data_10258 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10258 _Entry.Title ; Solution structures of the fn3 domain of human ephrin type-B receptor 1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-11-21 _Entry.Accession_date 2008-11-21 _Entry.Last_release_date 2009-11-24 _Entry.Original_release_date 2009-11-24 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.120 _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 M. Sato . . . 10258 2 N. Tochio . . . 10258 3 S. Koshiba . . . 10258 4 M. Inoue . . . 10258 5 T. Kigawa . . . 10258 6 S. Yokoyama . . . 10258 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'Protein 3000 Project' 'Protein Research Group, RIKEN Genomic Sciences Center' 'RIKEN GSC' 10258 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10258 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 450 10258 '15N chemical shifts' 108 10258 '1H chemical shifts' 706 10258 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 . . 2009-11-24 2008-11-21 original author . 10258 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DJS 'BMRB Entry Tracking System' 10258 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10258 _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 structures of the fn3 domain of human ephrin type-B receptor 1' _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 M. Sato . . . 10258 1 2 N. Tochio . . . 10258 1 3 S. Koshiba . . . 10258 1 4 M. Inoue . . . 10258 1 5 T. Kigawa . . . 10258 1 6 S. Yokoyama . . . 10258 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10258 _Assembly.ID 1 _Assembly.Name 'Ephrin type-B receptor 1' _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 'Fibronectin type III domain' 1 $entity_1 . . yes native no no . . . 10258 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 2DJS . . . . . . 10258 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10258 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Fibronectin type III domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGPSTVPIMHQVSAT MRSITLSWPQPEQPNGIILD YEIRYYEKEHNEFNSSMARS QTNTARIDGLRPGMVYVVQV RARTVAGYGKFSGKMCFQTL TDSGPSSG ; _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 108 _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 2015-11-26 loop_ _Entity_db_link.Ordinal _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 1 no PDB 2DJS . "Solution Structures Of The Fn3 Domain Of Human Ephrin Type- B Receptor 1" . . . . . 100.00 108 100.00 100.00 4.67e-73 . . . . 10258 1 2 no DBJ BAG53024 . "unnamed protein product [Homo sapiens]" . . . . . 83.33 545 98.89 98.89 1.28e-55 . . . . 10258 1 3 no REF XP_004321818 . "PREDICTED: ephrin type-B receptor 1-like [Tursiops truncatus]" . . . . . 83.33 545 98.89 98.89 1.22e-55 . . . . 10258 1 4 no REF XP_006883431 . "PREDICTED: ephrin type-B receptor 1-like [Elephantulus edwardii]" . . . . . 83.33 545 98.89 98.89 1.26e-55 . . . . 10258 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 . 10258 1 2 . SER . 10258 1 3 . SER . 10258 1 4 . GLY . 10258 1 5 . SER . 10258 1 6 . SER . 10258 1 7 . GLY . 10258 1 8 . PRO . 10258 1 9 . SER . 10258 1 10 . THR . 10258 1 11 . VAL . 10258 1 12 . PRO . 10258 1 13 . ILE . 10258 1 14 . MET . 10258 1 15 . HIS . 10258 1 16 . GLN . 10258 1 17 . VAL . 10258 1 18 . SER . 10258 1 19 . ALA . 10258 1 20 . THR . 10258 1 21 . MET . 10258 1 22 . ARG . 10258 1 23 . SER . 10258 1 24 . ILE . 10258 1 25 . THR . 10258 1 26 . LEU . 10258 1 27 . SER . 10258 1 28 . TRP . 10258 1 29 . PRO . 10258 1 30 . GLN . 10258 1 31 . PRO . 10258 1 32 . GLU . 10258 1 33 . GLN . 10258 1 34 . PRO . 10258 1 35 . ASN . 10258 1 36 . GLY . 10258 1 37 . ILE . 10258 1 38 . ILE . 10258 1 39 . LEU . 10258 1 40 . ASP . 10258 1 41 . TYR . 10258 1 42 . GLU . 10258 1 43 . ILE . 10258 1 44 . ARG . 10258 1 45 . TYR . 10258 1 46 . TYR . 10258 1 47 . GLU . 10258 1 48 . LYS . 10258 1 49 . GLU . 10258 1 50 . HIS . 10258 1 51 . ASN . 10258 1 52 . GLU . 10258 1 53 . PHE . 10258 1 54 . ASN . 10258 1 55 . SER . 10258 1 56 . SER . 10258 1 57 . MET . 10258 1 58 . ALA . 10258 1 59 . ARG . 10258 1 60 . SER . 10258 1 61 . GLN . 10258 1 62 . THR . 10258 1 63 . ASN . 10258 1 64 . THR . 10258 1 65 . ALA . 10258 1 66 . ARG . 10258 1 67 . ILE . 10258 1 68 . ASP . 10258 1 69 . GLY . 10258 1 70 . LEU . 10258 1 71 . ARG . 10258 1 72 . PRO . 10258 1 73 . GLY . 10258 1 74 . MET . 10258 1 75 . VAL . 10258 1 76 . TYR . 10258 1 77 . VAL . 10258 1 78 . VAL . 10258 1 79 . GLN . 10258 1 80 . VAL . 10258 1 81 . ARG . 10258 1 82 . ALA . 10258 1 83 . ARG . 10258 1 84 . THR . 10258 1 85 . VAL . 10258 1 86 . ALA . 10258 1 87 . GLY . 10258 1 88 . TYR . 10258 1 89 . GLY . 10258 1 90 . LYS . 10258 1 91 . PHE . 10258 1 92 . SER . 10258 1 93 . GLY . 10258 1 94 . LYS . 10258 1 95 . MET . 10258 1 96 . CYS . 10258 1 97 . PHE . 10258 1 98 . GLN . 10258 1 99 . THR . 10258 1 100 . LEU . 10258 1 101 . THR . 10258 1 102 . ASP . 10258 1 103 . SER . 10258 1 104 . GLY . 10258 1 105 . PRO . 10258 1 106 . SER . 10258 1 107 . SER . 10258 1 108 . GLY . 10258 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 10258 1 . SER 2 2 10258 1 . SER 3 3 10258 1 . GLY 4 4 10258 1 . SER 5 5 10258 1 . SER 6 6 10258 1 . GLY 7 7 10258 1 . PRO 8 8 10258 1 . SER 9 9 10258 1 . THR 10 10 10258 1 . VAL 11 11 10258 1 . PRO 12 12 10258 1 . ILE 13 13 10258 1 . MET 14 14 10258 1 . HIS 15 15 10258 1 . GLN 16 16 10258 1 . VAL 17 17 10258 1 . SER 18 18 10258 1 . ALA 19 19 10258 1 . THR 20 20 10258 1 . MET 21 21 10258 1 . ARG 22 22 10258 1 . SER 23 23 10258 1 . ILE 24 24 10258 1 . THR 25 25 10258 1 . LEU 26 26 10258 1 . SER 27 27 10258 1 . TRP 28 28 10258 1 . PRO 29 29 10258 1 . GLN 30 30 10258 1 . PRO 31 31 10258 1 . GLU 32 32 10258 1 . GLN 33 33 10258 1 . PRO 34 34 10258 1 . ASN 35 35 10258 1 . GLY 36 36 10258 1 . ILE 37 37 10258 1 . ILE 38 38 10258 1 . LEU 39 39 10258 1 . ASP 40 40 10258 1 . TYR 41 41 10258 1 . GLU 42 42 10258 1 . ILE 43 43 10258 1 . ARG 44 44 10258 1 . TYR 45 45 10258 1 . TYR 46 46 10258 1 . GLU 47 47 10258 1 . LYS 48 48 10258 1 . GLU 49 49 10258 1 . HIS 50 50 10258 1 . ASN 51 51 10258 1 . GLU 52 52 10258 1 . PHE 53 53 10258 1 . ASN 54 54 10258 1 . SER 55 55 10258 1 . SER 56 56 10258 1 . MET 57 57 10258 1 . ALA 58 58 10258 1 . ARG 59 59 10258 1 . SER 60 60 10258 1 . GLN 61 61 10258 1 . THR 62 62 10258 1 . ASN 63 63 10258 1 . THR 64 64 10258 1 . ALA 65 65 10258 1 . ARG 66 66 10258 1 . ILE 67 67 10258 1 . ASP 68 68 10258 1 . GLY 69 69 10258 1 . LEU 70 70 10258 1 . ARG 71 71 10258 1 . PRO 72 72 10258 1 . GLY 73 73 10258 1 . MET 74 74 10258 1 . VAL 75 75 10258 1 . TYR 76 76 10258 1 . VAL 77 77 10258 1 . VAL 78 78 10258 1 . GLN 79 79 10258 1 . VAL 80 80 10258 1 . ARG 81 81 10258 1 . ALA 82 82 10258 1 . ARG 83 83 10258 1 . THR 84 84 10258 1 . VAL 85 85 10258 1 . ALA 86 86 10258 1 . GLY 87 87 10258 1 . TYR 88 88 10258 1 . GLY 89 89 10258 1 . LYS 90 90 10258 1 . PHE 91 91 10258 1 . SER 92 92 10258 1 . GLY 93 93 10258 1 . LYS 94 94 10258 1 . MET 95 95 10258 1 . CYS 96 96 10258 1 . PHE 97 97 10258 1 . GLN 98 98 10258 1 . THR 99 99 10258 1 . LEU 100 100 10258 1 . THR 101 101 10258 1 . ASP 102 102 10258 1 . SER 103 103 10258 1 . GLY 104 104 10258 1 . PRO 105 105 10258 1 . SER 106 106 10258 1 . SER 107 107 10258 1 . GLY 108 108 10258 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 10258 _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 . . . . . . . . . . . . . . . . . . . . . 10258 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 10258 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'Cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P050912-11 . . . . . . 10258 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10258 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'fn3 domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1 . . mM . . . . 10258 1 2 d-Tris-HCl . . . . . . buffer 20 . . mM . . . . 10258 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10258 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10258 1 5 NaN3 . . . . . . salt 0.02 . . % . . . . 10258 1 6 H2O . . . . . . solvent 90 . . % . . . . 10258 1 7 D2O . . . . . . solvent 10 . . % . . . . 10258 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 10258 _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 10258 1 pH 7.0 0.05 pH 10258 1 pressure 1 0.001 atm 10258 1 temperature 296 0.1 K 10258 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10258 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10258 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10258 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10258 _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.' . . 10258 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10258 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10258 _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.' . . 10258 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10258 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10258 _Software.ID 4 _Software.Name Kujira _Software.Version 0.932 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10258 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10258 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10258 _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 'Guentert, P.' . . 10258 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10258 5 'structure solution' 10258 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 10258 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 10258 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 900 . . . 10258 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 10258 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10258 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10258 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 10258 _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 . . . . . . . . . 10258 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10258 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10258 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 10258 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10258 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10258 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 6 6 SER HA H 1 4.523 0.030 . 1 . . . . 6 SER HA . 10258 1 2 . 1 1 6 6 SER HB2 H 1 3.847 0.030 . 2 . . . . 6 SER HB2 . 10258 1 3 . 1 1 6 6 SER CA C 13 58.535 0.300 . 1 . . . . 6 SER CA . 10258 1 4 . 1 1 6 6 SER CB C 13 64.106 0.300 . 1 . . . . 6 SER CB . 10258 1 5 . 1 1 7 7 GLY H H 1 8.202 0.030 . 1 . . . . 7 GLY H . 10258 1 6 . 1 1 7 7 GLY HA2 H 1 3.881 0.030 . 2 . . . . 7 GLY HA2 . 10258 1 7 . 1 1 7 7 GLY HA3 H 1 3.740 0.030 . 2 . . . . 7 GLY HA3 . 10258 1 8 . 1 1 7 7 GLY CA C 13 44.322 0.300 . 1 . . . . 7 GLY CA . 10258 1 9 . 1 1 7 7 GLY N N 15 109.573 0.300 . 1 . . . . 7 GLY N . 10258 1 10 . 1 1 8 8 PRO HA H 1 4.641 0.030 . 1 . . . . 8 PRO HA . 10258 1 11 . 1 1 8 8 PRO HB2 H 1 2.346 0.030 . 2 . . . . 8 PRO HB2 . 10258 1 12 . 1 1 8 8 PRO HB3 H 1 1.852 0.030 . 2 . . . . 8 PRO HB3 . 10258 1 13 . 1 1 8 8 PRO HD2 H 1 3.514 0.030 . 2 . . . . 8 PRO HD2 . 10258 1 14 . 1 1 8 8 PRO HD3 H 1 3.252 0.030 . 2 . . . . 8 PRO HD3 . 10258 1 15 . 1 1 8 8 PRO HG2 H 1 1.847 0.030 . 2 . . . . 8 PRO HG2 . 10258 1 16 . 1 1 8 8 PRO HG3 H 1 1.799 0.030 . 2 . . . . 8 PRO HG3 . 10258 1 17 . 1 1 8 8 PRO C C 13 176.480 0.300 . 1 . . . . 8 PRO C . 10258 1 18 . 1 1 8 8 PRO CA C 13 62.582 0.300 . 1 . . . . 8 PRO CA . 10258 1 19 . 1 1 8 8 PRO CB C 13 32.331 0.300 . 1 . . . . 8 PRO CB . 10258 1 20 . 1 1 8 8 PRO CD C 13 48.999 0.300 . 1 . . . . 8 PRO CD . 10258 1 21 . 1 1 8 8 PRO CG C 13 27.222 0.300 . 1 . . . . 8 PRO CG . 10258 1 22 . 1 1 9 9 SER H H 1 8.061 0.030 . 1 . . . . 9 SER H . 10258 1 23 . 1 1 9 9 SER HA H 1 4.374 0.030 . 1 . . . . 9 SER HA . 10258 1 24 . 1 1 9 9 SER HB2 H 1 4.351 0.030 . 2 . . . . 9 SER HB2 . 10258 1 25 . 1 1 9 9 SER HB3 H 1 4.052 0.030 . 2 . . . . 9 SER HB3 . 10258 1 26 . 1 1 9 9 SER C C 13 173.090 0.300 . 1 . . . . 9 SER C . 10258 1 27 . 1 1 9 9 SER CA C 13 58.754 0.300 . 1 . . . . 9 SER CA . 10258 1 28 . 1 1 9 9 SER CB C 13 63.667 0.300 . 1 . . . . 9 SER CB . 10258 1 29 . 1 1 9 9 SER N N 15 115.137 0.300 . 1 . . . . 9 SER N . 10258 1 30 . 1 1 10 10 THR H H 1 8.359 0.030 . 1 . . . . 10 THR H . 10258 1 31 . 1 1 10 10 THR HA H 1 4.027 0.030 . 1 . . . . 10 THR HA . 10258 1 32 . 1 1 10 10 THR HB H 1 3.998 0.030 . 1 . . . . 10 THR HB . 10258 1 33 . 1 1 10 10 THR HG21 H 1 1.165 0.030 . 1 . . . . 10 THR HG2 . 10258 1 34 . 1 1 10 10 THR HG22 H 1 1.165 0.030 . 1 . . . . 10 THR HG2 . 10258 1 35 . 1 1 10 10 THR HG23 H 1 1.165 0.030 . 1 . . . . 10 THR HG2 . 10258 1 36 . 1 1 10 10 THR C C 13 175.380 0.300 . 1 . . . . 10 THR C . 10258 1 37 . 1 1 10 10 THR CA C 13 62.781 0.300 . 1 . . . . 10 THR CA . 10258 1 38 . 1 1 10 10 THR CB C 13 69.617 0.300 . 1 . . . . 10 THR CB . 10258 1 39 . 1 1 10 10 THR CG2 C 13 22.166 0.300 . 1 . . . . 10 THR CG2 . 10258 1 40 . 1 1 10 10 THR N N 15 115.079 0.300 . 1 . . . . 10 THR N . 10258 1 41 . 1 1 11 11 VAL H H 1 9.280 0.030 . 1 . . . . 11 VAL H . 10258 1 42 . 1 1 11 11 VAL HA H 1 4.097 0.030 . 1 . . . . 11 VAL HA . 10258 1 43 . 1 1 11 11 VAL HB H 1 1.898 0.030 . 1 . . . . 11 VAL HB . 10258 1 44 . 1 1 11 11 VAL HG11 H 1 1.206 0.030 . 1 . . . . 11 VAL HG1 . 10258 1 45 . 1 1 11 11 VAL HG12 H 1 1.206 0.030 . 1 . . . . 11 VAL HG1 . 10258 1 46 . 1 1 11 11 VAL HG13 H 1 1.206 0.030 . 1 . . . . 11 VAL HG1 . 10258 1 47 . 1 1 11 11 VAL HG21 H 1 1.187 0.030 . 1 . . . . 11 VAL HG2 . 10258 1 48 . 1 1 11 11 VAL HG22 H 1 1.187 0.030 . 1 . . . . 11 VAL HG2 . 10258 1 49 . 1 1 11 11 VAL HG23 H 1 1.187 0.030 . 1 . . . . 11 VAL HG2 . 10258 1 50 . 1 1 11 11 VAL C C 13 175.706 0.300 . 1 . . . . 11 VAL C . 10258 1 51 . 1 1 11 11 VAL CA C 13 61.518 0.300 . 1 . . . . 11 VAL CA . 10258 1 52 . 1 1 11 11 VAL CB C 13 33.174 0.300 . 1 . . . . 11 VAL CB . 10258 1 53 . 1 1 11 11 VAL CG1 C 13 21.318 0.300 . 2 . . . . 11 VAL CG1 . 10258 1 54 . 1 1 11 11 VAL CG2 C 13 21.416 0.300 . 2 . . . . 11 VAL CG2 . 10258 1 55 . 1 1 11 11 VAL N N 15 131.182 0.300 . 1 . . . . 11 VAL N . 10258 1 56 . 1 1 12 12 PRO HA H 1 4.415 0.030 . 1 . . . . 12 PRO HA . 10258 1 57 . 1 1 12 12 PRO HB2 H 1 2.357 0.030 . 2 . . . . 12 PRO HB2 . 10258 1 58 . 1 1 12 12 PRO HB3 H 1 2.016 0.030 . 2 . . . . 12 PRO HB3 . 10258 1 59 . 1 1 12 12 PRO HD2 H 1 4.037 0.030 . 2 . . . . 12 PRO HD2 . 10258 1 60 . 1 1 12 12 PRO HD3 H 1 3.783 0.030 . 2 . . . . 12 PRO HD3 . 10258 1 61 . 1 1 12 12 PRO HG2 H 1 2.207 0.030 . 2 . . . . 12 PRO HG2 . 10258 1 62 . 1 1 12 12 PRO HG3 H 1 2.018 0.030 . 2 . . . . 12 PRO HG3 . 10258 1 63 . 1 1 12 12 PRO C C 13 175.612 0.300 . 1 . . . . 12 PRO C . 10258 1 64 . 1 1 12 12 PRO CA C 13 64.850 0.300 . 1 . . . . 12 PRO CA . 10258 1 65 . 1 1 12 12 PRO CB C 13 32.578 0.300 . 1 . . . . 12 PRO CB . 10258 1 66 . 1 1 12 12 PRO CD C 13 51.791 0.300 . 1 . . . . 12 PRO CD . 10258 1 67 . 1 1 12 12 PRO CG C 13 27.387 0.300 . 1 . . . . 12 PRO CG . 10258 1 68 . 1 1 13 13 ILE H H 1 7.251 0.030 . 1 . . . . 13 ILE H . 10258 1 69 . 1 1 13 13 ILE HA H 1 4.439 0.030 . 1 . . . . 13 ILE HA . 10258 1 70 . 1 1 13 13 ILE HB H 1 1.899 0.030 . 1 . . . . 13 ILE HB . 10258 1 71 . 1 1 13 13 ILE HD11 H 1 0.998 0.030 . 1 . . . . 13 ILE HD1 . 10258 1 72 . 1 1 13 13 ILE HD12 H 1 0.998 0.030 . 1 . . . . 13 ILE HD1 . 10258 1 73 . 1 1 13 13 ILE HD13 H 1 0.998 0.030 . 1 . . . . 13 ILE HD1 . 10258 1 74 . 1 1 13 13 ILE HG12 H 1 1.459 0.030 . 2 . . . . 13 ILE HG12 . 10258 1 75 . 1 1 13 13 ILE HG13 H 1 1.100 0.030 . 2 . . . . 13 ILE HG13 . 10258 1 76 . 1 1 13 13 ILE HG21 H 1 0.644 0.030 . 1 . . . . 13 ILE HG2 . 10258 1 77 . 1 1 13 13 ILE HG22 H 1 0.644 0.030 . 1 . . . . 13 ILE HG2 . 10258 1 78 . 1 1 13 13 ILE HG23 H 1 0.644 0.030 . 1 . . . . 13 ILE HG2 . 10258 1 79 . 1 1 13 13 ILE C C 13 170.969 0.300 . 1 . . . . 13 ILE C . 10258 1 80 . 1 1 13 13 ILE CA C 13 59.973 0.300 . 1 . . . . 13 ILE CA . 10258 1 81 . 1 1 13 13 ILE CB C 13 40.776 0.300 . 1 . . . . 13 ILE CB . 10258 1 82 . 1 1 13 13 ILE CD1 C 13 14.513 0.300 . 1 . . . . 13 ILE CD1 . 10258 1 83 . 1 1 13 13 ILE CG1 C 13 29.068 0.300 . 1 . . . . 13 ILE CG1 . 10258 1 84 . 1 1 13 13 ILE CG2 C 13 16.345 0.300 . 1 . . . . 13 ILE CG2 . 10258 1 85 . 1 1 13 13 ILE N N 15 115.827 0.300 . 1 . . . . 13 ILE N . 10258 1 86 . 1 1 14 14 MET H H 1 6.827 0.030 . 1 . . . . 14 MET H . 10258 1 87 . 1 1 14 14 MET HA H 1 4.961 0.030 . 1 . . . . 14 MET HA . 10258 1 88 . 1 1 14 14 MET HB2 H 1 2.129 0.030 . 2 . . . . 14 MET HB2 . 10258 1 89 . 1 1 14 14 MET HB3 H 1 2.075 0.030 . 2 . . . . 14 MET HB3 . 10258 1 90 . 1 1 14 14 MET HE1 H 1 1.528 0.030 . 1 . . . . 14 MET HE . 10258 1 91 . 1 1 14 14 MET HE2 H 1 1.528 0.030 . 1 . . . . 14 MET HE . 10258 1 92 . 1 1 14 14 MET HE3 H 1 1.528 0.030 . 1 . . . . 14 MET HE . 10258 1 93 . 1 1 14 14 MET HG2 H 1 2.546 0.030 . 2 . . . . 14 MET HG2 . 10258 1 94 . 1 1 14 14 MET HG3 H 1 2.158 0.030 . 2 . . . . 14 MET HG3 . 10258 1 95 . 1 1 14 14 MET C C 13 173.380 0.300 . 1 . . . . 14 MET C . 10258 1 96 . 1 1 14 14 MET CA C 13 55.214 0.300 . 1 . . . . 14 MET CA . 10258 1 97 . 1 1 14 14 MET CB C 13 38.223 0.300 . 1 . . . . 14 MET CB . 10258 1 98 . 1 1 14 14 MET CE C 13 18.735 0.300 . 1 . . . . 14 MET CE . 10258 1 99 . 1 1 14 14 MET CG C 13 32.661 0.300 . 1 . . . . 14 MET CG . 10258 1 100 . 1 1 14 14 MET N N 15 116.754 0.300 . 1 . . . . 14 MET N . 10258 1 101 . 1 1 15 15 HIS H H 1 9.417 0.030 . 1 . . . . 15 HIS H . 10258 1 102 . 1 1 15 15 HIS HA H 1 4.958 0.030 . 1 . . . . 15 HIS HA . 10258 1 103 . 1 1 15 15 HIS HB2 H 1 2.957 0.030 . 2 . . . . 15 HIS HB2 . 10258 1 104 . 1 1 15 15 HIS HB3 H 1 2.888 0.030 . 2 . . . . 15 HIS HB3 . 10258 1 105 . 1 1 15 15 HIS HD2 H 1 6.838 0.030 . 1 . . . . 15 HIS HD2 . 10258 1 106 . 1 1 15 15 HIS HE1 H 1 7.714 0.030 . 1 . . . . 15 HIS HE1 . 10258 1 107 . 1 1 15 15 HIS C C 13 173.901 0.300 . 1 . . . . 15 HIS C . 10258 1 108 . 1 1 15 15 HIS CA C 13 55.190 0.300 . 1 . . . . 15 HIS CA . 10258 1 109 . 1 1 15 15 HIS CB C 13 33.361 0.300 . 1 . . . . 15 HIS CB . 10258 1 110 . 1 1 15 15 HIS CD2 C 13 119.860 0.300 . 1 . . . . 15 HIS CD2 . 10258 1 111 . 1 1 15 15 HIS CE1 C 13 138.130 0.300 . 1 . . . . 15 HIS CE1 . 10258 1 112 . 1 1 15 15 HIS N N 15 118.539 0.300 . 1 . . . . 15 HIS N . 10258 1 113 . 1 1 16 16 GLN H H 1 9.164 0.030 . 1 . . . . 16 GLN H . 10258 1 114 . 1 1 16 16 GLN HA H 1 4.385 0.030 . 1 . . . . 16 GLN HA . 10258 1 115 . 1 1 16 16 GLN HB2 H 1 2.093 0.030 . 1 . . . . 16 GLN HB2 . 10258 1 116 . 1 1 16 16 GLN HB3 H 1 2.093 0.030 . 1 . . . . 16 GLN HB3 . 10258 1 117 . 1 1 16 16 GLN HE21 H 1 7.022 0.030 . 2 . . . . 16 GLN HE21 . 10258 1 118 . 1 1 16 16 GLN HE22 H 1 6.805 0.030 . 2 . . . . 16 GLN HE22 . 10258 1 119 . 1 1 16 16 GLN HG2 H 1 2.106 0.030 . 1 . . . . 16 GLN HG2 . 10258 1 120 . 1 1 16 16 GLN HG3 H 1 2.106 0.030 . 1 . . . . 16 GLN HG3 . 10258 1 121 . 1 1 16 16 GLN C C 13 175.463 0.300 . 1 . . . . 16 GLN C . 10258 1 122 . 1 1 16 16 GLN CA C 13 55.992 0.300 . 1 . . . . 16 GLN CA . 10258 1 123 . 1 1 16 16 GLN CB C 13 29.159 0.300 . 1 . . . . 16 GLN CB . 10258 1 124 . 1 1 16 16 GLN CG C 13 34.367 0.300 . 1 . . . . 16 GLN CG . 10258 1 125 . 1 1 16 16 GLN N N 15 123.267 0.300 . 1 . . . . 16 GLN N . 10258 1 126 . 1 1 16 16 GLN NE2 N 15 109.816 0.300 . 1 . . . . 16 GLN NE2 . 10258 1 127 . 1 1 17 17 VAL H H 1 8.983 0.030 . 1 . . . . 17 VAL H . 10258 1 128 . 1 1 17 17 VAL HA H 1 3.910 0.030 . 1 . . . . 17 VAL HA . 10258 1 129 . 1 1 17 17 VAL HB H 1 1.609 0.030 . 1 . . . . 17 VAL HB . 10258 1 130 . 1 1 17 17 VAL HG11 H 1 0.822 0.030 . 1 . . . . 17 VAL HG1 . 10258 1 131 . 1 1 17 17 VAL HG12 H 1 0.822 0.030 . 1 . . . . 17 VAL HG1 . 10258 1 132 . 1 1 17 17 VAL HG13 H 1 0.822 0.030 . 1 . . . . 17 VAL HG1 . 10258 1 133 . 1 1 17 17 VAL HG21 H 1 0.747 0.030 . 1 . . . . 17 VAL HG2 . 10258 1 134 . 1 1 17 17 VAL HG22 H 1 0.747 0.030 . 1 . . . . 17 VAL HG2 . 10258 1 135 . 1 1 17 17 VAL HG23 H 1 0.747 0.030 . 1 . . . . 17 VAL HG2 . 10258 1 136 . 1 1 17 17 VAL C C 13 176.328 0.300 . 1 . . . . 17 VAL C . 10258 1 137 . 1 1 17 17 VAL CA C 13 63.807 0.300 . 1 . . . . 17 VAL CA . 10258 1 138 . 1 1 17 17 VAL CB C 13 33.088 0.300 . 1 . . . . 17 VAL CB . 10258 1 139 . 1 1 17 17 VAL CG1 C 13 20.720 0.300 . 2 . . . . 17 VAL CG1 . 10258 1 140 . 1 1 17 17 VAL CG2 C 13 21.023 0.300 . 2 . . . . 17 VAL CG2 . 10258 1 141 . 1 1 17 17 VAL N N 15 128.880 0.300 . 1 . . . . 17 VAL N . 10258 1 142 . 1 1 18 18 SER H H 1 7.740 0.030 . 1 . . . . 18 SER H . 10258 1 143 . 1 1 18 18 SER HA H 1 4.589 0.030 . 1 . . . . 18 SER HA . 10258 1 144 . 1 1 18 18 SER HB2 H 1 3.863 0.030 . 2 . . . . 18 SER HB2 . 10258 1 145 . 1 1 18 18 SER HB3 H 1 3.711 0.030 . 2 . . . . 18 SER HB3 . 10258 1 146 . 1 1 18 18 SER C C 13 171.965 0.300 . 1 . . . . 18 SER C . 10258 1 147 . 1 1 18 18 SER CA C 13 57.441 0.300 . 1 . . . . 18 SER CA . 10258 1 148 . 1 1 18 18 SER CB C 13 64.058 0.300 . 1 . . . . 18 SER CB . 10258 1 149 . 1 1 18 18 SER N N 15 110.447 0.300 . 1 . . . . 18 SER N . 10258 1 150 . 1 1 19 19 ALA H H 1 8.114 0.030 . 1 . . . . 19 ALA H . 10258 1 151 . 1 1 19 19 ALA HA H 1 5.086 0.030 . 1 . . . . 19 ALA HA . 10258 1 152 . 1 1 19 19 ALA HB1 H 1 1.590 0.030 . 1 . . . . 19 ALA HB . 10258 1 153 . 1 1 19 19 ALA HB2 H 1 1.590 0.030 . 1 . . . . 19 ALA HB . 10258 1 154 . 1 1 19 19 ALA HB3 H 1 1.590 0.030 . 1 . . . . 19 ALA HB . 10258 1 155 . 1 1 19 19 ALA C C 13 176.404 0.300 . 1 . . . . 19 ALA C . 10258 1 156 . 1 1 19 19 ALA CA C 13 52.453 0.300 . 1 . . . . 19 ALA CA . 10258 1 157 . 1 1 19 19 ALA CB C 13 23.038 0.300 . 1 . . . . 19 ALA CB . 10258 1 158 . 1 1 19 19 ALA N N 15 121.116 0.300 . 1 . . . . 19 ALA N . 10258 1 159 . 1 1 20 20 THR H H 1 8.710 0.030 . 1 . . . . 20 THR H . 10258 1 160 . 1 1 20 20 THR HA H 1 4.787 0.030 . 1 . . . . 20 THR HA . 10258 1 161 . 1 1 20 20 THR HB H 1 4.769 0.030 . 1 . . . . 20 THR HB . 10258 1 162 . 1 1 20 20 THR HG21 H 1 1.126 0.030 . 1 . . . . 20 THR HG2 . 10258 1 163 . 1 1 20 20 THR HG22 H 1 1.126 0.030 . 1 . . . . 20 THR HG2 . 10258 1 164 . 1 1 20 20 THR HG23 H 1 1.126 0.030 . 1 . . . . 20 THR HG2 . 10258 1 165 . 1 1 20 20 THR C C 13 175.596 0.300 . 1 . . . . 20 THR C . 10258 1 166 . 1 1 20 20 THR CA C 13 60.341 0.300 . 1 . . . . 20 THR CA . 10258 1 167 . 1 1 20 20 THR CB C 13 71.307 0.300 . 1 . . . . 20 THR CB . 10258 1 168 . 1 1 20 20 THR CG2 C 13 21.191 0.300 . 1 . . . . 20 THR CG2 . 10258 1 169 . 1 1 20 20 THR N N 15 110.762 0.300 . 1 . . . . 20 THR N . 10258 1 170 . 1 1 21 21 MET H H 1 8.686 0.030 . 1 . . . . 21 MET H . 10258 1 171 . 1 1 21 21 MET HA H 1 4.618 0.030 . 1 . . . . 21 MET HA . 10258 1 172 . 1 1 21 21 MET HB2 H 1 2.104 0.030 . 2 . . . . 21 MET HB2 . 10258 1 173 . 1 1 21 21 MET HB3 H 1 1.980 0.030 . 2 . . . . 21 MET HB3 . 10258 1 174 . 1 1 21 21 MET HE1 H 1 2.120 0.030 . 1 . . . . 21 MET HE . 10258 1 175 . 1 1 21 21 MET HE2 H 1 2.120 0.030 . 1 . . . . 21 MET HE . 10258 1 176 . 1 1 21 21 MET HE3 H 1 2.120 0.030 . 1 . . . . 21 MET HE . 10258 1 177 . 1 1 21 21 MET HG2 H 1 2.563 0.030 . 2 . . . . 21 MET HG2 . 10258 1 178 . 1 1 21 21 MET HG3 H 1 2.381 0.030 . 2 . . . . 21 MET HG3 . 10258 1 179 . 1 1 21 21 MET C C 13 174.754 0.300 . 1 . . . . 21 MET C . 10258 1 180 . 1 1 21 21 MET CA C 13 59.272 0.300 . 1 . . . . 21 MET CA . 10258 1 181 . 1 1 21 21 MET CB C 13 34.488 0.300 . 1 . . . . 21 MET CB . 10258 1 182 . 1 1 21 21 MET CE C 13 16.988 0.300 . 1 . . . . 21 MET CE . 10258 1 183 . 1 1 21 21 MET CG C 13 32.496 0.300 . 1 . . . . 21 MET CG . 10258 1 184 . 1 1 21 21 MET N N 15 118.478 0.300 . 1 . . . . 21 MET N . 10258 1 185 . 1 1 22 22 ARG H H 1 7.296 0.030 . 1 . . . . 22 ARG H . 10258 1 186 . 1 1 22 22 ARG HA H 1 4.453 0.030 . 1 . . . . 22 ARG HA . 10258 1 187 . 1 1 22 22 ARG HB2 H 1 2.132 0.030 . 2 . . . . 22 ARG HB2 . 10258 1 188 . 1 1 22 22 ARG HB3 H 1 1.465 0.030 . 2 . . . . 22 ARG HB3 . 10258 1 189 . 1 1 22 22 ARG HD2 H 1 3.278 0.030 . 2 . . . . 22 ARG HD2 . 10258 1 190 . 1 1 22 22 ARG HD3 H 1 3.178 0.030 . 2 . . . . 22 ARG HD3 . 10258 1 191 . 1 1 22 22 ARG HG2 H 1 1.521 0.030 . 2 . . . . 22 ARG HG2 . 10258 1 192 . 1 1 22 22 ARG HG3 H 1 1.420 0.030 . 2 . . . . 22 ARG HG3 . 10258 1 193 . 1 1 22 22 ARG C C 13 174.722 0.300 . 1 . . . . 22 ARG C . 10258 1 194 . 1 1 22 22 ARG CA C 13 54.218 0.300 . 1 . . . . 22 ARG CA . 10258 1 195 . 1 1 22 22 ARG CB C 13 32.509 0.300 . 1 . . . . 22 ARG CB . 10258 1 196 . 1 1 22 22 ARG CD C 13 43.290 0.300 . 1 . . . . 22 ARG CD . 10258 1 197 . 1 1 22 22 ARG CG C 13 28.169 0.300 . 1 . . . . 22 ARG CG . 10258 1 198 . 1 1 22 22 ARG N N 15 108.176 0.300 . 1 . . . . 22 ARG N . 10258 1 199 . 1 1 23 23 SER H H 1 7.387 0.030 . 1 . . . . 23 SER H . 10258 1 200 . 1 1 23 23 SER HA H 1 5.353 0.030 . 1 . . . . 23 SER HA . 10258 1 201 . 1 1 23 23 SER HB2 H 1 3.733 0.030 . 2 . . . . 23 SER HB2 . 10258 1 202 . 1 1 23 23 SER HB3 H 1 3.572 0.030 . 2 . . . . 23 SER HB3 . 10258 1 203 . 1 1 23 23 SER C C 13 171.910 0.300 . 1 . . . . 23 SER C . 10258 1 204 . 1 1 23 23 SER CA C 13 57.230 0.300 . 1 . . . . 23 SER CA . 10258 1 205 . 1 1 23 23 SER CB C 13 68.011 0.300 . 1 . . . . 23 SER CB . 10258 1 206 . 1 1 23 23 SER N N 15 114.861 0.300 . 1 . . . . 23 SER N . 10258 1 207 . 1 1 24 24 ILE H H 1 8.061 0.030 . 1 . . . . 24 ILE H . 10258 1 208 . 1 1 24 24 ILE HA H 1 4.470 0.030 . 1 . . . . 24 ILE HA . 10258 1 209 . 1 1 24 24 ILE HB H 1 1.178 0.030 . 1 . . . . 24 ILE HB . 10258 1 210 . 1 1 24 24 ILE HD11 H 1 0.495 0.030 . 1 . . . . 24 ILE HD1 . 10258 1 211 . 1 1 24 24 ILE HD12 H 1 0.495 0.030 . 1 . . . . 24 ILE HD1 . 10258 1 212 . 1 1 24 24 ILE HD13 H 1 0.495 0.030 . 1 . . . . 24 ILE HD1 . 10258 1 213 . 1 1 24 24 ILE HG12 H 1 1.236 0.030 . 2 . . . . 24 ILE HG12 . 10258 1 214 . 1 1 24 24 ILE HG13 H 1 0.766 0.030 . 2 . . . . 24 ILE HG13 . 10258 1 215 . 1 1 24 24 ILE HG21 H 1 0.688 0.030 . 1 . . . . 24 ILE HG2 . 10258 1 216 . 1 1 24 24 ILE HG22 H 1 0.688 0.030 . 1 . . . . 24 ILE HG2 . 10258 1 217 . 1 1 24 24 ILE HG23 H 1 0.688 0.030 . 1 . . . . 24 ILE HG2 . 10258 1 218 . 1 1 24 24 ILE C C 13 174.028 0.300 . 1 . . . . 24 ILE C . 10258 1 219 . 1 1 24 24 ILE CA C 13 61.402 0.300 . 1 . . . . 24 ILE CA . 10258 1 220 . 1 1 24 24 ILE CB C 13 43.249 0.300 . 1 . . . . 24 ILE CB . 10258 1 221 . 1 1 24 24 ILE CD1 C 13 13.854 0.300 . 1 . . . . 24 ILE CD1 . 10258 1 222 . 1 1 24 24 ILE CG1 C 13 26.916 0.300 . 1 . . . . 24 ILE CG1 . 10258 1 223 . 1 1 24 24 ILE CG2 C 13 18.021 0.300 . 1 . . . . 24 ILE CG2 . 10258 1 224 . 1 1 24 24 ILE N N 15 116.152 0.300 . 1 . . . . 24 ILE N . 10258 1 225 . 1 1 25 25 THR H H 1 8.584 0.030 . 1 . . . . 25 THR H . 10258 1 226 . 1 1 25 25 THR HA H 1 5.107 0.030 . 1 . . . . 25 THR HA . 10258 1 227 . 1 1 25 25 THR HB H 1 3.863 0.030 . 1 . . . . 25 THR HB . 10258 1 228 . 1 1 25 25 THR HG21 H 1 0.905 0.030 . 1 . . . . 25 THR HG2 . 10258 1 229 . 1 1 25 25 THR HG22 H 1 0.905 0.030 . 1 . . . . 25 THR HG2 . 10258 1 230 . 1 1 25 25 THR HG23 H 1 0.905 0.030 . 1 . . . . 25 THR HG2 . 10258 1 231 . 1 1 25 25 THR C C 13 173.463 0.300 . 1 . . . . 25 THR C . 10258 1 232 . 1 1 25 25 THR CA C 13 62.127 0.300 . 1 . . . . 25 THR CA . 10258 1 233 . 1 1 25 25 THR CB C 13 68.954 0.300 . 1 . . . . 25 THR CB . 10258 1 234 . 1 1 25 25 THR CG2 C 13 20.597 0.300 . 1 . . . . 25 THR CG2 . 10258 1 235 . 1 1 25 25 THR N N 15 122.080 0.300 . 1 . . . . 25 THR N . 10258 1 236 . 1 1 26 26 LEU H H 1 9.093 0.030 . 1 . . . . 26 LEU H . 10258 1 237 . 1 1 26 26 LEU HA H 1 5.427 0.030 . 1 . . . . 26 LEU HA . 10258 1 238 . 1 1 26 26 LEU HB2 H 1 1.678 0.030 . 2 . . . . 26 LEU HB2 . 10258 1 239 . 1 1 26 26 LEU HB3 H 1 1.481 0.030 . 2 . . . . 26 LEU HB3 . 10258 1 240 . 1 1 26 26 LEU HD11 H 1 0.466 0.030 . 1 . . . . 26 LEU HD1 . 10258 1 241 . 1 1 26 26 LEU HD12 H 1 0.466 0.030 . 1 . . . . 26 LEU HD1 . 10258 1 242 . 1 1 26 26 LEU HD13 H 1 0.466 0.030 . 1 . . . . 26 LEU HD1 . 10258 1 243 . 1 1 26 26 LEU HD21 H 1 -0.027 0.030 . 1 . . . . 26 LEU HD2 . 10258 1 244 . 1 1 26 26 LEU HD22 H 1 -0.027 0.030 . 1 . . . . 26 LEU HD2 . 10258 1 245 . 1 1 26 26 LEU HD23 H 1 -0.027 0.030 . 1 . . . . 26 LEU HD2 . 10258 1 246 . 1 1 26 26 LEU HG H 1 1.251 0.030 . 1 . . . . 26 LEU HG . 10258 1 247 . 1 1 26 26 LEU C C 13 175.180 0.300 . 1 . . . . 26 LEU C . 10258 1 248 . 1 1 26 26 LEU CA C 13 53.181 0.300 . 1 . . . . 26 LEU CA . 10258 1 249 . 1 1 26 26 LEU CB C 13 46.902 0.300 . 1 . . . . 26 LEU CB . 10258 1 250 . 1 1 26 26 LEU CD1 C 13 26.810 0.300 . 2 . . . . 26 LEU CD1 . 10258 1 251 . 1 1 26 26 LEU CD2 C 13 23.038 0.300 . 2 . . . . 26 LEU CD2 . 10258 1 252 . 1 1 26 26 LEU CG C 13 27.116 0.300 . 1 . . . . 26 LEU CG . 10258 1 253 . 1 1 26 26 LEU N N 15 128.231 0.300 . 1 . . . . 26 LEU N . 10258 1 254 . 1 1 27 27 SER H H 1 9.260 0.030 . 1 . . . . 27 SER H . 10258 1 255 . 1 1 27 27 SER HA H 1 4.757 0.030 . 1 . . . . 27 SER HA . 10258 1 256 . 1 1 27 27 SER HB2 H 1 3.611 0.030 . 2 . . . . 27 SER HB2 . 10258 1 257 . 1 1 27 27 SER HB3 H 1 3.335 0.030 . 2 . . . . 27 SER HB3 . 10258 1 258 . 1 1 27 27 SER C C 13 172.413 0.300 . 1 . . . . 27 SER C . 10258 1 259 . 1 1 27 27 SER CA C 13 56.912 0.300 . 1 . . . . 27 SER CA . 10258 1 260 . 1 1 27 27 SER CB C 13 66.220 0.300 . 1 . . . . 27 SER CB . 10258 1 261 . 1 1 27 27 SER N N 15 115.325 0.300 . 1 . . . . 27 SER N . 10258 1 262 . 1 1 28 28 TRP H H 1 7.430 0.030 . 1 . . . . 28 TRP H . 10258 1 263 . 1 1 28 28 TRP HA H 1 5.212 0.030 . 1 . . . . 28 TRP HA . 10258 1 264 . 1 1 28 28 TRP HB2 H 1 3.542 0.030 . 2 . . . . 28 TRP HB2 . 10258 1 265 . 1 1 28 28 TRP HB3 H 1 3.335 0.030 . 2 . . . . 28 TRP HB3 . 10258 1 266 . 1 1 28 28 TRP HD1 H 1 6.958 0.030 . 1 . . . . 28 TRP HD1 . 10258 1 267 . 1 1 28 28 TRP HE1 H 1 6.142 0.030 . 1 . . . . 28 TRP HE1 . 10258 1 268 . 1 1 28 28 TRP HE3 H 1 6.791 0.030 . 1 . . . . 28 TRP HE3 . 10258 1 269 . 1 1 28 28 TRP HH2 H 1 6.646 0.030 . 1 . . . . 28 TRP HH2 . 10258 1 270 . 1 1 28 28 TRP HZ2 H 1 6.663 0.030 . 1 . . . . 28 TRP HZ2 . 10258 1 271 . 1 1 28 28 TRP HZ3 H 1 6.446 0.030 . 1 . . . . 28 TRP HZ3 . 10258 1 272 . 1 1 28 28 TRP C C 13 171.555 0.300 . 1 . . . . 28 TRP C . 10258 1 273 . 1 1 28 28 TRP CA C 13 55.143 0.300 . 1 . . . . 28 TRP CA . 10258 1 274 . 1 1 28 28 TRP CB C 13 28.918 0.300 . 1 . . . . 28 TRP CB . 10258 1 275 . 1 1 28 28 TRP CD1 C 13 127.809 0.300 . 1 . . . . 28 TRP CD1 . 10258 1 276 . 1 1 28 28 TRP CE3 C 13 120.031 0.300 . 1 . . . . 28 TRP CE3 . 10258 1 277 . 1 1 28 28 TRP CH2 C 13 123.572 0.300 . 1 . . . . 28 TRP CH2 . 10258 1 278 . 1 1 28 28 TRP CZ2 C 13 114.367 0.300 . 1 . . . . 28 TRP CZ2 . 10258 1 279 . 1 1 28 28 TRP CZ3 C 13 120.540 0.300 . 1 . . . . 28 TRP CZ3 . 10258 1 280 . 1 1 28 28 TRP N N 15 119.703 0.300 . 1 . . . . 28 TRP N . 10258 1 281 . 1 1 28 28 TRP NE1 N 15 124.525 0.300 . 1 . . . . 28 TRP NE1 . 10258 1 282 . 1 1 29 29 PRO HA H 1 4.543 0.030 . 1 . . . . 29 PRO HA . 10258 1 283 . 1 1 29 29 PRO HB2 H 1 2.302 0.030 . 2 . . . . 29 PRO HB2 . 10258 1 284 . 1 1 29 29 PRO HB3 H 1 1.983 0.030 . 2 . . . . 29 PRO HB3 . 10258 1 285 . 1 1 29 29 PRO HD2 H 1 4.140 0.030 . 2 . . . . 29 PRO HD2 . 10258 1 286 . 1 1 29 29 PRO HD3 H 1 3.591 0.030 . 2 . . . . 29 PRO HD3 . 10258 1 287 . 1 1 29 29 PRO HG2 H 1 2.099 0.030 . 1 . . . . 29 PRO HG2 . 10258 1 288 . 1 1 29 29 PRO HG3 H 1 2.099 0.030 . 1 . . . . 29 PRO HG3 . 10258 1 289 . 1 1 29 29 PRO C C 13 175.962 0.300 . 1 . . . . 29 PRO C . 10258 1 290 . 1 1 29 29 PRO CA C 13 61.702 0.300 . 1 . . . . 29 PRO CA . 10258 1 291 . 1 1 29 29 PRO CB C 13 32.041 0.300 . 1 . . . . 29 PRO CB . 10258 1 292 . 1 1 29 29 PRO CD C 13 50.460 0.300 . 1 . . . . 29 PRO CD . 10258 1 293 . 1 1 29 29 PRO CG C 13 27.552 0.300 . 1 . . . . 29 PRO CG . 10258 1 294 . 1 1 30 30 GLN H H 1 8.248 0.030 . 1 . . . . 30 GLN H . 10258 1 295 . 1 1 30 30 GLN HA H 1 4.654 0.030 . 1 . . . . 30 GLN HA . 10258 1 296 . 1 1 30 30 GLN HB2 H 1 2.025 0.030 . 2 . . . . 30 GLN HB2 . 10258 1 297 . 1 1 30 30 GLN HB3 H 1 1.975 0.030 . 2 . . . . 30 GLN HB3 . 10258 1 298 . 1 1 30 30 GLN HE21 H 1 7.611 0.030 . 2 . . . . 30 GLN HE21 . 10258 1 299 . 1 1 30 30 GLN HE22 H 1 6.993 0.030 . 2 . . . . 30 GLN HE22 . 10258 1 300 . 1 1 30 30 GLN HG2 H 1 2.481 0.030 . 2 . . . . 30 GLN HG2 . 10258 1 301 . 1 1 30 30 GLN HG3 H 1 2.437 0.030 . 2 . . . . 30 GLN HG3 . 10258 1 302 . 1 1 30 30 GLN C C 13 174.856 0.300 . 1 . . . . 30 GLN C . 10258 1 303 . 1 1 30 30 GLN CA C 13 54.524 0.300 . 1 . . . . 30 GLN CA . 10258 1 304 . 1 1 30 30 GLN CB C 13 28.623 0.300 . 1 . . . . 30 GLN CB . 10258 1 305 . 1 1 30 30 GLN CG C 13 34.006 0.300 . 1 . . . . 30 GLN CG . 10258 1 306 . 1 1 30 30 GLN N N 15 117.321 0.300 . 1 . . . . 30 GLN N . 10258 1 307 . 1 1 30 30 GLN NE2 N 15 112.041 0.300 . 1 . . . . 30 GLN NE2 . 10258 1 308 . 1 1 31 31 PRO HA H 1 4.116 0.030 . 1 . . . . 31 PRO HA . 10258 1 309 . 1 1 31 31 PRO HB2 H 1 2.476 0.030 . 2 . . . . 31 PRO HB2 . 10258 1 310 . 1 1 31 31 PRO HB3 H 1 1.473 0.030 . 2 . . . . 31 PRO HB3 . 10258 1 311 . 1 1 31 31 PRO HD2 H 1 4.198 0.030 . 2 . . . . 31 PRO HD2 . 10258 1 312 . 1 1 31 31 PRO HD3 H 1 3.791 0.030 . 2 . . . . 31 PRO HD3 . 10258 1 313 . 1 1 31 31 PRO HG2 H 1 1.988 0.030 . 2 . . . . 31 PRO HG2 . 10258 1 314 . 1 1 31 31 PRO HG3 H 1 1.910 0.030 . 2 . . . . 31 PRO HG3 . 10258 1 315 . 1 1 31 31 PRO C C 13 175.787 0.300 . 1 . . . . 31 PRO C . 10258 1 316 . 1 1 31 31 PRO CA C 13 63.364 0.300 . 1 . . . . 31 PRO CA . 10258 1 317 . 1 1 31 31 PRO CB C 13 32.503 0.300 . 1 . . . . 31 PRO CB . 10258 1 318 . 1 1 31 31 PRO CD C 13 50.789 0.300 . 1 . . . . 31 PRO CD . 10258 1 319 . 1 1 31 31 PRO CG C 13 28.204 0.300 . 1 . . . . 31 PRO CG . 10258 1 320 . 1 1 32 32 GLU H H 1 8.367 0.030 . 1 . . . . 32 GLU H . 10258 1 321 . 1 1 32 32 GLU HA H 1 4.004 0.030 . 1 . . . . 32 GLU HA . 10258 1 322 . 1 1 32 32 GLU HB2 H 1 2.057 0.030 . 2 . . . . 32 GLU HB2 . 10258 1 323 . 1 1 32 32 GLU HB3 H 1 1.995 0.030 . 2 . . . . 32 GLU HB3 . 10258 1 324 . 1 1 32 32 GLU HG2 H 1 2.403 0.030 . 2 . . . . 32 GLU HG2 . 10258 1 325 . 1 1 32 32 GLU HG3 H 1 2.315 0.030 . 2 . . . . 32 GLU HG3 . 10258 1 326 . 1 1 32 32 GLU C C 13 176.748 0.300 . 1 . . . . 32 GLU C . 10258 1 327 . 1 1 32 32 GLU CA C 13 58.644 0.300 . 1 . . . . 32 GLU CA . 10258 1 328 . 1 1 32 32 GLU CB C 13 30.271 0.300 . 1 . . . . 32 GLU CB . 10258 1 329 . 1 1 32 32 GLU CG C 13 36.771 0.300 . 1 . . . . 32 GLU CG . 10258 1 330 . 1 1 32 32 GLU N N 15 122.959 0.300 . 1 . . . . 32 GLU N . 10258 1 331 . 1 1 33 33 GLN H H 1 8.220 0.030 . 1 . . . . 33 GLN H . 10258 1 332 . 1 1 33 33 GLN HA H 1 4.820 0.030 . 1 . . . . 33 GLN HA . 10258 1 333 . 1 1 33 33 GLN HB2 H 1 2.019 0.030 . 2 . . . . 33 GLN HB2 . 10258 1 334 . 1 1 33 33 GLN HB3 H 1 1.936 0.030 . 2 . . . . 33 GLN HB3 . 10258 1 335 . 1 1 33 33 GLN HE21 H 1 7.589 0.030 . 2 . . . . 33 GLN HE21 . 10258 1 336 . 1 1 33 33 GLN HE22 H 1 6.849 0.030 . 2 . . . . 33 GLN HE22 . 10258 1 337 . 1 1 33 33 GLN HG2 H 1 2.317 0.030 . 2 . . . . 33 GLN HG2 . 10258 1 338 . 1 1 33 33 GLN HG3 H 1 2.260 0.030 . 2 . . . . 33 GLN HG3 . 10258 1 339 . 1 1 33 33 GLN C C 13 172.938 0.300 . 1 . . . . 33 GLN C . 10258 1 340 . 1 1 33 33 GLN CA C 13 52.544 0.300 . 1 . . . . 33 GLN CA . 10258 1 341 . 1 1 33 33 GLN CB C 13 29.077 0.300 . 1 . . . . 33 GLN CB . 10258 1 342 . 1 1 33 33 GLN CG C 13 33.447 0.300 . 1 . . . . 33 GLN CG . 10258 1 343 . 1 1 33 33 GLN N N 15 116.413 0.300 . 1 . . . . 33 GLN N . 10258 1 344 . 1 1 33 33 GLN NE2 N 15 112.239 0.300 . 1 . . . . 33 GLN NE2 . 10258 1 345 . 1 1 34 34 PRO HA H 1 4.039 0.030 . 1 . . . . 34 PRO HA . 10258 1 346 . 1 1 34 34 PRO HB2 H 1 2.291 0.030 . 2 . . . . 34 PRO HB2 . 10258 1 347 . 1 1 34 34 PRO HB3 H 1 2.014 0.030 . 2 . . . . 34 PRO HB3 . 10258 1 348 . 1 1 34 34 PRO HD2 H 1 3.767 0.030 . 2 . . . . 34 PRO HD2 . 10258 1 349 . 1 1 34 34 PRO HD3 H 1 3.505 0.030 . 2 . . . . 34 PRO HD3 . 10258 1 350 . 1 1 34 34 PRO HG2 H 1 2.184 0.030 . 2 . . . . 34 PRO HG2 . 10258 1 351 . 1 1 34 34 PRO HG3 H 1 2.015 0.030 . 2 . . . . 34 PRO HG3 . 10258 1 352 . 1 1 34 34 PRO C C 13 175.293 0.300 . 1 . . . . 34 PRO C . 10258 1 353 . 1 1 34 34 PRO CA C 13 64.248 0.300 . 1 . . . . 34 PRO CA . 10258 1 354 . 1 1 34 34 PRO CB C 13 31.974 0.300 . 1 . . . . 34 PRO CB . 10258 1 355 . 1 1 34 34 PRO CD C 13 50.334 0.300 . 1 . . . . 34 PRO CD . 10258 1 356 . 1 1 34 34 PRO CG C 13 27.319 0.300 . 1 . . . . 34 PRO CG . 10258 1 357 . 1 1 35 35 ASN H H 1 8.478 0.030 . 1 . . . . 35 ASN H . 10258 1 358 . 1 1 35 35 ASN HA H 1 4.270 0.030 . 1 . . . . 35 ASN HA . 10258 1 359 . 1 1 35 35 ASN HB2 H 1 2.820 0.030 . 2 . . . . 35 ASN HB2 . 10258 1 360 . 1 1 35 35 ASN HB3 H 1 2.456 0.030 . 2 . . . . 35 ASN HB3 . 10258 1 361 . 1 1 35 35 ASN HD21 H 1 7.354 0.030 . 2 . . . . 35 ASN HD21 . 10258 1 362 . 1 1 35 35 ASN HD22 H 1 6.903 0.030 . 2 . . . . 35 ASN HD22 . 10258 1 363 . 1 1 35 35 ASN C C 13 173.982 0.300 . 1 . . . . 35 ASN C . 10258 1 364 . 1 1 35 35 ASN CA C 13 53.655 0.300 . 1 . . . . 35 ASN CA . 10258 1 365 . 1 1 35 35 ASN CB C 13 37.151 0.300 . 1 . . . . 35 ASN CB . 10258 1 366 . 1 1 35 35 ASN N N 15 111.907 0.300 . 1 . . . . 35 ASN N . 10258 1 367 . 1 1 35 35 ASN ND2 N 15 114.521 0.300 . 1 . . . . 35 ASN ND2 . 10258 1 368 . 1 1 36 36 GLY H H 1 7.537 0.030 . 1 . . . . 36 GLY H . 10258 1 369 . 1 1 36 36 GLY HA2 H 1 4.247 0.030 . 2 . . . . 36 GLY HA2 . 10258 1 370 . 1 1 36 36 GLY HA3 H 1 3.749 0.030 . 2 . . . . 36 GLY HA3 . 10258 1 371 . 1 1 36 36 GLY C C 13 172.062 0.300 . 1 . . . . 36 GLY C . 10258 1 372 . 1 1 36 36 GLY CA C 13 44.147 0.300 . 1 . . . . 36 GLY CA . 10258 1 373 . 1 1 36 36 GLY N N 15 105.149 0.300 . 1 . . . . 36 GLY N . 10258 1 374 . 1 1 37 37 ILE H H 1 8.107 0.030 . 1 . . . . 37 ILE H . 10258 1 375 . 1 1 37 37 ILE HA H 1 4.017 0.030 . 1 . . . . 37 ILE HA . 10258 1 376 . 1 1 37 37 ILE HB H 1 1.676 0.030 . 1 . . . . 37 ILE HB . 10258 1 377 . 1 1 37 37 ILE HD11 H 1 0.831 0.030 . 1 . . . . 37 ILE HD1 . 10258 1 378 . 1 1 37 37 ILE HD12 H 1 0.831 0.030 . 1 . . . . 37 ILE HD1 . 10258 1 379 . 1 1 37 37 ILE HD13 H 1 0.831 0.030 . 1 . . . . 37 ILE HD1 . 10258 1 380 . 1 1 37 37 ILE HG12 H 1 1.518 0.030 . 2 . . . . 37 ILE HG12 . 10258 1 381 . 1 1 37 37 ILE HG13 H 1 1.177 0.030 . 2 . . . . 37 ILE HG13 . 10258 1 382 . 1 1 37 37 ILE HG21 H 1 0.804 0.030 . 1 . . . . 37 ILE HG2 . 10258 1 383 . 1 1 37 37 ILE HG22 H 1 0.804 0.030 . 1 . . . . 37 ILE HG2 . 10258 1 384 . 1 1 37 37 ILE HG23 H 1 0.804 0.030 . 1 . . . . 37 ILE HG2 . 10258 1 385 . 1 1 37 37 ILE C C 13 176.534 0.300 . 1 . . . . 37 ILE C . 10258 1 386 . 1 1 37 37 ILE CA C 13 60.331 0.300 . 1 . . . . 37 ILE CA . 10258 1 387 . 1 1 37 37 ILE CB C 13 38.929 0.300 . 1 . . . . 37 ILE CB . 10258 1 388 . 1 1 37 37 ILE CD1 C 13 12.390 0.300 . 1 . . . . 37 ILE CD1 . 10258 1 389 . 1 1 37 37 ILE CG1 C 13 27.579 0.300 . 1 . . . . 37 ILE CG1 . 10258 1 390 . 1 1 37 37 ILE CG2 C 13 17.110 0.300 . 1 . . . . 37 ILE CG2 . 10258 1 391 . 1 1 37 37 ILE N N 15 120.104 0.300 . 1 . . . . 37 ILE N . 10258 1 392 . 1 1 38 38 ILE H H 1 8.678 0.030 . 1 . . . . 38 ILE H . 10258 1 393 . 1 1 38 38 ILE HA H 1 3.695 0.030 . 1 . . . . 38 ILE HA . 10258 1 394 . 1 1 38 38 ILE HB H 1 1.779 0.030 . 1 . . . . 38 ILE HB . 10258 1 395 . 1 1 38 38 ILE HD11 H 1 0.812 0.030 . 1 . . . . 38 ILE HD1 . 10258 1 396 . 1 1 38 38 ILE HD12 H 1 0.812 0.030 . 1 . . . . 38 ILE HD1 . 10258 1 397 . 1 1 38 38 ILE HD13 H 1 0.812 0.030 . 1 . . . . 38 ILE HD1 . 10258 1 398 . 1 1 38 38 ILE HG12 H 1 1.595 0.030 . 2 . . . . 38 ILE HG12 . 10258 1 399 . 1 1 38 38 ILE HG13 H 1 0.923 0.030 . 2 . . . . 38 ILE HG13 . 10258 1 400 . 1 1 38 38 ILE HG21 H 1 0.394 0.030 . 1 . . . . 38 ILE HG2 . 10258 1 401 . 1 1 38 38 ILE HG22 H 1 0.394 0.030 . 1 . . . . 38 ILE HG2 . 10258 1 402 . 1 1 38 38 ILE HG23 H 1 0.394 0.030 . 1 . . . . 38 ILE HG2 . 10258 1 403 . 1 1 38 38 ILE C C 13 176.027 0.300 . 1 . . . . 38 ILE C . 10258 1 404 . 1 1 38 38 ILE CA C 13 61.811 0.300 . 1 . . . . 38 ILE CA . 10258 1 405 . 1 1 38 38 ILE CB C 13 37.028 0.300 . 1 . . . . 38 ILE CB . 10258 1 406 . 1 1 38 38 ILE CD1 C 13 13.049 0.300 . 1 . . . . 38 ILE CD1 . 10258 1 407 . 1 1 38 38 ILE CG1 C 13 28.353 0.300 . 1 . . . . 38 ILE CG1 . 10258 1 408 . 1 1 38 38 ILE CG2 C 13 17.252 0.300 . 1 . . . . 38 ILE CG2 . 10258 1 409 . 1 1 38 38 ILE N N 15 127.591 0.300 . 1 . . . . 38 ILE N . 10258 1 410 . 1 1 39 39 LEU H H 1 9.054 0.030 . 1 . . . . 39 LEU H . 10258 1 411 . 1 1 39 39 LEU HA H 1 4.188 0.030 . 1 . . . . 39 LEU HA . 10258 1 412 . 1 1 39 39 LEU HB2 H 1 1.313 0.030 . 1 . . . . 39 LEU HB2 . 10258 1 413 . 1 1 39 39 LEU HB3 H 1 1.313 0.030 . 1 . . . . 39 LEU HB3 . 10258 1 414 . 1 1 39 39 LEU HD11 H 1 0.618 0.030 . 1 . . . . 39 LEU HD1 . 10258 1 415 . 1 1 39 39 LEU HD12 H 1 0.618 0.030 . 1 . . . . 39 LEU HD1 . 10258 1 416 . 1 1 39 39 LEU HD13 H 1 0.618 0.030 . 1 . . . . 39 LEU HD1 . 10258 1 417 . 1 1 39 39 LEU HD21 H 1 0.749 0.030 . 1 . . . . 39 LEU HD2 . 10258 1 418 . 1 1 39 39 LEU HD22 H 1 0.749 0.030 . 1 . . . . 39 LEU HD2 . 10258 1 419 . 1 1 39 39 LEU HD23 H 1 0.749 0.030 . 1 . . . . 39 LEU HD2 . 10258 1 420 . 1 1 39 39 LEU HG H 1 1.601 0.030 . 1 . . . . 39 LEU HG . 10258 1 421 . 1 1 39 39 LEU C C 13 176.826 0.300 . 1 . . . . 39 LEU C . 10258 1 422 . 1 1 39 39 LEU CA C 13 56.416 0.300 . 1 . . . . 39 LEU CA . 10258 1 423 . 1 1 39 39 LEU CB C 13 42.664 0.300 . 1 . . . . 39 LEU CB . 10258 1 424 . 1 1 39 39 LEU CD1 C 13 25.453 0.300 . 2 . . . . 39 LEU CD1 . 10258 1 425 . 1 1 39 39 LEU CD2 C 13 21.866 0.300 . 2 . . . . 39 LEU CD2 . 10258 1 426 . 1 1 39 39 LEU CG C 13 27.026 0.300 . 1 . . . . 39 LEU CG . 10258 1 427 . 1 1 39 39 LEU N N 15 130.577 0.300 . 1 . . . . 39 LEU N . 10258 1 428 . 1 1 40 40 ASP H H 1 7.502 0.030 . 1 . . . . 40 ASP H . 10258 1 429 . 1 1 40 40 ASP HA H 1 4.392 0.030 . 1 . . . . 40 ASP HA . 10258 1 430 . 1 1 40 40 ASP HB2 H 1 3.334 0.030 . 2 . . . . 40 ASP HB2 . 10258 1 431 . 1 1 40 40 ASP HB3 H 1 2.807 0.030 . 2 . . . . 40 ASP HB3 . 10258 1 432 . 1 1 40 40 ASP C C 13 171.781 0.300 . 1 . . . . 40 ASP C . 10258 1 433 . 1 1 40 40 ASP CA C 13 52.884 0.300 . 1 . . . . 40 ASP CA . 10258 1 434 . 1 1 40 40 ASP CB C 13 41.985 0.300 . 1 . . . . 40 ASP CB . 10258 1 435 . 1 1 40 40 ASP N N 15 112.731 0.300 . 1 . . . . 40 ASP N . 10258 1 436 . 1 1 41 41 TYR H H 1 8.974 0.030 . 1 . . . . 41 TYR H . 10258 1 437 . 1 1 41 41 TYR HA H 1 5.379 0.030 . 1 . . . . 41 TYR HA . 10258 1 438 . 1 1 41 41 TYR HB2 H 1 2.948 0.030 . 2 . . . . 41 TYR HB2 . 10258 1 439 . 1 1 41 41 TYR HB3 H 1 2.739 0.030 . 2 . . . . 41 TYR HB3 . 10258 1 440 . 1 1 41 41 TYR HD1 H 1 6.957 0.030 . 1 . . . . 41 TYR HD1 . 10258 1 441 . 1 1 41 41 TYR HD2 H 1 6.957 0.030 . 1 . . . . 41 TYR HD2 . 10258 1 442 . 1 1 41 41 TYR HE1 H 1 6.706 0.030 . 1 . . . . 41 TYR HE1 . 10258 1 443 . 1 1 41 41 TYR HE2 H 1 6.706 0.030 . 1 . . . . 41 TYR HE2 . 10258 1 444 . 1 1 41 41 TYR C C 13 175.555 0.300 . 1 . . . . 41 TYR C . 10258 1 445 . 1 1 41 41 TYR CA C 13 56.574 0.300 . 1 . . . . 41 TYR CA . 10258 1 446 . 1 1 41 41 TYR CB C 13 42.213 0.300 . 1 . . . . 41 TYR CB . 10258 1 447 . 1 1 41 41 TYR CE1 C 13 117.368 0.300 . 1 . . . . 41 TYR CE1 . 10258 1 448 . 1 1 41 41 TYR CE2 C 13 117.368 0.300 . 1 . . . . 41 TYR CE2 . 10258 1 449 . 1 1 41 41 TYR N N 15 111.324 0.300 . 1 . . . . 41 TYR N . 10258 1 450 . 1 1 42 42 GLU H H 1 9.184 0.030 . 1 . . . . 42 GLU H . 10258 1 451 . 1 1 42 42 GLU HA H 1 5.066 0.030 . 1 . . . . 42 GLU HA . 10258 1 452 . 1 1 42 42 GLU HB2 H 1 2.035 0.030 . 2 . . . . 42 GLU HB2 . 10258 1 453 . 1 1 42 42 GLU HB3 H 1 1.873 0.030 . 2 . . . . 42 GLU HB3 . 10258 1 454 . 1 1 42 42 GLU HG2 H 1 2.347 0.030 . 2 . . . . 42 GLU HG2 . 10258 1 455 . 1 1 42 42 GLU HG3 H 1 2.169 0.030 . 2 . . . . 42 GLU HG3 . 10258 1 456 . 1 1 42 42 GLU C C 13 174.368 0.300 . 1 . . . . 42 GLU C . 10258 1 457 . 1 1 42 42 GLU CA C 13 55.126 0.300 . 1 . . . . 42 GLU CA . 10258 1 458 . 1 1 42 42 GLU CB C 13 33.471 0.300 . 1 . . . . 42 GLU CB . 10258 1 459 . 1 1 42 42 GLU CG C 13 37.480 0.300 . 1 . . . . 42 GLU CG . 10258 1 460 . 1 1 42 42 GLU N N 15 120.875 0.300 . 1 . . . . 42 GLU N . 10258 1 461 . 1 1 43 43 ILE H H 1 9.355 0.030 . 1 . . . . 43 ILE H . 10258 1 462 . 1 1 43 43 ILE HA H 1 4.853 0.030 . 1 . . . . 43 ILE HA . 10258 1 463 . 1 1 43 43 ILE HB H 1 1.681 0.030 . 1 . . . . 43 ILE HB . 10258 1 464 . 1 1 43 43 ILE HD11 H 1 0.692 0.030 . 1 . . . . 43 ILE HD1 . 10258 1 465 . 1 1 43 43 ILE HD12 H 1 0.692 0.030 . 1 . . . . 43 ILE HD1 . 10258 1 466 . 1 1 43 43 ILE HD13 H 1 0.692 0.030 . 1 . . . . 43 ILE HD1 . 10258 1 467 . 1 1 43 43 ILE HG12 H 1 1.121 0.030 . 2 . . . . 43 ILE HG12 . 10258 1 468 . 1 1 43 43 ILE HG13 H 1 0.530 0.030 . 2 . . . . 43 ILE HG13 . 10258 1 469 . 1 1 43 43 ILE HG21 H 1 0.641 0.030 . 1 . . . . 43 ILE HG2 . 10258 1 470 . 1 1 43 43 ILE HG22 H 1 0.641 0.030 . 1 . . . . 43 ILE HG2 . 10258 1 471 . 1 1 43 43 ILE HG23 H 1 0.641 0.030 . 1 . . . . 43 ILE HG2 . 10258 1 472 . 1 1 43 43 ILE C C 13 174.430 0.300 . 1 . . . . 43 ILE C . 10258 1 473 . 1 1 43 43 ILE CA C 13 60.323 0.300 . 1 . . . . 43 ILE CA . 10258 1 474 . 1 1 43 43 ILE CB C 13 40.297 0.300 . 1 . . . . 43 ILE CB . 10258 1 475 . 1 1 43 43 ILE CD1 C 13 15.772 0.300 . 1 . . . . 43 ILE CD1 . 10258 1 476 . 1 1 43 43 ILE CG1 C 13 29.200 0.300 . 1 . . . . 43 ILE CG1 . 10258 1 477 . 1 1 43 43 ILE CG2 C 13 20.323 0.300 . 1 . . . . 43 ILE CG2 . 10258 1 478 . 1 1 43 43 ILE N N 15 126.045 0.300 . 1 . . . . 43 ILE N . 10258 1 479 . 1 1 44 44 ARG H H 1 9.097 0.030 . 1 . . . . 44 ARG H . 10258 1 480 . 1 1 44 44 ARG HA H 1 5.545 0.030 . 1 . . . . 44 ARG HA . 10258 1 481 . 1 1 44 44 ARG HB2 H 1 1.411 0.030 . 1 . . . . 44 ARG HB2 . 10258 1 482 . 1 1 44 44 ARG HB3 H 1 1.411 0.030 . 1 . . . . 44 ARG HB3 . 10258 1 483 . 1 1 44 44 ARG HD2 H 1 2.948 0.030 . 2 . . . . 44 ARG HD2 . 10258 1 484 . 1 1 44 44 ARG HD3 H 1 2.683 0.030 . 2 . . . . 44 ARG HD3 . 10258 1 485 . 1 1 44 44 ARG HG2 H 1 1.666 0.030 . 2 . . . . 44 ARG HG2 . 10258 1 486 . 1 1 44 44 ARG HG3 H 1 1.319 0.030 . 2 . . . . 44 ARG HG3 . 10258 1 487 . 1 1 44 44 ARG C C 13 175.523 0.300 . 1 . . . . 44 ARG C . 10258 1 488 . 1 1 44 44 ARG CA C 13 54.386 0.300 . 1 . . . . 44 ARG CA . 10258 1 489 . 1 1 44 44 ARG CB C 13 34.638 0.300 . 1 . . . . 44 ARG CB . 10258 1 490 . 1 1 44 44 ARG CD C 13 44.032 0.300 . 1 . . . . 44 ARG CD . 10258 1 491 . 1 1 44 44 ARG CG C 13 26.586 0.300 . 1 . . . . 44 ARG CG . 10258 1 492 . 1 1 44 44 ARG N N 15 127.831 0.300 . 1 . . . . 44 ARG N . 10258 1 493 . 1 1 45 45 TYR H H 1 8.893 0.030 . 1 . . . . 45 TYR H . 10258 1 494 . 1 1 45 45 TYR HA H 1 6.272 0.030 . 1 . . . . 45 TYR HA . 10258 1 495 . 1 1 45 45 TYR HB2 H 1 2.837 0.030 . 2 . . . . 45 TYR HB2 . 10258 1 496 . 1 1 45 45 TYR HB3 H 1 2.709 0.030 . 2 . . . . 45 TYR HB3 . 10258 1 497 . 1 1 45 45 TYR HD1 H 1 6.654 0.030 . 1 . . . . 45 TYR HD1 . 10258 1 498 . 1 1 45 45 TYR HD2 H 1 6.654 0.030 . 1 . . . . 45 TYR HD2 . 10258 1 499 . 1 1 45 45 TYR HE1 H 1 6.460 0.030 . 1 . . . . 45 TYR HE1 . 10258 1 500 . 1 1 45 45 TYR HE2 H 1 6.460 0.030 . 1 . . . . 45 TYR HE2 . 10258 1 501 . 1 1 45 45 TYR C C 13 173.560 0.300 . 1 . . . . 45 TYR C . 10258 1 502 . 1 1 45 45 TYR CA C 13 54.767 0.300 . 1 . . . . 45 TYR CA . 10258 1 503 . 1 1 45 45 TYR CB C 13 43.168 0.300 . 1 . . . . 45 TYR CB . 10258 1 504 . 1 1 45 45 TYR CD1 C 13 133.380 0.300 . 1 . . . . 45 TYR CD1 . 10258 1 505 . 1 1 45 45 TYR CD2 C 13 133.380 0.300 . 1 . . . . 45 TYR CD2 . 10258 1 506 . 1 1 45 45 TYR CE1 C 13 117.964 0.300 . 1 . . . . 45 TYR CE1 . 10258 1 507 . 1 1 45 45 TYR CE2 C 13 117.964 0.300 . 1 . . . . 45 TYR CE2 . 10258 1 508 . 1 1 45 45 TYR N N 15 123.683 0.300 . 1 . . . . 45 TYR N . 10258 1 509 . 1 1 46 46 TYR H H 1 8.479 0.030 . 1 . . . . 46 TYR H . 10258 1 510 . 1 1 46 46 TYR HA H 1 5.048 0.030 . 1 . . . . 46 TYR HA . 10258 1 511 . 1 1 46 46 TYR HB2 H 1 2.897 0.030 . 1 . . . . 46 TYR HB2 . 10258 1 512 . 1 1 46 46 TYR HB3 H 1 2.897 0.030 . 1 . . . . 46 TYR HB3 . 10258 1 513 . 1 1 46 46 TYR HD1 H 1 6.755 0.030 . 1 . . . . 46 TYR HD1 . 10258 1 514 . 1 1 46 46 TYR HD2 H 1 6.755 0.030 . 1 . . . . 46 TYR HD2 . 10258 1 515 . 1 1 46 46 TYR HE1 H 1 6.528 0.030 . 1 . . . . 46 TYR HE1 . 10258 1 516 . 1 1 46 46 TYR HE2 H 1 6.528 0.030 . 1 . . . . 46 TYR HE2 . 10258 1 517 . 1 1 46 46 TYR C C 13 173.870 0.300 . 1 . . . . 46 TYR C . 10258 1 518 . 1 1 46 46 TYR CA C 13 55.485 0.300 . 1 . . . . 46 TYR CA . 10258 1 519 . 1 1 46 46 TYR CB C 13 39.975 0.300 . 1 . . . . 46 TYR CB . 10258 1 520 . 1 1 46 46 TYR CD1 C 13 134.728 0.300 . 1 . . . . 46 TYR CD1 . 10258 1 521 . 1 1 46 46 TYR CD2 C 13 134.728 0.300 . 1 . . . . 46 TYR CD2 . 10258 1 522 . 1 1 46 46 TYR CE1 C 13 116.995 0.300 . 1 . . . . 46 TYR CE1 . 10258 1 523 . 1 1 46 46 TYR CE2 C 13 116.995 0.300 . 1 . . . . 46 TYR CE2 . 10258 1 524 . 1 1 46 46 TYR N N 15 114.778 0.300 . 1 . . . . 46 TYR N . 10258 1 525 . 1 1 47 47 GLU H H 1 9.111 0.030 . 1 . . . . 47 GLU H . 10258 1 526 . 1 1 47 47 GLU HA H 1 3.819 0.030 . 1 . . . . 47 GLU HA . 10258 1 527 . 1 1 47 47 GLU HB2 H 1 1.894 0.030 . 2 . . . . 47 GLU HB2 . 10258 1 528 . 1 1 47 47 GLU HB3 H 1 1.562 0.030 . 2 . . . . 47 GLU HB3 . 10258 1 529 . 1 1 47 47 GLU HG2 H 1 2.331 0.030 . 2 . . . . 47 GLU HG2 . 10258 1 530 . 1 1 47 47 GLU HG3 H 1 1.960 0.030 . 2 . . . . 47 GLU HG3 . 10258 1 531 . 1 1 47 47 GLU C C 13 177.764 0.300 . 1 . . . . 47 GLU C . 10258 1 532 . 1 1 47 47 GLU CA C 13 57.123 0.300 . 1 . . . . 47 GLU CA . 10258 1 533 . 1 1 47 47 GLU CB C 13 29.773 0.300 . 1 . . . . 47 GLU CB . 10258 1 534 . 1 1 47 47 GLU CG C 13 37.103 0.300 . 1 . . . . 47 GLU CG . 10258 1 535 . 1 1 47 47 GLU N N 15 122.069 0.300 . 1 . . . . 47 GLU N . 10258 1 536 . 1 1 48 48 LYS H H 1 8.246 0.030 . 1 . . . . 48 LYS H . 10258 1 537 . 1 1 48 48 LYS HA H 1 3.722 0.030 . 1 . . . . 48 LYS HA . 10258 1 538 . 1 1 48 48 LYS HB2 H 1 1.638 0.030 . 2 . . . . 48 LYS HB2 . 10258 1 539 . 1 1 48 48 LYS HB3 H 1 1.461 0.030 . 2 . . . . 48 LYS HB3 . 10258 1 540 . 1 1 48 48 LYS HD2 H 1 1.561 0.030 . 2 . . . . 48 LYS HD2 . 10258 1 541 . 1 1 48 48 LYS HD3 H 1 1.498 0.030 . 2 . . . . 48 LYS HD3 . 10258 1 542 . 1 1 48 48 LYS HE2 H 1 2.890 0.030 . 1 . . . . 48 LYS HE2 . 10258 1 543 . 1 1 48 48 LYS HE3 H 1 2.890 0.030 . 1 . . . . 48 LYS HE3 . 10258 1 544 . 1 1 48 48 LYS HG2 H 1 1.349 0.030 . 2 . . . . 48 LYS HG2 . 10258 1 545 . 1 1 48 48 LYS HG3 H 1 1.217 0.030 . 2 . . . . 48 LYS HG3 . 10258 1 546 . 1 1 48 48 LYS C C 13 176.588 0.300 . 1 . . . . 48 LYS C . 10258 1 547 . 1 1 48 48 LYS CA C 13 59.774 0.300 . 1 . . . . 48 LYS CA . 10258 1 548 . 1 1 48 48 LYS CB C 13 33.032 0.300 . 1 . . . . 48 LYS CB . 10258 1 549 . 1 1 48 48 LYS CD C 13 29.617 0.300 . 1 . . . . 48 LYS CD . 10258 1 550 . 1 1 48 48 LYS CE C 13 42.163 0.300 . 1 . . . . 48 LYS CE . 10258 1 551 . 1 1 48 48 LYS CG C 13 24.713 0.300 . 1 . . . . 48 LYS CG . 10258 1 552 . 1 1 48 48 LYS N N 15 122.857 0.300 . 1 . . . . 48 LYS N . 10258 1 553 . 1 1 49 49 GLU H H 1 8.192 0.030 . 1 . . . . 49 GLU H . 10258 1 554 . 1 1 49 49 GLU HA H 1 4.216 0.030 . 1 . . . . 49 GLU HA . 10258 1 555 . 1 1 49 49 GLU HB2 H 1 2.094 0.030 . 2 . . . . 49 GLU HB2 . 10258 1 556 . 1 1 49 49 GLU HB3 H 1 1.876 0.030 . 2 . . . . 49 GLU HB3 . 10258 1 557 . 1 1 49 49 GLU HG2 H 1 2.170 0.030 . 1 . . . . 49 GLU HG2 . 10258 1 558 . 1 1 49 49 GLU HG3 H 1 2.170 0.030 . 1 . . . . 49 GLU HG3 . 10258 1 559 . 1 1 49 49 GLU C C 13 176.987 0.300 . 1 . . . . 49 GLU C . 10258 1 560 . 1 1 49 49 GLU CA C 13 57.447 0.300 . 1 . . . . 49 GLU CA . 10258 1 561 . 1 1 49 49 GLU CB C 13 28.987 0.300 . 1 . . . . 49 GLU CB . 10258 1 562 . 1 1 49 49 GLU CG C 13 36.759 0.300 . 1 . . . . 49 GLU CG . 10258 1 563 . 1 1 49 49 GLU N N 15 114.305 0.300 . 1 . . . . 49 GLU N . 10258 1 564 . 1 1 50 50 HIS H H 1 8.329 0.030 . 1 . . . . 50 HIS H . 10258 1 565 . 1 1 50 50 HIS HA H 1 4.928 0.030 . 1 . . . . 50 HIS HA . 10258 1 566 . 1 1 50 50 HIS HB2 H 1 3.423 0.030 . 1 . . . . 50 HIS HB2 . 10258 1 567 . 1 1 50 50 HIS HB3 H 1 3.423 0.030 . 1 . . . . 50 HIS HB3 . 10258 1 568 . 1 1 50 50 HIS HD2 H 1 6.947 0.030 . 1 . . . . 50 HIS HD2 . 10258 1 569 . 1 1 50 50 HIS HE1 H 1 7.834 0.030 . 1 . . . . 50 HIS HE1 . 10258 1 570 . 1 1 50 50 HIS C C 13 173.255 0.300 . 1 . . . . 50 HIS C . 10258 1 571 . 1 1 50 50 HIS CA C 13 54.372 0.300 . 1 . . . . 50 HIS CA . 10258 1 572 . 1 1 50 50 HIS CB C 13 31.082 0.300 . 1 . . . . 50 HIS CB . 10258 1 573 . 1 1 50 50 HIS CD2 C 13 118.088 0.300 . 1 . . . . 50 HIS CD2 . 10258 1 574 . 1 1 50 50 HIS CE1 C 13 138.382 0.300 . 1 . . . . 50 HIS CE1 . 10258 1 575 . 1 1 50 50 HIS N N 15 120.021 0.300 . 1 . . . . 50 HIS N . 10258 1 576 . 1 1 51 51 ASN H H 1 7.687 0.030 . 1 . . . . 51 ASN H . 10258 1 577 . 1 1 51 51 ASN HA H 1 4.259 0.030 . 1 . . . . 51 ASN HA . 10258 1 578 . 1 1 51 51 ASN HB2 H 1 2.823 0.030 . 2 . . . . 51 ASN HB2 . 10258 1 579 . 1 1 51 51 ASN HB3 H 1 2.709 0.030 . 2 . . . . 51 ASN HB3 . 10258 1 580 . 1 1 51 51 ASN HD21 H 1 7.617 0.030 . 2 . . . . 51 ASN HD21 . 10258 1 581 . 1 1 51 51 ASN HD22 H 1 6.928 0.030 . 2 . . . . 51 ASN HD22 . 10258 1 582 . 1 1 51 51 ASN C C 13 174.779 0.300 . 1 . . . . 51 ASN C . 10258 1 583 . 1 1 51 51 ASN CA C 13 52.561 0.300 . 1 . . . . 51 ASN CA . 10258 1 584 . 1 1 51 51 ASN CB C 13 39.474 0.300 . 1 . . . . 51 ASN CB . 10258 1 585 . 1 1 51 51 ASN N N 15 114.158 0.300 . 1 . . . . 51 ASN N . 10258 1 586 . 1 1 51 51 ASN ND2 N 15 113.857 0.300 . 1 . . . . 51 ASN ND2 . 10258 1 587 . 1 1 52 52 GLU H H 1 8.551 0.030 . 1 . . . . 52 GLU H . 10258 1 588 . 1 1 52 52 GLU HA H 1 2.797 0.030 . 1 . . . . 52 GLU HA . 10258 1 589 . 1 1 52 52 GLU HB2 H 1 1.450 0.030 . 1 . . . . 52 GLU HB2 . 10258 1 590 . 1 1 52 52 GLU HB3 H 1 1.450 0.030 . 1 . . . . 52 GLU HB3 . 10258 1 591 . 1 1 52 52 GLU HG2 H 1 1.521 0.030 . 2 . . . . 52 GLU HG2 . 10258 1 592 . 1 1 52 52 GLU HG3 H 1 1.467 0.030 . 2 . . . . 52 GLU HG3 . 10258 1 593 . 1 1 52 52 GLU C C 13 177.117 0.300 . 1 . . . . 52 GLU C . 10258 1 594 . 1 1 52 52 GLU CA C 13 58.155 0.300 . 1 . . . . 52 GLU CA . 10258 1 595 . 1 1 52 52 GLU CB C 13 28.912 0.300 . 1 . . . . 52 GLU CB . 10258 1 596 . 1 1 52 52 GLU CG C 13 35.239 0.300 . 1 . . . . 52 GLU CG . 10258 1 597 . 1 1 52 52 GLU N N 15 117.019 0.300 . 1 . . . . 52 GLU N . 10258 1 598 . 1 1 53 53 PHE H H 1 7.855 0.030 . 1 . . . . 53 PHE H . 10258 1 599 . 1 1 53 53 PHE HA H 1 4.371 0.030 . 1 . . . . 53 PHE HA . 10258 1 600 . 1 1 53 53 PHE HB2 H 1 3.138 0.030 . 2 . . . . 53 PHE HB2 . 10258 1 601 . 1 1 53 53 PHE HB3 H 1 2.943 0.030 . 2 . . . . 53 PHE HB3 . 10258 1 602 . 1 1 53 53 PHE HD1 H 1 7.138 0.030 . 1 . . . . 53 PHE HD1 . 10258 1 603 . 1 1 53 53 PHE HD2 H 1 7.138 0.030 . 1 . . . . 53 PHE HD2 . 10258 1 604 . 1 1 53 53 PHE HE1 H 1 7.264 0.030 . 1 . . . . 53 PHE HE1 . 10258 1 605 . 1 1 53 53 PHE HE2 H 1 7.264 0.030 . 1 . . . . 53 PHE HE2 . 10258 1 606 . 1 1 53 53 PHE HZ H 1 7.216 0.030 . 1 . . . . 53 PHE HZ . 10258 1 607 . 1 1 53 53 PHE C C 13 175.783 0.300 . 1 . . . . 53 PHE C . 10258 1 608 . 1 1 53 53 PHE CA C 13 58.785 0.300 . 1 . . . . 53 PHE CA . 10258 1 609 . 1 1 53 53 PHE CB C 13 37.747 0.300 . 1 . . . . 53 PHE CB . 10258 1 610 . 1 1 53 53 PHE CD1 C 13 131.360 0.300 . 1 . . . . 53 PHE CD1 . 10258 1 611 . 1 1 53 53 PHE CD2 C 13 131.360 0.300 . 1 . . . . 53 PHE CD2 . 10258 1 612 . 1 1 53 53 PHE CE1 C 13 131.449 0.300 . 1 . . . . 53 PHE CE1 . 10258 1 613 . 1 1 53 53 PHE CE2 C 13 131.449 0.300 . 1 . . . . 53 PHE CE2 . 10258 1 614 . 1 1 53 53 PHE CZ C 13 129.870 0.300 . 1 . . . . 53 PHE CZ . 10258 1 615 . 1 1 53 53 PHE N N 15 119.462 0.300 . 1 . . . . 53 PHE N . 10258 1 616 . 1 1 54 54 ASN H H 1 7.744 0.030 . 1 . . . . 54 ASN H . 10258 1 617 . 1 1 54 54 ASN HA H 1 4.948 0.030 . 1 . . . . 54 ASN HA . 10258 1 618 . 1 1 54 54 ASN HB2 H 1 2.863 0.030 . 2 . . . . 54 ASN HB2 . 10258 1 619 . 1 1 54 54 ASN HB3 H 1 2.500 0.030 . 2 . . . . 54 ASN HB3 . 10258 1 620 . 1 1 54 54 ASN HD21 H 1 7.307 0.030 . 2 . . . . 54 ASN HD21 . 10258 1 621 . 1 1 54 54 ASN HD22 H 1 6.745 0.030 . 2 . . . . 54 ASN HD22 . 10258 1 622 . 1 1 54 54 ASN C C 13 173.922 0.300 . 1 . . . . 54 ASN C . 10258 1 623 . 1 1 54 54 ASN CA C 13 52.102 0.300 . 1 . . . . 54 ASN CA . 10258 1 624 . 1 1 54 54 ASN CB C 13 38.637 0.300 . 1 . . . . 54 ASN CB . 10258 1 625 . 1 1 54 54 ASN N N 15 120.451 0.300 . 1 . . . . 54 ASN N . 10258 1 626 . 1 1 54 54 ASN ND2 N 15 111.464 0.300 . 1 . . . . 54 ASN ND2 . 10258 1 627 . 1 1 55 55 SER H H 1 7.469 0.030 . 1 . . . . 55 SER H . 10258 1 628 . 1 1 55 55 SER HA H 1 4.710 0.030 . 1 . . . . 55 SER HA . 10258 1 629 . 1 1 55 55 SER HB2 H 1 3.846 0.030 . 2 . . . . 55 SER HB2 . 10258 1 630 . 1 1 55 55 SER HB3 H 1 3.639 0.030 . 2 . . . . 55 SER HB3 . 10258 1 631 . 1 1 55 55 SER C C 13 173.922 0.300 . 1 . . . . 55 SER C . 10258 1 632 . 1 1 55 55 SER CA C 13 57.883 0.300 . 1 . . . . 55 SER CA . 10258 1 633 . 1 1 55 55 SER CB C 13 66.064 0.300 . 1 . . . . 55 SER CB . 10258 1 634 . 1 1 55 55 SER N N 15 113.429 0.300 . 1 . . . . 55 SER N . 10258 1 635 . 1 1 56 56 SER H H 1 8.458 0.030 . 1 . . . . 56 SER H . 10258 1 636 . 1 1 56 56 SER HA H 1 4.632 0.030 . 1 . . . . 56 SER HA . 10258 1 637 . 1 1 56 56 SER HB2 H 1 3.522 0.030 . 2 . . . . 56 SER HB2 . 10258 1 638 . 1 1 56 56 SER HB3 H 1 2.445 0.030 . 2 . . . . 56 SER HB3 . 10258 1 639 . 1 1 56 56 SER C C 13 171.119 0.300 . 1 . . . . 56 SER C . 10258 1 640 . 1 1 56 56 SER CA C 13 57.866 0.300 . 1 . . . . 56 SER CA . 10258 1 641 . 1 1 56 56 SER CB C 13 65.164 0.300 . 1 . . . . 56 SER CB . 10258 1 642 . 1 1 56 56 SER N N 15 116.653 0.300 . 1 . . . . 56 SER N . 10258 1 643 . 1 1 57 57 MET H H 1 8.355 0.030 . 1 . . . . 57 MET H . 10258 1 644 . 1 1 57 57 MET HA H 1 5.776 0.030 . 1 . . . . 57 MET HA . 10258 1 645 . 1 1 57 57 MET HB2 H 1 1.967 0.030 . 1 . . . . 57 MET HB2 . 10258 1 646 . 1 1 57 57 MET HB3 H 1 1.967 0.030 . 1 . . . . 57 MET HB3 . 10258 1 647 . 1 1 57 57 MET HE1 H 1 1.997 0.030 . 1 . . . . 57 MET HE . 10258 1 648 . 1 1 57 57 MET HE2 H 1 1.997 0.030 . 1 . . . . 57 MET HE . 10258 1 649 . 1 1 57 57 MET HE3 H 1 1.997 0.030 . 1 . . . . 57 MET HE . 10258 1 650 . 1 1 57 57 MET HG2 H 1 2.509 0.030 . 2 . . . . 57 MET HG2 . 10258 1 651 . 1 1 57 57 MET HG3 H 1 2.462 0.030 . 2 . . . . 57 MET HG3 . 10258 1 652 . 1 1 57 57 MET C C 13 175.771 0.300 . 1 . . . . 57 MET C . 10258 1 653 . 1 1 57 57 MET CA C 13 53.913 0.300 . 1 . . . . 57 MET CA . 10258 1 654 . 1 1 57 57 MET CB C 13 36.115 0.300 . 1 . . . . 57 MET CB . 10258 1 655 . 1 1 57 57 MET CE C 13 17.206 0.300 . 1 . . . . 57 MET CE . 10258 1 656 . 1 1 57 57 MET CG C 13 32.249 0.300 . 1 . . . . 57 MET CG . 10258 1 657 . 1 1 57 57 MET N N 15 119.463 0.300 . 1 . . . . 57 MET N . 10258 1 658 . 1 1 58 58 ALA H H 1 9.547 0.030 . 1 . . . . 58 ALA H . 10258 1 659 . 1 1 58 58 ALA HA H 1 4.890 0.030 . 1 . . . . 58 ALA HA . 10258 1 660 . 1 1 58 58 ALA HB1 H 1 1.530 0.030 . 1 . . . . 58 ALA HB . 10258 1 661 . 1 1 58 58 ALA HB2 H 1 1.530 0.030 . 1 . . . . 58 ALA HB . 10258 1 662 . 1 1 58 58 ALA HB3 H 1 1.530 0.030 . 1 . . . . 58 ALA HB . 10258 1 663 . 1 1 58 58 ALA C C 13 175.328 0.300 . 1 . . . . 58 ALA C . 10258 1 664 . 1 1 58 58 ALA CA C 13 50.829 0.300 . 1 . . . . 58 ALA CA . 10258 1 665 . 1 1 58 58 ALA CB C 13 22.649 0.300 . 1 . . . . 58 ALA CB . 10258 1 666 . 1 1 58 58 ALA N N 15 127.410 0.300 . 1 . . . . 58 ALA N . 10258 1 667 . 1 1 59 59 ARG H H 1 8.776 0.030 . 1 . . . . 59 ARG H . 10258 1 668 . 1 1 59 59 ARG HA H 1 5.567 0.030 . 1 . . . . 59 ARG HA . 10258 1 669 . 1 1 59 59 ARG HB2 H 1 1.875 0.030 . 2 . . . . 59 ARG HB2 . 10258 1 670 . 1 1 59 59 ARG HB3 H 1 1.795 0.030 . 2 . . . . 59 ARG HB3 . 10258 1 671 . 1 1 59 59 ARG HD2 H 1 3.221 0.030 . 1 . . . . 59 ARG HD2 . 10258 1 672 . 1 1 59 59 ARG HD3 H 1 3.221 0.030 . 1 . . . . 59 ARG HD3 . 10258 1 673 . 1 1 59 59 ARG HG2 H 1 1.745 0.030 . 2 . . . . 59 ARG HG2 . 10258 1 674 . 1 1 59 59 ARG HG3 H 1 1.604 0.030 . 2 . . . . 59 ARG HG3 . 10258 1 675 . 1 1 59 59 ARG C C 13 176.336 0.300 . 1 . . . . 59 ARG C . 10258 1 676 . 1 1 59 59 ARG CA C 13 54.843 0.300 . 1 . . . . 59 ARG CA . 10258 1 677 . 1 1 59 59 ARG CB C 13 33.691 0.300 . 1 . . . . 59 ARG CB . 10258 1 678 . 1 1 59 59 ARG CD C 13 43.328 0.300 . 1 . . . . 59 ARG CD . 10258 1 679 . 1 1 59 59 ARG CG C 13 28.130 0.300 . 1 . . . . 59 ARG CG . 10258 1 680 . 1 1 59 59 ARG N N 15 119.945 0.300 . 1 . . . . 59 ARG N . 10258 1 681 . 1 1 60 60 SER H H 1 8.919 0.030 . 1 . . . . 60 SER H . 10258 1 682 . 1 1 60 60 SER HA H 1 5.011 0.030 . 1 . . . . 60 SER HA . 10258 1 683 . 1 1 60 60 SER HB2 H 1 4.025 0.030 . 1 . . . . 60 SER HB2 . 10258 1 684 . 1 1 60 60 SER HB3 H 1 4.025 0.030 . 1 . . . . 60 SER HB3 . 10258 1 685 . 1 1 60 60 SER C C 13 174.614 0.300 . 1 . . . . 60 SER C . 10258 1 686 . 1 1 60 60 SER CA C 13 56.752 0.300 . 1 . . . . 60 SER CA . 10258 1 687 . 1 1 60 60 SER CB C 13 66.198 0.300 . 1 . . . . 60 SER CB . 10258 1 688 . 1 1 60 60 SER N N 15 115.274 0.300 . 1 . . . . 60 SER N . 10258 1 689 . 1 1 61 61 GLN H H 1 9.367 0.030 . 1 . . . . 61 GLN H . 10258 1 690 . 1 1 61 61 GLN HA H 1 4.556 0.030 . 1 . . . . 61 GLN HA . 10258 1 691 . 1 1 61 61 GLN HB2 H 1 2.436 0.030 . 2 . . . . 61 GLN HB2 . 10258 1 692 . 1 1 61 61 GLN HB3 H 1 2.191 0.030 . 2 . . . . 61 GLN HB3 . 10258 1 693 . 1 1 61 61 GLN HE21 H 1 7.769 0.030 . 2 . . . . 61 GLN HE21 . 10258 1 694 . 1 1 61 61 GLN HE22 H 1 6.970 0.030 . 2 . . . . 61 GLN HE22 . 10258 1 695 . 1 1 61 61 GLN HG2 H 1 2.621 0.030 . 1 . . . . 61 GLN HG2 . 10258 1 696 . 1 1 61 61 GLN HG3 H 1 2.621 0.030 . 1 . . . . 61 GLN HG3 . 10258 1 697 . 1 1 61 61 GLN C C 13 175.391 0.300 . 1 . . . . 61 GLN C . 10258 1 698 . 1 1 61 61 GLN CA C 13 57.664 0.300 . 1 . . . . 61 GLN CA . 10258 1 699 . 1 1 61 61 GLN CB C 13 29.763 0.300 . 1 . . . . 61 GLN CB . 10258 1 700 . 1 1 61 61 GLN CG C 13 35.137 0.300 . 1 . . . . 61 GLN CG . 10258 1 701 . 1 1 61 61 GLN N N 15 124.808 0.300 . 1 . . . . 61 GLN N . 10258 1 702 . 1 1 61 61 GLN NE2 N 15 112.332 0.300 . 1 . . . . 61 GLN NE2 . 10258 1 703 . 1 1 62 62 THR H H 1 8.075 0.030 . 1 . . . . 62 THR H . 10258 1 704 . 1 1 62 62 THR HA H 1 4.918 0.030 . 1 . . . . 62 THR HA . 10258 1 705 . 1 1 62 62 THR HB H 1 4.260 0.030 . 1 . . . . 62 THR HB . 10258 1 706 . 1 1 62 62 THR HG21 H 1 1.193 0.030 . 1 . . . . 62 THR HG2 . 10258 1 707 . 1 1 62 62 THR HG22 H 1 1.193 0.030 . 1 . . . . 62 THR HG2 . 10258 1 708 . 1 1 62 62 THR HG23 H 1 1.193 0.030 . 1 . . . . 62 THR HG2 . 10258 1 709 . 1 1 62 62 THR C C 13 173.106 0.300 . 1 . . . . 62 THR C . 10258 1 710 . 1 1 62 62 THR CA C 13 59.369 0.300 . 1 . . . . 62 THR CA . 10258 1 711 . 1 1 62 62 THR CB C 13 70.607 0.300 . 1 . . . . 62 THR CB . 10258 1 712 . 1 1 62 62 THR CG2 C 13 20.548 0.300 . 1 . . . . 62 THR CG2 . 10258 1 713 . 1 1 62 62 THR N N 15 110.260 0.300 . 1 . . . . 62 THR N . 10258 1 714 . 1 1 63 63 ASN H H 1 8.575 0.030 . 1 . . . . 63 ASN H . 10258 1 715 . 1 1 63 63 ASN HA H 1 3.457 0.030 . 1 . . . . 63 ASN HA . 10258 1 716 . 1 1 63 63 ASN HB2 H 1 2.211 0.030 . 2 . . . . 63 ASN HB2 . 10258 1 717 . 1 1 63 63 ASN HB3 H 1 1.886 0.030 . 2 . . . . 63 ASN HB3 . 10258 1 718 . 1 1 63 63 ASN HD21 H 1 7.690 0.030 . 2 . . . . 63 ASN HD21 . 10258 1 719 . 1 1 63 63 ASN HD22 H 1 6.554 0.030 . 2 . . . . 63 ASN HD22 . 10258 1 720 . 1 1 63 63 ASN C C 13 172.343 0.300 . 1 . . . . 63 ASN C . 10258 1 721 . 1 1 63 63 ASN CA C 13 53.270 0.300 . 1 . . . . 63 ASN CA . 10258 1 722 . 1 1 63 63 ASN CB C 13 34.441 0.300 . 1 . . . . 63 ASN CB . 10258 1 723 . 1 1 63 63 ASN N N 15 119.090 0.300 . 1 . . . . 63 ASN N . 10258 1 724 . 1 1 63 63 ASN ND2 N 15 112.834 0.300 . 1 . . . . 63 ASN ND2 . 10258 1 725 . 1 1 64 64 THR H H 1 6.850 0.030 . 1 . . . . 64 THR H . 10258 1 726 . 1 1 64 64 THR HA H 1 4.296 0.030 . 1 . . . . 64 THR HA . 10258 1 727 . 1 1 64 64 THR HB H 1 3.670 0.030 . 1 . . . . 64 THR HB . 10258 1 728 . 1 1 64 64 THR HG21 H 1 0.809 0.030 . 1 . . . . 64 THR HG2 . 10258 1 729 . 1 1 64 64 THR HG22 H 1 0.809 0.030 . 1 . . . . 64 THR HG2 . 10258 1 730 . 1 1 64 64 THR HG23 H 1 0.809 0.030 . 1 . . . . 64 THR HG2 . 10258 1 731 . 1 1 64 64 THR C C 13 172.238 0.300 . 1 . . . . 64 THR C . 10258 1 732 . 1 1 64 64 THR CA C 13 60.501 0.300 . 1 . . . . 64 THR CA . 10258 1 733 . 1 1 64 64 THR CB C 13 71.252 0.300 . 1 . . . . 64 THR CB . 10258 1 734 . 1 1 64 64 THR CG2 C 13 19.689 0.300 . 1 . . . . 64 THR CG2 . 10258 1 735 . 1 1 64 64 THR N N 15 111.612 0.300 . 1 . . . . 64 THR N . 10258 1 736 . 1 1 65 65 ALA H H 1 8.619 0.030 . 1 . . . . 65 ALA H . 10258 1 737 . 1 1 65 65 ALA HA H 1 4.595 0.030 . 1 . . . . 65 ALA HA . 10258 1 738 . 1 1 65 65 ALA HB1 H 1 1.422 0.030 . 1 . . . . 65 ALA HB . 10258 1 739 . 1 1 65 65 ALA HB2 H 1 1.422 0.030 . 1 . . . . 65 ALA HB . 10258 1 740 . 1 1 65 65 ALA HB3 H 1 1.422 0.030 . 1 . . . . 65 ALA HB . 10258 1 741 . 1 1 65 65 ALA C C 13 174.046 0.300 . 1 . . . . 65 ALA C . 10258 1 742 . 1 1 65 65 ALA CA C 13 52.102 0.300 . 1 . . . . 65 ALA CA . 10258 1 743 . 1 1 65 65 ALA CB C 13 22.427 0.300 . 1 . . . . 65 ALA CB . 10258 1 744 . 1 1 65 65 ALA N N 15 124.370 0.300 . 1 . . . . 65 ALA N . 10258 1 745 . 1 1 66 66 ARG H H 1 8.533 0.030 . 1 . . . . 66 ARG H . 10258 1 746 . 1 1 66 66 ARG HA H 1 4.973 0.030 . 1 . . . . 66 ARG HA . 10258 1 747 . 1 1 66 66 ARG HB2 H 1 1.703 0.030 . 2 . . . . 66 ARG HB2 . 10258 1 748 . 1 1 66 66 ARG HB3 H 1 1.483 0.030 . 2 . . . . 66 ARG HB3 . 10258 1 749 . 1 1 66 66 ARG HD2 H 1 3.036 0.030 . 2 . . . . 66 ARG HD2 . 10258 1 750 . 1 1 66 66 ARG HD3 H 1 2.947 0.030 . 2 . . . . 66 ARG HD3 . 10258 1 751 . 1 1 66 66 ARG HG2 H 1 1.332 0.030 . 2 . . . . 66 ARG HG2 . 10258 1 752 . 1 1 66 66 ARG HG3 H 1 0.976 0.030 . 2 . . . . 66 ARG HG3 . 10258 1 753 . 1 1 66 66 ARG C C 13 175.240 0.300 . 1 . . . . 66 ARG C . 10258 1 754 . 1 1 66 66 ARG CA C 13 54.560 0.300 . 1 . . . . 66 ARG CA . 10258 1 755 . 1 1 66 66 ARG CB C 13 32.088 0.300 . 1 . . . . 66 ARG CB . 10258 1 756 . 1 1 66 66 ARG CD C 13 43.319 0.300 . 1 . . . . 66 ARG CD . 10258 1 757 . 1 1 66 66 ARG CG C 13 27.854 0.300 . 1 . . . . 66 ARG CG . 10258 1 758 . 1 1 66 66 ARG N N 15 122.633 0.300 . 1 . . . . 66 ARG N . 10258 1 759 . 1 1 67 67 ILE H H 1 8.967 0.030 . 1 . . . . 67 ILE H . 10258 1 760 . 1 1 67 67 ILE HA H 1 4.013 0.030 . 1 . . . . 67 ILE HA . 10258 1 761 . 1 1 67 67 ILE HB H 1 1.231 0.030 . 1 . . . . 67 ILE HB . 10258 1 762 . 1 1 67 67 ILE HD11 H 1 0.106 0.030 . 1 . . . . 67 ILE HD1 . 10258 1 763 . 1 1 67 67 ILE HD12 H 1 0.106 0.030 . 1 . . . . 67 ILE HD1 . 10258 1 764 . 1 1 67 67 ILE HD13 H 1 0.106 0.030 . 1 . . . . 67 ILE HD1 . 10258 1 765 . 1 1 67 67 ILE HG12 H 1 1.103 0.030 . 2 . . . . 67 ILE HG12 . 10258 1 766 . 1 1 67 67 ILE HG13 H 1 0.613 0.030 . 2 . . . . 67 ILE HG13 . 10258 1 767 . 1 1 67 67 ILE HG21 H 1 0.067 0.030 . 1 . . . . 67 ILE HG2 . 10258 1 768 . 1 1 67 67 ILE HG22 H 1 0.067 0.030 . 1 . . . . 67 ILE HG2 . 10258 1 769 . 1 1 67 67 ILE HG23 H 1 0.067 0.030 . 1 . . . . 67 ILE HG2 . 10258 1 770 . 1 1 67 67 ILE C C 13 174.026 0.300 . 1 . . . . 67 ILE C . 10258 1 771 . 1 1 67 67 ILE CA C 13 60.377 0.300 . 1 . . . . 67 ILE CA . 10258 1 772 . 1 1 67 67 ILE CB C 13 38.044 0.300 . 1 . . . . 67 ILE CB . 10258 1 773 . 1 1 67 67 ILE CD1 C 13 12.472 0.300 . 1 . . . . 67 ILE CD1 . 10258 1 774 . 1 1 67 67 ILE CG1 C 13 25.985 0.300 . 1 . . . . 67 ILE CG1 . 10258 1 775 . 1 1 67 67 ILE CG2 C 13 17.581 0.300 . 1 . . . . 67 ILE CG2 . 10258 1 776 . 1 1 67 67 ILE N N 15 128.560 0.300 . 1 . . . . 67 ILE N . 10258 1 777 . 1 1 68 68 ASP H H 1 8.117 0.030 . 1 . . . . 68 ASP H . 10258 1 778 . 1 1 68 68 ASP HA H 1 5.060 0.030 . 1 . . . . 68 ASP HA . 10258 1 779 . 1 1 68 68 ASP HB2 H 1 2.612 0.030 . 2 . . . . 68 ASP HB2 . 10258 1 780 . 1 1 68 68 ASP HB3 H 1 2.518 0.030 . 2 . . . . 68 ASP HB3 . 10258 1 781 . 1 1 68 68 ASP C C 13 175.792 0.300 . 1 . . . . 68 ASP C . 10258 1 782 . 1 1 68 68 ASP CA C 13 52.474 0.300 . 1 . . . . 68 ASP CA . 10258 1 783 . 1 1 68 68 ASP CB C 13 44.116 0.300 . 1 . . . . 68 ASP CB . 10258 1 784 . 1 1 68 68 ASP N N 15 125.243 0.300 . 1 . . . . 68 ASP N . 10258 1 785 . 1 1 69 69 GLY H H 1 8.568 0.030 . 1 . . . . 69 GLY H . 10258 1 786 . 1 1 69 69 GLY HA2 H 1 3.951 0.030 . 2 . . . . 69 GLY HA2 . 10258 1 787 . 1 1 69 69 GLY HA3 H 1 3.830 0.030 . 2 . . . . 69 GLY HA3 . 10258 1 788 . 1 1 69 69 GLY C C 13 175.359 0.300 . 1 . . . . 69 GLY C . 10258 1 789 . 1 1 69 69 GLY CA C 13 46.356 0.300 . 1 . . . . 69 GLY CA . 10258 1 790 . 1 1 69 69 GLY N N 15 105.736 0.300 . 1 . . . . 69 GLY N . 10258 1 791 . 1 1 70 70 LEU H H 1 7.982 0.030 . 1 . . . . 70 LEU H . 10258 1 792 . 1 1 70 70 LEU HA H 1 4.356 0.030 . 1 . . . . 70 LEU HA . 10258 1 793 . 1 1 70 70 LEU HB2 H 1 1.418 0.030 . 2 . . . . 70 LEU HB2 . 10258 1 794 . 1 1 70 70 LEU HB3 H 1 0.919 0.030 . 2 . . . . 70 LEU HB3 . 10258 1 795 . 1 1 70 70 LEU HD11 H 1 -0.126 0.030 . 1 . . . . 70 LEU HD1 . 10258 1 796 . 1 1 70 70 LEU HD12 H 1 -0.126 0.030 . 1 . . . . 70 LEU HD1 . 10258 1 797 . 1 1 70 70 LEU HD13 H 1 -0.126 0.030 . 1 . . . . 70 LEU HD1 . 10258 1 798 . 1 1 70 70 LEU HD21 H 1 0.017 0.030 . 1 . . . . 70 LEU HD2 . 10258 1 799 . 1 1 70 70 LEU HD22 H 1 0.017 0.030 . 1 . . . . 70 LEU HD2 . 10258 1 800 . 1 1 70 70 LEU HD23 H 1 0.017 0.030 . 1 . . . . 70 LEU HD2 . 10258 1 801 . 1 1 70 70 LEU HG H 1 0.937 0.030 . 1 . . . . 70 LEU HG . 10258 1 802 . 1 1 70 70 LEU C C 13 175.151 0.300 . 1 . . . . 70 LEU C . 10258 1 803 . 1 1 70 70 LEU CA C 13 53.110 0.300 . 1 . . . . 70 LEU CA . 10258 1 804 . 1 1 70 70 LEU CB C 13 40.992 0.300 . 1 . . . . 70 LEU CB . 10258 1 805 . 1 1 70 70 LEU CD1 C 13 25.105 0.300 . 2 . . . . 70 LEU CD1 . 10258 1 806 . 1 1 70 70 LEU CD2 C 13 19.646 0.300 . 2 . . . . 70 LEU CD2 . 10258 1 807 . 1 1 70 70 LEU CG C 13 25.952 0.300 . 1 . . . . 70 LEU CG . 10258 1 808 . 1 1 70 70 LEU N N 15 118.817 0.300 . 1 . . . . 70 LEU N . 10258 1 809 . 1 1 71 71 ARG H H 1 8.148 0.030 . 1 . . . . 71 ARG H . 10258 1 810 . 1 1 71 71 ARG HA H 1 4.922 0.030 . 1 . . . . 71 ARG HA . 10258 1 811 . 1 1 71 71 ARG HB2 H 1 1.886 0.030 . 2 . . . . 71 ARG HB2 . 10258 1 812 . 1 1 71 71 ARG HB3 H 1 1.702 0.030 . 2 . . . . 71 ARG HB3 . 10258 1 813 . 1 1 71 71 ARG HD2 H 1 3.282 0.030 . 2 . . . . 71 ARG HD2 . 10258 1 814 . 1 1 71 71 ARG HD3 H 1 3.231 0.030 . 2 . . . . 71 ARG HD3 . 10258 1 815 . 1 1 71 71 ARG HG2 H 1 1.827 0.030 . 2 . . . . 71 ARG HG2 . 10258 1 816 . 1 1 71 71 ARG HG3 H 1 1.701 0.030 . 2 . . . . 71 ARG HG3 . 10258 1 817 . 1 1 71 71 ARG C C 13 174.419 0.300 . 1 . . . . 71 ARG C . 10258 1 818 . 1 1 71 71 ARG CA C 13 53.534 0.300 . 1 . . . . 71 ARG CA . 10258 1 819 . 1 1 71 71 ARG CB C 13 32.001 0.300 . 1 . . . . 71 ARG CB . 10258 1 820 . 1 1 71 71 ARG CD C 13 44.167 0.300 . 1 . . . . 71 ARG CD . 10258 1 821 . 1 1 71 71 ARG CG C 13 27.183 0.300 . 1 . . . . 71 ARG CG . 10258 1 822 . 1 1 71 71 ARG N N 15 118.182 0.300 . 1 . . . . 71 ARG N . 10258 1 823 . 1 1 72 72 PRO HA H 1 5.168 0.030 . 1 . . . . 72 PRO HA . 10258 1 824 . 1 1 72 72 PRO HB2 H 1 2.366 0.030 . 2 . . . . 72 PRO HB2 . 10258 1 825 . 1 1 72 72 PRO HB3 H 1 2.001 0.030 . 2 . . . . 72 PRO HB3 . 10258 1 826 . 1 1 72 72 PRO HD2 H 1 3.778 0.030 . 2 . . . . 72 PRO HD2 . 10258 1 827 . 1 1 72 72 PRO HD3 H 1 3.714 0.030 . 2 . . . . 72 PRO HD3 . 10258 1 828 . 1 1 72 72 PRO HG2 H 1 2.127 0.030 . 2 . . . . 72 PRO HG2 . 10258 1 829 . 1 1 72 72 PRO HG3 H 1 1.920 0.030 . 2 . . . . 72 PRO HG3 . 10258 1 830 . 1 1 72 72 PRO C C 13 178.121 0.300 . 1 . . . . 72 PRO C . 10258 1 831 . 1 1 72 72 PRO CA C 13 63.416 0.300 . 1 . . . . 72 PRO CA . 10258 1 832 . 1 1 72 72 PRO CB C 13 32.908 0.300 . 1 . . . . 72 PRO CB . 10258 1 833 . 1 1 72 72 PRO CD C 13 51.283 0.300 . 1 . . . . 72 PRO CD . 10258 1 834 . 1 1 72 72 PRO CG C 13 27.469 0.300 . 1 . . . . 72 PRO CG . 10258 1 835 . 1 1 73 73 GLY H H 1 7.705 0.030 . 1 . . . . 73 GLY H . 10258 1 836 . 1 1 73 73 GLY HA2 H 1 3.856 0.030 . 2 . . . . 73 GLY HA2 . 10258 1 837 . 1 1 73 73 GLY HA3 H 1 3.508 0.030 . 2 . . . . 73 GLY HA3 . 10258 1 838 . 1 1 73 73 GLY C C 13 173.685 0.300 . 1 . . . . 73 GLY C . 10258 1 839 . 1 1 73 73 GLY CA C 13 46.731 0.300 . 1 . . . . 73 GLY CA . 10258 1 840 . 1 1 73 73 GLY N N 15 112.669 0.300 . 1 . . . . 73 GLY N . 10258 1 841 . 1 1 74 74 MET H H 1 7.511 0.030 . 1 . . . . 74 MET H . 10258 1 842 . 1 1 74 74 MET HA H 1 4.742 0.030 . 1 . . . . 74 MET HA . 10258 1 843 . 1 1 74 74 MET HB2 H 1 1.866 0.030 . 2 . . . . 74 MET HB2 . 10258 1 844 . 1 1 74 74 MET HB3 H 1 1.769 0.030 . 2 . . . . 74 MET HB3 . 10258 1 845 . 1 1 74 74 MET HE1 H 1 1.926 0.030 . 1 . . . . 74 MET HE . 10258 1 846 . 1 1 74 74 MET HE2 H 1 1.926 0.030 . 1 . . . . 74 MET HE . 10258 1 847 . 1 1 74 74 MET HE3 H 1 1.926 0.030 . 1 . . . . 74 MET HE . 10258 1 848 . 1 1 74 74 MET HG2 H 1 2.221 0.030 . 2 . . . . 74 MET HG2 . 10258 1 849 . 1 1 74 74 MET HG3 H 1 2.033 0.030 . 2 . . . . 74 MET HG3 . 10258 1 850 . 1 1 74 74 MET C C 13 173.525 0.300 . 1 . . . . 74 MET C . 10258 1 851 . 1 1 74 74 MET CA C 13 53.216 0.300 . 1 . . . . 74 MET CA . 10258 1 852 . 1 1 74 74 MET CB C 13 33.610 0.300 . 1 . . . . 74 MET CB . 10258 1 853 . 1 1 74 74 MET CE C 13 16.512 0.300 . 1 . . . . 74 MET CE . 10258 1 854 . 1 1 74 74 MET CG C 13 32.578 0.300 . 1 . . . . 74 MET CG . 10258 1 855 . 1 1 74 74 MET N N 15 119.820 0.300 . 1 . . . . 74 MET N . 10258 1 856 . 1 1 75 75 VAL H H 1 7.651 0.030 . 1 . . . . 75 VAL H . 10258 1 857 . 1 1 75 75 VAL HA H 1 4.361 0.030 . 1 . . . . 75 VAL HA . 10258 1 858 . 1 1 75 75 VAL HB H 1 1.786 0.030 . 1 . . . . 75 VAL HB . 10258 1 859 . 1 1 75 75 VAL HG11 H 1 0.876 0.030 . 1 . . . . 75 VAL HG1 . 10258 1 860 . 1 1 75 75 VAL HG12 H 1 0.876 0.030 . 1 . . . . 75 VAL HG1 . 10258 1 861 . 1 1 75 75 VAL HG13 H 1 0.876 0.030 . 1 . . . . 75 VAL HG1 . 10258 1 862 . 1 1 75 75 VAL HG21 H 1 0.812 0.030 . 1 . . . . 75 VAL HG2 . 10258 1 863 . 1 1 75 75 VAL HG22 H 1 0.812 0.030 . 1 . . . . 75 VAL HG2 . 10258 1 864 . 1 1 75 75 VAL HG23 H 1 0.812 0.030 . 1 . . . . 75 VAL HG2 . 10258 1 865 . 1 1 75 75 VAL C C 13 174.677 0.300 . 1 . . . . 75 VAL C . 10258 1 866 . 1 1 75 75 VAL CA C 13 61.581 0.300 . 1 . . . . 75 VAL CA . 10258 1 867 . 1 1 75 75 VAL CB C 13 32.345 0.300 . 1 . . . . 75 VAL CB . 10258 1 868 . 1 1 75 75 VAL CG1 C 13 21.352 0.300 . 2 . . . . 75 VAL CG1 . 10258 1 869 . 1 1 75 75 VAL CG2 C 13 22.437 0.300 . 2 . . . . 75 VAL CG2 . 10258 1 870 . 1 1 75 75 VAL N N 15 121.287 0.300 . 1 . . . . 75 VAL N . 10258 1 871 . 1 1 76 76 TYR H H 1 9.405 0.030 . 1 . . . . 76 TYR H . 10258 1 872 . 1 1 76 76 TYR HA H 1 4.743 0.030 . 1 . . . . 76 TYR HA . 10258 1 873 . 1 1 76 76 TYR HB2 H 1 2.544 0.030 . 2 . . . . 76 TYR HB2 . 10258 1 874 . 1 1 76 76 TYR HB3 H 1 2.418 0.030 . 2 . . . . 76 TYR HB3 . 10258 1 875 . 1 1 76 76 TYR HD1 H 1 6.861 0.030 . 1 . . . . 76 TYR HD1 . 10258 1 876 . 1 1 76 76 TYR HD2 H 1 6.861 0.030 . 1 . . . . 76 TYR HD2 . 10258 1 877 . 1 1 76 76 TYR HE1 H 1 6.910 0.030 . 1 . . . . 76 TYR HE1 . 10258 1 878 . 1 1 76 76 TYR HE2 H 1 6.910 0.030 . 1 . . . . 76 TYR HE2 . 10258 1 879 . 1 1 76 76 TYR C C 13 174.740 0.300 . 1 . . . . 76 TYR C . 10258 1 880 . 1 1 76 76 TYR CA C 13 57.424 0.300 . 1 . . . . 76 TYR CA . 10258 1 881 . 1 1 76 76 TYR CB C 13 41.151 0.300 . 1 . . . . 76 TYR CB . 10258 1 882 . 1 1 76 76 TYR CD1 C 13 132.360 0.300 . 1 . . . . 76 TYR CD1 . 10258 1 883 . 1 1 76 76 TYR CD2 C 13 132.360 0.300 . 1 . . . . 76 TYR CD2 . 10258 1 884 . 1 1 76 76 TYR CE1 C 13 119.277 0.300 . 1 . . . . 76 TYR CE1 . 10258 1 885 . 1 1 76 76 TYR CE2 C 13 119.277 0.300 . 1 . . . . 76 TYR CE2 . 10258 1 886 . 1 1 76 76 TYR N N 15 126.231 0.300 . 1 . . . . 76 TYR N . 10258 1 887 . 1 1 77 77 VAL H H 1 8.867 0.030 . 1 . . . . 77 VAL H . 10258 1 888 . 1 1 77 77 VAL HA H 1 4.318 0.030 . 1 . . . . 77 VAL HA . 10258 1 889 . 1 1 77 77 VAL HB H 1 0.325 0.030 . 1 . . . . 77 VAL HB . 10258 1 890 . 1 1 77 77 VAL HG11 H 1 0.573 0.030 . 1 . . . . 77 VAL HG1 . 10258 1 891 . 1 1 77 77 VAL HG12 H 1 0.573 0.030 . 1 . . . . 77 VAL HG1 . 10258 1 892 . 1 1 77 77 VAL HG13 H 1 0.573 0.030 . 1 . . . . 77 VAL HG1 . 10258 1 893 . 1 1 77 77 VAL HG21 H 1 0.573 0.030 . 1 . . . . 77 VAL HG2 . 10258 1 894 . 1 1 77 77 VAL HG22 H 1 0.573 0.030 . 1 . . . . 77 VAL HG2 . 10258 1 895 . 1 1 77 77 VAL HG23 H 1 0.573 0.030 . 1 . . . . 77 VAL HG2 . 10258 1 896 . 1 1 77 77 VAL C C 13 175.773 0.300 . 1 . . . . 77 VAL C . 10258 1 897 . 1 1 77 77 VAL CA C 13 61.473 0.300 . 1 . . . . 77 VAL CA . 10258 1 898 . 1 1 77 77 VAL CB C 13 31.218 0.300 . 1 . . . . 77 VAL CB . 10258 1 899 . 1 1 77 77 VAL CG1 C 13 21.759 0.300 . 2 . . . . 77 VAL CG1 . 10258 1 900 . 1 1 77 77 VAL CG2 C 13 21.376 0.300 . 2 . . . . 77 VAL CG2 . 10258 1 901 . 1 1 77 77 VAL N N 15 123.699 0.300 . 1 . . . . 77 VAL N . 10258 1 902 . 1 1 78 78 VAL H H 1 8.683 0.030 . 1 . . . . 78 VAL H . 10258 1 903 . 1 1 78 78 VAL HA H 1 4.995 0.030 . 1 . . . . 78 VAL HA . 10258 1 904 . 1 1 78 78 VAL HB H 1 1.893 0.030 . 1 . . . . 78 VAL HB . 10258 1 905 . 1 1 78 78 VAL HG11 H 1 0.684 0.030 . 1 . . . . 78 VAL HG1 . 10258 1 906 . 1 1 78 78 VAL HG12 H 1 0.684 0.030 . 1 . . . . 78 VAL HG1 . 10258 1 907 . 1 1 78 78 VAL HG13 H 1 0.684 0.030 . 1 . . . . 78 VAL HG1 . 10258 1 908 . 1 1 78 78 VAL HG21 H 1 0.844 0.030 . 1 . . . . 78 VAL HG2 . 10258 1 909 . 1 1 78 78 VAL HG22 H 1 0.844 0.030 . 1 . . . . 78 VAL HG2 . 10258 1 910 . 1 1 78 78 VAL HG23 H 1 0.844 0.030 . 1 . . . . 78 VAL HG2 . 10258 1 911 . 1 1 78 78 VAL C C 13 175.275 0.300 . 1 . . . . 78 VAL C . 10258 1 912 . 1 1 78 78 VAL CA C 13 60.942 0.300 . 1 . . . . 78 VAL CA . 10258 1 913 . 1 1 78 78 VAL CB C 13 34.790 0.300 . 1 . . . . 78 VAL CB . 10258 1 914 . 1 1 78 78 VAL CG1 C 13 23.185 0.300 . 2 . . . . 78 VAL CG1 . 10258 1 915 . 1 1 78 78 VAL CG2 C 13 21.372 0.300 . 2 . . . . 78 VAL CG2 . 10258 1 916 . 1 1 78 78 VAL N N 15 124.155 0.300 . 1 . . . . 78 VAL N . 10258 1 917 . 1 1 79 79 GLN H H 1 8.613 0.030 . 1 . . . . 79 GLN H . 10258 1 918 . 1 1 79 79 GLN HA H 1 4.511 0.030 . 1 . . . . 79 GLN HA . 10258 1 919 . 1 1 79 79 GLN HB2 H 1 2.266 0.030 . 2 . . . . 79 GLN HB2 . 10258 1 920 . 1 1 79 79 GLN HB3 H 1 1.463 0.030 . 2 . . . . 79 GLN HB3 . 10258 1 921 . 1 1 79 79 GLN HE21 H 1 8.422 0.030 . 2 . . . . 79 GLN HE21 . 10258 1 922 . 1 1 79 79 GLN HE22 H 1 7.421 0.030 . 2 . . . . 79 GLN HE22 . 10258 1 923 . 1 1 79 79 GLN HG2 H 1 2.360 0.030 . 2 . . . . 79 GLN HG2 . 10258 1 924 . 1 1 79 79 GLN HG3 H 1 1.697 0.030 . 2 . . . . 79 GLN HG3 . 10258 1 925 . 1 1 79 79 GLN C C 13 173.361 0.300 . 1 . . . . 79 GLN C . 10258 1 926 . 1 1 79 79 GLN CA C 13 54.666 0.300 . 1 . . . . 79 GLN CA . 10258 1 927 . 1 1 79 79 GLN CB C 13 36.751 0.300 . 1 . . . . 79 GLN CB . 10258 1 928 . 1 1 79 79 GLN CG C 13 36.580 0.300 . 1 . . . . 79 GLN CG . 10258 1 929 . 1 1 79 79 GLN N N 15 121.693 0.300 . 1 . . . . 79 GLN N . 10258 1 930 . 1 1 79 79 GLN NE2 N 15 115.797 0.300 . 1 . . . . 79 GLN NE2 . 10258 1 931 . 1 1 80 80 VAL H H 1 9.019 0.030 . 1 . . . . 80 VAL H . 10258 1 932 . 1 1 80 80 VAL HA H 1 5.801 0.030 . 1 . . . . 80 VAL HA . 10258 1 933 . 1 1 80 80 VAL HB H 1 1.169 0.030 . 1 . . . . 80 VAL HB . 10258 1 934 . 1 1 80 80 VAL HG11 H 1 0.020 0.030 . 1 . . . . 80 VAL HG1 . 10258 1 935 . 1 1 80 80 VAL HG12 H 1 0.020 0.030 . 1 . . . . 80 VAL HG1 . 10258 1 936 . 1 1 80 80 VAL HG13 H 1 0.020 0.030 . 1 . . . . 80 VAL HG1 . 10258 1 937 . 1 1 80 80 VAL HG21 H 1 0.213 0.030 . 1 . . . . 80 VAL HG2 . 10258 1 938 . 1 1 80 80 VAL HG22 H 1 0.213 0.030 . 1 . . . . 80 VAL HG2 . 10258 1 939 . 1 1 80 80 VAL HG23 H 1 0.213 0.030 . 1 . . . . 80 VAL HG2 . 10258 1 940 . 1 1 80 80 VAL C C 13 174.526 0.300 . 1 . . . . 80 VAL C . 10258 1 941 . 1 1 80 80 VAL CA C 13 58.750 0.300 . 1 . . . . 80 VAL CA . 10258 1 942 . 1 1 80 80 VAL CB C 13 35.479 0.300 . 1 . . . . 80 VAL CB . 10258 1 943 . 1 1 80 80 VAL CG1 C 13 21.909 0.300 . 2 . . . . 80 VAL CG1 . 10258 1 944 . 1 1 80 80 VAL CG2 C 13 18.606 0.300 . 2 . . . . 80 VAL CG2 . 10258 1 945 . 1 1 80 80 VAL N N 15 118.559 0.300 . 1 . . . . 80 VAL N . 10258 1 946 . 1 1 81 81 ARG H H 1 9.199 0.030 . 1 . . . . 81 ARG H . 10258 1 947 . 1 1 81 81 ARG HA H 1 4.951 0.030 . 1 . . . . 81 ARG HA . 10258 1 948 . 1 1 81 81 ARG HB2 H 1 1.456 0.030 . 2 . . . . 81 ARG HB2 . 10258 1 949 . 1 1 81 81 ARG HB3 H 1 0.693 0.030 . 2 . . . . 81 ARG HB3 . 10258 1 950 . 1 1 81 81 ARG HD2 H 1 2.490 0.030 . 2 . . . . 81 ARG HD2 . 10258 1 951 . 1 1 81 81 ARG HD3 H 1 0.675 0.030 . 2 . . . . 81 ARG HD3 . 10258 1 952 . 1 1 81 81 ARG HE H 1 5.921 0.030 . 1 . . . . 81 ARG HE . 10258 1 953 . 1 1 81 81 ARG HG2 H 1 1.565 0.030 . 2 . . . . 81 ARG HG2 . 10258 1 954 . 1 1 81 81 ARG HG3 H 1 1.132 0.030 . 2 . . . . 81 ARG HG3 . 10258 1 955 . 1 1 81 81 ARG C C 13 172.660 0.300 . 1 . . . . 81 ARG C . 10258 1 956 . 1 1 81 81 ARG CA C 13 54.295 0.300 . 1 . . . . 81 ARG CA . 10258 1 957 . 1 1 81 81 ARG CB C 13 33.750 0.300 . 1 . . . . 81 ARG CB . 10258 1 958 . 1 1 81 81 ARG CD C 13 43.208 0.300 . 1 . . . . 81 ARG CD . 10258 1 959 . 1 1 81 81 ARG CG C 13 25.103 0.300 . 1 . . . . 81 ARG CG . 10258 1 960 . 1 1 81 81 ARG N N 15 125.225 0.300 . 1 . . . . 81 ARG N . 10258 1 961 . 1 1 81 81 ARG NE N 15 83.856 0.300 . 1 . . . . 81 ARG NE . 10258 1 962 . 1 1 82 82 ALA H H 1 8.762 0.030 . 1 . . . . 82 ALA H . 10258 1 963 . 1 1 82 82 ALA HA H 1 4.820 0.030 . 1 . . . . 82 ALA HA . 10258 1 964 . 1 1 82 82 ALA HB1 H 1 1.334 0.030 . 1 . . . . 82 ALA HB . 10258 1 965 . 1 1 82 82 ALA HB2 H 1 1.334 0.030 . 1 . . . . 82 ALA HB . 10258 1 966 . 1 1 82 82 ALA HB3 H 1 1.334 0.030 . 1 . . . . 82 ALA HB . 10258 1 967 . 1 1 82 82 ALA C C 13 174.783 0.300 . 1 . . . . 82 ALA C . 10258 1 968 . 1 1 82 82 ALA CA C 13 50.741 0.300 . 1 . . . . 82 ALA CA . 10258 1 969 . 1 1 82 82 ALA CB C 13 22.383 0.300 . 1 . . . . 82 ALA CB . 10258 1 970 . 1 1 82 82 ALA N N 15 124.292 0.300 . 1 . . . . 82 ALA N . 10258 1 971 . 1 1 83 83 ARG H H 1 8.336 0.030 . 1 . . . . 83 ARG H . 10258 1 972 . 1 1 83 83 ARG HA H 1 4.737 0.030 . 1 . . . . 83 ARG HA . 10258 1 973 . 1 1 83 83 ARG HB2 H 1 1.914 0.030 . 2 . . . . 83 ARG HB2 . 10258 1 974 . 1 1 83 83 ARG HB3 H 1 1.178 0.030 . 2 . . . . 83 ARG HB3 . 10258 1 975 . 1 1 83 83 ARG HD2 H 1 2.904 0.030 . 2 . . . . 83 ARG HD2 . 10258 1 976 . 1 1 83 83 ARG HD3 H 1 2.482 0.030 . 2 . . . . 83 ARG HD3 . 10258 1 977 . 1 1 83 83 ARG HE H 1 8.818 0.030 . 1 . . . . 83 ARG HE . 10258 1 978 . 1 1 83 83 ARG HG2 H 1 0.997 0.030 . 2 . . . . 83 ARG HG2 . 10258 1 979 . 1 1 83 83 ARG HG3 H 1 0.448 0.030 . 2 . . . . 83 ARG HG3 . 10258 1 980 . 1 1 83 83 ARG C C 13 175.290 0.300 . 1 . . . . 83 ARG C . 10258 1 981 . 1 1 83 83 ARG CA C 13 55.727 0.300 . 1 . . . . 83 ARG CA . 10258 1 982 . 1 1 83 83 ARG CB C 13 34.562 0.300 . 1 . . . . 83 ARG CB . 10258 1 983 . 1 1 83 83 ARG CD C 13 43.104 0.300 . 1 . . . . 83 ARG CD . 10258 1 984 . 1 1 83 83 ARG CG C 13 28.926 0.300 . 1 . . . . 83 ARG CG . 10258 1 985 . 1 1 83 83 ARG N N 15 121.023 0.300 . 1 . . . . 83 ARG N . 10258 1 986 . 1 1 83 83 ARG NE N 15 85.704 0.300 . 1 . . . . 83 ARG NE . 10258 1 987 . 1 1 84 84 THR H H 1 8.485 0.030 . 1 . . . . 84 THR H . 10258 1 988 . 1 1 84 84 THR HA H 1 4.875 0.030 . 1 . . . . 84 THR HA . 10258 1 989 . 1 1 84 84 THR HB H 1 4.462 0.030 . 1 . . . . 84 THR HB . 10258 1 990 . 1 1 84 84 THR HG21 H 1 0.920 0.030 . 1 . . . . 84 THR HG2 . 10258 1 991 . 1 1 84 84 THR HG22 H 1 0.920 0.030 . 1 . . . . 84 THR HG2 . 10258 1 992 . 1 1 84 84 THR HG23 H 1 0.920 0.030 . 1 . . . . 84 THR HG2 . 10258 1 993 . 1 1 84 84 THR C C 13 176.218 0.300 . 1 . . . . 84 THR C . 10258 1 994 . 1 1 84 84 THR CA C 13 59.475 0.300 . 1 . . . . 84 THR CA . 10258 1 995 . 1 1 84 84 THR CB C 13 72.440 0.300 . 1 . . . . 84 THR CB . 10258 1 996 . 1 1 84 84 THR CG2 C 13 20.877 0.300 . 1 . . . . 84 THR CG2 . 10258 1 997 . 1 1 84 84 THR N N 15 116.374 0.300 . 1 . . . . 84 THR N . 10258 1 998 . 1 1 85 85 VAL H H 1 9.283 0.030 . 1 . . . . 85 VAL H . 10258 1 999 . 1 1 85 85 VAL HA H 1 3.794 0.030 . 1 . . . . 85 VAL HA . 10258 1 1000 . 1 1 85 85 VAL HB H 1 2.159 0.030 . 1 . . . . 85 VAL HB . 10258 1 1001 . 1 1 85 85 VAL HG11 H 1 1.035 0.030 . 1 . . . . 85 VAL HG1 . 10258 1 1002 . 1 1 85 85 VAL HG12 H 1 1.035 0.030 . 1 . . . . 85 VAL HG1 . 10258 1 1003 . 1 1 85 85 VAL HG13 H 1 1.035 0.030 . 1 . . . . 85 VAL HG1 . 10258 1 1004 . 1 1 85 85 VAL HG21 H 1 1.013 0.030 . 1 . . . . 85 VAL HG2 . 10258 1 1005 . 1 1 85 85 VAL HG22 H 1 1.013 0.030 . 1 . . . . 85 VAL HG2 . 10258 1 1006 . 1 1 85 85 VAL HG23 H 1 1.013 0.030 . 1 . . . . 85 VAL HG2 . 10258 1 1007 . 1 1 85 85 VAL C C 13 175.930 0.300 . 1 . . . . 85 VAL C . 10258 1 1008 . 1 1 85 85 VAL CA C 13 64.934 0.300 . 1 . . . . 85 VAL CA . 10258 1 1009 . 1 1 85 85 VAL CB C 13 31.621 0.300 . 1 . . . . 85 VAL CB . 10258 1 1010 . 1 1 85 85 VAL CG1 C 13 21.080 0.300 . 2 . . . . 85 VAL CG1 . 10258 1 1011 . 1 1 85 85 VAL CG2 C 13 20.777 0.300 . 2 . . . . 85 VAL CG2 . 10258 1 1012 . 1 1 85 85 VAL N N 15 119.099 0.300 . 1 . . . . 85 VAL N . 10258 1 1013 . 1 1 86 86 ALA H H 1 7.840 0.030 . 1 . . . . 86 ALA H . 10258 1 1014 . 1 1 86 86 ALA HA H 1 4.242 0.030 . 1 . . . . 86 ALA HA . 10258 1 1015 . 1 1 86 86 ALA HB1 H 1 1.211 0.030 . 1 . . . . 86 ALA HB . 10258 1 1016 . 1 1 86 86 ALA HB2 H 1 1.211 0.030 . 1 . . . . 86 ALA HB . 10258 1 1017 . 1 1 86 86 ALA HB3 H 1 1.211 0.030 . 1 . . . . 86 ALA HB . 10258 1 1018 . 1 1 86 86 ALA C C 13 177.467 0.300 . 1 . . . . 86 ALA C . 10258 1 1019 . 1 1 86 86 ALA CA C 13 52.774 0.300 . 1 . . . . 86 ALA CA . 10258 1 1020 . 1 1 86 86 ALA CB C 13 19.733 0.300 . 1 . . . . 86 ALA CB . 10258 1 1021 . 1 1 86 86 ALA N N 15 121.263 0.300 . 1 . . . . 86 ALA N . 10258 1 1022 . 1 1 87 87 GLY H H 1 7.365 0.030 . 1 . . . . 87 GLY H . 10258 1 1023 . 1 1 87 87 GLY HA2 H 1 4.402 0.030 . 2 . . . . 87 GLY HA2 . 10258 1 1024 . 1 1 87 87 GLY HA3 H 1 3.588 0.030 . 2 . . . . 87 GLY HA3 . 10258 1 1025 . 1 1 87 87 GLY C C 13 171.960 0.300 . 1 . . . . 87 GLY C . 10258 1 1026 . 1 1 87 87 GLY CA C 13 44.170 0.300 . 1 . . . . 87 GLY CA . 10258 1 1027 . 1 1 87 87 GLY N N 15 105.736 0.300 . 1 . . . . 87 GLY N . 10258 1 1028 . 1 1 88 88 TYR H H 1 8.444 0.030 . 1 . . . . 88 TYR H . 10258 1 1029 . 1 1 88 88 TYR HA H 1 5.063 0.030 . 1 . . . . 88 TYR HA . 10258 1 1030 . 1 1 88 88 TYR HB2 H 1 3.075 0.030 . 2 . . . . 88 TYR HB2 . 10258 1 1031 . 1 1 88 88 TYR HB3 H 1 2.608 0.030 . 2 . . . . 88 TYR HB3 . 10258 1 1032 . 1 1 88 88 TYR HD1 H 1 6.896 0.030 . 1 . . . . 88 TYR HD1 . 10258 1 1033 . 1 1 88 88 TYR HD2 H 1 6.896 0.030 . 1 . . . . 88 TYR HD2 . 10258 1 1034 . 1 1 88 88 TYR HE1 H 1 6.653 0.030 . 1 . . . . 88 TYR HE1 . 10258 1 1035 . 1 1 88 88 TYR HE2 H 1 6.653 0.030 . 1 . . . . 88 TYR HE2 . 10258 1 1036 . 1 1 88 88 TYR C C 13 179.239 0.300 . 1 . . . . 88 TYR C . 10258 1 1037 . 1 1 88 88 TYR CA C 13 58.308 0.300 . 1 . . . . 88 TYR CA . 10258 1 1038 . 1 1 88 88 TYR CB C 13 41.442 0.300 . 1 . . . . 88 TYR CB . 10258 1 1039 . 1 1 88 88 TYR CD1 C 13 132.603 0.300 . 1 . . . . 88 TYR CD1 . 10258 1 1040 . 1 1 88 88 TYR CD2 C 13 132.603 0.300 . 1 . . . . 88 TYR CD2 . 10258 1 1041 . 1 1 88 88 TYR CE1 C 13 118.655 0.300 . 1 . . . . 88 TYR CE1 . 10258 1 1042 . 1 1 88 88 TYR CE2 C 13 118.655 0.300 . 1 . . . . 88 TYR CE2 . 10258 1 1043 . 1 1 88 88 TYR N N 15 116.996 0.300 . 1 . . . . 88 TYR N . 10258 1 1044 . 1 1 89 89 GLY H H 1 8.676 0.030 . 1 . . . . 89 GLY H . 10258 1 1045 . 1 1 89 89 GLY HA2 H 1 4.324 0.030 . 2 . . . . 89 GLY HA2 . 10258 1 1046 . 1 1 89 89 GLY HA3 H 1 3.973 0.030 . 2 . . . . 89 GLY HA3 . 10258 1 1047 . 1 1 89 89 GLY C C 13 173.844 0.300 . 1 . . . . 89 GLY C . 10258 1 1048 . 1 1 89 89 GLY CA C 13 43.916 0.300 . 1 . . . . 89 GLY CA . 10258 1 1049 . 1 1 89 89 GLY N N 15 107.850 0.300 . 1 . . . . 89 GLY N . 10258 1 1050 . 1 1 90 90 LYS H H 1 8.711 0.030 . 1 . . . . 90 LYS H . 10258 1 1051 . 1 1 90 90 LYS HA H 1 4.166 0.030 . 1 . . . . 90 LYS HA . 10258 1 1052 . 1 1 90 90 LYS HB2 H 1 1.864 0.030 . 2 . . . . 90 LYS HB2 . 10258 1 1053 . 1 1 90 90 LYS HB3 H 1 1.734 0.030 . 2 . . . . 90 LYS HB3 . 10258 1 1054 . 1 1 90 90 LYS HD2 H 1 1.698 0.030 . 1 . . . . 90 LYS HD2 . 10258 1 1055 . 1 1 90 90 LYS HD3 H 1 1.698 0.030 . 1 . . . . 90 LYS HD3 . 10258 1 1056 . 1 1 90 90 LYS HE2 H 1 3.035 0.030 . 1 . . . . 90 LYS HE2 . 10258 1 1057 . 1 1 90 90 LYS HE3 H 1 3.035 0.030 . 1 . . . . 90 LYS HE3 . 10258 1 1058 . 1 1 90 90 LYS HG2 H 1 1.562 0.030 . 1 . . . . 90 LYS HG2 . 10258 1 1059 . 1 1 90 90 LYS HG3 H 1 1.562 0.030 . 1 . . . . 90 LYS HG3 . 10258 1 1060 . 1 1 90 90 LYS C C 13 177.819 0.300 . 1 . . . . 90 LYS C . 10258 1 1061 . 1 1 90 90 LYS CA C 13 56.162 0.300 . 1 . . . . 90 LYS CA . 10258 1 1062 . 1 1 90 90 LYS CB C 13 32.730 0.300 . 1 . . . . 90 LYS CB . 10258 1 1063 . 1 1 90 90 LYS CD C 13 29.100 0.300 . 1 . . . . 90 LYS CD . 10258 1 1064 . 1 1 90 90 LYS CE C 13 42.291 0.300 . 1 . . . . 90 LYS CE . 10258 1 1065 . 1 1 90 90 LYS CG C 13 25.162 0.300 . 1 . . . . 90 LYS CG . 10258 1 1066 . 1 1 90 90 LYS N N 15 119.382 0.300 . 1 . . . . 90 LYS N . 10258 1 1067 . 1 1 91 91 PHE H H 1 8.698 0.030 . 1 . . . . 91 PHE H . 10258 1 1068 . 1 1 91 91 PHE HA H 1 4.241 0.030 . 1 . . . . 91 PHE HA . 10258 1 1069 . 1 1 91 91 PHE HB2 H 1 3.192 0.030 . 2 . . . . 91 PHE HB2 . 10258 1 1070 . 1 1 91 91 PHE HB3 H 1 2.799 0.030 . 2 . . . . 91 PHE HB3 . 10258 1 1071 . 1 1 91 91 PHE HD1 H 1 7.062 0.030 . 1 . . . . 91 PHE HD1 . 10258 1 1072 . 1 1 91 91 PHE HD2 H 1 7.062 0.030 . 1 . . . . 91 PHE HD2 . 10258 1 1073 . 1 1 91 91 PHE HE1 H 1 7.132 0.030 . 1 . . . . 91 PHE HE1 . 10258 1 1074 . 1 1 91 91 PHE HE2 H 1 7.132 0.030 . 1 . . . . 91 PHE HE2 . 10258 1 1075 . 1 1 91 91 PHE HZ H 1 7.025 0.030 . 1 . . . . 91 PHE HZ . 10258 1 1076 . 1 1 91 91 PHE C C 13 176.805 0.300 . 1 . . . . 91 PHE C . 10258 1 1077 . 1 1 91 91 PHE CA C 13 61.027 0.300 . 1 . . . . 91 PHE CA . 10258 1 1078 . 1 1 91 91 PHE CB C 13 39.995 0.300 . 1 . . . . 91 PHE CB . 10258 1 1079 . 1 1 91 91 PHE CD1 C 13 131.360 0.300 . 1 . . . . 91 PHE CD1 . 10258 1 1080 . 1 1 91 91 PHE CD2 C 13 131.360 0.300 . 1 . . . . 91 PHE CD2 . 10258 1 1081 . 1 1 91 91 PHE CE1 C 13 131.449 0.300 . 1 . . . . 91 PHE CE1 . 10258 1 1082 . 1 1 91 91 PHE CE2 C 13 131.449 0.300 . 1 . . . . 91 PHE CE2 . 10258 1 1083 . 1 1 91 91 PHE CZ C 13 129.376 0.300 . 1 . . . . 91 PHE CZ . 10258 1 1084 . 1 1 91 91 PHE N N 15 120.691 0.300 . 1 . . . . 91 PHE N . 10258 1 1085 . 1 1 92 92 SER H H 1 8.311 0.030 . 1 . . . . 92 SER H . 10258 1 1086 . 1 1 92 92 SER HA H 1 4.259 0.030 . 1 . . . . 92 SER HA . 10258 1 1087 . 1 1 92 92 SER HB2 H 1 4.238 0.030 . 2 . . . . 92 SER HB2 . 10258 1 1088 . 1 1 92 92 SER HB3 H 1 4.087 0.030 . 2 . . . . 92 SER HB3 . 10258 1 1089 . 1 1 92 92 SER C C 13 173.499 0.300 . 1 . . . . 92 SER C . 10258 1 1090 . 1 1 92 92 SER CA C 13 58.146 0.300 . 1 . . . . 92 SER CA . 10258 1 1091 . 1 1 92 92 SER CB C 13 65.329 0.300 . 1 . . . . 92 SER CB . 10258 1 1092 . 1 1 92 92 SER N N 15 115.098 0.300 . 1 . . . . 92 SER N . 10258 1 1093 . 1 1 93 93 GLY H H 1 8.869 0.030 . 1 . . . . 93 GLY H . 10258 1 1094 . 1 1 93 93 GLY HA2 H 1 4.071 0.030 . 2 . . . . 93 GLY HA2 . 10258 1 1095 . 1 1 93 93 GLY HA3 H 1 3.780 0.030 . 2 . . . . 93 GLY HA3 . 10258 1 1096 . 1 1 93 93 GLY C C 13 174.375 0.300 . 1 . . . . 93 GLY C . 10258 1 1097 . 1 1 93 93 GLY CA C 13 45.331 0.300 . 1 . . . . 93 GLY CA . 10258 1 1098 . 1 1 93 93 GLY N N 15 106.252 0.300 . 1 . . . . 93 GLY N . 10258 1 1099 . 1 1 94 94 LYS H H 1 8.619 0.030 . 1 . . . . 94 LYS H . 10258 1 1100 . 1 1 94 94 LYS HA H 1 3.633 0.030 . 1 . . . . 94 LYS HA . 10258 1 1101 . 1 1 94 94 LYS HB2 H 1 1.634 0.030 . 2 . . . . 94 LYS HB2 . 10258 1 1102 . 1 1 94 94 LYS HB3 H 1 1.488 0.030 . 2 . . . . 94 LYS HB3 . 10258 1 1103 . 1 1 94 94 LYS HD2 H 1 1.619 0.030 . 1 . . . . 94 LYS HD2 . 10258 1 1104 . 1 1 94 94 LYS HD3 H 1 1.619 0.030 . 1 . . . . 94 LYS HD3 . 10258 1 1105 . 1 1 94 94 LYS HE2 H 1 2.960 0.030 . 2 . . . . 94 LYS HE2 . 10258 1 1106 . 1 1 94 94 LYS HE3 H 1 2.741 0.030 . 2 . . . . 94 LYS HE3 . 10258 1 1107 . 1 1 94 94 LYS HG2 H 1 1.523 0.030 . 2 . . . . 94 LYS HG2 . 10258 1 1108 . 1 1 94 94 LYS HG3 H 1 1.031 0.030 . 2 . . . . 94 LYS HG3 . 10258 1 1109 . 1 1 94 94 LYS C C 13 176.004 0.300 . 1 . . . . 94 LYS C . 10258 1 1110 . 1 1 94 94 LYS CA C 13 59.068 0.300 . 1 . . . . 94 LYS CA . 10258 1 1111 . 1 1 94 94 LYS CB C 13 33.072 0.300 . 1 . . . . 94 LYS CB . 10258 1 1112 . 1 1 94 94 LYS CD C 13 29.694 0.300 . 1 . . . . 94 LYS CD . 10258 1 1113 . 1 1 94 94 LYS CE C 13 42.054 0.300 . 1 . . . . 94 LYS CE . 10258 1 1114 . 1 1 94 94 LYS CG C 13 25.834 0.300 . 1 . . . . 94 LYS CG . 10258 1 1115 . 1 1 94 94 LYS N N 15 122.645 0.300 . 1 . . . . 94 LYS N . 10258 1 1116 . 1 1 95 95 MET H H 1 7.547 0.030 . 1 . . . . 95 MET H . 10258 1 1117 . 1 1 95 95 MET HA H 1 4.520 0.030 . 1 . . . . 95 MET HA . 10258 1 1118 . 1 1 95 95 MET HB2 H 1 1.791 0.030 . 1 . . . . 95 MET HB2 . 10258 1 1119 . 1 1 95 95 MET HB3 H 1 1.791 0.030 . 1 . . . . 95 MET HB3 . 10258 1 1120 . 1 1 95 95 MET HE1 H 1 2.192 0.030 . 1 . . . . 95 MET HE . 10258 1 1121 . 1 1 95 95 MET HE2 H 1 2.192 0.030 . 1 . . . . 95 MET HE . 10258 1 1122 . 1 1 95 95 MET HE3 H 1 2.192 0.030 . 1 . . . . 95 MET HE . 10258 1 1123 . 1 1 95 95 MET HG2 H 1 2.528 0.030 . 2 . . . . 95 MET HG2 . 10258 1 1124 . 1 1 95 95 MET HG3 H 1 2.475 0.030 . 2 . . . . 95 MET HG3 . 10258 1 1125 . 1 1 95 95 MET C C 13 173.400 0.300 . 1 . . . . 95 MET C . 10258 1 1126 . 1 1 95 95 MET CA C 13 54.701 0.300 . 1 . . . . 95 MET CA . 10258 1 1127 . 1 1 95 95 MET CB C 13 37.784 0.300 . 1 . . . . 95 MET CB . 10258 1 1128 . 1 1 95 95 MET CE C 13 17.418 0.300 . 1 . . . . 95 MET CE . 10258 1 1129 . 1 1 95 95 MET CG C 13 33.088 0.300 . 1 . . . . 95 MET CG . 10258 1 1130 . 1 1 95 95 MET N N 15 122.392 0.300 . 1 . . . . 95 MET N . 10258 1 1131 . 1 1 96 96 CYS H H 1 7.888 0.030 . 1 . . . . 96 CYS H . 10258 1 1132 . 1 1 96 96 CYS HA H 1 5.465 0.030 . 1 . . . . 96 CYS HA . 10258 1 1133 . 1 1 96 96 CYS HB2 H 1 2.544 0.030 . 2 . . . . 96 CYS HB2 . 10258 1 1134 . 1 1 96 96 CYS HB3 H 1 2.409 0.030 . 2 . . . . 96 CYS HB3 . 10258 1 1135 . 1 1 96 96 CYS C C 13 173.757 0.300 . 1 . . . . 96 CYS C . 10258 1 1136 . 1 1 96 96 CYS CA C 13 57.353 0.300 . 1 . . . . 96 CYS CA . 10258 1 1137 . 1 1 96 96 CYS CB C 13 29.941 0.300 . 1 . . . . 96 CYS CB . 10258 1 1138 . 1 1 96 96 CYS N N 15 117.124 0.300 . 1 . . . . 96 CYS N . 10258 1 1139 . 1 1 97 97 PHE H H 1 9.133 0.030 . 1 . . . . 97 PHE H . 10258 1 1140 . 1 1 97 97 PHE HA H 1 4.879 0.030 . 1 . . . . 97 PHE HA . 10258 1 1141 . 1 1 97 97 PHE HB2 H 1 3.338 0.030 . 2 . . . . 97 PHE HB2 . 10258 1 1142 . 1 1 97 97 PHE HB3 H 1 2.315 0.030 . 2 . . . . 97 PHE HB3 . 10258 1 1143 . 1 1 97 97 PHE HD1 H 1 7.195 0.030 . 1 . . . . 97 PHE HD1 . 10258 1 1144 . 1 1 97 97 PHE HD2 H 1 7.195 0.030 . 1 . . . . 97 PHE HD2 . 10258 1 1145 . 1 1 97 97 PHE HE1 H 1 7.150 0.030 . 1 . . . . 97 PHE HE1 . 10258 1 1146 . 1 1 97 97 PHE HE2 H 1 7.150 0.030 . 1 . . . . 97 PHE HE2 . 10258 1 1147 . 1 1 97 97 PHE HZ H 1 7.041 0.030 . 1 . . . . 97 PHE HZ . 10258 1 1148 . 1 1 97 97 PHE C C 13 173.309 0.300 . 1 . . . . 97 PHE C . 10258 1 1149 . 1 1 97 97 PHE CA C 13 56.983 0.300 . 1 . . . . 97 PHE CA . 10258 1 1150 . 1 1 97 97 PHE CB C 13 44.074 0.300 . 1 . . . . 97 PHE CB . 10258 1 1151 . 1 1 97 97 PHE CD1 C 13 132.619 0.300 . 1 . . . . 97 PHE CD1 . 10258 1 1152 . 1 1 97 97 PHE CD2 C 13 132.619 0.300 . 1 . . . . 97 PHE CD2 . 10258 1 1153 . 1 1 97 97 PHE CE1 C 13 131.046 0.300 . 1 . . . . 97 PHE CE1 . 10258 1 1154 . 1 1 97 97 PHE CE2 C 13 131.046 0.300 . 1 . . . . 97 PHE CE2 . 10258 1 1155 . 1 1 97 97 PHE CZ C 13 129.606 0.300 . 1 . . . . 97 PHE CZ . 10258 1 1156 . 1 1 97 97 PHE N N 15 121.239 0.300 . 1 . . . . 97 PHE N . 10258 1 1157 . 1 1 98 98 GLN H H 1 8.884 0.030 . 1 . . . . 98 GLN H . 10258 1 1158 . 1 1 98 98 GLN HA H 1 5.809 0.030 . 1 . . . . 98 GLN HA . 10258 1 1159 . 1 1 98 98 GLN HB2 H 1 2.076 0.030 . 2 . . . . 98 GLN HB2 . 10258 1 1160 . 1 1 98 98 GLN HB3 H 1 1.888 0.030 . 2 . . . . 98 GLN HB3 . 10258 1 1161 . 1 1 98 98 GLN HE21 H 1 7.363 0.030 . 2 . . . . 98 GLN HE21 . 10258 1 1162 . 1 1 98 98 GLN HE22 H 1 6.734 0.030 . 2 . . . . 98 GLN HE22 . 10258 1 1163 . 1 1 98 98 GLN HG2 H 1 2.690 0.030 . 1 . . . . 98 GLN HG2 . 10258 1 1164 . 1 1 98 98 GLN HG3 H 1 2.690 0.030 . 1 . . . . 98 GLN HG3 . 10258 1 1165 . 1 1 98 98 GLN C C 13 176.454 0.300 . 1 . . . . 98 GLN C . 10258 1 1166 . 1 1 98 98 GLN CA C 13 54.125 0.300 . 1 . . . . 98 GLN CA . 10258 1 1167 . 1 1 98 98 GLN CB C 13 33.444 0.300 . 1 . . . . 98 GLN CB . 10258 1 1168 . 1 1 98 98 GLN CG C 13 33.387 0.300 . 1 . . . . 98 GLN CG . 10258 1 1169 . 1 1 98 98 GLN N N 15 120.699 0.300 . 1 . . . . 98 GLN N . 10258 1 1170 . 1 1 98 98 GLN NE2 N 15 110.808 0.300 . 1 . . . . 98 GLN NE2 . 10258 1 1171 . 1 1 99 99 THR H H 1 8.176 0.030 . 1 . . . . 99 THR H . 10258 1 1172 . 1 1 99 99 THR HA H 1 4.324 0.030 . 1 . . . . 99 THR HA . 10258 1 1173 . 1 1 99 99 THR HB H 1 4.809 0.030 . 1 . . . . 99 THR HB . 10258 1 1174 . 1 1 99 99 THR HG21 H 1 1.077 0.030 . 1 . . . . 99 THR HG2 . 10258 1 1175 . 1 1 99 99 THR HG22 H 1 1.077 0.030 . 1 . . . . 99 THR HG2 . 10258 1 1176 . 1 1 99 99 THR HG23 H 1 1.077 0.030 . 1 . . . . 99 THR HG2 . 10258 1 1177 . 1 1 99 99 THR C C 13 175.929 0.300 . 1 . . . . 99 THR C . 10258 1 1178 . 1 1 99 99 THR CA C 13 60.341 0.300 . 1 . . . . 99 THR CA . 10258 1 1179 . 1 1 99 99 THR CB C 13 70.070 0.300 . 1 . . . . 99 THR CB . 10258 1 1180 . 1 1 99 99 THR CG2 C 13 25.162 0.300 . 1 . . . . 99 THR CG2 . 10258 1 1181 . 1 1 99 99 THR N N 15 112.214 0.300 . 1 . . . . 99 THR N . 10258 1 1182 . 1 1 100 100 LEU H H 1 7.368 0.030 . 1 . . . . 100 LEU H . 10258 1 1183 . 1 1 100 100 LEU HA H 1 4.310 0.030 . 1 . . . . 100 LEU HA . 10258 1 1184 . 1 1 100 100 LEU HB2 H 1 1.686 0.030 . 2 . . . . 100 LEU HB2 . 10258 1 1185 . 1 1 100 100 LEU HB3 H 1 1.225 0.030 . 2 . . . . 100 LEU HB3 . 10258 1 1186 . 1 1 100 100 LEU HD11 H 1 0.933 0.030 . 1 . . . . 100 LEU HD1 . 10258 1 1187 . 1 1 100 100 LEU HD12 H 1 0.933 0.030 . 1 . . . . 100 LEU HD1 . 10258 1 1188 . 1 1 100 100 LEU HD13 H 1 0.933 0.030 . 1 . . . . 100 LEU HD1 . 10258 1 1189 . 1 1 100 100 LEU HD21 H 1 0.852 0.030 . 1 . . . . 100 LEU HD2 . 10258 1 1190 . 1 1 100 100 LEU HD22 H 1 0.852 0.030 . 1 . . . . 100 LEU HD2 . 10258 1 1191 . 1 1 100 100 LEU HD23 H 1 0.852 0.030 . 1 . . . . 100 LEU HD2 . 10258 1 1192 . 1 1 100 100 LEU HG H 1 1.284 0.030 . 1 . . . . 100 LEU HG . 10258 1 1193 . 1 1 100 100 LEU C C 13 177.359 0.300 . 1 . . . . 100 LEU C . 10258 1 1194 . 1 1 100 100 LEU CA C 13 54.790 0.300 . 1 . . . . 100 LEU CA . 10258 1 1195 . 1 1 100 100 LEU CB C 13 42.096 0.300 . 1 . . . . 100 LEU CB . 10258 1 1196 . 1 1 100 100 LEU CD1 C 13 26.374 0.300 . 2 . . . . 100 LEU CD1 . 10258 1 1197 . 1 1 100 100 LEU CD2 C 13 21.754 0.300 . 2 . . . . 100 LEU CD2 . 10258 1 1198 . 1 1 100 100 LEU CG C 13 26.972 0.300 . 1 . . . . 100 LEU CG . 10258 1 1199 . 1 1 100 100 LEU N N 15 117.018 0.300 . 1 . . . . 100 LEU N . 10258 1 1200 . 1 1 101 101 THR H H 1 7.997 0.030 . 1 . . . . 101 THR H . 10258 1 1201 . 1 1 101 101 THR HA H 1 4.123 0.030 . 1 . . . . 101 THR HA . 10258 1 1202 . 1 1 101 101 THR HB H 1 4.197 0.030 . 1 . . . . 101 THR HB . 10258 1 1203 . 1 1 101 101 THR HG21 H 1 1.214 0.030 . 1 . . . . 101 THR HG2 . 10258 1 1204 . 1 1 101 101 THR HG22 H 1 1.214 0.030 . 1 . . . . 101 THR HG2 . 10258 1 1205 . 1 1 101 101 THR HG23 H 1 1.214 0.030 . 1 . . . . 101 THR HG2 . 10258 1 1206 . 1 1 101 101 THR C C 13 174.014 0.300 . 1 . . . . 101 THR C . 10258 1 1207 . 1 1 101 101 THR CA C 13 61.968 0.300 . 1 . . . . 101 THR CA . 10258 1 1208 . 1 1 101 101 THR CB C 13 70.172 0.300 . 1 . . . . 101 THR CB . 10258 1 1209 . 1 1 101 101 THR CG2 C 13 21.939 0.300 . 1 . . . . 101 THR CG2 . 10258 1 1210 . 1 1 101 101 THR N N 15 110.428 0.300 . 1 . . . . 101 THR N . 10258 1 1211 . 1 1 102 102 ASP H H 1 8.320 0.030 . 1 . . . . 102 ASP H . 10258 1 1212 . 1 1 102 102 ASP HA H 1 4.853 0.030 . 1 . . . . 102 ASP HA . 10258 1 1213 . 1 1 102 102 ASP HB2 H 1 2.731 0.030 . 2 . . . . 102 ASP HB2 . 10258 1 1214 . 1 1 102 102 ASP HB3 H 1 2.651 0.030 . 2 . . . . 102 ASP HB3 . 10258 1 1215 . 1 1 102 102 ASP C C 13 176.204 0.300 . 1 . . . . 102 ASP C . 10258 1 1216 . 1 1 102 102 ASP CA C 13 53.694 0.300 . 1 . . . . 102 ASP CA . 10258 1 1217 . 1 1 102 102 ASP CB C 13 41.808 0.300 . 1 . . . . 102 ASP CB . 10258 1 1218 . 1 1 102 102 ASP N N 15 120.693 0.300 . 1 . . . . 102 ASP N . 10258 1 1219 . 1 1 103 103 SER H H 1 8.294 0.030 . 1 . . . . 103 SER H . 10258 1 1220 . 1 1 103 103 SER HA H 1 4.486 0.030 . 1 . . . . 103 SER HA . 10258 1 1221 . 1 1 103 103 SER HB2 H 1 3.950 0.030 . 2 . . . . 103 SER HB2 . 10258 1 1222 . 1 1 103 103 SER HB3 H 1 3.847 0.030 . 2 . . . . 103 SER HB3 . 10258 1 1223 . 1 1 103 103 SER C C 13 174.875 0.300 . 1 . . . . 103 SER C . 10258 1 1224 . 1 1 103 103 SER CA C 13 58.361 0.300 . 1 . . . . 103 SER CA . 10258 1 1225 . 1 1 103 103 SER CB C 13 63.942 0.300 . 1 . . . . 103 SER CB . 10258 1 1226 . 1 1 103 103 SER N N 15 117.442 0.300 . 1 . . . . 103 SER N . 10258 1 1227 . 1 1 104 104 GLY H H 1 8.393 0.030 . 1 . . . . 104 GLY H . 10258 1 1228 . 1 1 104 104 GLY HA2 H 1 4.104 0.030 . 1 . . . . 104 GLY HA2 . 10258 1 1229 . 1 1 104 104 GLY HA3 H 1 4.104 0.030 . 1 . . . . 104 GLY HA3 . 10258 1 1230 . 1 1 104 104 GLY C C 13 172.016 0.300 . 1 . . . . 104 GLY C . 10258 1 1231 . 1 1 104 104 GLY CA C 13 44.800 0.300 . 1 . . . . 104 GLY CA . 10258 1 1232 . 1 1 104 104 GLY N N 15 111.065 0.300 . 1 . . . . 104 GLY N . 10258 1 1233 . 1 1 105 105 PRO HA H 1 4.475 0.030 . 1 . . . . 105 PRO HA . 10258 1 1234 . 1 1 105 105 PRO HB2 H 1 2.302 0.030 . 2 . . . . 105 PRO HB2 . 10258 1 1235 . 1 1 105 105 PRO HB3 H 1 1.972 0.030 . 2 . . . . 105 PRO HB3 . 10258 1 1236 . 1 1 105 105 PRO HD2 H 1 3.624 0.030 . 1 . . . . 105 PRO HD2 . 10258 1 1237 . 1 1 105 105 PRO HD3 H 1 3.624 0.030 . 1 . . . . 105 PRO HD3 . 10258 1 1238 . 1 1 105 105 PRO HG2 H 1 2.007 0.030 . 1 . . . . 105 PRO HG2 . 10258 1 1239 . 1 1 105 105 PRO HG3 H 1 2.007 0.030 . 1 . . . . 105 PRO HG3 . 10258 1 1240 . 1 1 105 105 PRO C C 13 177.464 0.300 . 1 . . . . 105 PRO C . 10258 1 1241 . 1 1 105 105 PRO CA C 13 63.329 0.300 . 1 . . . . 105 PRO CA . 10258 1 1242 . 1 1 105 105 PRO CB C 13 32.249 0.300 . 1 . . . . 105 PRO CB . 10258 1 1243 . 1 1 105 105 PRO CD C 13 49.835 0.300 . 1 . . . . 105 PRO CD . 10258 1 1244 . 1 1 105 105 PRO CG C 13 27.173 0.300 . 1 . . . . 105 PRO CG . 10258 1 1245 . 1 1 106 106 SER H H 1 8.514 0.030 . 1 . . . . 106 SER H . 10258 1 1246 . 1 1 106 106 SER HA H 1 4.512 0.030 . 1 . . . . 106 SER HA . 10258 1 1247 . 1 1 106 106 SER HB2 H 1 3.907 0.030 . 1 . . . . 106 SER HB2 . 10258 1 1248 . 1 1 106 106 SER HB3 H 1 3.907 0.030 . 1 . . . . 106 SER HB3 . 10258 1 1249 . 1 1 106 106 SER C C 13 174.735 0.300 . 1 . . . . 106 SER C . 10258 1 1250 . 1 1 106 106 SER CA C 13 58.361 0.300 . 1 . . . . 106 SER CA . 10258 1 1251 . 1 1 106 106 SER CB C 13 63.820 0.300 . 1 . . . . 106 SER CB . 10258 1 1252 . 1 1 106 106 SER N N 15 116.429 0.300 . 1 . . . . 106 SER N . 10258 1 1253 . 1 1 107 107 SER H H 1 8.329 0.030 . 1 . . . . 107 SER H . 10258 1 1254 . 1 1 107 107 SER HA H 1 4.512 0.030 . 1 . . . . 107 SER HA . 10258 1 1255 . 1 1 107 107 SER HB2 H 1 3.896 0.030 . 1 . . . . 107 SER HB2 . 10258 1 1256 . 1 1 107 107 SER HB3 H 1 3.896 0.030 . 1 . . . . 107 SER HB3 . 10258 1 1257 . 1 1 107 107 SER C C 13 174.004 0.300 . 1 . . . . 107 SER C . 10258 1 1258 . 1 1 107 107 SER CA C 13 58.414 0.300 . 1 . . . . 107 SER CA . 10258 1 1259 . 1 1 107 107 SER CB C 13 64.014 0.300 . 1 . . . . 107 SER CB . 10258 1 1260 . 1 1 107 107 SER N N 15 117.919 0.300 . 1 . . . . 107 SER N . 10258 1 1261 . 1 1 108 108 GLY H H 1 8.053 0.030 . 1 . . . . 108 GLY H . 10258 1 1262 . 1 1 108 108 GLY C C 13 179.008 0.300 . 1 . . . . 108 GLY C . 10258 1 1263 . 1 1 108 108 GLY CA C 13 46.250 0.300 . 1 . . . . 108 GLY CA . 10258 1 1264 . 1 1 108 108 GLY N N 15 116.885 0.300 . 1 . . . . 108 GLY N . 10258 1 stop_ save_