . 1 1 10 10 THR CB C 13 69.611 0.300 . 1 . . . . 10 THR CB . 11189 1 33 . 1 1 10 10 THR CG2 C 13 21.502 0.300 . 1 . . . . 10 THR CG2 . 11189 1 34 . 1 1 10 10 THR N N 15 114.556 0.300 . 1 . . . . 10 THR N . 11189 1 35 . 1 1 11 11 VAL H H 1 7.906 0.030 . 1 . . . . 11 VAL H . 11189 1 36 . 1 1 11 11 VAL HA H 1 3.967 0.030 . 1 . . . . 11 VAL HA . 11189 1 37 . 1 1 11 11 VAL HB H 1 1.797 0.030 . 1 . . . . 11 VAL HB . 11189 1 38 . 1 1 11 11 VAL HG11 H 1 0.731 0.030 . 1 . . . . 11 VAL HG1 . 11189 1 39 . 1 1 11 11 VAL HG12 H 1 0.731 0.030 . 1 . . . . 11 VAL HG1 . 11189 1 40 . 1 1 11 11 VAL HG13 H 1 0.731 0.030 . 1 . . . . 11 VAL HG1 . 11189 1 41 . 1 1 11 11 VAL HG21 H 1 0.452 0.030 . 1 . . . . 11 VAL HG2 . 11189 1 42 . 1 1 11 11 VAL HG22 H 1 0.452 0.030 . 1 . . . . 11 VAL HG2 . 11189 1 43 . 1 1 11 11 VAL HG23 H 1 0.452 0.030 . 1 . . . . 11 VAL HG2 . 11189 1 44 . 1 1 11 11 VAL C C 13 175.263 0.300 . 1 . . . . 11 VAL C . 11189 1 45 . 1 1 11 11 VAL CA C 13 62.160 0.300 . 1 . . . . 11 VAL CA . 11189 1 46 . 1 1 11 11 VAL CB C 13 32.593 0.300 . 1 . . . . 11 VAL CB . 11189 1 47 . 1 1 11 11 VAL CG1 C 13 20.431 0.300 . 2 . . . . 11 VAL CG1 . 11189 1 48 . 1 1 11 11 VAL CG2 C 13 20.494 0.300 . 2 . . . . 11 VAL CG2 . 11189 1 49 . 1 1 11 11 VAL N N 15 122.299 0.300 . 1 . . . . 11 VAL N . 11189 1 50 . 1 1 12 12 CYS H H 1 8.098 0.030 . 1 . . . . 12 CYS H . 11189 1 51 . 1 1 12 12 CYS HA H 1 4.380 0.030 . 1 . . . . 12 CYS HA . 11189 1 52 . 1 1 12 12 CYS HB2 H 1 2.654 0.030 . 1 . . . . 12 CYS HB2 . 11189 1 53 . 1 1 12 12 CYS HB3 H 1 2.654 0.030 . 1 . . . . 12 CYS HB3 . 11189 1 54 . 1 1 12 12 CYS C C 13 173.277 0.300 . 1 . . . . 12 CYS C . 11189 1 55 . 1 1 12 12 CYS CA C 13 57.771 0.300 . 1 . . . . 12 CYS CA . 11189 1 56 . 1 1 12 12 CYS CB C 13 27.647 0.300 . 1 . . . . 12 CYS CB . 11189 1 57 . 1 1 12 12 CYS N N 15 122.096 0.300 . 1 . . . . 12 CYS N . 11189 1 58 . 1 1 13 13 TRP H H 1 7.925 0.030 . 1 . . . . 13 TRP H . 11189 1 59 . 1 1 13 13 TRP HA H 1 4.648 0.030 . 1 . . . . 13 TRP HA . 11189 1 60 . 1 1 13 13 TRP HB2 H 1 2.803 0.030 . 2 . . . . 13 TRP HB2 . 11189 1 61 . 1 1 13 13 TRP HB3 H 1 3.234 0.030 . 2 . . . . 13 TRP HB3 . 11189 1 62 . 1 1 13 13 TRP HD1 H 1 7.075 0.030 . 1 . . . . 13 TRP HD1 . 11189 1 63 . 1 1 13 13 TRP HE1 H 1 9.979 0.030 . 1 . . . . 13 TRP HE1 . 11189 1 64 . 1 1 13 13 TRP HE3 H 1 7.182 0.030 . 1 . . . . 13 TRP HE3 . 11189 1 65 . 1 1 13 13 TRP HH2 H 1 6.337 0.030 . 1 . . . . 13 TRP HH2 . 11189 1 66 . 1 1 13 13 TRP HZ2 H 1 7.104 0.030 . 1 . . . . 13 TRP HZ2 . 11189 1 67 . 1 1 13 13 TRP HZ3 H 1 6.584 0.030 . 1 . . . . 13 TRP HZ3 . 11189 1 68 . 1 1 13 13 TRP C C 13 176.437 0.300 . 1 . . . . 13 TRP C . 11189 1 69 . 1 1 13 13 TRP CA C 13 55.988 0.300 . 1 . . . . 13 TRP CA . 11189 1 70 . 1 1 13 13 TRP CB C 13 31.393 0.300 . 1 . . . . 13 TRP CB . 11189 1 71 . 1 1 13 13 TRP CD1 C 13 127.161 0.300 . 1 . . . . 13 TRP CD1 . 11189 1 72 . 1 1 13 13 TRP CE3 C 13 119.832 0.300 . 1 . . . . 13 TRP CE3 . 11189 1 73 . 1 1 13 13 TRP CH2 C 13 123.304 0.300 . 1 . . . . 13 TRP CH2 . 11189 1 74 . 1 1 13 13 TRP CZ2 C 13 114.189 0.300 . 1 . . . . 13 TRP CZ2 . 11189 1 75 . 1 1 13 13 TRP CZ3 C 13 121.062 0.300 . 1 . . . . 13 TRP CZ3 . 11189 1 76 . 1 1 13 13 TRP N N 15 123.352 0.300 . 1 . . . . 13 TRP N . 11189 1 77 . 1 1 13 13 TRP NE1 N 15 128.918 0.300 . 1 . . . . 13 TRP NE1 . 11189 1 78 . 1 1 14 14 GLY H H 1 8.968 0.030 . 1 . . . . 14 GLY H . 11189 1 79 . 1 1 14 14 GLY HA2 H 1 4.003 0.030 . 2 . . . . 14 GLY HA2 . 11189 1 80 . 1 1 14 14 GLY HA3 H 1 4.081 0.030 . 2 . . . . 14 GLY HA3 . 11189 1 81 . 1 1 14 14 GLY C C 13 173.760 0.300 . 1 . . . . 14 GLY C . 11189 1 82 . 1 1 14 14 GLY CA C 13 46.218 0.300 . 1 . . . . 14 GLY CA . 11189 1 83 . 1 1 14 14 GLY N N 15 111.112 0.300 . 1 . . . . 14 GLY N . 11189 1 84 . 1 1 15 15 HIS H H 1 8.112 0.030 . 1 . . . . 15 HIS H . 11189 1 85 . 1 1 15 15 HIS HA H 1 4.817 0.030 . 1 . . . . 15 HIS HA . 11189 1 86 . 1 1 15 15 HIS HB2 H 1 2.988 0.030 . 2 . . . . 15 HIS HB2 . 11189 1 87 . 1 1 15 15 HIS HB3 H 1 3.113 0.030 . 2 . . . . 15 HIS HB3 . 11189 1 88 . 1 1 15 15 HIS HD2 H 1 6.757 0.030 . 1 . . . . 15 HIS HD2 . 11189 1 89 . 1 1 15 15 HIS HE1 H 1 8.133 0.030 . 1 . . . . 15 HIS HE1 . 11189 1 90 . 1 1 15 15 HIS C C 13 172.696 0.300 . 1 . . . . 15 HIS C . 11189 1 91 . 1 1 15 15 HIS CA C 13 56.170 0.300 . 1 . . . . 15 HIS CA . 11189 1 92 . 1 1 15 15 HIS CB C 13 31.949 0.300 . 1 . . . . 15 HIS CB . 11189 1 93 . 1 1 15 15 HIS CD2 C 13 118.222 0.300 . 1 . . . . 15 HIS CD2 . 11189 1 94 . 1 1 15 15 HIS CE1 C 13 137.843 0.300 . 1 . . . . 15 HIS CE1 . 11189 1 95 . 1 1 15 15 HIS N N 15 118.943 0.300 . 1 . . . . 15 HIS N . 11189 1 96 . 1 1 16 16 VAL H H 1 7.849 0.030 . 1 . . . . 16 VAL H . 11189 1 97 . 1 1 16 16 VAL HA H 1 4.956 0.030 . 1 . . . . 16 VAL HA . 11189 1 98 . 1 1 16 16 VAL HB H 1 1.778 0.030 . 1 . . . . 16 VAL HB . 11189 1 99 . 1 1 16 16 VAL HG11 H 1 0.748 0.030 . 1 . . . . 16 VAL HG1 . 11189 1 100 . 1 1 16 16 VAL HG12 H 1 0.748 0.030 . 1 . . . . 16 VAL HG1 . 11189 1 101 . 1 1 16 16 VAL HG13 H 1 0.748 0.030 . 1 . . . . 16 VAL HG1 . 11189 1 102 . 1 1 16 16 VAL HG21 H 1 0.802 0.030 . 1 . . . . 16 VAL HG2 . 11189 1 103 . 1 1 16 16 VAL HG22 H 1 0.802 0.030 . 1 . . . . 16 VAL HG2 . 11189 1 104 . 1 1 16 16 VAL HG23 H 1 0.802 0.030 . 1 . . . . 16 VAL HG2 . 11189 1 105 . 1 1 16 16 VAL C C 13 174.791 0.300 . 1 . . . . 16 VAL C . 11189 1 106 . 1 1 16 16 VAL CA C 13 60.174 0.300 . 1 . . . . 16 VAL CA . 11189 1 107 . 1 1 16 16 VAL CB C 13 34.473 0.300 . 1 . . . . 16 VAL CB . 11189 1 108 . 1 1 16 16 VAL CG1 C 13 21.198 0.300 . 2 . . . . 16 VAL CG1 . 11189 1 109 . 1 1 16 16 VAL CG2 C 13 20.711 0.300 . 2 . . . . 16 VAL CG2 . 11189 1 110 . 1 1 16 16 VAL N N 15 124.369 0.300 . 1 . . . . 16 VAL N . 11189 1 111 . 1 1 17 17 GLU H H 1 8.997 0.030 . 1 . . . . 17 GLU H . 11189 1 112 . 1 1 17 17 GLU HA H 1 4.536 0.030 . 1 . . . . 17 GLU HA . 11189 1 113 . 1 1 17 17 GLU HB2 H 1 1.767 0.030 . 1 . . . . 17 GLU HB2 . 11189 1 114 . 1 1 17 17 GLU HB3 H 1 1.767 0.030 . 1 . . . . 17 GLU HB3 . 11189 1 115 . 1 1 17 17 GLU HG2 H 1 2.009 0.030 . 1 . . . . 17 GLU HG2 . 11189 1 116 . 1 1 17 17 GLU HG3 H 1 2.009 0.030 . 1 . . . . 17 GLU HG3 . 11189 1 117 . 1 1 17 17 GLU C C 13 173.156 0.300 . 1 . . . . 17 GLU C . 11189 1 118 . 1 1 17 17 GLU CA C 13 54.792 0.300 . 1 . . . . 17 GLU CA . 11189 1 119 . 1 1 17 17 GLU CB C 13 33.862 0.300 . 1 . . . . 17 GLU CB . 11189 1 120 . 1 1 17 17 GLU CG C 13 35.301 0.300 . 1 . . . . 17 GLU CG . 11189 1 121 . 1 1 17 17 GLU N N 15 124.468 0.300 . 1 . . . . 17 GLU N . 11189 1 122 . 1 1 18 18 GLU H H 1 8.663 0.030 . 1 . . . . 18 GLU H . 11189 1 123 . 1 1 18 18 GLU HA H 1 5.172 0.030 . 1 . . . . 18 GLU HA . 11189 1 124 . 1 1 18 18 GLU HB2 H 1 1.827 0.030 . 2 . . . . 18 GLU HB2 . 11189 1 125 . 1 1 18 18 GLU HB3 H 1 1.926 0.030 . 2 . . . . 18 GLU HB3 . 11189 1 126 . 1 1 18 18 GLU HG2 H 1 1.947 0.030 . 2 . . . . 18 GLU HG2 . 11189 1 127 . 1 1 18 18 GLU HG3 H 1 2.076 0.030 . 2 . . . . 18 GLU HG3 . 11189 1 128 . 1 1 18 18 GLU C C 13 175.504 0.300 . 1 . . . . 18 GLU C . 11189 1 129 . 1 1 18 18 GLU CA C 13 54.993 0.300 . 1 . . . . 18 GLU CA . 11189 1 130 . 1 1 18 18 GLU CB C 13 31.214 0.300 . 1 . . . . 18 GLU CB . 11189 1 131 . 1 1 18 18 GLU CG C 13 37.575 0.300 . 1 . . . . 18 GLU CG . 11189 1 132 . 1 1 18 18 GLU N N 15 124.094 0.300 . 1 . . . . 18 GLU N . 11189 1 133 . 1 1 19 19 VAL H H 1 9.105 0.030 . 1 . . . . 19 VAL H . 11189 1 134 . 1 1 19 19 VAL HA H 1 4.008 0.030 . 1 . . . . 19 VAL HA . 11189 1 135 . 1 1 19 19 VAL HB H 1 1.718 0.030 . 1 . . . . 19 VAL HB . 11189 1 136 . 1 1 19 19 VAL HG11 H 1 0.739 0.030 . 1 . . . . 19 VAL HG1 . 11189 1 137 . 1 1 19 19 VAL HG12 H 1 0.739 0.030 . 1 . . . . 19 VAL HG1 . 11189 1 138 . 1 1 19 19 VAL HG13 H 1 0.739 0.030 . 1 . . . . 19 VAL HG1 . 11189 1 139 . 1 1 19 19 VAL HG21 H 1 0.686 0.030 . 1 . . . . 19 VAL HG2 . 11189 1 140 . 1 1 19 19 VAL HG22 H 1 0.686 0.030 . 1 . . . . 19 VAL HG2 . 11189 1 141 . 1 1 19 19 VAL HG23 H 1 0.686 0.030 . 1 . . . . 19 VAL HG2 . 11189 1 142 . 1 1 19 19 VAL C C 13 173.310 0.300 . 1 . . . . 19 VAL C . 11189 1 143 . 1 1 19 19 VAL CA C 13 61.420 0.300 . 1 . . . . 19 VAL CA . 11189 1 144 . 1 1 19 19 VAL CB C 13 35.260 0.300 . 1 . . . . 19 VAL CB . 11189 1 145 . 1 1 19 19 VAL CG1 C 13 20.484 0.300 . 2 . . . . 19 VAL CG1 . 11189 1 146 . 1 1 19 19 VAL CG2 C 13 21.221 0.300 . 2 . . . . 19 VAL CG2 . 11189 1 147 . 1 1 19 19 VAL N N 15 125.283 0.300 . 1 . . . . 19 VAL N . 11189 1 148 . 1 1 20 20 GLU H H 1 7.686 0.030 . 1 . . . . 20 GLU H . 11189 1 149 . 1 1 20 20 GLU HA H 1 5.426 0.030 . 1 . . . . 20 GLU HA . 11189 1 150 . 1 1 20 20 GLU HB2 H 1 1.725 0.030 . 2 . . . . 20 GLU HB2 . 11189 1 151 . 1 1 20 20 GLU HB3 H 1 2.068 0.030 . 2 . . . . 20 GLU HB3 . 11189 1 152 . 1 1 20 20 GLU HG2 H 1 1.876 0.030 . 1 . . . . 20 GLU HG2 . 11189 1 153 . 1 1 20 20 GLU HG3 H 1 1.876 0.030 . 1 . . . . 20 GLU HG3 . 11189 1 154 . 1 1 20 20 GLU C C 13 174.188 0.300 . 1 . . . . 20 GLU C . 11189 1 155 . 1 1 20 20 GLU CA C 13 54.402 0.300 . 1 . . . . 20 GLU CA . 11189 1 156 . 1 1 20 20 GLU CB C 13 31.844 0.300 . 1 . . . . 20 GLU CB . 11189 1 157 . 1 1 20 20 GLU CG C 13 36.600 0.300 . 1 . . . . 20 GLU CG . 11189 1 158 . 1 1 20 20 GLU N N 15 127.270 0.300 . 1 . . . . 20 GLU N . 11189 1 159 . 1 1 21 21 LEU H H 1 8.709 0.030 . 1 . . . . 21 LEU H . 11189 1 160 . 1 1 21 21 LEU HA H 1 4.727 0.030 . 1 . . . . 21 LEU HA . 11189 1 161 . 1 1 21 21 LEU HB2 H 1 1.648 0.030 . 2 . . . . 21 LEU HB2 . 11189 1 162 . 1 1 21 21 LEU HB3 H 1 1.347 0.030 . 2 . . . . 21 LEU HB3 . 11189 1 163 . 1 1 21 21 LEU HD11 H 1 0.896 0.030 . 1 . . . . 21 LEU HD1 . 11189 1 164 . 1 1 21 21 LEU HD12 H 1 0.896 0.030 . 1 . . . . 21 LEU HD1 . 11189 1 165 . 1 1 21 21 LEU HD13 H 1 0.896 0.030 . 1 . . . . 21 LEU HD1 . 11189 1 166 . 1 1 21 21 LEU HD21 H 1 0.821 0.030 . 1 . . . . 21 LEU HD2 . 11189 1 167 . 1 1 21 21 LEU HD22 H 1 0.821 0.030 . 1 . . . . 21 LEU HD2 . 11189 1 168 . 1 1 21 21 LEU HD23 H 1 0.821 0.030 . 1 . . . . 21 LEU HD2 . 11189 1 169 . 1 1 21 21 LEU HG H 1 1.481 0.030 . 1 . . . . 21 LEU HG . 11189 1 170 . 1 1 21 21 LEU C C 13 174.736 0.300 . 1 . . . . 21 LEU C . 11189 1 171 . 1 1 21 21 LEU CA C 13 52.519 0.300 . 1 . . . . 21 LEU CA . 11189 1 172 . 1 1 21 21 LEU CB C 13 44.819 0.300 . 1 . . . . 21 LEU CB . 11189 1 173 . 1 1 21 21 LEU CD1 C 13 26.375 0.300 . 2 . . . . 21 LEU CD1 . 11189 1 174 . 1 1 21 21 LEU CD2 C 13 22.702 0.300 . 2 . . . . 21 LEU CD2 . 11189 1 175 . 1 1 21 21 LEU CG C 13 26.780 0.300 . 1 . . . . 21 LEU CG . 11189 1 176 . 1 1 21 21 LEU N N 15 125.422 0.300 . 1 . . . . 21 LEU N . 11189 1 177 . 1 1 22 22 ILE H H 1 8.400 0.030 . 1 . . . . 22 ILE H . 11189 1 178 . 1 1 22 22 ILE HA H 1 4.605 0.030 . 1 . . . . 22 ILE HA . 11189 1 179 . 1 1 22 22 ILE HB H 1 1.810 0.030 . 1 . . . . 22 ILE HB . 11189 1 180 . 1 1 22 22 ILE HD11 H 1 0.793 0.030 . 1 . . . . 22 ILE HD1 . 11189 1 181 . 1 1 22 22 ILE HD12 H 1 0.793 0.030 . 1 . . . . 22 ILE HD1 . 11189 1 182 . 1 1 22 22 ILE HD13 H 1 0.793 0.030 . 1 . . . . 22 ILE HD1 . 11189 1 183 . 1 1 22 22 ILE HG12 H 1 1.424 0.030 . 2 . . . . 22 ILE HG12 . 11189 1 184 . 1 1 22 22 ILE HG13 H 1 1.151 0.030 . 2 . . . . 22 ILE HG13 . 11189 1 185 . 1 1 22 22 ILE HG21 H 1 0.777 0.030 . 1 . . . . 22 ILE HG2 . 11189 1 186 . 1 1 22 22 ILE HG22 H 1 0.777 0.030 . 1 . . . . 22 ILE HG2 . 11189 1 187 . 1 1 22 22 ILE HG23 H 1 0.777 0.030 . 1 . . . . 22 ILE HG2 . 11189 1 188 . 1 1 22 22 ILE C C 13 174.901 0.300 . 1 . . . . 22 ILE C . 11189 1 189 . 1 1 22 22 ILE CA C 13 59.372 0.300 . 1 . . . . 22 ILE CA . 11189 1 190 . 1 1 22 22 ILE CB C 13 37.528 0.300 . 1 . . . . 22 ILE CB . 11189 1 191 . 1 1 22 22 ILE CD1 C 13 12.110 0.300 . 1 . . . . 22 ILE CD1 . 11189 1 192 . 1 1 22 22 ILE CG1 C 13 27.110 0.300 . 1 . . . . 22 ILE CG1 . 11189 1 193 . 1 1 22 22 ILE CG2 C 13 17.198 0.300 . 1 . . . . 22 ILE CG2 . 11189 1 194 . 1 1 22 22 ILE N N 15 122.640 0.300 . 1 . . . . 22 ILE N . 11189 1 195 . 1 1 23 23 ASN H H 1 8.780 0.030 . 1 . . . . 23 ASN H . 11189 1 196 . 1 1 23 23 ASN HA H 1 4.392 0.030 . 1 . . . . 23 ASN HA . 11189 1 197 . 1 1 23 23 ASN HB2 H 1 2.537 0.030 . 2 . . . . 23 ASN HB2 . 11189 1 198 . 1 1 23 23 ASN HB3 H 1 3.113 0.030 . 2 . . . . 23 ASN HB3 . 11189 1 199 . 1 1 23 23 ASN HD21 H 1 7.070 0.030 . 2 . . . . 23 ASN HD21 . 11189 1 200 . 1 1 23 23 ASN HD22 H 1 7.682 0.030 . 2 . . . . 23 ASN HD22 . 11189 1 201 . 1 1 23 23 ASN C C 13 174.912 0.300 . 1 . . . . 23 ASN C . 11189 1 202 . 1 1 23 23 ASN CA C 13 53.097 0.300 . 1 . . . . 23 ASN CA . 11189 1 203 . 1 1 23 23 ASN CB C 13 38.589 0.300 . 1 . . . . 23 ASN CB . 11189 1 204 . 1 1 23 23 ASN N N 15 124.673 0.300 . 1 . . . . 23 ASN N . 11189 1 205 . 1 1 23 23 ASN ND2 N 15 111.132 0.300 . 1 . . . . 23 ASN ND2 . 11189 1 206 . 1 1 24 24 ASP H H 1 8.319 0.030 . 1 . . . . 24 ASP H . 11189 1 207 . 1 1 24 24 ASP HA H 1 4.640 0.030 . 1 . . . . 24 ASP HA . 11189 1 208 . 1 1 24 24 ASP HB2 H 1 2.625 0.030 . 2 . . . . 24 ASP HB2 . 11189 1 209 . 1 1 24 24 ASP HB3 H 1 3.108 0.030 . 2 . . . . 24 ASP HB3 . 11189 1 210 . 1 1 24 24 ASP C C 13 176.799 0.300 . 1 . . . . 24 ASP C . 11189 1 211 . 1 1 24 24 ASP CA C 13 52.890 0.300 . 1 . . . . 24 ASP CA . 11189 1 212 . 1 1 24 24 ASP CB C 13 40.652 0.300 . 1 . . . . 24 ASP CB . 11189 1 213 . 1 1 24 24 ASP N N 15 125.827 0.300 . 1 . . . . 24 ASP N . 11189 1 214 . 1 1 25 25 GLY H H 1 8.324 0.030 . 1 . . . . 25 GLY H . 11189 1 215 . 1 1 25 25 GLY HA2 H 1 3.632 0.030 . 2 . . . . 25 GLY HA2 . 11189 1 216 . 1 1 25 25 GLY HA3 H 1 4.541 0.030 . 2 . . . . 25 GLY HA3 . 11189 1 217 . 1 1 25 25 GLY C C 13 175.394 0.300 . 1 . . . . 25 GLY C . 11189 1 218 . 1 1 25 25 GLY CA C 13 44.932 0.300 . 1 . . . . 25 GLY CA . 11189 1 219 . 1 1 25 25 GLY N N 15 109.138 0.300 . 1 . . . . 25 GLY N . 11189 1 220 . 1 1 26 26 SER H H 1 8.638 0.030 . 1 . . . . 26 SER H . 11189 1 221 . 1 1 26 26 SER HA H 1 4.543 0.030 . 1 . . . . 26 SER HA . 11189 1 222 . 1 1 26 26 SER HB2 H 1 3.926 0.030 . 2 . . . . 26 SER HB2 . 11189 1 223 . 1 1 26 26 SER HB3 H 1 4.119 0.030 . 2 . . . . 26 SER HB3 . 11189 1 224 . 1 1 26 26 SER C C 13 174.791 0.300 . 1 . . . . 26 SER C . 11189 1 225 . 1 1 26 26 SER CA C 13 58.988 0.300 . 1 . . . . 26 SER CA . 11189 1 226 . 1 1 26 26 SER CB C 13 63.834 0.300 . 1 . . . . 26 SER CB . 11189 1 227 . 1 1 26 26 SER N N 15 116.483 0.300 . 1 . . . . 26 SER N . 11189 1 228 . 1 1 27 27 GLY H H 1 8.238 0.030 . 1 . . . . 27 GLY H . 11189 1 229 . 1 1 27 27 GLY HA2 H 1 3.736 0.030 . 2 . . . . 27 GLY HA2 . 11189 1 230 . 1 1 27 27 GLY HA3 H 1 4.554 0.030 . 2 . . . . 27 GLY HA3 . 11189 1 231 . 1 1 27 27 GLY C C 13 174.056 0.300 . 1 . . . . 27 GLY C . 11189 1 232 . 1 1 27 27 GLY CA C 13 43.958 0.300 . 1 . . . . 27 GLY CA . 11189 1 233 . 1 1 27 27 GLY N N 15 110.593 0.300 . 1 . . . . 27 GLY N . 11189 1 234 . 1 1 28 28 LEU H H 1 8.622 0.030 . 1 . . . . 28 LEU H . 11189 1 235 . 1 1 28 28 LEU HA H 1 4.223 0.030 . 1 . . . . 28 LEU HA . 11189 1 236 . 1 1 28 28 LEU HB2 H 1 1.576 0.030 . 1 . . . . 28 LEU HB2 . 11189 1 237 . 1 1 28 28 LEU HB3 H 1 1.576 0.030 . 1 . . . . 28 LEU HB3 . 11189 1 238 . 1 1 28 28 LEU HD11 H 1 0.949 0.030 . 1 . . . . 28 LEU HD1 . 11189 1 239 . 1 1 28 28 LEU HD12 H 1 0.949 0.030 . 1 . . . . 28 LEU HD1 . 11189 1 240 . 1 1 28 28 LEU HD13 H 1 0.949 0.030 . 1 . . . . 28 LEU HD1 . 11189 1 241 . 1 1 28 28 LEU HD21 H 1 0.798 0.030 . 1 . . . . 28 LEU HD2 . 11189 1 242 . 1 1 28 28 LEU HD22 H 1 0.798 0.030 . 1 . . . . 28 LEU HD2 . 11189 1 243 . 1 1 28 28 LEU HD23 H 1 0.798 0.030 . 1 . . . . 28 LEU HD2 . 11189 1 244 . 1 1 28 28 LEU HG H 1 1.749 0.030 . 1 . . . . 28 LEU HG . 11189 1 245 . 1 1 28 28 LEU C C 13 178.071 0.300 . 1 . . . . 28 LEU C . 11189 1 246 . 1 1 28 28 LEU CA C 13 56.541 0.300 . 1 . . . . 28 LEU CA . 11189 1 247 . 1 1 28 28 LEU CB C 13 42.130 0.300 . 1 . . . . 28 LEU CB . 11189 1 248 . 1 1 28 28 LEU CD1 C 13 26.388 0.300 . 2 . . . . 28 LEU CD1 . 11189 1 249 . 1 1 28 28 LEU CD2 C 13 22.415 0.300 . 2 . . . . 28 LEU CD2 . 11189 1 250 . 1 1 28 28 LEU CG C 13 27.135 0.300 . 1 . . . . 28 LEU CG . 11189 1 251 . 1 1 28 28 LEU N N 15 118.246 0.300 . 1 . . . . 28 LEU N . 11189 1 252 . 1 1 29 29 GLY H H 1 8.452 0.030 . 1 . . . . 29 GLY H . 11189 1 253 . 1 1 29 29 GLY HA2 H 1 3.813 0.030 . 2 . . . . 29 GLY HA2 . 11189 1 254 . 1 1 29 29 GLY HA3 H 1 4.153 0.030 . 2 . . . . 29 GLY HA3 . 11189 1 255 . 1 1 29 29 GLY C C 13 175.877 0.300 . 1 . . . . 29 GLY C . 11189 1 256 . 1 1 29 29 GLY CA C 13 46.474 0.300 . 1 . . . . 29 GLY CA . 11189 1 257 . 1 1 29 29 GLY N N 15 102.990 0.300 . 1 . . . . 29 GLY N . 11189 1 258 . 1 1 30 30 PHE H H 1 7.366 0.030 . 1 . . . . 30 PHE H . 11189 1 259 . 1 1 30 30 PHE HA H 1 5.291 0.030 . 1 . . . . 30 PHE HA . 11189 1 260 . 1 1 30 30 PHE HB2 H 1 2.842 0.030 . 2 . . . . 30 PHE HB2 . 11189 1 261 . 1 1 30 30 PHE HB3 H 1 3.284 0.030 . 2 . . . . 30 PHE HB3 . 11189 1 262 . 1 1 30 30 PHE HD1 H 1 6.834 0.030 . 1 . . . . 30 PHE HD1 . 11189 1 263 . 1 1 30 30 PHE HD2 H 1 6.834 0.030 . 1 . . . . 30 PHE HD2 . 11189 1 264 . 1 1 30 30 PHE HE1 H 1 6.911 0.030 . 1 . . . . 30 PHE HE1 . 11189 1 265 . 1 1 30 30 PHE HE2 H 1 6.911 0.030 . 1 . . . . 30 PHE HE2 . 11189 1 266 . 1 1 30 30 PHE HZ H 1 7.050 0.030 . 1 . . . . 30 PHE HZ . 11189 1 267 . 1 1 30 30 PHE C C 13 172.037 0.300 . 1 . . . . 30 PHE C . 11189 1 268 . 1 1 30 30 PHE CA C 13 56.028 0.300 . 1 . . . . 30 PHE CA . 11189 1 269 . 1 1 30 30 PHE CB C 13 41.112 0.300 . 1 . . . . 30 PHE CB . 11189 1 270 . 1 1 30 30 PHE CD1 C 13 132.086 0.300 . 1 . . . . 30 PHE CD1 . 11189 1 271 . 1 1 30 30 PHE CD2 C 13 132.086 0.300 . 1 . . . . 30 PHE CD2 . 11189 1 272 . 1 1 30 30 PHE CE1 C 13 130.404 0.300 . 1 . . . . 30 PHE CE1 . 11189 1 273 . 1 1 30 30 PHE CE2 C 13 130.404 0.300 . 1 . . . . 30 PHE CE2 . 11189 1 274 . 1 1 30 30 PHE CZ C 13 128.772 0.300 . 1 . . . . 30 PHE CZ . 11189 1 275 . 1 1 30 30 PHE N N 15 115.448 0.300 . 1 . . . . 30 PHE N . 11189 1 276 . 1 1 31 31 GLY H H 1 8.792 0.030 . 1 . . . . 31 GLY H . 11189 1 277 . 1 1 31 31 GLY HA2 H 1 3.680 0.030 . 2 . . . . 31 GLY HA2 . 11189 1 278 . 1 1 31 31 GLY HA3 H 1 4.665 0.030 . 2 . . . . 31 GLY HA3 . 11189 1 279 . 1 1 31 31 GLY C C 13 173.617 0.300 . 1 . . . . 31 GLY C . 11189 1 280 . 1 1 31 31 GLY CA C 13 43.405 0.300 . 1 . . . . 31 GLY CA . 11189 1 281 . 1 1 31 31 GLY N N 15 108.950 0.300 . 1 . . . . 31 GLY N . 11189 1 282 . 1 1 32 32 ILE H H 1 8.577 0.030 . 1 . . . . 32 ILE H . 11189 1 283 . 1 1 32 32 ILE HA H 1 5.498 0.030 . 1 . . . . 32 ILE HA . 11189 1 284 . 1 1 32 32 ILE HB H 1 1.803 0.030 . 1 . . . . 32 ILE HB . 11189 1 285 . 1 1 32 32 ILE HD11 H 1 0.776 0.030 . 1 . . . . 32 ILE HD1 . 11189 1 286 . 1 1 32 32 ILE HD12 H 1 0.776 0.030 . 1 . . . . 32 ILE HD1 . 11189 1 287 . 1 1 32 32 ILE HD13 H 1 0.776 0.030 . 1 . . . . 32 ILE HD1 . 11189 1 288 . 1 1 32 32 ILE HG12 H 1 1.371 0.030 . 2 . . . . 32 ILE HG12 . 11189 1 289 . 1 1 32 32 ILE HG13 H 1 1.035 0.030 . 2 . . . . 32 ILE HG13 . 11189 1 290 . 1 1 32 32 ILE HG21 H 1 0.866 0.030 . 1 . . . . 32 ILE HG2 . 11189 1 291 . 1 1 32 32 ILE HG22 H 1 0.866 0.030 . 1 . . . . 32 ILE HG2 . 11189 1 292 . 1 1 32 32 ILE HG23 H 1 0.866 0.030 . 1 . . . . 32 ILE HG2 . 11189 1 293 . 1 1 32 32 ILE C C 13 175.142 0.300 . 1 . . . . 32 ILE C . 11189 1 294 . 1 1 32 32 ILE CA C 13 59.108 0.300 . 1 . . . . 32 ILE CA . 11189 1 295 . 1 1 32 32 ILE CB C 13 42.267 0.300 . 1 . . . . 32 ILE CB . 11189 1 296 . 1 1 32 32 ILE CD1 C 13 14.233 0.300 . 1 . . . . 32 ILE CD1 . 11189 1 297 . 1 1 32 32 ILE CG1 C 13 25.208 0.300 . 1 . . . . 32 ILE CG1 . 11189 1 298 . 1 1 32 32 ILE CG2 C 13 19.095 0.300 . 1 . . . . 32 ILE CG2 . 11189 1 299 . 1 1 32 32 ILE N N 15 115.778 0.300 . 1 . . . . 32 ILE N . 11189 1 300 . 1 1 33 33 VAL H H 1 8.799 0.030 . 1 . . . . 33 VAL H . 11189 1 301 . 1 1 33 33 VAL HA H 1 4.490 0.030 . 1 . . . . 33 VAL HA . 11189 1 302 . 1 1 33 33 VAL HB H 1 2.034 0.030 . 1 . . . . 33 VAL HB . 11189 1 303 . 1 1 33 33 VAL HG11 H 1 0.879 0.030 . 1 . . . . 33 VAL HG1 . 11189 1 304 . 1 1 33 33 VAL HG12 H 1 0.879 0.030 . 1 . . . . 33 VAL HG1 . 11189 1 305 . 1 1 33 33 VAL HG13 H 1 0.879 0.030 . 1 . . . . 33 VAL HG1 . 11189 1 306 . 1 1 33 33 VAL HG21 H 1 1.008 0.030 . 1 . . . . 33 VAL HG2 . 11189 1 307 . 1 1 33 33 VAL HG22 H 1 1.008 0.030 . 1 . . . . 33 VAL HG2 . 11189 1 308 . 1 1 33 33 VAL HG23 H 1 1.008 0.030 . 1 . . . . 33 VAL HG2 . 11189 1 309 . 1 1 33 33 VAL C C 13 173.650 0.300 . 1 . . . . 33 VAL C . 11189 1 310 . 1 1 33 33 VAL CA C 13 60.563 0.300 . 1 . . . . 33 VAL CA . 11189 1 311 . 1 1 33 33 VAL CB C 13 35.354 0.300 . 1 . . . . 33 VAL CB . 11189 1 312 . 1 1 33 33 VAL CG1 C 13 20.393 0.300 . 2 . . . . 33 VAL CG1 . 11189 1 313 . 1 1 33 33 VAL CG2 C 13 20.526 0.300 . 2 . . . . 33 VAL CG2 . 11189 1 314 . 1 1 33 33 VAL N N 15 119.237 0.300 . 1 . . . . 33 VAL N . 11189 1 315 . 1 1 34 34 GLY H H 1 8.516 0.030 . 1 . . . . 34 GLY H . 11189 1 316 . 1 1 34 34 GLY HA2 H 1 3.887 0.030 . 2 . . . . 34 GLY HA2 . 11189 1 317 . 1 1 34 34 GLY HA3 H 1 4.631 0.030 . 2 . . . . 34 GLY HA3 . 11189 1 318 . 1 1 34 34 GLY C C 13 174.001 0.300 . 1 . . . . 34 GLY C . 11189 1 319 . 1 1 34 34 GLY CA C 13 44.937 0.300 . 1 . . . . 34 GLY CA . 11189 1 320 . 1 1 34 34 GLY N N 15 111.080 0.300 . 1 . . . . 34 GLY N . 11189 1 321 . 1 1 35 35 GLY H H 1 8.218 0.030 . 1 . . . . 35 GLY H . 11189 1 322 . 1 1 35 35 GLY HA2 H 1 4.031 0.030 . 2 . . . . 35 GLY HA2 . 11189 1 323 . 1 1 35 35 GLY HA3 H 1 4.140 0.030 . 2 . . . . 35 GLY HA3 . 11189 1 324 . 1 1 35 35 GLY C C 13 173.935 0.300 . 1 . . . . 35 GLY C . 11189 1 325 . 1 1 35 35 GLY CA C 13 44.552 0.300 . 1 . . . . 35 GLY CA . 11189 1 326 . 1 1 35 35 GLY N N 15 109.267 0.300 . 1 . . . . 35 GLY N . 11189 1 327 . 1 1 36 36 LYS H H 1 7.932 0.030 . 1 . . . . 36 LYS H . 11189 1 328 . 1 1 36 36 LYS HA H 1 4.140 0.030 . 1 . . . . 36 LYS HA . 11189 1 329 . 1 1 36 36 LYS HB2 H 1 1.919 0.030 . 1 . . . . 36 LYS HB2 . 11189 1 330 . 1 1 36 36 LYS HB3 H 1 1.919 0.030 . 1 . . . . 36 LYS HB3 . 11189 1 331 . 1 1 36 36 LYS HD2 H 1 1.739 0.030 . 1 . . . . 36 LYS HD2 . 11189 1 332 . 1 1 36 36 LYS HD3 H 1 1.739 0.030 . 1 . . . . 36 LYS HD3 . 11189 1 333 . 1 1 36 36 LYS HE2 H 1 3.035 0.030 . 1 . . . . 36 LYS HE2 . 11189 1 334 . 1 1 36 36 LYS HE3 H 1 3.035 0.030 . 1 . . . . 36 LYS HE3 . 11189 1 335 . 1 1 36 36 LYS HG2 H 1 1.478 0.030 . 2 . . . . 36 LYS HG2 . 11189 1 336 . 1 1 36 36 LYS HG3 H 1 1.550 0.030 . 2 . . . . 36 LYS HG3 . 11189 1 337 . 1 1 36 36 LYS CA C 13 58.698 0.300 . 1 . . . . 36 LYS CA . 11189 1 338 . 1 1 36 36 LYS CB C 13 32.460 0.300 . 1 . . . . 36 LYS CB . 11189 1 339 . 1 1 36 36 LYS CD C 13 28.935 0.300 . 1 . . . . 36 LYS CD . 11189 1 340 . 1 1 36 36 LYS CE C 13 41.950 0.300 . 1 . . . . 36 LYS CE . 11189 1 341 . 1 1 36 36 LYS CG C 13 24.816 0.300 . 1 . . . . 36 LYS CG . 11189 1 342 . 1 1 37 37 THR HA H 1 4.402 0.030 . 1 . . . . 37 THR HA . 11189 1 343 . 1 1 37 37 THR HB H 1 4.356 0.030 . 1 . . . . 37 THR HB . 11189 1 344 . 1 1 37 37 THR HG21 H 1 1.221 0.030 . 1 . . . . 37 THR HG2 . 11189 1 345 . 1 1 37 37 THR HG22 H 1 1.221 0.030 . 1 . . . . 37 THR HG2 . 11189 1 346 . 1 1 37 37 THR HG23 H 1 1.221 0.030 . 1 . . . . 37 THR HG2 . 11189 1 347 . 1 1 37 37 THR CA C 13 62.526 0.300 . 1 . . . . 37 THR CA . 11189 1 348 . 1 1 37 37 THR CB C 13 69.040 0.300 . 1 . . . . 37 THR CB . 11189 1 349 . 1 1 37 37 THR CG2 C 13 21.853 0.300 . 1 . . . . 37 THR CG2 . 11189 1 350 . 1 1 38 38 SER HA H 1 4.577 0.030 . 1 . . . . 38 SER HA . 11189 1 351 . 1 1 38 38 SER HB2 H 1 3.993 0.030 . 2 . . . . 38 SER HB2 . 11189 1 352 . 1 1 38 38 SER HB3 H 1 3.907 0.030 . 2 . . . . 38 SER HB3 . 11189 1 353 . 1 1 38 38 SER C C 13 174.484 0.300 . 1 . . . . 38 SER C . 11189 1 354 . 1 1 38 38 SER CA C 13 58.340 0.300 . 1 . . . . 38 SER CA . 11189 1 355 . 1 1 38 38 SER CB C 13 64.272 0.300 . 1 . . . . 38 SER CB . 11189 1 356 . 1 1 39 39 GLY H H 1 8.115 0.030 . 1 . . . . 39 GLY H . 11189 1 357 . 1 1 39 39 GLY HA2 H 1 4.205 0.030 . 2 . . . . 39 GLY HA2 . 11189 1 358 . 1 1 39 39 GLY HA3 H 1 4.437 0.030 . 2 . . . . 39 GLY HA3 . 11189 1 359 . 1 1 39 39 GLY C C 13 173.606 0.300 . 1 . . . . 39 GLY C . 11189 1 360 . 1 1 39 39 GLY CA C 13 45.103 0.300 . 1 . . . . 39 GLY CA . 11189 1 361 . 1 1 39 39 GLY N N 15 109.192 0.300 . 1 . . . . 39 GLY N . 11189 1 362 . 1 1 40 40 VAL H H 1 9.012 0.030 . 1 . . . . 40 VAL H . 11189 1 363 . 1 1 40 40 VAL HA H 1 4.807 0.030 . 1 . . . . 40 VAL HA . 11189 1 364 . 1 1 40 40 VAL HB H 1 2.165 0.030 . 1 . . . . 40 VAL HB . 11189 1 365 . 1 1 40 40 VAL HG11 H 1 0.812 0.030 . 1 . . . . 40 VAL HG1 . 11189 1 366 . 1 1 40 40 VAL HG12 H 1 0.812 0.030 . 1 . . . . 40 VAL HG1 . 11189 1 367 . 1 1 40 40 VAL HG13 H 1 0.812 0.030 . 1 . . . . 40 VAL HG1 . 11189 1 368 . 1 1 40 40 VAL HG21 H 1 0.911 0.030 . 1 . . . . 40 VAL HG2 . 11189 1 369 . 1 1 40 40 VAL HG22 H 1 0.911 0.030 . 1 . . . . 40 VAL HG2 . 11189 1 370 . 1 1 40 40 VAL HG23 H 1 0.911 0.030 . 1 . . . . 40 VAL HG2 . 11189 1 371 . 1 1 40 40 VAL C C 13 174.835 0.300 . 1 . . . . 40 VAL C . 11189 1 372 . 1 1 40 40 VAL CA C 13 61.390 0.300 . 1 . . . . 40 VAL CA . 11189 1 373 . 1 1 40 40 VAL CB C 13 33.240 0.300 . 1 . . . . 40 VAL CB . 11189 1 374 . 1 1 40 40 VAL CG1 C 13 22.278 0.300 . 2 . . . . 40 VAL CG1 . 11189 1 375 . 1 1 40 40 VAL CG2 C 13 21.359 0.300 . 2 . . . . 40 VAL CG2 . 11189 1 376 . 1 1 40 40 VAL N N 15 119.407 0.300 . 1 . . . . 40 VAL N . 11189 1 377 . 1 1 41 41 VAL H H 1 8.648 0.030 . 1 . . . . 41 VAL H . 11189 1 378 . 1 1 41 41 VAL HA H 1 5.170 0.030 . 1 . . . . 41 VAL HA . 11189 1 379 . 1 1 41 41 VAL HB H 1 1.578 0.030 . 1 . . . . 41 VAL HB . 11189 1 380 . 1 1 41 41 VAL HG11 H 1 0.451 0.030 . 1 . . . . 41 VAL HG1 . 11189 1 381 . 1 1 41 41 VAL HG12 H 1 0.451 0.030 . 1 . . . . 41 VAL HG1 . 11189 1 382 . 1 1 41 41 VAL HG13 H 1 0.451 0.030 . 1 . . . . 41 VAL HG1 . 11189 1 383 . 1 1 41 41 VAL HG21 H 1 0.473 0.030 . 1 . . . . 41 VAL HG2 . 11189 1 384 . 1 1 41 41 VAL HG22 H 1 0.473 0.030 . 1 . . . . 41 VAL HG2 . 11189 1 385 . 1 1 41 41 VAL HG23 H 1 0.473 0.030 . 1 . . . . 41 VAL HG2 . 11189 1 386 . 1 1 41 41 VAL C C 13 175.724 0.300 . 1 . . . . 41 VAL C . 11189 1 387 . 1 1 41 41 VAL CA C 13 58.254 0.300 . 1 . . . . 41 VAL CA . 11189 1 388 . 1 1 41 41 VAL CB C 13 35.836 0.300 . 1 . . . . 41 VAL CB . 11189 1 389 . 1 1 41 41 VAL CG1 C 13 20.448 0.300 . 2 . . . . 41 VAL CG1 . 11189 1 390 . 1 1 41 41 VAL CG2 C 13 19.557 0.300 . 2 . . . . 41 VAL CG2 . 11189 1 391 . 1 1 41 41 VAL N N 15 120.427 0.300 . 1 . . . . 41 VAL N . 11189 1 392 . 1 1 42 42 VAL H H 1 8.670 0.030 . 1 . . . . 42 VAL H . 11189 1 393 . 1 1 42 42 VAL HA H 1 4.075 0.030 . 1 . . . . 42 VAL HA . 11189 1 394 . 1 1 42 42 VAL HB H 1 2.199 0.030 . 1 . . . . 42 VAL HB . 11189 1 395 . 1 1 42 42 VAL HG11 H 1 0.759 0.030 . 1 . . . . 42 VAL HG1 . 11189 1 396 . 1 1 42 42 VAL HG12 H 1 0.759 0.030 . 1 . . . . 42 VAL HG1 . 11189 1 397 . 1 1 42 42 VAL HG13 H 1 0.759 0.030 . 1 . . . . 42 VAL HG1 . 11189 1 398 . 1 1 42 42 VAL HG21 H 1 0.756 0.030 . 1 . . . . 42 VAL HG2 . 11189 1 399 . 1 1 42 42 VAL HG22 H 1 0.756 0.030 . 1 . . . . 42 VAL HG2 . 11189 1 400 . 1 1 42 42 VAL HG23 H 1 0.756 0.030 . 1 . . . . 42 VAL HG2 . 11189 1 401 . 1 1 42 42 VAL C C 13 175.778 0.300 . 1 . . . . 42 VAL C . 11189 1 402 . 1 1 42 42 VAL CA C 13 63.301 0.300 . 1 . . . . 42 VAL CA . 11189 1 403 . 1 1 42 42 VAL CB C 13 31.620 0.300 . 1 . . . . 42 VAL CB . 11189 1 404 . 1 1 42 42 VAL CG1 C 13 21.652 0.300 . 2 . . . . 42 VAL CG1 . 11189 1 405 . 1 1 42 42 VAL CG2 C 13 21.581 0.300 . 2 . . . . 42 VAL CG2 . 11189 1 406 . 1 1 42 42 VAL N N 15 122.015 0.300 . 1 . . . . 42 VAL N . 11189 1 407 . 1 1 43 43 ARG H H 1 9.231 0.030 . 1 . . . . 43 ARG H . 11189 1 408 . 1 1 43 43 ARG HA H 1 4.490 0.030 . 1 . . . . 43 ARG HA . 11189 1 409 . 1 1 43 43 ARG HB2 H 1 1.619 0.030 . 2 . . . . 43 ARG HB2 . 11189 1 410 . 1 1 43 43 ARG HB3 H 1 1.679 0.030 . 2 . . . . 43 ARG HB3 . 11189 1 411 . 1 1 43 43 ARG HD2 H 1 3.114 0.030 . 2 . . . . 43 ARG HD2 . 11189 1 412 . 1 1 43 43 ARG HD3 H 1 3.191 0.030 . 2 . . . . 43 ARG HD3 . 11189 1 413 . 1 1 43 43 ARG HG2 H 1 1.617 0.030 . 1 . . . . 43 ARG HG2 . 11189 1 414 . 1 1 43 43 ARG HG3 H 1 1.617 0.030 . 1 . . . . 43 ARG HG3 . 11189 1 415 . 1 1 43 43 ARG C C 13 174.703 0.300 . 1 . . . . 43 ARG C . 11189 1 416 . 1 1 43 43 ARG CA C 13 55.981 0.300 . 1 . . . . 43 ARG CA . 11189 1 417 . 1 1 43 43 ARG CB C 13 32.419 0.300 . 1 . . . . 43 ARG CB . 11189 1 418 . 1 1 43 43 ARG CD C 13 42.746 0.300 . 1 . . . . 43 ARG CD . 11189 1 419 . 1 1 43 43 ARG CG C 13 26.701 0.300 . 1 . . . . 43 ARG CG . 11189 1 420 . 1 1 43 43 ARG N N 15 131.697 0.300 . 1 . . . . 43 ARG N . 11189 1 421 . 1 1 44 44 THR H H 1 7.501 0.030 . 1 . . . . 44 THR H . 11189 1 422 . 1 1 44 44 THR HA H 1 4.514 0.030 . 1 . . . . 44 THR HA . 11189 1 423 . 1 1 44 44 THR HB H 1 3.918 0.030 . 1 . . . . 44 THR HB . 11189 1 424 . 1 1 44 44 THR HG21 H 1 1.062 0.030 . 1 . . . . 44 THR HG2 . 11189 1 425 . 1 1 44 44 THR HG22 H 1 1.062 0.030 . 1 . . . . 44 THR HG2 . 11189 1 426 . 1 1 44 44 THR HG23 H 1 1.062 0.030 . 1 . . . . 44 THR HG2 . 11189 1 427 . 1 1 44 44 THR C C 13 172.432 0.300 . 1 . . . . 44 THR C . 11189 1 428 . 1 1 44 44 THR CA C 13 60.135 0.300 . 1 . . . . 44 THR CA . 11189 1 429 . 1 1 44 44 THR CB C 13 70.965 0.300 . 1 . . . . 44 THR CB . 11189 1 430 . 1 1 44 44 THR CG2 C 13 21.579 0.300 . 1 . . . . 44 THR CG2 . 11189 1 431 . 1 1 44 44 THR N N 15 110.021 0.300 . 1 . . . . 44 THR N . 11189 1 432 . 1 1 45 45 ILE H H 1 8.407 0.030 . 1 . . . . 45 ILE H . 11189 1 433 . 1 1 45 45 ILE HA H 1 4.388 0.030 . 1 . . . . 45 ILE HA . 11189 1 434 . 1 1 45 45 ILE HB H 1 1.716 0.030 . 1 . . . . 45 ILE HB . 11189 1 435 . 1 1 45 45 ILE HD11 H 1 0.527 0.030 . 1 . . . . 45 ILE HD1 . 11189 1 436 . 1 1 45 45 ILE HD12 H 1 0.527 0.030 . 1 . . . . 45 ILE HD1 . 11189 1 437 . 1 1 45 45 ILE HD13 H 1 0.527 0.030 . 1 . . . . 45 ILE HD1 . 11189 1 438 . 1 1 45 45 ILE HG12 H 1 1.381 0.030 . 2 . . . . 45 ILE HG12 . 11189 1 439 . 1 1 45 45 ILE HG13 H 1 0.881 0.030 . 2 . . . . 45 ILE HG13 . 11189 1 440 . 1 1 45 45 ILE HG21 H 1 0.798 0.030 . 1 . . . . 45 ILE HG2 . 11189 1 441 . 1 1 45 45 ILE HG22 H 1 0.798 0.030 . 1 . . . . 45 ILE HG2 . 11189 1 442 . 1 1 45 45 ILE HG23 H 1 0.798 0.030 . 1 . . . . 45 ILE HG2 . 11189 1 443 . 1 1 45 45 ILE C C 13 175.515 0.300 . 1 . . . . 45 ILE C . 11189 1 444 . 1 1 45 45 ILE CA C 13 59.935 0.300 . 1 . . . . 45 ILE CA . 11189 1 445 . 1 1 45 45 ILE CB C 13 39.370 0.300 . 1 . . . . 45 ILE CB . 11189 1 446 . 1 1 45 45 ILE CD1 C 13 12.587 0.300 . 1 . . . . 45 ILE CD1 . 11189 1 447 . 1 1 45 45 ILE CG1 C 13 27.508 0.300 . 1 . . . . 45 ILE CG1 . 11189 1 448 . 1 1 45 45 ILE CG2 C 13 17.257 0.300 . 1 . . . . 45 ILE CG2 . 11189 1 449 . 1 1 45 45 ILE N N 15 124.474 0.300 . 1 . . . . 45 ILE N . 11189 1 450 . 1 1 46 46 VAL H H 1 7.949 0.030 . 1 . . . . 46 VAL H . 11189 1 451 . 1 1 46 46 VAL HA H 1 4.105 0.030 . 1 . . . . 46 VAL HA . 11189 1 452 . 1 1 46 46 VAL HB H 1 1.882 0.030 . 1 . . . . 46 VAL HB . 11189 1 453 . 1 1 46 46 VAL HG11 H 1 0.922 0.030 . 1 . . . . 46 VAL HG1 . 11189 1 454 . 1 1 46 46 VAL HG12 H 1 0.922 0.030 . 1 . . . . 46 VAL HG1 . 11189 1 455 . 1 1 46 46 VAL HG13 H 1 0.922 0.030 . 1 . . . . 46 VAL HG1 . 11189 1 456 . 1 1 46 46 VAL HG21 H 1 0.884 0.030 . 1 . . . . 46 VAL HG2 . 11189 1 457 . 1 1 46 46 VAL HG22 H 1 0.884 0.030 . 1 . . . . 46 VAL HG2 . 11189 1 458 . 1 1 46 46 VAL HG23 H 1 0.884 0.030 . 1 . . . . 46 VAL HG2 . 11189 1 459 . 1 1 46 46 VAL C C 13 174.956 0.300 . 1 . . . . 46 VAL C . 11189 1 460 . 1 1 46 46 VAL CA C 13 60.969 0.300 . 1 . . . . 46 VAL CA . 11189 1 461 . 1 1 46 46 VAL CB C 13 33.180 0.300 . 1 . . . . 46 VAL CB . 11189 1 462 . 1 1 46 46 VAL CG1 C 13 19.679 0.300 . 2 . . . . 46 VAL CG1 . 11189 1 463 . 1 1 46 46 VAL CG2 C 13 20.856 0.300 . 2 . . . . 46 VAL CG2 . 11189 1 464 . 1 1 46 46 VAL N N 15 129.208 0.300 . 1 . . . . 46 VAL N . 11189 1 465 . 1 1 47 47 PRO HA H 1 4.312 0.030 . 1 . . . . 47 PRO HA . 11189 1 466 . 1 1 47 47 PRO HB2 H 1 1.943 0.030 . 2 . . . . 47 PRO HB2 . 11189 1 467 . 1 1 47 47 PRO HB3 H 1 2.333 0.030 . 2 . . . . 47 PRO HB3 . 11189 1 468 . 1 1 47 47 PRO HD2 H 1 3.662 0.030 . 2 . . . . 47 PRO HD2 . 11189 1 469 . 1 1 47 47 PRO HD3 H 1 4.289 0.030 . 2 . . . . 47 PRO HD3 . 11189 1 470 . 1 1 47 47 PRO HG2 H 1 1.999 0.030 . 2 . . . . 47 PRO HG2 . 11189 1 471 . 1 1 47 47 PRO HG3 H 1 2.169 0.030 . 2 . . . . 47 PRO HG3 . 11189 1 472 . 1 1 47 47 PRO C C 13 178.170 0.300 . 1 . . . . 47 PRO C . 11189 1 473 . 1 1 47 47 PRO CA C 13 63.786 0.300 . 1 . . . . 47 PRO CA . 11189 1 474 . 1 1 47 47 PRO CB C 13 31.263 0.300 . 1 . . . . 47 PRO CB . 11189 1 475 . 1 1 47 47 PRO CD C 13 51.529 0.300 . 1 . . . . 47 PRO CD . 11189 1 476 . 1 1 47 47 PRO CG C 13 27.618 0.300 . 1 . . . . 47 PRO CG . 11189 1 477 . 1 1 48 48 GLY H H 1 10.631 0.030 . 1 . . . . 48 GLY H . 11189 1 478 . 1 1 48 48 GLY HA2 H 1 3.750 0.030 . 2 . . . . 48 GLY HA2 . 11189 1 479 . 1 1 48 48 GLY HA3 H 1 4.234 0.030 . 2 . . . . 48 GLY HA3 . 11189 1 480 . 1 1 48 48 GLY C C 13 174.977 0.300 . 1 . . . . 48 GLY C . 11189 1 481 . 1 1 48 48 GLY CA C 13 45.246 0.300 . 1 . . . . 48 GLY CA . 11189 1 482 . 1 1 48 48 GLY N N 15 116.278 0.300 . 1 . . . . 48 GLY N . 11189 1 483 . 1 1 49 49 GLY H H 1 7.990 0.030 . 1 . . . . 49 GLY H . 11189 1 484 . 1 1 49 49 GLY HA2 H 1 3.892 0.030 . 2 . . . . 49 GLY HA2 . 11189 1 485 . 1 1 49 49 GLY HA3 H 1 4.305 0.030 . 2 . . . . 49 GLY HA3 . 11189 1 486 . 1 1 49 49 GLY C C 13 173.310 0.300 . 1 . . . . 49 GLY C . 11189 1 487 . 1 1 49 49 GLY CA C 13 44.590 0.300 . 1 . . . . 49 GLY CA . 11189 1 488 . 1 1 49 49 GLY N N 15 107.890 0.300 . 1 . . . . 49 GLY N . 11189 1 489 . 1 1 50 50 LEU H H 1 8.725 0.030 . 1 . . . . 50 LEU H . 11189 1 490 . 1 1 50 50 LEU HA H 1 3.877 0.030 . 1 . . . . 50 LEU HA . 11189 1 491 . 1 1 50 50 LEU HB2 H 1 1.744 0.030 . 1 . . . . 50 LEU HB2 . 11189 1 492 . 1 1 50 50 LEU HB3 H 1 1.744 0.030 . 1 . . . . 50 LEU HB3 . 11189 1 493 . 1 1 50 50 LEU HD11 H 1 1.068 0.030 . 1 . . . . 50 LEU HD1 . 11189 1 494 . 1 1 50 50 LEU HD12 H 1 1.068 0.030 . 1 . . . . 50 LEU HD1 . 11189 1 495 . 1 1 50 50 LEU HD13 H 1 1.068 0.030 . 1 . . . . 50 LEU HD1 . 11189 1 496 . 1 1 50 50 LEU HD21 H 1 0.976 0.030 . 1 . . . . 50 LEU HD2 . 11189 1 497 . 1 1 50 50 LEU HD22 H 1 0.976 0.030 . 1 . . . . 50 LEU HD2 . 11189 1 498 . 1 1 50 50 LEU HD23 H 1 0.976 0.030 . 1 . . . . 50 LEU HD2 . 11189 1 499 . 1 1 50 50 LEU HG H 1 1.651 0.030 . 1 . . . . 50 LEU HG . 11189 1 500 . 1 1 50 50 LEU C C 13 179.114 0.300 . 1 . . . . 50 LEU C . 11189 1 501 . 1 1 50 50 LEU CA C 13 58.839 0.300 . 1 . . . . 50 LEU CA . 11189 1 502 . 1 1 50 50 LEU CB C 13 41.769 0.300 . 1 . . . . 50 LEU CB . 11189 1 503 . 1 1 50 50 LEU CD1 C 13 24.242 0.300 . 2 . . . . 50 LEU CD1 . 11189 1 504 . 1 1 50 50 LEU CD2 C 13 26.120 0.300 . 2 . . . . 50 LEU CD2 . 11189 1 505 . 1 1 50 50 LEU CG C 13 26.852 0.300 . 1 . . . . 50 LEU CG . 11189 1 506 . 1 1 50 50 LEU N N 15 118.731 0.300 . 1 . . . . 50 LEU N . 11189 1 507 . 1 1 51 51 ALA H H 1 7.623 0.030 . 1 . . . . 51 ALA H . 11189 1 508 . 1 1 51 51 ALA HA H 1 4.109 0.030 . 1 . . . . 51 ALA HA . 11189 1 509 . 1 1 51 51 ALA HB1 H 1 1.470 0.030 . 1 . . . . 51 ALA HB . 11189 1 510 . 1 1 51 51 ALA HB2 H 1 1.470 0.030 . 1 . . . . 51 ALA HB . 11189 1 511 . 1 1 51 51 ALA HB3 H 1 1.470 0.030 . 1 . . . . 51 ALA HB . 11189 1 512 . 1 1 51 51 ALA C C 13 180.935 0.300 . 1 . . . . 51 ALA C . 11189 1 513 . 1 1 51 51 ALA CA C 13 54.966 0.300 . 1 . . . . 51 ALA CA . 11189 1 514 . 1 1 51 51 ALA CB C 13 18.123 0.300 . 1 . . . . 51 ALA CB . 11189 1 515 . 1 1 51 51 ALA N N 15 118.955 0.300 . 1 . . . . 51 ALA N . 11189 1 516 . 1 1 52 52 ASP H H 1 9.244 0.030 . 1 . . . . 52 ASP H . 11189 1 517 . 1 1 52 52 ASP HA H 1 4.284 0.030 . 1 . . . . 52 ASP HA . 11189 1 518 . 1 1 52 52 ASP HB2 H 1 2.800 0.030 . 1 . . . . 52 ASP HB2 . 11189 1 519 . 1 1 52 52 ASP HB3 H 1 2.800 0.030 . 1 . . . . 52 ASP HB3 . 11189 1 520 . 1 1 52 52 ASP C C 13 177.358 0.300 . 1 . . . . 52 ASP C . 11189 1 521 . 1 1 52 52 ASP CA C 13 57.026 0.300 . 1 . . . . 52 ASP CA . 11189 1 522 . 1 1 52 52 ASP CB C 13 42.526 0.300 . 1 . . . . 52 ASP CB . 11189 1 523 . 1 1 52 52 ASP N N 15 123.215 0.300 . 1 . . . . 52 ASP N . 11189 1 524 . 1 1 53 53 ARG H H 1 8.562 0.030 . 1 . . . . 53 ARG H . 11189 1 525 . 1 1 53 53 ARG HA H 1 3.898 0.030 . 1 . . . . 53 ARG HA . 11189 1 526 . 1 1 53 53 ARG HB2 H 1 1.824 0.030 . 1 . . . . 53 ARG HB2 . 11189 1 527 . 1 1 53 53 ARG HB3 H 1 1.824 0.030 . 1 . . . . 53 ARG HB3 . 11189 1 528 . 1 1 53 53 ARG HD2 H 1 3.168 0.030 . 2 . . . . 53 ARG HD2 . 11189 1 529 . 1 1 53 53 ARG HD3 H 1 3.255 0.030 . 2 . . . . 53 ARG HD3 . 11189 1 530 . 1 1 53 53 ARG HE H 1 6.986 0.030 . 1 . . . . 53 ARG HE . 11189 1 531 . 1 1 53 53 ARG HG2 H 1 1.594 0.030 . 2 . . . . 53 ARG HG2 . 11189 1 532 . 1 1 53 53 ARG HG3 H 1 1.789 0.030 . 2 . . . . 53 ARG HG3 . 11189 1 533 . 1 1 53 53 ARG C C 13 178.751 0.300 . 1 . . . . 53 ARG C . 11189 1 534 . 1 1 53 53 ARG CA C 13 59.146 0.300 . 1 . . . . 53 ARG CA . 11189 1 535 . 1 1 53 53 ARG CB C 13 30.095 0.300 . 1 . . . . 53 ARG CB . 11189 1 536 . 1 1 53 53 ARG CD C 13 43.703 0.300 . 1 . . . . 53 ARG CD . 11189 1 537 . 1 1 53 53 ARG CG C 13 28.085 0.300 . 1 . . . . 53 ARG CG . 11189 1 538 . 1 1 53 53 ARG N N 15 117.137 0.300 . 1 . . . . 53 ARG N . 11189 1 539 . 1 1 53 53 ARG NE N 15 83.690 0.300 . 1 . . . . 53 ARG NE . 11189 1 540 . 1 1 54 54 ASP H H 1 8.023 0.030 . 1 . . . . 54 ASP H . 11189 1 541 . 1 1 54 54 ASP HA H 1 4.353 0.030 . 1 . . . . 54 ASP HA . 11189 1 542 . 1 1 54 54 ASP HB2 H 1 2.535 0.030 . 2 . . . . 54 ASP HB2 . 11189 1 543 . 1 1 54 54 ASP HB3 H 1 2.775 0.030 . 2 . . . . 54 ASP HB3 . 11189 1 544 . 1 1 54 54 ASP C C 13 177.786 0.300 . 1 . . . . 54 ASP C . 11189 1 545 . 1 1 54 54 ASP CA C 13 57.054 0.300 . 1 . . . . 54 ASP CA . 11189 1 546 . 1 1 54 54 ASP CB C 13 43.379 0.300 . 1 . . . . 54 ASP CB . 11189 1 547 . 1 1 54 54 ASP N N 15 118.360 0.300 . 1 . . . . 54 ASP N . 11189 1 548 . 1 1 55 55 GLY H H 1 7.359 0.030 . 1 . . . . 55 GLY H . 11189 1 549 . 1 1 55 55 GLY HA2 H 1 4.000 0.030 . 1 . . . . 55 GLY HA2 . 11189 1 550 . 1 1 55 55 GLY HA3 H 1 4.000 0.030 . 1 . . . . 55 GLY HA3 . 11189 1 551 . 1 1 55 55 GLY C C 13 174.725 0.300 . 1 . . . . 55 GLY C . 11189 1 552 . 1 1 55 55 GLY CA C 13 46.382 0.300 . 1 . . . . 55 GLY CA . 11189 1 553 . 1 1 55 55 GLY N N 15 103.289 0.300 . 1 . . . . 55 GLY N . 11189 1 554 . 1 1 56 56 ARG H H 1 7.713 0.030 . 1 . . . . 56 ARG H . 11189 1 555 . 1 1 56 56 ARG HA H 1 4.265 0.030 . 1 . . . . 56 ARG HA . 11189 1 556 . 1 1 56 56 ARG HB2 H 1 1.660 0.030 . 2 . . . . 56 ARG HB2 . 11189 1 557 . 1 1 56 56 ARG HB3 H 1 1.834 0.030 . 2 . . . . 56 ARG HB3 . 11189 1 558 . 1 1 56 56 ARG HD2 H 1 3.190 0.030 . 2 . . . . 56 ARG HD2 . 11189 1 559 . 1 1 56 56 ARG HD3 H 1 3.374 0.030 . 2 . . . . 56 ARG HD3 . 11189 1 560 . 1 1 56 56 ARG HE H 1 9.075 0.030 . 1 . . . . 56 ARG HE . 11189 1 561 . 1 1 56 56 ARG HG2 H 1 1.652 0.030 . 2 . . . . 56 ARG HG2 . 11189 1 562 . 1 1 56 56 ARG HG3 H 1 1.762 0.030 . 2 . . . . 56 ARG HG3 . 11189 1 563 . 1 1 56 56 ARG C C 13 176.755 0.300 . 1 . . . . 56 ARG C . 11189 1 564 . 1 1 56 56 ARG CA C 13 58.395 0.300 . 1 . . . . 56 ARG CA . 11189 1 565 . 1 1 56 56 ARG CB C 13 33.001 0.300 . 1 . . . . 56 ARG CB . 11189 1 566 . 1 1 56 56 ARG CD C 13 43.841 0.300 . 1 . . . . 56 ARG CD . 11189 1 567 . 1 1 56 56 ARG CG C 13 27.144 0.300 . 1 . . . . 56 ARG CG . 11189 1 568 . 1 1 56 56 ARG N N 15 119.187 0.300 . 1 . . . . 56 ARG N . 11189 1 569 . 1 1 56 56 ARG NE N 15 88.123 0.300 . 1 . . . . 56 ARG NE . 11189 1 570 . 1 1 57 57 LEU H H 1 9.058 0.030 . 1 . . . . 57 LEU H . 11189 1 571 . 1 1 57 57 LEU HA H 1 3.994 0.030 . 1 . . . . 57 LEU HA . 11189 1 572 . 1 1 57 57 LEU HB2 H 1 1.277 0.030 . 2 . . . . 57 LEU HB2 . 11189 1 573 . 1 1 57 57 LEU HB3 H 1 1.113 0.030 . 2 . . . . 57 LEU HB3 . 11189 1 574 . 1 1 57 57 LEU HD11 H 1 0.430 0.030 . 1 . . . . 57 LEU HD1 . 11189 1 575 . 1 1 57 57 LEU HD12 H 1 0.430 0.030 . 1 . . . . 57 LEU HD1 . 11189 1 576 . 1 1 57 57 LEU HD13 H 1 0.430 0.030 . 1 . . . . 57 LEU HD1 . 11189 1 577 . 1 1 57 57 LEU HD21 H 1 0.191 0.030 . 1 . . . . 57 LEU HD2 . 11189 1 578 . 1 1 57 57 LEU HD22 H 1 0.191 0.030 . 1 . . . . 57 LEU HD2 . 11189 1 579 . 1 1 57 57 LEU HD23 H 1 0.191 0.030 . 1 . . . . 57 LEU HD2 . 11189 1 580 . 1 1 57 57 LEU HG H 1 1.452 0.030 . 1 . . . . 57 LEU HG . 11189 1 581 . 1 1 57 57 LEU C C 13 175.394 0.300 . 1 . . . . 57 LEU C . 11189 1 582 . 1 1 57 57 LEU CA C 13 54.830 0.300 . 1 . . . . 57 LEU CA . 11189 1 583 . 1 1 57 57 LEU CB C 13 43.900 0.300 . 1 . . . . 57 LEU CB . 11189 1 584 . 1 1 57 57 LEU CD1 C 13 24.812 0.300 . 2 . . . . 57 LEU CD1 . 11189 1 585 . 1 1 57 57 LEU CD2 C 13 24.781 0.300 . 2 . . . . 57 LEU CD2 . 11189 1 586 . 1 1 57 57 LEU CG C 13 26.413 0.300 . 1 . . . . 57 LEU CG . 11189 1 587 . 1 1 57 57 LEU N N 15 120.766 0.300 . 1 . . . . 57 LEU N . 11189 1 588 . 1 1 58 58 GLN H H 1 8.808 0.030 . 1 . . . . 58 GLN H . 11189 1 589 . 1 1 58 58 GLN HA H 1 4.491 0.030 . 1 . . . . 58 GLN HA . 11189 1 590 . 1 1 58 58 GLN HB2 H 1 1.908 0.030 . 2 . . . . 58 GLN HB2 . 11189 1 591 . 1 1 58 58 GLN HB3 H 1 1.998 0.030 . 2 . . . . 58 GLN HB3 . 11189 1 592 . 1 1 58 58 GLN HE21 H 1 6.686 0.030 . 2 . . . . 58 GLN HE21 . 11189 1 593 . 1 1 58 58 GLN HE22 H 1 7.088 0.030 . 2 . . . . 58 GLN HE22 . 11189 1 594 . 1 1 58 58 GLN HG2 H 1 2.219 0.030 . 2 . . . . 58 GLN HG2 . 11189 1 595 . 1 1 58 58 GLN HG3 H 1 2.300 0.030 . 2 . . . . 58 GLN HG3 . 11189 1 596 . 1 1 58 58 GLN C C 13 175.680 0.300 . 1 . . . . 58 GLN C . 11189 1 597 . 1 1 58 58 GLN CA C 13 53.289 0.300 . 1 . . . . 58 GLN CA . 11189 1 598 . 1 1 58 58 GLN CB C 13 31.445 0.300 . 1 . . . . 58 GLN CB . 11189 1 599 . 1 1 58 58 GLN CG C 13 33.202 0.300 . 1 . . . . 58 GLN CG . 11189 1 600 . 1 1 58 58 GLN N N 15 121.755 0.300 . 1 . . . . 58 GLN N . 11189 1 601 . 1 1 58 58 GLN NE2 N 15 111.755 0.300 . 1 . . . . 58 GLN NE2 . 11189 1 602 . 1 1 59 59 THR H H 1 8.582 0.030 . 1 . . . . 59 THR H . 11189 1 603 . 1 1 59 59 THR HA H 1 3.558 0.030 . 1 . . . . 59 THR HA . 11189 1 604 . 1 1 59 59 THR HB H 1 4.040 0.030 . 1 . . . . 59 THR HB . 11189 1 605 . 1 1 59 59 THR HG21 H 1 1.160 0.030 . 1 . . . . 59 THR HG2 . 11189 1 606 . 1 1 59 59 THR HG22 H 1 1.160 0.030 . 1 . . . . 59 THR HG2 . 11189 1 607 . 1 1 59 59 THR HG23 H 1 1.160 0.030 . 1 . . . . 59 THR HG2 . 11189 1 608 . 1 1 59 59 THR C C 13 175.998 0.300 . 1 . . . . 59 THR C . 11189 1 609 . 1 1 59 59 THR CA C 13 64.465 0.300 . 1 . . . . 59 THR CA . 11189 1 610 . 1 1 59 59 THR CB C 13 68.063 0.300 . 1 . . . . 59 THR CB . 11189 1 611 . 1 1 59 59 THR CG2 C 13 22.333 0.300 . 1 . . . . 59 THR CG2 . 11189 1 612 . 1 1 59 59 THR N N 15 115.883 0.300 . 1 . . . . 59 THR N . 11189 1 613 . 1 1 60 60 GLY H H 1 9.247 0.030 . 1 . . . . 60 GLY H . 11189 1 614 . 1 1 60 60 GLY HA2 H 1 3.437 0.030 . 2 . . . . 60 GLY HA2 . 11189 1 615 . 1 1 60 60 GLY HA3 H 1 4.480 0.030 . 2 . . . . 60 GLY HA3 . 11189 1 616 . 1 1 60 60 GLY C C 13 174.067 0.300 . 1 . . . . 60 GLY C . 11189 1 617 . 1 1 60 60 GLY CA C 13 44.504 0.300 . 1 . . . . 60 GLY CA . 11189 1 618 . 1 1 60 60 GLY N N 15 114.670 0.300 . 1 . . . . 60 GLY N . 11189 1 619 . 1 1 61 61 ASP H H 1 7.830 0.030 . 1 . . . . 61 ASP H . 11189 1 620 . 1 1 61 61 ASP HA H 1 4.640 0.030 . 1 . . . . 61 ASP HA . 11189 1 621 . 1 1 61 61 ASP HB2 H 1 2.290 0.030 . 2 . . . . 61 ASP HB2 . 11189 1 622 . 1 1 61 61 ASP HB3 H 1 2.519 0.030 . 2 . . . . 61 ASP HB3 . 11189 1 623 . 1 1 61 61 ASP C C 13 175.669 0.300 . 1 . . . . 61 ASP C . 11189 1 624 . 1 1 61 61 ASP CA C 13 55.635 0.300 . 1 . . . . 61 ASP CA . 11189 1 625 . 1 1 61 61 ASP CB C 13 40.429 0.300 . 1 . . . . 61 ASP CB . 11189 1 626 . 1 1 61 61 ASP N N 15 122.243 0.300 . 1 . . . . 61 ASP N . 11189 1 627 . 1 1 62 62 HIS H H 1 9.159 0.030 . 1 . . . . 62 HIS H . 11189 1 628 . 1 1 62 62 HIS HA H 1 4.994 0.030 . 1 . . . . 62 HIS HA . 11189 1 629 . 1 1 62 62 HIS HB2 H 1 2.596 0.030 . 2 . . . . 62 HIS HB2 . 11189 1 630 . 1 1 62 62 HIS HB3 H 1 2.800 0.030 . 2 . . . . 62 HIS HB3 . 11189 1 631 . 1 1 62 62 HIS HD2 H 1 7.253 0.030 . 1 . . . . 62 HIS HD2 . 11189 1 632 . 1 1 62 62 HIS HE1 H 1 8.352 0.030 . 1 . . . . 62 HIS HE1 . 11189 1 633 . 1 1 62 62 HIS C C 13 175.043 0.300 . 1 . . . . 62 HIS C . 11189 1 634 . 1 1 62 62 HIS CA C 13 54.972 0.300 . 1 . . . . 62 HIS CA . 11189 1 635 . 1 1 62 62 HIS CB C 13 30.219 0.300 . 1 . . . . 62 HIS CB . 11189 1 636 . 1 1 62 62 HIS CD2 C 13 121.324 0.300 . 1 . . . . 62 HIS CD2 . 11189 1 637 . 1 1 62 62 HIS CE1 C 13 136.632 0.300 . 1 . . . . 62 HIS CE1 . 11189 1 638 . 1 1 62 62 HIS N N 15 119.469 0.300 . 1 . . . . 62 HIS N . 11189 1 639 . 1 1 63 63 ILE H H 1 8.151 0.030 . 1 . . . . 63 ILE H . 11189 1 640 . 1 1 63 63 ILE HA H 1 4.159 0.030 . 1 . . . . 63 ILE HA . 11189 1 641 . 1 1 63 63 ILE HB H 1 1.601 0.030 . 1 . . . . 63 ILE HB . 11189 1 642 . 1 1 63 63 ILE HD11 H 1 0.672 0.030 . 1 . . . . 63 ILE HD1 . 11189 1 643 . 1 1 63 63 ILE HD12 H 1 0.672 0.030 . 1 . . . . 63 ILE HD1 . 11189 1 644 . 1 1 63 63 ILE HD13 H 1 0.672 0.030 . 1 . . . . 63 ILE HD1 . 11189 1 645 . 1 1 63 63 ILE HG12 H 1 1.413 0.030 . 2 . . . . 63 ILE HG12 . 11189 1 646 . 1 1 63 63 ILE HG13 H 1 0.812 0.030 . 2 . . . . 63 ILE HG13 . 11189 1 647 . 1 1 63 63 ILE HG21 H 1 0.682 0.030 . 1 . . . . 63 ILE HG2 . 11189 1 648 . 1 1 63 63 ILE HG22 H 1 0.682 0.030 . 1 . . . . 63 ILE HG2 . 11189 1 649 . 1 1 63 63 ILE HG23 H 1 0.682 0.030 . 1 . . . . 63 ILE HG2 . 11189 1 650 . 1 1 63 63 ILE C C 13 174.418 0.300 . 1 . . . . 63 ILE C . 11189 1 651 . 1 1 63 63 ILE CA C 13 61.076 0.300 . 1 . . . . 63 ILE CA . 11189 1 652 . 1 1 63 63 ILE CB C 13 37.447 0.300 . 1 . . . . 63 ILE CB . 11189 1 653 . 1 1 63 63 ILE CD1 C 13 12.974 0.300 . 1 . . . . 63 ILE CD1 . 11189 1 654 . 1 1 63 63 ILE CG1 C 13 26.899 0.300 . 1 . . . . 63 ILE CG1 . 11189 1 655 . 1 1 63 63 ILE CG2 C 13 18.184 0.300 . 1 . . . . 63 ILE CG2 . 11189 1 656 . 1 1 63 63 ILE N N 15 122.043 0.300 . 1 . . . . 63 ILE N . 11189 1 657 . 1 1 64 64 LEU H H 1 8.993 0.030 . 1 . . . . 64 LEU H . 11189 1 658 . 1 1 64 64 LEU HA H 1 4.424 0.030 . 1 . . . . 64 LEU HA . 11189 1 659 . 1 1 64 64 LEU HB2 H 1 1.487 0.030 . 1 . . . . 64 LEU HB2 . 11189 1 660 . 1 1 64 64 LEU HB3 H 1 1.487 0.030 . 1 . . . . 64 LEU HB3 . 11189 1 661 . 1 1 64 64 LEU HD11 H 1 0.462 0.030 . 1 . . . . 64 LEU HD1 . 11189 1 662 . 1 1 64 64 LEU HD12 H 1 0.462 0.030 . 1 . . . . 64 LEU HD1 . 11189 1 663 . 1 1 64 64 LEU HD13 H 1 0.462 0.030 . 1 . . . . 64 LEU HD1 . 11189 1 664 . 1 1 64 64 LEU HD21 H 1 0.503 0.030 . 1 . . . . 64 LEU HD2 . 11189 1 665 . 1 1 64 64 LEU HD22 H 1 0.503 0.030 . 1 . . . . 64 LEU HD2 . 11189 1 666 . 1 1 64 64 LEU HD23 H 1 0.503 0.030 . 1 . . . . 64 LEU HD2 . 11189 1 667 . 1 1 64 64 LEU HG H 1 1.301 0.030 . 1 . . . . 64 LEU HG . 11189 1 668 . 1 1 64 64 LEU C C 13 178.126 0.300 . 1 . . . . 64 LEU C . 11189 1 669 . 1 1 64 64 LEU CA C 13 55.657 0.300 . 1 . . . . 64 LEU CA . 11189 1 670 . 1 1 64 64 LEU CB C 13 42.435 0.300 . 1 . . . . 64 LEU CB . 11189 1 671 . 1 1 64 64 LEU CD1 C 13 24.929 0.300 . 2 . . . . 64 LEU CD1 . 11189 1 672 . 1 1 64 64 LEU CD2 C 13 21.679 0.300 . 2 . . . . 64 LEU CD2 . 11189 1 673 . 1 1 64 64 LEU CG C 13 26.770 0.300 . 1 . . . . 64 LEU CG . 11189 1 674 . 1 1 64 64 LEU N N 15 125.377 0.300 . 1 . . . . 64 LEU N . 11189 1 675 . 1 1 65 65 LYS H H 1 7.513 0.030 . 1 . . . . 65 LYS H . 11189 1 676 . 1 1 65 65 LYS HA H 1 5.266 0.030 . 1 . . . . 65 LYS HA . 11189 1 677 . 1 1 65 65 LYS HB2 H 1 1.561 0.030 . 2 . . . . 65 LYS HB2 . 11189 1 678 . 1 1 65 65 LYS HB3 H 1 1.634 0.030 . 2 . . . . 65 LYS HB3 . 11189 1 679 . 1 1 65 65 LYS HD2 H 1 1.472 0.030 . 2 . . . . 65 LYS HD2 . 11189 1 680 . 1 1 65 65 LYS HD3 H 1 1.562 0.030 . 2 . . . . 65 LYS HD3 . 11189 1 681 . 1 1 65 65 LYS HE2 H 1 2.774 0.030 . 2 . . . . 65 LYS HE2 . 11189 1 682 . 1 1 65 65 LYS HE3 H 1 2.884 0.030 . 2 . . . . 65 LYS HE3 . 11189 1 683 . 1 1 65 65 LYS HG2 H 1 1.188 0.030 . 2 . . . . 65 LYS HG2 . 11189 1 684 . 1 1 65 65 LYS HG3 H 1 1.257 0.030 . 2 . . . . 65 LYS HG3 . 11189 1 685 . 1 1 65 65 LYS C C 13 175.021 0.300 . 1 . . . . 65 LYS C . 11189 1 686 . 1 1 65 65 LYS CA C 13 55.029 0.300 . 1 . . . . 65 LYS CA . 11189 1 687 . 1 1 65 65 LYS CB C 13 38.242 0.300 . 1 . . . . 65 LYS CB . 11189 1 688 . 1 1 65 65 LYS CD C 13 29.711 0.300 . 1 . . . . 65 LYS CD . 11189 1 689 . 1 1 65 65 LYS CE C 13 41.766 0.300 . 1 . . . . 65 LYS CE . 11189 1 690 . 1 1 65 65 LYS CG C 13 25.423 0.300 . 1 . . . . 65 LYS CG . 11189 1 691 . 1 1 65 65 LYS N N 15 116.286 0.300 . 1 . . . . 65 LYS N . 11189 1 692 . 1 1 66 66 ILE H H 1 8.418 0.030 . 1 . . . . 66 ILE H . 11189 1 693 . 1 1 66 66 ILE HA H 1 4.536 0.030 . 1 . . . . 66 ILE HA . 11189 1 694 . 1 1 66 66 ILE HB H 1 1.504 0.030 . 1 . . . . 66 ILE HB . 11189 1 695 . 1 1 66 66 ILE HD11 H 1 0.798 0.030 . 1 . . . . 66 ILE HD1 . 11189 1 696 . 1 1 66 66 ILE HD12 H 1 0.798 0.030 . 1 . . . . 66 ILE HD1 . 11189 1 697 . 1 1 66 66 ILE HD13 H 1 0.798 0.030 . 1 . . . . 66 ILE HD1 . 11189 1 698 . 1 1 66 66 ILE HG12 H 1 1.479 0.030 . 2 . . . . 66 ILE HG12 . 11189 1 699 . 1 1 66 66 ILE HG13 H 1 0.794 0.030 . 2 . . . . 66 ILE HG13 . 11189 1 700 . 1 1 66 66 ILE HG21 H 1 0.766 0.030 . 1 . . . . 66 ILE HG2 . 11189 1 701 . 1 1 66 66 ILE HG22 H 1 0.766 0.030 . 1 . . . . 66 ILE HG2 . 11189 1 702 . 1 1 66 66 ILE HG23 H 1 0.766 0.030 . 1 . . . . 66 ILE HG2 . 11189 1 703 . 1 1 66 66 ILE C C 13 176.513 0.300 . 1 . . . . 66 ILE C . 11189 1 704 . 1 1 66 66 ILE CA C 13 60.777 0.300 . 1 . . . . 66 ILE CA . 11189 1 705 . 1 1 66 66 ILE CB C 13 40.281 0.300 . 1 . . . . 66 ILE CB . 11189 1 706 . 1 1 66 66 ILE CD1 C 13 14.454 0.300 . 1 . . . . 66 ILE CD1 . 11189 1 707 . 1 1 66 66 ILE CG1 C 13 27.616 0.300 . 1 . . . . 66 ILE CG1 . 11189 1 708 . 1 1 66 66 ILE CG2 C 13 18.107 0.300 . 1 . . . . 66 ILE CG2 . 11189 1 709 . 1 1 66 66 ILE N N 15 121.104 0.300 . 1 . . . . 66 ILE N . 11189 1 710 . 1 1 67 67 GLY H H 1 9.553 0.030 . 1 . . . . 67 GLY H . 11189 1 711 . 1 1 67 67 GLY HA2 H 1 3.852 0.030 . 2 . . . . 67 GLY HA2 . 11189 1 712 . 1 1 67 67 GLY HA3 H 1 4.049 0.030 . 2 . . . . 67 GLY HA3 . 11189 1 713 . 1 1 67 67 GLY C C 13 174.934 0.300 . 1 . . . . 67 GLY C . 11189 1 714 . 1 1 67 67 GLY CA C 13 47.292 0.300 . 1 . . . . 67 GLY CA . 11189 1 715 . 1 1 67 67 GLY N N 15 118.594 0.300 . 1 . . . . 67 GLY N . 11189 1 716 . 1 1 68 68 GLY HA2 H 1 3.991 0.030 . 1 . . . . 68 GLY HA2 . 11189 1 717 . 1 1 68 68 GLY HA3 H 1 3.991 0.030 . 1 . . . . 68 GLY HA3 . 11189 1 718 . 1 1 68 68 GLY C C 13 174.034 0.300 . 1 . . . . 68 GLY C . 11189 1 719 . 1 1 68 68 GLY CA C 13 45.003 0.300 . 1 . . . . 68 GLY CA . 11189 1 720 . 1 1 69 69 THR H H 1 8.225 0.030 . 1 . . . . 69 THR H . 11189 1 721 . 1 1 69 69 THR HA H 1 4.312 0.030 . 1 . . . . 69 THR HA . 11189 1 722 . 1 1 69 69 THR HB H 1 4.214 0.030 . 1 . . . . 69 THR HB . 11189 1 723 . 1 1 69 69 THR HG21 H 1 1.148 0.030 . 1 . . . . 69 THR HG2 . 11189 1 724 . 1 1 69 69 THR HG22 H 1 1.148 0.030 . 1 . . . . 69 THR HG2 . 11189 1 725 . 1 1 69 69 THR HG23 H 1 1.148 0.030 . 1 . . . . 69 THR HG2 . 11189 1 726 . 1 1 69 69 THR C C 13 173.156 0.300 . 1 . . . . 69 THR C . 11189 1 727 . 1 1 69 69 THR CA C 13 62.339 0.300 . 1 . . . . 69 THR CA . 11189 1 728 . 1 1 69 69 THR CB C 13 69.731 0.300 . 1 . . . . 69 THR CB . 11189 1 729 . 1 1 69 69 THR CG2 C 13 21.569 0.300 . 1 . . . . 69 THR CG2 . 11189 1 730 . 1 1 69 69 THR N N 15 119.265 0.300 . 1 . . . . 69 THR N . 11189 1 731 . 1 1 70 70 ASN H H 1 9.071 0.030 . 1 . . . . 70 ASN H . 11189 1 732 . 1 1 70 70 ASN HA H 1 4.793 0.030 . 1 . . . . 70 ASN HA . 11189 1 733 . 1 1 70 70 ASN HB2 H 1 3.092 0.030 . 2 . . . . 70 ASN HB2 . 11189 1 734 . 1 1 70 70 ASN HB3 H 1 2.885 0.030 . 2 . . . . 70 ASN HB3 . 11189 1 735 . 1 1 70 70 ASN HD21 H 1 7.618 0.030 . 2 . . . . 70 ASN HD21 . 11189 1 736 . 1 1 70 70 ASN HD22 H 1 7.072 0.030 . 2 . . . . 70 ASN HD22 . 11189 1 737 . 1 1 70 70 ASN C C 13 176.107 0.300 . 1 . . . . 70 ASN C . 11189 1 738 . 1 1 70 70 ASN CA C 13 54.002 0.300 . 1 . . . . 70 ASN CA . 11189 1 739 . 1 1 70 70 ASN CB C 13 38.116 0.300 . 1 . . . . 70 ASN CB . 11189 1 740 . 1 1 70 70 ASN N N 15 126.727 0.300 . 1 . . . . 70 ASN N . 11189 1 741 . 1 1 70 70 ASN ND2 N 15 111.578 0.300 . 1 . . . . 70 ASN ND2 . 11189 1 742 . 1 1 71 71 VAL H H 1 7.893 0.030 . 1 . . . . 71 VAL H . 11189 1 743 . 1 1 71 71 VAL HA H 1 4.797 0.030 . 1 . . . . 71 VAL HA . 11189 1 744 . 1 1 71 71 VAL HB H 1 2.614 0.030 . 1 . . . . 71 VAL HB . 11189 1 745 . 1 1 71 71 VAL HG11 H 1 0.930 0.030 . 1 . . . . 71 VAL HG1 . 11189 1 746 . 1 1 71 71 VAL HG12 H 1 0.930 0.030 . 1 . . . . 71 VAL HG1 . 11189 1 747 . 1 1 71 71 VAL HG13 H 1 0.930 0.030 . 1 . . . . 71 VAL HG1 . 11189 1 748 . 1 1 71 71 VAL HG21 H 1 0.553 0.030 . 1 . . . . 71 VAL HG2 . 11189 1 749 . 1 1 71 71 VAL HG22 H 1 0.553 0.030 . 1 . . . . 71 VAL HG2 . 11189 1 750 . 1 1 71 71 VAL HG23 H 1 0.553 0.030 . 1 . . . . 71 VAL HG2 . 11189 1 751 . 1 1 71 71 VAL C C 13 176.437 0.300 . 1 . . . . 71 VAL C . 11189 1 752 . 1 1 71 71 VAL CA C 13 60.106 0.300 . 1 . . . . 71 VAL CA . 11189 1 753 . 1 1 71 71 VAL CB C 13 31.081 0.300 . 1 . . . . 71 VAL CB . 11189 1 754 . 1 1 71 71 VAL CG1 C 13 20.891 0.300 . 2 . . . . 71 VAL CG1 . 11189 1 755 . 1 1 71 71 VAL CG2 C 13 18.997 0.300 . 2 . . . . 71 VAL CG2 . 11189 1 756 . 1 1 71 71 VAL N N 15 118.531 0.300 . 1 . . . . 71 VAL N . 11189 1 757 . 1 1 72 72 GLN H H 1 8.411 0.030 . 1 . . . . 72 GLN H . 11189 1 758 . 1 1 72 72 GLN HA H 1 4.274 0.030 . 1 . . . . 72 GLN HA . 11189 1 759 . 1 1 72 72 GLN HB2 H 1 2.227 0.030 . 2 . . . . 72 GLN HB2 . 11189 1 760 . 1 1 72 72 GLN HB3 H 1 2.325 0.030 . 2 . . . . 72 GLN HB3 . 11189 1 761 . 1 1 72 72 GLN HE21 H 1 7.099 0.030 . 2 . . . . 72 GLN HE21 . 11189 1 762 . 1 1 72 72 GLN HE22 H 1 7.692 0.030 . 2 . . . . 72 GLN HE22 . 11189 1 763 . 1 1 72 72 GLN HG2 H 1 2.485 0.030 . 2 . . . . 72 GLN HG2 . 11189 1 764 . 1 1 72 72 GLN HG3 H 1 2.757 0.030 . 2 . . . . 72 GLN HG3 . 11189 1 765 . 1 1 72 72 GLN C C 13 176.843 0.300 . 1 . . . . 72 GLN C . 11189 1 766 . 1 1 72 72 GLN CA C 13 58.794 0.300 . 1 . . . . 72 GLN CA . 11189 1 767 . 1 1 72 72 GLN CB C 13 29.021 0.300 . 1 . . . . 72 GLN CB . 11189 1 768 . 1 1 72 72 GLN CG C 13 35.135 0.300 . 1 . . . . 72 GLN CG . 11189 1 769 . 1 1 72 72 GLN N N 15 122.811 0.300 . 1 . . . . 72 GLN N . 11189 1 770 . 1 1 72 72 GLN NE2 N 15 112.405 0.300 . 1 . . . . 72 GLN NE2 . 11189 1 771 . 1 1 73 73 GLY H H 1 8.838 0.030 . 1 . . . . 73 GLY H . 11189 1 772 . 1 1 73 73 GLY HA2 H 1 4.014 0.030 . 2 . . . . 73 GLY HA2 . 11189 1 773 . 1 1 73 73 GLY HA3 H 1 4.065 0.030 . 2 . . . . 73 GLY HA3 . 11189 1 774 . 1 1 73 73 GLY C C 13 174.341 0.300 . 1 . . . . 73 GLY C . 11189 1 775 . 1 1 73 73 GLY CA C 13 44.914 0.300 . 1 . . . . 73 GLY CA . 11189 1 776 . 1 1 73 73 GLY N N 15 110.809 0.300 . 1 . . . . 73 GLY N . 11189 1 777 . 1 1 74 74 MET H H 1 7.503 0.030 . 1 . . . . 74 MET H . 11189 1 778 . 1 1 74 74 MET HA H 1 4.584 0.030 . 1 . . . . 74 MET HA . 11189 1 779 . 1 1 74 74 MET HB2 H 1 2.140 0.030 . 2 . . . . 74 MET HB2 . 11189 1 780 . 1 1 74 74 MET HB3 H 1 2.045 0.030 . 2 . . . . 74 MET HB3 . 11189 1 781 . 1 1 74 74 MET HE1 H 1 2.046 0.030 . 1 . . . . 74 MET HE . 11189 1 782 . 1 1 74 74 MET HE2 H 1 2.046 0.030 . 1 . . . . 74 MET HE . 11189 1 783 . 1 1 74 74 MET HE3 H 1 2.046 0.030 . 1 . . . . 74 MET HE . 11189 1 784 . 1 1 74 74 MET HG2 H 1 2.558 0.030 . 2 . . . . 74 MET HG2 . 11189 1 785 . 1 1 74 74 MET HG3 H 1 2.455 0.030 . 2 . . . . 74 MET HG3 . 11189 1 786 . 1 1 74 74 MET C C 13 176.173 0.300 . 1 . . . . 74 MET C . 11189 1 787 . 1 1 74 74 MET CA C 13 56.570 0.300 . 1 . . . . 74 MET CA . 11189 1 788 . 1 1 74 74 MET CB C 13 34.928 0.300 . 1 . . . . 74 MET CB . 11189 1 789 . 1 1 74 74 MET CE C 13 17.989 0.300 . 1 . . . . 74 MET CE . 11189 1 790 . 1 1 74 74 MET CG C 13 34.568 0.300 . 1 . . . . 74 MET CG . 11189 1 791 . 1 1 74 74 MET N N 15 119.399 0.300 . 1 . . . . 74 MET N . 11189 1 792 . 1 1 75 75 THR H H 1 8.422 0.030 . 1 . . . . 75 THR H . 11189 1 793 . 1 1 75 75 THR HA H 1 4.443 0.030 . 1 . . . . 75 THR HA . 11189 1 794 . 1 1 75 75 THR HB H 1 4.849 0.030 . 1 . . . . 75 THR HB . 11189 1 795 . 1 1 75 75 THR HG21 H 1 1.368 0.030 . 1 . . . . 75 THR HG2 . 11189 1 796 . 1 1 75 75 THR HG22 H 1 1.368 0.030 . 1 . . . . 75 THR HG2 . 11189 1 797 . 1 1 75 75 THR HG23 H 1 1.368 0.030 . 1 . . . . 75 THR HG2 . 11189 1 798 . 1 1 75 75 THR C C 13 176.129 0.300 . 1 . . . . 75 THR C . 11189 1 799 . 1 1 75 75 THR CA C 13 60.106 0.300 . 1 . . . . 75 THR CA . 11189 1 800 . 1 1 75 75 THR CB C 13 71.327 0.300 . 1 . . . . 75 THR CB . 11189 1 801 . 1 1 75 75 THR CG2 C 13 21.734 0.300 . 1 . . . . 75 THR CG2 . 11189 1 802 . 1 1 75 75 THR N N 15 108.969 0.300 . 1 . . . . 75 THR N . 11189 1 803 . 1 1 76 76 SER H H 1 9.187 0.030 . 1 . . . . 76 SER H . 11189 1 804 . 1 1 76 76 SER HA H 1 4.843 0.030 . 1 . . . . 76 SER HA . 11189 1 805 . 1 1 76 76 SER HB2 H 1 3.890 0.030 . 1 . . . . 76 SER HB2 . 11189 1 806 . 1 1 76 76 SER HB3 H 1 3.890 0.030 . 1 . . . . 76 SER HB3 . 11189 1 807 . 1 1 76 76 SER C C 13 176.448 0.300 . 1 . . . . 76 SER C . 11189 1 808 . 1 1 76 76 SER CA C 13 59.848 0.300 . 1 . . . . 76 SER CA . 11189 1 809 . 1 1 76 76 SER CB C 13 62.181 0.300 . 1 . . . . 76 SER CB . 11189 1 810 . 1 1 76 76 SER N N 15 116.063 0.300 . 1 . . . . 76 SER N . 11189 1 811 . 1 1 77 77 GLU H H 1 8.601 0.030 . 1 . . . . 77 GLU H . 11189 1 812 . 1 1 77 77 GLU HA H 1 4.088 0.030 . 1 . . . . 77 GLU HA . 11189 1 813 . 1 1 77 77 GLU HB2 H 1 1.955 0.030 . 2 . . . . 77 GLU HB2 . 11189 1 814 . 1 1 77 77 GLU HB3 H 1 2.067 0.030 . 2 . . . . 77 GLU HB3 . 11189 1 815 . 1 1 77 77 GLU HG2 H 1 2.304 0.030 . 2 . . . . 77 GLU HG2 . 11189 1 816 . 1 1 77 77 GLU HG3 H 1 2.381 0.030 . 2 . . . . 77 GLU HG3 . 11189 1 817 . 1 1 77 77 GLU C C 13 179.267 0.300 . 1 . . . . 77 GLU C . 11189 1 818 . 1 1 77 77 GLU CA C 13 59.712 0.300 . 1 . . . . 77 GLU CA . 11189 1 819 . 1 1 77 77 GLU CB C 13 28.922 0.300 . 1 . . . . 77 GLU CB . 11189 1 820 . 1 1 77 77 GLU CG C 13 36.525 0.300 . 1 . . . . 77 GLU CG . 11189 1 821 . 1 1 77 77 GLU N N 15 121.365 0.300 . 1 . . . . 77 GLU N . 11189 1 822 . 1 1 78 78 GLN H H 1 7.653 0.030 . 1 . . . . 78 GLN H . 11189 1 823 . 1 1 78 78 GLN HA H 1 4.084 0.030 . 1 . . . . 78 GLN HA . 11189 1 824 . 1 1 78 78 GLN HB2 H 1 2.191 0.030 . 2 . . . . 78 GLN HB2 . 11189 1 825 . 1 1 78 78 GLN HB3 H 1 2.433 0.030 . 2 . . . . 78 GLN HB3 . 11189 1 826 . 1 1 78 78 GLN HE21 H 1 6.849 0.030 . 2 . . . . 78 GLN HE21 . 11189 1 827 . 1 1 78 78 GLN HE22 H 1 7.553 0.030 . 2 . . . . 78 GLN HE22 . 11189 1 828 . 1 1 78 78 GLN HG2 H 1 2.483 0.030 . 1 . . . . 78 GLN HG2 . 11189 1 829 . 1 1 78 78 GLN HG3 H 1 2.483 0.030 . 1 . . . . 78 GLN HG3 . 11189 1 830 . 1 1 78 78 GLN C C 13 179.530 0.300 . 1 . . . . 78 GLN C . 11189 1 831 . 1 1 78 78 GLN CA C 13 58.680 0.300 . 1 . . . . 78 GLN CA . 11189 1 832 . 1 1 78 78 GLN CB C 13 28.969 0.300 . 1 . . . . 78 GLN CB . 11189 1 833 . 1 1 78 78 GLN CG C 13 34.731 0.300 . 1 . . . . 78 GLN CG . 11189 1 834 . 1 1 78 78 GLN N N 15 120.075 0.300 . 1 . . . . 78 GLN N . 11189 1 835 . 1 1 78 78 GLN NE2 N 15 110.728 0.300 . 1 . . . . 78 GLN NE2 . 11189 1 836 . 1 1 79 79 VAL H H 1 8.544 0.030 . 1 . . . . 79 VAL H . 11189 1 837 . 1 1 79 79 VAL HA H 1 3.491 0.030 . 1 . . . . 79 VAL HA . 11189 1 838 . 1 1 79 79 VAL HB H 1 1.996 0.030 . 1 . . . . 79 VAL HB . 11189 1 839 . 1 1 79 79 VAL HG11 H 1 0.839 0.030 . 1 . . . . 79 VAL HG1 . 11189 1 840 . 1 1 79 79 VAL HG12 H 1 0.839 0.030 . 1 . . . . 79 VAL HG1 . 11189 1 841 . 1 1 79 79 VAL HG13 H 1 0.839 0.030 . 1 . . . . 79 VAL HG1 . 11189 1 842 . 1 1 79 79 VAL HG21 H 1 1.025 0.030 . 1 . . . . 79 VAL HG2 . 11189 1 843 . 1 1 79 79 VAL HG22 H 1 1.025 0.030 . 1 . . . . 79 VAL HG2 . 11189 1 844 . 1 1 79 79 VAL HG23 H 1 1.025 0.030 . 1 . . . . 79 VAL HG2 . 11189 1 845 . 1 1 79 79 VAL C C 13 177.139 0.300 . 1 . . . . 79 VAL C . 11189 1 846 . 1 1 79 79 VAL CA C 13 66.876 0.300 . 1 . . . . 79 VAL CA . 11189 1 847 . 1 1 79 79 VAL CB C 13 30.835 0.300 . 1 . . . . 79 VAL CB . 11189 1 848 . 1 1 79 79 VAL CG1 C 13 21.880 0.300 . 2 . . . . 79 VAL CG1 . 11189 1 849 . 1 1 79 79 VAL CG2 C 13 24.925 0.300 . 2 . . . . 79 VAL CG2 . 11189 1 850 . 1 1 79 79 VAL N N 15 120.673 0.300 . 1 . . . . 79 VAL N . 11189 1 851 . 1 1 80 80 ALA H H 1 8.366 0.030 . 1 . . . . 80 ALA H . 11189 1 852 . 1 1 80 80 ALA HA H 1 3.990 0.030 . 1 . . . . 80 ALA HA . 11189 1 853 . 1 1 80 80 ALA HB1 H 1 1.510 0.030 . 1 . . . . 80 ALA HB . 11189 1 854 . 1 1 80 80 ALA HB2 H 1 1.510 0.030 . 1 . . . . 80 ALA HB . 11189 1 855 . 1 1 80 80 ALA HB3 H 1 1.510 0.030 . 1 . . . . 80 ALA HB . 11189 1 856 . 1 1 80 80 ALA C C 13 180.342 0.300 . 1 . . . . 80 ALA C . 11189 1 857 . 1 1 80 80 ALA CA C 13 55.200 0.300 . 1 . . . . 80 ALA CA . 11189 1 858 . 1 1 80 80 ALA CB C 13 17.523 0.300 . 1 . . . . 80 ALA CB . 11189 1 859 . 1 1 80 80 ALA N N 15 121.983 0.300 . 1 . . . . 80 ALA N . 11189 1 860 . 1 1 81 81 GLN H H 1 7.415 0.030 . 1 . . . . 81 GLN H . 11189 1 861 . 1 1 81 81 GLN HA H 1 4.000 0.030 . 1 . . . . 81 GLN HA . 11189 1 862 . 1 1 81 81 GLN HB2 H 1 2.230 0.030 . 1 . . . . 81 GLN HB2 . 11189 1 863 . 1 1 81 81 GLN HB3 H 1 2.230 0.030 . 1 . . . . 81 GLN HB3 . 11189 1 864 . 1 1 81 81 GLN HE21 H 1 7.486 0.030 . 2 . . . . 81 GLN HE21 . 11189 1 865 . 1 1 81 81 GLN HE22 H 1 6.935 0.030 . 2 . . . . 81 GLN HE22 . 11189 1 866 . 1 1 81 81 GLN HG2 H 1 2.447 0.030 . 1 . . . . 81 GLN HG2 . 11189 1 867 . 1 1 81 81 GLN HG3 H 1 2.447 0.030 . 1 . . . . 81 GLN HG3 . 11189 1 868 . 1 1 81 81 GLN C C 13 177.632 0.300 . 1 . . . . 81 GLN C . 11189 1 869 . 1 1 81 81 GLN CA C 13 58.566 0.300 . 1 . . . . 81 GLN CA . 11189 1 870 . 1 1 81 81 GLN CB C 13 27.966 0.300 . 1 . . . . 81 GLN CB . 11189 1 871 . 1 1 81 81 GLN CG C 13 33.366 0.300 . 1 . . . . 81 GLN CG . 11189 1 872 . 1 1 81 81 GLN N N 15 117.342 0.300 . 1 . . . . 81 GLN N . 11189 1 873 . 1 1 81 81 GLN NE2 N 15 112.803 0.300 . 1 . . . . 81 GLN NE2 . 11189 1 874 . 1 1 82 82 VAL H H 1 7.727 0.030 . 1 . . . . 82 VAL H . 11189 1 875 . 1 1 82 82 VAL HA H 1 3.677 0.030 . 1 . . . . 82 VAL HA . 11189 1 876 . 1 1 82 82 VAL HB H 1 2.285 0.030 . 1 . . . . 82 VAL HB . 11189 1 877 . 1 1 82 82 VAL HG11 H 1 0.884 0.030 . 1 . . . . 82 VAL HG1 . 11189 1 878 . 1 1 82 82 VAL HG12 H 1 0.884 0.030 . 1 . . . . 82 VAL HG1 . 11189 1 879 . 1 1 82 82 VAL HG13 H 1 0.884 0.030 . 1 . . . . 82 VAL HG1 . 11189 1 880 . 1 1 82 82 VAL HG21 H 1 1.075 0.030 . 1 . . . . 82 VAL HG2 . 11189 1 881 . 1 1 82 82 VAL HG22 H 1 1.075 0.030 . 1 . . . . 82 VAL HG2 . 11189 1 882 . 1 1 82 82 VAL HG23 H 1 1.075 0.030 . 1 . . . . 82 VAL HG2 . 11189 1 883 . 1 1 82 82 VAL C C 13 179.618 0.300 . 1 . . . . 82 VAL C . 11189 1 884 . 1 1 82 82 VAL CA C 13 66.356 0.300 . 1 . . . . 82 VAL CA . 11189 1 885 . 1 1 82 82 VAL CB C 13 31.176 0.300 . 1 . . . . 82 VAL CB . 11189 1 886 . 1 1 82 82 VAL CG1 C 13 21.481 0.300 . 2 . . . . 82 VAL CG1 . 11189 1 887 . 1 1 82 82 VAL CG2 C 13 22.616 0.300 . 2 . . . . 82 VAL CG2 . 11189 1 888 . 1 1 82 82 VAL N N 15 121.179 0.300 . 1 . . . . 82 VAL N . 11189 1 889 . 1 1 83 83 LEU H H 1 8.410 0.030 . 1 . . . . 83 LEU H . 11189 1 890 . 1 1 83 83 LEU HA H 1 4.118 0.030 . 1 . . . . 83 LEU HA . 11189 1 891 . 1 1 83 83 LEU HB2 H 1 1.868 0.030 . 2 . . . . 83 LEU HB2 . 11189 1 892 . 1 1 83 83 LEU HB3 H 1 1.442 0.030 . 2 . . . . 83 LEU HB3 . 11189 1 893 . 1 1 83 83 LEU HD11 H 1 0.791 0.030 . 1 . . . . 83 LEU HD1 . 11189 1 894 . 1 1 83 83 LEU HD12 H 1 0.791 0.030 . 1 . . . . 83 LEU HD1 . 11189 1 895 . 1 1 83 83 LEU HD13 H 1 0.791 0.030 . 1 . . . . 83 LEU HD1 . 11189 1 896 . 1 1 83 83 LEU HD21 H 1 0.891 0.030 . 1 . . . . 83 LEU HD2 . 11189 1 897 . 1 1 83 83 LEU HD22 H 1 0.891 0.030 . 1 . . . . 83 LEU HD2 . 11189 1 898 . 1 1 83 83 LEU HD23 H 1 0.891 0.030 . 1 . . . . 83 LEU HD2 . 11189 1 899 . 1 1 83 83 LEU HG H 1 1.654 0.030 . 1 . . . . 83 LEU HG . 11189 1 900 . 1 1 83 83 LEU C C 13 179.508 0.300 . 1 . . . . 83 LEU C . 11189 1 901 . 1 1 83 83 LEU CA C 13 58.136 0.300 . 1 . . . . 83 LEU CA . 11189 1 902 . 1 1 83 83 LEU CB C 13 41.902 0.300 . 1 . . . . 83 LEU CB . 11189 1 903 . 1 1 83 83 LEU CD1 C 13 25.371 0.300 . 2 . . . . 83 LEU CD1 . 11189 1 904 . 1 1 83 83 LEU CD2 C 13 24.306 0.300 . 2 . . . . 83 LEU CD2 . 11189 1 905 . 1 1 83 83 LEU CG C 13 27.156 0.300 . 1 . . . . 83 LEU CG . 11189 1 906 . 1 1 83 83 LEU N N 15 119.010 0.300 . 1 . . . . 83 LEU N . 11189 1 907 . 1 1 84 84 ARG H H 1 7.933 0.030 . 1 . . . . 84 ARG H . 11189 1 908 . 1 1 84 84 ARG HA H 1 4.106 0.030 . 1 . . . . 84 ARG HA . 11189 1 909 . 1 1 84 84 ARG HB2 H 1 1.900 0.030 . 2 . . . . 84 ARG HB2 . 11189 1 910 . 1 1 84 84 ARG HB3 H 1 1.959 0.030 . 2 . . . . 84 ARG HB3 . 11189 1 911 . 1 1 84 84 ARG HD2 H 1 3.197 0.030 . 2 . . . . 84 ARG HD2 . 11189 1 912 . 1 1 84 84 ARG HD3 H 1 3.245 0.030 . 2 . . . . 84 ARG HD3 . 11189 1 913 . 1 1 84 84 ARG HG2 H 1 1.801 0.030 . 2 . . . . 84 ARG HG2 . 11189 1 914 . 1 1 84 84 ARG HG3 H 1 1.664 0.030 . 2 . . . . 84 ARG HG3 . 11189 1 915 . 1 1 84 84 ARG C C 13 177.797 0.300 . 1 . . . . 84 ARG C . 11189 1 916 . 1 1 84 84 ARG CA C 13 58.686 0.300 . 1 . . . . 84 ARG CA . 11189 1 917 . 1 1 84 84 ARG CB C 13 30.106 0.300 . 1 . . . . 84 ARG CB . 11189 1 918 . 1 1 84 84 ARG CD C 13 43.466 0.300 . 1 . . . . 84 ARG CD . 11189 1 919 . 1 1 84 84 ARG CG C 13 27.589 0.300 . 1 . . . . 84 ARG CG . 11189 1 920 . 1 1 84 84 ARG N N 15 119.026 0.300 . 1 . . . . 84 ARG N . 11189 1 921 . 1 1 85 85 ASN H H 1 7.757 0.030 . 1 . . . . 85 ASN H . 11189 1 922 . 1 1 85 85 ASN HA H 1 4.775 0.030 . 1 . . . . 85 ASN HA . 11189 1 923 . 1 1 85 85 ASN HB2 H 1 2.843 0.030 . 2 . . . . 85 ASN HB2 . 11189 1 924 . 1 1 85 85 ASN HB3 H 1 3.019 0.030 . 2 . . . . 85 ASN HB3 . 11189 1 925 . 1 1 85 85 ASN HD21 H 1 7.609 0.030 . 2 . . . . 85 ASN HD21 . 11189 1 926 . 1 1 85 85 ASN HD22 H 1 6.942 0.030 . 2 . . . . 85 ASN HD22 . 11189 1 927 . 1 1 85 85 ASN C C 13 175.910 0.300 . 1 . . . . 85 ASN C . 11189 1 928 . 1 1 85 85 ASN CA C 13 53.461 0.300 . 1 . . . . 85 ASN CA . 11189 1 929 . 1 1 85 85 ASN CB C 13 38.854 0.300 . 1 . . . . 85 ASN CB . 11189 1 930 . 1 1 85 85 ASN N N 15 116.416 0.300 . 1 . . . . 85 ASN N . 11189 1 931 . 1 1 85 85 ASN ND2 N 15 112.064 0.300 . 1 . . . . 85 ASN ND2 . 11189 1 932 . 1 1 86 86 CYS H H 1 7.521 0.030 . 1 . . . . 86 CYS H . 11189 1 933 . 1 1 86 86 CYS HA H 1 4.414 0.030 . 1 . . . . 86 CYS HA . 11189 1 934 . 1 1 86 86 CYS HB2 H 1 3.119 0.030 . 1 . . . . 86 CYS HB2 . 11189 1 935 . 1 1 86 86 CYS HB3 H 1 3.119 0.030 . 1 . . . . 86 CYS HB3 . 11189 1 936 . 1 1 86 86 CYS C C 13 174.988 0.300 . 1 . . . . 86 CYS C . 11189 1 937 . 1 1 86 86 CYS CA C 13 61.318 0.300 . 1 . . . . 86 CYS CA . 11189 1 938 . 1 1 86 86 CYS CB C 13 28.237 0.300 . 1 . . . . 86 CYS CB . 11189 1 939 . 1 1 86 86 CYS N N 15 117.820 0.300 . 1 . . . . 86 CYS N . 11189 1 940 . 1 1 87 87 GLY H H 1 8.065 0.030 . 1 . . . . 87 GLY H . 11189 1 941 . 1 1 87 87 GLY HA2 H 1 4.051 0.030 . 2 . . . . 87 GLY HA2 . 11189 1 942 . 1 1 87 87 GLY HA3 H 1 3.959 0.030 . 2 . . . . 87 GLY HA3 . 11189 1 943 . 1 1 87 87 GLY C C 13 173.716 0.300 . 1 . . . . 87 GLY C . 11189 1 944 . 1 1 87 87 GLY CA C 13 44.741 0.300 . 1 . . . . 87 GLY CA . 11189 1 945 . 1 1 87 87 GLY N N 15 108.093 0.300 . 1 . . . . 87 GLY N . 11189 1 946 . 1 1 88 88 ASN H H 1 8.620 0.030 . 1 . . . . 88 ASN H . 11189 1 947 . 1 1 88 88 ASN HA H 1 4.566 0.030 . 1 . . . . 88 ASN HA . 11189 1 948 . 1 1 88 88 ASN HB2 H 1 2.827 0.030 . 2 . . . . 88 ASN HB2 . 11189 1 949 . 1 1 88 88 ASN HB3 H 1 2.961 0.030 . 2 . . . . 88 ASN HB3 . 11189 1 950 . 1 1 88 88 ASN HD21 H 1 6.933 0.030 . 2 . . . . 88 ASN HD21 . 11189 1 951 . 1 1 88 88 ASN HD22 H 1 7.559 0.030 . 2 . . . . 88 ASN HD22 . 11189 1 952 . 1 1 88 88 ASN C C 13 174.824 0.300 . 1 . . . . 88 ASN C . 11189 1 953 . 1 1 88 88 ASN CA C 13 55.441 0.300 . 1 . . . . 88 ASN CA . 11189 1 954 . 1 1 88 88 ASN CB C 13 38.680 0.300 . 1 . . . . 88 ASN CB . 11189 1 955 . 1 1 88 88 ASN ND2 N 15 112.455 0.300 . 1 . . . . 88 ASN ND2 . 11189 1 956 . 1 1 89 89 SER H H 1 7.756 0.030 . 1 . . . . 89 SER H . 11189 1 957 . 1 1 89 89 SER HA H 1 4.956 0.030 . 1 . . . . 89 SER HA . 11189 1 958 . 1 1 89 89 SER HB2 H 1 3.744 0.030 . 1 . . . . 89 SER HB2 . 11189 1 959 . 1 1 89 89 SER HB3 H 1 3.744 0.030 . 1 . . . . 89 SER HB3 . 11189 1 960 . 1 1 89 89 SER C C 13 173.134 0.300 . 1 . . . . 89 SER C . 11189 1 961 . 1 1 89 89 SER CA C 13 56.850 0.300 . 1 . . . . 89 SER CA . 11189 1 962 . 1 1 89 89 SER CB C 13 63.308 0.300 . 1 . . . . 89 SER CB . 11189 1 963 . 1 1 89 89 SER N N 15 112.426 0.300 . 1 . . . . 89 SER N . 11189 1 964 . 1 1 90 90 VAL H H 1 9.000 0.030 . 1 . . . . 90 VAL H . 11189 1 965 . 1 1 90 90 VAL HA H 1 4.210 0.030 . 1 . . . . 90 VAL HA . 11189 1 966 . 1 1 90 90 VAL HB H 1 2.110 0.030 . 1 . . . . 90 VAL HB . 11189 1 967 . 1 1 90 90 VAL HG11 H 1 0.927 0.030 . 1 . . . . 90 VAL HG1 . 11189 1 968 . 1 1 90 90 VAL HG12 H 1 0.927 0.030 . 1 . . . . 90 VAL HG1 . 11189 1 969 . 1 1 90 90 VAL HG13 H 1 0.927 0.030 . 1 . . . . 90 VAL HG1 . 11189 1 970 . 1 1 90 90 VAL HG21 H 1 0.983 0.030 . 1 . . . . 90 VAL HG2 . 11189 1 971 . 1 1 90 90 VAL HG22 H 1 0.983 0.030 . 1 . . . . 90 VAL HG2 . 11189 1 972 . 1 1 90 90 VAL HG23 H 1 0.983 0.030 . 1 . . . . 90 VAL HG2 . 11189 1 973 . 1 1 90 90 VAL C C 13 173.507 0.300 . 1 . . . . 90 VAL C . 11189 1 974 . 1 1 90 90 VAL CA C 13 61.402 0.300 . 1 . . . . 90 VAL CA . 11189 1 975 . 1 1 90 90 VAL CB C 13 33.373 0.300 . 1 . . . . 90 VAL CB . 11189 1 976 . 1 1 90 90 VAL CG1 C 13 21.093 0.300 . 2 . . . . 90 VAL CG1 . 11189 1 977 . 1 1 90 90 VAL CG2 C 13 21.237 0.300 . 2 . . . . 90 VAL CG2 . 11189 1 978 . 1 1 90 90 VAL N N 15 126.702 0.300 . 1 . . . . 90 VAL N . 11189 1 979 . 1 1 91 91 ARG H H 1 8.521 0.030 . 1 . . . . 91 ARG H . 11189 1 980 . 1 1 91 91 ARG HA H 1 5.018 0.030 . 1 . . . . 91 ARG HA . 11189 1 981 . 1 1 91 91 ARG HB2 H 1 1.659 0.030 . 2 . . . . 91 ARG HB2 . 11189 1 982 . 1 1 91 91 ARG HB3 H 1 1.779 0.030 . 2 . . . . 91 ARG HB3 . 11189 1 983 . 1 1 91 91 ARG HD2 H 1 3.123 0.030 . 1 . . . . 91 ARG HD2 . 11189 1 984 . 1 1 91 91 ARG HD3 H 1 3.123 0.030 . 1 . . . . 91 ARG HD3 . 11189 1 985 . 1 1 91 91 ARG HG2 H 1 1.338 0.030 . 2 . . . . 91 ARG HG2 . 11189 1 986 . 1 1 91 91 ARG HG3 H 1 1.456 0.030 . 2 . . . . 91 ARG HG3 . 11189 1 987 . 1 1 91 91 ARG C C 13 175.680 0.300 . 1 . . . . 91 ARG C . 11189 1 988 . 1 1 91 91 ARG CA C 13 54.773 0.300 . 1 . . . . 91 ARG CA . 11189 1 989 . 1 1 91 91 ARG CB C 13 31.384 0.300 . 1 . . . . 91 ARG CB . 11189 1 990 . 1 1 91 91 ARG CD C 13 43.178 0.300 . 1 . . . . 91 ARG CD . 11189 1 991 . 1 1 91 91 ARG CG C 13 27.797 0.300 . 1 . . . . 91 ARG CG . 11189 1 992 . 1 1 91 91 ARG N N 15 127.592 0.300 . 1 . . . . 91 ARG N . 11189 1 993 . 1 1 92 92 MET H H 1 9.391 0.030 . 1 . . . . 92 MET H . 11189 1 994 . 1 1 92 92 MET HA H 1 5.308 0.030 . 1 . . . . 92 MET HA . 11189 1 995 . 1 1 92 92 MET HB2 H 1 1.811 0.030 . 2 . . . . 92 MET HB2 . 11189 1 996 . 1 1 92 92 MET HB3 H 1 1.938 0.030 . 2 . . . . 92 MET HB3 . 11189 1 997 . 1 1 92 92 MET HE1 H 1 1.630 0.030 . 1 . . . . 92 MET HE . 11189 1 998 . 1 1 92 92 MET HE2 H 1 1.630 0.030 . 1 . . . . 92 MET HE . 11189 1 999 . 1 1 92 92 MET HE3 H 1 1.630 0.030 . 1 . . . . 92 MET HE . 11189 1 1000 . 1 1 92 92 MET HG2 H 1 2.325 0.030 . 1 . . . . 92 MET HG2 . 11189 1 1001 . 1 1 92 92 MET HG3 H 1 2.325 0.030 . 1 . . . . 92 MET HG3 . 11189 1 1002 . 1 1 92 92 MET C C 13 173.354 0.300 . 1 . . . . 92 MET C . 11189 1 1003 . 1 1 92 92 MET CA C 13 53.831 0.300 . 1 . . . . 92 MET CA . 11189 1 1004 . 1 1 92 92 MET CB C 13 37.394 0.300 . 1 . . . . 92 MET CB . 11189 1 1005 . 1 1 92 92 MET CE C 13 16.332 0.300 . 1 . . . . 92 MET CE . 11189 1 1006 . 1 1 92 92 MET CG C 13 31.940 0.300 . 1 . . . . 92 MET CG . 11189 1 1007 . 1 1 92 92 MET N N 15 125.081 0.300 . 1 . . . . 92 MET N . 11189 1 1008 . 1 1 93 93 LEU H H 1 8.439 0.030 . 1 . . . . 93 LEU H . 11189 1 1009 . 1 1 93 93 LEU HA H 1 4.941 0.030 . 1 . . . . 93 LEU HA . 11189 1 1010 . 1 1 93 93 LEU HB2 H 1 1.686 0.030 . 2 . . . . 93 LEU HB2 . 11189 1 1011 . 1 1 93 93 LEU HB3 H 1 1.415 0.030 . 2 . . . . 93 LEU HB3 . 11189 1 1012 . 1 1 93 93 LEU HD11 H 1 0.789 0.030 . 1 . . . . 93 LEU HD1 . 11189 1 1013 . 1 1 93 93 LEU HD12 H 1 0.789 0.030 . 1 . . . . 93 LEU HD1 . 11189 1 1014 . 1 1 93 93 LEU HD13 H 1 0.789 0.030 . 1 . . . . 93 LEU HD1 . 11189 1 1015 . 1 1 93 93 LEU HD21 H 1 0.776 0.030 . 1 . . . . 93 LEU HD2 . 11189 1 1016 . 1 1 93 93 LEU HD22 H 1 0.776 0.030 . 1 . . . . 93 LEU HD2 . 11189 1 1017 . 1 1 93 93 LEU HD23 H 1 0.776 0.030 . 1 . . . . 93 LEU HD2 . 11189 1 1018 . 1 1 93 93 LEU HG H 1 1.257 0.030 . 1 . . . . 93 LEU HG . 11189 1 1019 . 1 1 93 93 LEU C C 13 175.054 0.300 . 1 . . . . 93 LEU C . 11189 1 1020 . 1 1 93 93 LEU CA C 13 54.002 0.300 . 1 . . . . 93 LEU CA . 11189 1 1021 . 1 1 93 93 LEU CB C 13 44.352 0.300 . 1 . . . . 93 LEU CB . 11189 1 1022 . 1 1 93 93 LEU CD1 C 13 25.410 0.300 . 2 . . . . 93 LEU CD1 . 11189 1 1023 . 1 1 93 93 LEU CD2 C 13 23.403 0.300 . 2 . . . . 93 LEU CD2 . 11189 1 1024 . 1 1 93 93 LEU CG C 13 26.965 0.300 . 1 . . . . 93 LEU CG . 11189 1 1025 . 1 1 93 93 LEU N N 15 125.169 0.300 . 1 . . . . 93 LEU N . 11189 1 1026 . 1 1 94 94 VAL H H 1 9.023 0.030 . 1 . . . . 94 VAL H . 11189 1 1027 . 1 1 94 94 VAL HA H 1 5.106 0.030 . 1 . . . . 94 VAL HA . 11189 1 1028 . 1 1 94 94 VAL HB H 1 1.930 0.030 . 1 . . . . 94 VAL HB . 11189 1 1029 . 1 1 94 94 VAL HG11 H 1 0.706 0.030 . 1 . . . . 94 VAL HG1 . 11189 1 1030 . 1 1 94 94 VAL HG12 H 1 0.706 0.030 . 1 . . . . 94 VAL HG1 . 11189 1 1031 . 1 1 94 94 VAL HG13 H 1 0.706 0.030 . 1 . . . . 94 VAL HG1 . 11189 1 1032 . 1 1 94 94 VAL HG21 H 1 0.689 0.030 . 1 . . . . 94 VAL HG2 . 11189 1 1033 . 1 1 94 94 VAL HG22 H 1 0.689 0.030 . 1 . . . . 94 VAL HG2 . 11189 1 1034 . 1 1 94 94 VAL HG23 H 1 0.689 0.030 . 1 . . . . 94 VAL HG2 . 11189 1 1035 . 1 1 94 94 VAL C C 13 172.981 0.300 . 1 . . . . 94 VAL C . 11189 1 1036 . 1 1 94 94 VAL CA C 13 59.308 0.300 . 1 . . . . 94 VAL CA . 11189 1 1037 . 1 1 94 94 VAL CB C 13 34.642 0.300 . 1 . . . . 94 VAL CB . 11189 1 1038 . 1 1 94 94 VAL CG1 C 13 21.504 0.300 . 2 . . . . 94 VAL CG1 . 11189 1 1039 . 1 1 94 94 VAL CG2 C 13 19.109 0.300 . 2 . . . . 94 VAL CG2 . 11189 1 1040 . 1 1 94 94 VAL N N 15 123.416 0.300 . 1 . . . . 94 VAL N . 11189 1 1041 . 1 1 95 95 ALA H H 1 8.856 0.030 . 1 . . . . 95 ALA H . 11189 1 1042 . 1 1 95 95 ALA HA H 1 5.268 0.030 . 1 . . . . 95 ALA HA . 11189 1 1043 . 1 1 95 95 ALA HB1 H 1 0.333 0.030 . 1 . . . . 95 ALA HB . 11189 1 1044 . 1 1 95 95 ALA HB2 H 1 0.333 0.030 . 1 . . . . 95 ALA HB . 11189 1 1045 . 1 1 95 95 ALA HB3 H 1 0.333 0.030 . 1 . . . . 95 ALA HB . 11189 1 1046 . 1 1 95 95 ALA C C 13 175.164 0.300 . 1 . . . . 95 ALA C . 11189 1 1047 . 1 1 95 95 ALA CA C 13 49.695 0.300 . 1 . . . . 95 ALA CA . 11189 1 1048 . 1 1 95 95 ALA CB C 13 23.418 0.300 . 1 . . . . 95 ALA CB . 11189 1 1049 . 1 1 95 95 ALA N N 15 123.969 0.300 . 1 . . . . 95 ALA N . 11189 1 1050 . 1 1 96 96 ARG H H 1 8.725 0.030 . 1 . . . . 96 ARG H . 11189 1 1051 . 1 1 96 96 ARG HA H 1 4.972 0.030 . 1 . . . . 96 ARG HA . 11189 1 1052 . 1 1 96 96 ARG HB2 H 1 1.717 0.030 . 2 . . . . 96 ARG HB2 . 11189 1 1053 . 1 1 96 96 ARG HB3 H 1 2.165 0.030 . 2 . . . . 96 ARG HB3 . 11189 1 1054 . 1 1 96 96 ARG HD2 H 1 2.930 0.030 . 2 . . . . 96 ARG HD2 . 11189 1 1055 . 1 1 96 96 ARG HD3 H 1 3.066 0.030 . 2 . . . . 96 ARG HD3 . 11189 1 1056 . 1 1 96 96 ARG HE H 1 9.278 0.030 . 1 . . . . 96 ARG HE . 11189 1 1057 . 1 1 96 96 ARG HG2 H 1 1.474 0.030 . 1 . . . . 96 ARG HG2 . 11189 1 1058 . 1 1 96 96 ARG HG3 H 1 1.474 0.030 . 1 . . . . 96 ARG HG3 . 11189 1 1059 . 1 1 96 96 ARG C C 13 174.846 0.300 . 1 . . . . 96 ARG C . 11189 1 1060 . 1 1 96 96 ARG CA C 13 54.497 0.300 . 1 . . . . 96 ARG CA . 11189 1 1061 . 1 1 96 96 ARG CB C 13 33.827 0.300 . 1 . . . . 96 ARG CB . 11189 1 1062 . 1 1 96 96 ARG CD C 13 42.577 0.300 . 1 . . . . 96 ARG CD . 11189 1 1063 . 1 1 96 96 ARG CG C 13 27.043 0.300 . 1 . . . . 96 ARG CG . 11189 1 1064 . 1 1 96 96 ARG N N 15 117.212 0.300 . 1 . . . . 96 ARG N . 11189 1 1065 . 1 1 96 96 ARG NE N 15 86.095 0.300 . 1 . . . . 96 ARG NE . 11189 1 1066 . 1 1 97 97 ASP H H 1 8.976 0.030 . 1 . . . . 97 ASP H . 11189 1 1067 . 1 1 97 97 ASP HA H 1 4.835 0.030 . 1 . . . . 97 ASP HA . 11189 1 1068 . 1 1 97 97 ASP HB2 H 1 2.851 0.030 . 2 . . . . 97 ASP HB2 . 11189 1 1069 . 1 1 97 97 ASP HB3 H 1 2.913 0.030 . 2 . . . . 97 ASP HB3 . 11189 1 1070 . 1 1 97 97 ASP C C 13 173.902 0.300 . 1 . . . . 97 ASP C . 11189 1 1071 . 1 1 97 97 ASP CA C 13 53.594 0.300 . 1 . . . . 97 ASP CA . 11189 1 1072 . 1 1 97 97 ASP CB C 13 39.867 0.300 . 1 . . . . 97 ASP CB . 11189 1 1073 . 1 1 97 97 ASP N N 15 118.006 0.300 . 1 . . . . 97 ASP N . 11189 1 1074 . 1 1 98 98 PRO HA H 1 4.285 0.030 . 1 . . . . 98 PRO HA . 11189 1 1075 . 1 1 98 98 PRO HB2 H 1 1.755 0.030 . 1 . . . . 98 PRO HB2 . 11189 1 1076 . 1 1 98 98 PRO HB3 H 1 1.755 0.030 . 1 . . . . 98 PRO HB3 . 11189 1 1077 . 1 1 98 98 PRO HD2 H 1 3.899 0.030 . 1 . . . . 98 PRO HD2 . 11189 1 1078 . 1 1 98 98 PRO HD3 H 1 3.899 0.030 . 1 . . . . 98 PRO HD3 . 11189 1 1079 . 1 1 98 98 PRO HG2 H 1 1.947 0.030 . 2 . . . . 98 PRO HG2 . 11189 1 1080 . 1 1 98 98 PRO HG3 H 1 2.060 0.030 . 2 . . . . 98 PRO HG3 . 11189 1 1081 . 1 1 98 98 PRO C C 13 176.700 0.300 . 1 . . . . 98 PRO C . 11189 1 1082 . 1 1 98 98 PRO CA C 13 63.224 0.300 . 1 . . . . 98 PRO CA . 11189 1 1083 . 1 1 98 98 PRO CB C 13 31.487 0.300 . 1 . . . . 98 PRO CB . 11189 1 1084 . 1 1 98 98 PRO CD C 13 50.642 0.300 . 1 . . . . 98 PRO CD . 11189 1 1085 . 1 1 98 98 PRO CG C 13 26.992 0.300 . 1 . . . . 98 PRO CG . 11189 1 1086 . 1 1 99 99 ALA H H 1 8.195 0.030 . 1 . . . . 99 ALA H . 11189 1 1087 . 1 1 99 99 ALA HA H 1 4.311 0.030 . 1 . . . . 99 ALA HA . 11189 1 1088 . 1 1 99 99 ALA HB1 H 1 1.325 0.030 . 1 . . . . 99 ALA HB . 11189 1 1089 . 1 1 99 99 ALA HB2 H 1 1.325 0.030 . 1 . . . . 99 ALA HB . 11189 1 1090 . 1 1 99 99 ALA HB3 H 1 1.325 0.030 . 1 . . . . 99 ALA HB . 11189 1 1091 . 1 1 99 99 ALA C C 13 177.841 0.300 . 1 . . . . 99 ALA C . 11189 1 1092 . 1 1 99 99 ALA CA C 13 52.171 0.300 . 1 . . . . 99 ALA CA . 11189 1 1093 . 1 1 99 99 ALA CB C 13 19.238 0.300 . 1 . . . . 99 ALA CB . 11189 1 1094 . 1 1 99 99 ALA N N 15 124.404 0.300 . 1 . . . . 99 ALA N . 11189 1 1095 . 1 1 100 100 GLY H H 1 8.165 0.030 . 1 . . . . 100 GLY H . 11189 1 1096 . 1 1 100 100 GLY HA2 H 1 3.891 0.030 . 1 . . . . 100 GLY HA2 . 11189 1 1097 . 1 1 100 100 GLY HA3 H 1 3.891 0.030 . 1 . . . . 100 GLY HA3 . 11189 1 1098 . 1 1 100 100 GLY C C 13 173.376 0.300 . 1 . . . . 100 GLY C . 11189 1 1099 . 1 1 100 100 GLY CA C 13 44.629 0.300 . 1 . . . . 100 GLY CA . 11189 1 1100 . 1 1 100 100 GLY N N 15 107.749 0.300 . 1 . . . . 100 GLY N . 11189 1 1101 . 1 1 101 101 ASP H H 1 8.190 0.030 . 1 . . . . 101 ASP H . 11189 1 1102 . 1 1 101 101 ASP HA H 1 4.622 0.030 . 1 . . . . 101 ASP HA . 11189 1 1103 . 1 1 101 101 ASP HB2 H 1 2.570 0.030 . 2 . . . . 101 ASP HB2 . 11189 1 1104 . 1 1 101 101 ASP HB3 H 1 2.688 0.030 . 2 . . . . 101 ASP HB3 . 11189 1 1105 . 1 1 101 101 ASP C C 13 176.327 0.300 . 1 . . . . 101 ASP C . 11189 1 1106 . 1 1 101 101 ASP CA C 13 53.945 0.300 . 1 . . . . 101 ASP CA . 11189 1 1107 . 1 1 101 101 ASP CB C 13 41.121 0.300 . 1 . . . . 101 ASP CB . 11189 1 1108 . 1 1 101 101 ASP N N 15 120.342 0.300 . 1 . . . . 101 ASP N . 11189 1 1109 . 1 1 102 102 ILE H H 1 8.101 0.030 . 1 . . . . 102 ILE H . 11189 1 1110 . 1 1 102 102 ILE HA H 1 4.210 0.030 . 1 . . . . 102 ILE HA . 11189 1 1111 . 1 1 102 102 ILE HB H 1 1.899 0.030 . 1 . . . . 102 ILE HB . 11189 1 1112 . 1 1 102 102 ILE HD11 H 1 0.825 0.030 . 1 . . . . 102 ILE HD1 . 11189 1 1113 . 1 1 102 102 ILE HD12 H 1 0.825 0.030 . 1 . . . . 102 ILE HD1 . 11189 1 1114 . 1 1 102 102 ILE HD13 H 1 0.825 0.030 . 1 . . . . 102 ILE HD1 . 11189 1 1115 . 1 1 102 102 ILE HG12 H 1 1.167 0.030 . 2 . . . . 102 ILE HG12 . 11189 1 1116 . 1 1 102 102 ILE HG13 H 1 1.404 0.030 . 2 . . . . 102 ILE HG13 . 11189 1 1117 . 1 1 102 102 ILE HG21 H 1 0.869 0.030 . 1 . . . . 102 ILE HG2 . 11189 1 1118 . 1 1 102 102 ILE HG22 H 1 0.869 0.030 . 1 . . . . 102 ILE HG2 . 11189 1 1119 . 1 1 102 102 ILE HG23 H 1 0.869 0.030 . 1 . . . . 102 ILE HG2 . 11189 1 1120 . 1 1 102 102 ILE C C 13 176.206 0.300 . 1 . . . . 102 ILE C . 11189 1 1121 . 1 1 102 102 ILE CA C 13 61.144 0.300 . 1 . . . . 102 ILE CA . 11189 1 1122 . 1 1 102 102 ILE CB C 13 38.481 0.300 . 1 . . . . 102 ILE CB . 11189 1 1123 . 1 1 102 102 ILE CD1 C 13 13.167 0.300 . 1 . . . . 102 ILE CD1 . 11189 1 1124 . 1 1 102 102 ILE CG1 C 13 26.916 0.300 . 1 . . . . 102 ILE CG1 . 11189 1 1125 . 1 1 102 102 ILE CG2 C 13 17.542 0.300 . 1 . . . . 102 ILE CG2 . 11189 1 1126 . 1 1 102 102 ILE N N 15 120.829 0.300 . 1 . . . . 102 ILE N . 11189 1 1127 . 1 1 103 103 SER H H 1 8.418 0.030 . 1 . . . . 103 SER H . 11189 1 1128 . 1 1 103 103 SER HA H 1 4.460 0.030 . 1 . . . . 103 SER HA . 11189 1 1129 . 1 1 103 103 SER HB2 H 1 3.856 0.030 . 1 . . . . 103 SER HB2 . 11189 1 1130 . 1 1 103 103 SER HB3 H 1 3.856 0.030 . 1 . . . . 103 SER HB3 . 11189 1 1131 . 1 1 103 103 SER C C 13 174.495 0.300 . 1 . . . . 103 SER C . 11189 1 1132 . 1 1 103 103 SER CA C 13 58.403 0.300 . 1 . . . . 103 SER CA . 11189 1 1133 . 1 1 103 103 SER CB C 13 63.680 0.300 . 1 . . . . 103 SER CB . 11189 1 1134 . 1 1 103 103 SER N N 15 119.576 0.300 . 1 . . . . 103 SER N . 11189 1 1135 . 1 1 104 104 VAL H H 1 8.101 0.030 . 1 . . . . 104 VAL H . 11189 1 1136 . 1 1 104 104 VAL HA H 1 4.236 0.030 . 1 . . . . 104 VAL HA . 11189 1 1137 . 1 1 104 104 VAL HB H 1 2.142 0.030 . 1 . . . . 104 VAL HB . 11189 1 1138 . 1 1 104 104 VAL HG11 H 1 0.927 0.030 . 1 . . . . 104 VAL HG1 . 11189 1 1139 . 1 1 104 104 VAL HG12 H 1 0.927 0.030 . 1 . . . . 104 VAL HG1 . 11189 1 1140 . 1 1 104 104 VAL HG13 H 1 0.927 0.030 . 1 . . . . 104 VAL HG1 . 11189 1 1141 . 1 1 104 104 VAL HG21 H 1 0.937 0.030 . 1 . . . . 104 VAL HG2 . 11189 1 1142 . 1 1 104 104 VAL HG22 H 1 0.937 0.030 . 1 . . . . 104 VAL HG2 . 11189 1 1143 . 1 1 104 104 VAL HG23 H 1 0.937 0.030 . 1 . . . . 104 VAL HG2 . 11189 1 1144 . 1 1 104 104 VAL C C 13 176.283 0.300 . 1 . . . . 104 VAL C . 11189 1 1145 . 1 1 104 104 VAL CA C 13 62.191 0.300 . 1 . . . . 104 VAL CA . 11189 1 1146 . 1 1 104 104 VAL CB C 13 32.543 0.300 . 1 . . . . 104 VAL CB . 11189 1 1147 . 1 1 104 104 VAL CG1 C 13 21.055 0.300 . 2 . . . . 104 VAL CG1 . 11189 1 1148 . 1 1 104 104 VAL CG2 C 13 20.246 0.300 . 2 . . . . 104 VAL CG2 . 11189 1 1149 . 1 1 104 104 VAL N N 15 121.531 0.300 . 1 . . . . 104 VAL N . 11189 1 1150 . 1 1 105 105 THR H H 1 8.202 0.030 . 1 . . . . 105 THR H . 11189 1 1151 . 1 1 105 105 THR HA H 1 4.436 0.030 . 1 . . . . 105 THR HA . 11189 1 1152 . 1 1 105 105 THR HB H 1 4.256 0.030 . 1 . . . . 105 THR HB . 11189 1 1153 . 1 1 105 105 THR HG21 H 1 1.197 0.030 . 1 . . . . 105 THR HG2 . 11189 1 1154 . 1 1 105 105 THR HG22 H 1 1.197 0.030 . 1 . . . . 105 THR HG2 . 11189 1 1155 . 1 1 105 105 THR HG23 H 1 1.197 0.030 . 1 . . . . 105 THR HG2 . 11189 1 1156 . 1 1 105 105 THR C C 13 174.363 0.300 . 1 . . . . 105 THR C . 11189 1 1157 . 1 1 105 105 THR CA C 13 61.304 0.300 . 1 . . . . 105 THR CA . 11189 1 1158 . 1 1 105 105 THR CB C 13 69.685 0.300 . 1 . . . . 105 THR CB . 11189 1 1159 . 1 1 105 105 THR CG2 C 13 21.342 0.300 . 1 . . . . 105 THR CG2 . 11189 1 1160 . 1 1 105 105 THR N N 15 116.873 0.300 . 1 . . . . 105 THR N . 11189 1 1161 . 1 1 106 106 SER H H 1 8.278 0.030 . 1 . . . . 106 SER H . 11189 1 1162 . 1 1 106 106 SER HA H 1 3.896 0.030 . 1 . . . . 106 SER HA . 11189 1 1163 . 1 1 106 106 SER HB2 H 1 4.543 0.030 . 1 . . . . 106 SER HB2 . 11189 1 1164 . 1 1 106 106 SER HB3 H 1 4.543 0.030 . 1 . . . . 106 SER HB3 . 11189 1 1165 . 1 1 106 106 SER C C 13 174.264 0.300 . 1 . . . . 106 SER C . 11189 1 1166 . 1 1 106 106 SER CA C 13 58.024 0.300 . 1 . . . . 106 SER CA . 11189 1 1167 . 1 1 106 106 SER CB C 13 63.850 0.300 . 1 . . . . 106 SER CB . 11189 1 1168 . 1 1 106 106 SER N N 15 118.017 0.300 . 1 . . . . 106 SER N . 11189 1 1169 . 1 1 107 107 GLY H H 1 8.259 0.030 . 1 . . . . 107 GLY H . 11189 1 1170 . 1 1 107 107 GLY HA2 H 1 4.141 0.030 . 1 . . . . 107 GLY HA2 . 11189 1 1171 . 1 1 107 107 GLY HA3 H 1 4.141 0.030 . 1 . . . . 107 GLY HA3 . 11189 1 1172 . 1 1 107 107 GLY C C 13 171.829 0.300 . 1 . . . . 107 GLY C . 11189 1 1173 . 1 1 107 107 GLY CA C 13 44.330 0.300 . 1 . . . . 107 GLY CA . 11189 1 1174 . 1 1 107 107 GLY N N 15 110.593 0.300 . 1 . . . . 107 GLY N . 11189 1 1175 . 1 1 108 108 PRO HA H 1 4.489 0.030 . 1 . . . . 108 PRO HA . 11189 1 1176 . 1 1 108 108 PRO HB2 H 1 1.982 0.030 . 2 . . . . 108 PRO HB2 . 11189 1 1177 . 1 1 108 108 PRO HB3 H 1 2.307 0.030 . 2 . . . . 108 PRO HB3 . 11189 1 1178 . 1 1 108 108 PRO C C 13 177.216 0.300 . 1 . . . . 108 PRO C . 11189 1 1179 . 1 1 108 108 PRO CA C 13 63.016 0.300 . 1 . . . . 108 PRO CA . 11189 1 1180 . 1 1 108 108 PRO CB C 13 31.832 0.300 . 1 . . . . 108 PRO CB . 11189 1 1181 . 1 1 108 108 PRO CD C 13 49.605 0.300 . 1 . . . . 108 PRO CD . 11189 1 1182 . 1 1 108 108 PRO CG C 13 26.758 0.300 . 1 . . . . 108 PRO CG . 11189 1 1183 . 1 1 109 109 SER H H 1 8.525 0.030 . 1 . . . . 109 SER H . 11189 1 1184 . 1 1 109 109 SER HA H 1 3.910 0.030 . 1 . . . . 109 SER HA . 11189 1 1185 . 1 1 109 109 SER HB2 H 1 3.910 0.030 . 2 . . . . 109 SER HB2 . 11189 1 1186 . 1 1 109 109 SER HB3 H 1 4.521 0.030 . 2 . . . . 109 SER HB3 . 11189 1 1187 . 1 1 109 109 SER C C 13 174.506 0.300 . 1 . . . . 109 SER C . 11189 1 1188 . 1 1 109 109 SER CA C 13 58.081 0.300 . 1 . . . . 109 SER CA . 11189 1 1189 . 1 1 109 109 SER CB C 13 63.640 0.300 . 1 . . . . 109 SER CB . 11189 1 1190 . 1 1 109 109 SER N N 15 116.309 0.300 . 1 . . . . 109 SER N . 11189 1 1191 . 1 1 110 110 SER H H 1 8.331 0.030 . 1 . . . . 110 SER H . 11189 1 1192 . 1 1 110 110 SER C C 13 173.782 0.300 . 1 . . . . 110 SER C . 11189 1 1193 . 1 1 110 110 SER CA C 13 57.812 0.300 . 1 . . . . 110 SER CA . 11189 1 1194 . 1 1 110 110 SER CB C 13 63.570 0.300 . 1 . . . . 110 SER CB . 11189 1 1195 . 1 1 110 110 SER N N 15 117.750 0.300 . 1 . . . . 110 SER N . 11189 1 stop_ save_