data_10102 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10102 _Entry.Title ; Solution structure of the second fibronectin Type III domain of human KIAA1568 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-02-13 _Entry.Accession_date 2007-02-13 _Entry.Last_release_date 2008-08-15 _Entry.Original_release_date 2008-08-15 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 N. Tochio . . . 10102 2 S. Koshiba . . . 10102 3 T. Kigawa . . . 10102 4 S. Yokoyama . . . 10102 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10102 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10102 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 499 10102 '15N chemical shifts' 126 10102 '1H chemical shifts' 805 10102 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2008-08-15 2007-02-13 original author . 10102 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1UJT 'BMRB Entry Tracking System' 10102 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10102 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the second fibronectin Type III domain of human KIAA1568 protein ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 N. Tochio . . . 10102 1 2 S. Koshiba . . . 10102 1 3 T. Kigawa . . . 10102 1 4 S. Yokoyama . . . 10102 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10102 _Assembly.ID 1 _Assembly.Name 'KIAA1568 protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10102 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'KIAA1568 protein' 1 $entity_1 . . yes native no no . . . 10102 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 1UJT . . . . . . 10102 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10102 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'FN3 domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGRQVQKELGDVLVR LHNPVVLTPTTVQVTWTVDR QPQFIQGYRVMYRQTSGLQA TSSWQNLDAKVPTERSAVLV NLKKGVTYEIKVRPYFNEFQ GMDSESKTVRTTEESGPSSG ; _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 120 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2014-05-12 loop_ _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID no PDB 1UJT . "Solution Structure Of The Second Fibronectin Type Iii Domain Of Human Kiaa1568 Protein" . . . . . 100.00 120 100.00 100.00 1.62e-80 . . . . 10102 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'FN3 domain' . 10102 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 . 10102 1 2 . SER . 10102 1 3 . SER . 10102 1 4 . GLY . 10102 1 5 . SER . 10102 1 6 . SER . 10102 1 7 . GLY . 10102 1 8 . ARG . 10102 1 9 . GLN . 10102 1 10 . VAL . 10102 1 11 . GLN . 10102 1 12 . LYS . 10102 1 13 . GLU . 10102 1 14 . LEU . 10102 1 15 . GLY . 10102 1 16 . ASP . 10102 1 17 . VAL . 10102 1 18 . LEU . 10102 1 19 . VAL . 10102 1 20 . ARG . 10102 1 21 . LEU . 10102 1 22 . HIS . 10102 1 23 . ASN . 10102 1 24 . PRO . 10102 1 25 . VAL . 10102 1 26 . VAL . 10102 1 27 . LEU . 10102 1 28 . THR . 10102 1 29 . PRO . 10102 1 30 . THR . 10102 1 31 . THR . 10102 1 32 . VAL . 10102 1 33 . GLN . 10102 1 34 . VAL . 10102 1 35 . THR . 10102 1 36 . TRP . 10102 1 37 . THR . 10102 1 38 . VAL . 10102 1 39 . ASP . 10102 1 40 . ARG . 10102 1 41 . GLN . 10102 1 42 . PRO . 10102 1 43 . GLN . 10102 1 44 . PHE . 10102 1 45 . ILE . 10102 1 46 . GLN . 10102 1 47 . GLY . 10102 1 48 . TYR . 10102 1 49 . ARG . 10102 1 50 . VAL . 10102 1 51 . MET . 10102 1 52 . TYR . 10102 1 53 . ARG . 10102 1 54 . GLN . 10102 1 55 . THR . 10102 1 56 . SER . 10102 1 57 . GLY . 10102 1 58 . LEU . 10102 1 59 . GLN . 10102 1 60 . ALA . 10102 1 61 . THR . 10102 1 62 . SER . 10102 1 63 . SER . 10102 1 64 . TRP . 10102 1 65 . GLN . 10102 1 66 . ASN . 10102 1 67 . LEU . 10102 1 68 . ASP . 10102 1 69 . ALA . 10102 1 70 . LYS . 10102 1 71 . VAL . 10102 1 72 . PRO . 10102 1 73 . THR . 10102 1 74 . GLU . 10102 1 75 . ARG . 10102 1 76 . SER . 10102 1 77 . ALA . 10102 1 78 . VAL . 10102 1 79 . LEU . 10102 1 80 . VAL . 10102 1 81 . ASN . 10102 1 82 . LEU . 10102 1 83 . LYS . 10102 1 84 . LYS . 10102 1 85 . GLY . 10102 1 86 . VAL . 10102 1 87 . THR . 10102 1 88 . TYR . 10102 1 89 . GLU . 10102 1 90 . ILE . 10102 1 91 . LYS . 10102 1 92 . VAL . 10102 1 93 . ARG . 10102 1 94 . PRO . 10102 1 95 . TYR . 10102 1 96 . PHE . 10102 1 97 . ASN . 10102 1 98 . GLU . 10102 1 99 . PHE . 10102 1 100 . GLN . 10102 1 101 . GLY . 10102 1 102 . MET . 10102 1 103 . ASP . 10102 1 104 . SER . 10102 1 105 . GLU . 10102 1 106 . SER . 10102 1 107 . LYS . 10102 1 108 . THR . 10102 1 109 . VAL . 10102 1 110 . ARG . 10102 1 111 . THR . 10102 1 112 . THR . 10102 1 113 . GLU . 10102 1 114 . GLU . 10102 1 115 . SER . 10102 1 116 . GLY . 10102 1 117 . PRO . 10102 1 118 . SER . 10102 1 119 . SER . 10102 1 120 . GLY . 10102 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 10102 1 . SER 2 2 10102 1 . SER 3 3 10102 1 . GLY 4 4 10102 1 . SER 5 5 10102 1 . SER 6 6 10102 1 . GLY 7 7 10102 1 . ARG 8 8 10102 1 . GLN 9 9 10102 1 . VAL 10 10 10102 1 . GLN 11 11 10102 1 . LYS 12 12 10102 1 . GLU 13 13 10102 1 . LEU 14 14 10102 1 . GLY 15 15 10102 1 . ASP 16 16 10102 1 . VAL 17 17 10102 1 . LEU 18 18 10102 1 . VAL 19 19 10102 1 . ARG 20 20 10102 1 . LEU 21 21 10102 1 . HIS 22 22 10102 1 . ASN 23 23 10102 1 . PRO 24 24 10102 1 . VAL 25 25 10102 1 . VAL 26 26 10102 1 . LEU 27 27 10102 1 . THR 28 28 10102 1 . PRO 29 29 10102 1 . THR 30 30 10102 1 . THR 31 31 10102 1 . VAL 32 32 10102 1 . GLN 33 33 10102 1 . VAL 34 34 10102 1 . THR 35 35 10102 1 . TRP 36 36 10102 1 . THR 37 37 10102 1 . VAL 38 38 10102 1 . ASP 39 39 10102 1 . ARG 40 40 10102 1 . GLN 41 41 10102 1 . PRO 42 42 10102 1 . GLN 43 43 10102 1 . PHE 44 44 10102 1 . ILE 45 45 10102 1 . GLN 46 46 10102 1 . GLY 47 47 10102 1 . TYR 48 48 10102 1 . ARG 49 49 10102 1 . VAL 50 50 10102 1 . MET 51 51 10102 1 . TYR 52 52 10102 1 . ARG 53 53 10102 1 . GLN 54 54 10102 1 . THR 55 55 10102 1 . SER 56 56 10102 1 . GLY 57 57 10102 1 . LEU 58 58 10102 1 . GLN 59 59 10102 1 . ALA 60 60 10102 1 . THR 61 61 10102 1 . SER 62 62 10102 1 . SER 63 63 10102 1 . TRP 64 64 10102 1 . GLN 65 65 10102 1 . ASN 66 66 10102 1 . LEU 67 67 10102 1 . ASP 68 68 10102 1 . ALA 69 69 10102 1 . LYS 70 70 10102 1 . VAL 71 71 10102 1 . PRO 72 72 10102 1 . THR 73 73 10102 1 . GLU 74 74 10102 1 . ARG 75 75 10102 1 . SER 76 76 10102 1 . ALA 77 77 10102 1 . VAL 78 78 10102 1 . LEU 79 79 10102 1 . VAL 80 80 10102 1 . ASN 81 81 10102 1 . LEU 82 82 10102 1 . LYS 83 83 10102 1 . LYS 84 84 10102 1 . GLY 85 85 10102 1 . VAL 86 86 10102 1 . THR 87 87 10102 1 . TYR 88 88 10102 1 . GLU 89 89 10102 1 . ILE 90 90 10102 1 . LYS 91 91 10102 1 . VAL 92 92 10102 1 . ARG 93 93 10102 1 . PRO 94 94 10102 1 . TYR 95 95 10102 1 . PHE 96 96 10102 1 . ASN 97 97 10102 1 . GLU 98 98 10102 1 . PHE 99 99 10102 1 . GLN 100 100 10102 1 . GLY 101 101 10102 1 . MET 102 102 10102 1 . ASP 103 103 10102 1 . SER 104 104 10102 1 . GLU 105 105 10102 1 . SER 106 106 10102 1 . LYS 107 107 10102 1 . THR 108 108 10102 1 . VAL 109 109 10102 1 . ARG 110 110 10102 1 . THR 111 111 10102 1 . THR 112 112 10102 1 . GLU 113 113 10102 1 . GLU 114 114 10102 1 . SER 115 115 10102 1 . GLY 116 116 10102 1 . PRO 117 117 10102 1 . SER 118 118 10102 1 . SER 119 119 10102 1 . GLY 120 120 10102 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 10102 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 . . . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 10102 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 10102 _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 . . P021007-59 . . . . . . 10102 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10102 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'FN3 domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.0 . . mM . . . . 10102 1 2 phosphate . . . . . . buffer 20 . . mM . . . . 10102 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10102 1 4 NaN3 . . . . . . . 0.02 . . % . . . . 10102 1 5 H2O . . . . . . solvent 90 . . % . . . . 10102 1 6 D2O . . . . . . solvent 10 . . % . . . . 10102 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 10102 _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 10102 1 pH 6.0 0.05 pH 10102 1 pressure 1 0.001 atm 10102 1 temperature 298 0.1 K 10102 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10102 _Software.ID 1 _Software.Name xwinnmr _Software.Version 2.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10102 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10102 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10102 _Software.ID 2 _Software.Name xwinnmr _Software.Version 3.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10102 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10102 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10102 _Software.ID 3 _Software.Name NMRPipe _Software.Version 200204025 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10102 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10102 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10102 _Software.ID 4 _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.' . . 10102 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10102 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10102 _Software.ID 5 _Software.Name Kujira _Software.Version 0.816 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10102 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10102 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 10102 _Software.ID 6 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10102 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10102 6 'structure solution' 10102 6 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 10102 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 10102 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10102 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . . . . . . . . . . . . . . . . . . . 10102 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . . . . . . . . . . . . . . . . . . . 10102 1 3 '2D TROSY HNCO' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . . . . . . . . . . . . . . . . . . . 10102 1 stop_ save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10102 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10102 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_2D_TROSY_HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_TROSY_HNCO _NMR_spec_expt.Entry_ID 10102 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '2D TROSY HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10102 _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 . . . . . . . . . 10102 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10102 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10102 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 10102 _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 10102 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10102 1 3 '2D TROSY HNCO' 1 $sample_1 isotropic 10102 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 4.444 0.030 . 1 . . . . 6 SER HA . 10102 1 2 . 1 1 7 7 GLY H H 1 8.443 0.030 . 1 . . . . 7 GLY H . 10102 1 3 . 1 1 7 7 GLY HA2 H 1 3.950 0.030 . 2 . . . . 7 GLY HA2 . 10102 1 4 . 1 1 7 7 GLY HA3 H 1 3.832 0.030 . 2 . . . . 7 GLY HA3 . 10102 1 5 . 1 1 7 7 GLY C C 13 174.832 0.300 . 1 . . . . 7 GLY C . 10102 1 6 . 1 1 7 7 GLY CA C 13 46.199 0.300 . 1 . . . . 7 GLY CA . 10102 1 7 . 1 1 7 7 GLY N N 15 110.784 0.300 . 1 . . . . 7 GLY N . 10102 1 8 . 1 1 8 8 ARG H H 1 8.111 0.030 . 1 . . . . 8 ARG H . 10102 1 9 . 1 1 8 8 ARG HA H 1 4.137 0.030 . 1 . . . . 8 ARG HA . 10102 1 10 . 1 1 8 8 ARG HB2 H 1 1.780 0.030 . 1 . . . . 8 ARG HB2 . 10102 1 11 . 1 1 8 8 ARG HB3 H 1 1.780 0.030 . 1 . . . . 8 ARG HB3 . 10102 1 12 . 1 1 8 8 ARG HG2 H 1 1.647 0.030 . 2 . . . . 8 ARG HG2 . 10102 1 13 . 1 1 8 8 ARG HG3 H 1 1.582 0.030 . 2 . . . . 8 ARG HG3 . 10102 1 14 . 1 1 8 8 ARG HD2 H 1 3.163 0.030 . 1 . . . . 8 ARG HD2 . 10102 1 15 . 1 1 8 8 ARG HD3 H 1 3.163 0.030 . 1 . . . . 8 ARG HD3 . 10102 1 16 . 1 1 8 8 ARG HE H 1 7.362 0.030 . 1 . . . . 8 ARG HE . 10102 1 17 . 1 1 8 8 ARG C C 13 177.673 0.300 . 1 . . . . 8 ARG C . 10102 1 18 . 1 1 8 8 ARG CA C 13 57.453 0.300 . 1 . . . . 8 ARG CA . 10102 1 19 . 1 1 8 8 ARG CB C 13 30.256 0.300 . 1 . . . . 8 ARG CB . 10102 1 20 . 1 1 8 8 ARG CG C 13 27.208 0.300 . 1 . . . . 8 ARG CG . 10102 1 21 . 1 1 8 8 ARG CD C 13 43.386 0.300 . 1 . . . . 8 ARG CD . 10102 1 22 . 1 1 8 8 ARG N N 15 120.330 0.300 . 1 . . . . 8 ARG N . 10102 1 23 . 1 1 8 8 ARG NE N 15 84.531 0.300 . 1 . . . . 8 ARG NE . 10102 1 24 . 1 1 9 9 GLN H H 1 8.216 0.030 . 1 . . . . 9 GLN H . 10102 1 25 . 1 1 9 9 GLN HA H 1 4.110 0.030 . 1 . . . . 9 GLN HA . 10102 1 26 . 1 1 9 9 GLN HB2 H 1 1.962 0.030 . 1 . . . . 9 GLN HB2 . 10102 1 27 . 1 1 9 9 GLN HB3 H 1 1.962 0.030 . 1 . . . . 9 GLN HB3 . 10102 1 28 . 1 1 9 9 GLN HG2 H 1 2.326 0.030 . 1 . . . . 9 GLN HG2 . 10102 1 29 . 1 1 9 9 GLN HG3 H 1 2.326 0.030 . 1 . . . . 9 GLN HG3 . 10102 1 30 . 1 1 9 9 GLN HE21 H 1 7.694 0.030 . 2 . . . . 9 GLN HE21 . 10102 1 31 . 1 1 9 9 GLN HE22 H 1 6.673 0.030 . 2 . . . . 9 GLN HE22 . 10102 1 32 . 1 1 9 9 GLN C C 13 177.284 0.300 . 1 . . . . 9 GLN C . 10102 1 33 . 1 1 9 9 GLN CA C 13 57.453 0.300 . 1 . . . . 9 GLN CA . 10102 1 34 . 1 1 9 9 GLN CB C 13 28.230 0.300 . 1 . . . . 9 GLN CB . 10102 1 35 . 1 1 9 9 GLN CG C 13 33.560 0.300 . 1 . . . . 9 GLN CG . 10102 1 36 . 1 1 9 9 GLN N N 15 120.973 0.300 . 1 . . . . 9 GLN N . 10102 1 37 . 1 1 9 9 GLN NE2 N 15 112.462 0.300 . 1 . . . . 9 GLN NE2 . 10102 1 38 . 1 1 10 10 VAL H H 1 7.731 0.030 . 1 . . . . 10 VAL H . 10102 1 39 . 1 1 10 10 VAL HA H 1 3.361 0.030 . 1 . . . . 10 VAL HA . 10102 1 40 . 1 1 10 10 VAL HB H 1 1.572 0.030 . 1 . . . . 10 VAL HB . 10102 1 41 . 1 1 10 10 VAL HG11 H 1 0.429 0.030 . 1 . . . . 10 VAL HG1 . 10102 1 42 . 1 1 10 10 VAL HG12 H 1 0.429 0.030 . 1 . . . . 10 VAL HG1 . 10102 1 43 . 1 1 10 10 VAL HG13 H 1 0.429 0.030 . 1 . . . . 10 VAL HG1 . 10102 1 44 . 1 1 10 10 VAL HG21 H 1 0.397 0.030 . 1 . . . . 10 VAL HG2 . 10102 1 45 . 1 1 10 10 VAL HG22 H 1 0.397 0.030 . 1 . . . . 10 VAL HG2 . 10102 1 46 . 1 1 10 10 VAL HG23 H 1 0.397 0.030 . 1 . . . . 10 VAL HG2 . 10102 1 47 . 1 1 10 10 VAL C C 13 177.090 0.300 . 1 . . . . 10 VAL C . 10102 1 48 . 1 1 10 10 VAL CA C 13 65.188 0.300 . 1 . . . . 10 VAL CA . 10102 1 49 . 1 1 10 10 VAL CB C 13 31.520 0.300 . 1 . . . . 10 VAL CB . 10102 1 50 . 1 1 10 10 VAL CG1 C 13 21.082 0.300 . 2 . . . . 10 VAL CG1 . 10102 1 51 . 1 1 10 10 VAL CG2 C 13 21.268 0.300 . 2 . . . . 10 VAL CG2 . 10102 1 52 . 1 1 10 10 VAL N N 15 120.205 0.300 . 1 . . . . 10 VAL N . 10102 1 53 . 1 1 11 11 GLN H H 1 7.949 0.030 . 1 . . . . 11 GLN H . 10102 1 54 . 1 1 11 11 GLN HA H 1 3.727 0.030 . 1 . . . . 11 GLN HA . 10102 1 55 . 1 1 11 11 GLN HB2 H 1 1.922 0.030 . 2 . . . . 11 GLN HB2 . 10102 1 56 . 1 1 11 11 GLN HB3 H 1 1.802 0.030 . 2 . . . . 11 GLN HB3 . 10102 1 57 . 1 1 11 11 GLN HG2 H 1 2.097 0.030 . 1 . . . . 11 GLN HG2 . 10102 1 58 . 1 1 11 11 GLN HG3 H 1 2.097 0.030 . 1 . . . . 11 GLN HG3 . 10102 1 59 . 1 1 11 11 GLN HE21 H 1 7.214 0.030 . 2 . . . . 11 GLN HE21 . 10102 1 60 . 1 1 11 11 GLN HE22 H 1 6.683 0.030 . 2 . . . . 11 GLN HE22 . 10102 1 61 . 1 1 11 11 GLN C C 13 178.304 0.300 . 1 . . . . 11 GLN C . 10102 1 62 . 1 1 11 11 GLN CA C 13 58.682 0.300 . 1 . . . . 11 GLN CA . 10102 1 63 . 1 1 11 11 GLN CB C 13 28.615 0.300 . 1 . . . . 11 GLN CB . 10102 1 64 . 1 1 11 11 GLN CG C 13 34.242 0.300 . 1 . . . . 11 GLN CG . 10102 1 65 . 1 1 11 11 GLN N N 15 118.817 0.300 . 1 . . . . 11 GLN N . 10102 1 66 . 1 1 11 11 GLN NE2 N 15 112.121 0.300 . 1 . . . . 11 GLN NE2 . 10102 1 67 . 1 1 12 12 LYS H H 1 7.864 0.030 . 1 . . . . 12 LYS H . 10102 1 68 . 1 1 12 12 LYS HA H 1 4.003 0.030 . 1 . . . . 12 LYS HA . 10102 1 69 . 1 1 12 12 LYS HB2 H 1 1.848 0.030 . 1 . . . . 12 LYS HB2 . 10102 1 70 . 1 1 12 12 LYS HB3 H 1 1.848 0.030 . 1 . . . . 12 LYS HB3 . 10102 1 71 . 1 1 12 12 LYS HG2 H 1 1.436 0.030 . 2 . . . . 12 LYS HG2 . 10102 1 72 . 1 1 12 12 LYS HG3 H 1 1.378 0.030 . 2 . . . . 12 LYS HG3 . 10102 1 73 . 1 1 12 12 LYS HD2 H 1 1.632 0.030 . 1 . . . . 12 LYS HD2 . 10102 1 74 . 1 1 12 12 LYS HD3 H 1 1.632 0.030 . 1 . . . . 12 LYS HD3 . 10102 1 75 . 1 1 12 12 LYS HE2 H 1 2.936 0.030 . 1 . . . . 12 LYS HE2 . 10102 1 76 . 1 1 12 12 LYS HE3 H 1 2.936 0.030 . 1 . . . . 12 LYS HE3 . 10102 1 77 . 1 1 12 12 LYS C C 13 178.547 0.300 . 1 . . . . 12 LYS C . 10102 1 78 . 1 1 12 12 LYS CA C 13 58.786 0.300 . 1 . . . . 12 LYS CA . 10102 1 79 . 1 1 12 12 LYS CB C 13 32.346 0.300 . 1 . . . . 12 LYS CB . 10102 1 80 . 1 1 12 12 LYS CG C 13 24.816 0.300 . 1 . . . . 12 LYS CG . 10102 1 81 . 1 1 12 12 LYS CD C 13 28.999 0.300 . 1 . . . . 12 LYS CD . 10102 1 82 . 1 1 12 12 LYS CE C 13 41.748 0.300 . 1 . . . . 12 LYS CE . 10102 1 83 . 1 1 12 12 LYS N N 15 120.984 0.300 . 1 . . . . 12 LYS N . 10102 1 84 . 1 1 13 13 GLU H H 1 8.038 0.030 . 1 . . . . 13 GLU H . 10102 1 85 . 1 1 13 13 GLU HA H 1 4.103 0.030 . 1 . . . . 13 GLU HA . 10102 1 86 . 1 1 13 13 GLU HB2 H 1 2.050 0.030 . 1 . . . . 13 GLU HB2 . 10102 1 87 . 1 1 13 13 GLU HB3 H 1 2.050 0.030 . 1 . . . . 13 GLU HB3 . 10102 1 88 . 1 1 13 13 GLU HG2 H 1 2.384 0.030 . 2 . . . . 13 GLU HG2 . 10102 1 89 . 1 1 13 13 GLU HG3 H 1 2.215 0.030 . 2 . . . . 13 GLU HG3 . 10102 1 90 . 1 1 13 13 GLU C C 13 179.445 0.300 . 1 . . . . 13 GLU C . 10102 1 91 . 1 1 13 13 GLU CA C 13 59.394 0.300 . 1 . . . . 13 GLU CA . 10102 1 92 . 1 1 13 13 GLU CB C 13 29.740 0.300 . 1 . . . . 13 GLU CB . 10102 1 93 . 1 1 13 13 GLU CG C 13 37.230 0.300 . 1 . . . . 13 GLU CG . 10102 1 94 . 1 1 13 13 GLU N N 15 118.780 0.300 . 1 . . . . 13 GLU N . 10102 1 95 . 1 1 14 14 LEU H H 1 8.354 0.030 . 1 . . . . 14 LEU H . 10102 1 96 . 1 1 14 14 LEU HA H 1 4.097 0.030 . 1 . . . . 14 LEU HA . 10102 1 97 . 1 1 14 14 LEU HB2 H 1 1.680 0.030 . 2 . . . . 14 LEU HB2 . 10102 1 98 . 1 1 14 14 LEU HB3 H 1 1.576 0.030 . 2 . . . . 14 LEU HB3 . 10102 1 99 . 1 1 14 14 LEU HG H 1 1.585 0.030 . 1 . . . . 14 LEU HG . 10102 1 100 . 1 1 14 14 LEU HD11 H 1 0.796 0.030 . 1 . . . . 14 LEU HD1 . 10102 1 101 . 1 1 14 14 LEU HD12 H 1 0.796 0.030 . 1 . . . . 14 LEU HD1 . 10102 1 102 . 1 1 14 14 LEU HD13 H 1 0.796 0.030 . 1 . . . . 14 LEU HD1 . 10102 1 103 . 1 1 14 14 LEU HD21 H 1 0.759 0.030 . 1 . . . . 14 LEU HD2 . 10102 1 104 . 1 1 14 14 LEU HD22 H 1 0.759 0.030 . 1 . . . . 14 LEU HD2 . 10102 1 105 . 1 1 14 14 LEU HD23 H 1 0.759 0.030 . 1 . . . . 14 LEU HD2 . 10102 1 106 . 1 1 14 14 LEU C C 13 178.911 0.300 . 1 . . . . 14 LEU C . 10102 1 107 . 1 1 14 14 LEU CA C 13 57.219 0.300 . 1 . . . . 14 LEU CA . 10102 1 108 . 1 1 14 14 LEU CB C 13 42.065 0.300 . 1 . . . . 14 LEU CB . 10102 1 109 . 1 1 14 14 LEU CG C 13 26.974 0.300 . 1 . . . . 14 LEU CG . 10102 1 110 . 1 1 14 14 LEU CD1 C 13 25.121 0.300 . 2 . . . . 14 LEU CD1 . 10102 1 111 . 1 1 14 14 LEU CD2 C 13 25.160 0.300 . 2 . . . . 14 LEU CD2 . 10102 1 112 . 1 1 14 14 LEU N N 15 119.226 0.300 . 1 . . . . 14 LEU N . 10102 1 113 . 1 1 15 15 GLY H H 1 7.963 0.030 . 1 . . . . 15 GLY H . 10102 1 114 . 1 1 15 15 GLY HA2 H 1 4.052 0.030 . 2 . . . . 15 GLY HA2 . 10102 1 115 . 1 1 15 15 GLY HA3 H 1 3.930 0.030 . 2 . . . . 15 GLY HA3 . 10102 1 116 . 1 1 15 15 GLY C C 13 173.473 0.300 . 1 . . . . 15 GLY C . 10102 1 117 . 1 1 15 15 GLY CA C 13 46.290 0.300 . 1 . . . . 15 GLY CA . 10102 1 118 . 1 1 15 15 GLY N N 15 105.826 0.300 . 1 . . . . 15 GLY N . 10102 1 119 . 1 1 16 16 ASP H H 1 7.472 0.030 . 1 . . . . 16 ASP H . 10102 1 120 . 1 1 16 16 ASP HA H 1 4.830 0.030 . 1 . . . . 16 ASP HA . 10102 1 121 . 1 1 16 16 ASP HB2 H 1 2.746 0.030 . 2 . . . . 16 ASP HB2 . 10102 1 122 . 1 1 16 16 ASP HB3 H 1 2.680 0.030 . 2 . . . . 16 ASP HB3 . 10102 1 123 . 1 1 16 16 ASP C C 13 176.313 0.300 . 1 . . . . 16 ASP C . 10102 1 124 . 1 1 16 16 ASP CA C 13 54.219 0.300 . 1 . . . . 16 ASP CA . 10102 1 125 . 1 1 16 16 ASP CB C 13 41.979 0.300 . 1 . . . . 16 ASP CB . 10102 1 126 . 1 1 16 16 ASP N N 15 118.298 0.300 . 1 . . . . 16 ASP N . 10102 1 127 . 1 1 17 17 VAL H H 1 7.358 0.030 . 1 . . . . 17 VAL H . 10102 1 128 . 1 1 17 17 VAL HA H 1 3.964 0.030 . 1 . . . . 17 VAL HA . 10102 1 129 . 1 1 17 17 VAL HB H 1 2.222 0.030 . 1 . . . . 17 VAL HB . 10102 1 130 . 1 1 17 17 VAL HG11 H 1 1.136 0.030 . 1 . . . . 17 VAL HG1 . 10102 1 131 . 1 1 17 17 VAL HG12 H 1 1.136 0.030 . 1 . . . . 17 VAL HG1 . 10102 1 132 . 1 1 17 17 VAL HG13 H 1 1.136 0.030 . 1 . . . . 17 VAL HG1 . 10102 1 133 . 1 1 17 17 VAL HG21 H 1 1.031 0.030 . 1 . . . . 17 VAL HG2 . 10102 1 134 . 1 1 17 17 VAL HG22 H 1 1.031 0.030 . 1 . . . . 17 VAL HG2 . 10102 1 135 . 1 1 17 17 VAL HG23 H 1 1.031 0.030 . 1 . . . . 17 VAL HG2 . 10102 1 136 . 1 1 17 17 VAL C C 13 174.832 0.300 . 1 . . . . 17 VAL C . 10102 1 137 . 1 1 17 17 VAL CA C 13 63.549 0.300 . 1 . . . . 17 VAL CA . 10102 1 138 . 1 1 17 17 VAL CB C 13 32.057 0.300 . 1 . . . . 17 VAL CB . 10102 1 139 . 1 1 17 17 VAL CG1 C 13 22.754 0.300 . 2 . . . . 17 VAL CG1 . 10102 1 140 . 1 1 17 17 VAL CG2 C 13 21.816 0.300 . 2 . . . . 17 VAL CG2 . 10102 1 141 . 1 1 17 17 VAL N N 15 119.380 0.300 . 1 . . . . 17 VAL N . 10102 1 142 . 1 1 18 18 LEU H H 1 8.683 0.030 . 1 . . . . 18 LEU H . 10102 1 143 . 1 1 18 18 LEU HA H 1 4.665 0.030 . 1 . . . . 18 LEU HA . 10102 1 144 . 1 1 18 18 LEU HB2 H 1 1.644 0.030 . 2 . . . . 18 LEU HB2 . 10102 1 145 . 1 1 18 18 LEU HB3 H 1 1.563 0.030 . 2 . . . . 18 LEU HB3 . 10102 1 146 . 1 1 18 18 LEU HG H 1 1.529 0.030 . 1 . . . . 18 LEU HG . 10102 1 147 . 1 1 18 18 LEU HD11 H 1 0.951 0.030 . 1 . . . . 18 LEU HD1 . 10102 1 148 . 1 1 18 18 LEU HD12 H 1 0.951 0.030 . 1 . . . . 18 LEU HD1 . 10102 1 149 . 1 1 18 18 LEU HD13 H 1 0.951 0.030 . 1 . . . . 18 LEU HD1 . 10102 1 150 . 1 1 18 18 LEU HD21 H 1 0.886 0.030 . 1 . . . . 18 LEU HD2 . 10102 1 151 . 1 1 18 18 LEU HD22 H 1 0.886 0.030 . 1 . . . . 18 LEU HD2 . 10102 1 152 . 1 1 18 18 LEU HD23 H 1 0.886 0.030 . 1 . . . . 18 LEU HD2 . 10102 1 153 . 1 1 18 18 LEU C C 13 174.918 0.300 . 1 . . . . 18 LEU C . 10102 1 154 . 1 1 18 18 LEU CA C 13 54.004 0.300 . 1 . . . . 18 LEU CA . 10102 1 155 . 1 1 18 18 LEU CB C 13 43.367 0.300 . 1 . . . . 18 LEU CB . 10102 1 156 . 1 1 18 18 LEU CG C 13 27.332 0.300 . 1 . . . . 18 LEU CG . 10102 1 157 . 1 1 18 18 LEU CD1 C 13 24.476 0.300 . 2 . . . . 18 LEU CD1 . 10102 1 158 . 1 1 18 18 LEU CD2 C 13 24.634 0.300 . 2 . . . . 18 LEU CD2 . 10102 1 159 . 1 1 18 18 LEU N N 15 131.400 0.300 . 1 . . . . 18 LEU N . 10102 1 160 . 1 1 19 19 VAL H H 1 8.621 0.030 . 1 . . . . 19 VAL H . 10102 1 161 . 1 1 19 19 VAL HA H 1 4.641 0.030 . 1 . . . . 19 VAL HA . 10102 1 162 . 1 1 19 19 VAL HB H 1 1.928 0.030 . 1 . . . . 19 VAL HB . 10102 1 163 . 1 1 19 19 VAL HG11 H 1 0.965 0.030 . 1 . . . . 19 VAL HG1 . 10102 1 164 . 1 1 19 19 VAL HG12 H 1 0.965 0.030 . 1 . . . . 19 VAL HG1 . 10102 1 165 . 1 1 19 19 VAL HG13 H 1 0.965 0.030 . 1 . . . . 19 VAL HG1 . 10102 1 166 . 1 1 19 19 VAL HG21 H 1 0.686 0.030 . 1 . . . . 19 VAL HG2 . 10102 1 167 . 1 1 19 19 VAL HG22 H 1 0.686 0.030 . 1 . . . . 19 VAL HG2 . 10102 1 168 . 1 1 19 19 VAL HG23 H 1 0.686 0.030 . 1 . . . . 19 VAL HG2 . 10102 1 169 . 1 1 19 19 VAL C C 13 174.857 0.300 . 1 . . . . 19 VAL C . 10102 1 170 . 1 1 19 19 VAL CA C 13 61.195 0.300 . 1 . . . . 19 VAL CA . 10102 1 171 . 1 1 19 19 VAL CB C 13 32.859 0.300 . 1 . . . . 19 VAL CB . 10102 1 172 . 1 1 19 19 VAL CG1 C 13 22.285 0.300 . 2 . . . . 19 VAL CG1 . 10102 1 173 . 1 1 19 19 VAL CG2 C 13 22.050 0.300 . 2 . . . . 19 VAL CG2 . 10102 1 174 . 1 1 19 19 VAL N N 15 126.337 0.300 . 1 . . . . 19 VAL N . 10102 1 175 . 1 1 20 20 ARG H H 1 8.766 0.030 . 1 . . . . 20 ARG H . 10102 1 176 . 1 1 20 20 ARG HA H 1 4.687 0.030 . 1 . . . . 20 ARG HA . 10102 1 177 . 1 1 20 20 ARG HB2 H 1 1.734 0.030 . 1 . . . . 20 ARG HB2 . 10102 1 178 . 1 1 20 20 ARG HB3 H 1 1.734 0.030 . 1 . . . . 20 ARG HB3 . 10102 1 179 . 1 1 20 20 ARG HG2 H 1 1.573 0.030 . 2 . . . . 20 ARG HG2 . 10102 1 180 . 1 1 20 20 ARG HG3 H 1 1.499 0.030 . 2 . . . . 20 ARG HG3 . 10102 1 181 . 1 1 20 20 ARG HD2 H 1 3.187 0.030 . 2 . . . . 20 ARG HD2 . 10102 1 182 . 1 1 20 20 ARG HD3 H 1 3.169 0.030 . 2 . . . . 20 ARG HD3 . 10102 1 183 . 1 1 20 20 ARG C C 13 174.662 0.300 . 1 . . . . 20 ARG C . 10102 1 184 . 1 1 20 20 ARG CA C 13 54.196 0.300 . 1 . . . . 20 ARG CA . 10102 1 185 . 1 1 20 20 ARG CB C 13 31.429 0.300 . 1 . . . . 20 ARG CB . 10102 1 186 . 1 1 20 20 ARG CG C 13 27.443 0.300 . 1 . . . . 20 ARG CG . 10102 1 187 . 1 1 20 20 ARG CD C 13 43.386 0.300 . 1 . . . . 20 ARG CD . 10102 1 188 . 1 1 20 20 ARG N N 15 126.599 0.300 . 1 . . . . 20 ARG N . 10102 1 189 . 1 1 21 21 LEU H H 1 9.008 0.030 . 1 . . . . 21 LEU H . 10102 1 190 . 1 1 21 21 LEU HA H 1 4.622 0.030 . 1 . . . . 21 LEU HA . 10102 1 191 . 1 1 21 21 LEU HB2 H 1 1.991 0.030 . 2 . . . . 21 LEU HB2 . 10102 1 192 . 1 1 21 21 LEU HB3 H 1 1.472 0.030 . 2 . . . . 21 LEU HB3 . 10102 1 193 . 1 1 21 21 LEU HG H 1 1.982 0.030 . 1 . . . . 21 LEU HG . 10102 1 194 . 1 1 21 21 LEU HD11 H 1 0.978 0.030 . 1 . . . . 21 LEU HD1 . 10102 1 195 . 1 1 21 21 LEU HD12 H 1 0.978 0.030 . 1 . . . . 21 LEU HD1 . 10102 1 196 . 1 1 21 21 LEU HD13 H 1 0.978 0.030 . 1 . . . . 21 LEU HD1 . 10102 1 197 . 1 1 21 21 LEU HD21 H 1 1.065 0.030 . 1 . . . . 21 LEU HD2 . 10102 1 198 . 1 1 21 21 LEU HD22 H 1 1.065 0.030 . 1 . . . . 21 LEU HD2 . 10102 1 199 . 1 1 21 21 LEU HD23 H 1 1.065 0.030 . 1 . . . . 21 LEU HD2 . 10102 1 200 . 1 1 21 21 LEU C C 13 177.357 0.300 . 1 . . . . 21 LEU C . 10102 1 201 . 1 1 21 21 LEU CA C 13 54.373 0.300 . 1 . . . . 21 LEU CA . 10102 1 202 . 1 1 21 21 LEU CB C 13 44.187 0.300 . 1 . . . . 21 LEU CB . 10102 1 203 . 1 1 21 21 LEU CG C 13 26.999 0.300 . 1 . . . . 21 LEU CG . 10102 1 204 . 1 1 21 21 LEU CD1 C 13 27.540 0.300 . 2 . . . . 21 LEU CD1 . 10102 1 205 . 1 1 21 21 LEU CD2 C 13 25.469 0.300 . 2 . . . . 21 LEU CD2 . 10102 1 206 . 1 1 21 21 LEU N N 15 126.648 0.300 . 1 . . . . 21 LEU N . 10102 1 207 . 1 1 22 22 HIS H H 1 8.289 0.030 . 1 . . . . 22 HIS H . 10102 1 208 . 1 1 22 22 HIS HA H 1 4.861 0.030 . 1 . . . . 22 HIS HA . 10102 1 209 . 1 1 22 22 HIS HB2 H 1 3.193 0.030 . 1 . . . . 22 HIS HB2 . 10102 1 210 . 1 1 22 22 HIS HB3 H 1 3.193 0.030 . 1 . . . . 22 HIS HB3 . 10102 1 211 . 1 1 22 22 HIS HD2 H 1 6.812 0.030 . 1 . . . . 22 HIS HD2 . 10102 1 212 . 1 1 22 22 HIS HE1 H 1 7.888 0.030 . 1 . . . . 22 HIS HE1 . 10102 1 213 . 1 1 22 22 HIS C C 13 175.973 0.300 . 1 . . . . 22 HIS C . 10102 1 214 . 1 1 22 22 HIS CA C 13 54.638 0.300 . 1 . . . . 22 HIS CA . 10102 1 215 . 1 1 22 22 HIS CB C 13 30.191 0.300 . 1 . . . . 22 HIS CB . 10102 1 216 . 1 1 22 22 HIS CD2 C 13 119.373 0.300 . 1 . . . . 22 HIS CD2 . 10102 1 217 . 1 1 22 22 HIS CE1 C 13 137.549 0.300 . 1 . . . . 22 HIS CE1 . 10102 1 218 . 1 1 22 22 HIS N N 15 123.930 0.300 . 1 . . . . 22 HIS N . 10102 1 219 . 1 1 23 23 ASN H H 1 9.027 0.030 . 1 . . . . 23 ASN H . 10102 1 220 . 1 1 23 23 ASN HA H 1 4.784 0.030 . 1 . . . . 23 ASN HA . 10102 1 221 . 1 1 23 23 ASN HB2 H 1 2.887 0.030 . 2 . . . . 23 ASN HB2 . 10102 1 222 . 1 1 23 23 ASN HB3 H 1 2.791 0.030 . 2 . . . . 23 ASN HB3 . 10102 1 223 . 1 1 23 23 ASN HD21 H 1 7.776 0.030 . 2 . . . . 23 ASN HD21 . 10102 1 224 . 1 1 23 23 ASN HD22 H 1 7.104 0.030 . 2 . . . . 23 ASN HD22 . 10102 1 225 . 1 1 23 23 ASN C C 13 174.784 0.300 . 1 . . . . 23 ASN C . 10102 1 226 . 1 1 23 23 ASN CA C 13 52.275 0.300 . 1 . . . . 23 ASN CA . 10102 1 227 . 1 1 23 23 ASN CB C 13 37.023 0.300 . 1 . . . . 23 ASN CB . 10102 1 228 . 1 1 23 23 ASN N N 15 122.023 0.300 . 1 . . . . 23 ASN N . 10102 1 229 . 1 1 23 23 ASN ND2 N 15 113.132 0.300 . 1 . . . . 23 ASN ND2 . 10102 1 230 . 1 1 24 24 PRO HA H 1 4.848 0.030 . 1 . . . . 24 PRO HA . 10102 1 231 . 1 1 24 24 PRO HB2 H 1 2.072 0.030 . 2 . . . . 24 PRO HB2 . 10102 1 232 . 1 1 24 24 PRO HB3 H 1 1.583 0.030 . 2 . . . . 24 PRO HB3 . 10102 1 233 . 1 1 24 24 PRO HD2 H 1 4.212 0.030 . 2 . . . . 24 PRO HD2 . 10102 1 234 . 1 1 24 24 PRO HD3 H 1 3.818 0.030 . 2 . . . . 24 PRO HD3 . 10102 1 235 . 1 1 24 24 PRO C C 13 174.832 0.300 . 1 . . . . 24 PRO C . 10102 1 236 . 1 1 24 24 PRO CA C 13 62.823 0.300 . 1 . . . . 24 PRO CA . 10102 1 237 . 1 1 24 24 PRO CB C 13 32.681 0.300 . 1 . . . . 24 PRO CB . 10102 1 238 . 1 1 24 24 PRO CG C 13 27.094 0.300 . 1 . . . . 24 PRO CG . 10102 1 239 . 1 1 24 24 PRO CD C 13 51.230 0.300 . 1 . . . . 24 PRO CD . 10102 1 240 . 1 1 25 25 VAL H H 1 8.528 0.030 . 1 . . . . 25 VAL H . 10102 1 241 . 1 1 25 25 VAL HA H 1 4.336 0.030 . 1 . . . . 25 VAL HA . 10102 1 242 . 1 1 25 25 VAL HB H 1 1.949 0.030 . 1 . . . . 25 VAL HB . 10102 1 243 . 1 1 25 25 VAL HG11 H 1 0.989 0.030 . 1 . . . . 25 VAL HG1 . 10102 1 244 . 1 1 25 25 VAL HG12 H 1 0.989 0.030 . 1 . . . . 25 VAL HG1 . 10102 1 245 . 1 1 25 25 VAL HG13 H 1 0.989 0.030 . 1 . . . . 25 VAL HG1 . 10102 1 246 . 1 1 25 25 VAL HG21 H 1 0.861 0.030 . 1 . . . . 25 VAL HG2 . 10102 1 247 . 1 1 25 25 VAL HG22 H 1 0.861 0.030 . 1 . . . . 25 VAL HG2 . 10102 1 248 . 1 1 25 25 VAL HG23 H 1 0.861 0.030 . 1 . . . . 25 VAL HG2 . 10102 1 249 . 1 1 25 25 VAL C C 13 175.075 0.300 . 1 . . . . 25 VAL C . 10102 1 250 . 1 1 25 25 VAL CA C 13 61.205 0.300 . 1 . . . . 25 VAL CA . 10102 1 251 . 1 1 25 25 VAL CB C 13 35.649 0.300 . 1 . . . . 25 VAL CB . 10102 1 252 . 1 1 25 25 VAL CG1 C 13 21.257 0.300 . 2 . . . . 25 VAL CG1 . 10102 1 253 . 1 1 25 25 VAL CG2 C 13 20.972 0.300 . 2 . . . . 25 VAL CG2 . 10102 1 254 . 1 1 25 25 VAL N N 15 121.590 0.300 . 1 . . . . 25 VAL N . 10102 1 255 . 1 1 26 26 VAL H H 1 8.953 0.030 . 1 . . . . 26 VAL H . 10102 1 256 . 1 1 26 26 VAL HA H 1 3.964 0.030 . 1 . . . . 26 VAL HA . 10102 1 257 . 1 1 26 26 VAL HB H 1 2.056 0.030 . 1 . . . . 26 VAL HB . 10102 1 258 . 1 1 26 26 VAL HG11 H 1 0.981 0.030 . 1 . . . . 26 VAL HG1 . 10102 1 259 . 1 1 26 26 VAL HG12 H 1 0.981 0.030 . 1 . . . . 26 VAL HG1 . 10102 1 260 . 1 1 26 26 VAL HG13 H 1 0.981 0.030 . 1 . . . . 26 VAL HG1 . 10102 1 261 . 1 1 26 26 VAL HG21 H 1 0.917 0.030 . 1 . . . . 26 VAL HG2 . 10102 1 262 . 1 1 26 26 VAL HG22 H 1 0.917 0.030 . 1 . . . . 26 VAL HG2 . 10102 1 263 . 1 1 26 26 VAL HG23 H 1 0.917 0.030 . 1 . . . . 26 VAL HG2 . 10102 1 264 . 1 1 26 26 VAL C C 13 175.998 0.300 . 1 . . . . 26 VAL C . 10102 1 265 . 1 1 26 26 VAL CA C 13 63.784 0.300 . 1 . . . . 26 VAL CA . 10102 1 266 . 1 1 26 26 VAL CB C 13 31.577 0.300 . 1 . . . . 26 VAL CB . 10102 1 267 . 1 1 26 26 VAL CG1 C 13 22.519 0.300 . 2 . . . . 26 VAL CG1 . 10102 1 268 . 1 1 26 26 VAL CG2 C 13 22.050 0.300 . 2 . . . . 26 VAL CG2 . 10102 1 269 . 1 1 26 26 VAL N N 15 128.709 0.300 . 1 . . . . 26 VAL N . 10102 1 270 . 1 1 27 27 LEU H H 1 8.495 0.030 . 1 . . . . 27 LEU H . 10102 1 271 . 1 1 27 27 LEU HA H 1 4.406 0.030 . 1 . . . . 27 LEU HA . 10102 1 272 . 1 1 27 27 LEU HB2 H 1 1.994 0.030 . 2 . . . . 27 LEU HB2 . 10102 1 273 . 1 1 27 27 LEU HB3 H 1 1.411 0.030 . 2 . . . . 27 LEU HB3 . 10102 1 274 . 1 1 27 27 LEU HG H 1 1.617 0.030 . 1 . . . . 27 LEU HG . 10102 1 275 . 1 1 27 27 LEU HD11 H 1 0.842 0.030 . 1 . . . . 27 LEU HD1 . 10102 1 276 . 1 1 27 27 LEU HD12 H 1 0.842 0.030 . 1 . . . . 27 LEU HD1 . 10102 1 277 . 1 1 27 27 LEU HD13 H 1 0.842 0.030 . 1 . . . . 27 LEU HD1 . 10102 1 278 . 1 1 27 27 LEU HD21 H 1 0.766 0.030 . 1 . . . . 27 LEU HD2 . 10102 1 279 . 1 1 27 27 LEU HD22 H 1 0.766 0.030 . 1 . . . . 27 LEU HD2 . 10102 1 280 . 1 1 27 27 LEU HD23 H 1 0.766 0.030 . 1 . . . . 27 LEU HD2 . 10102 1 281 . 1 1 27 27 LEU C C 13 177.624 0.300 . 1 . . . . 27 LEU C . 10102 1 282 . 1 1 27 27 LEU CA C 13 56.515 0.300 . 1 . . . . 27 LEU CA . 10102 1 283 . 1 1 27 27 LEU CB C 13 42.767 0.300 . 1 . . . . 27 LEU CB . 10102 1 284 . 1 1 27 27 LEU CG C 13 26.505 0.300 . 1 . . . . 27 LEU CG . 10102 1 285 . 1 1 27 27 LEU CD1 C 13 26.226 0.300 . 2 . . . . 27 LEU CD1 . 10102 1 286 . 1 1 27 27 LEU CD2 C 13 22.004 0.300 . 2 . . . . 27 LEU CD2 . 10102 1 287 . 1 1 27 27 LEU N N 15 130.413 0.300 . 1 . . . . 27 LEU N . 10102 1 288 . 1 1 28 28 THR H H 1 8.387 0.030 . 1 . . . . 28 THR H . 10102 1 289 . 1 1 28 28 THR HA H 1 4.841 0.030 . 1 . . . . 28 THR HA . 10102 1 290 . 1 1 28 28 THR HB H 1 4.662 0.030 . 1 . . . . 28 THR HB . 10102 1 291 . 1 1 28 28 THR HG21 H 1 1.157 0.030 . 1 . . . . 28 THR HG2 . 10102 1 292 . 1 1 28 28 THR HG22 H 1 1.157 0.030 . 1 . . . . 28 THR HG2 . 10102 1 293 . 1 1 28 28 THR HG23 H 1 1.157 0.030 . 1 . . . . 28 THR HG2 . 10102 1 294 . 1 1 28 28 THR C C 13 171.725 0.300 . 1 . . . . 28 THR C . 10102 1 295 . 1 1 28 28 THR CA C 13 59.138 0.300 . 1 . . . . 28 THR CA . 10102 1 296 . 1 1 28 28 THR CB C 13 70.021 0.300 . 1 . . . . 28 THR CB . 10102 1 297 . 1 1 28 28 THR N N 15 112.242 0.300 . 1 . . . . 28 THR N . 10102 1 298 . 1 1 29 29 PRO HA H 1 4.323 0.030 . 1 . . . . 29 PRO HA . 10102 1 299 . 1 1 29 29 PRO HB2 H 1 2.417 0.030 . 2 . . . . 29 PRO HB2 . 10102 1 300 . 1 1 29 29 PRO HB3 H 1 1.792 0.030 . 2 . . . . 29 PRO HB3 . 10102 1 301 . 1 1 29 29 PRO HG2 H 1 2.109 0.030 . 2 . . . . 29 PRO HG2 . 10102 1 302 . 1 1 29 29 PRO HG3 H 1 1.876 0.030 . 2 . . . . 29 PRO HG3 . 10102 1 303 . 1 1 29 29 PRO HD2 H 1 3.908 0.030 . 2 . . . . 29 PRO HD2 . 10102 1 304 . 1 1 29 29 PRO HD3 H 1 3.688 0.030 . 2 . . . . 29 PRO HD3 . 10102 1 305 . 1 1 29 29 PRO C C 13 174.055 0.300 . 1 . . . . 29 PRO C . 10102 1 306 . 1 1 29 29 PRO CA C 13 65.743 0.300 . 1 . . . . 29 PRO CA . 10102 1 307 . 1 1 29 29 PRO CB C 13 32.791 0.300 . 1 . . . . 29 PRO CB . 10102 1 308 . 1 1 29 29 PRO CG C 13 28.157 0.300 . 1 . . . . 29 PRO CG . 10102 1 309 . 1 1 29 29 PRO CD C 13 50.546 0.300 . 1 . . . . 29 PRO CD . 10102 1 310 . 1 1 30 30 THR H H 1 7.062 0.030 . 1 . . . . 30 THR H . 10102 1 311 . 1 1 30 30 THR HA H 1 4.537 0.030 . 1 . . . . 30 THR HA . 10102 1 312 . 1 1 30 30 THR HB H 1 4.654 0.030 . 1 . . . . 30 THR HB . 10102 1 313 . 1 1 30 30 THR HG21 H 1 1.124 0.030 . 1 . . . . 30 THR HG2 . 10102 1 314 . 1 1 30 30 THR HG22 H 1 1.124 0.030 . 1 . . . . 30 THR HG2 . 10102 1 315 . 1 1 30 30 THR HG23 H 1 1.124 0.030 . 1 . . . . 30 THR HG2 . 10102 1 316 . 1 1 30 30 THR C C 13 174.492 0.300 . 1 . . . . 30 THR C . 10102 1 317 . 1 1 30 30 THR CA C 13 59.449 0.300 . 1 . . . . 30 THR CA . 10102 1 318 . 1 1 30 30 THR CB C 13 70.985 0.300 . 1 . . . . 30 THR CB . 10102 1 319 . 1 1 30 30 THR CG2 C 13 21.347 0.300 . 1 . . . . 30 THR CG2 . 10102 1 320 . 1 1 30 30 THR N N 15 97.474 0.300 . 1 . . . . 30 THR N . 10102 1 321 . 1 1 31 31 THR H H 1 7.609 0.030 . 1 . . . . 31 THR H . 10102 1 322 . 1 1 31 31 THR HA H 1 5.569 0.030 . 1 . . . . 31 THR HA . 10102 1 323 . 1 1 31 31 THR HB H 1 3.900 0.030 . 1 . . . . 31 THR HB . 10102 1 324 . 1 1 31 31 THR HG21 H 1 1.129 0.030 . 1 . . . . 31 THR HG2 . 10102 1 325 . 1 1 31 31 THR HG22 H 1 1.129 0.030 . 1 . . . . 31 THR HG2 . 10102 1 326 . 1 1 31 31 THR HG23 H 1 1.129 0.030 . 1 . . . . 31 THR HG2 . 10102 1 327 . 1 1 31 31 THR C C 13 173.376 0.300 . 1 . . . . 31 THR C . 10102 1 328 . 1 1 31 31 THR CA C 13 60.267 0.300 . 1 . . . . 31 THR CA . 10102 1 329 . 1 1 31 31 THR CB C 13 72.492 0.300 . 1 . . . . 31 THR CB . 10102 1 330 . 1 1 31 31 THR CG2 C 13 23.222 0.300 . 1 . . . . 31 THR CG2 . 10102 1 331 . 1 1 31 31 THR N N 15 112.786 0.300 . 1 . . . . 31 THR N . 10102 1 332 . 1 1 32 32 VAL H H 1 8.426 0.030 . 1 . . . . 32 VAL H . 10102 1 333 . 1 1 32 32 VAL HA H 1 4.824 0.030 . 1 . . . . 32 VAL HA . 10102 1 334 . 1 1 32 32 VAL HB H 1 1.523 0.030 . 1 . . . . 32 VAL HB . 10102 1 335 . 1 1 32 32 VAL HG11 H 1 0.667 0.030 . 1 . . . . 32 VAL HG1 . 10102 1 336 . 1 1 32 32 VAL HG12 H 1 0.667 0.030 . 1 . . . . 32 VAL HG1 . 10102 1 337 . 1 1 32 32 VAL HG13 H 1 0.667 0.030 . 1 . . . . 32 VAL HG1 . 10102 1 338 . 1 1 32 32 VAL HG21 H 1 0.686 0.030 . 1 . . . . 32 VAL HG2 . 10102 1 339 . 1 1 32 32 VAL HG22 H 1 0.686 0.030 . 1 . . . . 32 VAL HG2 . 10102 1 340 . 1 1 32 32 VAL HG23 H 1 0.686 0.030 . 1 . . . . 32 VAL HG2 . 10102 1 341 . 1 1 32 32 VAL C C 13 173.206 0.300 . 1 . . . . 32 VAL C . 10102 1 342 . 1 1 32 32 VAL CA C 13 59.297 0.300 . 1 . . . . 32 VAL CA . 10102 1 343 . 1 1 32 32 VAL CB C 13 37.758 0.300 . 1 . . . . 32 VAL CB . 10102 1 344 . 1 1 32 32 VAL CG1 C 13 23.186 0.300 . 2 . . . . 32 VAL CG1 . 10102 1 345 . 1 1 32 32 VAL CG2 C 13 22.220 0.300 . 2 . . . . 32 VAL CG2 . 10102 1 346 . 1 1 32 32 VAL N N 15 122.615 0.300 . 1 . . . . 32 VAL N . 10102 1 347 . 1 1 33 33 GLN H H 1 9.617 0.030 . 1 . . . . 33 GLN H . 10102 1 348 . 1 1 33 33 GLN HA H 1 4.996 0.030 . 1 . . . . 33 GLN HA . 10102 1 349 . 1 1 33 33 GLN HB2 H 1 2.124 0.030 . 2 . . . . 33 GLN HB2 . 10102 1 350 . 1 1 33 33 GLN HB3 H 1 1.932 0.030 . 2 . . . . 33 GLN HB3 . 10102 1 351 . 1 1 33 33 GLN HG2 H 1 2.122 0.030 . 2 . . . . 33 GLN HG2 . 10102 1 352 . 1 1 33 33 GLN HG3 H 1 2.072 0.030 . 2 . . . . 33 GLN HG3 . 10102 1 353 . 1 1 33 33 GLN HE21 H 1 7.097 0.030 . 2 . . . . 33 GLN HE21 . 10102 1 354 . 1 1 33 33 GLN HE22 H 1 6.704 0.030 . 2 . . . . 33 GLN HE22 . 10102 1 355 . 1 1 33 33 GLN C C 13 174.541 0.300 . 1 . . . . 33 GLN C . 10102 1 356 . 1 1 33 33 GLN CA C 13 54.818 0.300 . 1 . . . . 33 GLN CA . 10102 1 357 . 1 1 33 33 GLN CB C 13 31.663 0.300 . 1 . . . . 33 GLN CB . 10102 1 358 . 1 1 33 33 GLN CG C 13 34.007 0.300 . 1 . . . . 33 GLN CG . 10102 1 359 . 1 1 33 33 GLN N N 15 127.219 0.300 . 1 . . . . 33 GLN N . 10102 1 360 . 1 1 33 33 GLN NE2 N 15 110.846 0.300 . 1 . . . . 33 GLN NE2 . 10102 1 361 . 1 1 34 34 VAL H H 1 9.217 0.030 . 1 . . . . 34 VAL H . 10102 1 362 . 1 1 34 34 VAL HA H 1 4.902 0.030 . 1 . . . . 34 VAL HA . 10102 1 363 . 1 1 34 34 VAL HB H 1 2.109 0.030 . 1 . . . . 34 VAL HB . 10102 1 364 . 1 1 34 34 VAL HG11 H 1 1.021 0.030 . 1 . . . . 34 VAL HG1 . 10102 1 365 . 1 1 34 34 VAL HG12 H 1 1.021 0.030 . 1 . . . . 34 VAL HG1 . 10102 1 366 . 1 1 34 34 VAL HG13 H 1 1.021 0.030 . 1 . . . . 34 VAL HG1 . 10102 1 367 . 1 1 34 34 VAL HG21 H 1 0.946 0.030 . 1 . . . . 34 VAL HG2 . 10102 1 368 . 1 1 34 34 VAL HG22 H 1 0.946 0.030 . 1 . . . . 34 VAL HG2 . 10102 1 369 . 1 1 34 34 VAL HG23 H 1 0.946 0.030 . 1 . . . . 34 VAL HG2 . 10102 1 370 . 1 1 34 34 VAL C C 13 174.541 0.300 . 1 . . . . 34 VAL C . 10102 1 371 . 1 1 34 34 VAL CA C 13 59.920 0.300 . 1 . . . . 34 VAL CA . 10102 1 372 . 1 1 34 34 VAL CB C 13 34.476 0.300 . 1 . . . . 34 VAL CB . 10102 1 373 . 1 1 34 34 VAL CG1 C 13 22.285 0.300 . 2 . . . . 34 VAL CG1 . 10102 1 374 . 1 1 34 34 VAL CG2 C 13 21.581 0.300 . 2 . . . . 34 VAL CG2 . 10102 1 375 . 1 1 34 34 VAL N N 15 127.308 0.300 . 1 . . . . 34 VAL N . 10102 1 376 . 1 1 35 35 THR H H 1 9.096 0.030 . 1 . . . . 35 THR H . 10102 1 377 . 1 1 35 35 THR HA H 1 5.023 0.030 . 1 . . . . 35 THR HA . 10102 1 378 . 1 1 35 35 THR HB H 1 3.978 0.030 . 1 . . . . 35 THR HB . 10102 1 379 . 1 1 35 35 THR HG21 H 1 0.974 0.030 . 1 . . . . 35 THR HG2 . 10102 1 380 . 1 1 35 35 THR HG22 H 1 0.974 0.030 . 1 . . . . 35 THR HG2 . 10102 1 381 . 1 1 35 35 THR HG23 H 1 0.974 0.030 . 1 . . . . 35 THR HG2 . 10102 1 382 . 1 1 35 35 THR C C 13 172.939 0.300 . 1 . . . . 35 THR C . 10102 1 383 . 1 1 35 35 THR CA C 13 60.575 0.300 . 1 . . . . 35 THR CA . 10102 1 384 . 1 1 35 35 THR CB C 13 72.461 0.300 . 1 . . . . 35 THR CB . 10102 1 385 . 1 1 35 35 THR CG2 C 13 21.581 0.300 . 1 . . . . 35 THR CG2 . 10102 1 386 . 1 1 35 35 THR N N 15 118.139 0.300 . 1 . . . . 35 THR N . 10102 1 387 . 1 1 36 36 TRP H H 1 7.929 0.030 . 1 . . . . 36 TRP H . 10102 1 388 . 1 1 36 36 TRP HA H 1 5.334 0.030 . 1 . . . . 36 TRP HA . 10102 1 389 . 1 1 36 36 TRP HB2 H 1 3.073 0.030 . 2 . . . . 36 TRP HB2 . 10102 1 390 . 1 1 36 36 TRP HB3 H 1 2.917 0.030 . 2 . . . . 36 TRP HB3 . 10102 1 391 . 1 1 36 36 TRP HD1 H 1 6.176 0.030 . 1 . . . . 36 TRP HD1 . 10102 1 392 . 1 1 36 36 TRP HE1 H 1 6.453 0.030 . 1 . . . . 36 TRP HE1 . 10102 1 393 . 1 1 36 36 TRP HE3 H 1 6.832 0.030 . 1 . . . . 36 TRP HE3 . 10102 1 394 . 1 1 36 36 TRP HZ2 H 1 6.772 0.030 . 1 . . . . 36 TRP HZ2 . 10102 1 395 . 1 1 36 36 TRP HH2 H 1 6.577 0.030 . 1 . . . . 36 TRP HH2 . 10102 1 396 . 1 1 36 36 TRP C C 13 173.546 0.300 . 1 . . . . 36 TRP C . 10102 1 397 . 1 1 36 36 TRP CA C 13 55.649 0.300 . 1 . . . . 36 TRP CA . 10102 1 398 . 1 1 36 36 TRP CB C 13 32.316 0.300 . 1 . . . . 36 TRP CB . 10102 1 399 . 1 1 36 36 TRP CD1 C 13 124.590 0.300 . 1 . . . . 36 TRP CD1 . 10102 1 400 . 1 1 36 36 TRP CE3 C 13 120.457 0.300 . 1 . . . . 36 TRP CE3 . 10102 1 401 . 1 1 36 36 TRP CZ2 C 13 113.758 0.300 . 1 . . . . 36 TRP CZ2 . 10102 1 402 . 1 1 36 36 TRP CZ3 C 13 121.626 0.300 . 1 . . . . 36 TRP CZ3 . 10102 1 403 . 1 1 36 36 TRP CH2 C 13 124.129 0.300 . 1 . . . . 36 TRP CH2 . 10102 1 404 . 1 1 36 36 TRP N N 15 119.204 0.300 . 1 . . . . 36 TRP N . 10102 1 405 . 1 1 36 36 TRP NE1 N 15 122.743 0.300 . 1 . . . . 36 TRP NE1 . 10102 1 406 . 1 1 37 37 THR H H 1 8.974 0.030 . 1 . . . . 37 THR H . 10102 1 407 . 1 1 37 37 THR HA H 1 4.612 0.030 . 1 . . . . 37 THR HA . 10102 1 408 . 1 1 37 37 THR HB H 1 4.145 0.030 . 1 . . . . 37 THR HB . 10102 1 409 . 1 1 37 37 THR HG21 H 1 1.203 0.030 . 1 . . . . 37 THR HG2 . 10102 1 410 . 1 1 37 37 THR HG22 H 1 1.203 0.030 . 1 . . . . 37 THR HG2 . 10102 1 411 . 1 1 37 37 THR HG23 H 1 1.203 0.030 . 1 . . . . 37 THR HG2 . 10102 1 412 . 1 1 37 37 THR C C 13 173.206 0.300 . 1 . . . . 37 THR C . 10102 1 413 . 1 1 37 37 THR CA C 13 60.793 0.300 . 1 . . . . 37 THR CA . 10102 1 414 . 1 1 37 37 THR CB C 13 71.945 0.300 . 1 . . . . 37 THR CB . 10102 1 415 . 1 1 37 37 THR CG2 C 13 21.713 0.300 . 1 . . . . 37 THR CG2 . 10102 1 416 . 1 1 37 37 THR N N 15 112.131 0.300 . 1 . . . . 37 THR N . 10102 1 417 . 1 1 38 38 VAL H H 1 8.250 0.030 . 1 . . . . 38 VAL H . 10102 1 418 . 1 1 38 38 VAL HA H 1 4.938 0.030 . 1 . . . . 38 VAL HA . 10102 1 419 . 1 1 38 38 VAL HB H 1 2.013 0.030 . 1 . . . . 38 VAL HB . 10102 1 420 . 1 1 38 38 VAL HG11 H 1 1.067 0.030 . 1 . . . . 38 VAL HG1 . 10102 1 421 . 1 1 38 38 VAL HG12 H 1 1.067 0.030 . 1 . . . . 38 VAL HG1 . 10102 1 422 . 1 1 38 38 VAL HG13 H 1 1.067 0.030 . 1 . . . . 38 VAL HG1 . 10102 1 423 . 1 1 38 38 VAL HG21 H 1 0.965 0.030 . 1 . . . . 38 VAL HG2 . 10102 1 424 . 1 1 38 38 VAL HG22 H 1 0.965 0.030 . 1 . . . . 38 VAL HG2 . 10102 1 425 . 1 1 38 38 VAL HG23 H 1 0.965 0.030 . 1 . . . . 38 VAL HG2 . 10102 1 426 . 1 1 38 38 VAL C C 13 175.682 0.300 . 1 . . . . 38 VAL C . 10102 1 427 . 1 1 38 38 VAL CA C 13 60.704 0.300 . 1 . . . . 38 VAL CA . 10102 1 428 . 1 1 38 38 VAL CB C 13 35.183 0.300 . 1 . . . . 38 VAL CB . 10102 1 429 . 1 1 38 38 VAL CG1 C 13 22.285 0.300 . 2 . . . . 38 VAL CG1 . 10102 1 430 . 1 1 38 38 VAL CG2 C 13 20.936 0.300 . 2 . . . . 38 VAL CG2 . 10102 1 431 . 1 1 38 38 VAL N N 15 120.857 0.300 . 1 . . . . 38 VAL N . 10102 1 432 . 1 1 39 39 ASP H H 1 8.882 0.030 . 1 . . . . 39 ASP H . 10102 1 433 . 1 1 39 39 ASP HA H 1 4.564 0.030 . 1 . . . . 39 ASP HA . 10102 1 434 . 1 1 39 39 ASP HB2 H 1 2.755 0.030 . 1 . . . . 39 ASP HB2 . 10102 1 435 . 1 1 39 39 ASP HB3 H 1 2.755 0.030 . 1 . . . . 39 ASP HB3 . 10102 1 436 . 1 1 39 39 ASP C C 13 175.464 0.300 . 1 . . . . 39 ASP C . 10102 1 437 . 1 1 39 39 ASP CA C 13 55.762 0.300 . 1 . . . . 39 ASP CA . 10102 1 438 . 1 1 39 39 ASP CB C 13 41.647 0.300 . 1 . . . . 39 ASP CB . 10102 1 439 . 1 1 39 39 ASP N N 15 126.819 0.300 . 1 . . . . 39 ASP N . 10102 1 440 . 1 1 40 40 ARG H H 1 7.952 0.030 . 1 . . . . 40 ARG H . 10102 1 441 . 1 1 40 40 ARG HA H 1 4.317 0.030 . 1 . . . . 40 ARG HA . 10102 1 442 . 1 1 40 40 ARG HB2 H 1 1.834 0.030 . 1 . . . . 40 ARG HB2 . 10102 1 443 . 1 1 40 40 ARG HB3 H 1 1.834 0.030 . 1 . . . . 40 ARG HB3 . 10102 1 444 . 1 1 40 40 ARG HG2 H 1 1.512 0.030 . 2 . . . . 40 ARG HG2 . 10102 1 445 . 1 1 40 40 ARG HG3 H 1 1.435 0.030 . 2 . . . . 40 ARG HG3 . 10102 1 446 . 1 1 40 40 ARG HD2 H 1 3.187 0.030 . 2 . . . . 40 ARG HD2 . 10102 1 447 . 1 1 40 40 ARG HD3 H 1 3.169 0.030 . 2 . . . . 40 ARG HD3 . 10102 1 448 . 1 1 40 40 ARG C C 13 174.104 0.300 . 1 . . . . 40 ARG C . 10102 1 449 . 1 1 40 40 ARG CA C 13 55.109 0.300 . 1 . . . . 40 ARG CA . 10102 1 450 . 1 1 40 40 ARG CB C 13 30.725 0.300 . 1 . . . . 40 ARG CB . 10102 1 451 . 1 1 40 40 ARG CG C 13 26.505 0.300 . 1 . . . . 40 ARG CG . 10102 1 452 . 1 1 40 40 ARG CD C 13 43.386 0.300 . 1 . . . . 40 ARG CD . 10102 1 453 . 1 1 40 40 ARG N N 15 117.216 0.300 . 1 . . . . 40 ARG N . 10102 1 454 . 1 1 41 41 GLN H H 1 8.553 0.030 . 1 . . . . 41 GLN H . 10102 1 455 . 1 1 41 41 GLN HA H 1 4.515 0.030 . 1 . . . . 41 GLN HA . 10102 1 456 . 1 1 41 41 GLN HB2 H 1 2.007 0.030 . 2 . . . . 41 GLN HB2 . 10102 1 457 . 1 1 41 41 GLN HB3 H 1 1.941 0.030 . 2 . . . . 41 GLN HB3 . 10102 1 458 . 1 1 41 41 GLN HG2 H 1 2.329 0.030 . 2 . . . . 41 GLN HG2 . 10102 1 459 . 1 1 41 41 GLN HG3 H 1 2.200 0.030 . 2 . . . . 41 GLN HG3 . 10102 1 460 . 1 1 41 41 GLN HE21 H 1 7.652 0.030 . 2 . . . . 41 GLN HE21 . 10102 1 461 . 1 1 41 41 GLN HE22 H 1 6.864 0.030 . 2 . . . . 41 GLN HE22 . 10102 1 462 . 1 1 41 41 GLN C C 13 173.885 0.300 . 1 . . . . 41 GLN C . 10102 1 463 . 1 1 41 41 GLN CA C 13 53.519 0.300 . 1 . . . . 41 GLN CA . 10102 1 464 . 1 1 41 41 GLN CB C 13 29.389 0.300 . 1 . . . . 41 GLN CB . 10102 1 465 . 1 1 41 41 GLN CG C 13 33.539 0.300 . 1 . . . . 41 GLN CG . 10102 1 466 . 1 1 41 41 GLN N N 15 121.266 0.300 . 1 . . . . 41 GLN N . 10102 1 467 . 1 1 41 41 GLN NE2 N 15 112.397 0.300 . 1 . . . . 41 GLN NE2 . 10102 1 468 . 1 1 42 42 PRO HA H 1 4.491 0.030 . 1 . . . . 42 PRO HA . 10102 1 469 . 1 1 42 42 PRO HB2 H 1 2.163 0.030 . 2 . . . . 42 PRO HB2 . 10102 1 470 . 1 1 42 42 PRO HB3 H 1 1.657 0.030 . 2 . . . . 42 PRO HB3 . 10102 1 471 . 1 1 42 42 PRO HG2 H 1 1.816 0.030 . 2 . . . . 42 PRO HG2 . 10102 1 472 . 1 1 42 42 PRO HG3 H 1 1.704 0.030 . 2 . . . . 42 PRO HG3 . 10102 1 473 . 1 1 42 42 PRO HD2 H 1 4.039 0.030 . 2 . . . . 42 PRO HD2 . 10102 1 474 . 1 1 42 42 PRO HD3 H 1 3.453 0.030 . 2 . . . . 42 PRO HD3 . 10102 1 475 . 1 1 42 42 PRO C C 13 176.235 0.300 . 1 . . . . 42 PRO C . 10102 1 476 . 1 1 42 42 PRO CA C 13 62.414 0.300 . 1 . . . . 42 PRO CA . 10102 1 477 . 1 1 42 42 PRO CB C 13 32.621 0.300 . 1 . . . . 42 PRO CB . 10102 1 478 . 1 1 42 42 PRO CG C 13 27.369 0.300 . 1 . . . . 42 PRO CG . 10102 1 479 . 1 1 42 42 PRO CD C 13 50.638 0.300 . 1 . . . . 42 PRO CD . 10102 1 480 . 1 1 43 43 GLN H H 1 9.245 0.030 . 1 . . . . 43 GLN H . 10102 1 481 . 1 1 43 43 GLN HA H 1 3.965 0.030 . 1 . . . . 43 GLN HA . 10102 1 482 . 1 1 43 43 GLN HB2 H 1 1.719 0.030 . 2 . . . . 43 GLN HB2 . 10102 1 483 . 1 1 43 43 GLN HB3 H 1 1.585 0.030 . 2 . . . . 43 GLN HB3 . 10102 1 484 . 1 1 43 43 GLN HG2 H 1 2.030 0.030 . 2 . . . . 43 GLN HG2 . 10102 1 485 . 1 1 43 43 GLN HG3 H 1 1.832 0.030 . 2 . . . . 43 GLN HG3 . 10102 1 486 . 1 1 43 43 GLN HE21 H 1 7.374 0.030 . 2 . . . . 43 GLN HE21 . 10102 1 487 . 1 1 43 43 GLN HE22 H 1 6.777 0.030 . 2 . . . . 43 GLN HE22 . 10102 1 488 . 1 1 43 43 GLN C C 13 176.313 0.300 . 1 . . . . 43 GLN C . 10102 1 489 . 1 1 43 43 GLN CA C 13 57.616 0.300 . 1 . . . . 43 GLN CA . 10102 1 490 . 1 1 43 43 GLN CB C 13 29.318 0.300 . 1 . . . . 43 GLN CB . 10102 1 491 . 1 1 43 43 GLN CG C 13 33.539 0.300 . 1 . . . . 43 GLN CG . 10102 1 492 . 1 1 43 43 GLN N N 15 120.489 0.300 . 1 . . . . 43 GLN N . 10102 1 493 . 1 1 43 43 GLN NE2 N 15 112.213 0.300 . 1 . . . . 43 GLN NE2 . 10102 1 494 . 1 1 44 44 PHE H H 1 7.966 0.030 . 1 . . . . 44 PHE H . 10102 1 495 . 1 1 44 44 PHE HA H 1 4.415 0.030 . 1 . . . . 44 PHE HA . 10102 1 496 . 1 1 44 44 PHE HB2 H 1 2.557 0.030 . 2 . . . . 44 PHE HB2 . 10102 1 497 . 1 1 44 44 PHE HB3 H 1 2.235 0.030 . 2 . . . . 44 PHE HB3 . 10102 1 498 . 1 1 44 44 PHE HD1 H 1 6.865 0.030 . 1 . . . . 44 PHE HD1 . 10102 1 499 . 1 1 44 44 PHE HD2 H 1 6.865 0.030 . 1 . . . . 44 PHE HD2 . 10102 1 500 . 1 1 44 44 PHE HE1 H 1 7.149 0.030 . 1 . . . . 44 PHE HE1 . 10102 1 501 . 1 1 44 44 PHE HE2 H 1 7.149 0.030 . 1 . . . . 44 PHE HE2 . 10102 1 502 . 1 1 44 44 PHE HZ H 1 7.128 0.030 . 1 . . . . 44 PHE HZ . 10102 1 503 . 1 1 44 44 PHE C C 13 174.055 0.300 . 1 . . . . 44 PHE C . 10102 1 504 . 1 1 44 44 PHE CA C 13 56.750 0.300 . 1 . . . . 44 PHE CA . 10102 1 505 . 1 1 44 44 PHE CB C 13 38.441 0.300 . 1 . . . . 44 PHE CB . 10102 1 506 . 1 1 44 44 PHE CD1 C 13 131.967 0.300 . 1 . . . . 44 PHE CD1 . 10102 1 507 . 1 1 44 44 PHE CD2 C 13 131.967 0.300 . 1 . . . . 44 PHE CD2 . 10102 1 508 . 1 1 44 44 PHE CE1 C 13 131.234 0.300 . 1 . . . . 44 PHE CE1 . 10102 1 509 . 1 1 44 44 PHE CE2 C 13 131.234 0.300 . 1 . . . . 44 PHE CE2 . 10102 1 510 . 1 1 44 44 PHE CZ C 13 129.736 0.300 . 1 . . . . 44 PHE CZ . 10102 1 511 . 1 1 44 44 PHE N N 15 115.853 0.300 . 1 . . . . 44 PHE N . 10102 1 512 . 1 1 45 45 ILE H H 1 7.190 0.030 . 1 . . . . 45 ILE H . 10102 1 513 . 1 1 45 45 ILE HA H 1 3.940 0.030 . 1 . . . . 45 ILE HA . 10102 1 514 . 1 1 45 45 ILE HB H 1 1.668 0.030 . 1 . . . . 45 ILE HB . 10102 1 515 . 1 1 45 45 ILE HG12 H 1 1.322 0.030 . 2 . . . . 45 ILE HG12 . 10102 1 516 . 1 1 45 45 ILE HG13 H 1 0.927 0.030 . 2 . . . . 45 ILE HG13 . 10102 1 517 . 1 1 45 45 ILE HG21 H 1 0.689 0.030 . 1 . . . . 45 ILE HG2 . 10102 1 518 . 1 1 45 45 ILE HG22 H 1 0.689 0.030 . 1 . . . . 45 ILE HG2 . 10102 1 519 . 1 1 45 45 ILE HG23 H 1 0.689 0.030 . 1 . . . . 45 ILE HG2 . 10102 1 520 . 1 1 45 45 ILE HD11 H 1 0.686 0.030 . 1 . . . . 45 ILE HD1 . 10102 1 521 . 1 1 45 45 ILE HD12 H 1 0.686 0.030 . 1 . . . . 45 ILE HD1 . 10102 1 522 . 1 1 45 45 ILE HD13 H 1 0.686 0.030 . 1 . . . . 45 ILE HD1 . 10102 1 523 . 1 1 45 45 ILE C C 13 174.250 0.300 . 1 . . . . 45 ILE C . 10102 1 524 . 1 1 45 45 ILE CA C 13 61.512 0.300 . 1 . . . . 45 ILE CA . 10102 1 525 . 1 1 45 45 ILE CB C 13 39.368 0.300 . 1 . . . . 45 ILE CB . 10102 1 526 . 1 1 45 45 ILE CG1 C 13 28.471 0.300 . 1 . . . . 45 ILE CG1 . 10102 1 527 . 1 1 45 45 ILE CG2 C 13 17.294 0.300 . 1 . . . . 45 ILE CG2 . 10102 1 528 . 1 1 45 45 ILE CD1 C 13 14.000 0.300 . 1 . . . . 45 ILE CD1 . 10102 1 529 . 1 1 45 45 ILE N N 15 117.170 0.300 . 1 . . . . 45 ILE N . 10102 1 530 . 1 1 46 46 GLN H H 1 8.538 0.030 . 1 . . . . 46 GLN H . 10102 1 531 . 1 1 46 46 GLN HA H 1 4.383 0.030 . 1 . . . . 46 GLN HA . 10102 1 532 . 1 1 46 46 GLN HB2 H 1 1.885 0.030 . 2 . . . . 46 GLN HB2 . 10102 1 533 . 1 1 46 46 GLN HB3 H 1 1.852 0.030 . 2 . . . . 46 GLN HB3 . 10102 1 534 . 1 1 46 46 GLN HG2 H 1 2.475 0.030 . 1 . . . . 46 GLN HG2 . 10102 1 535 . 1 1 46 46 GLN HG3 H 1 2.475 0.030 . 1 . . . . 46 GLN HG3 . 10102 1 536 . 1 1 46 46 GLN HE21 H 1 7.536 0.030 . 2 . . . . 46 GLN HE21 . 10102 1 537 . 1 1 46 46 GLN HE22 H 1 6.779 0.030 . 2 . . . . 46 GLN HE22 . 10102 1 538 . 1 1 46 46 GLN C C 13 174.468 0.300 . 1 . . . . 46 GLN C . 10102 1 539 . 1 1 46 46 GLN CA C 13 56.148 0.300 . 1 . . . . 46 GLN CA . 10102 1 540 . 1 1 46 46 GLN CB C 13 31.194 0.300 . 1 . . . . 46 GLN CB . 10102 1 541 . 1 1 46 46 GLN CG C 13 34.233 0.300 . 1 . . . . 46 GLN CG . 10102 1 542 . 1 1 46 46 GLN N N 15 125.155 0.300 . 1 . . . . 46 GLN N . 10102 1 543 . 1 1 46 46 GLN NE2 N 15 111.839 0.300 . 1 . . . . 46 GLN NE2 . 10102 1 544 . 1 1 47 47 GLY H H 1 6.420 0.030 . 1 . . . . 47 GLY H . 10102 1 545 . 1 1 47 47 GLY HA2 H 1 3.834 0.030 . 2 . . . . 47 GLY HA2 . 10102 1 546 . 1 1 47 47 GLY HA3 H 1 3.323 0.030 . 2 . . . . 47 GLY HA3 . 10102 1 547 . 1 1 47 47 GLY C C 13 169.540 0.300 . 1 . . . . 47 GLY C . 10102 1 548 . 1 1 47 47 GLY CA C 13 44.853 0.300 . 1 . . . . 47 GLY CA . 10102 1 549 . 1 1 47 47 GLY N N 15 102.386 0.300 . 1 . . . . 47 GLY N . 10102 1 550 . 1 1 48 48 TYR H H 1 8.564 0.030 . 1 . . . . 48 TYR H . 10102 1 551 . 1 1 48 48 TYR HA H 1 4.812 0.030 . 1 . . . . 48 TYR HA . 10102 1 552 . 1 1 48 48 TYR HB2 H 1 2.498 0.030 . 2 . . . . 48 TYR HB2 . 10102 1 553 . 1 1 48 48 TYR HB3 H 1 2.107 0.030 . 2 . . . . 48 TYR HB3 . 10102 1 554 . 1 1 48 48 TYR HD1 H 1 6.750 0.030 . 1 . . . . 48 TYR HD1 . 10102 1 555 . 1 1 48 48 TYR HD2 H 1 6.750 0.030 . 1 . . . . 48 TYR HD2 . 10102 1 556 . 1 1 48 48 TYR HE1 H 1 6.809 0.030 . 1 . . . . 48 TYR HE1 . 10102 1 557 . 1 1 48 48 TYR HE2 H 1 6.809 0.030 . 1 . . . . 48 TYR HE2 . 10102 1 558 . 1 1 48 48 TYR C C 13 173.376 0.300 . 1 . . . . 48 TYR C . 10102 1 559 . 1 1 48 48 TYR CA C 13 56.254 0.300 . 1 . . . . 48 TYR CA . 10102 1 560 . 1 1 48 48 TYR CB C 13 41.835 0.300 . 1 . . . . 48 TYR CB . 10102 1 561 . 1 1 48 48 TYR CD1 C 13 132.949 0.300 . 1 . . . . 48 TYR CD1 . 10102 1 562 . 1 1 48 48 TYR CD2 C 13 132.949 0.300 . 1 . . . . 48 TYR CD2 . 10102 1 563 . 1 1 48 48 TYR CE1 C 13 117.837 0.300 . 1 . . . . 48 TYR CE1 . 10102 1 564 . 1 1 48 48 TYR CE2 C 13 117.837 0.300 . 1 . . . . 48 TYR CE2 . 10102 1 565 . 1 1 48 48 TYR N N 15 115.098 0.300 . 1 . . . . 48 TYR N . 10102 1 566 . 1 1 49 49 ARG H H 1 9.543 0.030 . 1 . . . . 49 ARG H . 10102 1 567 . 1 1 49 49 ARG HA H 1 4.928 0.030 . 1 . . . . 49 ARG HA . 10102 1 568 . 1 1 49 49 ARG HB2 H 1 1.797 0.030 . 2 . . . . 49 ARG HB2 . 10102 1 569 . 1 1 49 49 ARG HB3 H 1 1.625 0.030 . 2 . . . . 49 ARG HB3 . 10102 1 570 . 1 1 49 49 ARG HG2 H 1 1.413 0.030 . 1 . . . . 49 ARG HG2 . 10102 1 571 . 1 1 49 49 ARG HG3 H 1 1.413 0.030 . 1 . . . . 49 ARG HG3 . 10102 1 572 . 1 1 49 49 ARG HD2 H 1 2.934 0.030 . 2 . . . . 49 ARG HD2 . 10102 1 573 . 1 1 49 49 ARG HD3 H 1 2.764 0.030 . 2 . . . . 49 ARG HD3 . 10102 1 574 . 1 1 49 49 ARG HE H 1 7.905 0.030 . 1 . . . . 49 ARG HE . 10102 1 575 . 1 1 49 49 ARG C C 13 174.590 0.300 . 1 . . . . 49 ARG C . 10102 1 576 . 1 1 49 49 ARG CA C 13 55.048 0.300 . 1 . . . . 49 ARG CA . 10102 1 577 . 1 1 49 49 ARG CB C 13 31.486 0.300 . 1 . . . . 49 ARG CB . 10102 1 578 . 1 1 49 49 ARG CG C 13 26.517 0.300 . 1 . . . . 49 ARG CG . 10102 1 579 . 1 1 49 49 ARG CD C 13 43.283 0.300 . 1 . . . . 49 ARG CD . 10102 1 580 . 1 1 49 49 ARG N N 15 124.582 0.300 . 1 . . . . 49 ARG N . 10102 1 581 . 1 1 49 49 ARG NE N 15 84.746 0.300 . 1 . . . . 49 ARG NE . 10102 1 582 . 1 1 50 50 VAL H H 1 9.285 0.030 . 1 . . . . 50 VAL H . 10102 1 583 . 1 1 50 50 VAL HA H 1 4.181 0.030 . 1 . . . . 50 VAL HA . 10102 1 584 . 1 1 50 50 VAL HB H 1 2.420 0.030 . 1 . . . . 50 VAL HB . 10102 1 585 . 1 1 50 50 VAL HG11 H 1 0.859 0.030 . 1 . . . . 50 VAL HG1 . 10102 1 586 . 1 1 50 50 VAL HG12 H 1 0.859 0.030 . 1 . . . . 50 VAL HG1 . 10102 1 587 . 1 1 50 50 VAL HG13 H 1 0.859 0.030 . 1 . . . . 50 VAL HG1 . 10102 1 588 . 1 1 50 50 VAL HG21 H 1 0.674 0.030 . 1 . . . . 50 VAL HG2 . 10102 1 589 . 1 1 50 50 VAL HG22 H 1 0.674 0.030 . 1 . . . . 50 VAL HG2 . 10102 1 590 . 1 1 50 50 VAL HG23 H 1 0.674 0.030 . 1 . . . . 50 VAL HG2 . 10102 1 591 . 1 1 50 50 VAL C C 13 175.027 0.300 . 1 . . . . 50 VAL C . 10102 1 592 . 1 1 50 50 VAL CA C 13 62.164 0.300 . 1 . . . . 50 VAL CA . 10102 1 593 . 1 1 50 50 VAL CB C 13 31.092 0.300 . 1 . . . . 50 VAL CB . 10102 1 594 . 1 1 50 50 VAL CG1 C 13 22.302 0.300 . 2 . . . . 50 VAL CG1 . 10102 1 595 . 1 1 50 50 VAL CG2 C 13 20.915 0.300 . 2 . . . . 50 VAL CG2 . 10102 1 596 . 1 1 50 50 VAL N N 15 128.693 0.300 . 1 . . . . 50 VAL N . 10102 1 597 . 1 1 51 51 MET H H 1 9.321 0.030 . 1 . . . . 51 MET H . 10102 1 598 . 1 1 51 51 MET HA H 1 5.672 0.030 . 1 . . . . 51 MET HA . 10102 1 599 . 1 1 51 51 MET HB2 H 1 1.887 0.030 . 2 . . . . 51 MET HB2 . 10102 1 600 . 1 1 51 51 MET HB3 H 1 1.398 0.030 . 2 . . . . 51 MET HB3 . 10102 1 601 . 1 1 51 51 MET HG2 H 1 2.344 0.030 . 2 . . . . 51 MET HG2 . 10102 1 602 . 1 1 51 51 MET HG3 H 1 2.121 0.030 . 2 . . . . 51 MET HG3 . 10102 1 603 . 1 1 51 51 MET HE1 H 1 1.452 0.030 . 1 . . . . 51 MET HE . 10102 1 604 . 1 1 51 51 MET HE2 H 1 1.452 0.030 . 1 . . . . 51 MET HE . 10102 1 605 . 1 1 51 51 MET HE3 H 1 1.452 0.030 . 1 . . . . 51 MET HE . 10102 1 606 . 1 1 51 51 MET C C 13 174.808 0.300 . 1 . . . . 51 MET C . 10102 1 607 . 1 1 51 51 MET CA C 13 53.770 0.300 . 1 . . . . 51 MET CA . 10102 1 608 . 1 1 51 51 MET CB C 13 34.856 0.300 . 1 . . . . 51 MET CB . 10102 1 609 . 1 1 51 51 MET CG C 13 31.747 0.300 . 1 . . . . 51 MET CG . 10102 1 610 . 1 1 51 51 MET CE C 13 16.126 0.300 . 1 . . . . 51 MET CE . 10102 1 611 . 1 1 51 51 MET N N 15 127.456 0.300 . 1 . . . . 51 MET N . 10102 1 612 . 1 1 52 52 TYR H H 1 9.148 0.030 . 1 . . . . 52 TYR H . 10102 1 613 . 1 1 52 52 TYR HA H 1 6.691 0.030 . 1 . . . . 52 TYR HA . 10102 1 614 . 1 1 52 52 TYR HB2 H 1 3.083 0.030 . 2 . . . . 52 TYR HB2 . 10102 1 615 . 1 1 52 52 TYR HB3 H 1 2.705 0.030 . 2 . . . . 52 TYR HB3 . 10102 1 616 . 1 1 52 52 TYR HD1 H 1 6.825 0.030 . 1 . . . . 52 TYR HD1 . 10102 1 617 . 1 1 52 52 TYR HD2 H 1 6.825 0.030 . 1 . . . . 52 TYR HD2 . 10102 1 618 . 1 1 52 52 TYR HE1 H 1 6.505 0.030 . 1 . . . . 52 TYR HE1 . 10102 1 619 . 1 1 52 52 TYR HE2 H 1 6.505 0.030 . 1 . . . . 52 TYR HE2 . 10102 1 620 . 1 1 52 52 TYR C C 13 174.007 0.300 . 1 . . . . 52 TYR C . 10102 1 621 . 1 1 52 52 TYR CA C 13 54.988 0.300 . 1 . . . . 52 TYR CA . 10102 1 622 . 1 1 52 52 TYR CB C 13 41.979 0.300 . 1 . . . . 52 TYR CB . 10102 1 623 . 1 1 52 52 TYR CD1 C 13 133.728 0.300 . 1 . . . . 52 TYR CD1 . 10102 1 624 . 1 1 52 52 TYR CD2 C 13 133.728 0.300 . 1 . . . . 52 TYR CD2 . 10102 1 625 . 1 1 52 52 TYR CE1 C 13 118.192 0.300 . 1 . . . . 52 TYR CE1 . 10102 1 626 . 1 1 52 52 TYR CE2 C 13 118.192 0.300 . 1 . . . . 52 TYR CE2 . 10102 1 627 . 1 1 52 52 TYR N N 15 118.204 0.300 . 1 . . . . 52 TYR N . 10102 1 628 . 1 1 53 53 ARG H H 1 9.030 0.030 . 1 . . . . 53 ARG H . 10102 1 629 . 1 1 53 53 ARG HA H 1 4.902 0.030 . 1 . . . . 53 ARG HA . 10102 1 630 . 1 1 53 53 ARG HB2 H 1 1.190 0.030 . 2 . . . . 53 ARG HB2 . 10102 1 631 . 1 1 53 53 ARG HB3 H 1 1.117 0.030 . 2 . . . . 53 ARG HB3 . 10102 1 632 . 1 1 53 53 ARG HG2 H 1 0.862 0.030 . 2 . . . . 53 ARG HG2 . 10102 1 633 . 1 1 53 53 ARG HG3 H 1 0.425 0.030 . 2 . . . . 53 ARG HG3 . 10102 1 634 . 1 1 53 53 ARG HD2 H 1 2.252 0.030 . 2 . . . . 53 ARG HD2 . 10102 1 635 . 1 1 53 53 ARG HD3 H 1 0.433 0.030 . 2 . . . . 53 ARG HD3 . 10102 1 636 . 1 1 53 53 ARG HE H 1 5.716 0.030 . 1 . . . . 53 ARG HE . 10102 1 637 . 1 1 53 53 ARG C C 13 173.643 0.300 . 1 . . . . 53 ARG C . 10102 1 638 . 1 1 53 53 ARG CA C 13 54.101 0.300 . 1 . . . . 53 ARG CA . 10102 1 639 . 1 1 53 53 ARG CB C 13 33.233 0.300 . 1 . . . . 53 ARG CB . 10102 1 640 . 1 1 53 53 ARG CG C 13 24.881 0.300 . 1 . . . . 53 ARG CG . 10102 1 641 . 1 1 53 53 ARG CD C 13 42.827 0.300 . 1 . . . . 53 ARG CD . 10102 1 642 . 1 1 53 53 ARG N N 15 116.381 0.300 . 1 . . . . 53 ARG N . 10102 1 643 . 1 1 53 53 ARG NE N 15 85.319 0.300 . 1 . . . . 53 ARG NE . 10102 1 644 . 1 1 54 54 GLN H H 1 8.737 0.030 . 1 . . . . 54 GLN H . 10102 1 645 . 1 1 54 54 GLN HA H 1 4.018 0.030 . 1 . . . . 54 GLN HA . 10102 1 646 . 1 1 54 54 GLN HB2 H 1 1.776 0.030 . 1 . . . . 54 GLN HB2 . 10102 1 647 . 1 1 54 54 GLN HB3 H 1 1.776 0.030 . 1 . . . . 54 GLN HB3 . 10102 1 648 . 1 1 54 54 GLN HG2 H 1 2.054 0.030 . 2 . . . . 54 GLN HG2 . 10102 1 649 . 1 1 54 54 GLN HG3 H 1 1.986 0.030 . 2 . . . . 54 GLN HG3 . 10102 1 650 . 1 1 54 54 GLN HE21 H 1 7.718 0.030 . 2 . . . . 54 GLN HE21 . 10102 1 651 . 1 1 54 54 GLN HE22 H 1 6.919 0.030 . 2 . . . . 54 GLN HE22 . 10102 1 652 . 1 1 54 54 GLN C C 13 176.459 0.300 . 1 . . . . 54 GLN C . 10102 1 653 . 1 1 54 54 GLN CA C 13 55.674 0.300 . 1 . . . . 54 GLN CA . 10102 1 654 . 1 1 54 54 GLN CB C 13 28.615 0.300 . 1 . . . . 54 GLN CB . 10102 1 655 . 1 1 54 54 GLN CG C 13 33.539 0.300 . 1 . . . . 54 GLN CG . 10102 1 656 . 1 1 54 54 GLN N N 15 125.417 0.300 . 1 . . . . 54 GLN N . 10102 1 657 . 1 1 54 54 GLN NE2 N 15 110.207 0.300 . 1 . . . . 54 GLN NE2 . 10102 1 658 . 1 1 55 55 THR H H 1 8.747 0.030 . 1 . . . . 55 THR H . 10102 1 659 . 1 1 55 55 THR HA H 1 4.584 0.030 . 1 . . . . 55 THR HA . 10102 1 660 . 1 1 55 55 THR HB H 1 4.253 0.030 . 1 . . . . 55 THR HB . 10102 1 661 . 1 1 55 55 THR HG21 H 1 1.025 0.030 . 1 . . . . 55 THR HG2 . 10102 1 662 . 1 1 55 55 THR HG22 H 1 1.025 0.030 . 1 . . . . 55 THR HG2 . 10102 1 663 . 1 1 55 55 THR HG23 H 1 1.025 0.030 . 1 . . . . 55 THR HG2 . 10102 1 664 . 1 1 55 55 THR C C 13 174.371 0.300 . 1 . . . . 55 THR C . 10102 1 665 . 1 1 55 55 THR CA C 13 60.873 0.300 . 1 . . . . 55 THR CA . 10102 1 666 . 1 1 55 55 THR CB C 13 69.608 0.300 . 1 . . . . 55 THR CB . 10102 1 667 . 1 1 55 55 THR CG2 C 13 22.709 0.300 . 1 . . . . 55 THR CG2 . 10102 1 668 . 1 1 55 55 THR N N 15 114.522 0.300 . 1 . . . . 55 THR N . 10102 1 669 . 1 1 56 56 SER H H 1 7.677 0.030 . 1 . . . . 56 SER H . 10102 1 670 . 1 1 56 56 SER HA H 1 4.777 0.030 . 1 . . . . 56 SER HA . 10102 1 671 . 1 1 56 56 SER HB2 H 1 4.081 0.030 . 2 . . . . 56 SER HB2 . 10102 1 672 . 1 1 56 56 SER HB3 H 1 3.816 0.030 . 2 . . . . 56 SER HB3 . 10102 1 673 . 1 1 56 56 SER C C 13 173.570 0.300 . 1 . . . . 56 SER C . 10102 1 674 . 1 1 56 56 SER CA C 13 57.361 0.300 . 1 . . . . 56 SER CA . 10102 1 675 . 1 1 56 56 SER CB C 13 65.521 0.300 . 1 . . . . 56 SER CB . 10102 1 676 . 1 1 56 56 SER N N 15 116.275 0.300 . 1 . . . . 56 SER N . 10102 1 677 . 1 1 57 57 GLY H H 1 8.627 0.030 . 1 . . . . 57 GLY H . 10102 1 678 . 1 1 57 57 GLY HA2 H 1 4.119 0.030 . 2 . . . . 57 GLY HA2 . 10102 1 679 . 1 1 57 57 GLY HA3 H 1 3.852 0.030 . 2 . . . . 57 GLY HA3 . 10102 1 680 . 1 1 57 57 GLY C C 13 174.590 0.300 . 1 . . . . 57 GLY C . 10102 1 681 . 1 1 57 57 GLY CA C 13 44.935 0.300 . 1 . . . . 57 GLY CA . 10102 1 682 . 1 1 57 57 GLY N N 15 108.028 0.300 . 1 . . . . 57 GLY N . 10102 1 683 . 1 1 58 58 LEU H H 1 8.276 0.030 . 1 . . . . 58 LEU H . 10102 1 684 . 1 1 58 58 LEU HA H 1 4.208 0.030 . 1 . . . . 58 LEU HA . 10102 1 685 . 1 1 58 58 LEU HB2 H 1 1.641 0.030 . 2 . . . . 58 LEU HB2 . 10102 1 686 . 1 1 58 58 LEU HB3 H 1 1.587 0.030 . 2 . . . . 58 LEU HB3 . 10102 1 687 . 1 1 58 58 LEU HG H 1 1.581 0.030 . 1 . . . . 58 LEU HG . 10102 1 688 . 1 1 58 58 LEU HD11 H 1 0.904 0.030 . 1 . . . . 58 LEU HD1 . 10102 1 689 . 1 1 58 58 LEU HD12 H 1 0.904 0.030 . 1 . . . . 58 LEU HD1 . 10102 1 690 . 1 1 58 58 LEU HD13 H 1 0.904 0.030 . 1 . . . . 58 LEU HD1 . 10102 1 691 . 1 1 58 58 LEU HD21 H 1 0.867 0.030 . 1 . . . . 58 LEU HD2 . 10102 1 692 . 1 1 58 58 LEU HD22 H 1 0.867 0.030 . 1 . . . . 58 LEU HD2 . 10102 1 693 . 1 1 58 58 LEU HD23 H 1 0.867 0.030 . 1 . . . . 58 LEU HD2 . 10102 1 694 . 1 1 58 58 LEU C C 13 178.061 0.300 . 1 . . . . 58 LEU C . 10102 1 695 . 1 1 58 58 LEU CA C 13 56.298 0.300 . 1 . . . . 58 LEU CA . 10102 1 696 . 1 1 58 58 LEU CB C 13 42.432 0.300 . 1 . . . . 58 LEU CB . 10102 1 697 . 1 1 58 58 LEU CG C 13 26.599 0.300 . 1 . . . . 58 LEU CG . 10102 1 698 . 1 1 58 58 LEU CD1 C 13 24.870 0.300 . 2 . . . . 58 LEU CD1 . 10102 1 699 . 1 1 58 58 LEU CD2 C 13 23.410 0.300 . 2 . . . . 58 LEU CD2 . 10102 1 700 . 1 1 58 58 LEU N N 15 120.286 0.300 . 1 . . . . 58 LEU N . 10102 1 701 . 1 1 59 59 GLN H H 1 8.065 0.030 . 1 . . . . 59 GLN H . 10102 1 702 . 1 1 59 59 GLN HA H 1 4.331 0.030 . 1 . . . . 59 GLN HA . 10102 1 703 . 1 1 59 59 GLN HB2 H 1 2.199 0.030 . 2 . . . . 59 GLN HB2 . 10102 1 704 . 1 1 59 59 GLN HB3 H 1 1.956 0.030 . 2 . . . . 59 GLN HB3 . 10102 1 705 . 1 1 59 59 GLN HG2 H 1 2.359 0.030 . 2 . . . . 59 GLN HG2 . 10102 1 706 . 1 1 59 59 GLN HG3 H 1 2.281 0.030 . 2 . . . . 59 GLN HG3 . 10102 1 707 . 1 1 59 59 GLN HE21 H 1 7.552 0.030 . 2 . . . . 59 GLN HE21 . 10102 1 708 . 1 1 59 59 GLN HE22 H 1 6.862 0.030 . 2 . . . . 59 GLN HE22 . 10102 1 709 . 1 1 59 59 GLN C C 13 174.759 0.300 . 1 . . . . 59 GLN C . 10102 1 710 . 1 1 59 59 GLN CA C 13 55.578 0.300 . 1 . . . . 59 GLN CA . 10102 1 711 . 1 1 59 59 GLN CB C 13 27.934 0.300 . 1 . . . . 59 GLN CB . 10102 1 712 . 1 1 59 59 GLN CG C 13 33.982 0.300 . 1 . . . . 59 GLN CG . 10102 1 713 . 1 1 59 59 GLN N N 15 116.883 0.300 . 1 . . . . 59 GLN N . 10102 1 714 . 1 1 59 59 GLN NE2 N 15 112.386 0.300 . 1 . . . . 59 GLN NE2 . 10102 1 715 . 1 1 60 60 ALA H H 1 7.430 0.030 . 1 . . . . 60 ALA H . 10102 1 716 . 1 1 60 60 ALA HA H 1 4.008 0.030 . 1 . . . . 60 ALA HA . 10102 1 717 . 1 1 60 60 ALA HB1 H 1 1.163 0.030 . 1 . . . . 60 ALA HB . 10102 1 718 . 1 1 60 60 ALA HB2 H 1 1.163 0.030 . 1 . . . . 60 ALA HB . 10102 1 719 . 1 1 60 60 ALA HB3 H 1 1.163 0.030 . 1 . . . . 60 ALA HB . 10102 1 720 . 1 1 60 60 ALA C C 13 177.406 0.300 . 1 . . . . 60 ALA C . 10102 1 721 . 1 1 60 60 ALA CA C 13 52.678 0.300 . 1 . . . . 60 ALA CA . 10102 1 722 . 1 1 60 60 ALA CB C 13 18.877 0.300 . 1 . . . . 60 ALA CB . 10102 1 723 . 1 1 60 60 ALA N N 15 122.385 0.300 . 1 . . . . 60 ALA N . 10102 1 724 . 1 1 61 61 THR H H 1 8.245 0.030 . 1 . . . . 61 THR H . 10102 1 725 . 1 1 61 61 THR HA H 1 4.503 0.030 . 1 . . . . 61 THR HA . 10102 1 726 . 1 1 61 61 THR HB H 1 4.158 0.030 . 1 . . . . 61 THR HB . 10102 1 727 . 1 1 61 61 THR HG21 H 1 1.204 0.030 . 1 . . . . 61 THR HG2 . 10102 1 728 . 1 1 61 61 THR HG22 H 1 1.204 0.030 . 1 . . . . 61 THR HG2 . 10102 1 729 . 1 1 61 61 THR HG23 H 1 1.204 0.030 . 1 . . . . 61 THR HG2 . 10102 1 730 . 1 1 61 61 THR C C 13 173.424 0.300 . 1 . . . . 61 THR C . 10102 1 731 . 1 1 61 61 THR CA C 13 60.669 0.300 . 1 . . . . 61 THR CA . 10102 1 732 . 1 1 61 61 THR CB C 13 69.854 0.300 . 1 . . . . 61 THR CB . 10102 1 733 . 1 1 61 61 THR CG2 C 13 20.964 0.300 . 1 . . . . 61 THR CG2 . 10102 1 734 . 1 1 61 61 THR N N 15 113.787 0.300 . 1 . . . . 61 THR N . 10102 1 735 . 1 1 62 62 SER H H 1 8.169 0.030 . 1 . . . . 62 SER H . 10102 1 736 . 1 1 62 62 SER HA H 1 4.375 0.030 . 1 . . . . 62 SER HA . 10102 1 737 . 1 1 62 62 SER HB2 H 1 3.926 0.030 . 2 . . . . 62 SER HB2 . 10102 1 738 . 1 1 62 62 SER HB3 H 1 3.789 0.030 . 2 . . . . 62 SER HB3 . 10102 1 739 . 1 1 62 62 SER C C 13 174.905 0.300 . 1 . . . . 62 SER C . 10102 1 740 . 1 1 62 62 SER CA C 13 57.722 0.300 . 1 . . . . 62 SER CA . 10102 1 741 . 1 1 62 62 SER CB C 13 64.252 0.300 . 1 . . . . 62 SER CB . 10102 1 742 . 1 1 62 62 SER N N 15 117.836 0.300 . 1 . . . . 62 SER N . 10102 1 743 . 1 1 63 63 SER H H 1 8.163 0.030 . 1 . . . . 63 SER H . 10102 1 744 . 1 1 63 63 SER HA H 1 4.392 0.030 . 1 . . . . 63 SER HA . 10102 1 745 . 1 1 63 63 SER HB2 H 1 3.899 0.030 . 2 . . . . 63 SER HB2 . 10102 1 746 . 1 1 63 63 SER HB3 H 1 3.803 0.030 . 2 . . . . 63 SER HB3 . 10102 1 747 . 1 1 63 63 SER C C 13 173.497 0.300 . 1 . . . . 63 SER C . 10102 1 748 . 1 1 63 63 SER CA C 13 57.968 0.300 . 1 . . . . 63 SER CA . 10102 1 749 . 1 1 63 63 SER CB C 13 64.018 0.300 . 1 . . . . 63 SER CB . 10102 1 750 . 1 1 63 63 SER N N 15 118.480 0.300 . 1 . . . . 63 SER N . 10102 1 751 . 1 1 64 64 TRP H H 1 8.422 0.030 . 1 . . . . 64 TRP H . 10102 1 752 . 1 1 64 64 TRP HA H 1 4.392 0.030 . 1 . . . . 64 TRP HA . 10102 1 753 . 1 1 64 64 TRP HB2 H 1 3.067 0.030 . 2 . . . . 64 TRP HB2 . 10102 1 754 . 1 1 64 64 TRP HB3 H 1 2.935 0.030 . 2 . . . . 64 TRP HB3 . 10102 1 755 . 1 1 64 64 TRP HD1 H 1 7.391 0.030 . 1 . . . . 64 TRP HD1 . 10102 1 756 . 1 1 64 64 TRP HE1 H 1 10.194 0.030 . 1 . . . . 64 TRP HE1 . 10102 1 757 . 1 1 64 64 TRP HE3 H 1 7.410 0.030 . 1 . . . . 64 TRP HE3 . 10102 1 758 . 1 1 64 64 TRP HZ2 H 1 7.411 0.030 . 1 . . . . 64 TRP HZ2 . 10102 1 759 . 1 1 64 64 TRP HH2 H 1 6.879 0.030 . 1 . . . . 64 TRP HH2 . 10102 1 760 . 1 1 64 64 TRP C C 13 177.139 0.300 . 1 . . . . 64 TRP C . 10102 1 761 . 1 1 64 64 TRP CA C 13 57.922 0.300 . 1 . . . . 64 TRP CA . 10102 1 762 . 1 1 64 64 TRP CB C 13 30.155 0.300 . 1 . . . . 64 TRP CB . 10102 1 763 . 1 1 64 64 TRP CD1 C 13 128.669 0.300 . 1 . . . . 64 TRP CD1 . 10102 1 764 . 1 1 64 64 TRP CE3 C 13 120.281 0.300 . 1 . . . . 64 TRP CE3 . 10102 1 765 . 1 1 64 64 TRP CZ2 C 13 113.999 0.300 . 1 . . . . 64 TRP CZ2 . 10102 1 766 . 1 1 64 64 TRP CZ3 C 13 122.232 0.300 . 1 . . . . 64 TRP CZ3 . 10102 1 767 . 1 1 64 64 TRP CH2 C 13 123.593 0.300 . 1 . . . . 64 TRP CH2 . 10102 1 768 . 1 1 64 64 TRP N N 15 121.917 0.300 . 1 . . . . 64 TRP N . 10102 1 769 . 1 1 64 64 TRP NE1 N 15 130.344 0.300 . 1 . . . . 64 TRP NE1 . 10102 1 770 . 1 1 65 65 GLN H H 1 9.212 0.030 . 1 . . . . 65 GLN H . 10102 1 771 . 1 1 65 65 GLN HA H 1 4.434 0.030 . 1 . . . . 65 GLN HA . 10102 1 772 . 1 1 65 65 GLN HB2 H 1 1.655 0.030 . 2 . . . . 65 GLN HB2 . 10102 1 773 . 1 1 65 65 GLN HB3 H 1 0.712 0.030 . 2 . . . . 65 GLN HB3 . 10102 1 774 . 1 1 65 65 GLN HG2 H 1 2.206 0.030 . 1 . . . . 65 GLN HG2 . 10102 1 775 . 1 1 65 65 GLN HG3 H 1 2.206 0.030 . 1 . . . . 65 GLN HG3 . 10102 1 776 . 1 1 65 65 GLN HE21 H 1 7.450 0.030 . 2 . . . . 65 GLN HE21 . 10102 1 777 . 1 1 65 65 GLN HE22 H 1 6.817 0.030 . 2 . . . . 65 GLN HE22 . 10102 1 778 . 1 1 65 65 GLN C C 13 174.614 0.300 . 1 . . . . 65 GLN C . 10102 1 779 . 1 1 65 65 GLN CA C 13 54.848 0.300 . 1 . . . . 65 GLN CA . 10102 1 780 . 1 1 65 65 GLN CB C 13 30.338 0.300 . 1 . . . . 65 GLN CB . 10102 1 781 . 1 1 65 65 GLN CG C 13 35.022 0.300 . 1 . . . . 65 GLN CG . 10102 1 782 . 1 1 65 65 GLN N N 15 123.914 0.300 . 1 . . . . 65 GLN N . 10102 1 783 . 1 1 65 65 GLN NE2 N 15 111.785 0.300 . 1 . . . . 65 GLN NE2 . 10102 1 784 . 1 1 66 66 ASN H H 1 8.480 0.030 . 1 . . . . 66 ASN H . 10102 1 785 . 1 1 66 66 ASN HA H 1 5.941 0.030 . 1 . . . . 66 ASN HA . 10102 1 786 . 1 1 66 66 ASN HB2 H 1 2.504 0.030 . 2 . . . . 66 ASN HB2 . 10102 1 787 . 1 1 66 66 ASN HB3 H 1 2.409 0.030 . 2 . . . . 66 ASN HB3 . 10102 1 788 . 1 1 66 66 ASN HD21 H 1 7.100 0.030 . 2 . . . . 66 ASN HD21 . 10102 1 789 . 1 1 66 66 ASN HD22 H 1 6.687 0.030 . 2 . . . . 66 ASN HD22 . 10102 1 790 . 1 1 66 66 ASN C C 13 174.225 0.300 . 1 . . . . 66 ASN C . 10102 1 791 . 1 1 66 66 ASN CA C 13 53.183 0.300 . 1 . . . . 66 ASN CA . 10102 1 792 . 1 1 66 66 ASN CB C 13 43.271 0.300 . 1 . . . . 66 ASN CB . 10102 1 793 . 1 1 66 66 ASN N N 15 114.804 0.300 . 1 . . . . 66 ASN N . 10102 1 794 . 1 1 66 66 ASN ND2 N 15 113.095 0.300 . 1 . . . . 66 ASN ND2 . 10102 1 795 . 1 1 67 67 LEU H H 1 9.411 0.030 . 1 . . . . 67 LEU H . 10102 1 796 . 1 1 67 67 LEU HA H 1 4.640 0.030 . 1 . . . . 67 LEU HA . 10102 1 797 . 1 1 67 67 LEU HB2 H 1 1.776 0.030 . 2 . . . . 67 LEU HB2 . 10102 1 798 . 1 1 67 67 LEU HB3 H 1 1.706 0.030 . 2 . . . . 67 LEU HB3 . 10102 1 799 . 1 1 67 67 LEU HG H 1 1.625 0.030 . 1 . . . . 67 LEU HG . 10102 1 800 . 1 1 67 67 LEU HD11 H 1 1.079 0.030 . 1 . . . . 67 LEU HD1 . 10102 1 801 . 1 1 67 67 LEU HD12 H 1 1.079 0.030 . 1 . . . . 67 LEU HD1 . 10102 1 802 . 1 1 67 67 LEU HD13 H 1 1.079 0.030 . 1 . . . . 67 LEU HD1 . 10102 1 803 . 1 1 67 67 LEU HD21 H 1 0.964 0.030 . 1 . . . . 67 LEU HD2 . 10102 1 804 . 1 1 67 67 LEU HD22 H 1 0.964 0.030 . 1 . . . . 67 LEU HD2 . 10102 1 805 . 1 1 67 67 LEU HD23 H 1 0.964 0.030 . 1 . . . . 67 LEU HD2 . 10102 1 806 . 1 1 67 67 LEU C C 13 174.541 0.300 . 1 . . . . 67 LEU C . 10102 1 807 . 1 1 67 67 LEU CA C 13 54.549 0.300 . 1 . . . . 67 LEU CA . 10102 1 808 . 1 1 67 67 LEU CB C 13 45.382 0.300 . 1 . . . . 67 LEU CB . 10102 1 809 . 1 1 67 67 LEU CD1 C 13 24.918 0.300 . 2 . . . . 67 LEU CD1 . 10102 1 810 . 1 1 67 67 LEU CD2 C 13 26.120 0.300 . 2 . . . . 67 LEU CD2 . 10102 1 811 . 1 1 67 67 LEU N N 15 126.077 0.300 . 1 . . . . 67 LEU N . 10102 1 812 . 1 1 68 68 ASP H H 1 8.754 0.030 . 1 . . . . 68 ASP H . 10102 1 813 . 1 1 68 68 ASP HA H 1 5.233 0.030 . 1 . . . . 68 ASP HA . 10102 1 814 . 1 1 68 68 ASP HB2 H 1 2.716 0.030 . 2 . . . . 68 ASP HB2 . 10102 1 815 . 1 1 68 68 ASP HB3 H 1 2.496 0.030 . 2 . . . . 68 ASP HB3 . 10102 1 816 . 1 1 68 68 ASP C C 13 175.391 0.300 . 1 . . . . 68 ASP C . 10102 1 817 . 1 1 68 68 ASP CA C 13 54.138 0.300 . 1 . . . . 68 ASP CA . 10102 1 818 . 1 1 68 68 ASP CB C 13 41.102 0.300 . 1 . . . . 68 ASP CB . 10102 1 819 . 1 1 68 68 ASP N N 15 126.334 0.300 . 1 . . . . 68 ASP N . 10102 1 820 . 1 1 69 69 ALA H H 1 9.519 0.030 . 1 . . . . 69 ALA H . 10102 1 821 . 1 1 69 69 ALA HA H 1 4.854 0.030 . 1 . . . . 69 ALA HA . 10102 1 822 . 1 1 69 69 ALA HB1 H 1 1.797 0.030 . 1 . . . . 69 ALA HB . 10102 1 823 . 1 1 69 69 ALA HB2 H 1 1.797 0.030 . 1 . . . . 69 ALA HB . 10102 1 824 . 1 1 69 69 ALA HB3 H 1 1.797 0.030 . 1 . . . . 69 ALA HB . 10102 1 825 . 1 1 69 69 ALA C C 13 177.309 0.300 . 1 . . . . 69 ALA C . 10102 1 826 . 1 1 69 69 ALA CA C 13 51.783 0.300 . 1 . . . . 69 ALA CA . 10102 1 827 . 1 1 69 69 ALA CB C 13 18.831 0.300 . 1 . . . . 69 ALA CB . 10102 1 828 . 1 1 69 69 ALA N N 15 130.564 0.300 . 1 . . . . 69 ALA N . 10102 1 829 . 1 1 70 70 LYS H H 1 8.456 0.030 . 1 . . . . 70 LYS H . 10102 1 830 . 1 1 70 70 LYS HA H 1 4.463 0.030 . 1 . . . . 70 LYS HA . 10102 1 831 . 1 1 70 70 LYS HB2 H 1 2.109 0.030 . 2 . . . . 70 LYS HB2 . 10102 1 832 . 1 1 70 70 LYS HB3 H 1 1.877 0.030 . 2 . . . . 70 LYS HB3 . 10102 1 833 . 1 1 70 70 LYS HG2 H 1 1.547 0.030 . 1 . . . . 70 LYS HG2 . 10102 1 834 . 1 1 70 70 LYS HG3 H 1 1.547 0.030 . 1 . . . . 70 LYS HG3 . 10102 1 835 . 1 1 70 70 LYS HD2 H 1 1.800 0.030 . 1 . . . . 70 LYS HD2 . 10102 1 836 . 1 1 70 70 LYS HD3 H 1 1.800 0.030 . 1 . . . . 70 LYS HD3 . 10102 1 837 . 1 1 70 70 LYS HE2 H 1 3.109 0.030 . 1 . . . . 70 LYS HE2 . 10102 1 838 . 1 1 70 70 LYS HE3 H 1 3.109 0.030 . 1 . . . . 70 LYS HE3 . 10102 1 839 . 1 1 70 70 LYS C C 13 175.609 0.300 . 1 . . . . 70 LYS C . 10102 1 840 . 1 1 70 70 LYS CA C 13 57.686 0.300 . 1 . . . . 70 LYS CA . 10102 1 841 . 1 1 70 70 LYS CB C 13 32.877 0.300 . 1 . . . . 70 LYS CB . 10102 1 842 . 1 1 70 70 LYS CG C 13 25.160 0.300 . 1 . . . . 70 LYS CG . 10102 1 843 . 1 1 70 70 LYS CD C 13 29.466 0.300 . 1 . . . . 70 LYS CD . 10102 1 844 . 1 1 70 70 LYS CE C 13 42.189 0.300 . 1 . . . . 70 LYS CE . 10102 1 845 . 1 1 70 70 LYS N N 15 121.788 0.300 . 1 . . . . 70 LYS N . 10102 1 846 . 1 1 71 71 VAL H H 1 7.711 0.030 . 1 . . . . 71 VAL H . 10102 1 847 . 1 1 71 71 VAL HA H 1 4.896 0.030 . 1 . . . . 71 VAL HA . 10102 1 848 . 1 1 71 71 VAL HB H 1 2.275 0.030 . 1 . . . . 71 VAL HB . 10102 1 849 . 1 1 71 71 VAL HG11 H 1 1.131 0.030 . 1 . . . . 71 VAL HG1 . 10102 1 850 . 1 1 71 71 VAL HG12 H 1 1.131 0.030 . 1 . . . . 71 VAL HG1 . 10102 1 851 . 1 1 71 71 VAL HG13 H 1 1.131 0.030 . 1 . . . . 71 VAL HG1 . 10102 1 852 . 1 1 71 71 VAL HG21 H 1 1.036 0.030 . 1 . . . . 71 VAL HG2 . 10102 1 853 . 1 1 71 71 VAL HG22 H 1 1.036 0.030 . 1 . . . . 71 VAL HG2 . 10102 1 854 . 1 1 71 71 VAL HG23 H 1 1.036 0.030 . 1 . . . . 71 VAL HG2 . 10102 1 855 . 1 1 71 71 VAL C C 13 176.775 0.300 . 1 . . . . 71 VAL C . 10102 1 856 . 1 1 71 71 VAL CA C 13 58.701 0.300 . 1 . . . . 71 VAL CA . 10102 1 857 . 1 1 71 71 VAL CB C 13 34.007 0.300 . 1 . . . . 71 VAL CB . 10102 1 858 . 1 1 71 71 VAL CG1 C 13 22.066 0.300 . 2 . . . . 71 VAL CG1 . 10102 1 859 . 1 1 71 71 VAL CG2 C 13 20.553 0.300 . 2 . . . . 71 VAL CG2 . 10102 1 860 . 1 1 71 71 VAL N N 15 117.176 0.300 . 1 . . . . 71 VAL N . 10102 1 861 . 1 1 72 72 PRO HA H 1 4.240 0.030 . 1 . . . . 72 PRO HA . 10102 1 862 . 1 1 72 72 PRO HB2 H 1 2.075 0.030 . 1 . . . . 72 PRO HB2 . 10102 1 863 . 1 1 72 72 PRO HB3 H 1 2.075 0.030 . 1 . . . . 72 PRO HB3 . 10102 1 864 . 1 1 72 72 PRO HG2 H 1 2.084 0.030 . 1 . . . . 72 PRO HG2 . 10102 1 865 . 1 1 72 72 PRO HG3 H 1 2.084 0.030 . 1 . . . . 72 PRO HG3 . 10102 1 866 . 1 1 72 72 PRO HD2 H 1 4.007 0.030 . 1 . . . . 72 PRO HD2 . 10102 1 867 . 1 1 72 72 PRO HD3 H 1 4.007 0.030 . 1 . . . . 72 PRO HD3 . 10102 1 868 . 1 1 72 72 PRO C C 13 177.139 0.300 . 1 . . . . 72 PRO C . 10102 1 869 . 1 1 72 72 PRO CA C 13 65.275 0.300 . 1 . . . . 72 PRO CA . 10102 1 870 . 1 1 72 72 PRO CB C 13 32.366 0.300 . 1 . . . . 72 PRO CB . 10102 1 871 . 1 1 72 72 PRO CG C 13 27.506 0.300 . 1 . . . . 72 PRO CG . 10102 1 872 . 1 1 72 72 PRO CD C 13 51.239 0.300 . 1 . . . . 72 PRO CD . 10102 1 873 . 1 1 73 73 THR H H 1 7.156 0.030 . 1 . . . . 73 THR H . 10102 1 874 . 1 1 73 73 THR HA H 1 4.296 0.030 . 1 . . . . 73 THR HA . 10102 1 875 . 1 1 73 73 THR HB H 1 4.472 0.030 . 1 . . . . 73 THR HB . 10102 1 876 . 1 1 73 73 THR HG21 H 1 1.264 0.030 . 1 . . . . 73 THR HG2 . 10102 1 877 . 1 1 73 73 THR HG22 H 1 1.264 0.030 . 1 . . . . 73 THR HG2 . 10102 1 878 . 1 1 73 73 THR HG23 H 1 1.264 0.030 . 1 . . . . 73 THR HG2 . 10102 1 879 . 1 1 73 73 THR C C 13 175.099 0.300 . 1 . . . . 73 THR C . 10102 1 880 . 1 1 73 73 THR CA C 13 61.684 0.300 . 1 . . . . 73 THR CA . 10102 1 881 . 1 1 73 73 THR CB C 13 68.838 0.300 . 1 . . . . 73 THR CB . 10102 1 882 . 1 1 73 73 THR CG2 C 13 22.285 0.300 . 1 . . . . 73 THR CG2 . 10102 1 883 . 1 1 73 73 THR N N 15 105.957 0.300 . 1 . . . . 73 THR N . 10102 1 884 . 1 1 74 74 GLU H H 1 7.762 0.030 . 1 . . . . 74 GLU H . 10102 1 885 . 1 1 74 74 GLU HA H 1 4.212 0.030 . 1 . . . . 74 GLU HA . 10102 1 886 . 1 1 74 74 GLU HB2 H 1 2.355 0.030 . 2 . . . . 74 GLU HB2 . 10102 1 887 . 1 1 74 74 GLU HB3 H 1 2.201 0.030 . 2 . . . . 74 GLU HB3 . 10102 1 888 . 1 1 74 74 GLU HG2 H 1 2.497 0.030 . 1 . . . . 74 GLU HG2 . 10102 1 889 . 1 1 74 74 GLU HG3 H 1 2.497 0.030 . 1 . . . . 74 GLU HG3 . 10102 1 890 . 1 1 74 74 GLU C C 13 176.944 0.300 . 1 . . . . 74 GLU C . 10102 1 891 . 1 1 74 74 GLU CA C 13 57.453 0.300 . 1 . . . . 74 GLU CA . 10102 1 892 . 1 1 74 74 GLU CB C 13 31.024 0.300 . 1 . . . . 74 GLU CB . 10102 1 893 . 1 1 74 74 GLU CG C 13 37.450 0.300 . 1 . . . . 74 GLU CG . 10102 1 894 . 1 1 74 74 GLU N N 15 123.578 0.300 . 1 . . . . 74 GLU N . 10102 1 895 . 1 1 75 75 ARG H H 1 8.235 0.030 . 1 . . . . 75 ARG H . 10102 1 896 . 1 1 75 75 ARG HA H 1 2.926 0.030 . 1 . . . . 75 ARG HA . 10102 1 897 . 1 1 75 75 ARG HB2 H 1 1.810 0.030 . 2 . . . . 75 ARG HB2 . 10102 1 898 . 1 1 75 75 ARG HB3 H 1 1.119 0.030 . 2 . . . . 75 ARG HB3 . 10102 1 899 . 1 1 75 75 ARG HG2 H 1 1.420 0.030 . 2 . . . . 75 ARG HG2 . 10102 1 900 . 1 1 75 75 ARG HG3 H 1 1.262 0.030 . 2 . . . . 75 ARG HG3 . 10102 1 901 . 1 1 75 75 ARG HD2 H 1 2.898 0.030 . 2 . . . . 75 ARG HD2 . 10102 1 902 . 1 1 75 75 ARG HD3 H 1 2.875 0.030 . 2 . . . . 75 ARG HD3 . 10102 1 903 . 1 1 75 75 ARG HE H 1 7.392 0.030 . 1 . . . . 75 ARG HE . 10102 1 904 . 1 1 75 75 ARG C C 13 172.574 0.300 . 1 . . . . 75 ARG C . 10102 1 905 . 1 1 75 75 ARG CA C 13 52.770 0.300 . 1 . . . . 75 ARG CA . 10102 1 906 . 1 1 75 75 ARG CB C 13 30.749 0.300 . 1 . . . . 75 ARG CB . 10102 1 907 . 1 1 75 75 ARG CG C 13 26.602 0.300 . 1 . . . . 75 ARG CG . 10102 1 908 . 1 1 75 75 ARG CD C 13 42.332 0.300 . 1 . . . . 75 ARG CD . 10102 1 909 . 1 1 75 75 ARG N N 15 121.158 0.300 . 1 . . . . 75 ARG N . 10102 1 910 . 1 1 75 75 ARG NE N 15 85.486 0.300 . 1 . . . . 75 ARG NE . 10102 1 911 . 1 1 76 76 SER H H 1 6.745 0.030 . 1 . . . . 76 SER H . 10102 1 912 . 1 1 76 76 SER HA H 1 4.909 0.030 . 1 . . . . 76 SER HA . 10102 1 913 . 1 1 76 76 SER HB2 H 1 3.443 0.030 . 1 . . . . 76 SER HB2 . 10102 1 914 . 1 1 76 76 SER HB3 H 1 3.443 0.030 . 1 . . . . 76 SER HB3 . 10102 1 915 . 1 1 76 76 SER C C 13 172.574 0.300 . 1 . . . . 76 SER C . 10102 1 916 . 1 1 76 76 SER CA C 13 56.076 0.300 . 1 . . . . 76 SER CA . 10102 1 917 . 1 1 76 76 SER CB C 13 66.155 0.300 . 1 . . . . 76 SER CB . 10102 1 918 . 1 1 76 76 SER N N 15 111.282 0.300 . 1 . . . . 76 SER N . 10102 1 919 . 1 1 77 77 ALA H H 1 9.163 0.030 . 1 . . . . 77 ALA H . 10102 1 920 . 1 1 77 77 ALA HA H 1 4.650 0.030 . 1 . . . . 77 ALA HA . 10102 1 921 . 1 1 77 77 ALA HB1 H 1 1.525 0.030 . 1 . . . . 77 ALA HB . 10102 1 922 . 1 1 77 77 ALA HB2 H 1 1.525 0.030 . 1 . . . . 77 ALA HB . 10102 1 923 . 1 1 77 77 ALA HB3 H 1 1.525 0.030 . 1 . . . . 77 ALA HB . 10102 1 924 . 1 1 77 77 ALA C C 13 174.711 0.300 . 1 . . . . 77 ALA C . 10102 1 925 . 1 1 77 77 ALA CA C 13 51.664 0.300 . 1 . . . . 77 ALA CA . 10102 1 926 . 1 1 77 77 ALA CB C 13 23.192 0.300 . 1 . . . . 77 ALA CB . 10102 1 927 . 1 1 77 77 ALA N N 15 123.210 0.300 . 1 . . . . 77 ALA N . 10102 1 928 . 1 1 78 78 VAL H H 1 8.376 0.030 . 1 . . . . 78 VAL H . 10102 1 929 . 1 1 78 78 VAL HA H 1 4.733 0.030 . 1 . . . . 78 VAL HA . 10102 1 930 . 1 1 78 78 VAL HB H 1 1.818 0.030 . 1 . . . . 78 VAL HB . 10102 1 931 . 1 1 78 78 VAL HG11 H 1 0.822 0.030 . 1 . . . . 78 VAL HG1 . 10102 1 932 . 1 1 78 78 VAL HG12 H 1 0.822 0.030 . 1 . . . . 78 VAL HG1 . 10102 1 933 . 1 1 78 78 VAL HG13 H 1 0.822 0.030 . 1 . . . . 78 VAL HG1 . 10102 1 934 . 1 1 78 78 VAL HG21 H 1 0.692 0.030 . 1 . . . . 78 VAL HG2 . 10102 1 935 . 1 1 78 78 VAL HG22 H 1 0.692 0.030 . 1 . . . . 78 VAL HG2 . 10102 1 936 . 1 1 78 78 VAL HG23 H 1 0.692 0.030 . 1 . . . . 78 VAL HG2 . 10102 1 937 . 1 1 78 78 VAL C C 13 174.735 0.300 . 1 . . . . 78 VAL C . 10102 1 938 . 1 1 78 78 VAL CA C 13 61.372 0.300 . 1 . . . . 78 VAL CA . 10102 1 939 . 1 1 78 78 VAL CB C 13 33.581 0.300 . 1 . . . . 78 VAL CB . 10102 1 940 . 1 1 78 78 VAL CG1 C 13 21.423 0.300 . 2 . . . . 78 VAL CG1 . 10102 1 941 . 1 1 78 78 VAL CG2 C 13 21.542 0.300 . 2 . . . . 78 VAL CG2 . 10102 1 942 . 1 1 78 78 VAL N N 15 119.978 0.300 . 1 . . . . 78 VAL N . 10102 1 943 . 1 1 79 79 LEU H H 1 9.178 0.030 . 1 . . . . 79 LEU H . 10102 1 944 . 1 1 79 79 LEU HA H 1 4.357 0.030 . 1 . . . . 79 LEU HA . 10102 1 945 . 1 1 79 79 LEU HB2 H 1 1.472 0.030 . 2 . . . . 79 LEU HB2 . 10102 1 946 . 1 1 79 79 LEU HB3 H 1 0.693 0.030 . 2 . . . . 79 LEU HB3 . 10102 1 947 . 1 1 79 79 LEU HG H 1 1.333 0.030 . 1 . . . . 79 LEU HG . 10102 1 948 . 1 1 79 79 LEU HD11 H 1 0.194 0.030 . 1 . . . . 79 LEU HD1 . 10102 1 949 . 1 1 79 79 LEU HD12 H 1 0.194 0.030 . 1 . . . . 79 LEU HD1 . 10102 1 950 . 1 1 79 79 LEU HD13 H 1 0.194 0.030 . 1 . . . . 79 LEU HD1 . 10102 1 951 . 1 1 79 79 LEU HD21 H 1 0.271 0.030 . 1 . . . . 79 LEU HD2 . 10102 1 952 . 1 1 79 79 LEU HD22 H 1 0.271 0.030 . 1 . . . . 79 LEU HD2 . 10102 1 953 . 1 1 79 79 LEU HD23 H 1 0.271 0.030 . 1 . . . . 79 LEU HD2 . 10102 1 954 . 1 1 79 79 LEU C C 13 175.633 0.300 . 1 . . . . 79 LEU C . 10102 1 955 . 1 1 79 79 LEU CA C 13 53.700 0.300 . 1 . . . . 79 LEU CA . 10102 1 956 . 1 1 79 79 LEU CB C 13 42.342 0.300 . 1 . . . . 79 LEU CB . 10102 1 957 . 1 1 79 79 LEU CG C 13 26.739 0.300 . 1 . . . . 79 LEU CG . 10102 1 958 . 1 1 79 79 LEU CD1 C 13 24.805 0.300 . 2 . . . . 79 LEU CD1 . 10102 1 959 . 1 1 79 79 LEU CD2 C 13 23.250 0.300 . 2 . . . . 79 LEU CD2 . 10102 1 960 . 1 1 79 79 LEU N N 15 127.116 0.300 . 1 . . . . 79 LEU N . 10102 1 961 . 1 1 80 80 VAL H H 1 7.688 0.030 . 1 . . . . 80 VAL H . 10102 1 962 . 1 1 80 80 VAL HA H 1 4.937 0.030 . 1 . . . . 80 VAL HA . 10102 1 963 . 1 1 80 80 VAL HB H 1 2.111 0.030 . 1 . . . . 80 VAL HB . 10102 1 964 . 1 1 80 80 VAL HG11 H 1 0.842 0.030 . 1 . . . . 80 VAL HG1 . 10102 1 965 . 1 1 80 80 VAL HG12 H 1 0.842 0.030 . 1 . . . . 80 VAL HG1 . 10102 1 966 . 1 1 80 80 VAL HG13 H 1 0.842 0.030 . 1 . . . . 80 VAL HG1 . 10102 1 967 . 1 1 80 80 VAL HG21 H 1 0.834 0.030 . 1 . . . . 80 VAL HG2 . 10102 1 968 . 1 1 80 80 VAL HG22 H 1 0.834 0.030 . 1 . . . . 80 VAL HG2 . 10102 1 969 . 1 1 80 80 VAL HG23 H 1 0.834 0.030 . 1 . . . . 80 VAL HG2 . 10102 1 970 . 1 1 80 80 VAL C C 13 175.245 0.300 . 1 . . . . 80 VAL C . 10102 1 971 . 1 1 80 80 VAL CA C 13 58.650 0.300 . 1 . . . . 80 VAL CA . 10102 1 972 . 1 1 80 80 VAL CB C 13 34.242 0.300 . 1 . . . . 80 VAL CB . 10102 1 973 . 1 1 80 80 VAL CG1 C 13 21.569 0.300 . 2 . . . . 80 VAL CG1 . 10102 1 974 . 1 1 80 80 VAL CG2 C 13 18.018 0.300 . 2 . . . . 80 VAL CG2 . 10102 1 975 . 1 1 80 80 VAL N N 15 112.105 0.300 . 1 . . . . 80 VAL N . 10102 1 976 . 1 1 81 81 ASN H H 1 8.887 0.030 . 1 . . . . 81 ASN H . 10102 1 977 . 1 1 81 81 ASN HA H 1 4.320 0.030 . 1 . . . . 81 ASN HA . 10102 1 978 . 1 1 81 81 ASN HB2 H 1 3.121 0.030 . 2 . . . . 81 ASN HB2 . 10102 1 979 . 1 1 81 81 ASN HB3 H 1 2.882 0.030 . 2 . . . . 81 ASN HB3 . 10102 1 980 . 1 1 81 81 ASN HD21 H 1 7.690 0.030 . 2 . . . . 81 ASN HD21 . 10102 1 981 . 1 1 81 81 ASN HD22 H 1 6.943 0.030 . 2 . . . . 81 ASN HD22 . 10102 1 982 . 1 1 81 81 ASN C C 13 175.027 0.300 . 1 . . . . 81 ASN C . 10102 1 983 . 1 1 81 81 ASN CA C 13 53.856 0.300 . 1 . . . . 81 ASN CA . 10102 1 984 . 1 1 81 81 ASN CB C 13 37.023 0.300 . 1 . . . . 81 ASN CB . 10102 1 985 . 1 1 81 81 ASN N N 15 114.901 0.300 . 1 . . . . 81 ASN N . 10102 1 986 . 1 1 81 81 ASN ND2 N 15 113.670 0.300 . 1 . . . . 81 ASN ND2 . 10102 1 987 . 1 1 82 82 LEU H H 1 8.446 0.030 . 1 . . . . 82 LEU H . 10102 1 988 . 1 1 82 82 LEU HA H 1 4.213 0.030 . 1 . . . . 82 LEU HA . 10102 1 989 . 1 1 82 82 LEU HB2 H 1 1.282 0.030 . 2 . . . . 82 LEU HB2 . 10102 1 990 . 1 1 82 82 LEU HB3 H 1 1.122 0.030 . 2 . . . . 82 LEU HB3 . 10102 1 991 . 1 1 82 82 LEU HG H 1 1.023 0.030 . 1 . . . . 82 LEU HG . 10102 1 992 . 1 1 82 82 LEU HD11 H 1 0.064 0.030 . 1 . . . . 82 LEU HD1 . 10102 1 993 . 1 1 82 82 LEU HD12 H 1 0.064 0.030 . 1 . . . . 82 LEU HD1 . 10102 1 994 . 1 1 82 82 LEU HD13 H 1 0.064 0.030 . 1 . . . . 82 LEU HD1 . 10102 1 995 . 1 1 82 82 LEU HD21 H 1 -0.027 0.030 . 1 . . . . 82 LEU HD2 . 10102 1 996 . 1 1 82 82 LEU HD22 H 1 -0.027 0.030 . 1 . . . . 82 LEU HD2 . 10102 1 997 . 1 1 82 82 LEU HD23 H 1 -0.027 0.030 . 1 . . . . 82 LEU HD2 . 10102 1 998 . 1 1 82 82 LEU C C 13 176.653 0.300 . 1 . . . . 82 LEU C . 10102 1 999 . 1 1 82 82 LEU CA C 13 54.349 0.300 . 1 . . . . 82 LEU CA . 10102 1 1000 . 1 1 82 82 LEU CB C 13 40.829 0.300 . 1 . . . . 82 LEU CB . 10102 1 1001 . 1 1 82 82 LEU CG C 13 26.059 0.300 . 1 . . . . 82 LEU CG . 10102 1 1002 . 1 1 82 82 LEU CD1 C 13 25.637 0.300 . 2 . . . . 82 LEU CD1 . 10102 1 1003 . 1 1 82 82 LEU CD2 C 13 20.427 0.300 . 2 . . . . 82 LEU CD2 . 10102 1 1004 . 1 1 82 82 LEU N N 15 117.895 0.300 . 1 . . . . 82 LEU N . 10102 1 1005 . 1 1 83 83 LYS H H 1 8.390 0.030 . 1 . . . . 83 LYS H . 10102 1 1006 . 1 1 83 83 LYS HA H 1 4.322 0.030 . 1 . . . . 83 LYS HA . 10102 1 1007 . 1 1 83 83 LYS HB2 H 1 1.768 0.030 . 1 . . . . 83 LYS HB2 . 10102 1 1008 . 1 1 83 83 LYS HB3 H 1 1.768 0.030 . 1 . . . . 83 LYS HB3 . 10102 1 1009 . 1 1 83 83 LYS HG2 H 1 1.610 0.030 . 2 . . . . 83 LYS HG2 . 10102 1 1010 . 1 1 83 83 LYS HG3 H 1 1.504 0.030 . 2 . . . . 83 LYS HG3 . 10102 1 1011 . 1 1 83 83 LYS HD2 H 1 1.719 0.030 . 1 . . . . 83 LYS HD2 . 10102 1 1012 . 1 1 83 83 LYS HD3 H 1 1.719 0.030 . 1 . . . . 83 LYS HD3 . 10102 1 1013 . 1 1 83 83 LYS HE2 H 1 3.069 0.030 . 1 . . . . 83 LYS HE2 . 10102 1 1014 . 1 1 83 83 LYS HE3 H 1 3.069 0.030 . 1 . . . . 83 LYS HE3 . 10102 1 1015 . 1 1 83 83 LYS C C 13 176.459 0.300 . 1 . . . . 83 LYS C . 10102 1 1016 . 1 1 83 83 LYS CA C 13 55.578 0.300 . 1 . . . . 83 LYS CA . 10102 1 1017 . 1 1 83 83 LYS CB C 13 32.995 0.300 . 1 . . . . 83 LYS CB . 10102 1 1018 . 1 1 83 83 LYS CG C 13 25.398 0.300 . 1 . . . . 83 LYS CG . 10102 1 1019 . 1 1 83 83 LYS CD C 13 29.052 0.300 . 1 . . . . 83 LYS CD . 10102 1 1020 . 1 1 83 83 LYS CE C 13 42.580 0.300 . 1 . . . . 83 LYS CE . 10102 1 1021 . 1 1 83 83 LYS N N 15 119.472 0.300 . 1 . . . . 83 LYS N . 10102 1 1022 . 1 1 84 84 LYS H H 1 8.230 0.030 . 1 . . . . 84 LYS H . 10102 1 1023 . 1 1 84 84 LYS HA H 1 4.398 0.030 . 1 . . . . 84 LYS HA . 10102 1 1024 . 1 1 84 84 LYS HB2 H 1 1.803 0.030 . 2 . . . . 84 LYS HB2 . 10102 1 1025 . 1 1 84 84 LYS HB3 H 1 1.728 0.030 . 2 . . . . 84 LYS HB3 . 10102 1 1026 . 1 1 84 84 LYS HG2 H 1 1.417 0.030 . 1 . . . . 84 LYS HG2 . 10102 1 1027 . 1 1 84 84 LYS HG3 H 1 1.417 0.030 . 1 . . . . 84 LYS HG3 . 10102 1 1028 . 1 1 84 84 LYS HD2 H 1 1.674 0.030 . 1 . . . . 84 LYS HD2 . 10102 1 1029 . 1 1 84 84 LYS HD3 H 1 1.674 0.030 . 1 . . . . 84 LYS HD3 . 10102 1 1030 . 1 1 84 84 LYS HE2 H 1 2.953 0.030 . 1 . . . . 84 LYS HE2 . 10102 1 1031 . 1 1 84 84 LYS HE3 H 1 2.953 0.030 . 1 . . . . 84 LYS HE3 . 10102 1 1032 . 1 1 84 84 LYS C C 13 177.794 0.300 . 1 . . . . 84 LYS C . 10102 1 1033 . 1 1 84 84 LYS CA C 13 56.984 0.300 . 1 . . . . 84 LYS CA . 10102 1 1034 . 1 1 84 84 LYS CB C 13 33.494 0.300 . 1 . . . . 84 LYS CB . 10102 1 1035 . 1 1 84 84 LYS CG C 13 25.098 0.300 . 1 . . . . 84 LYS CG . 10102 1 1036 . 1 1 84 84 LYS CD C 13 29.767 0.300 . 1 . . . . 84 LYS CD . 10102 1 1037 . 1 1 84 84 LYS CE C 13 41.979 0.300 . 1 . . . . 84 LYS CE . 10102 1 1038 . 1 1 84 84 LYS N N 15 121.796 0.300 . 1 . . . . 84 LYS N . 10102 1 1039 . 1 1 85 85 GLY H H 1 7.930 0.030 . 1 . . . . 85 GLY H . 10102 1 1040 . 1 1 85 85 GLY HA2 H 1 3.903 0.030 . 2 . . . . 85 GLY HA2 . 10102 1 1041 . 1 1 85 85 GLY HA3 H 1 3.726 0.030 . 2 . . . . 85 GLY HA3 . 10102 1 1042 . 1 1 85 85 GLY C C 13 174.444 0.300 . 1 . . . . 85 GLY C . 10102 1 1043 . 1 1 85 85 GLY CA C 13 46.709 0.300 . 1 . . . . 85 GLY CA . 10102 1 1044 . 1 1 85 85 GLY N N 15 112.699 0.300 . 1 . . . . 85 GLY N . 10102 1 1045 . 1 1 86 86 VAL H H 1 7.559 0.030 . 1 . . . . 86 VAL H . 10102 1 1046 . 1 1 86 86 VAL HA H 1 4.404 0.030 . 1 . . . . 86 VAL HA . 10102 1 1047 . 1 1 86 86 VAL HB H 1 1.966 0.030 . 1 . . . . 86 VAL HB . 10102 1 1048 . 1 1 86 86 VAL HG11 H 1 0.644 0.030 . 1 . . . . 86 VAL HG1 . 10102 1 1049 . 1 1 86 86 VAL HG12 H 1 0.644 0.030 . 1 . . . . 86 VAL HG1 . 10102 1 1050 . 1 1 86 86 VAL HG13 H 1 0.644 0.030 . 1 . . . . 86 VAL HG1 . 10102 1 1051 . 1 1 86 86 VAL HG21 H 1 0.586 0.030 . 1 . . . . 86 VAL HG2 . 10102 1 1052 . 1 1 86 86 VAL HG22 H 1 0.586 0.030 . 1 . . . . 86 VAL HG2 . 10102 1 1053 . 1 1 86 86 VAL HG23 H 1 0.586 0.030 . 1 . . . . 86 VAL HG2 . 10102 1 1054 . 1 1 86 86 VAL C C 13 173.813 0.300 . 1 . . . . 86 VAL C . 10102 1 1055 . 1 1 86 86 VAL CA C 13 59.695 0.300 . 1 . . . . 86 VAL CA . 10102 1 1056 . 1 1 86 86 VAL CB C 13 35.130 0.300 . 1 . . . . 86 VAL CB . 10102 1 1057 . 1 1 86 86 VAL CG1 C 13 21.393 0.300 . 2 . . . . 86 VAL CG1 . 10102 1 1058 . 1 1 86 86 VAL CG2 C 13 20.824 0.300 . 2 . . . . 86 VAL CG2 . 10102 1 1059 . 1 1 86 86 VAL N N 15 114.774 0.300 . 1 . . . . 86 VAL N . 10102 1 1060 . 1 1 87 87 THR H H 1 8.131 0.030 . 1 . . . . 87 THR H . 10102 1 1061 . 1 1 87 87 THR HA H 1 5.106 0.030 . 1 . . . . 87 THR HA . 10102 1 1062 . 1 1 87 87 THR HB H 1 3.893 0.030 . 1 . . . . 87 THR HB . 10102 1 1063 . 1 1 87 87 THR HG21 H 1 1.088 0.030 . 1 . . . . 87 THR HG2 . 10102 1 1064 . 1 1 87 87 THR HG22 H 1 1.088 0.030 . 1 . . . . 87 THR HG2 . 10102 1 1065 . 1 1 87 87 THR HG23 H 1 1.088 0.030 . 1 . . . . 87 THR HG2 . 10102 1 1066 . 1 1 87 87 THR C C 13 173.910 0.300 . 1 . . . . 87 THR C . 10102 1 1067 . 1 1 87 87 THR CA C 13 61.610 0.300 . 1 . . . . 87 THR CA . 10102 1 1068 . 1 1 87 87 THR CB C 13 69.821 0.300 . 1 . . . . 87 THR CB . 10102 1 1069 . 1 1 87 87 THR CG2 C 13 22.285 0.300 . 1 . . . . 87 THR CG2 . 10102 1 1070 . 1 1 87 87 THR N N 15 116.205 0.300 . 1 . . . . 87 THR N . 10102 1 1071 . 1 1 88 88 TYR H H 1 9.297 0.030 . 1 . . . . 88 TYR H . 10102 1 1072 . 1 1 88 88 TYR HA H 1 5.362 0.030 . 1 . . . . 88 TYR HA . 10102 1 1073 . 1 1 88 88 TYR HB2 H 1 2.712 0.030 . 2 . . . . 88 TYR HB2 . 10102 1 1074 . 1 1 88 88 TYR HB3 H 1 2.645 0.030 . 2 . . . . 88 TYR HB3 . 10102 1 1075 . 1 1 88 88 TYR HD1 H 1 6.976 0.030 . 1 . . . . 88 TYR HD1 . 10102 1 1076 . 1 1 88 88 TYR HD2 H 1 6.976 0.030 . 1 . . . . 88 TYR HD2 . 10102 1 1077 . 1 1 88 88 TYR HE1 H 1 6.975 0.030 . 1 . . . . 88 TYR HE1 . 10102 1 1078 . 1 1 88 88 TYR HE2 H 1 6.975 0.030 . 1 . . . . 88 TYR HE2 . 10102 1 1079 . 1 1 88 88 TYR C C 13 174.395 0.300 . 1 . . . . 88 TYR C . 10102 1 1080 . 1 1 88 88 TYR CA C 13 57.326 0.300 . 1 . . . . 88 TYR CA . 10102 1 1081 . 1 1 88 88 TYR CB C 13 42.448 0.300 . 1 . . . . 88 TYR CB . 10102 1 1082 . 1 1 88 88 TYR CD1 C 13 132.480 0.300 . 1 . . . . 88 TYR CD1 . 10102 1 1083 . 1 1 88 88 TYR CD2 C 13 132.480 0.300 . 1 . . . . 88 TYR CD2 . 10102 1 1084 . 1 1 88 88 TYR CE1 C 13 118.647 0.300 . 1 . . . . 88 TYR CE1 . 10102 1 1085 . 1 1 88 88 TYR CE2 C 13 118.647 0.300 . 1 . . . . 88 TYR CE2 . 10102 1 1086 . 1 1 88 88 TYR N N 15 123.218 0.300 . 1 . . . . 88 TYR N . 10102 1 1087 . 1 1 89 89 GLU H H 1 9.112 0.030 . 1 . . . . 89 GLU H . 10102 1 1088 . 1 1 89 89 GLU HA H 1 5.128 0.030 . 1 . . . . 89 GLU HA . 10102 1 1089 . 1 1 89 89 GLU HB2 H 1 1.855 0.030 . 1 . . . . 89 GLU HB2 . 10102 1 1090 . 1 1 89 89 GLU HB3 H 1 1.855 0.030 . 1 . . . . 89 GLU HB3 . 10102 1 1091 . 1 1 89 89 GLU HG2 H 1 2.335 0.030 . 1 . . . . 89 GLU HG2 . 10102 1 1092 . 1 1 89 89 GLU HG3 H 1 2.335 0.030 . 1 . . . . 89 GLU HG3 . 10102 1 1093 . 1 1 89 89 GLU C C 13 175.366 0.300 . 1 . . . . 89 GLU C . 10102 1 1094 . 1 1 89 89 GLU CA C 13 54.701 0.300 . 1 . . . . 89 GLU CA . 10102 1 1095 . 1 1 89 89 GLU CB C 13 33.070 0.300 . 1 . . . . 89 GLU CB . 10102 1 1096 . 1 1 89 89 GLU CG C 13 36.902 0.300 . 1 . . . . 89 GLU CG . 10102 1 1097 . 1 1 89 89 GLU N N 15 121.963 0.300 . 1 . . . . 89 GLU N . 10102 1 1098 . 1 1 90 90 ILE H H 1 9.209 0.030 . 1 . . . . 90 ILE H . 10102 1 1099 . 1 1 90 90 ILE HA H 1 5.593 0.030 . 1 . . . . 90 ILE HA . 10102 1 1100 . 1 1 90 90 ILE HB H 1 1.538 0.030 . 1 . . . . 90 ILE HB . 10102 1 1101 . 1 1 90 90 ILE HG12 H 1 1.637 0.030 . 2 . . . . 90 ILE HG12 . 10102 1 1102 . 1 1 90 90 ILE HG13 H 1 1.033 0.030 . 2 . . . . 90 ILE HG13 . 10102 1 1103 . 1 1 90 90 ILE HG21 H 1 0.955 0.030 . 1 . . . . 90 ILE HG2 . 10102 1 1104 . 1 1 90 90 ILE HG22 H 1 0.955 0.030 . 1 . . . . 90 ILE HG2 . 10102 1 1105 . 1 1 90 90 ILE HG23 H 1 0.955 0.030 . 1 . . . . 90 ILE HG2 . 10102 1 1106 . 1 1 90 90 ILE HD11 H 1 0.634 0.030 . 1 . . . . 90 ILE HD1 . 10102 1 1107 . 1 1 90 90 ILE HD12 H 1 0.634 0.030 . 1 . . . . 90 ILE HD1 . 10102 1 1108 . 1 1 90 90 ILE HD13 H 1 0.634 0.030 . 1 . . . . 90 ILE HD1 . 10102 1 1109 . 1 1 90 90 ILE C C 13 173.716 0.300 . 1 . . . . 90 ILE C . 10102 1 1110 . 1 1 90 90 ILE CA C 13 60.032 0.300 . 1 . . . . 90 ILE CA . 10102 1 1111 . 1 1 90 90 ILE CB C 13 42.855 0.300 . 1 . . . . 90 ILE CB . 10102 1 1112 . 1 1 90 90 ILE CG1 C 13 28.096 0.300 . 1 . . . . 90 ILE CG1 . 10102 1 1113 . 1 1 90 90 ILE CG2 C 13 18.323 0.300 . 1 . . . . 90 ILE CG2 . 10102 1 1114 . 1 1 90 90 ILE CD1 C 13 15.202 0.300 . 1 . . . . 90 ILE CD1 . 10102 1 1115 . 1 1 90 90 ILE N N 15 125.006 0.300 . 1 . . . . 90 ILE N . 10102 1 1116 . 1 1 91 91 LYS H H 1 9.352 0.030 . 1 . . . . 91 LYS H . 10102 1 1117 . 1 1 91 91 LYS HA H 1 4.644 0.030 . 1 . . . . 91 LYS HA . 10102 1 1118 . 1 1 91 91 LYS HB2 H 1 1.745 0.030 . 2 . . . . 91 LYS HB2 . 10102 1 1119 . 1 1 91 91 LYS HB3 H 1 1.653 0.030 . 2 . . . . 91 LYS HB3 . 10102 1 1120 . 1 1 91 91 LYS HG2 H 1 0.641 0.030 . 1 . . . . 91 LYS HG2 . 10102 1 1121 . 1 1 91 91 LYS HG3 H 1 0.641 0.030 . 1 . . . . 91 LYS HG3 . 10102 1 1122 . 1 1 91 91 LYS HD2 H 1 1.168 0.030 . 2 . . . . 91 LYS HD2 . 10102 1 1123 . 1 1 91 91 LYS HD3 H 1 1.085 0.030 . 2 . . . . 91 LYS HD3 . 10102 1 1124 . 1 1 91 91 LYS HE2 H 1 2.153 0.030 . 2 . . . . 91 LYS HE2 . 10102 1 1125 . 1 1 91 91 LYS HE3 H 1 0.601 0.030 . 2 . . . . 91 LYS HE3 . 10102 1 1126 . 1 1 91 91 LYS C C 13 172.623 0.300 . 1 . . . . 91 LYS C . 10102 1 1127 . 1 1 91 91 LYS CA C 13 54.919 0.300 . 1 . . . . 91 LYS CA . 10102 1 1128 . 1 1 91 91 LYS CB C 13 36.051 0.300 . 1 . . . . 91 LYS CB . 10102 1 1129 . 1 1 91 91 LYS CG C 13 23.553 0.300 . 1 . . . . 91 LYS CG . 10102 1 1130 . 1 1 91 91 LYS CD C 13 30.763 0.300 . 1 . . . . 91 LYS CD . 10102 1 1131 . 1 1 91 91 LYS CE C 13 41.413 0.300 . 1 . . . . 91 LYS CE . 10102 1 1132 . 1 1 91 91 LYS N N 15 121.468 0.300 . 1 . . . . 91 LYS N . 10102 1 1133 . 1 1 92 92 VAL H H 1 8.482 0.030 . 1 . . . . 92 VAL H . 10102 1 1134 . 1 1 92 92 VAL HA H 1 4.985 0.030 . 1 . . . . 92 VAL HA . 10102 1 1135 . 1 1 92 92 VAL HB H 1 1.246 0.030 . 1 . . . . 92 VAL HB . 10102 1 1136 . 1 1 92 92 VAL HG11 H 1 0.352 0.030 . 1 . . . . 92 VAL HG1 . 10102 1 1137 . 1 1 92 92 VAL HG12 H 1 0.352 0.030 . 1 . . . . 92 VAL HG1 . 10102 1 1138 . 1 1 92 92 VAL HG13 H 1 0.352 0.030 . 1 . . . . 92 VAL HG1 . 10102 1 1139 . 1 1 92 92 VAL HG21 H 1 -0.159 0.030 . 1 . . . . 92 VAL HG2 . 10102 1 1140 . 1 1 92 92 VAL HG22 H 1 -0.159 0.030 . 1 . . . . 92 VAL HG2 . 10102 1 1141 . 1 1 92 92 VAL HG23 H 1 -0.159 0.030 . 1 . . . . 92 VAL HG2 . 10102 1 1142 . 1 1 92 92 VAL C C 13 173.740 0.300 . 1 . . . . 92 VAL C . 10102 1 1143 . 1 1 92 92 VAL CA C 13 60.665 0.300 . 1 . . . . 92 VAL CA . 10102 1 1144 . 1 1 92 92 VAL CB C 13 35.460 0.300 . 1 . . . . 92 VAL CB . 10102 1 1145 . 1 1 92 92 VAL CG1 C 13 22.835 0.300 . 2 . . . . 92 VAL CG1 . 10102 1 1146 . 1 1 92 92 VAL CG2 C 13 21.228 0.300 . 2 . . . . 92 VAL CG2 . 10102 1 1147 . 1 1 92 92 VAL N N 15 118.523 0.300 . 1 . . . . 92 VAL N . 10102 1 1148 . 1 1 93 93 ARG H H 1 8.671 0.030 . 1 . . . . 93 ARG H . 10102 1 1149 . 1 1 93 93 ARG HA H 1 5.346 0.030 . 1 . . . . 93 ARG HA . 10102 1 1150 . 1 1 93 93 ARG HB2 H 1 1.910 0.030 . 2 . . . . 93 ARG HB2 . 10102 1 1151 . 1 1 93 93 ARG HB3 H 1 1.665 0.030 . 2 . . . . 93 ARG HB3 . 10102 1 1152 . 1 1 93 93 ARG HG2 H 1 1.595 0.030 . 2 . . . . 93 ARG HG2 . 10102 1 1153 . 1 1 93 93 ARG HG3 H 1 1.487 0.030 . 2 . . . . 93 ARG HG3 . 10102 1 1154 . 1 1 93 93 ARG HD2 H 1 3.114 0.030 . 2 . . . . 93 ARG HD2 . 10102 1 1155 . 1 1 93 93 ARG HD3 H 1 3.068 0.030 . 2 . . . . 93 ARG HD3 . 10102 1 1156 . 1 1 93 93 ARG HE H 1 8.429 0.030 . 1 . . . . 93 ARG HE . 10102 1 1157 . 1 1 93 93 ARG C C 13 173.643 0.300 . 1 . . . . 93 ARG C . 10102 1 1158 . 1 1 93 93 ARG CA C 13 52.237 0.300 . 1 . . . . 93 ARG CA . 10102 1 1159 . 1 1 93 93 ARG CB C 13 34.269 0.300 . 1 . . . . 93 ARG CB . 10102 1 1160 . 1 1 93 93 ARG CG C 13 25.333 0.300 . 1 . . . . 93 ARG CG . 10102 1 1161 . 1 1 93 93 ARG CD C 13 44.085 0.300 . 1 . . . . 93 ARG CD . 10102 1 1162 . 1 1 93 93 ARG N N 15 124.149 0.300 . 1 . . . . 93 ARG N . 10102 1 1163 . 1 1 93 93 ARG NE N 15 86.036 0.300 . 1 . . . . 93 ARG NE . 10102 1 1164 . 1 1 94 94 PRO HA H 1 4.941 0.030 . 1 . . . . 94 PRO HA . 10102 1 1165 . 1 1 94 94 PRO HB2 H 1 2.079 0.030 . 2 . . . . 94 PRO HB2 . 10102 1 1166 . 1 1 94 94 PRO HB3 H 1 1.698 0.030 . 2 . . . . 94 PRO HB3 . 10102 1 1167 . 1 1 94 94 PRO HG2 H 1 2.199 0.030 . 2 . . . . 94 PRO HG2 . 10102 1 1168 . 1 1 94 94 PRO HG3 H 1 2.076 0.030 . 2 . . . . 94 PRO HG3 . 10102 1 1169 . 1 1 94 94 PRO HD2 H 1 3.931 0.030 . 2 . . . . 94 PRO HD2 . 10102 1 1170 . 1 1 94 94 PRO HD3 H 1 3.765 0.030 . 2 . . . . 94 PRO HD3 . 10102 1 1171 . 1 1 94 94 PRO C C 13 175.439 0.300 . 1 . . . . 94 PRO C . 10102 1 1172 . 1 1 94 94 PRO CA C 13 62.174 0.300 . 1 . . . . 94 PRO CA . 10102 1 1173 . 1 1 94 94 PRO CB C 13 32.928 0.300 . 1 . . . . 94 PRO CB . 10102 1 1174 . 1 1 94 94 PRO CG C 13 27.435 0.300 . 1 . . . . 94 PRO CG . 10102 1 1175 . 1 1 94 94 PRO CD C 13 50.844 0.300 . 1 . . . . 94 PRO CD . 10102 1 1176 . 1 1 95 95 TYR H H 1 7.995 0.030 . 1 . . . . 95 TYR H . 10102 1 1177 . 1 1 95 95 TYR HA H 1 5.267 0.030 . 1 . . . . 95 TYR HA . 10102 1 1178 . 1 1 95 95 TYR HB2 H 1 3.131 0.030 . 2 . . . . 95 TYR HB2 . 10102 1 1179 . 1 1 95 95 TYR HB3 H 1 2.644 0.030 . 2 . . . . 95 TYR HB3 . 10102 1 1180 . 1 1 95 95 TYR HD1 H 1 6.777 0.030 . 1 . . . . 95 TYR HD1 . 10102 1 1181 . 1 1 95 95 TYR HD2 H 1 6.777 0.030 . 1 . . . . 95 TYR HD2 . 10102 1 1182 . 1 1 95 95 TYR HE1 H 1 6.490 0.030 . 1 . . . . 95 TYR HE1 . 10102 1 1183 . 1 1 95 95 TYR HE2 H 1 6.490 0.030 . 1 . . . . 95 TYR HE2 . 10102 1 1184 . 1 1 95 95 TYR C C 13 173.351 0.300 . 1 . . . . 95 TYR C . 10102 1 1185 . 1 1 95 95 TYR CA C 13 57.217 0.300 . 1 . . . . 95 TYR CA . 10102 1 1186 . 1 1 95 95 TYR CB C 13 41.979 0.300 . 1 . . . . 95 TYR CB . 10102 1 1187 . 1 1 95 95 TYR CD1 C 13 133.550 0.300 . 1 . . . . 95 TYR CD1 . 10102 1 1188 . 1 1 95 95 TYR CD2 C 13 133.550 0.300 . 1 . . . . 95 TYR CD2 . 10102 1 1189 . 1 1 95 95 TYR CE1 C 13 118.151 0.300 . 1 . . . . 95 TYR CE1 . 10102 1 1190 . 1 1 95 95 TYR CE2 C 13 118.151 0.300 . 1 . . . . 95 TYR CE2 . 10102 1 1191 . 1 1 95 95 TYR N N 15 115.066 0.300 . 1 . . . . 95 TYR N . 10102 1 1192 . 1 1 96 96 PHE H H 1 8.742 0.030 . 1 . . . . 96 PHE H . 10102 1 1193 . 1 1 96 96 PHE HA H 1 4.381 0.030 . 1 . . . . 96 PHE HA . 10102 1 1194 . 1 1 96 96 PHE HB2 H 1 2.994 0.030 . 1 . . . . 96 PHE HB2 . 10102 1 1195 . 1 1 96 96 PHE HB3 H 1 2.994 0.030 . 1 . . . . 96 PHE HB3 . 10102 1 1196 . 1 1 96 96 PHE HD1 H 1 7.150 0.030 . 1 . . . . 96 PHE HD1 . 10102 1 1197 . 1 1 96 96 PHE HD2 H 1 7.150 0.030 . 1 . . . . 96 PHE HD2 . 10102 1 1198 . 1 1 96 96 PHE HE1 H 1 7.370 0.030 . 1 . . . . 96 PHE HE1 . 10102 1 1199 . 1 1 96 96 PHE HE2 H 1 7.370 0.030 . 1 . . . . 96 PHE HE2 . 10102 1 1200 . 1 1 96 96 PHE HZ H 1 7.269 0.030 . 1 . . . . 96 PHE HZ . 10102 1 1201 . 1 1 96 96 PHE C C 13 172.647 0.300 . 1 . . . . 96 PHE C . 10102 1 1202 . 1 1 96 96 PHE CA C 13 58.157 0.300 . 1 . . . . 96 PHE CA . 10102 1 1203 . 1 1 96 96 PHE CB C 13 42.213 0.300 . 1 . . . . 96 PHE CB . 10102 1 1204 . 1 1 96 96 PHE CD1 C 13 132.281 0.300 . 1 . . . . 96 PHE CD1 . 10102 1 1205 . 1 1 96 96 PHE CD2 C 13 132.281 0.300 . 1 . . . . 96 PHE CD2 . 10102 1 1206 . 1 1 96 96 PHE CE1 C 13 131.663 0.300 . 1 . . . . 96 PHE CE1 . 10102 1 1207 . 1 1 96 96 PHE CE2 C 13 131.663 0.300 . 1 . . . . 96 PHE CE2 . 10102 1 1208 . 1 1 96 96 PHE CZ C 13 130.142 0.300 . 1 . . . . 96 PHE CZ . 10102 1 1209 . 1 1 96 96 PHE N N 15 120.936 0.300 . 1 . . . . 96 PHE N . 10102 1 1210 . 1 1 97 97 ASN H H 1 9.005 0.030 . 1 . . . . 97 ASN H . 10102 1 1211 . 1 1 97 97 ASN HA H 1 4.111 0.030 . 1 . . . . 97 ASN HA . 10102 1 1212 . 1 1 97 97 ASN HB2 H 1 2.791 0.030 . 2 . . . . 97 ASN HB2 . 10102 1 1213 . 1 1 97 97 ASN HB3 H 1 2.735 0.030 . 2 . . . . 97 ASN HB3 . 10102 1 1214 . 1 1 97 97 ASN HD21 H 1 6.871 0.030 . 2 . . . . 97 ASN HD21 . 10102 1 1215 . 1 1 97 97 ASN HD22 H 1 6.683 0.030 . 2 . . . . 97 ASN HD22 . 10102 1 1216 . 1 1 97 97 ASN C C 13 174.784 0.300 . 1 . . . . 97 ASN C . 10102 1 1217 . 1 1 97 97 ASN CA C 13 55.439 0.300 . 1 . . . . 97 ASN CA . 10102 1 1218 . 1 1 97 97 ASN CB C 13 36.941 0.300 . 1 . . . . 97 ASN CB . 10102 1 1219 . 1 1 97 97 ASN N N 15 126.210 0.300 . 1 . . . . 97 ASN N . 10102 1 1220 . 1 1 97 97 ASN ND2 N 15 113.216 0.300 . 1 . . . . 97 ASN ND2 . 10102 1 1221 . 1 1 98 98 GLU H H 1 9.280 0.030 . 1 . . . . 98 GLU H . 10102 1 1222 . 1 1 98 98 GLU HA H 1 4.188 0.030 . 1 . . . . 98 GLU HA . 10102 1 1223 . 1 1 98 98 GLU HB2 H 1 1.851 0.030 . 2 . . . . 98 GLU HB2 . 10102 1 1224 . 1 1 98 98 GLU HB3 H 1 1.790 0.030 . 2 . . . . 98 GLU HB3 . 10102 1 1225 . 1 1 98 98 GLU HG2 H 1 1.905 0.030 . 2 . . . . 98 GLU HG2 . 10102 1 1226 . 1 1 98 98 GLU HG3 H 1 1.404 0.030 . 2 . . . . 98 GLU HG3 . 10102 1 1227 . 1 1 98 98 GLU C C 13 176.143 0.300 . 1 . . . . 98 GLU C . 10102 1 1228 . 1 1 98 98 GLU CA C 13 57.453 0.300 . 1 . . . . 98 GLU CA . 10102 1 1229 . 1 1 98 98 GLU CB C 13 28.615 0.300 . 1 . . . . 98 GLU CB . 10102 1 1230 . 1 1 98 98 GLU CG C 13 35.373 0.300 . 1 . . . . 98 GLU CG . 10102 1 1231 . 1 1 98 98 GLU N N 15 122.594 0.300 . 1 . . . . 98 GLU N . 10102 1 1232 . 1 1 99 99 PHE H H 1 8.671 0.030 . 1 . . . . 99 PHE H . 10102 1 1233 . 1 1 99 99 PHE HA H 1 4.740 0.030 . 1 . . . . 99 PHE HA . 10102 1 1234 . 1 1 99 99 PHE HB2 H 1 3.272 0.030 . 2 . . . . 99 PHE HB2 . 10102 1 1235 . 1 1 99 99 PHE HB3 H 1 3.116 0.030 . 2 . . . . 99 PHE HB3 . 10102 1 1236 . 1 1 99 99 PHE HD1 H 1 7.369 0.030 . 1 . . . . 99 PHE HD1 . 10102 1 1237 . 1 1 99 99 PHE HD2 H 1 7.369 0.030 . 1 . . . . 99 PHE HD2 . 10102 1 1238 . 1 1 99 99 PHE HE1 H 1 7.149 0.030 . 1 . . . . 99 PHE HE1 . 10102 1 1239 . 1 1 99 99 PHE HE2 H 1 7.149 0.030 . 1 . . . . 99 PHE HE2 . 10102 1 1240 . 1 1 99 99 PHE HZ H 1 7.328 0.030 . 1 . . . . 99 PHE HZ . 10102 1 1241 . 1 1 99 99 PHE C C 13 174.929 0.300 . 1 . . . . 99 PHE C . 10102 1 1242 . 1 1 99 99 PHE CA C 13 57.193 0.300 . 1 . . . . 99 PHE CA . 10102 1 1243 . 1 1 99 99 PHE CB C 13 39.868 0.300 . 1 . . . . 99 PHE CB . 10102 1 1244 . 1 1 99 99 PHE CD1 C 13 131.662 0.300 . 1 . . . . 99 PHE CD1 . 10102 1 1245 . 1 1 99 99 PHE CD2 C 13 131.662 0.300 . 1 . . . . 99 PHE CD2 . 10102 1 1246 . 1 1 99 99 PHE CE1 C 13 132.258 0.300 . 1 . . . . 99 PHE CE1 . 10102 1 1247 . 1 1 99 99 PHE CE2 C 13 132.258 0.300 . 1 . . . . 99 PHE CE2 . 10102 1 1248 . 1 1 99 99 PHE CZ C 13 130.317 0.300 . 1 . . . . 99 PHE CZ . 10102 1 1249 . 1 1 99 99 PHE N N 15 122.604 0.300 . 1 . . . . 99 PHE N . 10102 1 1250 . 1 1 100 100 GLN H H 1 8.921 0.030 . 1 . . . . 100 GLN H . 10102 1 1251 . 1 1 100 100 GLN HA H 1 4.833 0.030 . 1 . . . . 100 GLN HA . 10102 1 1252 . 1 1 100 100 GLN HB2 H 1 2.132 0.030 . 2 . . . . 100 GLN HB2 . 10102 1 1253 . 1 1 100 100 GLN HB3 H 1 2.033 0.030 . 2 . . . . 100 GLN HB3 . 10102 1 1254 . 1 1 100 100 GLN HG2 H 1 2.376 0.030 . 2 . . . . 100 GLN HG2 . 10102 1 1255 . 1 1 100 100 GLN HG3 H 1 2.239 0.030 . 2 . . . . 100 GLN HG3 . 10102 1 1256 . 1 1 100 100 GLN HE21 H 1 7.331 0.030 . 2 . . . . 100 GLN HE21 . 10102 1 1257 . 1 1 100 100 GLN HE22 H 1 6.519 0.030 . 2 . . . . 100 GLN HE22 . 10102 1 1258 . 1 1 100 100 GLN C C 13 176.435 0.300 . 1 . . . . 100 GLN C . 10102 1 1259 . 1 1 100 100 GLN CA C 13 53.990 0.300 . 1 . . . . 100 GLN CA . 10102 1 1260 . 1 1 100 100 GLN CB C 13 32.132 0.300 . 1 . . . . 100 GLN CB . 10102 1 1261 . 1 1 100 100 GLN CG C 13 34.007 0.300 . 1 . . . . 100 GLN CG . 10102 1 1262 . 1 1 100 100 GLN N N 15 119.956 0.300 . 1 . . . . 100 GLN N . 10102 1 1263 . 1 1 100 100 GLN NE2 N 15 112.523 0.300 . 1 . . . . 100 GLN NE2 . 10102 1 1264 . 1 1 101 101 GLY H H 1 8.366 0.030 . 1 . . . . 101 GLY H . 10102 1 1265 . 1 1 101 101 GLY HA2 H 1 4.416 0.030 . 2 . . . . 101 GLY HA2 . 10102 1 1266 . 1 1 101 101 GLY HA3 H 1 3.468 0.030 . 2 . . . . 101 GLY HA3 . 10102 1 1267 . 1 1 101 101 GLY C C 13 171.482 0.300 . 1 . . . . 101 GLY C . 10102 1 1268 . 1 1 101 101 GLY CA C 13 43.679 0.300 . 1 . . . . 101 GLY CA . 10102 1 1269 . 1 1 101 101 GLY N N 15 108.726 0.300 . 1 . . . . 101 GLY N . 10102 1 1270 . 1 1 102 102 MET H H 1 9.134 0.030 . 1 . . . . 102 MET H . 10102 1 1271 . 1 1 102 102 MET HA H 1 4.414 0.030 . 1 . . . . 102 MET HA . 10102 1 1272 . 1 1 102 102 MET HB2 H 1 2.120 0.030 . 2 . . . . 102 MET HB2 . 10102 1 1273 . 1 1 102 102 MET HB3 H 1 2.075 0.030 . 2 . . . . 102 MET HB3 . 10102 1 1274 . 1 1 102 102 MET HG2 H 1 2.764 0.030 . 2 . . . . 102 MET HG2 . 10102 1 1275 . 1 1 102 102 MET HG3 H 1 2.701 0.030 . 2 . . . . 102 MET HG3 . 10102 1 1276 . 1 1 102 102 MET HE1 H 1 2.155 0.030 . 1 . . . . 102 MET HE . 10102 1 1277 . 1 1 102 102 MET HE2 H 1 2.155 0.030 . 1 . . . . 102 MET HE . 10102 1 1278 . 1 1 102 102 MET HE3 H 1 2.155 0.030 . 1 . . . . 102 MET HE . 10102 1 1279 . 1 1 102 102 MET C C 13 176.556 0.300 . 1 . . . . 102 MET C . 10102 1 1280 . 1 1 102 102 MET CA C 13 55.109 0.300 . 1 . . . . 102 MET CA . 10102 1 1281 . 1 1 102 102 MET CB C 13 33.304 0.300 . 1 . . . . 102 MET CB . 10102 1 1282 . 1 1 102 102 MET CG C 13 32.076 0.300 . 1 . . . . 102 MET CG . 10102 1 1283 . 1 1 102 102 MET CE C 13 16.996 0.300 . 1 . . . . 102 MET CE . 10102 1 1284 . 1 1 102 102 MET N N 15 119.088 0.300 . 1 . . . . 102 MET N . 10102 1 1285 . 1 1 103 103 ASP H H 1 8.317 0.030 . 1 . . . . 103 ASP H . 10102 1 1286 . 1 1 103 103 ASP HA H 1 4.632 0.030 . 1 . . . . 103 ASP HA . 10102 1 1287 . 1 1 103 103 ASP HB2 H 1 2.689 0.030 . 2 . . . . 103 ASP HB2 . 10102 1 1288 . 1 1 103 103 ASP HB3 H 1 2.439 0.030 . 2 . . . . 103 ASP HB3 . 10102 1 1289 . 1 1 103 103 ASP C C 13 178.498 0.300 . 1 . . . . 103 ASP C . 10102 1 1290 . 1 1 103 103 ASP CA C 13 55.042 0.300 . 1 . . . . 103 ASP CA . 10102 1 1291 . 1 1 103 103 ASP CB C 13 42.397 0.300 . 1 . . . . 103 ASP CB . 10102 1 1292 . 1 1 103 103 ASP N N 15 122.870 0.300 . 1 . . . . 103 ASP N . 10102 1 1293 . 1 1 104 104 SER H H 1 8.817 0.030 . 1 . . . . 104 SER H . 10102 1 1294 . 1 1 104 104 SER HA H 1 4.610 0.030 . 1 . . . . 104 SER HA . 10102 1 1295 . 1 1 104 104 SER HB2 H 1 4.419 0.030 . 2 . . . . 104 SER HB2 . 10102 1 1296 . 1 1 104 104 SER HB3 H 1 3.816 0.030 . 2 . . . . 104 SER HB3 . 10102 1 1297 . 1 1 104 104 SER C C 13 174.055 0.300 . 1 . . . . 104 SER C . 10102 1 1298 . 1 1 104 104 SER CA C 13 58.381 0.300 . 1 . . . . 104 SER CA . 10102 1 1299 . 1 1 104 104 SER CB C 13 65.877 0.300 . 1 . . . . 104 SER CB . 10102 1 1300 . 1 1 104 104 SER N N 15 116.892 0.300 . 1 . . . . 104 SER N . 10102 1 1301 . 1 1 105 105 GLU H H 1 8.739 0.030 . 1 . . . . 105 GLU H . 10102 1 1302 . 1 1 105 105 GLU HA H 1 4.393 0.030 . 1 . . . . 105 GLU HA . 10102 1 1303 . 1 1 105 105 GLU HB2 H 1 2.198 0.030 . 1 . . . . 105 GLU HB2 . 10102 1 1304 . 1 1 105 105 GLU HB3 H 1 2.198 0.030 . 1 . . . . 105 GLU HB3 . 10102 1 1305 . 1 1 105 105 GLU HG2 H 1 2.498 0.030 . 1 . . . . 105 GLU HG2 . 10102 1 1306 . 1 1 105 105 GLU HG3 H 1 2.498 0.030 . 1 . . . . 105 GLU HG3 . 10102 1 1307 . 1 1 105 105 GLU C C 13 177.576 0.300 . 1 . . . . 105 GLU C . 10102 1 1308 . 1 1 105 105 GLU CA C 13 57.688 0.300 . 1 . . . . 105 GLU CA . 10102 1 1309 . 1 1 105 105 GLU CB C 13 30.223 0.300 . 1 . . . . 105 GLU CB . 10102 1 1310 . 1 1 105 105 GLU CG C 13 36.710 0.300 . 1 . . . . 105 GLU CG . 10102 1 1311 . 1 1 105 105 GLU N N 15 119.529 0.300 . 1 . . . . 105 GLU N . 10102 1 1312 . 1 1 106 106 SER H H 1 8.875 0.030 . 1 . . . . 106 SER H . 10102 1 1313 . 1 1 106 106 SER HA H 1 5.488 0.030 . 1 . . . . 106 SER HA . 10102 1 1314 . 1 1 106 106 SER HB2 H 1 4.037 0.030 . 2 . . . . 106 SER HB2 . 10102 1 1315 . 1 1 106 106 SER HB3 H 1 3.944 0.030 . 2 . . . . 106 SER HB3 . 10102 1 1316 . 1 1 106 106 SER C C 13 175.099 0.300 . 1 . . . . 106 SER C . 10102 1 1317 . 1 1 106 106 SER CA C 13 57.611 0.300 . 1 . . . . 106 SER CA . 10102 1 1318 . 1 1 106 106 SER CB C 13 65.451 0.300 . 1 . . . . 106 SER CB . 10102 1 1319 . 1 1 106 106 SER N N 15 121.255 0.300 . 1 . . . . 106 SER N . 10102 1 1320 . 1 1 107 107 LYS H H 1 9.144 0.030 . 1 . . . . 107 LYS H . 10102 1 1321 . 1 1 107 107 LYS HA H 1 4.951 0.030 . 1 . . . . 107 LYS HA . 10102 1 1322 . 1 1 107 107 LYS HB2 H 1 1.916 0.030 . 2 . . . . 107 LYS HB2 . 10102 1 1323 . 1 1 107 107 LYS HB3 H 1 1.578 0.030 . 2 . . . . 107 LYS HB3 . 10102 1 1324 . 1 1 107 107 LYS HG2 H 1 1.502 0.030 . 1 . . . . 107 LYS HG2 . 10102 1 1325 . 1 1 107 107 LYS HG3 H 1 1.502 0.030 . 1 . . . . 107 LYS HG3 . 10102 1 1326 . 1 1 107 107 LYS HD2 H 1 2.018 0.030 . 2 . . . . 107 LYS HD2 . 10102 1 1327 . 1 1 107 107 LYS HD3 H 1 1.734 0.030 . 2 . . . . 107 LYS HD3 . 10102 1 1328 . 1 1 107 107 LYS HE2 H 1 2.948 0.030 . 1 . . . . 107 LYS HE2 . 10102 1 1329 . 1 1 107 107 LYS HE3 H 1 2.948 0.030 . 1 . . . . 107 LYS HE3 . 10102 1 1330 . 1 1 107 107 LYS C C 13 175.415 0.300 . 1 . . . . 107 LYS C . 10102 1 1331 . 1 1 107 107 LYS CA C 13 53.971 0.300 . 1 . . . . 107 LYS CA . 10102 1 1332 . 1 1 107 107 LYS CB C 13 37.352 0.300 . 1 . . . . 107 LYS CB . 10102 1 1333 . 1 1 107 107 LYS CG C 13 25.802 0.300 . 1 . . . . 107 LYS CG . 10102 1 1334 . 1 1 107 107 LYS CD C 13 29.193 0.300 . 1 . . . . 107 LYS CD . 10102 1 1335 . 1 1 107 107 LYS CE C 13 43.151 0.300 . 1 . . . . 107 LYS CE . 10102 1 1336 . 1 1 107 107 LYS N N 15 120.562 0.300 . 1 . . . . 107 LYS N . 10102 1 1337 . 1 1 108 108 THR H H 1 8.439 0.030 . 1 . . . . 108 THR H . 10102 1 1338 . 1 1 108 108 THR HA H 1 5.864 0.030 . 1 . . . . 108 THR HA . 10102 1 1339 . 1 1 108 108 THR HB H 1 4.033 0.030 . 1 . . . . 108 THR HB . 10102 1 1340 . 1 1 108 108 THR HG21 H 1 1.159 0.030 . 1 . . . . 108 THR HG2 . 10102 1 1341 . 1 1 108 108 THR HG22 H 1 1.159 0.030 . 1 . . . . 108 THR HG2 . 10102 1 1342 . 1 1 108 108 THR HG23 H 1 1.159 0.030 . 1 . . . . 108 THR HG2 . 10102 1 1343 . 1 1 108 108 THR C C 13 174.250 0.300 . 1 . . . . 108 THR C . 10102 1 1344 . 1 1 108 108 THR CA C 13 59.948 0.300 . 1 . . . . 108 THR CA . 10102 1 1345 . 1 1 108 108 THR CB C 13 71.902 0.300 . 1 . . . . 108 THR CB . 10102 1 1346 . 1 1 108 108 THR CG2 C 13 21.581 0.300 . 1 . . . . 108 THR CG2 . 10102 1 1347 . 1 1 108 108 THR N N 15 112.150 0.300 . 1 . . . . 108 THR N . 10102 1 1348 . 1 1 109 109 VAL H H 1 9.042 0.030 . 1 . . . . 109 VAL H . 10102 1 1349 . 1 1 109 109 VAL HA H 1 4.598 0.030 . 1 . . . . 109 VAL HA . 10102 1 1350 . 1 1 109 109 VAL HB H 1 1.893 0.030 . 1 . . . . 109 VAL HB . 10102 1 1351 . 1 1 109 109 VAL HG11 H 1 0.880 0.030 . 1 . . . . 109 VAL HG1 . 10102 1 1352 . 1 1 109 109 VAL HG12 H 1 0.880 0.030 . 1 . . . . 109 VAL HG1 . 10102 1 1353 . 1 1 109 109 VAL HG13 H 1 0.880 0.030 . 1 . . . . 109 VAL HG1 . 10102 1 1354 . 1 1 109 109 VAL HG21 H 1 0.849 0.030 . 1 . . . . 109 VAL HG2 . 10102 1 1355 . 1 1 109 109 VAL HG22 H 1 0.849 0.030 . 1 . . . . 109 VAL HG2 . 10102 1 1356 . 1 1 109 109 VAL HG23 H 1 0.849 0.030 . 1 . . . . 109 VAL HG2 . 10102 1 1357 . 1 1 109 109 VAL C C 13 170.802 0.300 . 1 . . . . 109 VAL C . 10102 1 1358 . 1 1 109 109 VAL CA C 13 59.766 0.300 . 1 . . . . 109 VAL CA . 10102 1 1359 . 1 1 109 109 VAL CB C 13 35.414 0.300 . 1 . . . . 109 VAL CB . 10102 1 1360 . 1 1 109 109 VAL CG1 C 13 22.120 0.300 . 2 . . . . 109 VAL CG1 . 10102 1 1361 . 1 1 109 109 VAL CG2 C 13 19.911 0.300 . 2 . . . . 109 VAL CG2 . 10102 1 1362 . 1 1 109 109 VAL N N 15 120.787 0.300 . 1 . . . . 109 VAL N . 10102 1 1363 . 1 1 110 110 ARG H H 1 8.244 0.030 . 1 . . . . 110 ARG H . 10102 1 1364 . 1 1 110 110 ARG HA H 1 5.303 0.030 . 1 . . . . 110 ARG HA . 10102 1 1365 . 1 1 110 110 ARG HB2 H 1 1.750 0.030 . 2 . . . . 110 ARG HB2 . 10102 1 1366 . 1 1 110 110 ARG HB3 H 1 1.588 0.030 . 2 . . . . 110 ARG HB3 . 10102 1 1367 . 1 1 110 110 ARG HG2 H 1 1.583 0.030 . 2 . . . . 110 ARG HG2 . 10102 1 1368 . 1 1 110 110 ARG HG3 H 1 1.344 0.030 . 2 . . . . 110 ARG HG3 . 10102 1 1369 . 1 1 110 110 ARG HD2 H 1 3.078 0.030 . 2 . . . . 110 ARG HD2 . 10102 1 1370 . 1 1 110 110 ARG HD3 H 1 3.046 0.030 . 2 . . . . 110 ARG HD3 . 10102 1 1371 . 1 1 110 110 ARG HE H 1 7.038 0.030 . 1 . . . . 110 ARG HE . 10102 1 1372 . 1 1 110 110 ARG C C 13 176.872 0.300 . 1 . . . . 110 ARG C . 10102 1 1373 . 1 1 110 110 ARG CA C 13 53.915 0.300 . 1 . . . . 110 ARG CA . 10102 1 1374 . 1 1 110 110 ARG CB C 13 32.699 0.300 . 1 . . . . 110 ARG CB . 10102 1 1375 . 1 1 110 110 ARG CG C 13 27.208 0.300 . 1 . . . . 110 ARG CG . 10102 1 1376 . 1 1 110 110 ARG CD C 13 43.584 0.300 . 1 . . . . 110 ARG CD . 10102 1 1377 . 1 1 110 110 ARG N N 15 127.032 0.300 . 1 . . . . 110 ARG N . 10102 1 1378 . 1 1 110 110 ARG NE N 15 84.782 0.300 . 1 . . . . 110 ARG NE . 10102 1 1379 . 1 1 111 111 THR H H 1 9.323 0.030 . 1 . . . . 111 THR H . 10102 1 1380 . 1 1 111 111 THR HA H 1 4.253 0.030 . 1 . . . . 111 THR HA . 10102 1 1381 . 1 1 111 111 THR HB H 1 4.939 0.030 . 1 . . . . 111 THR HB . 10102 1 1382 . 1 1 111 111 THR HG21 H 1 1.139 0.030 . 1 . . . . 111 THR HG2 . 10102 1 1383 . 1 1 111 111 THR HG22 H 1 1.139 0.030 . 1 . . . . 111 THR HG2 . 10102 1 1384 . 1 1 111 111 THR HG23 H 1 1.139 0.030 . 1 . . . . 111 THR HG2 . 10102 1 1385 . 1 1 111 111 THR C C 13 175.196 0.300 . 1 . . . . 111 THR C . 10102 1 1386 . 1 1 111 111 THR CA C 13 61.653 0.300 . 1 . . . . 111 THR CA . 10102 1 1387 . 1 1 111 111 THR CB C 13 68.274 0.300 . 1 . . . . 111 THR CB . 10102 1 1388 . 1 1 111 111 THR CG2 C 13 23.222 0.300 . 1 . . . . 111 THR CG2 . 10102 1 1389 . 1 1 111 111 THR N N 15 117.238 0.300 . 1 . . . . 111 THR N . 10102 1 1390 . 1 1 112 112 THR H H 1 7.266 0.030 . 1 . . . . 112 THR H . 10102 1 1391 . 1 1 112 112 THR HA H 1 4.354 0.030 . 1 . . . . 112 THR HA . 10102 1 1392 . 1 1 112 112 THR HB H 1 4.217 0.030 . 1 . . . . 112 THR HB . 10102 1 1393 . 1 1 112 112 THR HG21 H 1 1.253 0.030 . 1 . . . . 112 THR HG2 . 10102 1 1394 . 1 1 112 112 THR HG22 H 1 1.253 0.030 . 1 . . . . 112 THR HG2 . 10102 1 1395 . 1 1 112 112 THR HG23 H 1 1.253 0.030 . 1 . . . . 112 THR HG2 . 10102 1 1396 . 1 1 112 112 THR C C 13 173.254 0.300 . 1 . . . . 112 THR C . 10102 1 1397 . 1 1 112 112 THR CA C 13 61.226 0.300 . 1 . . . . 112 THR CA . 10102 1 1398 . 1 1 112 112 THR CB C 13 70.316 0.300 . 1 . . . . 112 THR CB . 10102 1 1399 . 1 1 112 112 THR CG2 C 13 22.285 0.300 . 1 . . . . 112 THR CG2 . 10102 1 1400 . 1 1 112 112 THR N N 15 112.215 0.300 . 1 . . . . 112 THR N . 10102 1 1401 . 1 1 113 113 GLU H H 1 8.450 0.030 . 1 . . . . 113 GLU H . 10102 1 1402 . 1 1 113 113 GLU HA H 1 4.308 0.030 . 1 . . . . 113 GLU HA . 10102 1 1403 . 1 1 113 113 GLU HB2 H 1 2.094 0.030 . 2 . . . . 113 GLU HB2 . 10102 1 1404 . 1 1 113 113 GLU HB3 H 1 1.919 0.030 . 2 . . . . 113 GLU HB3 . 10102 1 1405 . 1 1 113 113 GLU HG2 H 1 2.254 0.030 . 1 . . . . 113 GLU HG2 . 10102 1 1406 . 1 1 113 113 GLU HG3 H 1 2.254 0.030 . 1 . . . . 113 GLU HG3 . 10102 1 1407 . 1 1 113 113 GLU C C 13 176.507 0.300 . 1 . . . . 113 GLU C . 10102 1 1408 . 1 1 113 113 GLU CA C 13 56.351 0.300 . 1 . . . . 113 GLU CA . 10102 1 1409 . 1 1 113 113 GLU CB C 13 31.025 0.300 . 1 . . . . 113 GLU CB . 10102 1 1410 . 1 1 113 113 GLU CG C 13 36.587 0.300 . 1 . . . . 113 GLU CG . 10102 1 1411 . 1 1 113 113 GLU N N 15 119.705 0.300 . 1 . . . . 113 GLU N . 10102 1 1412 . 1 1 114 114 GLU H H 1 8.557 0.030 . 1 . . . . 114 GLU H . 10102 1 1413 . 1 1 114 114 GLU HA H 1 4.339 0.030 . 1 . . . . 114 GLU HA . 10102 1 1414 . 1 1 114 114 GLU HB2 H 1 2.092 0.030 . 2 . . . . 114 GLU HB2 . 10102 1 1415 . 1 1 114 114 GLU HB3 H 1 1.935 0.030 . 2 . . . . 114 GLU HB3 . 10102 1 1416 . 1 1 114 114 GLU HG2 H 1 2.270 0.030 . 1 . . . . 114 GLU HG2 . 10102 1 1417 . 1 1 114 114 GLU HG3 H 1 2.270 0.030 . 1 . . . . 114 GLU HG3 . 10102 1 1418 . 1 1 114 114 GLU C C 13 176.289 0.300 . 1 . . . . 114 GLU C . 10102 1 1419 . 1 1 114 114 GLU CA C 13 56.502 0.300 . 1 . . . . 114 GLU CA . 10102 1 1420 . 1 1 114 114 GLU CB C 13 30.627 0.300 . 1 . . . . 114 GLU CB . 10102 1 1421 . 1 1 114 114 GLU CG C 13 36.250 0.300 . 1 . . . . 114 GLU CG . 10102 1 1422 . 1 1 114 114 GLU N N 15 121.639 0.300 . 1 . . . . 114 GLU N . 10102 1 1423 . 1 1 115 115 SER H H 1 8.492 0.030 . 1 . . . . 115 SER H . 10102 1 1424 . 1 1 115 115 SER HA H 1 4.477 0.030 . 1 . . . . 115 SER HA . 10102 1 1425 . 1 1 115 115 SER HB2 H 1 3.891 0.030 . 1 . . . . 115 SER HB2 . 10102 1 1426 . 1 1 115 115 SER HB3 H 1 3.891 0.030 . 1 . . . . 115 SER HB3 . 10102 1 1427 . 1 1 115 115 SER C C 13 174.565 0.300 . 1 . . . . 115 SER C . 10102 1 1428 . 1 1 115 115 SER CA C 13 58.039 0.300 . 1 . . . . 115 SER CA . 10102 1 1429 . 1 1 115 115 SER CB C 13 64.252 0.300 . 1 . . . . 115 SER CB . 10102 1 1430 . 1 1 115 115 SER N N 15 117.590 0.300 . 1 . . . . 115 SER N . 10102 1 stop_ save_