data_16536 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16536 _Entry.Title ; Structure of the E1064A mutant of the N-domain of Wilson Disease Associated Protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-10-03 _Entry.Accession_date 2009-10-03 _Entry.Last_release_date 2012-08-03 _Entry.Original_release_date 2012-08-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details 'The E1064A variant of the ATP7B N-domain (residues 1032-1196) modified to delete the disordered loop A1115-H1138' _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 Oleg Dmitriev . Y. . 16536 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 16536 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID ATP7B . 16536 ATPase . 16536 'ATP binding' . 16536 'copper transport' . 16536 'Wilson disease' . 16536 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16536 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 523 16536 '15N chemical shifts' 141 16536 '1H chemical shifts' 865 16536 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 . . 2012-08-03 2009-10-03 original author . 16536 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2ARF 'wild type N-domain' 16536 PDB 2KOY 'BMRB Entry Tracking System' 16536 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16536 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'The structure of the E1064A mutant reveals ATP-dependent conformational changes in the ATP7B N-domain.' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev Biochemistry _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 Oleg Dmitriev . Y. . 16536 1 2 Svetlana Lutsenko . L. . 16536 1 3 Eva-Maria Uhelmann . E. . 16536 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16536 _Assembly.ID 1 _Assembly.Name 'Wilson Disease Associated Protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'E1064A mutant' 1 $entity A . yes native no no . . . 16536 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 16536 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'E1064A mutant' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AGHMVPRVMRVLLLGDVATL PLRKVLAVVGTAAASSEHPL GVAVTKYCKEELGTETLGYC TDFQAVPGCGIGCKVSNVEG ILAAVPQTFSVLIGNREWLR RNGLTISSDVSDAMTDHEMK GQTAILVAIDGVLCGMIAIA D ; _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 141 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment N-domain _Entity.Mutation ; E1064A deletion H1115-D1138 ; _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14752.269 _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 2KOY . "Structure Of The E1064a Mutant Of The N-Domain Of Wilson Disease Associated Protein" . . . . . 100.00 141 100.00 100.00 1.86e-96 . . . . 16536 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 . ALA . 16536 1 2 . GLY . 16536 1 3 . HIS . 16536 1 4 . MET . 16536 1 5 . VAL . 16536 1 6 . PRO . 16536 1 7 . ARG . 16536 1 8 . VAL . 16536 1 9 . MET . 16536 1 10 . ARG . 16536 1 11 . VAL . 16536 1 12 . LEU . 16536 1 13 . LEU . 16536 1 14 . LEU . 16536 1 15 . GLY . 16536 1 16 . ASP . 16536 1 17 . VAL . 16536 1 18 . ALA . 16536 1 19 . THR . 16536 1 20 . LEU . 16536 1 21 . PRO . 16536 1 22 . LEU . 16536 1 23 . ARG . 16536 1 24 . LYS . 16536 1 25 . VAL . 16536 1 26 . LEU . 16536 1 27 . ALA . 16536 1 28 . VAL . 16536 1 29 . VAL . 16536 1 30 . GLY . 16536 1 31 . THR . 16536 1 32 . ALA . 16536 1 33 . ALA . 16536 1 34 . ALA . 16536 1 35 . SER . 16536 1 36 . SER . 16536 1 37 . GLU . 16536 1 38 . HIS . 16536 1 39 . PRO . 16536 1 40 . LEU . 16536 1 41 . GLY . 16536 1 42 . VAL . 16536 1 43 . ALA . 16536 1 44 . VAL . 16536 1 45 . THR . 16536 1 46 . LYS . 16536 1 47 . TYR . 16536 1 48 . CYS . 16536 1 49 . LYS . 16536 1 50 . GLU . 16536 1 51 . GLU . 16536 1 52 . LEU . 16536 1 53 . GLY . 16536 1 54 . THR . 16536 1 55 . GLU . 16536 1 56 . THR . 16536 1 57 . LEU . 16536 1 58 . GLY . 16536 1 59 . TYR . 16536 1 60 . CYS . 16536 1 61 . THR . 16536 1 62 . ASP . 16536 1 63 . PHE . 16536 1 64 . GLN . 16536 1 65 . ALA . 16536 1 66 . VAL . 16536 1 67 . PRO . 16536 1 68 . GLY . 16536 1 69 . CYS . 16536 1 70 . GLY . 16536 1 71 . ILE . 16536 1 72 . GLY . 16536 1 73 . CYS . 16536 1 74 . LYS . 16536 1 75 . VAL . 16536 1 76 . SER . 16536 1 77 . ASN . 16536 1 78 . VAL . 16536 1 79 . GLU . 16536 1 80 . GLY . 16536 1 81 . ILE . 16536 1 82 . LEU . 16536 1 83 . ALA . 16536 1 84 . ALA . 16536 1 85 . VAL . 16536 1 86 . PRO . 16536 1 87 . GLN . 16536 1 88 . THR . 16536 1 89 . PHE . 16536 1 90 . SER . 16536 1 91 . VAL . 16536 1 92 . LEU . 16536 1 93 . ILE . 16536 1 94 . GLY . 16536 1 95 . ASN . 16536 1 96 . ARG . 16536 1 97 . GLU . 16536 1 98 . TRP . 16536 1 99 . LEU . 16536 1 100 . ARG . 16536 1 101 . ARG . 16536 1 102 . ASN . 16536 1 103 . GLY . 16536 1 104 . LEU . 16536 1 105 . THR . 16536 1 106 . ILE . 16536 1 107 . SER . 16536 1 108 . SER . 16536 1 109 . ASP . 16536 1 110 . VAL . 16536 1 111 . SER . 16536 1 112 . ASP . 16536 1 113 . ALA . 16536 1 114 . MET . 16536 1 115 . THR . 16536 1 116 . ASP . 16536 1 117 . HIS . 16536 1 118 . GLU . 16536 1 119 . MET . 16536 1 120 . LYS . 16536 1 121 . GLY . 16536 1 122 . GLN . 16536 1 123 . THR . 16536 1 124 . ALA . 16536 1 125 . ILE . 16536 1 126 . LEU . 16536 1 127 . VAL . 16536 1 128 . ALA . 16536 1 129 . ILE . 16536 1 130 . ASP . 16536 1 131 . GLY . 16536 1 132 . VAL . 16536 1 133 . LEU . 16536 1 134 . CYS . 16536 1 135 . GLY . 16536 1 136 . MET . 16536 1 137 . ILE . 16536 1 138 . ALA . 16536 1 139 . ILE . 16536 1 140 . ALA . 16536 1 141 . ASP . 16536 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 . ALA 1 1 16536 1 . GLY 2 2 16536 1 . HIS 3 3 16536 1 . MET 4 4 16536 1 . VAL 5 5 16536 1 . PRO 6 6 16536 1 . ARG 7 7 16536 1 . VAL 8 8 16536 1 . MET 9 9 16536 1 . ARG 10 10 16536 1 . VAL 11 11 16536 1 . LEU 12 12 16536 1 . LEU 13 13 16536 1 . LEU 14 14 16536 1 . GLY 15 15 16536 1 . ASP 16 16 16536 1 . VAL 17 17 16536 1 . ALA 18 18 16536 1 . THR 19 19 16536 1 . LEU 20 20 16536 1 . PRO 21 21 16536 1 . LEU 22 22 16536 1 . ARG 23 23 16536 1 . LYS 24 24 16536 1 . VAL 25 25 16536 1 . LEU 26 26 16536 1 . ALA 27 27 16536 1 . VAL 28 28 16536 1 . VAL 29 29 16536 1 . GLY 30 30 16536 1 . THR 31 31 16536 1 . ALA 32 32 16536 1 . ALA 33 33 16536 1 . ALA 34 34 16536 1 . SER 35 35 16536 1 . SER 36 36 16536 1 . GLU 37 37 16536 1 . HIS 38 38 16536 1 . PRO 39 39 16536 1 . LEU 40 40 16536 1 . GLY 41 41 16536 1 . VAL 42 42 16536 1 . ALA 43 43 16536 1 . VAL 44 44 16536 1 . THR 45 45 16536 1 . LYS 46 46 16536 1 . TYR 47 47 16536 1 . CYS 48 48 16536 1 . LYS 49 49 16536 1 . GLU 50 50 16536 1 . GLU 51 51 16536 1 . LEU 52 52 16536 1 . GLY 53 53 16536 1 . THR 54 54 16536 1 . GLU 55 55 16536 1 . THR 56 56 16536 1 . LEU 57 57 16536 1 . GLY 58 58 16536 1 . TYR 59 59 16536 1 . CYS 60 60 16536 1 . THR 61 61 16536 1 . ASP 62 62 16536 1 . PHE 63 63 16536 1 . GLN 64 64 16536 1 . ALA 65 65 16536 1 . VAL 66 66 16536 1 . PRO 67 67 16536 1 . GLY 68 68 16536 1 . CYS 69 69 16536 1 . GLY 70 70 16536 1 . ILE 71 71 16536 1 . GLY 72 72 16536 1 . CYS 73 73 16536 1 . LYS 74 74 16536 1 . VAL 75 75 16536 1 . SER 76 76 16536 1 . ASN 77 77 16536 1 . VAL 78 78 16536 1 . GLU 79 79 16536 1 . GLY 80 80 16536 1 . ILE 81 81 16536 1 . LEU 82 82 16536 1 . ALA 83 83 16536 1 . ALA 84 84 16536 1 . VAL 85 85 16536 1 . PRO 86 86 16536 1 . GLN 87 87 16536 1 . THR 88 88 16536 1 . PHE 89 89 16536 1 . SER 90 90 16536 1 . VAL 91 91 16536 1 . LEU 92 92 16536 1 . ILE 93 93 16536 1 . GLY 94 94 16536 1 . ASN 95 95 16536 1 . ARG 96 96 16536 1 . GLU 97 97 16536 1 . TRP 98 98 16536 1 . LEU 99 99 16536 1 . ARG 100 100 16536 1 . ARG 101 101 16536 1 . ASN 102 102 16536 1 . GLY 103 103 16536 1 . LEU 104 104 16536 1 . THR 105 105 16536 1 . ILE 106 106 16536 1 . SER 107 107 16536 1 . SER 108 108 16536 1 . ASP 109 109 16536 1 . VAL 110 110 16536 1 . SER 111 111 16536 1 . ASP 112 112 16536 1 . ALA 113 113 16536 1 . MET 114 114 16536 1 . THR 115 115 16536 1 . ASP 116 116 16536 1 . HIS 117 117 16536 1 . GLU 118 118 16536 1 . MET 119 119 16536 1 . LYS 120 120 16536 1 . GLY 121 121 16536 1 . GLN 122 122 16536 1 . THR 123 123 16536 1 . ALA 124 124 16536 1 . ILE 125 125 16536 1 . LEU 126 126 16536 1 . VAL 127 127 16536 1 . ALA 128 128 16536 1 . ILE 129 129 16536 1 . ASP 130 130 16536 1 . GLY 131 131 16536 1 . VAL 132 132 16536 1 . LEU 133 133 16536 1 . CYS 134 134 16536 1 . GLY 135 135 16536 1 . MET 136 136 16536 1 . ILE 137 137 16536 1 . ALA 138 138 16536 1 . ILE 139 139 16536 1 . ALA 140 140 16536 1 . ASP 141 141 16536 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 16536 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16536 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 16536 _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 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pTYB12 . . . . . . 16536 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16536 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 16536 1 2 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 16536 1 3 DSS 'natural abundance' . . . . . . 0.3 . . mM . . . . 16536 1 4 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16536 1 5 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16536 1 6 protein '[13C; 15N]' . . 1 $entity . . 0.8 . . mM . . . . 16536 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16536 _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' 0.1 . M 16536 1 pH 6.0 . pH 16536 1 pressure 1 . atm 16536 1 temperature 300 . K 16536 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16536 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 16536 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16536 1 stop_ save_ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 16536 _Software.ID 2 _Software.Name FELIX _Software.Version 2007 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 16536 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 16536 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 16536 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 16536 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16536 3 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 16536 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details Cryoprobe _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16536 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 Cryoprobe . . 16536 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 16536 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 4 '3D HN(COCA)CB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 6 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 8 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16536 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16536 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 16536 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16536 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 16536 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16536 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D HNCO' . . . 16536 1 3 '3D HNCA' . . . 16536 1 4 '3D HN(COCA)CB' . . . 16536 1 5 '3D HNCACB' . . . 16536 1 6 '3D C(CO)NH' . . . 16536 1 7 '3D H(CCO)NH' . . . 16536 1 8 '3D 1H-15N TOCSY' . . . 16536 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA HB1 H 1 1.52 0.03 . 1 . . . . 1 A QB . 16536 1 2 . 1 1 1 1 ALA HB2 H 1 1.52 0.03 . 1 . . . . 1 A QB . 16536 1 3 . 1 1 1 1 ALA HB3 H 1 1.52 0.03 . 1 . . . . 1 A QB . 16536 1 4 . 1 1 1 1 ALA C C 13 174.70 0.30 . 1 . . . . 1 A C . 16536 1 5 . 1 1 2 2 GLY H H 1 8.69 0.03 . 1 . . . . 2 G H . 16536 1 6 . 1 1 2 2 GLY HA2 H 1 3.95 0.03 . 2 . . . . 2 G HA2 . 16536 1 7 . 1 1 2 2 GLY HA3 H 1 3.95 0.03 . 2 . . . . 2 G HA3 . 16536 1 8 . 1 1 2 2 GLY C C 13 174.00 0.30 . 1 . . . . 2 G C . 16536 1 9 . 1 1 2 2 GLY CA C 13 45.30 0.30 . 1 . . . . 2 G CA . 16536 1 10 . 1 1 2 2 GLY N N 15 108.50 0.20 . 1 . . . . 2 G N . 16536 1 11 . 1 1 3 3 HIS H H 1 8.59 0.03 . 1 . . . . 3 H H . 16536 1 12 . 1 1 3 3 HIS HA H 1 4.71 0.03 . 1 . . . . 3 H HA . 16536 1 13 . 1 1 3 3 HIS HB2 H 1 3.23 0.03 . 2 . . . . 3 H HB2 . 16536 1 14 . 1 1 3 3 HIS HB3 H 1 3.11 0.03 . 2 . . . . 3 H HB3 . 16536 1 15 . 1 1 3 3 HIS C C 13 174.90 0.30 . 1 . . . . 3 H C . 16536 1 16 . 1 1 3 3 HIS CA C 13 55.80 0.30 . 1 . . . . 3 H CA . 16536 1 17 . 1 1 3 3 HIS CB C 13 30.00 0.30 . 1 . . . . 3 H CB . 16536 1 18 . 1 1 3 3 HIS N N 15 118.70 0.20 . 1 . . . . 3 H N . 16536 1 19 . 1 1 4 4 MET H H 1 8.49 0.03 . 1 . . . . 4 M H . 16536 1 20 . 1 1 4 4 MET HA H 1 4.50 0.03 . 1 . . . . 4 M HA . 16536 1 21 . 1 1 4 4 MET HB2 H 1 2.01 0.03 . 2 . . . . 4 M HB2 . 16536 1 22 . 1 1 4 4 MET HG2 H 1 2.50 0.03 . 2 . . . . 4 M HG2 . 16536 1 23 . 1 1 4 4 MET C C 13 176.00 0.30 . 1 . . . . 4 M C . 16536 1 24 . 1 1 4 4 MET CA C 13 55.80 0.30 . 1 . . . . 4 M CA . 16536 1 25 . 1 1 4 4 MET CB C 13 33.50 0.30 . 1 . . . . 4 M CB . 16536 1 26 . 1 1 4 4 MET CG C 13 32.30 0.30 . 1 . . . . 4 M CG . 16536 1 27 . 1 1 4 4 MET N N 15 122.00 0.20 . 1 . . . . 4 M N . 16536 1 28 . 1 1 5 5 VAL H H 1 8.15 0.03 . 1 . . . . 5 V H . 16536 1 29 . 1 1 5 5 VAL HA H 1 4.49 0.03 . 1 . . . . 5 V HA . 16536 1 30 . 1 1 5 5 VAL HB H 1 2.10 0.03 . 1 . . . . 5 V HB . 16536 1 31 . 1 1 5 5 VAL HG11 H 1 0.81 0.03 . 1 . . . . 5 V QG1 . 16536 1 32 . 1 1 5 5 VAL HG12 H 1 0.81 0.03 . 1 . . . . 5 V QG1 . 16536 1 33 . 1 1 5 5 VAL HG13 H 1 0.81 0.03 . 1 . . . . 5 V QG1 . 16536 1 34 . 1 1 5 5 VAL HG21 H 1 0.94 0.03 . 1 . . . . 5 V QG2 . 16536 1 35 . 1 1 5 5 VAL HG22 H 1 0.94 0.03 . 1 . . . . 5 V QG2 . 16536 1 36 . 1 1 5 5 VAL HG23 H 1 0.94 0.03 . 1 . . . . 5 V QG2 . 16536 1 37 . 1 1 5 5 VAL C C 13 173.90 0.30 . 1 . . . . 5 V C . 16536 1 38 . 1 1 5 5 VAL CA C 13 60.10 0.30 . 1 . . . . 5 V CA . 16536 1 39 . 1 1 5 5 VAL CB C 13 33.00 0.30 . 1 . . . . 5 V CB . 16536 1 40 . 1 1 5 5 VAL CG2 C 13 20.40 0.30 . 2 . . . . 5 V CG2 . 16536 1 41 . 1 1 5 5 VAL N N 15 121.60 0.20 . 1 . . . . 5 V N . 16536 1 42 . 1 1 6 6 PRO HA H 1 4.75 0.03 . 1 . . . . 6 P HA . 16536 1 43 . 1 1 6 6 PRO HB2 H 1 1.51 0.03 . 2 . . . . 6 P HB2 . 16536 1 44 . 1 1 6 6 PRO HB3 H 1 2.17 0.03 . 2 . . . . 6 P HB3 . 16536 1 45 . 1 1 6 6 PRO HD2 H 1 3.69 0.03 . 2 . . . . 6 P HD2 . 16536 1 46 . 1 1 6 6 PRO HD3 H 1 3.85 0.03 . 2 . . . . 6 P HD3 . 16536 1 47 . 1 1 6 6 PRO HG2 H 1 1.94 0.03 . 2 . . . . 6 P HG2 . 16536 1 48 . 1 1 6 6 PRO C C 13 175.50 0.30 . 1 . . . . 6 P C . 16536 1 49 . 1 1 6 6 PRO CA C 13 63.00 0.30 . 1 . . . . 6 P CA . 16536 1 50 . 1 1 6 6 PRO CB C 13 32.90 0.30 . 1 . . . . 6 P CB . 16536 1 51 . 1 1 6 6 PRO CD C 13 51.20 0.30 . 1 . . . . 6 P CD . 16536 1 52 . 1 1 6 6 PRO CG C 13 28.00 0.30 . 1 . . . . 6 P CG . 16536 1 53 . 1 1 7 7 ARG H H 1 8.47 0.03 . 1 . . . . 7 R H . 16536 1 54 . 1 1 7 7 ARG HA H 1 4.72 0.03 . 1 . . . . 7 R HA . 16536 1 55 . 1 1 7 7 ARG HB2 H 1 1.70 0.03 . 2 . . . . 7 R HB2 . 16536 1 56 . 1 1 7 7 ARG HD2 H 1 3.18 0.03 . 2 . . . . 7 R HD2 . 16536 1 57 . 1 1 7 7 ARG HG2 H 1 1.56 0.03 . 2 . . . . 7 R HG2 . 16536 1 58 . 1 1 7 7 ARG C C 13 175.50 0.30 . 1 . . . . 7 R C . 16536 1 59 . 1 1 7 7 ARG CA C 13 54.40 0.30 . 1 . . . . 7 R CA . 16536 1 60 . 1 1 7 7 ARG CB C 13 33.90 0.30 . 1 . . . . 7 R CB . 16536 1 61 . 1 1 7 7 ARG CD C 13 43.90 0.30 . 1 . . . . 7 R CD . 16536 1 62 . 1 1 7 7 ARG CG C 13 26.80 0.30 . 1 . . . . 7 R CG . 16536 1 63 . 1 1 7 7 ARG N N 15 118.10 0.20 . 1 . . . . 7 R N . 16536 1 64 . 1 1 8 8 VAL H H 1 8.80 0.03 . 1 . . . . 8 V H . 16536 1 65 . 1 1 8 8 VAL HA H 1 3.60 0.03 . 1 . . . . 8 V HA . 16536 1 66 . 1 1 8 8 VAL HB H 1 1.49 0.03 . 1 . . . . 8 V HB . 16536 1 67 . 1 1 8 8 VAL HG11 H 1 0.53 0.03 . 1 . . . . 8 V QG1 . 16536 1 68 . 1 1 8 8 VAL HG12 H 1 0.53 0.03 . 1 . . . . 8 V QG1 . 16536 1 69 . 1 1 8 8 VAL HG13 H 1 0.53 0.03 . 1 . . . . 8 V QG1 . 16536 1 70 . 1 1 8 8 VAL HG21 H 1 -0.13 0.03 . 1 . . . . 8 V QG2 . 16536 1 71 . 1 1 8 8 VAL HG22 H 1 -0.13 0.03 . 1 . . . . 8 V QG2 . 16536 1 72 . 1 1 8 8 VAL HG23 H 1 -0.13 0.03 . 1 . . . . 8 V QG2 . 16536 1 73 . 1 1 8 8 VAL C C 13 175.50 0.30 . 1 . . . . 8 V C . 16536 1 74 . 1 1 8 8 VAL CA C 13 64.40 0.30 . 1 . . . . 8 V CA . 16536 1 75 . 1 1 8 8 VAL CB C 13 31.90 0.30 . 1 . . . . 8 V CB . 16536 1 76 . 1 1 8 8 VAL CG1 C 13 22.70 0.30 . 2 . . . . 8 V CG1 . 16536 1 77 . 1 1 8 8 VAL CG2 C 13 20.30 0.30 . 2 . . . . 8 V CG2 . 16536 1 78 . 1 1 8 8 VAL N N 15 125.10 0.20 . 1 . . . . 8 V N . 16536 1 79 . 1 1 9 9 MET H H 1 9.07 0.03 . 1 . . . . 9 M H . 16536 1 80 . 1 1 9 9 MET HA H 1 4.65 0.03 . 1 . . . . 9 M HA . 16536 1 81 . 1 1 9 9 MET HB2 H 1 2.03 0.03 . 2 . . . . 9 M HB2 . 16536 1 82 . 1 1 9 9 MET HB3 H 1 1.63 0.03 . 2 . . . . 9 M HB3 . 16536 1 83 . 1 1 9 9 MET HG2 H 1 2.45 0.03 . 2 . . . . 9 M HG2 . 16536 1 84 . 1 1 9 9 MET C C 13 176.80 0.30 . 1 . . . . 9 M C . 16536 1 85 . 1 1 9 9 MET CA C 13 55.00 0.30 . 1 . . . . 9 M CA . 16536 1 86 . 1 1 9 9 MET CB C 13 33.50 0.30 . 1 . . . . 9 M CB . 16536 1 87 . 1 1 9 9 MET CG C 13 32.10 0.30 . 1 . . . . 9 M CG . 16536 1 88 . 1 1 9 9 MET N N 15 125.50 0.20 . 1 . . . . 9 M N . 16536 1 89 . 1 1 10 10 ARG H H 1 7.30 0.03 . 1 . . . . 10 R H . 16536 1 90 . 1 1 10 10 ARG HA H 1 4.43 0.03 . 1 . . . . 10 R HA . 16536 1 91 . 1 1 10 10 ARG HB2 H 1 1.59 0.03 . 2 . . . . 10 R HB2 . 16536 1 92 . 1 1 10 10 ARG HB3 H 1 1.87 0.03 . 2 . . . . 10 R HB3 . 16536 1 93 . 1 1 10 10 ARG HD2 H 1 3.24 0.03 . 2 . . . . 10 R HD2 . 16536 1 94 . 1 1 10 10 ARG HG2 H 1 1.42 0.03 . 2 . . . . 10 R HG2 . 16536 1 95 . 1 1 10 10 ARG HG3 H 1 1.87 0.03 . 2 . . . . 10 R HG3 . 16536 1 96 . 1 1 10 10 ARG C C 13 173.50 0.30 . 1 . . . . 10 R C . 16536 1 97 . 1 1 10 10 ARG CA C 13 56.10 0.30 . 1 . . . . 10 R CA . 16536 1 98 . 1 1 10 10 ARG CB C 13 34.30 0.30 . 1 . . . . 10 R CB . 16536 1 99 . 1 1 10 10 ARG CD C 13 44.40 0.30 . 1 . . . . 10 R CD . 16536 1 100 . 1 1 10 10 ARG CG C 13 26.70 0.30 . 1 . . . . 10 R CG . 16536 1 101 . 1 1 10 10 ARG N N 15 116.30 0.20 . 1 . . . . 10 R N . 16536 1 102 . 1 1 11 11 VAL H H 1 8.42 0.03 . 1 . . . . 11 V H . 16536 1 103 . 1 1 11 11 VAL HA H 1 4.47 0.03 . 1 . . . . 11 V HA . 16536 1 104 . 1 1 11 11 VAL HB H 1 2.00 0.03 . 1 . . . . 11 V HB . 16536 1 105 . 1 1 11 11 VAL HG11 H 1 0.64 0.03 . 1 . . . . 11 V QG1 . 16536 1 106 . 1 1 11 11 VAL HG12 H 1 0.64 0.03 . 1 . . . . 11 V QG1 . 16536 1 107 . 1 1 11 11 VAL HG13 H 1 0.64 0.03 . 1 . . . . 11 V QG1 . 16536 1 108 . 1 1 11 11 VAL HG21 H 1 0.77 0.03 . 1 . . . . 11 V QG2 . 16536 1 109 . 1 1 11 11 VAL HG22 H 1 0.77 0.03 . 1 . . . . 11 V QG2 . 16536 1 110 . 1 1 11 11 VAL HG23 H 1 0.77 0.03 . 1 . . . . 11 V QG2 . 16536 1 111 . 1 1 11 11 VAL C C 13 174.20 0.30 . 1 . . . . 11 V C . 16536 1 112 . 1 1 11 11 VAL CA C 13 62.40 0.30 . 1 . . . . 11 V CA . 16536 1 113 . 1 1 11 11 VAL CB C 13 33.50 0.30 . 1 . . . . 11 V CB . 16536 1 114 . 1 1 11 11 VAL CG1 C 13 20.20 0.30 . 2 . . . . 11 V CG1 . 16536 1 115 . 1 1 11 11 VAL CG2 C 13 22.30 0.30 . 2 . . . . 11 V CG2 . 16536 1 116 . 1 1 11 11 VAL N N 15 123.60 0.20 . 1 . . . . 11 V N . 16536 1 117 . 1 1 12 12 LEU H H 1 9.22 0.03 . 1 . . . . 12 L H . 16536 1 118 . 1 1 12 12 LEU HA H 1 4.70 0.03 . 1 . . . . 12 L HA . 16536 1 119 . 1 1 12 12 LEU HB2 H 1 1.78 0.03 . 2 . . . . 12 L HB2 . 16536 1 120 . 1 1 12 12 LEU HB3 H 1 1.27 0.03 . 2 . . . . 12 L HB3 . 16536 1 121 . 1 1 12 12 LEU HD21 H 1 0.88 0.03 . 1 . . . . 12 L QD2 . 16536 1 122 . 1 1 12 12 LEU HD22 H 1 0.88 0.03 . 1 . . . . 12 L QD2 . 16536 1 123 . 1 1 12 12 LEU HD23 H 1 0.88 0.03 . 1 . . . . 12 L QD2 . 16536 1 124 . 1 1 12 12 LEU HG H 1 1.42 0.03 . 1 . . . . 12 L HG . 16536 1 125 . 1 1 12 12 LEU C C 13 175.40 0.30 . 1 . . . . 12 L C . 16536 1 126 . 1 1 12 12 LEU CA C 13 53.60 0.30 . 1 . . . . 12 L CA . 16536 1 127 . 1 1 12 12 LEU CB C 13 45.30 0.30 . 1 . . . . 12 L CB . 16536 1 128 . 1 1 12 12 LEU CD1 C 13 25.80 0.30 . 2 . . . . 12 L CD1 . 16536 1 129 . 1 1 12 12 LEU CD2 C 13 24.10 0.30 . 2 . . . . 12 L CD2 . 16536 1 130 . 1 1 12 12 LEU CG C 13 27.50 0.30 . 1 . . . . 12 L CG . 16536 1 131 . 1 1 12 12 LEU N N 15 129.80 0.20 . 1 . . . . 12 L N . 16536 1 132 . 1 1 13 13 LEU H H 1 8.72 0.03 . 1 . . . . 13 L H . 16536 1 133 . 1 1 13 13 LEU HA H 1 4.83 0.03 . 1 . . . . 13 L HA . 16536 1 134 . 1 1 13 13 LEU HB2 H 1 1.76 0.03 . 2 . . . . 13 L HB2 . 16536 1 135 . 1 1 13 13 LEU HB3 H 1 1.74 0.03 . 2 . . . . 13 L HB3 . 16536 1 136 . 1 1 13 13 LEU HD11 H 1 1.03 0.03 . 1 . . . . 13 L QD1 . 16536 1 137 . 1 1 13 13 LEU HD12 H 1 1.03 0.03 . 1 . . . . 13 L QD1 . 16536 1 138 . 1 1 13 13 LEU HD13 H 1 1.03 0.03 . 1 . . . . 13 L QD1 . 16536 1 139 . 1 1 13 13 LEU HD21 H 1 0.91 0.03 . 1 . . . . 13 L QD2 . 16536 1 140 . 1 1 13 13 LEU HD22 H 1 0.91 0.03 . 1 . . . . 13 L QD2 . 16536 1 141 . 1 1 13 13 LEU HD23 H 1 0.91 0.03 . 1 . . . . 13 L QD2 . 16536 1 142 . 1 1 13 13 LEU C C 13 176.90 0.30 . 1 . . . . 13 L C . 16536 1 143 . 1 1 13 13 LEU CA C 13 54.60 0.30 . 1 . . . . 13 L CA . 16536 1 144 . 1 1 13 13 LEU CB C 13 41.90 0.30 . 1 . . . . 13 L CB . 16536 1 145 . 1 1 13 13 LEU CD1 C 13 25.60 0.30 . 2 . . . . 13 L CD1 . 16536 1 146 . 1 1 13 13 LEU CD2 C 13 23.50 0.30 . 2 . . . . 13 L CD2 . 16536 1 147 . 1 1 13 13 LEU N N 15 125.40 0.20 . 1 . . . . 13 L N . 16536 1 148 . 1 1 14 14 LEU H H 1 7.52 0.03 . 1 . . . . 14 L H . 16536 1 149 . 1 1 14 14 LEU HA H 1 4.55 0.03 . 1 . . . . 14 L HA . 16536 1 150 . 1 1 14 14 LEU HB2 H 1 1.15 0.03 . 2 . . . . 14 L HB2 . 16536 1 151 . 1 1 14 14 LEU HB3 H 1 1.46 0.03 . 2 . . . . 14 L HB3 . 16536 1 152 . 1 1 14 14 LEU HD11 H 1 0.75 0.03 . 1 . . . . 14 L QD1 . 16536 1 153 . 1 1 14 14 LEU HD12 H 1 0.75 0.03 . 1 . . . . 14 L QD1 . 16536 1 154 . 1 1 14 14 LEU HD13 H 1 0.75 0.03 . 1 . . . . 14 L QD1 . 16536 1 155 . 1 1 14 14 LEU HD21 H 1 0.88 0.03 . 1 . . . . 14 L QD2 . 16536 1 156 . 1 1 14 14 LEU HD22 H 1 0.88 0.03 . 1 . . . . 14 L QD2 . 16536 1 157 . 1 1 14 14 LEU HD23 H 1 0.88 0.03 . 1 . . . . 14 L QD2 . 16536 1 158 . 1 1 14 14 LEU HG H 1 1.33 0.03 . 1 . . . . 14 L HG . 16536 1 159 . 1 1 14 14 LEU C C 13 176.70 0.30 . 1 . . . . 14 L C . 16536 1 160 . 1 1 14 14 LEU CA C 13 53.80 0.30 . 1 . . . . 14 L CA . 16536 1 161 . 1 1 14 14 LEU CB C 13 44.50 0.30 . 1 . . . . 14 L CB . 16536 1 162 . 1 1 14 14 LEU CD1 C 13 26.50 0.30 . 2 . . . . 14 L CD1 . 16536 1 163 . 1 1 14 14 LEU CD2 C 13 23.00 0.30 . 2 . . . . 14 L CD2 . 16536 1 164 . 1 1 14 14 LEU N N 15 122.10 0.20 . 1 . . . . 14 L N . 16536 1 165 . 1 1 15 15 GLY H H 1 8.20 0.03 . 1 . . . . 15 G H . 16536 1 166 . 1 1 15 15 GLY HA3 H 1 3.97 0.03 . 2 . . . . 15 G HA3 . 16536 1 167 . 1 1 15 15 GLY C C 13 173.70 0.30 . 1 . . . . 15 G C . 16536 1 168 . 1 1 15 15 GLY CA C 13 45.30 0.30 . 1 . . . . 15 G CA . 16536 1 169 . 1 1 15 15 GLY N N 15 108.00 0.20 . 1 . . . . 15 G N . 16536 1 170 . 1 1 16 16 ASP H H 1 8.45 0.03 . 1 . . . . 16 D H . 16536 1 171 . 1 1 16 16 ASP HA H 1 4.61 0.03 . 1 . . . . 16 D HA . 16536 1 172 . 1 1 16 16 ASP HB2 H 1 2.62 0.03 . 2 . . . . 16 D HB2 . 16536 1 173 . 1 1 16 16 ASP HB3 H 1 2.81 0.03 . 2 . . . . 16 D HB3 . 16536 1 174 . 1 1 16 16 ASP C C 13 176.60 0.30 . 1 . . . . 16 D C . 16536 1 175 . 1 1 16 16 ASP CA C 13 54.40 0.30 . 1 . . . . 16 D CA . 16536 1 176 . 1 1 16 16 ASP CB C 13 41.30 0.30 . 1 . . . . 16 D CB . 16536 1 177 . 1 1 16 16 ASP N N 15 120.60 0.20 . 1 . . . . 16 D N . 16536 1 178 . 1 1 17 17 VAL H H 1 8.30 0.03 . 1 . . . . 17 V H . 16536 1 179 . 1 1 17 17 VAL HA H 1 4.00 0.03 . 1 . . . . 17 V HA . 16536 1 180 . 1 1 17 17 VAL HB H 1 2.23 0.03 . 1 . . . . 17 V HB . 16536 1 181 . 1 1 17 17 VAL HG11 H 1 0.97 0.03 . 1 . . . . 17 V QG1 . 16536 1 182 . 1 1 17 17 VAL HG12 H 1 0.97 0.03 . 1 . . . . 17 V QG1 . 16536 1 183 . 1 1 17 17 VAL HG13 H 1 0.97 0.03 . 1 . . . . 17 V QG1 . 16536 1 184 . 1 1 17 17 VAL HG21 H 1 0.99 0.03 . 1 . . . . 17 V QG2 . 16536 1 185 . 1 1 17 17 VAL HG22 H 1 0.99 0.03 . 1 . . . . 17 V QG2 . 16536 1 186 . 1 1 17 17 VAL HG23 H 1 0.99 0.03 . 1 . . . . 17 V QG2 . 16536 1 187 . 1 1 17 17 VAL C C 13 177.10 0.30 . 1 . . . . 17 V C . 16536 1 188 . 1 1 17 17 VAL CA C 13 63.00 0.30 . 1 . . . . 17 V CA . 16536 1 189 . 1 1 17 17 VAL CB C 13 32.40 0.30 . 1 . . . . 17 V CB . 16536 1 190 . 1 1 17 17 VAL CG1 C 13 20.40 0.30 . 2 . . . . 17 V CG1 . 16536 1 191 . 1 1 17 17 VAL CG2 C 13 21.60 0.30 . 2 . . . . 17 V CG2 . 16536 1 192 . 1 1 17 17 VAL N N 15 121.70 0.20 . 1 . . . . 17 V N . 16536 1 193 . 1 1 18 18 ALA H H 1 8.45 0.03 . 1 . . . . 18 A H . 16536 1 194 . 1 1 18 18 ALA HA H 1 4.25 0.03 . 1 . . . . 18 A HA . 16536 1 195 . 1 1 18 18 ALA HB1 H 1 1.47 0.03 . 1 . . . . 18 A QB . 16536 1 196 . 1 1 18 18 ALA HB2 H 1 1.47 0.03 . 1 . . . . 18 A QB . 16536 1 197 . 1 1 18 18 ALA HB3 H 1 1.47 0.03 . 1 . . . . 18 A QB . 16536 1 198 . 1 1 18 18 ALA C C 13 179.10 0.30 . 1 . . . . 18 A C . 16536 1 199 . 1 1 18 18 ALA CA C 13 54.20 0.30 . 1 . . . . 18 A CA . 16536 1 200 . 1 1 18 18 ALA CB C 13 19.40 0.30 . 1 . . . . 18 A CB . 16536 1 201 . 1 1 18 18 ALA N N 15 125.70 0.20 . 1 . . . . 18 A N . 16536 1 202 . 1 1 19 19 THR H H 1 7.64 0.03 . 1 . . . . 19 T H . 16536 1 203 . 1 1 19 19 THR HA H 1 4.32 0.03 . 1 . . . . 19 T HA . 16536 1 204 . 1 1 19 19 THR HB H 1 4.37 0.03 . 1 . . . . 19 T HB . 16536 1 205 . 1 1 19 19 THR HG21 H 1 1.24 0.03 . 1 . . . . 19 T QG2 . 16536 1 206 . 1 1 19 19 THR HG22 H 1 1.24 0.03 . 1 . . . . 19 T QG2 . 16536 1 207 . 1 1 19 19 THR HG23 H 1 1.24 0.03 . 1 . . . . 19 T QG2 . 16536 1 208 . 1 1 19 19 THR C C 13 174.60 0.30 . 1 . . . . 19 T C . 16536 1 209 . 1 1 19 19 THR CA C 13 62.40 0.30 . 1 . . . . 19 T CA . 16536 1 210 . 1 1 19 19 THR CB C 13 69.60 0.30 . 1 . . . . 19 T CB . 16536 1 211 . 1 1 19 19 THR CG2 C 13 22.30 0.30 . 1 . . . . 19 T CG2 . 16536 1 212 . 1 1 19 19 THR N N 15 108.50 0.20 . 1 . . . . 19 T N . 16536 1 213 . 1 1 20 20 LEU H H 1 7.90 0.03 . 1 . . . . 20 L H . 16536 1 214 . 1 1 20 20 LEU HA H 1 4.70 0.03 . 1 . . . . 20 L HA . 16536 1 215 . 1 1 20 20 LEU HB2 H 1 1.55 0.03 . 2 . . . . 20 L HB2 . 16536 1 216 . 1 1 20 20 LEU HB3 H 1 1.36 0.03 . 2 . . . . 20 L HB3 . 16536 1 217 . 1 1 20 20 LEU HD11 H 1 0.97 0.03 . 1 . . . . 20 L QD1 . 16536 1 218 . 1 1 20 20 LEU HD12 H 1 0.97 0.03 . 1 . . . . 20 L QD1 . 16536 1 219 . 1 1 20 20 LEU HD13 H 1 0.97 0.03 . 1 . . . . 20 L QD1 . 16536 1 220 . 1 1 20 20 LEU HD21 H 1 0.86 0.03 . 1 . . . . 20 L QD2 . 16536 1 221 . 1 1 20 20 LEU HD22 H 1 0.86 0.03 . 1 . . . . 20 L QD2 . 16536 1 222 . 1 1 20 20 LEU HD23 H 1 0.86 0.03 . 1 . . . . 20 L QD2 . 16536 1 223 . 1 1 20 20 LEU HG H 1 1.54 0.03 . 1 . . . . 20 L HG . 16536 1 224 . 1 1 20 20 LEU C C 13 172.40 0.30 . 1 . . . . 20 L C . 16536 1 225 . 1 1 20 20 LEU CA C 13 52.60 0.30 . 1 . . . . 20 L CA . 16536 1 226 . 1 1 20 20 LEU CB C 13 43.60 0.30 . 1 . . . . 20 L CB . 16536 1 227 . 1 1 20 20 LEU CD1 C 13 21.60 0.30 . 2 . . . . 20 L CD1 . 16536 1 228 . 1 1 20 20 LEU CD2 C 13 25.60 0.30 . 2 . . . . 20 L CD2 . 16536 1 229 . 1 1 20 20 LEU CG C 13 26.50 0.30 . 1 . . . . 20 L CG . 16536 1 230 . 1 1 20 20 LEU N N 15 123.40 0.20 . 1 . . . . 20 L N . 16536 1 231 . 1 1 21 21 PRO HA H 1 4.59 0.03 . 1 . . . . 21 P HA . 16536 1 232 . 1 1 21 21 PRO HB2 H 1 2.12 0.03 . 2 . . . . 21 P HB2 . 16536 1 233 . 1 1 21 21 PRO HB3 H 1 2.48 0.03 . 2 . . . . 21 P HB3 . 16536 1 234 . 1 1 21 21 PRO HD2 H 1 3.44 0.03 . 2 . . . . 21 P HD2 . 16536 1 235 . 1 1 21 21 PRO HD3 H 1 3.60 0.03 . 2 . . . . 21 P HD3 . 16536 1 236 . 1 1 21 21 PRO HG2 H 1 1.93 0.03 . 2 . . . . 21 P HG2 . 16536 1 237 . 1 1 21 21 PRO C C 13 177.80 0.30 . 1 . . . . 21 P C . 16536 1 238 . 1 1 21 21 PRO CA C 13 62.60 0.30 . 1 . . . . 21 P CA . 16536 1 239 . 1 1 21 21 PRO CB C 13 32.70 0.30 . 1 . . . . 21 P CB . 16536 1 240 . 1 1 21 21 PRO CD C 13 50.60 0.30 . 1 . . . . 21 P CD . 16536 1 241 . 1 1 21 21 PRO CG C 13 28.40 0.30 . 1 . . . . 21 P CG . 16536 1 242 . 1 1 22 22 LEU H H 1 8.76 0.03 . 1 . . . . 22 L H . 16536 1 243 . 1 1 22 22 LEU HA H 1 3.92 0.03 . 1 . . . . 22 L HA . 16536 1 244 . 1 1 22 22 LEU HB2 H 1 1.82 0.03 . 2 . . . . 22 L HB2 . 16536 1 245 . 1 1 22 22 LEU HB3 H 1 1.67 0.03 . 2 . . . . 22 L HB3 . 16536 1 246 . 1 1 22 22 LEU HD11 H 1 0.97 0.03 . 1 . . . . 22 L QD1 . 16536 1 247 . 1 1 22 22 LEU HD12 H 1 0.97 0.03 . 1 . . . . 22 L QD1 . 16536 1 248 . 1 1 22 22 LEU HD13 H 1 0.97 0.03 . 1 . . . . 22 L QD1 . 16536 1 249 . 1 1 22 22 LEU HD21 H 1 1.01 0.03 . 1 . . . . 22 L QD2 . 16536 1 250 . 1 1 22 22 LEU HD22 H 1 1.01 0.03 . 1 . . . . 22 L QD2 . 16536 1 251 . 1 1 22 22 LEU HD23 H 1 1.01 0.03 . 1 . . . . 22 L QD2 . 16536 1 252 . 1 1 22 22 LEU HG H 1 1.49 0.03 . 1 . . . . 22 L HG . 16536 1 253 . 1 1 22 22 LEU C C 13 178.20 0.30 . 1 . . . . 22 L C . 16536 1 254 . 1 1 22 22 LEU CA C 13 59.30 0.30 . 1 . . . . 22 L CA . 16536 1 255 . 1 1 22 22 LEU CB C 13 42.00 0.30 . 1 . . . . 22 L CB . 16536 1 256 . 1 1 22 22 LEU CD1 C 13 22.40 0.30 . 2 . . . . 22 L CD1 . 16536 1 257 . 1 1 22 22 LEU CD2 C 13 25.80 0.30 . 2 . . . . 22 L CD2 . 16536 1 258 . 1 1 22 22 LEU CG C 13 27.10 0.30 . 1 . . . . 22 L CG . 16536 1 259 . 1 1 22 22 LEU N N 15 122.50 0.20 . 1 . . . . 22 L N . 16536 1 260 . 1 1 23 23 ARG H H 1 8.86 0.03 . 1 . . . . 23 R H . 16536 1 261 . 1 1 23 23 ARG HA H 1 3.75 0.03 . 1 . . . . 23 R HA . 16536 1 262 . 1 1 23 23 ARG HB2 H 1 1.72 0.03 . 2 . . . . 23 R HB2 . 16536 1 263 . 1 1 23 23 ARG HB3 H 1 2.12 0.03 . 2 . . . . 23 R HB3 . 16536 1 264 . 1 1 23 23 ARG HD2 H 1 3.31 0.03 . 2 . . . . 23 R HD2 . 16536 1 265 . 1 1 23 23 ARG HD3 H 1 3.14 0.03 . 2 . . . . 23 R HD3 . 16536 1 266 . 1 1 23 23 ARG C C 13 178.20 0.30 . 1 . . . . 23 R C . 16536 1 267 . 1 1 23 23 ARG CA C 13 60.90 0.30 . 1 . . . . 23 R CA . 16536 1 268 . 1 1 23 23 ARG CB C 13 30.30 0.30 . 1 . . . . 23 R CB . 16536 1 269 . 1 1 23 23 ARG CD C 13 43.90 0.30 . 1 . . . . 23 R CD . 16536 1 270 . 1 1 23 23 ARG N N 15 114.60 0.20 . 1 . . . . 23 R N . 16536 1 271 . 1 1 24 24 LYS H H 1 6.87 0.03 . 1 . . . . 24 K H . 16536 1 272 . 1 1 24 24 LYS HA H 1 3.95 0.03 . 1 . . . . 24 K HA . 16536 1 273 . 1 1 24 24 LYS HB2 H 1 1.86 0.03 . 2 . . . . 24 K HB2 . 16536 1 274 . 1 1 24 24 LYS HB3 H 1 1.80 0.03 . 2 . . . . 24 K HB3 . 16536 1 275 . 1 1 24 24 LYS HE2 H 1 2.79 0.03 . 2 . . . . 24 K HE2 . 16536 1 276 . 1 1 24 24 LYS HE3 H 1 2.90 0.03 . 2 . . . . 24 K HE3 . 16536 1 277 . 1 1 24 24 LYS HG2 H 1 1.09 0.03 . 2 . . . . 24 K HG2 . 16536 1 278 . 1 1 24 24 LYS C C 13 177.50 0.30 . 1 . . . . 24 K C . 16536 1 279 . 1 1 24 24 LYS CA C 13 59.30 0.30 . 1 . . . . 24 K CA . 16536 1 280 . 1 1 24 24 LYS CB C 13 32.90 0.30 . 1 . . . . 24 K CB . 16536 1 281 . 1 1 24 24 LYS CD C 13 30.10 0.30 . 1 . . . . 24 K CD . 16536 1 282 . 1 1 24 24 LYS CE C 13 42.10 0.30 . 1 . . . . 24 K CE . 16536 1 283 . 1 1 24 24 LYS CG C 13 24.90 0.30 . 1 . . . . 24 K CG . 16536 1 284 . 1 1 24 24 LYS N N 15 116.80 0.20 . 1 . . . . 24 K N . 16536 1 285 . 1 1 25 25 VAL H H 1 7.73 0.03 . 1 . . . . 25 V H . 16536 1 286 . 1 1 25 25 VAL HA H 1 3.13 0.03 . 1 . . . . 25 V HA . 16536 1 287 . 1 1 25 25 VAL HB H 1 2.14 0.03 . 1 . . . . 25 V HB . 16536 1 288 . 1 1 25 25 VAL HG11 H 1 0.83 0.03 . 1 . . . . 25 V QG1 . 16536 1 289 . 1 1 25 25 VAL HG12 H 1 0.83 0.03 . 1 . . . . 25 V QG1 . 16536 1 290 . 1 1 25 25 VAL HG13 H 1 0.83 0.03 . 1 . . . . 25 V QG1 . 16536 1 291 . 1 1 25 25 VAL HG21 H 1 0.65 0.03 . 1 . . . . 25 V QG2 . 16536 1 292 . 1 1 25 25 VAL HG22 H 1 0.65 0.03 . 1 . . . . 25 V QG2 . 16536 1 293 . 1 1 25 25 VAL HG23 H 1 0.65 0.03 . 1 . . . . 25 V QG2 . 16536 1 294 . 1 1 25 25 VAL C C 13 178.20 0.30 . 1 . . . . 25 V C . 16536 1 295 . 1 1 25 25 VAL CA C 13 68.00 0.30 . 1 . . . . 25 V CA . 16536 1 296 . 1 1 25 25 VAL CB C 13 31.70 0.30 . 1 . . . . 25 V CB . 16536 1 297 . 1 1 25 25 VAL CG1 C 13 23.80 0.30 . 2 . . . . 25 V CG1 . 16536 1 298 . 1 1 25 25 VAL CG2 C 13 20.20 0.30 . 2 . . . . 25 V CG2 . 16536 1 299 . 1 1 25 25 VAL N N 15 118.40 0.20 . 1 . . . . 25 V N . 16536 1 300 . 1 1 26 26 LEU H H 1 8.82 0.03 . 1 . . . . 26 L H . 16536 1 301 . 1 1 26 26 LEU HA H 1 4.03 0.03 . 1 . . . . 26 L HA . 16536 1 302 . 1 1 26 26 LEU HB2 H 1 1.98 0.03 . 2 . . . . 26 L HB2 . 16536 1 303 . 1 1 26 26 LEU HB3 H 1 1.18 0.03 . 2 . . . . 26 L HB3 . 16536 1 304 . 1 1 26 26 LEU HD11 H 1 0.86 0.03 . 1 . . . . 26 L QD1 . 16536 1 305 . 1 1 26 26 LEU HD12 H 1 0.86 0.03 . 1 . . . . 26 L QD1 . 16536 1 306 . 1 1 26 26 LEU HD13 H 1 0.86 0.03 . 1 . . . . 26 L QD1 . 16536 1 307 . 1 1 26 26 LEU HD21 H 1 0.97 0.03 . 1 . . . . 26 L QD2 . 16536 1 308 . 1 1 26 26 LEU HD22 H 1 0.97 0.03 . 1 . . . . 26 L QD2 . 16536 1 309 . 1 1 26 26 LEU HD23 H 1 0.97 0.03 . 1 . . . . 26 L QD2 . 16536 1 310 . 1 1 26 26 LEU HG H 1 2.02 0.03 . 1 . . . . 26 L HG . 16536 1 311 . 1 1 26 26 LEU C C 13 179.50 0.30 . 1 . . . . 26 L C . 16536 1 312 . 1 1 26 26 LEU CA C 13 58.20 0.30 . 1 . . . . 26 L CA . 16536 1 313 . 1 1 26 26 LEU CB C 13 41.80 0.30 . 1 . . . . 26 L CB . 16536 1 314 . 1 1 26 26 LEU CD1 C 13 26.20 0.30 . 2 . . . . 26 L CD1 . 16536 1 315 . 1 1 26 26 LEU CD2 C 13 22.70 0.30 . 2 . . . . 26 L CD2 . 16536 1 316 . 1 1 26 26 LEU CG C 13 26.50 0.30 . 1 . . . . 26 L CG . 16536 1 317 . 1 1 26 26 LEU N N 15 115.90 0.20 . 1 . . . . 26 L N . 16536 1 318 . 1 1 27 27 ALA H H 1 7.97 0.03 . 1 . . . . 27 A H . 16536 1 319 . 1 1 27 27 ALA HA H 1 3.88 0.03 . 1 . . . . 27 A HA . 16536 1 320 . 1 1 27 27 ALA HB1 H 1 1.40 0.03 . 1 . . . . 27 A QB . 16536 1 321 . 1 1 27 27 ALA HB2 H 1 1.40 0.03 . 1 . . . . 27 A QB . 16536 1 322 . 1 1 27 27 ALA HB3 H 1 1.40 0.03 . 1 . . . . 27 A QB . 16536 1 323 . 1 1 27 27 ALA C C 13 180.20 0.30 . 1 . . . . 27 A C . 16536 1 324 . 1 1 27 27 ALA CA C 13 55.60 0.30 . 1 . . . . 27 A CA . 16536 1 325 . 1 1 27 27 ALA CB C 13 18.80 0.30 . 1 . . . . 27 A CB . 16536 1 326 . 1 1 27 27 ALA N N 15 121.40 0.20 . 1 . . . . 27 A N . 16536 1 327 . 1 1 28 28 VAL H H 1 8.14 0.03 . 1 . . . . 28 V H . 16536 1 328 . 1 1 28 28 VAL HA H 1 3.55 0.03 . 1 . . . . 28 V HA . 16536 1 329 . 1 1 28 28 VAL HB H 1 1.91 0.03 . 1 . . . . 28 V HB . 16536 1 330 . 1 1 28 28 VAL HG11 H 1 0.64 0.03 . 1 . . . . 28 V QG1 . 16536 1 331 . 1 1 28 28 VAL HG12 H 1 0.64 0.03 . 1 . . . . 28 V QG1 . 16536 1 332 . 1 1 28 28 VAL HG13 H 1 0.64 0.03 . 1 . . . . 28 V QG1 . 16536 1 333 . 1 1 28 28 VAL HG21 H 1 0.34 0.03 . 1 . . . . 28 V QG2 . 16536 1 334 . 1 1 28 28 VAL HG22 H 1 0.34 0.03 . 1 . . . . 28 V QG2 . 16536 1 335 . 1 1 28 28 VAL HG23 H 1 0.34 0.03 . 1 . . . . 28 V QG2 . 16536 1 336 . 1 1 28 28 VAL C C 13 177.40 0.30 . 1 . . . . 28 V C . 16536 1 337 . 1 1 28 28 VAL CA C 13 67.00 0.30 . 1 . . . . 28 V CA . 16536 1 338 . 1 1 28 28 VAL CB C 13 32.20 0.30 . 1 . . . . 28 V CB . 16536 1 339 . 1 1 28 28 VAL CG1 C 13 21.90 0.30 . 2 . . . . 28 V CG1 . 16536 1 340 . 1 1 28 28 VAL CG2 C 13 22.80 0.30 . 2 . . . . 28 V CG2 . 16536 1 341 . 1 1 28 28 VAL N N 15 120.30 0.20 . 1 . . . . 28 V N . 16536 1 342 . 1 1 29 29 VAL H H 1 8.91 0.03 . 1 . . . . 29 V H . 16536 1 343 . 1 1 29 29 VAL HA H 1 3.34 0.03 . 1 . . . . 29 V HA . 16536 1 344 . 1 1 29 29 VAL HB H 1 2.11 0.03 . 1 . . . . 29 V HB . 16536 1 345 . 1 1 29 29 VAL HG11 H 1 0.78 0.03 . 1 . . . . 29 V QG1 . 16536 1 346 . 1 1 29 29 VAL HG12 H 1 0.78 0.03 . 1 . . . . 29 V QG1 . 16536 1 347 . 1 1 29 29 VAL HG13 H 1 0.78 0.03 . 1 . . . . 29 V QG1 . 16536 1 348 . 1 1 29 29 VAL HG21 H 1 0.91 0.03 . 1 . . . . 29 V QG2 . 16536 1 349 . 1 1 29 29 VAL HG22 H 1 0.91 0.03 . 1 . . . . 29 V QG2 . 16536 1 350 . 1 1 29 29 VAL HG23 H 1 0.91 0.03 . 1 . . . . 29 V QG2 . 16536 1 351 . 1 1 29 29 VAL C C 13 177.60 0.30 . 1 . . . . 29 V C . 16536 1 352 . 1 1 29 29 VAL CA C 13 66.90 0.30 . 1 . . . . 29 V CA . 16536 1 353 . 1 1 29 29 VAL CB C 13 31.80 0.30 . 1 . . . . 29 V CB . 16536 1 354 . 1 1 29 29 VAL CG1 C 13 21.50 0.30 . 2 . . . . 29 V CG1 . 16536 1 355 . 1 1 29 29 VAL CG2 C 13 25.70 0.30 . 2 . . . . 29 V CG2 . 16536 1 356 . 1 1 29 29 VAL N N 15 119.00 0.20 . 1 . . . . 29 V N . 16536 1 357 . 1 1 30 30 GLY H H 1 8.85 0.03 . 1 . . . . 30 G H . 16536 1 358 . 1 1 30 30 GLY HA2 H 1 3.60 0.03 . 2 . . . . 30 G HA2 . 16536 1 359 . 1 1 30 30 GLY HA3 H 1 3.43 0.03 . 2 . . . . 30 G HA3 . 16536 1 360 . 1 1 30 30 GLY C C 13 174.60 0.30 . 1 . . . . 30 G C . 16536 1 361 . 1 1 30 30 GLY CA C 13 48.40 0.30 . 1 . . . . 30 G CA . 16536 1 362 . 1 1 30 30 GLY N N 15 107.40 0.20 . 1 . . . . 30 G N . 16536 1 363 . 1 1 31 31 THR H H 1 7.36 0.03 . 1 . . . . 31 T H . 16536 1 364 . 1 1 31 31 THR HA H 1 3.80 0.03 . 1 . . . . 31 T HA . 16536 1 365 . 1 1 31 31 THR HB H 1 4.26 0.03 . 1 . . . . 31 T HB . 16536 1 366 . 1 1 31 31 THR HG21 H 1 1.13 0.03 . 1 . . . . 31 T QG2 . 16536 1 367 . 1 1 31 31 THR HG22 H 1 1.13 0.03 . 1 . . . . 31 T QG2 . 16536 1 368 . 1 1 31 31 THR HG23 H 1 1.13 0.03 . 1 . . . . 31 T QG2 . 16536 1 369 . 1 1 31 31 THR C C 13 175.50 0.30 . 1 . . . . 31 T C . 16536 1 370 . 1 1 31 31 THR CA C 13 67.70 0.30 . 1 . . . . 31 T CA . 16536 1 371 . 1 1 31 31 THR CB C 13 68.80 0.30 . 1 . . . . 31 T CB . 16536 1 372 . 1 1 31 31 THR CG2 C 13 22.40 0.30 . 1 . . . . 31 T CG2 . 16536 1 373 . 1 1 31 31 THR N N 15 116.00 0.20 . 1 . . . . 31 T N . 16536 1 374 . 1 1 32 32 ALA H H 1 7.63 0.03 . 1 . . . . 32 A H . 16536 1 375 . 1 1 32 32 ALA HA H 1 4.29 0.03 . 1 . . . . 32 A HA . 16536 1 376 . 1 1 32 32 ALA HB1 H 1 1.30 0.03 . 1 . . . . 32 A QB . 16536 1 377 . 1 1 32 32 ALA HB2 H 1 1.30 0.03 . 1 . . . . 32 A QB . 16536 1 378 . 1 1 32 32 ALA HB3 H 1 1.30 0.03 . 1 . . . . 32 A QB . 16536 1 379 . 1 1 32 32 ALA C C 13 178.50 0.30 . 1 . . . . 32 A C . 16536 1 380 . 1 1 32 32 ALA CA C 13 55.20 0.30 . 1 . . . . 32 A CA . 16536 1 381 . 1 1 32 32 ALA CB C 13 20.80 0.30 . 1 . . . . 32 A CB . 16536 1 382 . 1 1 32 32 ALA N N 15 123.10 0.20 . 1 . . . . 32 A N . 16536 1 383 . 1 1 33 33 ALA H H 1 8.59 0.03 . 1 . . . . 33 A H . 16536 1 384 . 1 1 33 33 ALA HA H 1 3.83 0.03 . 1 . . . . 33 A HA . 16536 1 385 . 1 1 33 33 ALA HB1 H 1 1.41 0.03 . 1 . . . . 33 A QB . 16536 1 386 . 1 1 33 33 ALA HB2 H 1 1.41 0.03 . 1 . . . . 33 A QB . 16536 1 387 . 1 1 33 33 ALA HB3 H 1 1.41 0.03 . 1 . . . . 33 A QB . 16536 1 388 . 1 1 33 33 ALA C C 13 179.50 0.30 . 1 . . . . 33 A C . 16536 1 389 . 1 1 33 33 ALA CA C 13 54.50 0.30 . 1 . . . . 33 A CA . 16536 1 390 . 1 1 33 33 ALA CB C 13 18.90 0.30 . 1 . . . . 33 A CB . 16536 1 391 . 1 1 33 33 ALA N N 15 116.60 0.20 . 1 . . . . 33 A N . 16536 1 392 . 1 1 34 34 ALA H H 1 7.66 0.03 . 1 . . . . 34 A H . 16536 1 393 . 1 1 34 34 ALA HA H 1 4.23 0.03 . 1 . . . . 34 A HA . 16536 1 394 . 1 1 34 34 ALA HB1 H 1 1.53 0.03 . 1 . . . . 34 A QB . 16536 1 395 . 1 1 34 34 ALA HB2 H 1 1.53 0.03 . 1 . . . . 34 A QB . 16536 1 396 . 1 1 34 34 ALA HB3 H 1 1.53 0.03 . 1 . . . . 34 A QB . 16536 1 397 . 1 1 34 34 ALA C C 13 179.30 0.30 . 1 . . . . 34 A C . 16536 1 398 . 1 1 34 34 ALA CA C 13 54.50 0.30 . 1 . . . . 34 A CA . 16536 1 399 . 1 1 34 34 ALA CB C 13 18.50 0.30 . 1 . . . . 34 A CB . 16536 1 400 . 1 1 34 34 ALA N N 15 121.10 0.20 . 1 . . . . 34 A N . 16536 1 401 . 1 1 35 35 SER H H 1 7.36 0.03 . 1 . . . . 35 S H . 16536 1 402 . 1 1 35 35 SER HA H 1 4.26 0.03 . 1 . . . . 35 S HA . 16536 1 403 . 1 1 35 35 SER HB2 H 1 3.20 0.03 . 2 . . . . 35 S HB2 . 16536 1 404 . 1 1 35 35 SER HB3 H 1 3.44 0.03 . 2 . . . . 35 S HB3 . 16536 1 405 . 1 1 35 35 SER C C 13 173.30 0.30 . 1 . . . . 35 S C . 16536 1 406 . 1 1 35 35 SER CA C 13 59.60 0.30 . 1 . . . . 35 S CA . 16536 1 407 . 1 1 35 35 SER CB C 13 64.30 0.30 . 1 . . . . 35 S CB . 16536 1 408 . 1 1 35 35 SER N N 15 112.10 0.20 . 1 . . . . 35 S N . 16536 1 409 . 1 1 36 36 SER H H 1 7.58 0.03 . 1 . . . . 36 S H . 16536 1 410 . 1 1 36 36 SER HA H 1 4.37 0.03 . 1 . . . . 36 S HA . 16536 1 411 . 1 1 36 36 SER HB2 H 1 4.25 0.03 . 2 . . . . 36 S HB2 . 16536 1 412 . 1 1 36 36 SER C C 13 175.30 0.30 . 1 . . . . 36 S C . 16536 1 413 . 1 1 36 36 SER CA C 13 57.80 0.30 . 1 . . . . 36 S CA . 16536 1 414 . 1 1 36 36 SER CB C 13 65.20 0.30 . 1 . . . . 36 S CB . 16536 1 415 . 1 1 36 36 SER N N 15 114.50 0.20 . 1 . . . . 36 S N . 16536 1 416 . 1 1 37 37 GLU H H 1 8.87 0.03 . 1 . . . . 37 E H . 16536 1 417 . 1 1 37 37 GLU HA H 1 4.38 0.03 . 1 . . . . 37 E HA . 16536 1 418 . 1 1 37 37 GLU HB2 H 1 2.22 0.03 . 2 . . . . 37 E HB2 . 16536 1 419 . 1 1 37 37 GLU HB3 H 1 1.89 0.03 . 2 . . . . 37 E HB3 . 16536 1 420 . 1 1 37 37 GLU HG2 H 1 2.24 0.03 . 2 . . . . 37 E HG2 . 16536 1 421 . 1 1 37 37 GLU C C 13 176.20 0.30 . 1 . . . . 37 E C . 16536 1 422 . 1 1 37 37 GLU CA C 13 55.80 0.30 . 1 . . . . 37 E CA . 16536 1 423 . 1 1 37 37 GLU CB C 13 30.20 0.30 . 1 . . . . 37 E CB . 16536 1 424 . 1 1 37 37 GLU CG C 13 36.40 0.30 . 1 . . . . 37 E CG . 16536 1 425 . 1 1 37 37 GLU N N 15 125.60 0.20 . 1 . . . . 37 E N . 16536 1 426 . 1 1 38 38 HIS H H 1 8.42 0.03 . 1 . . . . 38 H H . 16536 1 427 . 1 1 38 38 HIS HA H 1 4.53 0.03 . 1 . . . . 38 H HA . 16536 1 428 . 1 1 38 38 HIS HB2 H 1 3.22 0.03 . 2 . . . . 38 H HB2 . 16536 1 429 . 1 1 38 38 HIS HB3 H 1 2.80 0.03 . 2 . . . . 38 H HB3 . 16536 1 430 . 1 1 38 38 HIS C C 13 175.80 0.30 . 1 . . . . 38 H C . 16536 1 431 . 1 1 38 38 HIS CA C 13 56.60 0.30 . 1 . . . . 38 H CA . 16536 1 432 . 1 1 38 38 HIS N N 15 125.20 0.20 . 1 . . . . 38 H N . 16536 1 433 . 1 1 39 39 PRO HA H 1 4.47 0.30 . 1 . . . . 39 P HA . 16536 1 434 . 1 1 39 39 PRO HD2 H 1 3.85 0.03 . 2 . . . . 39 P HD2 . 16536 1 435 . 1 1 39 39 PRO HD3 H 1 3.58 0.03 . 2 . . . . 39 P HD3 . 16536 1 436 . 1 1 39 39 PRO HG2 H 1 2.12 0.03 . 2 . . . . 39 P HG2 . 16536 1 437 . 1 1 39 39 PRO HG3 H 1 1.97 0.03 . 2 . . . . 39 P HG3 . 16536 1 438 . 1 1 39 39 PRO CA C 13 58.50 0.30 . 1 . . . . 39 P CA . 16536 1 439 . 1 1 39 39 PRO CD C 13 52.10 0.30 . 1 . . . . 39 P CD . 16536 1 440 . 1 1 41 41 GLY H H 1 7.85 0.03 . 1 . . . . 41 G H . 16536 1 441 . 1 1 41 41 GLY HA2 H 1 3.60 0.03 . 2 . . . . 41 G HA2 . 16536 1 442 . 1 1 41 41 GLY HA3 H 1 3.83 0.03 . 2 . . . . 41 G HA3 . 16536 1 443 . 1 1 41 41 GLY CA C 13 47.60 0.30 . 1 . . . . 41 G CA . 16536 1 444 . 1 1 41 41 GLY N N 15 107.50 0.20 . 1 . . . . 41 G N . 16536 1 445 . 1 1 42 42 VAL H H 1 8.24 0.03 . 1 . . . . 42 V H . 16536 1 446 . 1 1 42 42 VAL HA H 1 3.77 0.03 . 1 . . . . 42 V HA . 16536 1 447 . 1 1 42 42 VAL HB H 1 2.09 0.03 . 1 . . . . 42 V HB . 16536 1 448 . 1 1 42 42 VAL HG11 H 1 1.00 0.03 . 1 . . . . 42 V QG1 . 16536 1 449 . 1 1 42 42 VAL HG12 H 1 1.00 0.03 . 1 . . . . 42 V QG1 . 16536 1 450 . 1 1 42 42 VAL HG13 H 1 1.00 0.03 . 1 . . . . 42 V QG1 . 16536 1 451 . 1 1 42 42 VAL HG21 H 1 0.95 0.03 . 1 . . . . 42 V QG2 . 16536 1 452 . 1 1 42 42 VAL HG22 H 1 0.95 0.03 . 1 . . . . 42 V QG2 . 16536 1 453 . 1 1 42 42 VAL HG23 H 1 0.95 0.03 . 1 . . . . 42 V QG2 . 16536 1 454 . 1 1 42 42 VAL C C 13 178.90 0.30 . 1 . . . . 42 V C . 16536 1 455 . 1 1 42 42 VAL CA C 13 66.30 0.30 . 1 . . . . 42 V CA . 16536 1 456 . 1 1 42 42 VAL CB C 13 32.30 0.30 . 1 . . . . 42 V CB . 16536 1 457 . 1 1 42 42 VAL CG1 C 13 21.20 0.30 . 2 . . . . 42 V CG1 . 16536 1 458 . 1 1 42 42 VAL CG2 C 13 21.90 0.30 . 2 . . . . 42 V CG2 . 16536 1 459 . 1 1 42 42 VAL N N 15 125.70 0.20 . 1 . . . . 42 V N . 16536 1 460 . 1 1 43 43 ALA H H 1 7.76 0.03 . 1 . . . . 43 A H . 16536 1 461 . 1 1 43 43 ALA HA H 1 4.21 0.03 . 1 . . . . 43 A HA . 16536 1 462 . 1 1 43 43 ALA HB1 H 1 1.38 0.03 . 1 . . . . 43 A QB . 16536 1 463 . 1 1 43 43 ALA HB2 H 1 1.38 0.03 . 1 . . . . 43 A QB . 16536 1 464 . 1 1 43 43 ALA HB3 H 1 1.38 0.03 . 1 . . . . 43 A QB . 16536 1 465 . 1 1 43 43 ALA C C 13 181.50 0.30 . 1 . . . . 43 A C . 16536 1 466 . 1 1 43 43 ALA CA C 13 55.30 0.30 . 1 . . . . 43 A CA . 16536 1 467 . 1 1 43 43 ALA CB C 13 18.90 0.30 . 1 . . . . 43 A CB . 16536 1 468 . 1 1 43 43 ALA N N 15 121.20 0.20 . 1 . . . . 43 A N . 16536 1 469 . 1 1 44 44 VAL H H 1 8.11 0.03 . 1 . . . . 44 V H . 16536 1 470 . 1 1 44 44 VAL HA H 1 3.54 0.03 . 1 . . . . 44 V HA . 16536 1 471 . 1 1 44 44 VAL HB H 1 2.07 0.03 . 1 . . . . 44 V HB . 16536 1 472 . 1 1 44 44 VAL HG11 H 1 0.87 0.03 . 1 . . . . 44 V QG1 . 16536 1 473 . 1 1 44 44 VAL HG12 H 1 0.87 0.03 . 1 . . . . 44 V QG1 . 16536 1 474 . 1 1 44 44 VAL HG13 H 1 0.87 0.03 . 1 . . . . 44 V QG1 . 16536 1 475 . 1 1 44 44 VAL HG21 H 1 0.67 0.03 . 1 . . . . 44 V QG2 . 16536 1 476 . 1 1 44 44 VAL HG22 H 1 0.67 0.03 . 1 . . . . 44 V QG2 . 16536 1 477 . 1 1 44 44 VAL HG23 H 1 0.67 0.03 . 1 . . . . 44 V QG2 . 16536 1 478 . 1 1 44 44 VAL C C 13 177.60 0.30 . 1 . . . . 44 V C . 16536 1 479 . 1 1 44 44 VAL CA C 13 67.30 0.30 . 1 . . . . 44 V CA . 16536 1 480 . 1 1 44 44 VAL CB C 13 32.30 0.30 . 1 . . . . 44 V CB . 16536 1 481 . 1 1 44 44 VAL CG1 C 13 23.80 0.30 . 2 . . . . 44 V CG1 . 16536 1 482 . 1 1 44 44 VAL N N 15 119.50 0.20 . 1 . . . . 44 V N . 16536 1 483 . 1 1 45 45 THR H H 1 8.56 0.03 . 1 . . . . 45 T H . 16536 1 484 . 1 1 45 45 THR HA H 1 3.57 0.03 . 1 . . . . 45 T HA . 16536 1 485 . 1 1 45 45 THR HB H 1 4.22 0.03 . 1 . . . . 45 T HB . 16536 1 486 . 1 1 45 45 THR HG21 H 1 1.18 0.03 . 1 . . . . 45 T QG2 . 16536 1 487 . 1 1 45 45 THR HG22 H 1 1.18 0.03 . 1 . . . . 45 T QG2 . 16536 1 488 . 1 1 45 45 THR HG23 H 1 1.18 0.03 . 1 . . . . 45 T QG2 . 16536 1 489 . 1 1 45 45 THR CA C 13 69.70 0.30 . 1 . . . . 45 T CA . 16536 1 490 . 1 1 45 45 THR CB C 13 68.10 0.30 . 1 . . . . 45 T CB . 16536 1 491 . 1 1 45 45 THR CG2 C 13 21.60 0.30 . 1 . . . . 45 T CG2 . 16536 1 492 . 1 1 45 45 THR N N 15 119.70 0.20 . 1 . . . . 45 T N . 16536 1 493 . 1 1 46 46 LYS H H 1 8.03 0.03 . 1 . . . . 46 K H . 16536 1 494 . 1 1 46 46 LYS HA H 1 3.93 0.03 . 1 . . . . 46 K HA . 16536 1 495 . 1 1 46 46 LYS HB2 H 1 1.91 0.03 . 2 . . . . 46 K HB2 . 16536 1 496 . 1 1 46 46 LYS HG2 H 1 1.40 0.03 . 2 . . . . 46 K HG2 . 16536 1 497 . 1 1 46 46 LYS HG3 H 1 1.55 0.03 . 2 . . . . 46 K HG3 . 16536 1 498 . 1 1 46 46 LYS C C 13 178.40 0.30 . 1 . . . . 46 K C . 16536 1 499 . 1 1 46 46 LYS CA C 13 60.40 0.30 . 1 . . . . 46 K CA . 16536 1 500 . 1 1 46 46 LYS CB C 13 33.30 0.30 . 1 . . . . 46 K CB . 16536 1 501 . 1 1 46 46 LYS CD C 13 30.00 0.30 . 1 . . . . 46 K CD . 16536 1 502 . 1 1 46 46 LYS CE C 13 42.30 0.30 . 1 . . . . 46 K CE . 16536 1 503 . 1 1 46 46 LYS CG C 13 25.10 0.30 . 1 . . . . 46 K CG . 16536 1 504 . 1 1 46 46 LYS N N 15 120.60 0.20 . 1 . . . . 46 K N . 16536 1 505 . 1 1 47 47 TYR H H 1 7.69 0.03 . 1 . . . . 47 Y H . 16536 1 506 . 1 1 47 47 TYR HA H 1 4.30 0.03 . 1 . . . . 47 Y HA . 16536 1 507 . 1 1 47 47 TYR HB2 H 1 3.17 0.03 . 2 . . . . 47 Y HB2 . 16536 1 508 . 1 1 47 47 TYR HD1 H 1 7.07 0.03 . 3 . . . . 47 Y HD1 . 16536 1 509 . 1 1 47 47 TYR C C 13 177.40 0.30 . 1 . . . . 47 Y C . 16536 1 510 . 1 1 47 47 TYR CA C 13 61.70 0.30 . 1 . . . . 47 Y CA . 16536 1 511 . 1 1 47 47 TYR CB C 13 39.40 0.30 . 1 . . . . 47 Y CB . 16536 1 512 . 1 1 47 47 TYR N N 15 118.50 0.20 . 1 . . . . 47 Y N . 16536 1 513 . 1 1 48 48 CYS H H 1 8.46 0.03 . 1 . . . . 48 C H . 16536 1 514 . 1 1 48 48 CYS HA H 1 3.83 0.03 . 1 . . . . 48 C HA . 16536 1 515 . 1 1 48 48 CYS HB2 H 1 2.56 0.03 . 2 . . . . 48 C HB2 . 16536 1 516 . 1 1 48 48 CYS HB3 H 1 3.07 0.03 . 2 . . . . 48 C HB3 . 16536 1 517 . 1 1 48 48 CYS C C 13 176.90 0.30 . 1 . . . . 48 C C . 16536 1 518 . 1 1 48 48 CYS CA C 13 65.50 0.30 . 1 . . . . 48 C CA . 16536 1 519 . 1 1 48 48 CYS CB C 13 27.40 0.30 . 1 . . . . 48 C CB . 16536 1 520 . 1 1 48 48 CYS N N 15 116.50 0.20 . 1 . . . . 48 C N . 16536 1 521 . 1 1 49 49 LYS H H 1 8.26 0.03 . 1 . . . . 49 K H . 16536 1 522 . 1 1 49 49 LYS HA H 1 3.91 0.03 . 1 . . . . 49 K HA . 16536 1 523 . 1 1 49 49 LYS HB2 H 1 1.98 0.03 . 2 . . . . 49 K HB2 . 16536 1 524 . 1 1 49 49 LYS HB3 H 1 1.84 0.03 . 2 . . . . 49 K HB3 . 16536 1 525 . 1 1 49 49 LYS HD2 H 1 1.65 0.30 . 2 . . . . 49 K HD2 . 16536 1 526 . 1 1 49 49 LYS HE2 H 1 3.19 0.03 . 2 . . . . 49 K HE2 . 16536 1 527 . 1 1 49 49 LYS HG2 H 1 1.21 0.03 . 2 . . . . 49 K HG2 . 16536 1 528 . 1 1 49 49 LYS C C 13 179.80 0.30 . 1 . . . . 49 K C . 16536 1 529 . 1 1 49 49 LYS CA C 13 61.30 0.30 . 1 . . . . 49 K CA . 16536 1 530 . 1 1 49 49 LYS CB C 13 33.50 0.30 . 1 . . . . 49 K CB . 16536 1 531 . 1 1 49 49 LYS CD C 13 30.30 0.30 . 1 . . . . 49 K CD . 16536 1 532 . 1 1 49 49 LYS CG C 13 27.10 0.30 . 1 . . . . 49 K CG . 16536 1 533 . 1 1 49 49 LYS N N 15 117.50 0.20 . 1 . . . . 49 K N . 16536 1 534 . 1 1 50 50 GLU H H 1 8.06 0.03 . 1 . . . . 50 E H . 16536 1 535 . 1 1 50 50 GLU HA H 1 3.93 0.03 . 1 . . . . 50 E HA . 16536 1 536 . 1 1 50 50 GLU HB2 H 1 1.95 0.03 . 2 . . . . 50 E HB2 . 16536 1 537 . 1 1 50 50 GLU HG2 H 1 2.44 0.03 . 2 . . . . 50 E HG2 . 16536 1 538 . 1 1 50 50 GLU HG3 H 1 2.15 0.03 . 2 . . . . 50 E HG3 . 16536 1 539 . 1 1 50 50 GLU C C 13 180.00 0.30 . 1 . . . . 50 E C . 16536 1 540 . 1 1 50 50 GLU CA C 13 59.50 0.30 . 1 . . . . 50 E CA . 16536 1 541 . 1 1 50 50 GLU CB C 13 29.20 0.30 . 1 . . . . 50 E CB . 16536 1 542 . 1 1 50 50 GLU CG C 13 36.80 0.30 . 1 . . . . 50 E CG . 16536 1 543 . 1 1 50 50 GLU N N 15 119.40 0.20 . 1 . . . . 50 E N . 16536 1 544 . 1 1 51 51 GLU H H 1 8.32 0.03 . 1 . . . . 51 E H . 16536 1 545 . 1 1 51 51 GLU HA H 1 3.79 0.03 . 1 . . . . 51 E HA . 16536 1 546 . 1 1 51 51 GLU HB2 H 1 1.58 0.03 . 2 . . . . 51 E HB2 . 16536 1 547 . 1 1 51 51 GLU HB3 H 1 1.77 0.03 . 2 . . . . 51 E HB3 . 16536 1 548 . 1 1 51 51 GLU HG2 H 1 1.58 0.03 . 2 . . . . 51 E HG2 . 16536 1 549 . 1 1 51 51 GLU C C 13 179.60 0.30 . 1 . . . . 51 E C . 16536 1 550 . 1 1 51 51 GLU CA C 13 58.50 0.30 . 1 . . . . 51 E CA . 16536 1 551 . 1 1 51 51 GLU CB C 13 30.70 0.30 . 1 . . . . 51 E CB . 16536 1 552 . 1 1 51 51 GLU CG C 13 35.80 0.30 . 1 . . . . 51 E CG . 16536 1 553 . 1 1 51 51 GLU N N 15 118.60 0.20 . 1 . . . . 51 E N . 16536 1 554 . 1 1 52 52 LEU H H 1 8.07 0.03 . 1 . . . . 52 L H . 16536 1 555 . 1 1 52 52 LEU HA H 1 4.16 0.03 . 1 . . . . 52 L HA . 16536 1 556 . 1 1 52 52 LEU HB2 H 1 1.90 0.03 . 2 . . . . 52 L HB2 . 16536 1 557 . 1 1 52 52 LEU HB3 H 1 1.31 0.03 . 2 . . . . 52 L HB3 . 16536 1 558 . 1 1 52 52 LEU HD11 H 1 0.92 0.03 . 1 . . . . 52 L QD1 . 16536 1 559 . 1 1 52 52 LEU HD12 H 1 0.92 0.03 . 1 . . . . 52 L QD1 . 16536 1 560 . 1 1 52 52 LEU HD13 H 1 0.92 0.03 . 1 . . . . 52 L QD1 . 16536 1 561 . 1 1 52 52 LEU HD21 H 1 0.59 0.03 . 1 . . . . 52 L QD2 . 16536 1 562 . 1 1 52 52 LEU HD22 H 1 0.59 0.03 . 1 . . . . 52 L QD2 . 16536 1 563 . 1 1 52 52 LEU HD23 H 1 0.59 0.03 . 1 . . . . 52 L QD2 . 16536 1 564 . 1 1 52 52 LEU HG H 1 1.75 0.03 . 1 . . . . 52 L HG . 16536 1 565 . 1 1 52 52 LEU C C 13 178.60 0.30 . 1 . . . . 52 L C . 16536 1 566 . 1 1 52 52 LEU CA C 13 55.70 0.30 . 1 . . . . 52 L CA . 16536 1 567 . 1 1 52 52 LEU CB C 13 44.10 0.30 . 1 . . . . 52 L CB . 16536 1 568 . 1 1 52 52 LEU CD1 C 13 23.20 0.30 . 2 . . . . 52 L CD1 . 16536 1 569 . 1 1 52 52 LEU CD2 C 13 25.40 0.30 . 2 . . . . 52 L CD2 . 16536 1 570 . 1 1 52 52 LEU CG C 13 27.50 0.30 . 1 . . . . 52 L CG . 16536 1 571 . 1 1 52 52 LEU N N 15 116.50 0.20 . 1 . . . . 52 L N . 16536 1 572 . 1 1 53 53 GLY H H 1 7.86 0.03 . 1 . . . . 53 G H . 16536 1 573 . 1 1 53 53 GLY HA2 H 1 3.94 0.03 . 2 . . . . 53 G HA2 . 16536 1 574 . 1 1 53 53 GLY HA3 H 1 3.82 0.03 . 2 . . . . 53 G HA3 . 16536 1 575 . 1 1 53 53 GLY C C 13 174.20 0.30 . 1 . . . . 53 G C . 16536 1 576 . 1 1 53 53 GLY CA C 13 46.60 0.30 . 1 . . . . 53 G CA . 16536 1 577 . 1 1 53 53 GLY N N 15 108.80 0.20 . 1 . . . . 53 G N . 16536 1 578 . 1 1 54 54 THR H H 1 7.62 0.03 . 1 . . . . 54 T H . 16536 1 579 . 1 1 54 54 THR HA H 1 4.73 0.03 . 1 . . . . 54 T HA . 16536 1 580 . 1 1 54 54 THR HB H 1 3.98 0.03 . 1 . . . . 54 T HB . 16536 1 581 . 1 1 54 54 THR HG21 H 1 1.00 0.03 . 1 . . . . 54 T QG2 . 16536 1 582 . 1 1 54 54 THR HG22 H 1 1.00 0.03 . 1 . . . . 54 T QG2 . 16536 1 583 . 1 1 54 54 THR HG23 H 1 1.00 0.03 . 1 . . . . 54 T QG2 . 16536 1 584 . 1 1 54 54 THR C C 13 171.70 0.30 . 1 . . . . 54 T C . 16536 1 585 . 1 1 54 54 THR CA C 13 59.30 0.30 . 1 . . . . 54 T CA . 16536 1 586 . 1 1 54 54 THR CB C 13 70.30 0.30 . 1 . . . . 54 T CB . 16536 1 587 . 1 1 54 54 THR CG2 C 13 19.80 0.30 . 1 . . . . 54 T CG2 . 16536 1 588 . 1 1 54 54 THR N N 15 112.20 0.20 . 1 . . . . 54 T N . 16536 1 589 . 1 1 55 55 GLU H H 1 8.26 0.03 . 1 . . . . 55 E H . 16536 1 590 . 1 1 55 55 GLU HA H 1 4.35 0.03 . 1 . . . . 55 E HA . 16536 1 591 . 1 1 55 55 GLU HB2 H 1 1.88 0.03 . 2 . . . . 55 E HB2 . 16536 1 592 . 1 1 55 55 GLU HB3 H 1 2.21 0.03 . 2 . . . . 55 E HB3 . 16536 1 593 . 1 1 55 55 GLU HG2 H 1 2.31 0.03 . 2 . . . . 55 E HG2 . 16536 1 594 . 1 1 55 55 GLU C C 13 176.70 0.30 . 1 . . . . 55 E C . 16536 1 595 . 1 1 55 55 GLU CA C 13 56.40 0.30 . 1 . . . . 55 E CA . 16536 1 596 . 1 1 55 55 GLU CB C 13 31.20 0.30 . 1 . . . . 55 E CB . 16536 1 597 . 1 1 55 55 GLU CG C 13 36.50 0.30 . 1 . . . . 55 E CG . 16536 1 598 . 1 1 55 55 GLU N N 15 121.70 0.20 . 1 . . . . 55 E N . 16536 1 599 . 1 1 56 56 THR H H 1 8.11 0.03 . 1 . . . . 56 T H . 16536 1 600 . 1 1 56 56 THR HA H 1 4.35 0.03 . 1 . . . . 56 T HA . 16536 1 601 . 1 1 56 56 THR HB H 1 4.03 0.03 . 1 . . . . 56 T HB . 16536 1 602 . 1 1 56 56 THR HG21 H 1 1.25 0.03 . 1 . . . . 56 T QG2 . 16536 1 603 . 1 1 56 56 THR HG22 H 1 1.25 0.03 . 1 . . . . 56 T QG2 . 16536 1 604 . 1 1 56 56 THR HG23 H 1 1.25 0.03 . 1 . . . . 56 T QG2 . 16536 1 605 . 1 1 56 56 THR C C 13 173.60 0.30 . 1 . . . . 56 T C . 16536 1 606 . 1 1 56 56 THR CA C 13 61.90 0.30 . 1 . . . . 56 T CA . 16536 1 607 . 1 1 56 56 THR CB C 13 70.40 0.30 . 1 . . . . 56 T CB . 16536 1 608 . 1 1 56 56 THR CG2 C 13 21.80 0.30 . 1 . . . . 56 T CG2 . 16536 1 609 . 1 1 56 56 THR N N 15 116.10 0.20 . 1 . . . . 56 T N . 16536 1 610 . 1 1 57 57 LEU H H 1 8.40 0.03 . 1 . . . . 57 L H . 16536 1 611 . 1 1 57 57 LEU HA H 1 4.56 0.03 . 1 . . . . 57 L HA . 16536 1 612 . 1 1 57 57 LEU HB2 H 1 1.78 0.03 . 2 . . . . 57 L HB2 . 16536 1 613 . 1 1 57 57 LEU HB3 H 1 1.66 0.03 . 2 . . . . 57 L HB3 . 16536 1 614 . 1 1 57 57 LEU HD11 H 1 0.71 0.03 . 1 . . . . 57 L QD1 . 16536 1 615 . 1 1 57 57 LEU HD12 H 1 0.71 0.03 . 1 . . . . 57 L QD1 . 16536 1 616 . 1 1 57 57 LEU HD13 H 1 0.71 0.03 . 1 . . . . 57 L QD1 . 16536 1 617 . 1 1 57 57 LEU HD21 H 1 0.88 0.03 . 1 . . . . 57 L QD2 . 16536 1 618 . 1 1 57 57 LEU HD22 H 1 0.88 0.03 . 1 . . . . 57 L QD2 . 16536 1 619 . 1 1 57 57 LEU HD23 H 1 0.88 0.03 . 1 . . . . 57 L QD2 . 16536 1 620 . 1 1 57 57 LEU HG H 1 1.36 0.03 . 1 . . . . 57 L HG . 16536 1 621 . 1 1 57 57 LEU C C 13 176.60 0.30 . 1 . . . . 57 L C . 16536 1 622 . 1 1 57 57 LEU CA C 13 53.20 0.30 . 1 . . . . 57 L CA . 16536 1 623 . 1 1 57 57 LEU CB C 13 42.40 0.30 . 1 . . . . 57 L CB . 16536 1 624 . 1 1 57 57 LEU CD1 C 13 23.00 0.30 . 2 . . . . 57 L CD1 . 16536 1 625 . 1 1 57 57 LEU CD2 C 13 26.40 0.30 . 2 . . . . 57 L CD2 . 16536 1 626 . 1 1 57 57 LEU CG C 13 27.00 0.30 . 1 . . . . 57 L CG . 16536 1 627 . 1 1 57 57 LEU N N 15 126.30 0.20 . 1 . . . . 57 L N . 16536 1 628 . 1 1 58 58 GLY H H 1 7.78 0.03 . 1 . . . . 58 G H . 16536 1 629 . 1 1 58 58 GLY HA2 H 1 3.62 0.03 . 2 . . . . 58 G HA2 . 16536 1 630 . 1 1 58 58 GLY HA3 H 1 4.46 0.03 . 2 . . . . 58 G HA3 . 16536 1 631 . 1 1 58 58 GLY C C 13 173.00 0.30 . 1 . . . . 58 G C . 16536 1 632 . 1 1 58 58 GLY CA C 13 45.50 0.30 . 1 . . . . 58 G CA . 16536 1 633 . 1 1 58 58 GLY N N 15 106.80 0.20 . 1 . . . . 58 G N . 16536 1 634 . 1 1 59 59 TYR H H 1 8.60 0.03 . 1 . . . . 59 Y H . 16536 1 635 . 1 1 59 59 TYR HA H 1 5.07 0.03 . 1 . . . . 59 Y HA . 16536 1 636 . 1 1 59 59 TYR HB2 H 1 2.93 0.03 . 2 . . . . 59 Y HB2 . 16536 1 637 . 1 1 59 59 TYR HB3 H 1 2.99 0.03 . 2 . . . . 59 Y HB3 . 16536 1 638 . 1 1 59 59 TYR HD1 H 1 7.06 0.03 . 3 . . . . 59 Y HD1 . 16536 1 639 . 1 1 59 59 TYR HE1 H 1 7.35 0.03 . 3 . . . . 59 Y HE1 . 16536 1 640 . 1 1 59 59 TYR C C 13 174.40 0.30 . 1 . . . . 59 Y C . 16536 1 641 . 1 1 59 59 TYR CA C 13 55.70 0.30 . 1 . . . . 59 Y CA . 16536 1 642 . 1 1 59 59 TYR CB C 13 41.10 0.30 . 1 . . . . 59 Y CB . 16536 1 643 . 1 1 59 59 TYR N N 15 120.30 0.20 . 1 . . . . 59 Y N . 16536 1 644 . 1 1 60 60 CYS H H 1 8.66 0.03 . 1 . . . . 60 C H . 16536 1 645 . 1 1 60 60 CYS HA H 1 5.55 0.03 . 1 . . . . 60 C HA . 16536 1 646 . 1 1 60 60 CYS HB2 H 1 2.78 0.03 . 2 . . . . 60 C HB2 . 16536 1 647 . 1 1 60 60 CYS HB3 H 1 2.83 0.03 . 2 . . . . 60 C HB3 . 16536 1 648 . 1 1 60 60 CYS C C 13 174.40 0.30 . 1 . . . . 60 C C . 16536 1 649 . 1 1 60 60 CYS CA C 13 56.80 0.30 . 1 . . . . 60 C CA . 16536 1 650 . 1 1 60 60 CYS CB C 13 30.40 0.30 . 1 . . . . 60 C CB . 16536 1 651 . 1 1 60 60 CYS N N 15 124.60 0.20 . 1 . . . . 60 C N . 16536 1 652 . 1 1 61 61 THR H H 1 9.11 0.03 . 1 . . . . 61 T H . 16536 1 653 . 1 1 61 61 THR HA H 1 4.71 0.03 . 1 . . . . 61 T HA . 16536 1 654 . 1 1 61 61 THR HG21 H 1 1.11 0.03 . 1 . . . . 61 T QG2 . 16536 1 655 . 1 1 61 61 THR HG22 H 1 1.11 0.03 . 1 . . . . 61 T QG2 . 16536 1 656 . 1 1 61 61 THR HG23 H 1 1.11 0.03 . 1 . . . . 61 T QG2 . 16536 1 657 . 1 1 61 61 THR C C 13 173.10 0.30 . 1 . . . . 61 T C . 16536 1 658 . 1 1 61 61 THR CA C 13 60.40 0.30 . 1 . . . . 61 T CA . 16536 1 659 . 1 1 61 61 THR CB C 13 72.20 0.30 . 1 . . . . 61 T CB . 16536 1 660 . 1 1 61 61 THR CG2 C 13 21.80 0.30 . 1 . . . . 61 T CG2 . 16536 1 661 . 1 1 61 61 THR N N 15 117.60 0.20 . 1 . . . . 61 T N . 16536 1 662 . 1 1 62 62 ASP H H 1 8.89 0.03 . 1 . . . . 62 D H . 16536 1 663 . 1 1 62 62 ASP HA H 1 4.30 0.03 . 1 . . . . 62 D HA . 16536 1 664 . 1 1 62 62 ASP HB2 H 1 2.92 0.03 . 2 . . . . 62 D HB2 . 16536 1 665 . 1 1 62 62 ASP HB3 H 1 2.64 0.03 . 2 . . . . 62 D HB3 . 16536 1 666 . 1 1 62 62 ASP C C 13 175.20 0.30 . 1 . . . . 62 D C . 16536 1 667 . 1 1 62 62 ASP CA C 13 55.30 0.30 . 1 . . . . 62 D CA . 16536 1 668 . 1 1 62 62 ASP CB C 13 39.70 0.30 . 1 . . . . 62 D CB . 16536 1 669 . 1 1 62 62 ASP N N 15 118.50 0.20 . 1 . . . . 62 D N . 16536 1 670 . 1 1 63 63 PHE H H 1 8.36 0.03 . 1 . . . . 63 F H . 16536 1 671 . 1 1 63 63 PHE HA H 1 4.57 0.03 . 1 . . . . 63 F HA . 16536 1 672 . 1 1 63 63 PHE HB2 H 1 2.85 0.03 . 2 . . . . 63 F HB2 . 16536 1 673 . 1 1 63 63 PHE HB3 H 1 3.10 0.03 . 2 . . . . 63 F HB3 . 16536 1 674 . 1 1 63 63 PHE HD1 H 1 7.07 0.03 . 3 . . . . 63 F HD1 . 16536 1 675 . 1 1 63 63 PHE HE1 H 1 7.32 0.03 . 3 . . . . 63 F HE1 . 16536 1 676 . 1 1 63 63 PHE C C 13 176.10 0.30 . 1 . . . . 63 F C . 16536 1 677 . 1 1 63 63 PHE CA C 13 60.20 0.30 . 1 . . . . 63 F CA . 16536 1 678 . 1 1 63 63 PHE CB C 13 40.60 0.30 . 1 . . . . 63 F CB . 16536 1 679 . 1 1 63 63 PHE N N 15 118.50 0.20 . 1 . . . . 63 F N . 16536 1 680 . 1 1 64 64 GLN H H 1 8.86 0.03 . 1 . . . . 64 Q H . 16536 1 681 . 1 1 64 64 GLN HA H 1 4.55 0.03 . 1 . . . . 64 Q HA . 16536 1 682 . 1 1 64 64 GLN HB2 H 1 1.90 0.03 . 2 . . . . 64 Q HB2 . 16536 1 683 . 1 1 64 64 GLN HB3 H 1 2.01 0.03 . 2 . . . . 64 Q HB3 . 16536 1 684 . 1 1 64 64 GLN HE21 H 1 6.80 0.03 . 2 . . . . 64 Q HE21 . 16536 1 685 . 1 1 64 64 GLN HE22 H 1 7.47 0.03 . 2 . . . . 64 Q HE22 . 16536 1 686 . 1 1 64 64 GLN HG2 H 1 2.23 0.03 . 2 . . . . 64 Q HG2 . 16536 1 687 . 1 1 64 64 GLN C C 13 172.80 0.30 . 1 . . . . 64 Q C . 16536 1 688 . 1 1 64 64 GLN CA C 13 55.00 0.30 . 1 . . . . 64 Q CA . 16536 1 689 . 1 1 64 64 GLN CB C 13 32.20 0.30 . 1 . . . . 64 Q CB . 16536 1 690 . 1 1 64 64 GLN CG C 13 33.60 0.30 . 1 . . . . 64 Q CG . 16536 1 691 . 1 1 64 64 GLN N N 15 129.30 0.20 . 1 . . . . 64 Q N . 16536 1 692 . 1 1 64 64 GLN NE2 N 15 111.20 0.03 . 1 . . . . 64 Q NE2 . 16536 1 693 . 1 1 65 65 ALA H H 1 8.55 0.03 . 1 . . . . 65 A H . 16536 1 694 . 1 1 65 65 ALA HA H 1 4.70 0.03 . 1 . . . . 65 A HA . 16536 1 695 . 1 1 65 65 ALA HB1 H 1 1.33 0.03 . 1 . . . . 65 A QB . 16536 1 696 . 1 1 65 65 ALA HB2 H 1 1.33 0.03 . 1 . . . . 65 A QB . 16536 1 697 . 1 1 65 65 ALA HB3 H 1 1.33 0.03 . 1 . . . . 65 A QB . 16536 1 698 . 1 1 65 65 ALA C C 13 176.80 0.30 . 1 . . . . 65 A C . 16536 1 699 . 1 1 65 65 ALA CA C 13 50.90 0.30 . 1 . . . . 65 A CA . 16536 1 700 . 1 1 65 65 ALA CB C 13 22.40 0.30 . 1 . . . . 65 A CB . 16536 1 701 . 1 1 65 65 ALA N N 15 125.00 0.20 . 1 . . . . 65 A N . 16536 1 702 . 1 1 66 66 VAL H H 1 8.40 0.03 . 1 . . . . 66 V H . 16536 1 703 . 1 1 66 66 VAL HA H 1 4.33 0.03 . 1 . . . . 66 V HA . 16536 1 704 . 1 1 66 66 VAL HG11 H 1 1.14 0.03 . 1 . . . . 66 V QG1 . 16536 1 705 . 1 1 66 66 VAL HG12 H 1 1.14 0.03 . 1 . . . . 66 V QG1 . 16536 1 706 . 1 1 66 66 VAL HG13 H 1 1.14 0.03 . 1 . . . . 66 V QG1 . 16536 1 707 . 1 1 66 66 VAL HG21 H 1 0.79 0.03 . 1 . . . . 66 V QG2 . 16536 1 708 . 1 1 66 66 VAL HG22 H 1 0.79 0.03 . 1 . . . . 66 V QG2 . 16536 1 709 . 1 1 66 66 VAL HG23 H 1 0.79 0.03 . 1 . . . . 66 V QG2 . 16536 1 710 . 1 1 66 66 VAL CA C 13 59.60 0.30 . 1 . . . . 66 V CA . 16536 1 711 . 1 1 66 66 VAL CB C 13 33.60 0.30 . 1 . . . . 66 V CB . 16536 1 712 . 1 1 66 66 VAL CG1 C 13 21.50 0.30 . 2 . . . . 66 V CG1 . 16536 1 713 . 1 1 66 66 VAL N N 15 124.00 0.20 . 1 . . . . 66 V N . 16536 1 714 . 1 1 67 67 PRO HA H 1 4.28 0.03 . 1 . . . . 67 P HA . 16536 1 715 . 1 1 67 67 PRO HD3 H 1 3.64 0.03 . 2 . . . . 67 P HD3 . 16536 1 716 . 1 1 67 67 PRO HG2 H 1 1.97 0.03 . 2 . . . . 67 P HG2 . 16536 1 717 . 1 1 67 67 PRO CA C 13 63.90 0.30 . 1 . . . . 67 P CA . 16536 1 718 . 1 1 68 68 GLY H H 1 8.53 0.03 . 1 . . . . 68 G H . 16536 1 719 . 1 1 68 68 GLY HA2 H 1 4.16 0.03 . 2 . . . . 68 G HA2 . 16536 1 720 . 1 1 68 68 GLY HA3 H 1 3.98 0.03 . 2 . . . . 68 G HA3 . 16536 1 721 . 1 1 68 68 GLY C C 13 174.50 0.30 . 1 . . . . 68 G C . 16536 1 722 . 1 1 68 68 GLY CA C 13 45.90 0.30 . 1 . . . . 68 G CA . 16536 1 723 . 1 1 68 68 GLY N N 15 113.30 0.20 . 1 . . . . 68 G N . 16536 1 724 . 1 1 69 69 CYS H H 1 7.94 0.03 . 1 . . . . 69 C H . 16536 1 725 . 1 1 69 69 CYS HA H 1 4.71 0.03 . 1 . . . . 69 C HA . 16536 1 726 . 1 1 69 69 CYS HB2 H 1 2.41 0.03 . 2 . . . . 69 C HB2 . 16536 1 727 . 1 1 69 69 CYS HB3 H 1 2.62 0.03 . 2 . . . . 69 C HB3 . 16536 1 728 . 1 1 69 69 CYS CB C 13 30.50 0.30 . 1 . . . . 69 C CB . 16536 1 729 . 1 1 69 69 CYS N N 15 118.10 0.20 . 1 . . . . 69 C N . 16536 1 730 . 1 1 70 70 GLY H H 1 7.28 0.03 . 1 . . . . 70 G H . 16536 1 731 . 1 1 70 70 GLY HA2 H 1 3.36 0.03 . 2 . . . . 70 G HA2 . 16536 1 732 . 1 1 70 70 GLY HA3 H 1 3.55 0.03 . 2 . . . . 70 G HA3 . 16536 1 733 . 1 1 70 70 GLY C C 13 170.50 0.30 . 1 . . . . 70 G C . 16536 1 734 . 1 1 70 70 GLY CA C 13 44.10 0.30 . 1 . . . . 70 G CA . 16536 1 735 . 1 1 70 70 GLY N N 15 104.70 0.20 . 1 . . . . 70 G N . 16536 1 736 . 1 1 71 71 ILE H H 1 8.76 0.03 . 1 . . . . 71 I H . 16536 1 737 . 1 1 71 71 ILE HA H 1 5.09 0.03 . 1 . . . . 71 I HA . 16536 1 738 . 1 1 71 71 ILE HB H 1 1.34 0.03 . 1 . . . . 71 I HB . 16536 1 739 . 1 1 71 71 ILE HD11 H 1 0.55 0.03 . 1 . . . . 71 I QD1 . 16536 1 740 . 1 1 71 71 ILE HD12 H 1 0.55 0.03 . 1 . . . . 71 I QD1 . 16536 1 741 . 1 1 71 71 ILE HD13 H 1 0.55 0.03 . 1 . . . . 71 I QD1 . 16536 1 742 . 1 1 71 71 ILE HG12 H 1 1.14 0.03 . 2 . . . . 71 I HG12 . 16536 1 743 . 1 1 71 71 ILE HG21 H 1 0.77 0.03 . 1 . . . . 71 I QG2 . 16536 1 744 . 1 1 71 71 ILE HG22 H 1 0.77 0.03 . 1 . . . . 71 I QG2 . 16536 1 745 . 1 1 71 71 ILE HG23 H 1 0.77 0.03 . 1 . . . . 71 I QG2 . 16536 1 746 . 1 1 71 71 ILE CA C 13 58.60 0.30 . 1 . . . . 71 I CA . 16536 1 747 . 1 1 71 71 ILE CB C 13 43.70 0.30 . 1 . . . . 71 I CB . 16536 1 748 . 1 1 71 71 ILE CG1 C 13 26.60 0.30 . 1 . . . . 71 I CG1 . 16536 1 749 . 1 1 71 71 ILE N N 15 111.20 0.20 . 1 . . . . 71 I N . 16536 1 750 . 1 1 72 72 GLY H H 1 8.91 0.03 . 1 . . . . 72 G H . 16536 1 751 . 1 1 72 72 GLY HA2 H 1 4.12 0.03 . 2 . . . . 72 G HA2 . 16536 1 752 . 1 1 72 72 GLY HA3 H 1 5.51 0.03 . 2 . . . . 72 G HA3 . 16536 1 753 . 1 1 72 72 GLY C C 13 171.70 0.30 . 1 . . . . 72 G C . 16536 1 754 . 1 1 72 72 GLY CA C 13 45.30 0.30 . 1 . . . . 72 G CA . 16536 1 755 . 1 1 72 72 GLY N N 15 114.00 0.20 . 1 . . . . 72 G N . 16536 1 756 . 1 1 73 73 CYS H H 1 8.66 0.03 . 1 . . . . 73 C H . 16536 1 757 . 1 1 73 73 CYS HA H 1 5.12 0.03 . 1 . . . . 73 C HA . 16536 1 758 . 1 1 73 73 CYS HB2 H 1 3.25 0.03 . 2 . . . . 73 C HB2 . 16536 1 759 . 1 1 73 73 CYS HB3 H 1 3.54 0.03 . 2 . . . . 73 C HB3 . 16536 1 760 . 1 1 73 73 CYS C C 13 172.40 0.30 . 1 . . . . 73 C C . 16536 1 761 . 1 1 73 73 CYS CA C 13 57.10 0.30 . 1 . . . . 73 C CA . 16536 1 762 . 1 1 73 73 CYS CB C 13 30.80 0.30 . 1 . . . . 73 C CB . 16536 1 763 . 1 1 73 73 CYS N N 15 113.30 0.20 . 1 . . . . 73 C N . 16536 1 764 . 1 1 74 74 LYS H H 1 8.83 0.03 . 1 . . . . 74 K H . 16536 1 765 . 1 1 74 74 LYS HA H 1 5.63 0.03 . 1 . . . . 74 K HA . 16536 1 766 . 1 1 74 74 LYS HB2 H 1 1.84 0.03 . 2 . . . . 74 K HB2 . 16536 1 767 . 1 1 74 74 LYS HB3 H 1 1.55 0.03 . 2 . . . . 74 K HB3 . 16536 1 768 . 1 1 74 74 LYS HD2 H 1 1.69 0.03 . 2 . . . . 74 K HD2 . 16536 1 769 . 1 1 74 74 LYS HE2 H 1 2.92 0.03 . 2 . . . . 74 K HE2 . 16536 1 770 . 1 1 74 74 LYS HG2 H 1 1.37 0.03 . 2 . . . . 74 K HG2 . 16536 1 771 . 1 1 74 74 LYS HG3 H 1 1.55 0.03 . 2 . . . . 74 K HG3 . 16536 1 772 . 1 1 74 74 LYS C C 13 176.80 0.30 . 1 . . . . 74 K C . 16536 1 773 . 1 1 74 74 LYS CA C 13 55.30 0.30 . 1 . . . . 74 K CA . 16536 1 774 . 1 1 74 74 LYS CB C 13 34.80 0.30 . 1 . . . . 74 K CB . 16536 1 775 . 1 1 74 74 LYS CD C 13 29.60 0.30 . 1 . . . . 74 K CD . 16536 1 776 . 1 1 74 74 LYS CE C 13 42.60 0.30 . 1 . . . . 74 K CE . 16536 1 777 . 1 1 74 74 LYS CG C 13 25.70 0.30 . 1 . . . . 74 K CG . 16536 1 778 . 1 1 74 74 LYS N N 15 118.10 0.20 . 1 . . . . 74 K N . 16536 1 779 . 1 1 75 75 VAL H H 1 9.35 0.03 . 1 . . . . 75 V H . 16536 1 780 . 1 1 75 75 VAL HA H 1 5.21 0.03 . 1 . . . . 75 V HA . 16536 1 781 . 1 1 75 75 VAL HB H 1 1.97 0.03 . 1 . . . . 75 V HB . 16536 1 782 . 1 1 75 75 VAL HG11 H 1 1.14 0.03 . 1 . . . . 75 V QG1 . 16536 1 783 . 1 1 75 75 VAL HG12 H 1 1.14 0.03 . 1 . . . . 75 V QG1 . 16536 1 784 . 1 1 75 75 VAL HG13 H 1 1.14 0.03 . 1 . . . . 75 V QG1 . 16536 1 785 . 1 1 75 75 VAL HG21 H 1 1.18 0.03 . 1 . . . . 75 V QG2 . 16536 1 786 . 1 1 75 75 VAL HG22 H 1 1.18 0.03 . 1 . . . . 75 V QG2 . 16536 1 787 . 1 1 75 75 VAL HG23 H 1 1.18 0.03 . 1 . . . . 75 V QG2 . 16536 1 788 . 1 1 75 75 VAL C C 13 174.60 0.30 . 1 . . . . 75 V C . 16536 1 789 . 1 1 75 75 VAL CA C 13 60.80 0.30 . 1 . . . . 75 V CA . 16536 1 790 . 1 1 75 75 VAL CB C 13 36.10 0.30 . 1 . . . . 75 V CB . 16536 1 791 . 1 1 75 75 VAL CG1 C 13 22.30 0.30 . 2 . . . . 75 V CG1 . 16536 1 792 . 1 1 75 75 VAL N N 15 120.40 0.20 . 1 . . . . 75 V N . 16536 1 793 . 1 1 76 76 SER H H 1 9.04 0.03 . 1 . . . . 76 S H . 16536 1 794 . 1 1 76 76 SER HA H 1 5.40 0.03 . 1 . . . . 76 S HA . 16536 1 795 . 1 1 76 76 SER HB2 H 1 3.72 0.03 . 2 . . . . 76 S HB2 . 16536 1 796 . 1 1 76 76 SER HB3 H 1 3.92 0.03 . 2 . . . . 76 S HB3 . 16536 1 797 . 1 1 76 76 SER C C 13 173.70 0.30 . 1 . . . . 76 S C . 16536 1 798 . 1 1 76 76 SER CA C 13 57.00 0.30 . 1 . . . . 76 S CA . 16536 1 799 . 1 1 76 76 SER CB C 13 66.70 0.30 . 1 . . . . 76 S CB . 16536 1 800 . 1 1 76 76 SER N N 15 119.90 0.20 . 1 . . . . 76 S N . 16536 1 801 . 1 1 77 77 ASN H H 1 9.32 0.03 . 1 . . . . 77 N H . 16536 1 802 . 1 1 77 77 ASN HA H 1 4.94 0.03 . 1 . . . . 77 N HA . 16536 1 803 . 1 1 77 77 ASN HB2 H 1 3.15 0.03 . 2 . . . . 77 N HB2 . 16536 1 804 . 1 1 77 77 ASN HB3 H 1 2.63 0.03 . 2 . . . . 77 N HB3 . 16536 1 805 . 1 1 77 77 ASN HD21 H 1 6.80 0.03 . 2 . . . . 77 N HD21 . 16536 1 806 . 1 1 77 77 ASN HD22 H 1 7.35 0.03 . 2 . . . . 77 N HD22 . 16536 1 807 . 1 1 77 77 ASN C C 13 176.20 0.30 . 1 . . . . 77 N C . 16536 1 808 . 1 1 77 77 ASN CA C 13 54.70 0.30 . 1 . . . . 77 N CA . 16536 1 809 . 1 1 77 77 ASN CB C 13 38.10 0.30 . 1 . . . . 77 N CB . 16536 1 810 . 1 1 77 77 ASN N N 15 118.40 0.20 . 1 . . . . 77 N N . 16536 1 811 . 1 1 77 77 ASN ND2 N 15 111.60 0.03 . 1 . . . . 77 N ND2 . 16536 1 812 . 1 1 78 78 VAL H H 1 8.30 0.03 . 1 . . . . 78 V H . 16536 1 813 . 1 1 78 78 VAL HA H 1 4.33 0.03 . 1 . . . . 78 V HA . 16536 1 814 . 1 1 78 78 VAL HB H 1 2.31 0.03 . 1 . . . . 78 V HB . 16536 1 815 . 1 1 78 78 VAL HG11 H 1 0.85 0.03 . 1 . . . . 78 V QG1 . 16536 1 816 . 1 1 78 78 VAL HG12 H 1 0.85 0.03 . 1 . . . . 78 V QG1 . 16536 1 817 . 1 1 78 78 VAL HG13 H 1 0.85 0.03 . 1 . . . . 78 V QG1 . 16536 1 818 . 1 1 78 78 VAL HG21 H 1 0.72 0.03 . 1 . . . . 78 V QG2 . 16536 1 819 . 1 1 78 78 VAL HG22 H 1 0.72 0.03 . 1 . . . . 78 V QG2 . 16536 1 820 . 1 1 78 78 VAL HG23 H 1 0.72 0.03 . 1 . . . . 78 V QG2 . 16536 1 821 . 1 1 78 78 VAL C C 13 177.20 0.30 . 1 . . . . 78 V C . 16536 1 822 . 1 1 78 78 VAL CA C 13 61.90 0.30 . 1 . . . . 78 V CA . 16536 1 823 . 1 1 78 78 VAL CB C 13 32.30 0.30 . 1 . . . . 78 V CB . 16536 1 824 . 1 1 78 78 VAL CG1 C 13 19.70 0.30 . 2 . . . . 78 V CG1 . 16536 1 825 . 1 1 78 78 VAL N N 15 108.10 0.20 . 1 . . . . 78 V N . 16536 1 826 . 1 1 79 79 GLU H H 1 9.21 0.03 . 1 . . . . 79 E H . 16536 1 827 . 1 1 79 79 GLU HA H 1 4.17 0.03 . 1 . . . . 79 E HA . 16536 1 828 . 1 1 79 79 GLU HB2 H 1 2.06 0.03 . 2 . . . . 79 E HB2 . 16536 1 829 . 1 1 79 79 GLU HB3 H 1 1.93 0.03 . 2 . . . . 79 E HB3 . 16536 1 830 . 1 1 79 79 GLU HG2 H 1 2.29 0.03 . 2 . . . . 79 E HG2 . 16536 1 831 . 1 1 79 79 GLU HG3 H 1 2.23 0.03 . 2 . . . . 79 E HG3 . 16536 1 832 . 1 1 79 79 GLU C C 13 179.40 0.30 . 1 . . . . 79 E C . 16536 1 833 . 1 1 79 79 GLU CA C 13 61.10 0.30 . 1 . . . . 79 E CA . 16536 1 834 . 1 1 79 79 GLU CB C 13 28.80 0.30 . 1 . . . . 79 E CB . 16536 1 835 . 1 1 79 79 GLU N N 15 121.60 0.20 . 1 . . . . 79 E N . 16536 1 836 . 1 1 80 80 GLY H H 1 8.42 0.03 . 1 . . . . 80 G H . 16536 1 837 . 1 1 80 80 GLY HA2 H 1 3.90 0.03 . 2 . . . . 80 G HA2 . 16536 1 838 . 1 1 80 80 GLY HA3 H 1 3.90 0.03 . 2 . . . . 80 G HA3 . 16536 1 839 . 1 1 80 80 GLY C C 13 175.90 0.30 . 1 . . . . 80 G C . 16536 1 840 . 1 1 80 80 GLY CA C 13 46.20 0.30 . 1 . . . . 80 G CA . 16536 1 841 . 1 1 80 80 GLY N N 15 110.20 0.20 . 1 . . . . 80 G N . 16536 1 842 . 1 1 81 81 ILE H H 1 7.54 0.03 . 1 . . . . 81 I H . 16536 1 843 . 1 1 81 81 ILE HA H 1 4.03 0.03 . 1 . . . . 81 I HA . 16536 1 844 . 1 1 81 81 ILE HB H 1 1.85 0.03 . 1 . . . . 81 I HB . 16536 1 845 . 1 1 81 81 ILE HD11 H 1 0.76 0.03 . 1 . . . . 81 I QD1 . 16536 1 846 . 1 1 81 81 ILE HD12 H 1 0.76 0.03 . 1 . . . . 81 I QD1 . 16536 1 847 . 1 1 81 81 ILE HD13 H 1 0.76 0.03 . 1 . . . . 81 I QD1 . 16536 1 848 . 1 1 81 81 ILE HG12 H 1 1.10 0.03 . 2 . . . . 81 I HG12 . 16536 1 849 . 1 1 81 81 ILE HG13 H 1 1.57 0.03 . 2 . . . . 81 I HG13 . 16536 1 850 . 1 1 81 81 ILE HG21 H 1 0.89 0.03 . 1 . . . . 81 I QG2 . 16536 1 851 . 1 1 81 81 ILE HG22 H 1 0.89 0.03 . 1 . . . . 81 I QG2 . 16536 1 852 . 1 1 81 81 ILE HG23 H 1 0.89 0.03 . 1 . . . . 81 I QG2 . 16536 1 853 . 1 1 81 81 ILE C C 13 178.00 0.30 . 1 . . . . 81 I C . 16536 1 854 . 1 1 81 81 ILE CA C 13 62.80 0.30 . 1 . . . . 81 I CA . 16536 1 855 . 1 1 81 81 ILE CB C 13 39.60 0.30 . 1 . . . . 81 I CB . 16536 1 856 . 1 1 81 81 ILE CG1 C 13 27.80 0.30 . 1 . . . . 81 I CG1 . 16536 1 857 . 1 1 81 81 ILE N N 15 120.30 0.20 . 1 . . . . 81 I N . 16536 1 858 . 1 1 82 82 LEU H H 1 7.74 0.03 . 1 . . . . 82 L H . 16536 1 859 . 1 1 82 82 LEU HA H 1 4.28 0.03 . 1 . . . . 82 L HA . 16536 1 860 . 1 1 82 82 LEU HB2 H 1 1.60 0.03 . 2 . . . . 82 L HB2 . 16536 1 861 . 1 1 82 82 LEU HB3 H 1 1.85 0.03 . 2 . . . . 82 L HB3 . 16536 1 862 . 1 1 82 82 LEU HD11 H 1 0.74 0.03 . 1 . . . . 82 L QD1 . 16536 1 863 . 1 1 82 82 LEU HD12 H 1 0.74 0.03 . 1 . . . . 82 L QD1 . 16536 1 864 . 1 1 82 82 LEU HD13 H 1 0.74 0.03 . 1 . . . . 82 L QD1 . 16536 1 865 . 1 1 82 82 LEU HD21 H 1 0.87 0.03 . 1 . . . . 82 L QD2 . 16536 1 866 . 1 1 82 82 LEU HD22 H 1 0.87 0.03 . 1 . . . . 82 L QD2 . 16536 1 867 . 1 1 82 82 LEU HD23 H 1 0.87 0.03 . 1 . . . . 82 L QD2 . 16536 1 868 . 1 1 82 82 LEU HG H 1 1.72 0.03 . 1 . . . . 82 L HG . 16536 1 869 . 1 1 82 82 LEU C C 13 177.90 0.30 . 1 . . . . 82 L C . 16536 1 870 . 1 1 82 82 LEU CA C 13 55.00 0.30 . 1 . . . . 82 L CA . 16536 1 871 . 1 1 82 82 LEU CB C 13 41.90 0.30 . 1 . . . . 82 L CB . 16536 1 872 . 1 1 82 82 LEU CD1 C 13 22.40 0.30 . 2 . . . . 82 L CD1 . 16536 1 873 . 1 1 82 82 LEU CD2 C 13 25.40 0.30 . 2 . . . . 82 L CD2 . 16536 1 874 . 1 1 82 82 LEU CG C 13 26.70 0.30 . 1 . . . . 82 L CG . 16536 1 875 . 1 1 82 82 LEU N N 15 119.70 0.20 . 1 . . . . 82 L N . 16536 1 876 . 1 1 83 83 ALA H H 1 7.91 0.03 . 1 . . . . 83 A H . 16536 1 877 . 1 1 83 83 ALA HA H 1 4.18 0.03 . 1 . . . . 83 A HA . 16536 1 878 . 1 1 83 83 ALA HB1 H 1 1.39 0.03 . 1 . . . . 83 A QB . 16536 1 879 . 1 1 83 83 ALA HB2 H 1 1.39 0.03 . 1 . . . . 83 A QB . 16536 1 880 . 1 1 83 83 ALA HB3 H 1 1.39 0.03 . 1 . . . . 83 A QB . 16536 1 881 . 1 1 83 83 ALA C C 13 176.60 0.30 . 1 . . . . 83 A C . 16536 1 882 . 1 1 83 83 ALA CA C 13 52.90 0.30 . 1 . . . . 83 A CA . 16536 1 883 . 1 1 83 83 ALA CB C 13 18.00 0.30 . 1 . . . . 83 A CB . 16536 1 884 . 1 1 83 83 ALA N N 15 124.20 0.20 . 1 . . . . 83 A N . 16536 1 885 . 1 1 84 84 ALA H H 1 8.00 0.03 . 1 . . . . 84 A H . 16536 1 886 . 1 1 84 84 ALA HA H 1 4.63 0.03 . 1 . . . . 84 A HA . 16536 1 887 . 1 1 84 84 ALA HB1 H 1 1.42 0.03 . 1 . . . . 84 A QB . 16536 1 888 . 1 1 84 84 ALA HB2 H 1 1.42 0.03 . 1 . . . . 84 A QB . 16536 1 889 . 1 1 84 84 ALA HB3 H 1 1.42 0.03 . 1 . . . . 84 A QB . 16536 1 890 . 1 1 84 84 ALA C C 13 177.30 0.30 . 1 . . . . 84 A C . 16536 1 891 . 1 1 84 84 ALA CA C 13 51.80 0.30 . 1 . . . . 84 A CA . 16536 1 892 . 1 1 84 84 ALA CB C 13 22.10 0.30 . 1 . . . . 84 A CB . 16536 1 893 . 1 1 84 84 ALA N N 15 121.90 0.20 . 1 . . . . 84 A N . 16536 1 894 . 1 1 85 85 VAL H H 1 7.61 0.03 . 1 . . . . 85 V H . 16536 1 895 . 1 1 85 85 VAL HA H 1 4.55 0.03 . 1 . . . . 85 V HA . 16536 1 896 . 1 1 85 85 VAL HB H 1 2.19 0.03 . 1 . . . . 85 V HB . 16536 1 897 . 1 1 85 85 VAL HG11 H 1 1.02 0.03 . 1 . . . . 85 V QG1 . 16536 1 898 . 1 1 85 85 VAL HG12 H 1 1.02 0.03 . 1 . . . . 85 V QG1 . 16536 1 899 . 1 1 85 85 VAL HG13 H 1 1.02 0.03 . 1 . . . . 85 V QG1 . 16536 1 900 . 1 1 85 85 VAL HG21 H 1 0.91 0.03 . 1 . . . . 85 V QG2 . 16536 1 901 . 1 1 85 85 VAL HG22 H 1 0.91 0.03 . 1 . . . . 85 V QG2 . 16536 1 902 . 1 1 85 85 VAL HG23 H 1 0.91 0.03 . 1 . . . . 85 V QG2 . 16536 1 903 . 1 1 85 85 VAL C C 13 174.60 0.30 . 1 . . . . 85 V C . 16536 1 904 . 1 1 85 85 VAL CA C 13 60.10 0.30 . 1 . . . . 85 V CA . 16536 1 905 . 1 1 85 85 VAL CB C 13 33.00 0.30 . 1 . . . . 85 V CB . 16536 1 906 . 1 1 85 85 VAL CG2 C 13 19.70 0.30 . 2 . . . . 85 V CG2 . 16536 1 907 . 1 1 85 85 VAL N N 15 115.90 0.20 . 1 . . . . 85 V N . 16536 1 908 . 1 1 86 86 PRO HA H 1 4.32 0.03 . 1 . . . . 86 P HA . 16536 1 909 . 1 1 86 86 PRO HB2 H 1 2.28 0.03 . 2 . . . . 86 P HB2 . 16536 1 910 . 1 1 86 86 PRO HB3 H 1 1.93 0.03 . 2 . . . . 86 P HB3 . 16536 1 911 . 1 1 86 86 PRO HD2 H 1 3.67 0.03 . 2 . . . . 86 P HD2 . 16536 1 912 . 1 1 86 86 PRO HD3 H 1 3.84 0.03 . 2 . . . . 86 P HD3 . 16536 1 913 . 1 1 86 86 PRO HG2 H 1 2.06 0.03 . 2 . . . . 86 P HG2 . 16536 1 914 . 1 1 86 86 PRO HG3 H 1 2.27 0.03 . 2 . . . . 86 P HG3 . 16536 1 915 . 1 1 86 86 PRO C C 13 176.10 0.30 . 1 . . . . 86 P C . 16536 1 916 . 1 1 86 86 PRO CA C 13 64.50 0.30 . 1 . . . . 86 P CA . 16536 1 917 . 1 1 86 86 PRO CB C 13 32.30 0.30 . 1 . . . . 86 P CB . 16536 1 918 . 1 1 86 86 PRO CD C 13 51.40 0.30 . 1 . . . . 86 P CD . 16536 1 919 . 1 1 86 86 PRO CG C 13 27.70 0.30 . 1 . . . . 86 P CG . 16536 1 920 . 1 1 87 87 GLN H H 1 7.91 0.03 . 1 . . . . 87 Q H . 16536 1 921 . 1 1 87 87 GLN HA H 1 4.22 0.03 . 1 . . . . 87 Q HA . 16536 1 922 . 1 1 87 87 GLN HB3 H 1 1.91 0.03 . 2 . . . . 87 Q HB3 . 16536 1 923 . 1 1 87 87 GLN HE21 H 1 6.79 0.03 . 2 . . . . 87 Q HE21 . 16536 1 924 . 1 1 87 87 GLN HE22 H 1 7.87 0.03 . 2 . . . . 87 Q HE22 . 16536 1 925 . 1 1 87 87 GLN HG2 H 1 2.01 0.03 . 2 . . . . 87 Q HG2 . 16536 1 926 . 1 1 87 87 GLN HG3 H 1 1.48 0.03 . 2 . . . . 87 Q HG3 . 16536 1 927 . 1 1 87 87 GLN C C 13 174.20 0.30 . 1 . . . . 87 Q C . 16536 1 928 . 1 1 87 87 GLN CA C 13 56.30 0.30 . 1 . . . . 87 Q CA . 16536 1 929 . 1 1 87 87 GLN CB C 13 31.30 0.30 . 1 . . . . 87 Q CB . 16536 1 930 . 1 1 87 87 GLN CG C 13 33.20 0.30 . 1 . . . . 87 Q CG . 16536 1 931 . 1 1 87 87 GLN N N 15 123.00 0.20 . 1 . . . . 87 Q N . 16536 1 932 . 1 1 87 87 GLN NE2 N 15 112.80 0.20 . 1 . . . . 87 Q NE2 . 16536 1 933 . 1 1 88 88 THR H H 1 8.38 0.03 . 1 . . . . 88 T H . 16536 1 934 . 1 1 88 88 THR HA H 1 5.08 0.03 . 1 . . . . 88 T HA . 16536 1 935 . 1 1 88 88 THR HB H 1 3.79 0.03 . 1 . . . . 88 T HB . 16536 1 936 . 1 1 88 88 THR HG21 H 1 1.12 0.03 . 1 . . . . 88 T QG2 . 16536 1 937 . 1 1 88 88 THR HG22 H 1 1.12 0.03 . 1 . . . . 88 T QG2 . 16536 1 938 . 1 1 88 88 THR HG23 H 1 1.12 0.03 . 1 . . . . 88 T QG2 . 16536 1 939 . 1 1 88 88 THR C C 13 174.00 0.30 . 1 . . . . 88 T C . 16536 1 940 . 1 1 88 88 THR CA C 13 61.30 0.30 . 1 . . . . 88 T CA . 16536 1 941 . 1 1 88 88 THR CB C 13 70.60 0.30 . 1 . . . . 88 T CB . 16536 1 942 . 1 1 88 88 THR CG2 C 13 22.10 0.30 . 1 . . . . 88 T CG2 . 16536 1 943 . 1 1 88 88 THR N N 15 121.10 0.20 . 1 . . . . 88 T N . 16536 1 944 . 1 1 89 89 PHE H H 1 9.74 0.03 . 1 . . . . 89 F H . 16536 1 945 . 1 1 89 89 PHE HA H 1 5.17 0.03 . 1 . . . . 89 F HA . 16536 1 946 . 1 1 89 89 PHE HB2 H 1 2.94 0.03 . 2 . . . . 89 F HB2 . 16536 1 947 . 1 1 89 89 PHE HB3 H 1 2.64 0.03 . 2 . . . . 89 F HB3 . 16536 1 948 . 1 1 89 89 PHE HD1 H 1 7.22 0.03 . 3 . . . . 89 F HD1 . 16536 1 949 . 1 1 89 89 PHE HE1 H 1 7.11 0.03 . 3 . . . . 89 F HE1 . 16536 1 950 . 1 1 89 89 PHE C C 13 176.10 0.30 . 1 . . . . 89 F C . 16536 1 951 . 1 1 89 89 PHE CA C 13 56.70 0.30 . 1 . . . . 89 F CA . 16536 1 952 . 1 1 89 89 PHE CB C 13 42.70 0.30 . 1 . . . . 89 F CB . 16536 1 953 . 1 1 89 89 PHE N N 15 126.70 0.20 . 1 . . . . 89 F N . 16536 1 954 . 1 1 90 90 SER H H 1 9.49 0.03 . 1 . . . . 90 S H . 16536 1 955 . 1 1 90 90 SER HA H 1 5.08 0.03 . 1 . . . . 90 S HA . 16536 1 956 . 1 1 90 90 SER HB2 H 1 3.97 0.03 . 2 . . . . 90 S HB2 . 16536 1 957 . 1 1 90 90 SER C C 13 174.60 0.30 . 1 . . . . 90 S C . 16536 1 958 . 1 1 90 90 SER CA C 13 58.50 0.30 . 1 . . . . 90 S CA . 16536 1 959 . 1 1 90 90 SER CB C 13 63.90 0.30 . 1 . . . . 90 S CB . 16536 1 960 . 1 1 90 90 SER N N 15 119.70 0.20 . 1 . . . . 90 S N . 16536 1 961 . 1 1 91 91 VAL H H 1 9.31 0.03 . 1 . . . . 91 V H . 16536 1 962 . 1 1 91 91 VAL HA H 1 5.01 0.03 . 1 . . . . 91 V HA . 16536 1 963 . 1 1 91 91 VAL HB H 1 2.12 0.03 . 1 . . . . 91 V HB . 16536 1 964 . 1 1 91 91 VAL HG11 H 1 0.80 0.03 . 1 . . . . 91 V QG1 . 16536 1 965 . 1 1 91 91 VAL HG12 H 1 0.80 0.03 . 1 . . . . 91 V QG1 . 16536 1 966 . 1 1 91 91 VAL HG13 H 1 0.80 0.03 . 1 . . . . 91 V QG1 . 16536 1 967 . 1 1 91 91 VAL HG21 H 1 0.64 0.03 . 1 . . . . 91 V QG2 . 16536 1 968 . 1 1 91 91 VAL HG22 H 1 0.64 0.03 . 1 . . . . 91 V QG2 . 16536 1 969 . 1 1 91 91 VAL HG23 H 1 0.64 0.03 . 1 . . . . 91 V QG2 . 16536 1 970 . 1 1 91 91 VAL C C 13 175.00 0.30 . 1 . . . . 91 V C . 16536 1 971 . 1 1 91 91 VAL CA C 13 61.50 0.30 . 1 . . . . 91 V CA . 16536 1 972 . 1 1 91 91 VAL CB C 13 35.40 0.30 . 1 . . . . 91 V CB . 16536 1 973 . 1 1 91 91 VAL CG1 C 13 21.50 0.30 . 2 . . . . 91 V CG1 . 16536 1 974 . 1 1 91 91 VAL CG2 C 13 23.10 0.30 . 2 . . . . 91 V CG2 . 16536 1 975 . 1 1 91 91 VAL N N 15 127.10 0.20 . 1 . . . . 91 V N . 16536 1 976 . 1 1 92 92 LEU H H 1 8.86 0.03 . 1 . . . . 92 L H . 16536 1 977 . 1 1 92 92 LEU HA H 1 5.45 0.03 . 1 . . . . 92 L HA . 16536 1 978 . 1 1 92 92 LEU HB2 H 1 1.68 0.03 . 2 . . . . 92 L HB2 . 16536 1 979 . 1 1 92 92 LEU HB3 H 1 1.14 0.03 . 2 . . . . 92 L HB3 . 16536 1 980 . 1 1 92 92 LEU HD11 H 1 0.53 0.03 . 1 . . . . 92 L QD1 . 16536 1 981 . 1 1 92 92 LEU HD12 H 1 0.53 0.03 . 1 . . . . 92 L QD1 . 16536 1 982 . 1 1 92 92 LEU HD13 H 1 0.53 0.03 . 1 . . . . 92 L QD1 . 16536 1 983 . 1 1 92 92 LEU HD21 H 1 0.79 0.03 . 1 . . . . 92 L QD2 . 16536 1 984 . 1 1 92 92 LEU HD22 H 1 0.79 0.03 . 1 . . . . 92 L QD2 . 16536 1 985 . 1 1 92 92 LEU HD23 H 1 0.79 0.03 . 1 . . . . 92 L QD2 . 16536 1 986 . 1 1 92 92 LEU C C 13 176.10 0.30 . 1 . . . . 92 L C . 16536 1 987 . 1 1 92 92 LEU CA C 13 54.00 0.30 . 1 . . . . 92 L CA . 16536 1 988 . 1 1 92 92 LEU CB C 13 47.20 0.30 . 1 . . . . 92 L CB . 16536 1 989 . 1 1 92 92 LEU CD2 C 13 22.70 0.30 . 2 . . . . 92 L CD2 . 16536 1 990 . 1 1 92 92 LEU N N 15 127.20 0.20 . 1 . . . . 92 L N . 16536 1 991 . 1 1 93 93 ILE H H 1 8.52 0.03 . 1 . . . . 93 I H . 16536 1 992 . 1 1 93 93 ILE HA H 1 5.58 0.03 . 1 . . . . 93 I HA . 16536 1 993 . 1 1 93 93 ILE HB H 1 1.59 0.03 . 1 . . . . 93 I HB . 16536 1 994 . 1 1 93 93 ILE HD11 H 1 1.12 0.03 . 1 . . . . 93 I QD1 . 16536 1 995 . 1 1 93 93 ILE HD12 H 1 1.12 0.03 . 1 . . . . 93 I QD1 . 16536 1 996 . 1 1 93 93 ILE HD13 H 1 1.12 0.03 . 1 . . . . 93 I QD1 . 16536 1 997 . 1 1 93 93 ILE HG21 H 1 0.99 0.03 . 1 . . . . 93 I QG2 . 16536 1 998 . 1 1 93 93 ILE HG22 H 1 0.99 0.03 . 1 . . . . 93 I QG2 . 16536 1 999 . 1 1 93 93 ILE HG23 H 1 0.99 0.03 . 1 . . . . 93 I QG2 . 16536 1 1000 . 1 1 93 93 ILE C C 13 175.50 0.30 . 1 . . . . 93 I C . 16536 1 1001 . 1 1 93 93 ILE CA C 13 59.50 0.30 . 1 . . . . 93 I CA . 16536 1 1002 . 1 1 93 93 ILE CB C 13 42.40 0.30 . 1 . . . . 93 I CB . 16536 1 1003 . 1 1 93 93 ILE CG1 C 13 27.50 0.30 . 1 . . . . 93 I CG1 . 16536 1 1004 . 1 1 93 93 ILE CG2 C 13 18.80 0.30 . 1 . . . . 93 I CG2 . 16536 1 1005 . 1 1 93 93 ILE N N 15 119.10 0.20 . 1 . . . . 93 I N . 16536 1 1006 . 1 1 94 94 GLY H H 1 9.04 0.03 . 1 . . . . 94 G H . 16536 1 1007 . 1 1 94 94 GLY HA2 H 1 4.88 0.03 . 2 . . . . 94 G HA2 . 16536 1 1008 . 1 1 94 94 GLY HA3 H 1 3.97 0.03 . 2 . . . . 94 G HA3 . 16536 1 1009 . 1 1 94 94 GLY C C 13 171.00 0.30 . 1 . . . . 94 G C . 16536 1 1010 . 1 1 94 94 GLY CA C 13 47.20 0.30 . 1 . . . . 94 G CA . 16536 1 1011 . 1 1 94 94 GLY N N 15 111.80 0.20 . 1 . . . . 94 G N . 16536 1 1012 . 1 1 95 95 ASN H H 1 8.04 0.03 . 1 . . . . 95 N H . 16536 1 1013 . 1 1 95 95 ASN HA H 1 4.91 0.03 . 1 . . . . 95 N HA . 16536 1 1014 . 1 1 95 95 ASN HB2 H 1 3.03 0.03 . 2 . . . . 95 N HB2 . 16536 1 1015 . 1 1 95 95 ASN HB3 H 1 3.79 0.03 . 2 . . . . 95 N HB3 . 16536 1 1016 . 1 1 95 95 ASN HD21 H 1 7.00 0.03 . 2 . . . . 95 N HD21 . 16536 1 1017 . 1 1 95 95 ASN HD22 H 1 7.60 0.03 . 2 . . . . 95 N HD22 . 16536 1 1018 . 1 1 95 95 ASN C C 13 175.00 0.30 . 1 . . . . 95 N C . 16536 1 1019 . 1 1 95 95 ASN CA C 13 51.40 0.30 . 1 . . . . 95 N CA . 16536 1 1020 . 1 1 95 95 ASN CB C 13 39.30 0.30 . 1 . . . . 95 N CB . 16536 1 1021 . 1 1 95 95 ASN N N 15 119.00 0.20 . 1 . . . . 95 N N . 16536 1 1022 . 1 1 95 95 ASN ND2 N 15 110.00 0.03 . 1 . . . . 95 N ND2 . 16536 1 1023 . 1 1 96 96 ARG H H 1 8.57 0.03 . 1 . . . . 96 R H . 16536 1 1024 . 1 1 96 96 ARG HA H 1 3.78 0.03 . 1 . . . . 96 R HA . 16536 1 1025 . 1 1 96 96 ARG HB2 H 1 1.78 0.03 . 2 . . . . 96 R HB2 . 16536 1 1026 . 1 1 96 96 ARG HB3 H 1 1.48 0.03 . 2 . . . . 96 R HB3 . 16536 1 1027 . 1 1 96 96 ARG HD2 H 1 3.03 0.03 . 2 . . . . 96 R HD2 . 16536 1 1028 . 1 1 96 96 ARG HD3 H 1 3.19 0.03 . 2 . . . . 96 R HD3 . 16536 1 1029 . 1 1 96 96 ARG HG2 H 1 1.90 0.03 . 2 . . . . 96 R HG2 . 16536 1 1030 . 1 1 96 96 ARG C C 13 178.50 0.30 . 1 . . . . 96 R C . 16536 1 1031 . 1 1 96 96 ARG CA C 13 60.80 0.30 . 1 . . . . 96 R CA . 16536 1 1032 . 1 1 96 96 ARG CB C 13 31.20 0.30 . 1 . . . . 96 R CB . 16536 1 1033 . 1 1 96 96 ARG CD C 13 44.30 0.30 . 1 . . . . 96 R CD . 16536 1 1034 . 1 1 96 96 ARG CG C 13 28.60 0.30 . 1 . . . . 96 R CG . 16536 1 1035 . 1 1 96 96 ARG N N 15 115.40 0.20 . 1 . . . . 96 R N . 16536 1 1036 . 1 1 97 97 GLU H H 1 8.15 0.03 . 1 . . . . 97 E H . 16536 1 1037 . 1 1 97 97 GLU HA H 1 4.11 0.03 . 1 . . . . 97 E HA . 16536 1 1038 . 1 1 97 97 GLU HB2 H 1 2.03 0.03 . 2 . . . . 97 E HB2 . 16536 1 1039 . 1 1 97 97 GLU HB3 H 1 2.19 0.03 . 2 . . . . 97 E HB3 . 16536 1 1040 . 1 1 97 97 GLU HG2 H 1 2.45 0.03 . 2 . . . . 97 E HG2 . 16536 1 1041 . 1 1 97 97 GLU HG3 H 1 2.28 0.03 . 2 . . . . 97 E HG3 . 16536 1 1042 . 1 1 97 97 GLU C C 13 178.50 0.30 . 1 . . . . 97 E C . 16536 1 1043 . 1 1 97 97 GLU CA C 13 59.20 0.30 . 1 . . . . 97 E CA . 16536 1 1044 . 1 1 97 97 GLU CB C 13 28.90 0.30 . 1 . . . . 97 E CB . 16536 1 1045 . 1 1 97 97 GLU CG C 13 36.20 0.30 . 1 . . . . 97 E CG . 16536 1 1046 . 1 1 97 97 GLU N N 15 118.80 0.20 . 1 . . . . 97 E N . 16536 1 1047 . 1 1 98 98 TRP H H 1 8.68 0.03 . 1 . . . . 98 W H . 16536 1 1048 . 1 1 98 98 TRP HA H 1 4.70 0.03 . 1 . . . . 98 W HA . 16536 1 1049 . 1 1 98 98 TRP HB2 H 1 3.36 0.03 . 2 . . . . 98 W HB2 . 16536 1 1050 . 1 1 98 98 TRP HD1 H 1 6.52 0.03 . 1 . . . . 98 W HD1 . 16536 1 1051 . 1 1 98 98 TRP HE1 H 1 9.18 0.03 . 1 . . . . 98 W HE1 . 16536 1 1052 . 1 1 98 98 TRP HH2 H 1 6.93 0.03 . 1 . . . . 98 W HH2 . 16536 1 1053 . 1 1 98 98 TRP HZ2 H 1 7.50 0.03 . 1 . . . . 98 W HZ2 . 16536 1 1054 . 1 1 98 98 TRP C C 13 178.90 0.30 . 1 . . . . 98 W C . 16536 1 1055 . 1 1 98 98 TRP CA C 13 58.30 0.30 . 1 . . . . 98 W CA . 16536 1 1056 . 1 1 98 98 TRP CB C 13 31.50 0.30 . 1 . . . . 98 W CB . 16536 1 1057 . 1 1 98 98 TRP N N 15 121.10 0.20 . 1 . . . . 98 W N . 16536 1 1058 . 1 1 98 98 TRP NE1 N 15 127.80 0.20 . 1 . . . . 98 W NE1 . 16536 1 1059 . 1 1 99 99 LEU H H 1 7.76 0.03 . 1 . . . . 99 L H . 16536 1 1060 . 1 1 99 99 LEU HA H 1 3.57 0.03 . 1 . . . . 99 L HA . 16536 1 1061 . 1 1 99 99 LEU HB2 H 1 1.69 0.03 . 2 . . . . 99 L HB2 . 16536 1 1062 . 1 1 99 99 LEU HB3 H 1 1.51 0.03 . 2 . . . . 99 L HB3 . 16536 1 1063 . 1 1 99 99 LEU HD11 H 1 0.76 0.03 . 1 . . . . 99 L QD1 . 16536 1 1064 . 1 1 99 99 LEU HD12 H 1 0.76 0.03 . 1 . . . . 99 L QD1 . 16536 1 1065 . 1 1 99 99 LEU HD13 H 1 0.76 0.03 . 1 . . . . 99 L QD1 . 16536 1 1066 . 1 1 99 99 LEU HD21 H 1 0.68 0.03 . 1 . . . . 99 L QD2 . 16536 1 1067 . 1 1 99 99 LEU HD22 H 1 0.68 0.03 . 1 . . . . 99 L QD2 . 16536 1 1068 . 1 1 99 99 LEU HD23 H 1 0.68 0.03 . 1 . . . . 99 L QD2 . 16536 1 1069 . 1 1 99 99 LEU HG H 1 1.64 0.03 . 1 . . . . 99 L HG . 16536 1 1070 . 1 1 99 99 LEU C C 13 179.30 0.30 . 1 . . . . 99 L C . 16536 1 1071 . 1 1 99 99 LEU CA C 13 58.50 0.30 . 1 . . . . 99 L CA . 16536 1 1072 . 1 1 99 99 LEU CB C 13 39.00 0.30 . 1 . . . . 99 L CB . 16536 1 1073 . 1 1 99 99 LEU CD1 C 13 25.00 0.30 . 2 . . . . 99 L CD1 . 16536 1 1074 . 1 1 99 99 LEU CD2 C 13 23.20 0.30 . 2 . . . . 99 L CD2 . 16536 1 1075 . 1 1 99 99 LEU CG C 13 30.10 0.30 . 1 . . . . 99 L CG . 16536 1 1076 . 1 1 99 99 LEU N N 15 121.30 0.20 . 1 . . . . 99 L N . 16536 1 1077 . 1 1 100 100 ARG H H 1 8.30 0.03 . 1 . . . . 100 R H . 16536 1 1078 . 1 1 100 100 ARG HA H 1 4.27 0.03 . 1 . . . . 100 R HA . 16536 1 1079 . 1 1 100 100 ARG HB2 H 1 1.98 0.03 . 2 . . . . 100 R HB2 . 16536 1 1080 . 1 1 100 100 ARG HD2 H 1 3.24 0.03 . 2 . . . . 100 R HD2 . 16536 1 1081 . 1 1 100 100 ARG HD3 H 1 3.13 0.03 . 2 . . . . 100 R HD3 . 16536 1 1082 . 1 1 100 100 ARG HG2 H 1 1.56 0.03 . 2 . . . . 100 R HG2 . 16536 1 1083 . 1 1 100 100 ARG HG3 H 1 1.80 0.03 . 2 . . . . 100 R HG3 . 16536 1 1084 . 1 1 100 100 ARG C C 13 181.70 0.30 . 1 . . . . 100 R C . 16536 1 1085 . 1 1 100 100 ARG CA C 13 59.80 0.30 . 1 . . . . 100 R CA . 16536 1 1086 . 1 1 100 100 ARG CB C 13 30.20 0.30 . 1 . . . . 100 R CB . 16536 1 1087 . 1 1 100 100 ARG CD C 13 43.40 0.30 . 1 . . . . 100 R CD . 16536 1 1088 . 1 1 100 100 ARG CG C 13 27.30 0.30 . 1 . . . . 100 R CG . 16536 1 1089 . 1 1 100 100 ARG N N 15 120.90 0.20 . 1 . . . . 100 R N . 16536 1 1090 . 1 1 101 101 ARG H H 1 8.76 0.03 . 1 . . . . 101 R H . 16536 1 1091 . 1 1 101 101 ARG HA H 1 4.01 0.03 . 1 . . . . 101 R HA . 16536 1 1092 . 1 1 101 101 ARG HB3 H 1 1.96 0.03 . 2 . . . . 101 R HB3 . 16536 1 1093 . 1 1 101 101 ARG HD2 H 1 3.00 0.03 . 2 . . . . 101 R HD2 . 16536 1 1094 . 1 1 101 101 ARG HG2 H 1 1.84 0.03 . 2 . . . . 101 R HG2 . 16536 1 1095 . 1 1 101 101 ARG C C 13 177.30 0.30 . 1 . . . . 101 R C . 16536 1 1096 . 1 1 101 101 ARG CA C 13 59.00 0.30 . 1 . . . . 101 R CA . 16536 1 1097 . 1 1 101 101 ARG CB C 13 30.40 0.30 . 1 . . . . 101 R CB . 16536 1 1098 . 1 1 101 101 ARG CD C 13 44.50 0.30 . 1 . . . . 101 R CD . 16536 1 1099 . 1 1 101 101 ARG CG C 13 27.10 0.30 . 1 . . . . 101 R CG . 16536 1 1100 . 1 1 101 101 ARG N N 15 121.20 0.20 . 1 . . . . 101 R N . 16536 1 1101 . 1 1 102 102 ASN H H 1 6.93 0.03 . 1 . . . . 102 N H . 16536 1 1102 . 1 1 102 102 ASN HA H 1 4.40 0.03 . 1 . . . . 102 N HA . 16536 1 1103 . 1 1 102 102 ASN HB2 H 1 2.56 0.03 . 2 . . . . 102 N HB2 . 16536 1 1104 . 1 1 102 102 ASN HB3 H 1 1.95 0.03 . 2 . . . . 102 N HB3 . 16536 1 1105 . 1 1 102 102 ASN HD21 H 1 6.37 0.03 . 2 . . . . 102 N HD21 . 16536 1 1106 . 1 1 102 102 ASN C C 13 173.80 0.30 . 1 . . . . 102 N C . 16536 1 1107 . 1 1 102 102 ASN CA C 13 54.00 0.30 . 1 . . . . 102 N CA . 16536 1 1108 . 1 1 102 102 ASN CB C 13 41.30 0.30 . 1 . . . . 102 N CB . 16536 1 1109 . 1 1 102 102 ASN N N 15 115.10 0.20 . 1 . . . . 102 N N . 16536 1 1110 . 1 1 102 102 ASN ND2 N 15 111.20 0.30 . 1 . . . . 102 N ND2 . 16536 1 1111 . 1 1 103 103 GLY H H 1 7.70 0.03 . 1 . . . . 103 G H . 16536 1 1112 . 1 1 103 103 GLY HA2 H 1 4.11 0.03 . 2 . . . . 103 G HA2 . 16536 1 1113 . 1 1 103 103 GLY HA3 H 1 3.68 0.03 . 2 . . . . 103 G HA3 . 16536 1 1114 . 1 1 103 103 GLY C C 13 174.40 0.30 . 1 . . . . 103 G C . 16536 1 1115 . 1 1 103 103 GLY CA C 13 46.00 0.30 . 1 . . . . 103 G CA . 16536 1 1116 . 1 1 103 103 GLY N N 15 105.90 0.20 . 1 . . . . 103 G N . 16536 1 1117 . 1 1 104 104 LEU H H 1 7.81 0.03 . 1 . . . . 104 L H . 16536 1 1118 . 1 1 104 104 LEU HA H 1 4.58 0.03 . 1 . . . . 104 L HA . 16536 1 1119 . 1 1 104 104 LEU HB2 H 1 1.31 0.03 . 2 . . . . 104 L QB . 16536 1 1120 . 1 1 104 104 LEU HB3 H 1 1.31 0.03 . 2 . . . . 104 L QB . 16536 1 1121 . 1 1 104 104 LEU HD11 H 1 0.62 0.03 . 1 . . . . 104 L QD1 . 16536 1 1122 . 1 1 104 104 LEU HD12 H 1 0.62 0.03 . 1 . . . . 104 L QD1 . 16536 1 1123 . 1 1 104 104 LEU HD13 H 1 0.62 0.03 . 1 . . . . 104 L QD1 . 16536 1 1124 . 1 1 104 104 LEU HD21 H 1 0.76 0.03 . 1 . . . . 104 L QD2 . 16536 1 1125 . 1 1 104 104 LEU HD22 H 1 0.76 0.03 . 1 . . . . 104 L QD2 . 16536 1 1126 . 1 1 104 104 LEU HD23 H 1 0.76 0.03 . 1 . . . . 104 L QD2 . 16536 1 1127 . 1 1 104 104 LEU HG H 1 1.47 0.03 . 1 . . . . 104 L HG . 16536 1 1128 . 1 1 104 104 LEU C C 13 176.20 0.30 . 1 . . . . 104 L C . 16536 1 1129 . 1 1 104 104 LEU CA C 13 55.00 0.30 . 1 . . . . 104 L CA . 16536 1 1130 . 1 1 104 104 LEU CB C 13 42.50 0.30 . 1 . . . . 104 L CB . 16536 1 1131 . 1 1 104 104 LEU CD1 C 13 25.30 0.30 . 2 . . . . 104 L CD1 . 16536 1 1132 . 1 1 104 104 LEU CD2 C 13 23.70 0.30 . 2 . . . . 104 L CD2 . 16536 1 1133 . 1 1 104 104 LEU CG C 13 29.00 0.30 . 1 . . . . 104 L CG . 16536 1 1134 . 1 1 104 104 LEU N N 15 122.60 0.20 . 1 . . . . 104 L N . 16536 1 1135 . 1 1 105 105 THR H H 1 8.18 0.03 . 1 . . . . 105 T H . 16536 1 1136 . 1 1 105 105 THR HA H 1 4.23 0.03 . 1 . . . . 105 T HA . 16536 1 1137 . 1 1 105 105 THR HB H 1 4.01 0.03 . 1 . . . . 105 T HB . 16536 1 1138 . 1 1 105 105 THR HG21 H 1 1.11 0.03 . 1 . . . . 105 T QG2 . 16536 1 1139 . 1 1 105 105 THR HG22 H 1 1.11 0.03 . 1 . . . . 105 T QG2 . 16536 1 1140 . 1 1 105 105 THR HG23 H 1 1.11 0.03 . 1 . . . . 105 T QG2 . 16536 1 1141 . 1 1 105 105 THR C C 13 173.90 0.30 . 1 . . . . 105 T C . 16536 1 1142 . 1 1 105 105 THR CA C 13 62.00 0.30 . 1 . . . . 105 T CA . 16536 1 1143 . 1 1 105 105 THR CB C 13 70.20 0.30 . 1 . . . . 105 T CB . 16536 1 1144 . 1 1 105 105 THR CG2 C 13 21.30 0.30 . 1 . . . . 105 T CG2 . 16536 1 1145 . 1 1 105 105 THR N N 15 115.90 0.20 . 1 . . . . 105 T N . 16536 1 1146 . 1 1 106 106 ILE H H 1 8.46 0.03 . 1 . . . . 106 I H . 16536 1 1147 . 1 1 106 106 ILE HA H 1 4.18 0.03 . 1 . . . . 106 I HA . 16536 1 1148 . 1 1 106 106 ILE HB H 1 1.84 0.03 . 1 . . . . 106 I HB . 16536 1 1149 . 1 1 106 106 ILE HD11 H 1 0.99 0.03 . 1 . . . . 106 I QD1 . 16536 1 1150 . 1 1 106 106 ILE HD12 H 1 0.99 0.03 . 1 . . . . 106 I QD1 . 16536 1 1151 . 1 1 106 106 ILE HD13 H 1 0.99 0.03 . 1 . . . . 106 I QD1 . 16536 1 1152 . 1 1 106 106 ILE HG12 H 1 1.34 0.03 . 2 . . . . 106 I HG12 . 16536 1 1153 . 1 1 106 106 ILE HG13 H 1 1.11 0.03 . 2 . . . . 106 I HG13 . 16536 1 1154 . 1 1 106 106 ILE HG21 H 1 0.86 0.03 . 1 . . . . 106 I QG2 . 16536 1 1155 . 1 1 106 106 ILE HG22 H 1 0.86 0.03 . 1 . . . . 106 I QG2 . 16536 1 1156 . 1 1 106 106 ILE HG23 H 1 0.86 0.03 . 1 . . . . 106 I QG2 . 16536 1 1157 . 1 1 106 106 ILE C C 13 175.90 0.30 . 1 . . . . 106 I C . 16536 1 1158 . 1 1 106 106 ILE CA C 13 60.00 0.30 . 1 . . . . 106 I CA . 16536 1 1159 . 1 1 106 106 ILE CB C 13 38.50 0.30 . 1 . . . . 106 I CB . 16536 1 1160 . 1 1 106 106 ILE CD1 C 13 13.60 0.30 . 1 . . . . 106 I CD1 . 16536 1 1161 . 1 1 106 106 ILE CG1 C 13 27.10 0.30 . 1 . . . . 106 I CG1 . 16536 1 1162 . 1 1 106 106 ILE CG2 C 13 17.80 0.30 . 1 . . . . 106 I CG2 . 16536 1 1163 . 1 1 106 106 ILE N N 15 124.64 0.20 . 1 . . . . 106 I N . 16536 1 1164 . 1 1 107 107 SER H H 1 8.60 0.03 . 1 . . . . 107 S H . 16536 1 1165 . 1 1 107 107 SER HA H 1 4.45 0.03 . 1 . . . . 107 S HA . 16536 1 1166 . 1 1 107 107 SER HB2 H 1 4.04 0.03 . 2 . . . . 107 S HB2 . 16536 1 1167 . 1 1 107 107 SER HB3 H 1 4.34 0.03 . 2 . . . . 107 S HB3 . 16536 1 1168 . 1 1 107 107 SER C C 13 175.70 0.30 . 1 . . . . 107 S C . 16536 1 1169 . 1 1 107 107 SER CA C 13 58.20 0.30 . 1 . . . . 107 S CA . 16536 1 1170 . 1 1 107 107 SER CB C 13 64.70 0.30 . 1 . . . . 107 S CB . 16536 1 1171 . 1 1 107 107 SER N N 15 123.90 0.20 . 1 . . . . 107 S N . 16536 1 1172 . 1 1 108 108 SER H H 1 9.10 0.03 . 1 . . . . 108 S H . 16536 1 1173 . 1 1 108 108 SER HA H 1 4.18 0.03 . 1 . . . . 108 S HA . 16536 1 1174 . 1 1 108 108 SER HB2 H 1 3.98 0.03 . 2 . . . . 108 S HB2 . 16536 1 1175 . 1 1 108 108 SER HB3 H 1 4.34 0.03 . 2 . . . . 108 S HB3 . 16536 1 1176 . 1 1 108 108 SER C C 13 175.90 0.30 . 1 . . . . 108 S C . 16536 1 1177 . 1 1 108 108 SER CA C 13 62.00 0.30 . 1 . . . . 108 S CA . 16536 1 1178 . 1 1 108 108 SER N N 15 118.40 0.20 . 1 . . . . 108 S N . 16536 1 1179 . 1 1 109 109 ASP H H 1 8.42 0.03 . 1 . . . . 109 D H . 16536 1 1180 . 1 1 109 109 ASP HA H 1 4.36 0.03 . 1 . . . . 109 D HA . 16536 1 1181 . 1 1 109 109 ASP HB2 H 1 2.70 0.03 . 2 . . . . 109 D HB2 . 16536 1 1182 . 1 1 109 109 ASP HB3 H 1 2.54 0.03 . 2 . . . . 109 D HB3 . 16536 1 1183 . 1 1 109 109 ASP C C 13 179.60 0.30 . 1 . . . . 109 D C . 16536 1 1184 . 1 1 109 109 ASP CA C 13 57.20 0.30 . 1 . . . . 109 D CA . 16536 1 1185 . 1 1 109 109 ASP CB C 13 40.10 0.30 . 1 . . . . 109 D CB . 16536 1 1186 . 1 1 109 109 ASP N N 15 119.60 0.30 . 1 . . . . 109 D N . 16536 1 1187 . 1 1 110 110 VAL H H 1 7.49 0.03 . 1 . . . . 110 V H . 16536 1 1188 . 1 1 110 110 VAL HA H 1 3.60 0.03 . 1 . . . . 110 V HA . 16536 1 1189 . 1 1 110 110 VAL HB H 1 2.14 0.03 . 1 . . . . 110 V HB . 16536 1 1190 . 1 1 110 110 VAL HG11 H 1 1.00 0.03 . 1 . . . . 110 V QG1 . 16536 1 1191 . 1 1 110 110 VAL HG12 H 1 1.00 0.03 . 1 . . . . 110 V QG1 . 16536 1 1192 . 1 1 110 110 VAL HG13 H 1 1.00 0.03 . 1 . . . . 110 V QG1 . 16536 1 1193 . 1 1 110 110 VAL HG21 H 1 0.86 0.03 . 1 . . . . 110 V QG2 . 16536 1 1194 . 1 1 110 110 VAL HG22 H 1 0.86 0.03 . 1 . . . . 110 V QG2 . 16536 1 1195 . 1 1 110 110 VAL HG23 H 1 0.86 0.03 . 1 . . . . 110 V QG2 . 16536 1 1196 . 1 1 110 110 VAL C C 13 177.80 0.30 . 1 . . . . 110 V C . 16536 1 1197 . 1 1 110 110 VAL CA C 13 66.50 0.30 . 1 . . . . 110 V CA . 16536 1 1198 . 1 1 110 110 VAL CB C 13 31.80 0.30 . 1 . . . . 110 V CB . 16536 1 1199 . 1 1 110 110 VAL CG1 C 13 23.30 0.30 . 2 . . . . 110 V CG1 . 16536 1 1200 . 1 1 110 110 VAL CG2 C 13 22.30 0.30 . 2 . . . . 110 V CG2 . 16536 1 1201 . 1 1 110 110 VAL N N 15 122.50 0.20 . 1 . . . . 110 V N . 16536 1 1202 . 1 1 111 111 SER H H 1 8.20 0.03 . 1 . . . . 111 S H . 16536 1 1203 . 1 1 111 111 SER HA H 1 4.16 0.03 . 1 . . . . 111 S HA . 16536 1 1204 . 1 1 111 111 SER HB2 H 1 3.89 0.03 . 2 . . . . 111 S HB2 . 16536 1 1205 . 1 1 111 111 SER HB3 H 1 4.03 0.03 . 2 . . . . 111 S HB3 . 16536 1 1206 . 1 1 111 111 SER C C 13 178.10 0.30 . 1 . . . . 111 S C . 16536 1 1207 . 1 1 111 111 SER CA C 13 62.20 0.30 . 1 . . . . 111 S CA . 16536 1 1208 . 1 1 111 111 SER CB C 13 62.80 0.30 . 1 . . . . 111 S CB . 16536 1 1209 . 1 1 111 111 SER N N 15 114.80 0.20 . 1 . . . . 111 S N . 16536 1 1210 . 1 1 112 112 ASP H H 1 8.83 0.03 . 1 . . . . 112 D H . 16536 1 1211 . 1 1 112 112 ASP HA H 1 4.37 0.03 . 1 . . . . 112 D HA . 16536 1 1212 . 1 1 112 112 ASP HB2 H 1 2.69 0.03 . 2 . . . . 112 D HB2 . 16536 1 1213 . 1 1 112 112 ASP HB3 H 1 2.80 0.03 . 2 . . . . 112 D HB3 . 16536 1 1214 . 1 1 112 112 ASP C C 13 178.60 0.30 . 1 . . . . 112 D C . 16536 1 1215 . 1 1 112 112 ASP CA C 13 57.60 0.30 . 1 . . . . 112 D CA . 16536 1 1216 . 1 1 112 112 ASP CB C 13 40.10 0.30 . 1 . . . . 112 D CB . 16536 1 1217 . 1 1 112 112 ASP N N 15 120.90 0.20 . 1 . . . . 112 D N . 16536 1 1218 . 1 1 113 113 ALA H H 1 7.51 0.03 . 1 . . . . 113 A H . 16536 1 1219 . 1 1 113 113 ALA HA H 1 4.28 0.03 . 1 . . . . 113 A HA . 16536 1 1220 . 1 1 113 113 ALA HB1 H 1 1.49 0.03 . 1 . . . . 113 A QB . 16536 1 1221 . 1 1 113 113 ALA HB2 H 1 1.49 0.03 . 1 . . . . 113 A QB . 16536 1 1222 . 1 1 113 113 ALA HB3 H 1 1.49 0.03 . 1 . . . . 113 A QB . 16536 1 1223 . 1 1 113 113 ALA C C 13 180.80 0.30 . 1 . . . . 113 A C . 16536 1 1224 . 1 1 113 113 ALA CA C 13 55.10 0.30 . 1 . . . . 113 A CA . 16536 1 1225 . 1 1 113 113 ALA CB C 13 18.10 0.30 . 1 . . . . 113 A CB . 16536 1 1226 . 1 1 113 113 ALA N N 15 123.40 0.20 . 1 . . . . 113 A N . 16536 1 1227 . 1 1 114 114 MET H H 1 8.21 0.03 . 1 . . . . 114 M H . 16536 1 1228 . 1 1 114 114 MET HA H 1 3.98 0.03 . 1 . . . . 114 M HA . 16536 1 1229 . 1 1 114 114 MET HB2 H 1 2.21 0.03 . 2 . . . . 114 M HB2 . 16536 1 1230 . 1 1 114 114 MET HB3 H 1 2.40 0.03 . 2 . . . . 114 M HB3 . 16536 1 1231 . 1 1 114 114 MET HG2 H 1 2.92 0.03 . 2 . . . . 114 M HG2 . 16536 1 1232 . 1 1 114 114 MET C C 13 178.70 0.30 . 1 . . . . 114 M C . 16536 1 1233 . 1 1 114 114 MET CA C 13 60.30 0.30 . 1 . . . . 114 M CA . 16536 1 1234 . 1 1 114 114 MET CB C 13 34.30 0.30 . 1 . . . . 114 M CB . 16536 1 1235 . 1 1 114 114 MET CG C 13 32.50 0.30 . 1 . . . . 114 M CG . 16536 1 1236 . 1 1 114 114 MET N N 15 117.70 0.20 . 1 . . . . 114 M N . 16536 1 1237 . 1 1 115 115 THR H H 1 8.50 0.03 . 1 . . . . 115 T H . 16536 1 1238 . 1 1 115 115 THR HA H 1 4.17 0.03 . 1 . . . . 115 T HA . 16536 1 1239 . 1 1 115 115 THR HB H 1 4.37 0.03 . 1 . . . . 115 T HB . 16536 1 1240 . 1 1 115 115 THR HG21 H 1 1.32 0.03 . 1 . . . . 115 T QG2 . 16536 1 1241 . 1 1 115 115 THR HG22 H 1 1.32 0.03 . 1 . . . . 115 T QG2 . 16536 1 1242 . 1 1 115 115 THR HG23 H 1 1.32 0.03 . 1 . . . . 115 T QG2 . 16536 1 1243 . 1 1 115 115 THR C C 13 175.90 0.30 . 1 . . . . 115 T C . 16536 1 1244 . 1 1 115 115 THR CA C 13 66.70 0.30 . 1 . . . . 115 T CA . 16536 1 1245 . 1 1 115 115 THR CB C 13 69.10 0.30 . 1 . . . . 115 T CB . 16536 1 1246 . 1 1 115 115 THR CG2 C 13 22.50 0.30 . 1 . . . . 115 T CG2 . 16536 1 1247 . 1 1 115 115 THR N N 15 117.50 0.20 . 1 . . . . 115 T N . 16536 1 1248 . 1 1 116 116 ASP H H 1 7.86 0.03 . 1 . . . . 116 D H . 16536 1 1249 . 1 1 116 116 ASP HA H 1 4.31 0.03 . 1 . . . . 116 D HA . 16536 1 1250 . 1 1 116 116 ASP HB2 H 1 2.52 0.03 . 2 . . . . 116 D HB2 . 16536 1 1251 . 1 1 116 116 ASP HB3 H 1 2.69 0.03 . 2 . . . . 116 D HB3 . 16536 1 1252 . 1 1 116 116 ASP C C 13 178.50 0.30 . 1 . . . . 116 D C . 16536 1 1253 . 1 1 116 116 ASP CA C 13 57.90 0.30 . 1 . . . . 116 D CA . 16536 1 1254 . 1 1 116 116 ASP CB C 13 41.50 0.30 . 1 . . . . 116 D CB . 16536 1 1255 . 1 1 116 116 ASP N N 15 121.00 0.20 . 1 . . . . 116 D N . 16536 1 1256 . 1 1 117 117 HIS H H 1 7.36 0.03 . 1 . . . . 117 H H . 16536 1 1257 . 1 1 117 117 HIS HA H 1 4.03 0.03 . 1 . . . . 117 H HA . 16536 1 1258 . 1 1 117 117 HIS HB2 H 1 3.13 0.03 . 2 . . . . 117 H HB2 . 16536 1 1259 . 1 1 117 117 HIS HB3 H 1 3.04 0.03 . 2 . . . . 117 H HB3 . 16536 1 1260 . 1 1 117 117 HIS C C 13 178.10 0.30 . 1 . . . . 117 H C . 16536 1 1261 . 1 1 117 117 HIS CA C 13 60.70 0.30 . 1 . . . . 117 H CA . 16536 1 1262 . 1 1 117 117 HIS CB C 13 28.70 0.30 . 1 . . . . 117 H CB . 16536 1 1263 . 1 1 117 117 HIS N N 15 115.50 0.20 . 1 . . . . 117 H N . 16536 1 1264 . 1 1 118 118 GLU H H 1 8.75 0.03 . 1 . . . . 118 E H . 16536 1 1265 . 1 1 118 118 GLU HA H 1 4.55 0.03 . 1 . . . . 118 E HA . 16536 1 1266 . 1 1 118 118 GLU HB2 H 1 2.12 0.03 . 2 . . . . 118 E HB2 . 16536 1 1267 . 1 1 118 118 GLU HB3 H 1 2.34 0.03 . 2 . . . . 118 E HB3 . 16536 1 1268 . 1 1 118 118 GLU HG2 H 1 2.55 0.03 . 2 . . . . 118 E HG2 . 16536 1 1269 . 1 1 118 118 GLU HG3 H 1 2.46 0.03 . 2 . . . . 118 E HG3 . 16536 1 1270 . 1 1 118 118 GLU C C 13 181.70 0.30 . 1 . . . . 118 E C . 16536 1 1271 . 1 1 118 118 GLU CA C 13 59.40 0.30 . 1 . . . . 118 E CA . 16536 1 1272 . 1 1 118 118 GLU CB C 13 29.60 0.30 . 1 . . . . 118 E CB . 16536 1 1273 . 1 1 118 118 GLU CG C 13 36.70 0.30 . 1 . . . . 118 E CG . 16536 1 1274 . 1 1 118 118 GLU N N 15 122.70 0.20 . 1 . . . . 118 E N . 16536 1 1275 . 1 1 119 119 MET H H 1 8.79 0.03 . 1 . . . . 119 M H . 16536 1 1276 . 1 1 119 119 MET HA H 1 4.39 0.03 . 1 . . . . 119 M HA . 16536 1 1277 . 1 1 119 119 MET HB2 H 1 2.72 0.03 . 2 . . . . 119 M HB2 . 16536 1 1278 . 1 1 119 119 MET HB3 H 1 2.23 0.03 . 2 . . . . 119 M HB3 . 16536 1 1279 . 1 1 119 119 MET HG2 H 1 2.78 0.03 . 2 . . . . 119 M HG2 . 16536 1 1280 . 1 1 119 119 MET HG3 H 1 2.97 0.03 . 2 . . . . 119 M HG3 . 16536 1 1281 . 1 1 119 119 MET C C 13 177.90 0.30 . 1 . . . . 119 M C . 16536 1 1282 . 1 1 119 119 MET CA C 13 57.70 0.30 . 1 . . . . 119 M CA . 16536 1 1283 . 1 1 119 119 MET CB C 13 32.70 0.30 . 1 . . . . 119 M CB . 16536 1 1284 . 1 1 119 119 MET CG C 13 32.40 0.30 . 1 . . . . 119 M CG . 16536 1 1285 . 1 1 119 119 MET N N 15 119.40 0.20 . 1 . . . . 119 M N . 16536 1 1286 . 1 1 120 120 LYS H H 1 7.41 0.03 . 1 . . . . 120 K H . 16536 1 1287 . 1 1 120 120 LYS HA H 1 4.43 0.03 . 1 . . . . 120 K HA . 16536 1 1288 . 1 1 120 120 LYS HB2 H 1 1.81 0.03 . 2 . . . . 120 K HB2 . 16536 1 1289 . 1 1 120 120 LYS HB3 H 1 2.10 0.03 . 2 . . . . 120 K HB3 . 16536 1 1290 . 1 1 120 120 LYS HD2 H 1 1.44 0.03 . 2 . . . . 120 K HD2 . 16536 1 1291 . 1 1 120 120 LYS HE2 H 1 2.82 0.03 . 2 . . . . 120 K HE2 . 16536 1 1292 . 1 1 120 120 LYS HE3 H 1 2.71 0.03 . 2 . . . . 120 K HE3 . 16536 1 1293 . 1 1 120 120 LYS HG2 H 1 1.54 0.03 . 2 . . . . 120 K HG2 . 16536 1 1294 . 1 1 120 120 LYS C C 13 176.90 0.30 . 1 . . . . 120 K C . 16536 1 1295 . 1 1 120 120 LYS CA C 13 56.30 0.30 . 1 . . . . 120 K CA . 16536 1 1296 . 1 1 120 120 LYS CB C 13 33.00 0.30 . 1 . . . . 120 K CB . 16536 1 1297 . 1 1 120 120 LYS CD C 13 29.90 0.30 . 1 . . . . 120 K CD . 16536 1 1298 . 1 1 120 120 LYS CE C 13 42.30 0.30 . 1 . . . . 120 K CE . 16536 1 1299 . 1 1 120 120 LYS CG C 13 25.00 0.30 . 1 . . . . 120 K CG . 16536 1 1300 . 1 1 120 120 LYS N N 15 118.20 0.20 . 1 . . . . 120 K N . 16536 1 1301 . 1 1 121 121 GLY H H 1 8.13 0.03 . 1 . . . . 121 G H . 16536 1 1302 . 1 1 121 121 GLY HA2 H 1 3.89 0.03 . 2 . . . . 121 G HA2 . 16536 1 1303 . 1 1 121 121 GLY HA3 H 1 4.24 0.03 . 2 . . . . 121 G HA3 . 16536 1 1304 . 1 1 121 121 GLY C C 13 175.00 0.30 . 1 . . . . 121 G C . 16536 1 1305 . 1 1 121 121 GLY CA C 13 45.90 0.30 . 1 . . . . 121 G CA . 16536 1 1306 . 1 1 121 121 GLY N N 15 108.20 0.20 . 1 . . . . 121 G N . 16536 1 1307 . 1 1 122 122 GLN H H 1 7.74 0.03 . 1 . . . . 122 Q H . 16536 1 1308 . 1 1 122 122 GLN HA H 1 4.75 0.03 . 1 . . . . 122 Q HA . 16536 1 1309 . 1 1 122 122 GLN HB2 H 1 1.88 0.03 . 2 . . . . 122 Q HB2 . 16536 1 1310 . 1 1 122 122 GLN HB3 H 1 2.23 0.03 . 2 . . . . 122 Q HB3 . 16536 1 1311 . 1 1 122 122 GLN HE21 H 1 7.62 0.03 . 2 . . . . 122 Q HE21 . 16536 1 1312 . 1 1 122 122 GLN HE22 H 1 6.90 0.03 . 2 . . . . 122 Q HE22 . 16536 1 1313 . 1 1 122 122 GLN HG2 H 1 2.29 0.03 . 2 . . . . 122 Q HG2 . 16536 1 1314 . 1 1 122 122 GLN HG3 H 1 2.03 0.03 . 2 . . . . 122 Q HG3 . 16536 1 1315 . 1 1 122 122 GLN C C 13 175.40 0.30 . 1 . . . . 122 Q C . 16536 1 1316 . 1 1 122 122 GLN CA C 13 54.70 0.30 . 1 . . . . 122 Q CA . 16536 1 1317 . 1 1 122 122 GLN CB C 13 30.10 0.30 . 1 . . . . 122 Q CB . 16536 1 1318 . 1 1 122 122 GLN CG C 13 33.90 0.30 . 1 . . . . 122 Q CG . 16536 1 1319 . 1 1 122 122 GLN N N 15 119.10 0.20 . 1 . . . . 122 Q N . 16536 1 1320 . 1 1 122 122 GLN NE2 N 15 108.80 0.30 . 1 . . . . 122 Q NE2 . 16536 1 1321 . 1 1 123 123 THR H H 1 8.88 0.03 . 1 . . . . 123 T H . 16536 1 1322 . 1 1 123 123 THR HA H 1 4.39 0.03 . 1 . . . . 123 T HA . 16536 1 1323 . 1 1 123 123 THR HB H 1 3.83 0.03 . 1 . . . . 123 T HB . 16536 1 1324 . 1 1 123 123 THR HG21 H 1 1.09 0.03 . 1 . . . . 123 T QG2 . 16536 1 1325 . 1 1 123 123 THR HG22 H 1 1.09 0.03 . 1 . . . . 123 T QG2 . 16536 1 1326 . 1 1 123 123 THR HG23 H 1 1.09 0.03 . 1 . . . . 123 T QG2 . 16536 1 1327 . 1 1 123 123 THR C C 13 173.00 0.30 . 1 . . . . 123 T C . 16536 1 1328 . 1 1 123 123 THR CA C 13 63.10 0.30 . 1 . . . . 123 T CA . 16536 1 1329 . 1 1 123 123 THR CB C 13 70.40 0.30 . 1 . . . . 123 T CB . 16536 1 1330 . 1 1 123 123 THR CG2 C 13 21.30 0.30 . 1 . . . . 123 T CG2 . 16536 1 1331 . 1 1 123 123 THR N N 15 118.40 0.20 . 1 . . . . 123 T N . 16536 1 1332 . 1 1 124 124 ALA H H 1 8.96 0.03 . 1 . . . . 124 A H . 16536 1 1333 . 1 1 124 124 ALA HA H 1 5.28 0.03 . 1 . . . . 124 A HA . 16536 1 1334 . 1 1 124 124 ALA HB1 H 1 1.29 0.03 . 1 . . . . 124 A QB . 16536 1 1335 . 1 1 124 124 ALA HB2 H 1 1.29 0.03 . 1 . . . . 124 A QB . 16536 1 1336 . 1 1 124 124 ALA HB3 H 1 1.29 0.03 . 1 . . . . 124 A QB . 16536 1 1337 . 1 1 124 124 ALA C C 13 175.30 0.30 . 1 . . . . 124 A C . 16536 1 1338 . 1 1 124 124 ALA CA C 13 50.30 0.30 . 1 . . . . 124 A CA . 16536 1 1339 . 1 1 124 124 ALA CB C 13 21.80 0.30 . 1 . . . . 124 A CB . 16536 1 1340 . 1 1 124 124 ALA N N 15 130.20 0.20 . 1 . . . . 124 A N . 16536 1 1341 . 1 1 125 125 ILE H H 1 8.89 0.03 . 1 . . . . 125 I H . 16536 1 1342 . 1 1 125 125 ILE HA H 1 4.36 0.03 . 1 . . . . 125 I HA . 16536 1 1343 . 1 1 125 125 ILE HB H 1 1.89 0.03 . 1 . . . . 125 I HB . 16536 1 1344 . 1 1 125 125 ILE C C 13 174.30 0.30 . 1 . . . . 125 I C . 16536 1 1345 . 1 1 125 125 ILE CA C 13 59.30 0.30 . 1 . . . . 125 I CA . 16536 1 1346 . 1 1 125 125 ILE CB C 13 41.10 0.30 . 1 . . . . 125 I CB . 16536 1 1347 . 1 1 125 125 ILE N N 15 118.80 0.20 . 1 . . . . 125 I N . 16536 1 1348 . 1 1 126 126 LEU H H 1 9.06 0.03 . 1 . . . . 126 L H . 16536 1 1349 . 1 1 126 126 LEU HA H 1 5.07 0.03 . 1 . . . . 126 L HA . 16536 1 1350 . 1 1 126 126 LEU HB2 H 1 1.31 0.03 . 2 . . . . 126 L HB2 . 16536 1 1351 . 1 1 126 126 LEU HB3 H 1 1.88 0.03 . 2 . . . . 126 L HB3 . 16536 1 1352 . 1 1 126 126 LEU HD11 H 1 0.94 0.03 . 1 . . . . 126 L QD1 . 16536 1 1353 . 1 1 126 126 LEU HD12 H 1 0.94 0.03 . 1 . . . . 126 L QD1 . 16536 1 1354 . 1 1 126 126 LEU HD13 H 1 0.94 0.03 . 1 . . . . 126 L QD1 . 16536 1 1355 . 1 1 126 126 LEU HD21 H 1 0.73 0.03 . 1 . . . . 126 L QD2 . 16536 1 1356 . 1 1 126 126 LEU HD22 H 1 0.73 0.03 . 1 . . . . 126 L QD2 . 16536 1 1357 . 1 1 126 126 LEU HD23 H 1 0.73 0.03 . 1 . . . . 126 L QD2 . 16536 1 1358 . 1 1 126 126 LEU HG H 1 1.31 0.03 . 1 . . . . 126 L HG . 16536 1 1359 . 1 1 126 126 LEU C C 13 175.80 0.30 . 1 . . . . 126 L C . 16536 1 1360 . 1 1 126 126 LEU CA C 13 54.00 0.30 . 1 . . . . 126 L CA . 16536 1 1361 . 1 1 126 126 LEU CB C 13 45.50 0.30 . 1 . . . . 126 L CB . 16536 1 1362 . 1 1 126 126 LEU CD1 C 13 23.00 0.30 . 2 . . . . 126 L CD1 . 16536 1 1363 . 1 1 126 126 LEU CD2 C 13 26.00 0.30 . 2 . . . . 126 L CD2 . 16536 1 1364 . 1 1 126 126 LEU CG C 13 27.50 0.30 . 1 . . . . 126 L CG . 16536 1 1365 . 1 1 126 126 LEU N N 15 124.20 0.20 . 1 . . . . 126 L N . 16536 1 1366 . 1 1 127 127 VAL H H 1 8.29 0.03 . 1 . . . . 127 V H . 16536 1 1367 . 1 1 127 127 VAL HA H 1 4.88 0.03 . 1 . . . . 127 V HA . 16536 1 1368 . 1 1 127 127 VAL HB H 1 1.67 0.03 . 1 . . . . 127 V HB . 16536 1 1369 . 1 1 127 127 VAL HG11 H 1 0.70 0.03 . 1 . . . . 127 V QG1 . 16536 1 1370 . 1 1 127 127 VAL HG12 H 1 0.70 0.03 . 1 . . . . 127 V QG1 . 16536 1 1371 . 1 1 127 127 VAL HG13 H 1 0.70 0.03 . 1 . . . . 127 V QG1 . 16536 1 1372 . 1 1 127 127 VAL HG21 H 1 0.74 0.03 . 1 . . . . 127 V QG2 . 16536 1 1373 . 1 1 127 127 VAL HG22 H 1 0.74 0.03 . 1 . . . . 127 V QG2 . 16536 1 1374 . 1 1 127 127 VAL HG23 H 1 0.74 0.03 . 1 . . . . 127 V QG2 . 16536 1 1375 . 1 1 127 127 VAL C C 13 174.50 0.30 . 1 . . . . 127 V C . 16536 1 1376 . 1 1 127 127 VAL CA C 13 60.70 0.30 . 1 . . . . 127 V CA . 16536 1 1377 . 1 1 127 127 VAL CB C 13 35.60 0.30 . 1 . . . . 127 V CB . 16536 1 1378 . 1 1 127 127 VAL CG1 C 13 20.60 0.30 . 2 . . . . 127 V CG1 . 16536 1 1379 . 1 1 127 127 VAL CG2 C 13 20.60 0.30 . 2 . . . . 127 V CG2 . 16536 1 1380 . 1 1 127 127 VAL N N 15 116.50 0.20 . 1 . . . . 127 V N . 16536 1 1381 . 1 1 128 128 ALA H H 1 9.48 0.03 . 1 . . . . 128 A H . 16536 1 1382 . 1 1 128 128 ALA HA H 1 5.55 0.03 . 1 . . . . 128 A HA . 16536 1 1383 . 1 1 128 128 ALA HB1 H 1 1.05 0.03 . 1 . . . . 128 A QB . 16536 1 1384 . 1 1 128 128 ALA HB2 H 1 1.05 0.03 . 1 . . . . 128 A QB . 16536 1 1385 . 1 1 128 128 ALA HB3 H 1 1.05 0.03 . 1 . . . . 128 A QB . 16536 1 1386 . 1 1 128 128 ALA C C 13 176.10 0.30 . 1 . . . . 128 A C . 16536 1 1387 . 1 1 128 128 ALA CA C 13 50.60 0.30 . 1 . . . . 128 A CA . 16536 1 1388 . 1 1 128 128 ALA CB C 13 22.90 0.30 . 1 . . . . 128 A CB . 16536 1 1389 . 1 1 128 128 ALA N N 15 129.50 0.20 . 1 . . . . 128 A N . 16536 1 1390 . 1 1 129 129 ILE H H 1 8.33 0.03 . 1 . . . . 129 I H . 16536 1 1391 . 1 1 129 129 ILE HA H 1 4.84 0.03 . 1 . . . . 129 I HA . 16536 1 1392 . 1 1 129 129 ILE HB H 1 1.70 0.03 . 1 . . . . 129 I HB . 16536 1 1393 . 1 1 129 129 ILE HD11 H 1 0.66 0.03 . 1 . . . . 129 I QD1 . 16536 1 1394 . 1 1 129 129 ILE HD12 H 1 0.66 0.03 . 1 . . . . 129 I QD1 . 16536 1 1395 . 1 1 129 129 ILE HD13 H 1 0.66 0.03 . 1 . . . . 129 I QD1 . 16536 1 1396 . 1 1 129 129 ILE HG12 H 1 1.56 0.03 . 2 . . . . 129 I HG12 . 16536 1 1397 . 1 1 129 129 ILE HG21 H 1 0.90 0.03 . 1 . . . . 129 I QG2 . 16536 1 1398 . 1 1 129 129 ILE HG22 H 1 0.90 0.03 . 1 . . . . 129 I QG2 . 16536 1 1399 . 1 1 129 129 ILE HG23 H 1 0.90 0.03 . 1 . . . . 129 I QG2 . 16536 1 1400 . 1 1 129 129 ILE C C 13 176.00 0.30 . 1 . . . . 129 I C . 16536 1 1401 . 1 1 129 129 ILE CA C 13 60.50 0.30 . 1 . . . . 129 I CA . 16536 1 1402 . 1 1 129 129 ILE CB C 13 40.70 0.30 . 1 . . . . 129 I CB . 16536 1 1403 . 1 1 129 129 ILE CD1 C 13 14.10 0.30 . 1 . . . . 129 I CD1 . 16536 1 1404 . 1 1 129 129 ILE CG2 C 13 18.20 0.30 . 1 . . . . 129 I CG2 . 16536 1 1405 . 1 1 129 129 ILE N N 15 121.20 0.20 . 1 . . . . 129 I N . 16536 1 1406 . 1 1 130 130 ASP H H 1 10.26 0.03 . 1 . . . . 130 D H . 16536 1 1407 . 1 1 130 130 ASP HA H 1 4.49 0.03 . 1 . . . . 130 D HA . 16536 1 1408 . 1 1 130 130 ASP HB2 H 1 2.87 0.03 . 2 . . . . 130 D HB2 . 16536 1 1409 . 1 1 130 130 ASP HB3 H 1 3.03 0.03 . 2 . . . . 130 D HB3 . 16536 1 1410 . 1 1 130 130 ASP C C 13 176.30 0.30 . 1 . . . . 130 D C . 16536 1 1411 . 1 1 130 130 ASP CA C 13 56.00 0.30 . 1 . . . . 130 D CA . 16536 1 1412 . 1 1 130 130 ASP CB C 13 39.70 0.30 . 1 . . . . 130 D CB . 16536 1 1413 . 1 1 130 130 ASP N N 15 129.70 0.20 . 1 . . . . 130 D N . 16536 1 1414 . 1 1 131 131 GLY H H 1 9.20 0.03 . 1 . . . . 131 G H . 16536 1 1415 . 1 1 131 131 GLY HA2 H 1 3.34 0.03 . 2 . . . . 131 G HA2 . 16536 1 1416 . 1 1 131 131 GLY HA3 H 1 4.09 0.03 . 2 . . . . 131 G HA3 . 16536 1 1417 . 1 1 131 131 GLY C C 13 173.60 0.30 . 1 . . . . 131 G C . 16536 1 1418 . 1 1 131 131 GLY CA C 13 45.50 0.30 . 1 . . . . 131 G CA . 16536 1 1419 . 1 1 131 131 GLY N N 15 103.00 0.20 . 1 . . . . 131 G N . 16536 1 1420 . 1 1 132 132 VAL H H 1 7.68 0.03 . 1 . . . . 132 V H . 16536 1 1421 . 1 1 132 132 VAL HA H 1 4.14 0.03 . 1 . . . . 132 V HA . 16536 1 1422 . 1 1 132 132 VAL HB H 1 2.12 0.03 . 1 . . . . 132 V HB . 16536 1 1423 . 1 1 132 132 VAL HG11 H 1 0.90 0.03 . 1 . . . . 132 V QG1 . 16536 1 1424 . 1 1 132 132 VAL HG12 H 1 0.90 0.03 . 1 . . . . 132 V QG1 . 16536 1 1425 . 1 1 132 132 VAL HG13 H 1 0.90 0.03 . 1 . . . . 132 V QG1 . 16536 1 1426 . 1 1 132 132 VAL HG21 H 1 0.92 0.03 . 1 . . . . 132 V QG2 . 16536 1 1427 . 1 1 132 132 VAL HG22 H 1 0.92 0.03 . 1 . . . . 132 V QG2 . 16536 1 1428 . 1 1 132 132 VAL HG23 H 1 0.92 0.03 . 1 . . . . 132 V QG2 . 16536 1 1429 . 1 1 132 132 VAL C C 13 176.10 0.30 . 1 . . . . 132 V C . 16536 1 1430 . 1 1 132 132 VAL CA C 13 61.30 0.30 . 1 . . . . 132 V CA . 16536 1 1431 . 1 1 132 132 VAL CB C 13 34.30 0.30 . 1 . . . . 132 V CB . 16536 1 1432 . 1 1 132 132 VAL CG1 C 13 21.30 0.30 . 2 . . . . 132 V CG1 . 16536 1 1433 . 1 1 132 132 VAL CG2 C 13 21.30 0.30 . 2 . . . . 132 V CG2 . 16536 1 1434 . 1 1 132 132 VAL N N 15 120.10 0.20 . 1 . . . . 132 V N . 16536 1 1435 . 1 1 133 133 LEU H H 1 8.93 0.03 . 1 . . . . 133 L H . 16536 1 1436 . 1 1 133 133 LEU HA H 1 4.33 0.03 . 1 . . . . 133 L HA . 16536 1 1437 . 1 1 133 133 LEU HB2 H 1 1.91 0.03 . 2 . . . . 133 L HB2 . 16536 1 1438 . 1 1 133 133 LEU HB3 H 1 1.44 0.03 . 2 . . . . 133 L HB3 . 16536 1 1439 . 1 1 133 133 LEU HD11 H 1 0.69 0.03 . 1 . . . . 133 L QD1 . 16536 1 1440 . 1 1 133 133 LEU HD12 H 1 0.69 0.03 . 1 . . . . 133 L QD1 . 16536 1 1441 . 1 1 133 133 LEU HD13 H 1 0.69 0.03 . 1 . . . . 133 L QD1 . 16536 1 1442 . 1 1 133 133 LEU HD21 H 1 0.90 0.03 . 1 . . . . 133 L QD2 . 16536 1 1443 . 1 1 133 133 LEU HD22 H 1 0.90 0.03 . 1 . . . . 133 L QD2 . 16536 1 1444 . 1 1 133 133 LEU HD23 H 1 0.90 0.03 . 1 . . . . 133 L QD2 . 16536 1 1445 . 1 1 133 133 LEU HG H 1 1.56 0.03 . 1 . . . . 133 L HG . 16536 1 1446 . 1 1 133 133 LEU C C 13 176.20 0.30 . 1 . . . . 133 L C . 16536 1 1447 . 1 1 133 133 LEU CA C 13 56.70 0.30 . 1 . . . . 133 L CA . 16536 1 1448 . 1 1 133 133 LEU CB C 13 41.70 0.30 . 1 . . . . 133 L CB . 16536 1 1449 . 1 1 133 133 LEU CD1 C 13 25.70 0.30 . 2 . . . . 133 L CD1 . 16536 1 1450 . 1 1 133 133 LEU CG C 13 26.40 0.30 . 1 . . . . 133 L CG . 16536 1 1451 . 1 1 133 133 LEU N N 15 130.10 0.20 . 1 . . . . 133 L N . 16536 1 1452 . 1 1 134 134 CYS H H 1 9.12 0.03 . 1 . . . . 134 C H . 16536 1 1453 . 1 1 134 134 CYS HA H 1 5.25 0.03 . 1 . . . . 134 C HA . 16536 1 1454 . 1 1 134 134 CYS HB2 H 1 3.16 0.03 . 2 . . . . 134 C HB2 . 16536 1 1455 . 1 1 134 134 CYS HB3 H 1 2.69 0.03 . 2 . . . . 134 C HB3 . 16536 1 1456 . 1 1 134 134 CYS C C 13 175.20 0.30 . 1 . . . . 134 C C . 16536 1 1457 . 1 1 134 134 CYS CA C 13 57.80 0.30 . 1 . . . . 134 C CA . 16536 1 1458 . 1 1 134 134 CYS CB C 13 31.80 0.30 . 1 . . . . 134 C CB . 16536 1 1459 . 1 1 134 134 CYS N N 15 120.80 0.20 . 1 . . . . 134 C N . 16536 1 1460 . 1 1 135 135 GLY H H 1 7.95 0.03 . 1 . . . . 135 G H . 16536 1 1461 . 1 1 135 135 GLY HA2 H 1 3.45 0.03 . 2 . . . . 135 G HA2 . 16536 1 1462 . 1 1 135 135 GLY HA3 H 1 5.22 0.03 . 2 . . . . 135 G HA3 . 16536 1 1463 . 1 1 135 135 GLY C C 13 169.80 0.30 . 1 . . . . 135 G C . 16536 1 1464 . 1 1 135 135 GLY CA C 13 45.50 0.30 . 1 . . . . 135 G CA . 16536 1 1465 . 1 1 135 135 GLY N N 15 110.00 0.20 . 1 . . . . 135 G N . 16536 1 1466 . 1 1 136 136 MET H H 1 9.06 0.03 . 1 . . . . 136 M H . 16536 1 1467 . 1 1 136 136 MET HA H 1 5.30 0.03 . 1 . . . . 136 M HA . 16536 1 1468 . 1 1 136 136 MET HB2 H 1 2.07 0.03 . 2 . . . . 136 M HB2 . 16536 1 1469 . 1 1 136 136 MET HB3 H 1 1.99 0.03 . 2 . . . . 136 M HB3 . 16536 1 1470 . 1 1 136 136 MET HG3 H 1 2.31 0.03 . 2 . . . . 136 M HG3 . 16536 1 1471 . 1 1 136 136 MET C C 13 173.70 0.30 . 1 . . . . 136 M C . 16536 1 1472 . 1 1 136 136 MET CA C 13 54.50 0.30 . 1 . . . . 136 M CA . 16536 1 1473 . 1 1 136 136 MET CB C 13 37.50 0.30 . 1 . . . . 136 M CB . 16536 1 1474 . 1 1 136 136 MET CG C 13 31.70 0.30 . 1 . . . . 136 M CG . 16536 1 1475 . 1 1 136 136 MET N N 15 121.00 0.20 . 1 . . . . 136 M N . 16536 1 1476 . 1 1 137 137 ILE H H 1 9.37 0.03 . 1 . . . . 137 I H . 16536 1 1477 . 1 1 137 137 ILE HA H 1 4.60 0.03 . 1 . . . . 137 I HA . 16536 1 1478 . 1 1 137 137 ILE HB H 1 1.45 0.03 . 1 . . . . 137 I HB . 16536 1 1479 . 1 1 137 137 ILE HD11 H 1 0.56 0.03 . 1 . . . . 137 I QD1 . 16536 1 1480 . 1 1 137 137 ILE HD12 H 1 0.56 0.03 . 1 . . . . 137 I QD1 . 16536 1 1481 . 1 1 137 137 ILE HD13 H 1 0.56 0.03 . 1 . . . . 137 I QD1 . 16536 1 1482 . 1 1 137 137 ILE HG21 H 1 0.62 0.03 . 1 . . . . 137 I QG2 . 16536 1 1483 . 1 1 137 137 ILE HG22 H 1 0.62 0.03 . 1 . . . . 137 I QG2 . 16536 1 1484 . 1 1 137 137 ILE HG23 H 1 0.62 0.03 . 1 . . . . 137 I QG2 . 16536 1 1485 . 1 1 137 137 ILE C C 13 173.90 0.30 . 1 . . . . 137 I C . 16536 1 1486 . 1 1 137 137 ILE CA C 13 60.30 0.30 . 1 . . . . 137 I CA . 16536 1 1487 . 1 1 137 137 ILE CB C 13 40.60 0.30 . 1 . . . . 137 I CB . 16536 1 1488 . 1 1 137 137 ILE CD1 C 13 14.40 0.30 . 1 . . . . 137 I CD1 . 16536 1 1489 . 1 1 137 137 ILE CG2 C 13 18.10 0.30 . 1 . . . . 137 I CG2 . 16536 1 1490 . 1 1 137 137 ILE N N 15 126.30 0.20 . 1 . . . . 137 I N . 16536 1 1491 . 1 1 138 138 ALA H H 1 8.58 0.03 . 1 . . . . 138 A H . 16536 1 1492 . 1 1 138 138 ALA HA H 1 5.21 0.03 . 1 . . . . 138 A HA . 16536 1 1493 . 1 1 138 138 ALA HB1 H 1 0.82 0.03 . 1 . . . . 138 A QB . 16536 1 1494 . 1 1 138 138 ALA HB2 H 1 0.82 0.03 . 1 . . . . 138 A QB . 16536 1 1495 . 1 1 138 138 ALA HB3 H 1 0.82 0.03 . 1 . . . . 138 A QB . 16536 1 1496 . 1 1 138 138 ALA C C 13 176.60 0.30 . 1 . . . . 138 A C . 16536 1 1497 . 1 1 138 138 ALA CA C 13 50.30 0.30 . 1 . . . . 138 A CA . 16536 1 1498 . 1 1 138 138 ALA CB C 13 20.40 0.30 . 1 . . . . 138 A CB . 16536 1 1499 . 1 1 138 138 ALA N N 15 129.50 0.20 . 1 . . . . 138 A N . 16536 1 1500 . 1 1 139 139 ILE H H 1 9.27 0.03 . 1 . . . . 139 I H . 16536 1 1501 . 1 1 139 139 ILE HA H 1 4.58 0.03 . 1 . . . . 139 I HA . 16536 1 1502 . 1 1 139 139 ILE HB H 1 1.52 0.03 . 1 . . . . 139 I HB . 16536 1 1503 . 1 1 139 139 ILE HD11 H 1 0.59 0.03 . 1 . . . . 139 I QD1 . 16536 1 1504 . 1 1 139 139 ILE HD12 H 1 0.59 0.03 . 1 . . . . 139 I QD1 . 16536 1 1505 . 1 1 139 139 ILE HD13 H 1 0.59 0.03 . 1 . . . . 139 I QD1 . 16536 1 1506 . 1 1 139 139 ILE HG21 H 1 0.70 0.03 . 1 . . . . 139 I QG2 . 16536 1 1507 . 1 1 139 139 ILE HG22 H 1 0.70 0.03 . 1 . . . . 139 I QG2 . 16536 1 1508 . 1 1 139 139 ILE HG23 H 1 0.70 0.03 . 1 . . . . 139 I QG2 . 16536 1 1509 . 1 1 139 139 ILE C C 13 174.20 0.30 . 1 . . . . 139 I C . 16536 1 1510 . 1 1 139 139 ILE CA C 13 60.30 0.30 . 1 . . . . 139 I CA . 16536 1 1511 . 1 1 139 139 ILE CG2 C 13 18.20 0.30 . 1 . . . . 139 I CG2 . 16536 1 1512 . 1 1 139 139 ILE N N 15 124.30 0.20 . 1 . . . . 139 I N . 16536 1 1513 . 1 1 140 140 ALA H H 1 8.96 0.03 . 1 . . . . 140 A H . 16536 1 1514 . 1 1 140 140 ALA HA H 1 4.83 0.03 . 1 . . . . 140 A HA . 16536 1 1515 . 1 1 140 140 ALA HB1 H 1 1.47 0.03 . 1 . . . . 140 A QB . 16536 1 1516 . 1 1 140 140 ALA HB2 H 1 1.47 0.03 . 1 . . . . 140 A QB . 16536 1 1517 . 1 1 140 140 ALA HB3 H 1 1.47 0.03 . 1 . . . . 140 A QB . 16536 1 1518 . 1 1 140 140 ALA C C 13 175.30 0.30 . 1 . . . . 140 A C . 16536 1 1519 . 1 1 140 140 ALA CA C 13 51.40 0.30 . 1 . . . . 140 A CA . 16536 1 1520 . 1 1 140 140 ALA CB C 13 21.60 0.30 . 1 . . . . 140 A CB . 16536 1 1521 . 1 1 140 140 ALA N N 15 129.80 0.20 . 1 . . . . 140 A N . 16536 1 1522 . 1 1 141 141 ASP H H 1 8.23 0.03 . 1 . . . . 141 D H . 16536 1 1523 . 1 1 141 141 ASP HA H 1 4.32 0.03 . 1 . . . . 141 D HA . 16536 1 1524 . 1 1 141 141 ASP HB2 H 1 2.69 0.03 . 2 . . . . 141 D HB2 . 16536 1 1525 . 1 1 141 141 ASP HB3 H 1 2.50 0.03 . 2 . . . . 141 D HB3 . 16536 1 1526 . 1 1 141 141 ASP C C 13 180.50 0.30 . 1 . . . . 141 D C . 16536 1 1527 . 1 1 141 141 ASP CA C 13 55.50 0.30 . 1 . . . . 141 D CA . 16536 1 1528 . 1 1 141 141 ASP CB C 13 42.20 0.30 . 1 . . . . 141 D CB . 16536 1 1529 . 1 1 141 141 ASP N N 15 126.70 0.20 . 1 . . . . 141 D N . 16536 1 stop_ save_