data_15782 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15782 _Entry.Title ; 1H, 13C and 15N chemical shifts of the sylvatic Dengue 1 Envelope Protein Domain III, strain P72-1244 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-05-27 _Entry.Accession_date 2008-05-27 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.116 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 David Volk . E. . 15782 2 Kurtis Anderson . . . 15782 3 Sai Gandham . H.A. . 15782 4 Fiona May . J. . 15782 5 David Beasley . W.C. . 15782 6 Alan Barrett . D.T. . 15782 7 David Gorenstein . G. . 15782 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15782 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 442 15782 '15N chemical shifts' 102 15782 '1H chemical shifts' 746 15782 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 3 . . 2009-08-14 2008-05-27 update BMRB 'added PubMed ID' 15782 2 . . 2008-12-03 2008-05-27 update BMRB 'complete entry citation' 15782 1 . . 2008-09-12 2008-05-27 original author 'original release' 15782 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15782 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636893 _Citation.Full_citation . _Citation.Title 'NMR assignments of the sylvatic dengue 1 virus envelope protein domain III' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR Assignments' _Citation.Journal_volume 2 _Citation.Journal_issue 2 _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 155 _Citation.Page_last 157 _Citation.Year 2008 _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 David Volk . E. . 15782 1 2 Kurtis Anderson . M. . 15782 1 3 Sai Gandham . H.A. . 15782 1 4 Fiona May . J. . 15782 1 5 Li Li . . . 15782 1 6 David Beasley . W.C. . 15782 1 7 Alan Barrett . D.T. . 15782 1 8 David Gorenstein . G. . 15782 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'envelope protein domain III' 15782 1 'strain P72-1244' 15782 1 'sylvatic dengue 1 virus' 15782 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15782 _Assembly.ID 1 _Assembly.Name DEN1ED3 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds yes _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 subunit1 1 $DEN1ED3 A . yes native no no . . . 15782 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 14 14 SG . 1 . 1 CYS 45 45 SG . . 8 CYS HG . . 39 CYS HG 15782 1 stop_ loop_ _Entity_deleted_atom.ID _Entity_deleted_atom.Entity_atom_list_ID _Entity_deleted_atom.Entity_assembly_ID _Entity_deleted_atom.Entity_ID _Entity_deleted_atom.Comp_ID _Entity_deleted_atom.Comp_index_ID _Entity_deleted_atom.Seq_ID _Entity_deleted_atom.Atom_ID _Entity_deleted_atom.Auth_entity_assembly_ID _Entity_deleted_atom.Auth_seq_ID _Entity_deleted_atom.Auth_comp_ID _Entity_deleted_atom.Auth_atom_ID _Entity_deleted_atom.Entry_ID _Entity_deleted_atom.Assembly_ID . . 1 1 CYS 14 14 HG . 8 CYS HG 15782 1 . . 1 1 CYS 45 45 HG . 39 CYS HG 15782 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_DEN1ED3 _Entity.Sf_category entity _Entity.Sf_framecode DEN1ED3 _Entity.Entry_ID 15782 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name DEN1ED3 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MDKLTLKGMSYVMCTGSFKL EKEVAETQHGTVLVQVKYEG TDAPCKIPFSTQDEKGITQN GRLITANPIVTDKEKPVSIE AKPPFGESYIVVGAGEKALK LSWFKKGSSIGK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; Corresponds to M289-K400 of the sylvatic Dengue 1 strain P72-1244 ; _Entity.Polymer_author_seq_details 'M289-K400 of the sylvatic Dengue 1 ED3, with mutations N366S,E370K' _Entity.Ambiguous_conformational_states yes _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 112 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Domain III of the envelope protein' _Entity.Mutation 'N366S, E370K' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no DBJ BAJ72472 . "polyprotein, partial [Dengue virus 1]" . . . . . 100.00 930 97.32 100.00 1.02e-66 . . . . 15782 1 2 no EMBL CBL95104 . "polyprotein, partial [Dengue virus 1]" . . . . . 100.00 495 98.21 100.00 1.55e-69 . . . . 15782 1 3 no GB AAF59976 . "polyprotein precursor [Dengue virus 1]" . . . . . 100.00 3392 97.32 99.11 6.92e-65 . . . . 15782 1 4 no GB AAF59977 . "polyprotein precursor [Dengue virus 1]" . . . . . 100.00 3392 97.32 99.11 6.66e-65 . . . . 15782 1 5 no GB AAF61125 . "envelope protein, partial [Dengue virus 1]" . . . . . 100.00 494 98.21 100.00 1.62e-69 . . . . 15782 1 6 no GB AAN32773 . "envelope protein, partial [Dengue virus 1]" . . . . . 100.00 495 97.32 100.00 3.60e-69 . . . . 15782 1 7 no GB AAN32776 . "envelope protein, partial [Dengue virus 1]" . . . . . 100.00 495 98.21 100.00 1.44e-69 . . . . 15782 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'virus envelope protein' 15782 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 . MET . 15782 1 2 . ASP . 15782 1 3 . LYS . 15782 1 4 . LEU . 15782 1 5 . THR . 15782 1 6 . LEU . 15782 1 7 . LYS . 15782 1 8 . GLY . 15782 1 9 . MET . 15782 1 10 . SER . 15782 1 11 . TYR . 15782 1 12 . VAL . 15782 1 13 . MET . 15782 1 14 . CYS . 15782 1 15 . THR . 15782 1 16 . GLY . 15782 1 17 . SER . 15782 1 18 . PHE . 15782 1 19 . LYS . 15782 1 20 . LEU . 15782 1 21 . GLU . 15782 1 22 . LYS . 15782 1 23 . GLU . 15782 1 24 . VAL . 15782 1 25 . ALA . 15782 1 26 . GLU . 15782 1 27 . THR . 15782 1 28 . GLN . 15782 1 29 . HIS . 15782 1 30 . GLY . 15782 1 31 . THR . 15782 1 32 . VAL . 15782 1 33 . LEU . 15782 1 34 . VAL . 15782 1 35 . GLN . 15782 1 36 . VAL . 15782 1 37 . LYS . 15782 1 38 . TYR . 15782 1 39 . GLU . 15782 1 40 . GLY . 15782 1 41 . THR . 15782 1 42 . ASP . 15782 1 43 . ALA . 15782 1 44 . PRO . 15782 1 45 . CYS . 15782 1 46 . LYS . 15782 1 47 . ILE . 15782 1 48 . PRO . 15782 1 49 . PHE . 15782 1 50 . SER . 15782 1 51 . THR . 15782 1 52 . GLN . 15782 1 53 . ASP . 15782 1 54 . GLU . 15782 1 55 . LYS . 15782 1 56 . GLY . 15782 1 57 . ILE . 15782 1 58 . THR . 15782 1 59 . GLN . 15782 1 60 . ASN . 15782 1 61 . GLY . 15782 1 62 . ARG . 15782 1 63 . LEU . 15782 1 64 . ILE . 15782 1 65 . THR . 15782 1 66 . ALA . 15782 1 67 . ASN . 15782 1 68 . PRO . 15782 1 69 . ILE . 15782 1 70 . VAL . 15782 1 71 . THR . 15782 1 72 . ASP . 15782 1 73 . LYS . 15782 1 74 . GLU . 15782 1 75 . LYS . 15782 1 76 . PRO . 15782 1 77 . VAL . 15782 1 78 . SER . 15782 1 79 . ILE . 15782 1 80 . GLU . 15782 1 81 . ALA . 15782 1 82 . LYS . 15782 1 83 . PRO . 15782 1 84 . PRO . 15782 1 85 . PHE . 15782 1 86 . GLY . 15782 1 87 . GLU . 15782 1 88 . SER . 15782 1 89 . TYR . 15782 1 90 . ILE . 15782 1 91 . VAL . 15782 1 92 . VAL . 15782 1 93 . GLY . 15782 1 94 . ALA . 15782 1 95 . GLY . 15782 1 96 . GLU . 15782 1 97 . LYS . 15782 1 98 . ALA . 15782 1 99 . LEU . 15782 1 100 . LYS . 15782 1 101 . LEU . 15782 1 102 . SER . 15782 1 103 . TRP . 15782 1 104 . PHE . 15782 1 105 . LYS . 15782 1 106 . LYS . 15782 1 107 . GLY . 15782 1 108 . SER . 15782 1 109 . SER . 15782 1 110 . ILE . 15782 1 111 . GLY . 15782 1 112 . LYS . 15782 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 . MET 1 1 15782 1 . ASP 2 2 15782 1 . LYS 3 3 15782 1 . LEU 4 4 15782 1 . THR 5 5 15782 1 . LEU 6 6 15782 1 . LYS 7 7 15782 1 . GLY 8 8 15782 1 . MET 9 9 15782 1 . SER 10 10 15782 1 . TYR 11 11 15782 1 . VAL 12 12 15782 1 . MET 13 13 15782 1 . CYS 14 14 15782 1 . THR 15 15 15782 1 . GLY 16 16 15782 1 . SER 17 17 15782 1 . PHE 18 18 15782 1 . LYS 19 19 15782 1 . LEU 20 20 15782 1 . GLU 21 21 15782 1 . LYS 22 22 15782 1 . GLU 23 23 15782 1 . VAL 24 24 15782 1 . ALA 25 25 15782 1 . GLU 26 26 15782 1 . THR 27 27 15782 1 . GLN 28 28 15782 1 . HIS 29 29 15782 1 . GLY 30 30 15782 1 . THR 31 31 15782 1 . VAL 32 32 15782 1 . LEU 33 33 15782 1 . VAL 34 34 15782 1 . GLN 35 35 15782 1 . VAL 36 36 15782 1 . LYS 37 37 15782 1 . TYR 38 38 15782 1 . GLU 39 39 15782 1 . GLY 40 40 15782 1 . THR 41 41 15782 1 . ASP 42 42 15782 1 . ALA 43 43 15782 1 . PRO 44 44 15782 1 . CYS 45 45 15782 1 . LYS 46 46 15782 1 . ILE 47 47 15782 1 . PRO 48 48 15782 1 . PHE 49 49 15782 1 . SER 50 50 15782 1 . THR 51 51 15782 1 . GLN 52 52 15782 1 . ASP 53 53 15782 1 . GLU 54 54 15782 1 . LYS 55 55 15782 1 . GLY 56 56 15782 1 . ILE 57 57 15782 1 . THR 58 58 15782 1 . GLN 59 59 15782 1 . ASN 60 60 15782 1 . GLY 61 61 15782 1 . ARG 62 62 15782 1 . LEU 63 63 15782 1 . ILE 64 64 15782 1 . THR 65 65 15782 1 . ALA 66 66 15782 1 . ASN 67 67 15782 1 . PRO 68 68 15782 1 . ILE 69 69 15782 1 . VAL 70 70 15782 1 . THR 71 71 15782 1 . ASP 72 72 15782 1 . LYS 73 73 15782 1 . GLU 74 74 15782 1 . LYS 75 75 15782 1 . PRO 76 76 15782 1 . VAL 77 77 15782 1 . SER 78 78 15782 1 . ILE 79 79 15782 1 . GLU 80 80 15782 1 . ALA 81 81 15782 1 . LYS 82 82 15782 1 . PRO 83 83 15782 1 . PRO 84 84 15782 1 . PHE 85 85 15782 1 . GLY 86 86 15782 1 . GLU 87 87 15782 1 . SER 88 88 15782 1 . TYR 89 89 15782 1 . ILE 90 90 15782 1 . VAL 91 91 15782 1 . VAL 92 92 15782 1 . GLY 93 93 15782 1 . ALA 94 94 15782 1 . GLY 95 95 15782 1 . GLU 96 96 15782 1 . LYS 97 97 15782 1 . ALA 98 98 15782 1 . LEU 99 99 15782 1 . LYS 100 100 15782 1 . LEU 101 101 15782 1 . SER 102 102 15782 1 . TRP 103 103 15782 1 . PHE 104 104 15782 1 . LYS 105 105 15782 1 . LYS 106 106 15782 1 . GLY 107 107 15782 1 . SER 108 108 15782 1 . SER 109 109 15782 1 . ILE 110 110 15782 1 . GLY 111 111 15782 1 . LYS 112 112 15782 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 15782 _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 $DEN1ED3 . 12637 virus . 'Flavivirus, Dengue 1 syvlatic' 'Dengue virus' . . Viruses . Flavivirus 'Dengue virus' P72-1244 . . . . . . . . . . . . . . . . . . . . 15782 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 15782 _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 $DEN1ED3 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET-15 . . . . . . 15782 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15782 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DEN1ED3 '[U-99% 13C; U-99% 15N]' . . 1 $DEN1ED3 . . 0.25 . . mM 0.05 . . . 15782 1 2 'sodium chloride' 'natural abundance' . . . . . . 25 . . mM 1 . . . 15782 1 3 TRIS [U-2H] . . . . . . 25 . . mM 1 . . . 15782 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 15782 _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' 0.05 . M 15782 1 pH 6.5 . pH 15782 1 pressure 1 . atm 15782 1 temperature 298 . K 15782 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 15782 _Software.ID 1 _Software.Name FELIX _Software.Version 2000 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 15782 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15782 1 processing 15782 1 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 15782 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15782 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 15782 _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 Varian INOVA . 800 . . . 15782 1 2 spectrometer_2 Varian INOVA . 600 . . . 15782 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 15782 _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 . . . . . . . . . . . . . . . . 15782 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15782 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15782 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15782 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15782 1 6 '3D HNCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15782 1 7 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15782 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15782 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15782 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 15782 _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 . indirect 0.251449530 . . . . . . . . . 15782 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15782 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15782 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 15782 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15782 1 2 '2D 1H-13C HSQC' . . . 15782 1 3 '3D CBCA(CO)NH' . . . 15782 1 4 '3D HNCACB' . . . 15782 1 5 '3D HNCO' . . . 15782 1 6 '3D HNCACO' . . . 15782 1 7 '3D C(CO)NH' . . . 15782 1 8 '3D H(CCO)NH' . . . 15782 1 9 '3D HCCH-TOCSY' . . . 15782 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 MET HA H 1 3.87 0.01 . 1 . . . . 1 MET HA . 15782 1 2 . 1 1 1 1 MET HB2 H 1 2.20 0.01 . 2 . . . . 1 MET HB2 . 15782 1 3 . 1 1 1 1 MET HB3 H 1 2.12 0.01 . 2 . . . . 1 MET HB3 . 15782 1 4 . 1 1 1 1 MET HG2 H 1 2.65 0.01 . 1 . . . . 1 MET HG2 . 15782 1 5 . 1 1 1 1 MET HG3 H 1 2.65 0.01 . 1 . . . . 1 MET HG3 . 15782 1 6 . 1 1 1 1 MET CA C 13 56.8 0.2 . 1 . . . . 1 MET CA . 15782 1 7 . 1 1 1 1 MET CB C 13 32.4 0.2 . 1 . . . . 1 MET CB . 15782 1 8 . 1 1 1 1 MET CG C 13 31.5 0.2 . 1 . . . . 1 MET CG . 15782 1 9 . 1 1 2 2 ASP HA H 1 4.57 0.01 . 1 . . . . 2 ASP HA . 15782 1 10 . 1 1 2 2 ASP HB2 H 1 2.69 0.01 . 1 . . . . 2 ASP HB2 . 15782 1 11 . 1 1 2 2 ASP HB3 H 1 2.69 0.01 . 1 . . . . 2 ASP HB3 . 15782 1 12 . 1 1 2 2 ASP C C 13 174.8 0.2 . 1 . . . . 2 ASP C . 15782 1 13 . 1 1 2 2 ASP CA C 13 54.3 0.2 . 1 . . . . 2 ASP CA . 15782 1 14 . 1 1 2 2 ASP CB C 13 41.7 0.2 . 1 . . . . 2 ASP CB . 15782 1 15 . 1 1 3 3 LYS H H 1 8.47 0.01 . 1 . . . . 3 LYS H . 15782 1 16 . 1 1 3 3 LYS HA H 1 4.27 0.01 . 1 . . . . 3 LYS HA . 15782 1 17 . 1 1 3 3 LYS HB2 H 1 1.86 0.01 . 2 . . . . 3 LYS HB2 . 15782 1 18 . 1 1 3 3 LYS HB3 H 1 1.74 0.01 . 2 . . . . 3 LYS HB3 . 15782 1 19 . 1 1 3 3 LYS HG2 H 1 1.43 0.01 . 1 . . . . 3 LYS HG2 . 15782 1 20 . 1 1 3 3 LYS HG3 H 1 1.43 0.01 . 1 . . . . 3 LYS HG3 . 15782 1 21 . 1 1 3 3 LYS C C 13 174.1 0.2 . 1 . . . . 3 LYS C . 15782 1 22 . 1 1 3 3 LYS CA C 13 56.9 0.2 . 1 . . . . 3 LYS CA . 15782 1 23 . 1 1 3 3 LYS CB C 13 33.0 0.2 . 1 . . . . 3 LYS CB . 15782 1 24 . 1 1 3 3 LYS CD C 13 29.3 0.2 . 1 . . . . 3 LYS CD . 15782 1 25 . 1 1 3 3 LYS CE C 13 42.4 0.2 . 1 . . . . 3 LYS CE . 15782 1 26 . 1 1 3 3 LYS CG C 13 25.1 0.2 . 1 . . . . 3 LYS CG . 15782 1 27 . 1 1 3 3 LYS N N 15 122.5 0.2 . 1 . . . . 3 LYS N . 15782 1 28 . 1 1 4 4 LEU H H 1 8.33 0.01 . 1 . . . . 4 LEU H . 15782 1 29 . 1 1 4 4 LEU HA H 1 4.39 0.01 . 1 . . . . 4 LEU HA . 15782 1 30 . 1 1 4 4 LEU HB2 H 1 1.62 0.01 . 1 . . . . 4 LEU HB2 . 15782 1 31 . 1 1 4 4 LEU HB3 H 1 1.62 0.01 . 1 . . . . 4 LEU HB3 . 15782 1 32 . 1 1 4 4 LEU HD11 H 1 0.92 0.01 . 2 . . . . 4 LEU MD1 . 15782 1 33 . 1 1 4 4 LEU HD12 H 1 0.92 0.01 . 2 . . . . 4 LEU MD1 . 15782 1 34 . 1 1 4 4 LEU HD13 H 1 0.92 0.01 . 2 . . . . 4 LEU MD1 . 15782 1 35 . 1 1 4 4 LEU HD21 H 1 0.88 0.01 . 2 . . . . 4 LEU MD2 . 15782 1 36 . 1 1 4 4 LEU HD22 H 1 0.88 0.01 . 2 . . . . 4 LEU MD2 . 15782 1 37 . 1 1 4 4 LEU HD23 H 1 0.88 0.01 . 2 . . . . 4 LEU MD2 . 15782 1 38 . 1 1 4 4 LEU HG H 1 1.48 0.01 . 1 . . . . 4 LEU HG . 15782 1 39 . 1 1 4 4 LEU C C 13 173.0 0.2 . 1 . . . . 4 LEU C . 15782 1 40 . 1 1 4 4 LEU CA C 13 55.7 0.2 . 1 . . . . 4 LEU CA . 15782 1 41 . 1 1 4 4 LEU CB C 13 42.3 0.2 . 1 . . . . 4 LEU CB . 15782 1 42 . 1 1 4 4 LEU CD1 C 13 25.1 0.2 . 2 . . . . 4 LEU CD1 . 15782 1 43 . 1 1 4 4 LEU CD2 C 13 23.8 0.2 . 2 . . . . 4 LEU CD2 . 15782 1 44 . 1 1 4 4 LEU CG C 13 27.5 0.2 . 1 . . . . 4 LEU CG . 15782 1 45 . 1 1 4 4 LEU N N 15 123.3 0.1 . 1 . . . . 4 LEU N . 15782 1 46 . 1 1 5 5 THR H H 1 8.10 0.01 . 1 . . . . 5 THR H . 15782 1 47 . 1 1 5 5 THR HA H 1 4.31 0.01 . 1 . . . . 5 THR HA . 15782 1 48 . 1 1 5 5 THR HB H 1 4.20 0.01 . 1 . . . . 5 THR HB . 15782 1 49 . 1 1 5 5 THR HG21 H 1 1.19 0.01 . 1 . . . . 5 THR MG . 15782 1 50 . 1 1 5 5 THR HG22 H 1 1.19 0.01 . 1 . . . . 5 THR MG . 15782 1 51 . 1 1 5 5 THR HG23 H 1 1.19 0.01 . 1 . . . . 5 THR MG . 15782 1 52 . 1 1 5 5 THR C C 13 176.1 0.2 . 1 . . . . 5 THR C . 15782 1 53 . 1 1 5 5 THR CA C 13 62.3 0.2 . 1 . . . . 5 THR CA . 15782 1 54 . 1 1 5 5 THR CB C 13 69.6 0.2 . 1 . . . . 5 THR CB . 15782 1 55 . 1 1 5 5 THR CG2 C 13 21.9 0.2 . 1 . . . . 5 THR CG2 . 15782 1 56 . 1 1 5 5 THR N N 15 116.2 0.1 . 1 . . . . 5 THR N . 15782 1 57 . 1 1 6 6 LEU H H 1 8.14 0.01 . 1 . . . . 6 LEU H . 15782 1 58 . 1 1 6 6 LEU HA H 1 4.34 0.01 . 1 . . . . 6 LEU HA . 15782 1 59 . 1 1 6 6 LEU HB2 H 1 1.65 0.01 . 1 . . . . 6 LEU HB2 . 15782 1 60 . 1 1 6 6 LEU HB3 H 1 1.65 0.01 . 1 . . . . 6 LEU HB3 . 15782 1 61 . 1 1 6 6 LEU HD11 H 1 0.93 0.01 . 2 . . . . 6 LEU MD1 . 15782 1 62 . 1 1 6 6 LEU HD12 H 1 0.93 0.01 . 2 . . . . 6 LEU MD1 . 15782 1 63 . 1 1 6 6 LEU HD13 H 1 0.93 0.01 . 2 . . . . 6 LEU MD1 . 15782 1 64 . 1 1 6 6 LEU HD21 H 1 0.88 0.01 . 2 . . . . 6 LEU MD2 . 15782 1 65 . 1 1 6 6 LEU HD22 H 1 0.88 0.01 . 2 . . . . 6 LEU MD2 . 15782 1 66 . 1 1 6 6 LEU HD23 H 1 0.88 0.01 . 2 . . . . 6 LEU MD2 . 15782 1 67 . 1 1 6 6 LEU HG H 1 1.50 0.01 . 1 . . . . 6 LEU HG . 15782 1 68 . 1 1 6 6 LEU C C 13 173.3 0.2 . 1 . . . . 6 LEU C . 15782 1 69 . 1 1 6 6 LEU CA C 13 55.5 0.2 . 1 . . . . 6 LEU CA . 15782 1 70 . 1 1 6 6 LEU CB C 13 42.4 0.2 . 1 . . . . 6 LEU CB . 15782 1 71 . 1 1 6 6 LEU CD1 C 13 25.2 0.2 . 2 . . . . 6 LEU CD1 . 15782 1 72 . 1 1 6 6 LEU CD2 C 13 23.6 0.2 . 2 . . . . 6 LEU CD2 . 15782 1 73 . 1 1 6 6 LEU CG C 13 27.4 0.2 . 1 . . . . 6 LEU CG . 15782 1 74 . 1 1 6 6 LEU N N 15 125.0 0.1 . 1 . . . . 6 LEU N . 15782 1 75 . 1 1 7 7 LYS H H 1 8.23 0.01 . 1 . . . . 7 LYS H . 15782 1 76 . 1 1 7 7 LYS HA H 1 4.24 0.01 . 1 . . . . 7 LYS HA . 15782 1 77 . 1 1 7 7 LYS HB2 H 1 1.83 0.01 . 2 . . . . 7 LYS HB2 . 15782 1 78 . 1 1 7 7 LYS HB3 H 1 1.78 0.01 . 2 . . . . 7 LYS HB3 . 15782 1 79 . 1 1 7 7 LYS HD2 H 1 1.71 0.01 . 1 . . . . 7 LYS HD2 . 15782 1 80 . 1 1 7 7 LYS HD3 H 1 1.71 0.01 . 1 . . . . 7 LYS HD3 . 15782 1 81 . 1 1 7 7 LYS HG2 H 1 1.44 0.01 . 1 . . . . 7 LYS HG2 . 15782 1 82 . 1 1 7 7 LYS HG3 H 1 1.44 0.01 . 1 . . . . 7 LYS HG3 . 15782 1 83 . 1 1 7 7 LYS C C 13 173.6 0.2 . 1 . . . . 7 LYS C . 15782 1 84 . 1 1 7 7 LYS CA C 13 56.8 0.2 . 1 . . . . 7 LYS CA . 15782 1 85 . 1 1 7 7 LYS CB C 13 33.0 0.2 . 1 . . . . 7 LYS CB . 15782 1 86 . 1 1 7 7 LYS CD C 13 29.2 0.2 . 1 . . . . 7 LYS CD . 15782 1 87 . 1 1 7 7 LYS CG C 13 24.9 0.2 . 1 . . . . 7 LYS CG . 15782 1 88 . 1 1 7 7 LYS N N 15 122.6 0.1 . 1 . . . . 7 LYS N . 15782 1 89 . 1 1 8 8 GLY H H 1 8.29 0.01 . 1 . . . . 8 GLY H . 15782 1 90 . 1 1 8 8 GLY HA2 H 1 3.87 0.02 . 2 . . . . 8 GLY HA2 . 15782 1 91 . 1 1 8 8 GLY HA3 H 1 3.84 0.02 . 2 . . . . 8 GLY HA3 . 15782 1 92 . 1 1 8 8 GLY C C 13 176.7 0.2 . 1 . . . . 8 GLY C . 15782 1 93 . 1 1 8 8 GLY CA C 13 45.5 0.2 . 1 . . . . 8 GLY CA . 15782 1 94 . 1 1 8 8 GLY N N 15 110.2 0.1 . 1 . . . . 8 GLY N . 15782 1 95 . 1 1 9 9 MET H H 1 7.96 0.01 . 1 . . . . 9 MET H . 15782 1 96 . 1 1 9 9 MET HA H 1 4.41 0.01 . 1 . . . . 9 MET HA . 15782 1 97 . 1 1 9 9 MET HB2 H 1 1.90 0.01 . 1 . . . . 9 MET HB2 . 15782 1 98 . 1 1 9 9 MET HB3 H 1 1.90 0.01 . 1 . . . . 9 MET HB3 . 15782 1 99 . 1 1 9 9 MET HG2 H 1 2.45 0.01 . 1 . . . . 9 MET HG2 . 15782 1 100 . 1 1 9 9 MET HG3 H 1 2.45 0.01 . 1 . . . . 9 MET HG3 . 15782 1 101 . 1 1 9 9 MET C C 13 174.9 0.2 . 1 . . . . 9 MET C . 15782 1 102 . 1 1 9 9 MET CA C 13 55.5 0.2 . 1 . . . . 9 MET CA . 15782 1 103 . 1 1 9 9 MET CB C 13 33.1 0.2 . 1 . . . . 9 MET CB . 15782 1 104 . 1 1 9 9 MET CG C 13 32.2 0.2 . 1 . . . . 9 MET CG . 15782 1 105 . 1 1 9 9 MET N N 15 120.0 0.01 . 1 . . . . 9 MET N . 15782 1 106 . 1 1 10 10 SER H H 1 8.07 0.01 . 1 . . . . 10 SER H . 15782 1 107 . 1 1 10 10 SER HA H 1 4.46 0.01 . 1 . . . . 10 SER HA . 15782 1 108 . 1 1 10 10 SER HB2 H 1 3.74 0.01 . 2 . . . . 10 SER HB2 . 15782 1 109 . 1 1 10 10 SER HB3 H 1 3.71 0.01 . 2 . . . . 10 SER HB3 . 15782 1 110 . 1 1 10 10 SER C C 13 177.1 0.2 . 1 . . . . 10 SER C . 15782 1 111 . 1 1 10 10 SER CA C 13 57.6 0.2 . 1 . . . . 10 SER CA . 15782 1 112 . 1 1 10 10 SER CB C 13 63.7 0.2 . 1 . . . . 10 SER CB . 15782 1 113 . 1 1 10 10 SER N N 15 117.3 0.1 . 1 . . . . 10 SER N . 15782 1 114 . 1 1 11 11 TYR H H 1 7.84 0.01 . 1 . . . . 11 TYR H . 15782 1 115 . 1 1 11 11 TYR HA H 1 4.80 0.01 . 1 . . . . 11 TYR HA . 15782 1 116 . 1 1 11 11 TYR HB2 H 1 3.09 0.01 . 2 . . . . 11 TYR HB2 . 15782 1 117 . 1 1 11 11 TYR HB3 H 1 2.64 0.01 . 2 . . . . 11 TYR HB3 . 15782 1 118 . 1 1 11 11 TYR HD1 H 1 7.02 0.01 . 1 . . . . 11 TYR HD1 . 15782 1 119 . 1 1 11 11 TYR HD2 H 1 7.02 0.01 . 1 . . . . 11 TYR HD2 . 15782 1 120 . 1 1 11 11 TYR HE1 H 1 6.78 0.01 . 1 . . . . 11 TYR HE1 . 15782 1 121 . 1 1 11 11 TYR HE2 H 1 6.78 0.01 . 1 . . . . 11 TYR HE2 . 15782 1 122 . 1 1 11 11 TYR C C 13 174.7 0.2 . 1 . . . . 11 TYR C . 15782 1 123 . 1 1 11 11 TYR CA C 13 56.9 0.2 . 1 . . . . 11 TYR CA . 15782 1 124 . 1 1 11 11 TYR CB C 13 40.7 0.2 . 1 . . . . 11 TYR CB . 15782 1 125 . 1 1 11 11 TYR N N 15 121.9 0.1 . 1 . . . . 11 TYR N . 15782 1 126 . 1 1 12 12 VAL H H 1 8.60 0.01 . 1 . . . . 12 VAL H . 15782 1 127 . 1 1 12 12 VAL HA H 1 4.44 0.01 . 1 . . . . 12 VAL HA . 15782 1 128 . 1 1 12 12 VAL HB H 1 2.37 0.01 . 1 . . . . 12 VAL HB . 15782 1 129 . 1 1 12 12 VAL HG11 H 1 1.09 0.01 . 2 . . . . 12 VAL MG1 . 15782 1 130 . 1 1 12 12 VAL HG12 H 1 1.09 0.01 . 2 . . . . 12 VAL MG1 . 15782 1 131 . 1 1 12 12 VAL HG13 H 1 1.09 0.01 . 2 . . . . 12 VAL MG1 . 15782 1 132 . 1 1 12 12 VAL HG21 H 1 1.00 0.01 . 2 . . . . 12 VAL MG2 . 15782 1 133 . 1 1 12 12 VAL HG22 H 1 1.00 0.01 . 2 . . . . 12 VAL MG2 . 15782 1 134 . 1 1 12 12 VAL HG23 H 1 1.00 0.01 . 2 . . . . 12 VAL MG2 . 15782 1 135 . 1 1 12 12 VAL C C 13 174.7 0.2 . 1 . . . . 12 VAL C . 15782 1 136 . 1 1 12 12 VAL CA C 13 60.5 0.2 . 1 . . . . 12 VAL CA . 15782 1 137 . 1 1 12 12 VAL CB C 13 33.2 0.2 . 1 . . . . 12 VAL CB . 15782 1 138 . 1 1 12 12 VAL CG1 C 13 21.6 0.2 . 2 . . . . 12 VAL CG1 . 15782 1 139 . 1 1 12 12 VAL CG2 C 13 19.2 0.2 . 2 . . . . 12 VAL CG2 . 15782 1 140 . 1 1 12 12 VAL N N 15 117.9 0.2 . 1 . . . . 12 VAL N . 15782 1 141 . 1 1 13 13 MET H H 1 8.35 0.01 . 1 . . . . 13 MET H . 15782 1 142 . 1 1 13 13 MET HA H 1 4.89 0.01 . 1 . . . . 13 MET HA . 15782 1 143 . 1 1 13 13 MET HB2 H 1 2.11 0.01 . 2 . . . . 13 MET HB2 . 15782 1 144 . 1 1 13 13 MET HB3 H 1 1.95 0.01 . 2 . . . . 13 MET HB3 . 15782 1 145 . 1 1 13 13 MET HG2 H 1 2.81 0.01 . 2 . . . . 13 MET HG2 . 15782 1 146 . 1 1 13 13 MET HG3 H 1 2.71 0.01 . 2 . . . . 13 MET HG3 . 15782 1 147 . 1 1 13 13 MET C C 13 173.1 0.1 . 1 . . . . 13 MET C . 15782 1 148 . 1 1 13 13 MET CA C 13 54.8 0.01 . 1 . . . . 13 MET CA . 15782 1 149 . 1 1 13 13 MET CB C 13 31.8 0.01 . 1 . . . . 13 MET CB . 15782 1 150 . 1 1 13 13 MET CG C 13 32.1 0.01 . 1 . . . . 13 MET CG . 15782 1 151 . 1 1 13 13 MET N N 15 120.8 0.1 . 1 . . . . 13 MET N . 15782 1 152 . 1 1 14 14 CYS H H 1 9.62 0.01 . 1 . . . . 14 CYS H . 15782 1 153 . 1 1 14 14 CYS HA H 1 4.71 0.01 . 1 . . . . 14 CYS HA . 15782 1 154 . 1 1 14 14 CYS HB2 H 1 3.72 0.01 . 2 . . . . 14 CYS HB2 . 15782 1 155 . 1 1 14 14 CYS HB3 H 1 2.43 0.01 . 2 . . . . 14 CYS HB3 . 15782 1 156 . 1 1 14 14 CYS C C 13 172.9 0.2 . 1 . . . . 14 CYS C . 15782 1 157 . 1 1 14 14 CYS CA C 13 55.2 0.2 . 1 . . . . 14 CYS CA . 15782 1 158 . 1 1 14 14 CYS CB C 13 39.3 0.2 . 1 . . . . 14 CYS CB . 15782 1 159 . 1 1 14 14 CYS N N 15 123.4 0.1 . 1 . . . . 14 CYS N . 15782 1 160 . 1 1 15 15 THR H H 1 9.41 0.01 . 1 . . . . 15 THR H . 15782 1 161 . 1 1 15 15 THR HA H 1 4.56 0.01 . 1 . . . . 15 THR HA . 15782 1 162 . 1 1 15 15 THR HB H 1 4.45 0.01 . 1 . . . . 15 THR HB . 15782 1 163 . 1 1 15 15 THR HG21 H 1 1.40 0.01 . 1 . . . . 15 THR MG . 15782 1 164 . 1 1 15 15 THR HG22 H 1 1.40 0.01 . 1 . . . . 15 THR MG . 15782 1 165 . 1 1 15 15 THR HG23 H 1 1.40 0.01 . 1 . . . . 15 THR MG . 15782 1 166 . 1 1 15 15 THR C C 13 174.2 0.2 . 1 . . . . 15 THR C . 15782 1 167 . 1 1 15 15 THR CA C 13 62.7 0.2 . 1 . . . . 15 THR CA . 15782 1 168 . 1 1 15 15 THR CB C 13 71.0 0.2 . 1 . . . . 15 THR CB . 15782 1 169 . 1 1 15 15 THR CG2 C 13 22.1 0.2 . 1 . . . . 15 THR CG2 . 15782 1 170 . 1 1 15 15 THR N N 15 117.6 0.1 . 1 . . . . 15 THR N . 15782 1 171 . 1 1 16 16 GLY H H 1 9.52 0.01 . 1 . . . . 16 GLY H . 15782 1 172 . 1 1 16 16 GLY HA2 H 1 4.44 0.01 . 2 . . . . 16 GLY HA2 . 15782 1 173 . 1 1 16 16 GLY HA3 H 1 3.48 0.01 . 2 . . . . 16 GLY HA3 . 15782 1 174 . 1 1 16 16 GLY C C 13 178.0 0.2 . 1 . . . . 16 GLY C . 15782 1 175 . 1 1 16 16 GLY CA C 13 44.4 0.2 . 1 . . . . 16 GLY CA . 15782 1 176 . 1 1 16 16 GLY N N 15 114.1 0.1 . 1 . . . . 16 GLY N . 15782 1 177 . 1 1 17 17 SER H H 1 8.02 0.01 . 1 . . . . 17 SER H . 15782 1 178 . 1 1 17 17 SER HA H 1 4.83 0.01 . 1 . . . . 17 SER HA . 15782 1 179 . 1 1 17 17 SER HB2 H 1 3.99 0.01 . 2 . . . . 17 SER HB2 . 15782 1 180 . 1 1 17 17 SER HB3 H 1 3.75 0.01 . 2 . . . . 17 SER HB3 . 15782 1 181 . 1 1 17 17 SER C C 13 179.0 0.2 . 1 . . . . 17 SER C . 15782 1 182 . 1 1 17 17 SER CA C 13 57.4 0.2 . 1 . . . . 17 SER CA . 15782 1 183 . 1 1 17 17 SER CB C 13 65.9 0.2 . 1 . . . . 17 SER CB . 15782 1 184 . 1 1 17 17 SER N N 15 114.0 0.1 . 1 . . . . 17 SER N . 15782 1 185 . 1 1 18 18 PHE H H 1 9.09 0.01 . 1 . . . . 18 PHE H . 15782 1 186 . 1 1 18 18 PHE HA H 1 5.30 0.01 . 1 . . . . 18 PHE HA . 15782 1 187 . 1 1 18 18 PHE HB2 H 1 2.83 0.01 . 2 . . . . 18 PHE HB2 . 15782 1 188 . 1 1 18 18 PHE HB3 H 1 2.73 0.01 . 2 . . . . 18 PHE HB3 . 15782 1 189 . 1 1 18 18 PHE HD1 H 1 7.22 0.01 . 1 . . . . 18 PHE HD1 . 15782 1 190 . 1 1 18 18 PHE HD2 H 1 7.22 0.01 . 1 . . . . 18 PHE HD2 . 15782 1 191 . 1 1 18 18 PHE HE1 H 1 7.14 0.01 . 1 . . . . 18 PHE HE1 . 15782 1 192 . 1 1 18 18 PHE HE2 H 1 7.14 0.01 . 1 . . . . 18 PHE HE2 . 15782 1 193 . 1 1 18 18 PHE HZ H 1 6.78 0.01 . 1 . . . . 18 PHE HZ . 15782 1 194 . 1 1 18 18 PHE C C 13 176.5 0.2 . 1 . . . . 18 PHE C . 15782 1 195 . 1 1 18 18 PHE CA C 13 56.9 0.2 . 1 . . . . 18 PHE CA . 15782 1 196 . 1 1 18 18 PHE CB C 13 43.3 0.2 . 1 . . . . 18 PHE CB . 15782 1 197 . 1 1 18 18 PHE N N 15 118.3 0.1 . 1 . . . . 18 PHE N . 15782 1 198 . 1 1 19 19 LYS H H 1 9.05 0.01 . 1 . . . . 19 LYS H . 15782 1 199 . 1 1 19 19 LYS HA H 1 4.80 0.01 . 1 . . . . 19 LYS HA . 15782 1 200 . 1 1 19 19 LYS HB2 H 1 1.77 0.01 . 1 . . . . 19 LYS HB2 . 15782 1 201 . 1 1 19 19 LYS HB3 H 1 1.77 0.01 . 1 . . . . 19 LYS HB3 . 15782 1 202 . 1 1 19 19 LYS HD2 H 1 1.68 0.01 . 1 . . . . 19 LYS HD2 . 15782 1 203 . 1 1 19 19 LYS HG2 H 1 1.38 0.01 . 1 . . . . 19 LYS HG2 . 15782 1 204 . 1 1 19 19 LYS HG3 H 1 1.38 0.01 . 1 . . . . 19 LYS HG3 . 15782 1 205 . 1 1 19 19 LYS C C 13 175.0 0.2 . 1 . . . . 19 LYS C . 15782 1 206 . 1 1 19 19 LYS CA C 13 54.1 0.2 . 1 . . . . 19 LYS CA . 15782 1 207 . 1 1 19 19 LYS CB C 13 36.2 0.2 . 1 . . . . 19 LYS CB . 15782 1 208 . 1 1 19 19 LYS CD C 13 29.5 0.2 . 1 . . . . 19 LYS CD . 15782 1 209 . 1 1 19 19 LYS CE C 13 42.2 0.2 . 1 . . . . 19 LYS CE . 15782 1 210 . 1 1 19 19 LYS CG C 13 24.6 0.2 . 1 . . . . 19 LYS CG . 15782 1 211 . 1 1 19 19 LYS N N 15 119.3 0.2 . 1 . . . . 19 LYS N . 15782 1 212 . 1 1 20 20 LEU H H 1 8.95 0.01 . 1 . . . . 20 LEU H . 15782 1 213 . 1 1 20 20 LEU HA H 1 4.53 0.01 . 1 . . . . 20 LEU HA . 15782 1 214 . 1 1 20 20 LEU HB2 H 1 1.89 0.01 . 2 . . . . 20 LEU HB2 . 15782 1 215 . 1 1 20 20 LEU HB3 H 1 1.51 0.01 . 2 . . . . 20 LEU HB3 . 15782 1 216 . 1 1 20 20 LEU HD11 H 1 1.09 0.01 . 2 . . . . 20 LEU MD1 . 15782 1 217 . 1 1 20 20 LEU HD12 H 1 1.09 0.01 . 2 . . . . 20 LEU MD1 . 15782 1 218 . 1 1 20 20 LEU HD13 H 1 1.09 0.01 . 2 . . . . 20 LEU MD1 . 15782 1 219 . 1 1 20 20 LEU HD21 H 1 0.98 0.01 . 2 . . . . 20 LEU MD2 . 15782 1 220 . 1 1 20 20 LEU HD22 H 1 0.98 0.01 . 2 . . . . 20 LEU MD2 . 15782 1 221 . 1 1 20 20 LEU HD23 H 1 0.98 0.01 . 2 . . . . 20 LEU MD2 . 15782 1 222 . 1 1 20 20 LEU HG H 1 1.06 0.01 . 1 . . . . 20 LEU HG . 15782 1 223 . 1 1 20 20 LEU C C 13 173.2 0.2 . 1 . . . . 20 LEU C . 15782 1 224 . 1 1 20 20 LEU CA C 13 55.7 0.2 . 1 . . . . 20 LEU CA . 15782 1 225 . 1 1 20 20 LEU CB C 13 42.9 0.2 . 1 . . . . 20 LEU CB . 15782 1 226 . 1 1 20 20 LEU CG C 13 25.0 0.2 . 1 . . . . 20 LEU CG . 15782 1 227 . 1 1 20 20 LEU N N 15 124.9 0.1 . 1 . . . . 20 LEU N . 15782 1 228 . 1 1 21 21 GLU H H 1 9.03 0.01 . 1 . . . . 21 GLU H . 15782 1 229 . 1 1 21 21 GLU HA H 1 4.47 0.01 . 1 . . . . 21 GLU HA . 15782 1 230 . 1 1 21 21 GLU HB2 H 1 1.77 0.01 . 1 . . . . 21 GLU HB2 . 15782 1 231 . 1 1 21 21 GLU HB3 H 1 1.77 0.01 . 1 . . . . 21 GLU HB3 . 15782 1 232 . 1 1 21 21 GLU HG2 H 1 2.12 0.01 . 1 . . . . 21 GLU HG2 . 15782 1 233 . 1 1 21 21 GLU HG3 H 1 2.12 0.01 . 1 . . . . 21 GLU HG3 . 15782 1 234 . 1 1 21 21 GLU C C 13 175.2 0.2 . 1 . . . . 21 GLU C . 15782 1 235 . 1 1 21 21 GLU CA C 13 57.2 0.2 . 1 . . . . 21 GLU CA . 15782 1 236 . 1 1 21 21 GLU CB C 13 31.8 0.2 . 1 . . . . 21 GLU CB . 15782 1 237 . 1 1 21 21 GLU CG C 13 36.0 0.2 . 1 . . . . 21 GLU CG . 15782 1 238 . 1 1 21 21 GLU N N 15 128.0 0.1 . 1 . . . . 21 GLU N . 15782 1 239 . 1 1 22 22 LYS H H 1 7.45 0.01 . 1 . . . . 22 LYS H . 15782 1 240 . 1 1 22 22 LYS HA H 1 4.55 0.01 . 1 . . . . 22 LYS HA . 15782 1 241 . 1 1 22 22 LYS HB2 H 1 1.97 0.01 . 2 . . . . 22 LYS HB2 . 15782 1 242 . 1 1 22 22 LYS HB3 H 1 1.72 0.01 . 2 . . . . 22 LYS HB3 . 15782 1 243 . 1 1 22 22 LYS HD2 H 1 1.68 0.01 . 1 . . . . 22 LYS HD2 . 15782 1 244 . 1 1 22 22 LYS HD3 H 1 1.68 0.01 . 1 . . . . 22 LYS HD3 . 15782 1 245 . 1 1 22 22 LYS HE2 H 1 2.97 0.01 . 1 . . . . 22 LYS HE2 . 15782 1 246 . 1 1 22 22 LYS HE3 H 1 2.97 0.01 . 1 . . . . 22 LYS HE3 . 15782 1 247 . 1 1 22 22 LYS HG2 H 1 1.40 0.01 . 1 . . . . 22 LYS HG2 . 15782 1 248 . 1 1 22 22 LYS HG3 H 1 1.40 0.01 . 1 . . . . 22 LYS HG3 . 15782 1 249 . 1 1 22 22 LYS C C 13 176.0 0.2 . 1 . . . . 22 LYS C . 15782 1 250 . 1 1 22 22 LYS CA C 13 54.4 0.2 . 1 . . . . 22 LYS CA . 15782 1 251 . 1 1 22 22 LYS CB C 13 35.7 0.2 . 1 . . . . 22 LYS CB . 15782 1 252 . 1 1 22 22 LYS CD C 13 29.2 0.2 . 1 . . . . 22 LYS CD . 15782 1 253 . 1 1 22 22 LYS CE C 13 42.0 0.2 . 1 . . . . 22 LYS CE . 15782 1 254 . 1 1 22 22 LYS CG C 13 24.0 0.2 . 1 . . . . 22 LYS CG . 15782 1 255 . 1 1 22 22 LYS N N 15 115.2 0.1 . 1 . . . . 22 LYS N . 15782 1 256 . 1 1 23 23 GLU H H 1 8.56 0.01 . 1 . . . . 23 GLU H . 15782 1 257 . 1 1 23 23 GLU HA H 1 4.30 0.01 . 1 . . . . 23 GLU HA . 15782 1 258 . 1 1 23 23 GLU HB2 H 1 2.17 0.01 . 2 . . . . 23 GLU HB2 . 15782 1 259 . 1 1 23 23 GLU HB3 H 1 2.03 0.01 . 2 . . . . 23 GLU HB3 . 15782 1 260 . 1 1 23 23 GLU HG2 H 1 2.45 0.01 . 1 . . . . 23 GLU HG2 . 15782 1 261 . 1 1 23 23 GLU HG3 H 1 2.45 0.01 . 1 . . . . 23 GLU HG3 . 15782 1 262 . 1 1 23 23 GLU C C 13 173.7 0.2 . 1 . . . . 23 GLU C . 15782 1 263 . 1 1 23 23 GLU CA C 13 57.1 0.2 . 1 . . . . 23 GLU CA . 15782 1 264 . 1 1 23 23 GLU CB C 13 30.1 0.2 . 1 . . . . 23 GLU CB . 15782 1 265 . 1 1 23 23 GLU CG C 13 36.5 0.2 . 1 . . . . 23 GLU CG . 15782 1 266 . 1 1 23 23 GLU N N 15 120.7 0.2 . 1 . . . . 23 GLU N . 15782 1 267 . 1 1 24 24 VAL H H 1 8.81 0.01 . 1 . . . . 24 VAL H . 15782 1 268 . 1 1 24 24 VAL HA H 1 3.97 0.01 . 1 . . . . 24 VAL HA . 15782 1 269 . 1 1 24 24 VAL HB H 1 2.11 0.01 . 1 . . . . 24 VAL HB . 15782 1 270 . 1 1 24 24 VAL HG11 H 1 1.18 0.01 . 2 . . . . 24 VAL MG1 . 15782 1 271 . 1 1 24 24 VAL HG12 H 1 1.18 0.01 . 2 . . . . 24 VAL MG1 . 15782 1 272 . 1 1 24 24 VAL HG13 H 1 1.18 0.01 . 2 . . . . 24 VAL MG1 . 15782 1 273 . 1 1 24 24 VAL HG21 H 1 0.54 0.01 . 2 . . . . 24 VAL MG2 . 15782 1 274 . 1 1 24 24 VAL HG22 H 1 0.54 0.01 . 2 . . . . 24 VAL MG2 . 15782 1 275 . 1 1 24 24 VAL HG23 H 1 0.54 0.01 . 2 . . . . 24 VAL MG2 . 15782 1 276 . 1 1 24 24 VAL C C 13 175.9 0.2 . 1 . . . . 24 VAL C . 15782 1 277 . 1 1 24 24 VAL CA C 13 64.5 0.2 . 1 . . . . 24 VAL CA . 15782 1 278 . 1 1 24 24 VAL CB C 13 32.0 0.2 . 1 . . . . 24 VAL CB . 15782 1 279 . 1 1 24 24 VAL CG1 C 13 23.5 0.2 . 2 . . . . 24 VAL CG1 . 15782 1 280 . 1 1 24 24 VAL CG2 C 13 22.4 0.2 . 2 . . . . 24 VAL CG2 . 15782 1 281 . 1 1 24 24 VAL N N 15 125.6 0.2 . 1 . . . . 24 VAL N . 15782 1 282 . 1 1 25 25 ALA H H 1 7.72 0.01 . 1 . . . . 25 ALA H . 15782 1 283 . 1 1 25 25 ALA HA H 1 4.95 0.01 . 1 . . . . 25 ALA HA . 15782 1 284 . 1 1 25 25 ALA HB1 H 1 1.44 0.01 . 1 . . . . 25 ALA MB . 15782 1 285 . 1 1 25 25 ALA HB2 H 1 1.44 0.01 . 1 . . . . 25 ALA MB . 15782 1 286 . 1 1 25 25 ALA HB3 H 1 1.44 0.01 . 1 . . . . 25 ALA MB . 15782 1 287 . 1 1 25 25 ALA C C 13 175.3 0.2 . 1 . . . . 25 ALA C . 15782 1 288 . 1 1 25 25 ALA CA C 13 50.8 0.2 . 1 . . . . 25 ALA CA . 15782 1 289 . 1 1 25 25 ALA CB C 13 23.2 0.2 . 1 . . . . 25 ALA CB . 15782 1 290 . 1 1 25 25 ALA N N 15 128.5 0.1 . 1 . . . . 25 ALA N . 15782 1 291 . 1 1 26 26 GLU H H 1 8.79 0.01 . 1 . . . . 26 GLU H . 15782 1 292 . 1 1 26 26 GLU HA H 1 5.00 0.01 . 1 . . . . 26 GLU HA . 15782 1 293 . 1 1 26 26 GLU HB2 H 1 2.23 0.01 . 2 . . . . 26 GLU HB2 . 15782 1 294 . 1 1 26 26 GLU HB3 H 1 2.15 0.01 . 2 . . . . 26 GLU HB3 . 15782 1 295 . 1 1 26 26 GLU HG2 H 1 2.58 0.01 . 2 . . . . 26 GLU HG2 . 15782 1 296 . 1 1 26 26 GLU HG3 H 1 2.43 0.01 . 2 . . . . 26 GLU HG3 . 15782 1 297 . 1 1 26 26 GLU C C 13 173.1 0.2 . 1 . . . . 26 GLU C . 15782 1 298 . 1 1 26 26 GLU CA C 13 55.6 0.2 . 1 . . . . 26 GLU CA . 15782 1 299 . 1 1 26 26 GLU CB C 13 32.1 0.2 . 1 . . . . 26 GLU CB . 15782 1 300 . 1 1 26 26 GLU CG C 13 37.4 0.2 . 1 . . . . 26 GLU CG . 15782 1 301 . 1 1 26 26 GLU N N 15 121.4 0.1 . 1 . . . . 26 GLU N . 15782 1 302 . 1 1 27 27 THR H H 1 8.65 0.01 . 1 . . . . 27 THR H . 15782 1 303 . 1 1 27 27 THR HA H 1 4.53 0.01 . 1 . . . . 27 THR HA . 15782 1 304 . 1 1 27 27 THR HB H 1 4.33 0.01 . 1 . . . . 27 THR HB . 15782 1 305 . 1 1 27 27 THR HG21 H 1 1.01 0.01 . 1 . . . . 27 THR MG . 15782 1 306 . 1 1 27 27 THR HG22 H 1 1.01 0.01 . 1 . . . . 27 THR MG . 15782 1 307 . 1 1 27 27 THR HG23 H 1 1.01 0.01 . 1 . . . . 27 THR MG . 15782 1 308 . 1 1 27 27 THR C C 13 174.6 0.2 . 1 . . . . 27 THR C . 15782 1 309 . 1 1 27 27 THR CA C 13 60.4 0.2 . 1 . . . . 27 THR CA . 15782 1 310 . 1 1 27 27 THR CB C 13 71.6 0.2 . 1 . . . . 27 THR CB . 15782 1 311 . 1 1 27 27 THR N N 15 115.8 0.1 . 1 . . . . 27 THR N . 15782 1 312 . 1 1 28 28 GLN HA H 1 4.29 0.01 . 1 . . . . 28 GLN HA . 15782 1 313 . 1 1 28 28 GLN HB2 H 1 2.18 0.01 . 2 . . . . 28 GLN HB2 . 15782 1 314 . 1 1 28 28 GLN HB3 H 1 2.02 0.01 . 2 . . . . 28 GLN HB3 . 15782 1 315 . 1 1 28 28 GLN HG2 H 1 2.31 0.01 . 1 . . . . 28 GLN HG2 . 15782 1 316 . 1 1 28 28 GLN HG3 H 1 2.31 0.01 . 1 . . . . 28 GLN HG3 . 15782 1 317 . 1 1 28 28 GLN C C 13 174.8 0.2 . 1 . . . . 28 GLN C . 15782 1 318 . 1 1 28 28 GLN CA C 13 57.0 0.2 . 1 . . . . 28 GLN CA . 15782 1 319 . 1 1 28 28 GLN CB C 13 28.5 0.2 . 1 . . . . 28 GLN CB . 15782 1 320 . 1 1 29 29 HIS H H 1 7.60 0.01 . 1 . . . . 29 HIS H . 15782 1 321 . 1 1 29 29 HIS HA H 1 4.94 0.01 . 1 . . . . 29 HIS HA . 15782 1 322 . 1 1 29 29 HIS HB2 H 1 3.19 0.02 . 2 . . . . 29 HIS HB2 . 15782 1 323 . 1 1 29 29 HIS HB3 H 1 3.09 0.02 . 2 . . . . 29 HIS HB3 . 15782 1 324 . 1 1 29 29 HIS HD2 H 1 6.84 0.02 . 1 . . . . 29 HIS HD2 . 15782 1 325 . 1 1 29 29 HIS C C 13 174.9 0.2 . 1 . . . . 29 HIS C . 15782 1 326 . 1 1 29 29 HIS CA C 13 55.2 0.2 . 1 . . . . 29 HIS CA . 15782 1 327 . 1 1 29 29 HIS CB C 13 30.1 0.2 . 1 . . . . 29 HIS CB . 15782 1 328 . 1 1 29 29 HIS N N 15 115.2 0.1 . 1 . . . . 29 HIS N . 15782 1 329 . 1 1 30 30 GLY H H 1 7.60 0.01 . 1 . . . . 30 GLY H . 15782 1 330 . 1 1 30 30 GLY HA2 H 1 4.09 0.01 . 2 . . . . 30 GLY HA2 . 15782 1 331 . 1 1 30 30 GLY HA3 H 1 3.91 0.01 . 2 . . . . 30 GLY HA3 . 15782 1 332 . 1 1 30 30 GLY C C 13 176.0 0.2 . 1 . . . . 30 GLY C . 15782 1 333 . 1 1 30 30 GLY CA C 13 46.7 0.2 . 1 . . . . 30 GLY CA . 15782 1 334 . 1 1 30 30 GLY N N 15 108.7 0.1 . 1 . . . . 30 GLY N . 15782 1 335 . 1 1 31 31 THR H H 1 7.00 0.01 . 1 . . . . 31 THR H . 15782 1 336 . 1 1 31 31 THR HA H 1 4.77 0.01 . 1 . . . . 31 THR HA . 15782 1 337 . 1 1 31 31 THR HB H 1 4.37 0.01 . 1 . . . . 31 THR HB . 15782 1 338 . 1 1 31 31 THR HG21 H 1 1.01 0.01 . 1 . . . . 31 THR MG . 15782 1 339 . 1 1 31 31 THR HG22 H 1 1.01 0.01 . 1 . . . . 31 THR MG . 15782 1 340 . 1 1 31 31 THR HG23 H 1 1.01 0.01 . 1 . . . . 31 THR MG . 15782 1 341 . 1 1 31 31 THR C C 13 177.7 0.2 . 1 . . . . 31 THR C . 15782 1 342 . 1 1 31 31 THR CA C 13 59.0 0.2 . 1 . . . . 31 THR CA . 15782 1 343 . 1 1 31 31 THR CB C 13 70.9 0.2 . 1 . . . . 31 THR CB . 15782 1 344 . 1 1 31 31 THR CG2 C 13 23.1 0.2 . 1 . . . . 31 THR CG2 . 15782 1 345 . 1 1 31 31 THR N N 15 109.4 0.1 . 1 . . . . 31 THR N . 15782 1 346 . 1 1 32 32 VAL H H 1 8.96 0.01 . 1 . . . . 32 VAL H . 15782 1 347 . 1 1 32 32 VAL HA H 1 4.91 0.01 . 1 . . . . 32 VAL HA . 15782 1 348 . 1 1 32 32 VAL HB H 1 1.35 0.01 . 1 . . . . 32 VAL HB . 15782 1 349 . 1 1 32 32 VAL HG11 H 1 0.01 0.01 . 2 . . . . 32 VAL MG1 . 15782 1 350 . 1 1 32 32 VAL HG12 H 1 0.01 0.01 . 2 . . . . 32 VAL MG1 . 15782 1 351 . 1 1 32 32 VAL HG13 H 1 0.01 0.01 . 2 . . . . 32 VAL MG1 . 15782 1 352 . 1 1 32 32 VAL HG21 H 1 0.18 0.01 . 2 . . . . 32 VAL MG2 . 15782 1 353 . 1 1 32 32 VAL HG22 H 1 0.18 0.01 . 2 . . . . 32 VAL MG2 . 15782 1 354 . 1 1 32 32 VAL HG23 H 1 0.18 0.01 . 2 . . . . 32 VAL MG2 . 15782 1 355 . 1 1 32 32 VAL C C 13 177.1 0.2 . 1 . . . . 32 VAL C . 15782 1 356 . 1 1 32 32 VAL CA C 13 59.7 0.2 . 1 . . . . 32 VAL CA . 15782 1 357 . 1 1 32 32 VAL CB C 13 34.2 0.2 . 1 . . . . 32 VAL CB . 15782 1 358 . 1 1 32 32 VAL CG1 C 13 21.2 0.2 . 2 . . . . 32 VAL CG1 . 15782 1 359 . 1 1 32 32 VAL CG2 C 13 19.2 0.2 . 2 . . . . 32 VAL CG2 . 15782 1 360 . 1 1 32 32 VAL N N 15 114.6 0.1 . 1 . . . . 32 VAL N . 15782 1 361 . 1 1 33 33 LEU H H 1 8.69 0.01 . 1 . . . . 33 LEU H . 15782 1 362 . 1 1 33 33 LEU HA H 1 5.06 0.01 . 1 . . . . 33 LEU HA . 15782 1 363 . 1 1 33 33 LEU HB2 H 1 1.51 0.01 . 2 . . . . 33 LEU HB2 . 15782 1 364 . 1 1 33 33 LEU HB3 H 1 1.32 0.01 . 2 . . . . 33 LEU HB3 . 15782 1 365 . 1 1 33 33 LEU HD11 H 1 0.77 0.01 . 2 . . . . 33 LEU MD1 . 15782 1 366 . 1 1 33 33 LEU HD12 H 1 0.77 0.01 . 2 . . . . 33 LEU MD1 . 15782 1 367 . 1 1 33 33 LEU HD13 H 1 0.77 0.01 . 2 . . . . 33 LEU MD1 . 15782 1 368 . 1 1 33 33 LEU HD21 H 1 0.74 0.01 . 2 . . . . 33 LEU MD2 . 15782 1 369 . 1 1 33 33 LEU HD22 H 1 0.74 0.01 . 2 . . . . 33 LEU MD2 . 15782 1 370 . 1 1 33 33 LEU HD23 H 1 0.74 0.01 . 2 . . . . 33 LEU MD2 . 15782 1 371 . 1 1 33 33 LEU HG H 1 1.34 0.01 . 1 . . . . 33 LEU HG . 15782 1 372 . 1 1 33 33 LEU C C 13 174.8 0.2 . 1 . . . . 33 LEU C . 15782 1 373 . 1 1 33 33 LEU CA C 13 53.6 0.2 . 1 . . . . 33 LEU CA . 15782 1 374 . 1 1 33 33 LEU CB C 13 44.9 0.2 . 1 . . . . 33 LEU CB . 15782 1 375 . 1 1 33 33 LEU CD1 C 13 24.6 0.2 . 1 . . . . 33 LEU CD1 . 15782 1 376 . 1 1 33 33 LEU CD2 C 13 24.6 0.2 . 1 . . . . 33 LEU CD2 . 15782 1 377 . 1 1 33 33 LEU CG C 13 27.6 0.2 . 1 . . . . 33 LEU CG . 15782 1 378 . 1 1 33 33 LEU N N 15 124.5 0.1 . 1 . . . . 33 LEU N . 15782 1 379 . 1 1 34 34 VAL H H 1 9.27 0.01 . 1 . . . . 34 VAL H . 15782 1 380 . 1 1 34 34 VAL HA H 1 4.40 0.01 . 1 . . . . 34 VAL HA . 15782 1 381 . 1 1 34 34 VAL HB H 1 2.00 0.01 . 1 . . . . 34 VAL HB . 15782 1 382 . 1 1 34 34 VAL HG11 H 1 0.81 0.01 . 2 . . . . 34 VAL MG1 . 15782 1 383 . 1 1 34 34 VAL HG12 H 1 0.81 0.01 . 2 . . . . 34 VAL MG1 . 15782 1 384 . 1 1 34 34 VAL HG13 H 1 0.81 0.01 . 2 . . . . 34 VAL MG1 . 15782 1 385 . 1 1 34 34 VAL HG21 H 1 0.79 0.01 . 2 . . . . 34 VAL MG2 . 15782 1 386 . 1 1 34 34 VAL HG22 H 1 0.79 0.01 . 2 . . . . 34 VAL MG2 . 15782 1 387 . 1 1 34 34 VAL HG23 H 1 0.79 0.01 . 2 . . . . 34 VAL MG2 . 15782 1 388 . 1 1 34 34 VAL C C 13 177.2 0.2 . 1 . . . . 34 VAL C . 15782 1 389 . 1 1 34 34 VAL CA C 13 60.4 0.2 . 1 . . . . 34 VAL CA . 15782 1 390 . 1 1 34 34 VAL CB C 13 34.2 0.2 . 1 . . . . 34 VAL CB . 15782 1 391 . 1 1 34 34 VAL CG1 C 13 21.1 0.2 . 1 . . . . 34 VAL CG1 . 15782 1 392 . 1 1 34 34 VAL CG2 C 13 21.1 0.2 . 1 . . . . 34 VAL CG2 . 15782 1 393 . 1 1 34 34 VAL N N 15 128.4 0.1 . 1 . . . . 34 VAL N . 15782 1 394 . 1 1 35 35 GLN H H 1 9.48 0.01 . 1 . . . . 35 GLN H . 15782 1 395 . 1 1 35 35 GLN HA H 1 5.51 0.01 . 1 . . . . 35 GLN HA . 15782 1 396 . 1 1 35 35 GLN HB2 H 1 2.00 0.01 . 2 . . . . 35 GLN HB2 . 15782 1 397 . 1 1 35 35 GLN HB3 H 1 1.82 0.01 . 2 . . . . 35 GLN HB3 . 15782 1 398 . 1 1 35 35 GLN HG2 H 1 2.16 0.01 . 2 . . . . 35 GLN HG2 . 15782 1 399 . 1 1 35 35 GLN HG3 H 1 2.05 0.01 . 2 . . . . 35 GLN HG3 . 15782 1 400 . 1 1 35 35 GLN C C 13 175.2 0.2 . 1 . . . . 35 GLN C . 15782 1 401 . 1 1 35 35 GLN CA C 13 54.7 0.2 . 1 . . . . 35 GLN CA . 15782 1 402 . 1 1 35 35 GLN CB C 13 31.1 0.2 . 1 . . . . 35 GLN CB . 15782 1 403 . 1 1 35 35 GLN CG C 13 34.7 0.2 . 1 . . . . 35 GLN CG . 15782 1 404 . 1 1 35 35 GLN N N 15 128.8 0.1 . 1 . . . . 35 GLN N . 15782 1 405 . 1 1 36 36 VAL H H 1 8.94 0.01 . 1 . . . . 36 VAL H . 15782 1 406 . 1 1 36 36 VAL HA H 1 5.51 0.01 . 1 . . . . 36 VAL HA . 15782 1 407 . 1 1 36 36 VAL HB H 1 2.33 0.01 . 1 . . . . 36 VAL HB . 15782 1 408 . 1 1 36 36 VAL HG11 H 1 0.86 0.01 . 2 . . . . 36 VAL MG1 . 15782 1 409 . 1 1 36 36 VAL HG12 H 1 0.86 0.01 . 2 . . . . 36 VAL MG1 . 15782 1 410 . 1 1 36 36 VAL HG13 H 1 0.86 0.01 . 2 . . . . 36 VAL MG1 . 15782 1 411 . 1 1 36 36 VAL HG21 H 1 0.81 0.01 . 2 . . . . 36 VAL MG2 . 15782 1 412 . 1 1 36 36 VAL HG22 H 1 0.81 0.01 . 2 . . . . 36 VAL MG2 . 15782 1 413 . 1 1 36 36 VAL HG23 H 1 0.81 0.01 . 2 . . . . 36 VAL MG2 . 15782 1 414 . 1 1 36 36 VAL C C 13 177.2 0.2 . 1 . . . . 36 VAL C . 15782 1 415 . 1 1 36 36 VAL CA C 13 58.3 0.2 . 1 . . . . 36 VAL CA . 15782 1 416 . 1 1 36 36 VAL CB C 13 36.5 0.2 . 1 . . . . 36 VAL CB . 15782 1 417 . 1 1 36 36 VAL CG1 C 13 22.5 0.2 . 1 . . . . 36 VAL CG1 . 15782 1 418 . 1 1 36 36 VAL CG2 C 13 22.5 0.2 . 1 . . . . 36 VAL CG2 . 15782 1 419 . 1 1 36 36 VAL N N 15 117.0 0.1 . 1 . . . . 36 VAL N . 15782 1 420 . 1 1 37 37 LYS H H 1 9.31 0.01 . 1 . . . . 37 LYS H . 15782 1 421 . 1 1 37 37 LYS HA H 1 4.90 0.01 . 1 . . . . 37 LYS HA . 15782 1 422 . 1 1 37 37 LYS HB2 H 1 1.88 0.03 . 2 . . . . 37 LYS HB2 . 15782 1 423 . 1 1 37 37 LYS HB3 H 1 1.71 0.03 . 2 . . . . 37 LYS HB3 . 15782 1 424 . 1 1 37 37 LYS HD2 H 1 1.84 0.03 . 1 . . . . 37 LYS HD2 . 15782 1 425 . 1 1 37 37 LYS HD3 H 1 1.84 0.03 . 1 . . . . 37 LYS HD3 . 15782 1 426 . 1 1 37 37 LYS HG2 H 1 1.40 0.02 . 1 . . . . 37 LYS HG2 . 15782 1 427 . 1 1 37 37 LYS HG3 H 1 1.40 0.02 . 1 . . . . 37 LYS HG3 . 15782 1 428 . 1 1 37 37 LYS C C 13 175.7 0.2 . 1 . . . . 37 LYS C . 15782 1 429 . 1 1 37 37 LYS CA C 13 54.4 0.2 . 1 . . . . 37 LYS CA . 15782 1 430 . 1 1 37 37 LYS CB C 13 36.1 0.2 . 1 . . . . 37 LYS CB . 15782 1 431 . 1 1 37 37 LYS CD C 13 29.1 0.2 . 1 . . . . 37 LYS CD . 15782 1 432 . 1 1 37 37 LYS CG C 13 25.5 0.2 . 1 . . . . 37 LYS CG . 15782 1 433 . 1 1 37 37 LYS N N 15 122.3 0.1 . 1 . . . . 37 LYS N . 15782 1 434 . 1 1 38 38 TYR H H 1 9.58 0.01 . 1 . . . . 38 TYR H . 15782 1 435 . 1 1 38 38 TYR HA H 1 4.59 0.01 . 1 . . . . 38 TYR HA . 15782 1 436 . 1 1 38 38 TYR HB2 H 1 2.76 0.01 . 1 . . . . 38 TYR HB2 . 15782 1 437 . 1 1 38 38 TYR HB3 H 1 2.76 0.01 . 1 . . . . 38 TYR HB3 . 15782 1 438 . 1 1 38 38 TYR HD1 H 1 6.56 0.01 . 3 . . . . 38 TYR HD1 . 15782 1 439 . 1 1 38 38 TYR HD2 H 1 6.56 0.01 . 3 . . . . 38 TYR HD2 . 15782 1 440 . 1 1 38 38 TYR HE1 H 1 5.83 0.01 . 3 . . . . 38 TYR HE1 . 15782 1 441 . 1 1 38 38 TYR HE2 H 1 5.16 0.01 . 3 . . . . 38 TYR HE2 . 15782 1 442 . 1 1 38 38 TYR C C 13 175.9 0.2 . 1 . . . . 38 TYR C . 15782 1 443 . 1 1 38 38 TYR CA C 13 56.2 0.2 . 1 . . . . 38 TYR CA . 15782 1 444 . 1 1 38 38 TYR CB C 13 41.9 0.2 . 1 . . . . 38 TYR CB . 15782 1 445 . 1 1 38 38 TYR N N 15 127.7 0.1 . 1 . . . . 38 TYR N . 15782 1 446 . 1 1 39 39 GLU H H 1 8.02 0.01 . 1 . . . . 39 GLU H . 15782 1 447 . 1 1 39 39 GLU HA H 1 4.28 0.01 . 1 . . . . 39 GLU HA . 15782 1 448 . 1 1 39 39 GLU HB2 H 1 1.93 0.01 . 2 . . . . 39 GLU HB2 . 15782 1 449 . 1 1 39 39 GLU HB3 H 1 1.61 0.01 . 2 . . . . 39 GLU HB3 . 15782 1 450 . 1 1 39 39 GLU HG2 H 1 1.89 0.01 . 2 . . . . 39 GLU HG2 . 15782 1 451 . 1 1 39 39 GLU HG3 H 1 1.83 0.01 . 2 . . . . 39 GLU HG3 . 15782 1 452 . 1 1 39 39 GLU C C 13 175.7 0.2 . 1 . . . . 39 GLU C . 15782 1 453 . 1 1 39 39 GLU CA C 13 55.2 0.2 . 1 . . . . 39 GLU CA . 15782 1 454 . 1 1 39 39 GLU CB C 13 30.8 0.2 . 1 . . . . 39 GLU CB . 15782 1 455 . 1 1 39 39 GLU CG C 13 36.5 0.2 . 1 . . . . 39 GLU CG . 15782 1 456 . 1 1 39 39 GLU N N 15 123.3 0.2 . 1 . . . . 39 GLU N . 15782 1 457 . 1 1 40 40 GLY HA2 H 1 4.17 0.02 . 2 . . . . 40 GLY HA2 . 15782 1 458 . 1 1 40 40 GLY HA3 H 1 3.32 0.02 . 2 . . . . 40 GLY HA3 . 15782 1 459 . 1 1 40 40 GLY C C 13 175.7 0.2 . 1 . . . . 40 GLY C . 15782 1 460 . 1 1 40 40 GLY CA C 13 45.1 0.2 . 1 . . . . 40 GLY CA . 15782 1 461 . 1 1 41 41 THR H H 1 8.33 0.01 . 1 . . . . 41 THR H . 15782 1 462 . 1 1 41 41 THR HA H 1 4.61 0.01 . 1 . . . . 41 THR HA . 15782 1 463 . 1 1 41 41 THR HB H 1 4.61 0.01 . 1 . . . . 41 THR HB . 15782 1 464 . 1 1 41 41 THR HG21 H 1 1.11 0.01 . 1 . . . . 41 THR MG . 15782 1 465 . 1 1 41 41 THR HG22 H 1 1.11 0.01 . 1 . . . . 41 THR MG . 15782 1 466 . 1 1 41 41 THR HG23 H 1 1.11 0.01 . 1 . . . . 41 THR MG . 15782 1 467 . 1 1 41 41 THR C C 13 175.7 0.01 . 1 . . . . 41 THR C . 15782 1 468 . 1 1 41 41 THR CA C 13 61.8 0.2 . 1 . . . . 41 THR CA . 15782 1 469 . 1 1 41 41 THR CB C 13 69.5 0.2 . 1 . . . . 41 THR CB . 15782 1 470 . 1 1 41 41 THR CG2 C 13 21.7 0.2 . 1 . . . . 41 THR CG2 . 15782 1 471 . 1 1 41 41 THR N N 15 107.3 0.1 . 1 . . . . 41 THR N . 15782 1 472 . 1 1 42 42 ASP H H 1 9.34 0.01 . 1 . . . . 42 ASP H . 15782 1 473 . 1 1 42 42 ASP HA H 1 4.66 0.01 . 1 . . . . 42 ASP HA . 15782 1 474 . 1 1 42 42 ASP HB2 H 1 3.05 0.01 . 2 . . . . 42 ASP HB2 . 15782 1 475 . 1 1 42 42 ASP HB3 H 1 2.51 0.01 . 2 . . . . 42 ASP HB3 . 15782 1 476 . 1 1 42 42 ASP C C 13 175.6 0.2 . 1 . . . . 42 ASP C . 15782 1 477 . 1 1 42 42 ASP CA C 13 52.9 0.2 . 1 . . . . 42 ASP CA . 15782 1 478 . 1 1 42 42 ASP CB C 13 39.6 0.2 . 1 . . . . 42 ASP CB . 15782 1 479 . 1 1 42 42 ASP N N 15 122.1 0.1 . 1 . . . . 42 ASP N . 15782 1 480 . 1 1 43 43 ALA H H 1 8.21 0.01 . 1 . . . . 43 ALA H . 15782 1 481 . 1 1 43 43 ALA HA H 1 3.97 0.01 . 1 . . . . 43 ALA HA . 15782 1 482 . 1 1 43 43 ALA HB1 H 1 1.21 0.01 . 1 . . . . 43 ALA MB . 15782 1 483 . 1 1 43 43 ALA HB2 H 1 1.21 0.01 . 1 . . . . 43 ALA MB . 15782 1 484 . 1 1 43 43 ALA HB3 H 1 1.21 0.01 . 1 . . . . 43 ALA MB . 15782 1 485 . 1 1 43 43 ALA C C 13 174.8 0.2 . 1 . . . . 43 ALA C . 15782 1 486 . 1 1 43 43 ALA CA C 13 51.9 0.2 . 1 . . . . 43 ALA CA . 15782 1 487 . 1 1 43 43 ALA CB C 13 17.1 0.2 . 1 . . . . 43 ALA CB . 15782 1 488 . 1 1 43 43 ALA N N 15 122.7 0.1 . 1 . . . . 43 ALA N . 15782 1 489 . 1 1 44 44 PRO HA H 1 5.15 0.01 . 1 . . . . 44 PRO HA . 15782 1 490 . 1 1 44 44 PRO HB2 H 1 2.26 0.01 . 2 . . . . 44 PRO HB2 . 15782 1 491 . 1 1 44 44 PRO HB3 H 1 1.66 0.01 . 2 . . . . 44 PRO HB3 . 15782 1 492 . 1 1 44 44 PRO HD2 H 1 3.67 0.01 . 2 . . . . 44 PRO HD2 . 15782 1 493 . 1 1 44 44 PRO HD3 H 1 3.56 0.01 . 2 . . . . 44 PRO HD3 . 15782 1 494 . 1 1 44 44 PRO HG2 H 1 2.04 0.01 . 2 . . . . 44 PRO HG2 . 15782 1 495 . 1 1 44 44 PRO HG3 H 1 2.00 0.01 . 2 . . . . 44 PRO HG3 . 15782 1 496 . 1 1 44 44 PRO C C 13 176.2 0.2 . 1 . . . . 44 PRO C . 15782 1 497 . 1 1 44 44 PRO CA C 13 61.6 0.2 . 1 . . . . 44 PRO CA . 15782 1 498 . 1 1 44 44 PRO CB C 13 35.0 0.2 . 1 . . . . 44 PRO CB . 15782 1 499 . 1 1 44 44 PRO CD C 13 50.6 0.2 . 1 . . . . 44 PRO CD . 15782 1 500 . 1 1 44 44 PRO CG C 13 25.3 0.2 . 1 . . . . 44 PRO CG . 15782 1 501 . 1 1 45 45 CYS H H 1 8.17 0.01 . 1 . . . . 45 CYS H . 15782 1 502 . 1 1 45 45 CYS HA H 1 5.12 0.01 . 1 . . . . 45 CYS HA . 15782 1 503 . 1 1 45 45 CYS HB2 H 1 3.23 0.01 . 2 . . . . 45 CYS HB2 . 15782 1 504 . 1 1 45 45 CYS HB3 H 1 3.08 0.01 . 2 . . . . 45 CYS HB3 . 15782 1 505 . 1 1 45 45 CYS C C 13 179.2 0.2 . 1 . . . . 45 CYS C . 15782 1 506 . 1 1 45 45 CYS CA C 13 53.9 0.2 . 1 . . . . 45 CYS CA . 15782 1 507 . 1 1 45 45 CYS CB C 13 45.0 0.2 . 1 . . . . 45 CYS CB . 15782 1 508 . 1 1 45 45 CYS N N 15 116.1 0.1 . 1 . . . . 45 CYS N . 15782 1 509 . 1 1 46 46 LYS H H 1 9.22 0.01 . 1 . . . . 46 LYS H . 15782 1 510 . 1 1 46 46 LYS HA H 1 4.50 0.01 . 1 . . . . 46 LYS HA . 15782 1 511 . 1 1 46 46 LYS HB2 H 1 1.63 0.01 . 1 . . . . 46 LYS HB2 . 15782 1 512 . 1 1 46 46 LYS HB3 H 1 1.63 0.01 . 1 . . . . 46 LYS HB3 . 15782 1 513 . 1 1 46 46 LYS HD2 H 1 1.93 0.01 . 1 . . . . 46 LYS HD2 . 15782 1 514 . 1 1 46 46 LYS HD3 H 1 1.93 0.01 . 1 . . . . 46 LYS HD3 . 15782 1 515 . 1 1 46 46 LYS HE2 H 1 2.94 0.01 . 1 . . . . 46 LYS HE2 . 15782 1 516 . 1 1 46 46 LYS HE3 H 1 2.94 0.01 . 1 . . . . 46 LYS HE3 . 15782 1 517 . 1 1 46 46 LYS HG2 H 1 1.32 0.01 . 1 . . . . 46 LYS HG2 . 15782 1 518 . 1 1 46 46 LYS HG3 H 1 1.32 0.01 . 1 . . . . 46 LYS HG3 . 15782 1 519 . 1 1 46 46 LYS C C 13 175.9 0.2 . 1 . . . . 46 LYS C . 15782 1 520 . 1 1 46 46 LYS CA C 13 56.2 0.2 . 1 . . . . 46 LYS CA . 15782 1 521 . 1 1 46 46 LYS CB C 13 34.3 0.2 . 1 . . . . 46 LYS CB . 15782 1 522 . 1 1 46 46 LYS CD C 13 29.6 0.2 . 1 . . . . 46 LYS CD . 15782 1 523 . 1 1 46 46 LYS CE C 13 41.1 0.2 . 1 . . . . 46 LYS CE . 15782 1 524 . 1 1 46 46 LYS CG C 13 25.6 0.2 . 1 . . . . 46 LYS CG . 15782 1 525 . 1 1 46 46 LYS N N 15 121.5 0.2 . 1 . . . . 46 LYS N . 15782 1 526 . 1 1 47 47 ILE H H 1 8.26 0.01 . 1 . . . . 47 ILE H . 15782 1 527 . 1 1 47 47 ILE HA H 1 3.74 0.01 . 1 . . . . 47 ILE HA . 15782 1 528 . 1 1 47 47 ILE HB H 1 1.55 0.01 . 1 . . . . 47 ILE HB . 15782 1 529 . 1 1 47 47 ILE HD11 H 1 0.58 0.01 . 1 . . . . 47 ILE MD . 15782 1 530 . 1 1 47 47 ILE HD12 H 1 0.58 0.01 . 1 . . . . 47 ILE MD . 15782 1 531 . 1 1 47 47 ILE HD13 H 1 0.58 0.01 . 1 . . . . 47 ILE MD . 15782 1 532 . 1 1 47 47 ILE HG12 H 1 0.94 0.01 . 2 . . . . 47 ILE HG12 . 15782 1 533 . 1 1 47 47 ILE HG13 H 1 0.94 0.01 . 2 . . . . 47 ILE HG13 . 15782 1 534 . 1 1 47 47 ILE HG21 H 1 0.30 0.01 . 1 . . . . 47 ILE MG . 15782 1 535 . 1 1 47 47 ILE HG22 H 1 0.30 0.01 . 1 . . . . 47 ILE MG . 15782 1 536 . 1 1 47 47 ILE HG23 H 1 0.30 0.01 . 1 . . . . 47 ILE MG . 15782 1 537 . 1 1 47 47 ILE C C 13 177.4 0.2 . 1 . . . . 47 ILE C . 15782 1 538 . 1 1 47 47 ILE CA C 13 61.2 0.2 . 1 . . . . 47 ILE CA . 15782 1 539 . 1 1 47 47 ILE CB C 13 39.9 0.2 . 1 . . . . 47 ILE CB . 15782 1 540 . 1 1 47 47 ILE CD1 C 13 14.0 0.2 . 1 . . . . 47 ILE CD1 . 15782 1 541 . 1 1 47 47 ILE CG1 C 13 28.5 0.2 . 1 . . . . 47 ILE CG1 . 15782 1 542 . 1 1 47 47 ILE CG2 C 13 15.4 0.2 . 1 . . . . 47 ILE CG2 . 15782 1 543 . 1 1 47 47 ILE N N 15 128.3 0.1 . 1 . . . . 47 ILE N . 15782 1 544 . 1 1 48 48 PRO HA H 1 4.50 0.01 . 1 . . . . 48 PRO HA . 15782 1 545 . 1 1 48 48 PRO HB2 H 1 2.37 0.03 . 1 . . . . 48 PRO HB2 . 15782 1 546 . 1 1 48 48 PRO HB3 H 1 2.37 0.03 . 1 . . . . 48 PRO HB3 . 15782 1 547 . 1 1 48 48 PRO HG2 H 1 1.68 0.03 . 2 . . . . 48 PRO HG2 . 15782 1 548 . 1 1 48 48 PRO HG3 H 1 2.14 0.03 . 2 . . . . 48 PRO HG3 . 15782 1 549 . 1 1 48 48 PRO C C 13 175.8 0.1 . 1 . . . . 48 PRO C . 15782 1 550 . 1 1 48 48 PRO CA C 13 62.7 0.2 . 1 . . . . 48 PRO CA . 15782 1 551 . 1 1 48 48 PRO CB C 13 30.9 0.2 . 1 . . . . 48 PRO CB . 15782 1 552 . 1 1 48 48 PRO CG C 13 28.4 0.2 . 1 . . . . 48 PRO CG . 15782 1 553 . 1 1 49 49 PHE H H 1 8.10 0.01 . 1 . . . . 49 PHE H . 15782 1 554 . 1 1 49 49 PHE HA H 1 5.32 0.01 . 1 . . . . 49 PHE HA . 15782 1 555 . 1 1 49 49 PHE HB2 H 1 2.98 0.01 . 2 . . . . 49 PHE HB2 . 15782 1 556 . 1 1 49 49 PHE HB3 H 1 2.64 0.01 . 2 . . . . 49 PHE HB3 . 15782 1 557 . 1 1 49 49 PHE HD1 H 1 6.99 0.02 . 1 . . . . 49 PHE HD1 . 15782 1 558 . 1 1 49 49 PHE HD2 H 1 6.99 0.02 . 1 . . . . 49 PHE HD2 . 15782 1 559 . 1 1 49 49 PHE HE1 H 1 6.92 0.02 . 1 . . . . 49 PHE HE1 . 15782 1 560 . 1 1 49 49 PHE HE2 H 1 6.92 0.02 . 1 . . . . 49 PHE HE2 . 15782 1 561 . 1 1 49 49 PHE HZ H 1 6.73 0.02 . 1 . . . . 49 PHE HZ . 15782 1 562 . 1 1 49 49 PHE C C 13 176.8 0.2 . 1 . . . . 49 PHE C . 15782 1 563 . 1 1 49 49 PHE CA C 13 57.3 0.2 . 1 . . . . 49 PHE CA . 15782 1 564 . 1 1 49 49 PHE CB C 13 43.3 0.2 . 1 . . . . 49 PHE CB . 15782 1 565 . 1 1 49 49 PHE N N 15 127.7 0.1 . 1 . . . . 49 PHE N . 15782 1 566 . 1 1 50 50 SER H H 1 8.43 0.01 . 1 . . . . 50 SER H . 15782 1 567 . 1 1 50 50 SER HA H 1 4.64 0.01 . 1 . . . . 50 SER HA . 15782 1 568 . 1 1 50 50 SER HB2 H 1 3.83 0.02 . 2 . . . . 50 SER HB2 . 15782 1 569 . 1 1 50 50 SER HB3 H 1 3.83 0.02 . 2 . . . . 50 SER HB3 . 15782 1 570 . 1 1 50 50 SER C C 13 178.9 0.2 . 1 . . . . 50 SER C . 15782 1 571 . 1 1 50 50 SER CA C 13 57.2 0.2 . 1 . . . . 50 SER CA . 15782 1 572 . 1 1 50 50 SER CB C 13 65.8 0.2 . 1 . . . . 50 SER CB . 15782 1 573 . 1 1 50 50 SER N N 15 122.2 0.1 . 1 . . . . 50 SER N . 15782 1 574 . 1 1 51 51 THR H H 1 8.30 0.01 . 1 . . . . 51 THR H . 15782 1 575 . 1 1 51 51 THR HA H 1 5.22 0.01 . 1 . . . . 51 THR HA . 15782 1 576 . 1 1 51 51 THR HB H 1 4.13 0.01 . 1 . . . . 51 THR HB . 15782 1 577 . 1 1 51 51 THR HG21 H 1 1.09 0.01 . 1 . . . . 51 THR MG . 15782 1 578 . 1 1 51 51 THR HG22 H 1 1.09 0.01 . 1 . . . . 51 THR MG . 15782 1 579 . 1 1 51 51 THR HG23 H 1 1.09 0.01 . 1 . . . . 51 THR MG . 15782 1 580 . 1 1 51 51 THR C C 13 176.9 0.1 . 1 . . . . 51 THR C . 15782 1 581 . 1 1 51 51 THR CA C 13 59.8 0.2 . 1 . . . . 51 THR CA . 15782 1 582 . 1 1 51 51 THR CB C 13 71.2 0.2 . 1 . . . . 51 THR CB . 15782 1 583 . 1 1 51 51 THR CG2 C 13 22.2 0.2 . 1 . . . . 51 THR CG2 . 15782 1 584 . 1 1 51 51 THR N N 15 111.6 0.1 . 1 . . . . 51 THR N . 15782 1 585 . 1 1 52 52 GLN H H 1 8.94 0.01 . 1 . . . . 52 GLN H . 15782 1 586 . 1 1 52 52 GLN HA H 1 5.24 0.01 . 1 . . . . 52 GLN HA . 15782 1 587 . 1 1 52 52 GLN HB2 H 1 2.16 0.01 . 2 . . . . 52 GLN HB2 . 15782 1 588 . 1 1 52 52 GLN HB3 H 1 2.08 0.01 . 2 . . . . 52 GLN HB3 . 15782 1 589 . 1 1 52 52 GLN HG2 H 1 1.92 0.01 . 9 . . . . 52 GLN HG2 . 15782 1 590 . 1 1 52 52 GLN HG3 H 1 1.81 0.01 . 9 . . . . 52 GLN HG3 . 15782 1 591 . 1 1 52 52 GLN C C 13 175.6 0.2 . 1 . . . . 52 GLN C . 15782 1 592 . 1 1 52 52 GLN CA C 13 54.0 0.2 . 1 . . . . 52 GLN CA . 15782 1 593 . 1 1 52 52 GLN CB C 13 33.3 0.2 . 1 . . . . 52 GLN CB . 15782 1 594 . 1 1 52 52 GLN N N 15 121.5 0.1 . 1 . . . . 52 GLN N . 15782 1 595 . 1 1 53 53 ASP H H 1 8.26 0.01 . 1 . . . . 53 ASP H . 15782 1 596 . 1 1 53 53 ASP HA H 1 4.88 0.02 . 1 . . . . 53 ASP HA . 15782 1 597 . 1 1 53 53 ASP HB2 H 1 2.72 0.02 . 2 . . . . 53 ASP HB2 . 15782 1 598 . 1 1 53 53 ASP HB3 H 1 2.72 0.02 . 2 . . . . 53 ASP HB3 . 15782 1 599 . 1 1 53 53 ASP C C 13 173.3 0.1 . 1 . . . . 53 ASP C . 15782 1 600 . 1 1 53 53 ASP CA C 13 52.7 0.2 . 1 . . . . 53 ASP CA . 15782 1 601 . 1 1 53 53 ASP CB C 13 41.9 0.2 . 1 . . . . 53 ASP CB . 15782 1 602 . 1 1 53 53 ASP N N 15 121.7 0.1 . 1 . . . . 53 ASP N . 15782 1 603 . 1 1 54 54 GLU H H 1 8.98 0.01 . 1 . . . . 54 GLU H . 15782 1 604 . 1 1 54 54 GLU HA H 1 4.20 0.01 . 1 . . . . 54 GLU HA . 15782 1 605 . 1 1 54 54 GLU HB2 H 1 2.20 0.01 . 2 . . . . 54 GLU HB2 . 15782 1 606 . 1 1 54 54 GLU HB3 H 1 2.20 0.01 . 2 . . . . 54 GLU HB3 . 15782 1 607 . 1 1 54 54 GLU HG2 H 1 2.35 0.01 . 2 . . . . 54 GLU HG2 . 15782 1 608 . 1 1 54 54 GLU HG3 H 1 2.35 0.01 . 2 . . . . 54 GLU HG3 . 15782 1 609 . 1 1 54 54 GLU C C 13 173.5 0.1 . 1 . . . . 54 GLU C . 15782 1 610 . 1 1 54 54 GLU CA C 13 58.6 0.2 . 1 . . . . 54 GLU CA . 15782 1 611 . 1 1 54 54 GLU CB C 13 29.2 0.2 . 1 . . . . 54 GLU CB . 15782 1 612 . 1 1 54 54 GLU CG C 13 35.9 0.2 . 1 . . . . 54 GLU CG . 15782 1 613 . 1 1 54 54 GLU N N 15 118.1 0.1 . 1 . . . . 54 GLU N . 15782 1 614 . 1 1 55 55 LYS H H 1 8.19 0.01 . 1 . . . . 55 LYS H . 15782 1 615 . 1 1 55 55 LYS HA H 1 4.45 0.01 . 1 . . . . 55 LYS HA . 15782 1 616 . 1 1 55 55 LYS HB2 H 1 2.02 0.01 . 1 . . . . 55 LYS HB2 . 15782 1 617 . 1 1 55 55 LYS HB3 H 1 2.02 0.01 . 1 . . . . 55 LYS HB3 . 15782 1 618 . 1 1 55 55 LYS HD2 H 1 1.71 0.01 . 1 . . . . 55 LYS HD2 . 15782 1 619 . 1 1 55 55 LYS HD3 H 1 1.71 0.01 . 1 . . . . 55 LYS HD3 . 15782 1 620 . 1 1 55 55 LYS HE2 H 1 3.02 0.01 . 1 . . . . 55 LYS HE2 . 15782 1 621 . 1 1 55 55 LYS HE3 H 1 3.02 0.01 . 1 . . . . 55 LYS HE3 . 15782 1 622 . 1 1 55 55 LYS HG2 H 1 1.47 0.01 . 1 . . . . 55 LYS HG2 . 15782 1 623 . 1 1 55 55 LYS HG3 H 1 1.47 0.01 . 1 . . . . 55 LYS HG3 . 15782 1 624 . 1 1 55 55 LYS C C 13 174.0 0.1 . 1 . . . . 55 LYS C . 15782 1 625 . 1 1 55 55 LYS CA C 13 55.6 0.2 . 1 . . . . 55 LYS CA . 15782 1 626 . 1 1 55 55 LYS CB C 13 32.7 0.2 . 1 . . . . 55 LYS CB . 15782 1 627 . 1 1 55 55 LYS CD C 13 29.1 0.2 . 1 . . . . 55 LYS CD . 15782 1 628 . 1 1 55 55 LYS CE C 13 42.1 0.2 . 1 . . . . 55 LYS CE . 15782 1 629 . 1 1 55 55 LYS CG C 13 25.5 0.2 . 1 . . . . 55 LYS CG . 15782 1 630 . 1 1 55 55 LYS N N 15 120.1 0.1 . 1 . . . . 55 LYS N . 15782 1 631 . 1 1 56 56 GLY H H 1 8.14 0.01 . 1 . . . . 56 GLY H . 15782 1 632 . 1 1 56 56 GLY HA2 H 1 4.14 0.01 . 2 . . . . 56 GLY HA2 . 15782 1 633 . 1 1 56 56 GLY HA3 H 1 3.69 0.01 . 2 . . . . 56 GLY HA3 . 15782 1 634 . 1 1 56 56 GLY C C 13 177.0 0.1 . 1 . . . . 56 GLY C . 15782 1 635 . 1 1 56 56 GLY CA C 13 45.4 0.2 . 1 . . . . 56 GLY CA . 15782 1 636 . 1 1 56 56 GLY N N 15 109.1 0.1 . 1 . . . . 56 GLY N . 15782 1 637 . 1 1 57 57 ILE H H 1 8.44 0.01 . 1 . . . . 57 ILE H . 15782 1 638 . 1 1 57 57 ILE HA H 1 4.14 0.01 . 1 . . . . 57 ILE HA . 15782 1 639 . 1 1 57 57 ILE HB H 1 2.18 0.01 . 1 . . . . 57 ILE HB . 15782 1 640 . 1 1 57 57 ILE HD11 H 1 0.82 0.01 . 1 . . . . 57 ILE MD . 15782 1 641 . 1 1 57 57 ILE HD12 H 1 0.82 0.01 . 1 . . . . 57 ILE MD . 15782 1 642 . 1 1 57 57 ILE HD13 H 1 0.82 0.01 . 1 . . . . 57 ILE MD . 15782 1 643 . 1 1 57 57 ILE HG12 H 1 1.24 0.01 . 2 . . . . 57 ILE HG12 . 15782 1 644 . 1 1 57 57 ILE HG13 H 1 1.24 0.01 . 2 . . . . 57 ILE HG13 . 15782 1 645 . 1 1 57 57 ILE HG21 H 1 0.92 0.01 . 1 . . . . 57 ILE MG . 15782 1 646 . 1 1 57 57 ILE HG22 H 1 0.92 0.01 . 1 . . . . 57 ILE MG . 15782 1 647 . 1 1 57 57 ILE HG23 H 1 0.92 0.01 . 1 . . . . 57 ILE MG . 15782 1 648 . 1 1 57 57 ILE C C 13 173.4 0.1 . 1 . . . . 57 ILE C . 15782 1 649 . 1 1 57 57 ILE CA C 13 60.4 0.2 . 1 . . . . 57 ILE CA . 15782 1 650 . 1 1 57 57 ILE CB C 13 36.7 0.2 . 1 . . . . 57 ILE CB . 15782 1 651 . 1 1 57 57 ILE CD1 C 13 11.1 0.2 . 1 . . . . 57 ILE CD1 . 15782 1 652 . 1 1 57 57 ILE CG1 C 13 27.7 0.2 . 1 . . . . 57 ILE CG1 . 15782 1 653 . 1 1 57 57 ILE CG2 C 13 17.4 0.2 . 1 . . . . 57 ILE CG2 . 15782 1 654 . 1 1 57 57 ILE N N 15 124.1 0.2 . 1 . . . . 57 ILE N . 15782 1 655 . 1 1 58 58 THR H H 1 8.63 0.01 . 1 . . . . 58 THR H . 15782 1 656 . 1 1 58 58 THR HA H 1 4.57 0.01 . 1 . . . . 58 THR HA . 15782 1 657 . 1 1 58 58 THR HB H 1 4.13 0.01 . 1 . . . . 58 THR HB . 15782 1 658 . 1 1 58 58 THR HG21 H 1 1.30 0.01 . 1 . . . . 58 THR MG . 15782 1 659 . 1 1 58 58 THR HG22 H 1 1.30 0.01 . 1 . . . . 58 THR MG . 15782 1 660 . 1 1 58 58 THR HG23 H 1 1.30 0.01 . 1 . . . . 58 THR MG . 15782 1 661 . 1 1 58 58 THR C C 13 176.7 0.1 . 1 . . . . 58 THR C . 15782 1 662 . 1 1 58 58 THR CA C 13 63.5 0.2 . 1 . . . . 58 THR CA . 15782 1 663 . 1 1 58 58 THR CB C 13 69.8 0.2 . 1 . . . . 58 THR CB . 15782 1 664 . 1 1 58 58 THR CG2 C 13 22.1 0.2 . 1 . . . . 58 THR CG2 . 15782 1 665 . 1 1 58 58 THR N N 15 125.4 0.1 . 1 . . . . 58 THR N . 15782 1 666 . 1 1 59 59 GLN H H 1 8.70 0.01 . 1 . . . . 59 GLN H . 15782 1 667 . 1 1 59 59 GLN HA H 1 4.62 0.01 . 1 . . . . 59 GLN HA . 15782 1 668 . 1 1 59 59 GLN HB2 H 1 1.85 0.01 . 1 . . . . 59 GLN HB2 . 15782 1 669 . 1 1 59 59 GLN HB3 H 1 1.85 0.01 . 1 . . . . 59 GLN HB3 . 15782 1 670 . 1 1 59 59 GLN C C 13 175.2 0.1 . 1 . . . . 59 GLN C . 15782 1 671 . 1 1 59 59 GLN CA C 13 54.2 0.2 . 1 . . . . 59 GLN CA . 15782 1 672 . 1 1 59 59 GLN CB C 13 30.5 0.2 . 1 . . . . 59 GLN CB . 15782 1 673 . 1 1 59 59 GLN N N 15 125.7 0.1 . 1 . . . . 59 GLN N . 15782 1 674 . 1 1 60 60 ASN CA C 13 53.8 0.2 . 1 . . . . 60 ASN CA . 15782 1 675 . 1 1 60 60 ASN CB C 13 39.1 0.2 . 1 . . . . 60 ASN CB . 15782 1 676 . 1 1 61 61 GLY H H 1 8.44 0.01 . 1 . . . . 61 GLY H . 15782 1 677 . 1 1 61 61 GLY HA2 H 1 4.08 0.01 . 2 . . . . 61 GLY HA2 . 15782 1 678 . 1 1 61 61 GLY HA3 H 1 3.88 0.01 . 2 . . . . 61 GLY HA3 . 15782 1 679 . 1 1 61 61 GLY C C 13 176.6 0.1 . 1 . . . . 61 GLY C . 15782 1 680 . 1 1 61 61 GLY CA C 13 46.1 0.2 . 1 . . . . 61 GLY CA . 15782 1 681 . 1 1 61 61 GLY N N 15 109.1 0.1 . 1 . . . . 61 GLY N . 15782 1 682 . 1 1 62 62 ARG H H 1 8.45 0.01 . 1 . . . . 62 ARG H . 15782 1 683 . 1 1 62 62 ARG HA H 1 4.43 0.01 . 1 . . . . 62 ARG HA . 15782 1 684 . 1 1 62 62 ARG HB2 H 1 1.79 0.01 . 2 . . . . 62 ARG HB2 . 15782 1 685 . 1 1 62 62 ARG HB3 H 1 1.79 0.01 . 2 . . . . 62 ARG HB3 . 15782 1 686 . 1 1 62 62 ARG HD2 H 1 3.15 0.01 . 2 . . . . 62 ARG HD2 . 15782 1 687 . 1 1 62 62 ARG HD3 H 1 3.15 0.01 . 2 . . . . 62 ARG HD3 . 15782 1 688 . 1 1 62 62 ARG HG2 H 1 2.10 0.01 . 2 . . . . 62 ARG HG2 . 15782 1 689 . 1 1 62 62 ARG HG3 H 1 1.57 0.01 . 2 . . . . 62 ARG HG3 . 15782 1 690 . 1 1 62 62 ARG C C 13 175.4 0.2 . 1 . . . . 62 ARG C . 15782 1 691 . 1 1 62 62 ARG CA C 13 55.7 0.2 . 1 . . . . 62 ARG CA . 15782 1 692 . 1 1 62 62 ARG CB C 13 30.5 0.2 . 1 . . . . 62 ARG CB . 15782 1 693 . 1 1 62 62 ARG CD C 13 42.8 0.2 . 1 . . . . 62 ARG CD . 15782 1 694 . 1 1 62 62 ARG CG C 13 27.5 0.2 . 1 . . . . 62 ARG CG . 15782 1 695 . 1 1 62 62 ARG N N 15 119.3 0.1 . 1 . . . . 62 ARG N . 15782 1 696 . 1 1 63 63 LEU H H 1 8.09 0.01 . 1 . . . . 63 LEU H . 15782 1 697 . 1 1 63 63 LEU HA H 1 4.14 0.01 . 1 . . . . 63 LEU HA . 15782 1 698 . 1 1 63 63 LEU HB2 H 1 1.56 0.01 . 1 . . . . 63 LEU HB2 . 15782 1 699 . 1 1 63 63 LEU HB3 H 1 1.56 0.01 . 1 . . . . 63 LEU HB3 . 15782 1 700 . 1 1 63 63 LEU HD11 H 1 0.51 0.01 . 2 . . . . 63 LEU MD1 . 15782 1 701 . 1 1 63 63 LEU HD12 H 1 0.51 0.01 . 2 . . . . 63 LEU MD1 . 15782 1 702 . 1 1 63 63 LEU HD13 H 1 0.51 0.01 . 2 . . . . 63 LEU MD1 . 15782 1 703 . 1 1 63 63 LEU HD21 H 1 0.46 0.01 . 2 . . . . 63 LEU MD2 . 15782 1 704 . 1 1 63 63 LEU HD22 H 1 0.46 0.01 . 2 . . . . 63 LEU MD2 . 15782 1 705 . 1 1 63 63 LEU HD23 H 1 0.46 0.01 . 2 . . . . 63 LEU MD2 . 15782 1 706 . 1 1 63 63 LEU HG H 1 1.45 0.01 . 1 . . . . 63 LEU HG . 15782 1 707 . 1 1 63 63 LEU C C 13 174.2 0.2 . 1 . . . . 63 LEU C . 15782 1 708 . 1 1 63 63 LEU CA C 13 55.5 0.2 . 1 . . . . 63 LEU CA . 15782 1 709 . 1 1 63 63 LEU CB C 13 42.6 0.2 . 1 . . . . 63 LEU CB . 15782 1 710 . 1 1 63 63 LEU CD1 C 13 24.5 0.2 . 1 . . . . 63 LEU CD1 . 15782 1 711 . 1 1 63 63 LEU CD2 C 13 24.5 0.2 . 1 . . . . 63 LEU CD2 . 15782 1 712 . 1 1 63 63 LEU CG C 13 27.2 0.2 . 1 . . . . 63 LEU CG . 15782 1 713 . 1 1 63 63 LEU N N 15 123.1 0.1 . 1 . . . . 63 LEU N . 15782 1 714 . 1 1 64 64 ILE H H 1 8.40 0.01 . 1 . . . . 64 ILE H . 15782 1 715 . 1 1 64 64 ILE HA H 1 4.07 0.01 . 1 . . . . 64 ILE HA . 15782 1 716 . 1 1 64 64 ILE HB H 1 1.59 0.01 . 1 . . . . 64 ILE HB . 15782 1 717 . 1 1 64 64 ILE HD11 H 1 0.68 0.01 . 1 . . . . 64 ILE MD . 15782 1 718 . 1 1 64 64 ILE HD12 H 1 0.68 0.01 . 1 . . . . 64 ILE MD . 15782 1 719 . 1 1 64 64 ILE HD13 H 1 0.68 0.01 . 1 . . . . 64 ILE MD . 15782 1 720 . 1 1 64 64 ILE HG12 H 1 1.29 0.01 . 2 . . . . 64 ILE HG12 . 15782 1 721 . 1 1 64 64 ILE HG13 H 1 1.26 0.01 . 2 . . . . 64 ILE HG13 . 15782 1 722 . 1 1 64 64 ILE HG21 H 1 0.81 0.01 . 1 . . . . 64 ILE MG . 15782 1 723 . 1 1 64 64 ILE HG22 H 1 0.81 0.01 . 1 . . . . 64 ILE MG . 15782 1 724 . 1 1 64 64 ILE HG23 H 1 0.81 0.01 . 1 . . . . 64 ILE MG . 15782 1 725 . 1 1 64 64 ILE C C 13 173.8 0.1 . 1 . . . . 64 ILE C . 15782 1 726 . 1 1 64 64 ILE CA C 13 61.4 0.2 . 1 . . . . 64 ILE CA . 15782 1 727 . 1 1 64 64 ILE CB C 13 37.6 0.2 . 1 . . . . 64 ILE CB . 15782 1 728 . 1 1 64 64 ILE CD1 C 13 11.4 0.2 . 1 . . . . 64 ILE CD1 . 15782 1 729 . 1 1 64 64 ILE CG1 C 13 28.1 0.2 . 1 . . . . 64 ILE CG1 . 15782 1 730 . 1 1 64 64 ILE CG2 C 13 17.4 0.2 . 1 . . . . 64 ILE CG2 . 15782 1 731 . 1 1 64 64 ILE N N 15 125.5 0.1 . 1 . . . . 64 ILE N . 15782 1 732 . 1 1 65 65 THR H H 1 7.35 0.01 . 1 . . . . 65 THR H . 15782 1 733 . 1 1 65 65 THR HA H 1 4.06 0.01 . 1 . . . . 65 THR HA . 15782 1 734 . 1 1 65 65 THR HB H 1 3.89 0.01 . 1 . . . . 65 THR HB . 15782 1 735 . 1 1 65 65 THR HG21 H 1 1.20 0.01 . 1 . . . . 65 THR MG . 15782 1 736 . 1 1 65 65 THR HG22 H 1 1.20 0.01 . 1 . . . . 65 THR MG . 15782 1 737 . 1 1 65 65 THR HG23 H 1 1.20 0.01 . 1 . . . . 65 THR MG . 15782 1 738 . 1 1 65 65 THR C C 13 177.2 0.1 . 1 . . . . 65 THR C . 15782 1 739 . 1 1 65 65 THR CA C 13 62.3 0.2 . 1 . . . . 65 THR CA . 15782 1 740 . 1 1 65 65 THR CB C 13 70.0 0.2 . 1 . . . . 65 THR CB . 15782 1 741 . 1 1 65 65 THR CG2 C 13 21.8 0.2 . 1 . . . . 65 THR CG2 . 15782 1 742 . 1 1 65 65 THR N N 15 116.4 0.1 . 1 . . . . 65 THR N . 15782 1 743 . 1 1 66 66 ALA H H 1 8.16 0.01 . 1 . . . . 66 ALA H . 15782 1 744 . 1 1 66 66 ALA HA H 1 4.07 0.01 . 1 . . . . 66 ALA HA . 15782 1 745 . 1 1 66 66 ALA HB1 H 1 1.37 0.01 . 1 . . . . 66 ALA MB . 15782 1 746 . 1 1 66 66 ALA HB2 H 1 1.37 0.01 . 1 . . . . 66 ALA MB . 15782 1 747 . 1 1 66 66 ALA HB3 H 1 1.37 0.01 . 1 . . . . 66 ALA MB . 15782 1 748 . 1 1 66 66 ALA C C 13 173.5 0.1 . 1 . . . . 66 ALA C . 15782 1 749 . 1 1 66 66 ALA CA C 13 53.3 0.2 . 1 . . . . 66 ALA CA . 15782 1 750 . 1 1 66 66 ALA CB C 13 19.7 0.2 . 1 . . . . 66 ALA CB . 15782 1 751 . 1 1 66 66 ALA N N 15 128.6 0.1 . 1 . . . . 66 ALA N . 15782 1 752 . 1 1 67 67 ASN H H 1 8.56 0.01 . 1 . . . . 67 ASN H . 15782 1 753 . 1 1 67 67 ASN HA H 1 4.68 0.01 . 1 . . . . 67 ASN HA . 15782 1 754 . 1 1 67 67 ASN HB2 H 1 2.78 0.01 . 2 . . . . 67 ASN HB2 . 15782 1 755 . 1 1 67 67 ASN HB3 H 1 2.60 0.01 . 2 . . . . 67 ASN HB3 . 15782 1 756 . 1 1 67 67 ASN C C 13 179.4 0.1 . 1 . . . . 67 ASN C . 15782 1 757 . 1 1 67 67 ASN CA C 13 52.3 0.2 . 1 . . . . 67 ASN CA . 15782 1 758 . 1 1 67 67 ASN CB C 13 39.4 0.2 . 1 . . . . 67 ASN CB . 15782 1 759 . 1 1 67 67 ASN N N 15 116.0 0.1 . 1 . . . . 67 ASN N . 15782 1 760 . 1 1 68 68 PRO HA H 1 4.43 0.01 . 1 . . . . 68 PRO HA . 15782 1 761 . 1 1 68 68 PRO HB2 H 1 2.15 0.02 . 2 . . . . 68 PRO HB2 . 15782 1 762 . 1 1 68 68 PRO HB3 H 1 1.82 0.02 . 2 . . . . 68 PRO HB3 . 15782 1 763 . 1 1 68 68 PRO HG2 H 1 1.77 0.02 . 1 . . . . 68 PRO HG2 . 15782 1 764 . 1 1 68 68 PRO HG3 H 1 1.77 0.02 . 1 . . . . 68 PRO HG3 . 15782 1 765 . 1 1 68 68 PRO C C 13 175.3 0.1 . 1 . . . . 68 PRO C . 15782 1 766 . 1 1 68 68 PRO CA C 13 63.0 0.2 . 1 . . . . 68 PRO CA . 15782 1 767 . 1 1 68 68 PRO CB C 13 31.1 0.2 . 1 . . . . 68 PRO CB . 15782 1 768 . 1 1 68 68 PRO CG C 13 27.5 0.2 . 1 . . . . 68 PRO CG . 15782 1 769 . 1 1 69 69 ILE H H 1 8.02 0.01 . 1 . . . . 69 ILE H . 15782 1 770 . 1 1 69 69 ILE HA H 1 4.80 0.01 . 1 . . . . 69 ILE HA . 15782 1 771 . 1 1 69 69 ILE HB H 1 1.50 0.01 . 1 . . . . 69 ILE HB . 15782 1 772 . 1 1 69 69 ILE HD11 H 1 0.51 0.01 . 1 . . . . 69 ILE MD . 15782 1 773 . 1 1 69 69 ILE HD12 H 1 0.51 0.01 . 1 . . . . 69 ILE MD . 15782 1 774 . 1 1 69 69 ILE HD13 H 1 0.51 0.01 . 1 . . . . 69 ILE MD . 15782 1 775 . 1 1 69 69 ILE HG12 H 1 1.19 0.01 . 2 . . . . 69 ILE HG12 . 15782 1 776 . 1 1 69 69 ILE HG13 H 1 0.95 0.01 . 2 . . . . 69 ILE HG13 . 15782 1 777 . 1 1 69 69 ILE HG21 H 1 0.43 0.01 . 1 . . . . 69 ILE MG . 15782 1 778 . 1 1 69 69 ILE HG22 H 1 0.43 0.01 . 1 . . . . 69 ILE MG . 15782 1 779 . 1 1 69 69 ILE HG23 H 1 0.43 0.01 . 1 . . . . 69 ILE MG . 15782 1 780 . 1 1 69 69 ILE C C 13 175.3 0.1 . 1 . . . . 69 ILE C . 15782 1 781 . 1 1 69 69 ILE CA C 13 59.1 0.2 . 1 . . . . 69 ILE CA . 15782 1 782 . 1 1 69 69 ILE CB C 13 42.8 0.2 . 1 . . . . 69 ILE CB . 15782 1 783 . 1 1 69 69 ILE CD1 C 13 13.2 0.2 . 1 . . . . 69 ILE CD1 . 15782 1 784 . 1 1 69 69 ILE CG1 C 13 26.4 0.2 . 1 . . . . 69 ILE CG1 . 15782 1 785 . 1 1 69 69 ILE CG2 C 13 17.0 0.2 . 1 . . . . 69 ILE CG2 . 15782 1 786 . 1 1 69 69 ILE N N 15 123.0 0.1 . 1 . . . . 69 ILE N . 15782 1 787 . 1 1 70 70 VAL H H 1 8.70 0.01 . 1 . . . . 70 VAL H . 15782 1 788 . 1 1 70 70 VAL HA H 1 4.17 0.01 . 1 . . . . 70 VAL HA . 15782 1 789 . 1 1 70 70 VAL HB H 1 2.04 0.01 . 1 . . . . 70 VAL HB . 15782 1 790 . 1 1 70 70 VAL HG11 H 1 0.77 0.01 . 2 . . . . 70 VAL MG1 . 15782 1 791 . 1 1 70 70 VAL HG12 H 1 0.77 0.01 . 2 . . . . 70 VAL MG1 . 15782 1 792 . 1 1 70 70 VAL HG13 H 1 0.77 0.01 . 2 . . . . 70 VAL MG1 . 15782 1 793 . 1 1 70 70 VAL HG21 H 1 0.74 0.01 . 2 . . . . 70 VAL MG2 . 15782 1 794 . 1 1 70 70 VAL HG22 H 1 0.74 0.01 . 2 . . . . 70 VAL MG2 . 15782 1 795 . 1 1 70 70 VAL HG23 H 1 0.74 0.01 . 2 . . . . 70 VAL MG2 . 15782 1 796 . 1 1 70 70 VAL C C 13 175.3 0.1 . 1 . . . . 70 VAL C . 15782 1 797 . 1 1 70 70 VAL CA C 13 61.3 0.2 . 1 . . . . 70 VAL CA . 15782 1 798 . 1 1 70 70 VAL CB C 13 33.0 0.2 . 1 . . . . 70 VAL CB . 15782 1 799 . 1 1 70 70 VAL CG1 C 13 21.3 0.2 . 2 . . . . 70 VAL CG1 . 15782 1 800 . 1 1 70 70 VAL CG2 C 13 21.3 0.2 . 2 . . . . 70 VAL CG2 . 15782 1 801 . 1 1 70 70 VAL N N 15 123.8 0.1 . 1 . . . . 70 VAL N . 15782 1 802 . 1 1 71 71 THR H H 1 8.23 0.01 . 1 . . . . 71 THR H . 15782 1 803 . 1 1 71 71 THR HA H 1 4.24 0.01 . 1 . . . . 71 THR HA . 15782 1 804 . 1 1 71 71 THR HB H 1 4.18 0.01 . 1 . . . . 71 THR HB . 15782 1 805 . 1 1 71 71 THR HG21 H 1 1.18 0.01 . 1 . . . . 71 THR MG . 15782 1 806 . 1 1 71 71 THR HG22 H 1 1.18 0.01 . 1 . . . . 71 THR MG . 15782 1 807 . 1 1 71 71 THR HG23 H 1 1.18 0.01 . 1 . . . . 71 THR MG . 15782 1 808 . 1 1 71 71 THR C C 13 176.0 0.1 . 1 . . . . 71 THR C . 15782 1 809 . 1 1 71 71 THR CA C 13 62.9 0.2 . 1 . . . . 71 THR CA . 15782 1 810 . 1 1 71 71 THR CB C 13 69.1 0.2 . 1 . . . . 71 THR CB . 15782 1 811 . 1 1 71 71 THR N N 15 118.7 0.1 . 1 . . . . 71 THR N . 15782 1 812 . 1 1 72 72 ASP H H 1 8.02 0.01 . 1 . . . . 72 ASP H . 15782 1 813 . 1 1 72 72 ASP HA H 1 4.63 0.01 . 1 . . . . 72 ASP HA . 15782 1 814 . 1 1 72 72 ASP HB2 H 1 2.62 0.01 . 1 . . . . 72 ASP HB2 . 15782 1 815 . 1 1 72 72 ASP HB3 H 1 2.62 0.01 . 1 . . . . 72 ASP HB3 . 15782 1 816 . 1 1 72 72 ASP C C 13 174.1 0.2 . 1 . . . . 72 ASP C . 15782 1 817 . 1 1 72 72 ASP CA C 13 53.3 0.2 . 1 . . . . 72 ASP CA . 15782 1 818 . 1 1 72 72 ASP CB C 13 43.5 0.2 . 1 . . . . 72 ASP CB . 15782 1 819 . 1 1 72 72 ASP N N 15 123.0 0.1 . 1 . . . . 72 ASP N . 15782 1 820 . 1 1 73 73 LYS H H 1 9.15 0.01 . 1 . . . . 73 LYS H . 15782 1 821 . 1 1 73 73 LYS HA H 1 4.18 0.01 . 1 . . . . 73 LYS HA . 15782 1 822 . 1 1 73 73 LYS HB2 H 1 2.27 0.01 . 2 . . . . 73 LYS HB2 . 15782 1 823 . 1 1 73 73 LYS HB3 H 1 1.76 0.01 . 2 . . . . 73 LYS HB3 . 15782 1 824 . 1 1 73 73 LYS HD2 H 1 1.60 0.01 . 2 . . . . 73 LYS HD2 . 15782 1 825 . 1 1 73 73 LYS HD3 H 1 1.60 0.01 . 2 . . . . 73 LYS HD3 . 15782 1 826 . 1 1 73 73 LYS HG2 H 1 1.37 0.01 . 2 . . . . 73 LYS HG2 . 15782 1 827 . 1 1 73 73 LYS HG3 H 1 1.37 0.01 . 2 . . . . 73 LYS HG3 . 15782 1 828 . 1 1 73 73 LYS C C 13 173.4 0.1 . 1 . . . . 73 LYS C . 15782 1 829 . 1 1 73 73 LYS CA C 13 59.4 0.2 . 1 . . . . 73 LYS CA . 15782 1 830 . 1 1 73 73 LYS CB C 13 31.6 0.2 . 1 . . . . 73 LYS CB . 15782 1 831 . 1 1 73 73 LYS CD C 13 29.8 0.2 . 1 . . . . 73 LYS CD . 15782 1 832 . 1 1 73 73 LYS CE C 13 42.0 0.2 . 1 . . . . 73 LYS CE . 15782 1 833 . 1 1 73 73 LYS CG C 13 24.0 0.2 . 1 . . . . 73 LYS CG . 15782 1 834 . 1 1 73 73 LYS N N 15 126.6 0.1 . 1 . . . . 73 LYS N . 15782 1 835 . 1 1 74 74 GLU H H 1 8.74 0.01 . 1 . . . . 74 GLU H . 15782 1 836 . 1 1 74 74 GLU HA H 1 4.28 0.01 . 1 . . . . 74 GLU HA . 15782 1 837 . 1 1 74 74 GLU HB2 H 1 2.23 0.01 . 2 . . . . 74 GLU HB2 . 15782 1 838 . 1 1 74 74 GLU HB3 H 1 1.92 0.01 . 2 . . . . 74 GLU HB3 . 15782 1 839 . 1 1 74 74 GLU HG2 H 1 2.42 0.01 . 2 . . . . 74 GLU HG2 . 15782 1 840 . 1 1 74 74 GLU HG3 H 1 2.27 0.01 . 2 . . . . 74 GLU HG3 . 15782 1 841 . 1 1 74 74 GLU C C 13 174.2 0.1 . 1 . . . . 74 GLU C . 15782 1 842 . 1 1 74 74 GLU CA C 13 56.9 0.2 . 1 . . . . 74 GLU CA . 15782 1 843 . 1 1 74 74 GLU CB C 13 29.8 0.2 . 1 . . . . 74 GLU CB . 15782 1 844 . 1 1 74 74 GLU CG C 13 36.6 0.2 . 1 . . . . 74 GLU CG . 15782 1 845 . 1 1 74 74 GLU N N 15 118.3 0.2 . 1 . . . . 74 GLU N . 15782 1 846 . 1 1 75 75 LYS H H 1 7.97 0.01 . 1 . . . . 75 LYS H . 15782 1 847 . 1 1 75 75 LYS HA H 1 4.95 0.01 . 1 . . . . 75 LYS HA . 15782 1 848 . 1 1 75 75 LYS HB2 H 1 1.93 0.01 . 1 . . . . 75 LYS HB2 . 15782 1 849 . 1 1 75 75 LYS HB3 H 1 1.93 0.01 . 1 . . . . 75 LYS HB3 . 15782 1 850 . 1 1 75 75 LYS HD2 H 1 1.73 0.01 . 2 . . . . 75 LYS HD2 . 15782 1 851 . 1 1 75 75 LYS HD3 H 1 1.65 0.01 . 2 . . . . 75 LYS HD3 . 15782 1 852 . 1 1 75 75 LYS HE2 H 1 2.99 0.01 . 1 . . . . 75 LYS HE2 . 15782 1 853 . 1 1 75 75 LYS HE3 H 1 2.99 0.01 . 1 . . . . 75 LYS HE3 . 15782 1 854 . 1 1 75 75 LYS HG2 H 1 1.44 0.01 . 1 . . . . 75 LYS HG2 . 15782 1 855 . 1 1 75 75 LYS HG3 H 1 1.44 0.01 . 1 . . . . 75 LYS HG3 . 15782 1 856 . 1 1 75 75 LYS C C 13 176.7 0.1 . 1 . . . . 75 LYS C . 15782 1 857 . 1 1 75 75 LYS CA C 13 52.8 0.2 . 1 . . . . 75 LYS CA . 15782 1 858 . 1 1 75 75 LYS CB C 13 33.9 0.2 . 1 . . . . 75 LYS CB . 15782 1 859 . 1 1 75 75 LYS CE C 13 42.2 0.2 . 1 . . . . 75 LYS CE . 15782 1 860 . 1 1 75 75 LYS CG C 13 22.8 0.2 . 1 . . . . 75 LYS CG . 15782 1 861 . 1 1 75 75 LYS N N 15 121.3 0.1 . 1 . . . . 75 LYS N . 15782 1 862 . 1 1 76 76 PRO HA H 1 4.92 0.01 . 1 . . . . 76 PRO HA . 15782 1 863 . 1 1 76 76 PRO HB2 H 1 2.02 0.01 . 2 . . . . 76 PRO HB2 . 15782 1 864 . 1 1 76 76 PRO HB3 H 1 1.82 0.01 . 2 . . . . 76 PRO HB3 . 15782 1 865 . 1 1 76 76 PRO HD2 H 1 3.97 0.01 . 2 . . . . 76 PRO HD2 . 15782 1 866 . 1 1 76 76 PRO HD3 H 1 3.78 0.01 . 2 . . . . 76 PRO HD3 . 15782 1 867 . 1 1 76 76 PRO HG2 H 1 2.03 0.01 . 2 . . . . 76 PRO HG2 . 15782 1 868 . 1 1 76 76 PRO HG3 H 1 1.93 0.01 . 2 . . . . 76 PRO HG3 . 15782 1 869 . 1 1 76 76 PRO C C 13 174.8 0.1 . 1 . . . . 76 PRO C . 15782 1 870 . 1 1 76 76 PRO CA C 13 62.6 0.2 . 1 . . . . 76 PRO CA . 15782 1 871 . 1 1 76 76 PRO CB C 13 33.1 0.2 . 1 . . . . 76 PRO CB . 15782 1 872 . 1 1 76 76 PRO CD C 13 51.0 0.2 . 1 . . . . 76 PRO CD . 15782 1 873 . 1 1 76 76 PRO CG C 13 27.6 0.2 . 1 . . . . 76 PRO CG . 15782 1 874 . 1 1 77 77 VAL H H 1 9.21 0.01 . 1 . . . . 77 VAL H . 15782 1 875 . 1 1 77 77 VAL HA H 1 4.37 0.01 . 1 . . . . 77 VAL HA . 15782 1 876 . 1 1 77 77 VAL HB H 1 1.81 0.01 . 1 . . . . 77 VAL HB . 15782 1 877 . 1 1 77 77 VAL HG11 H 1 1.13 0.01 . 2 . . . . 77 VAL MG1 . 15782 1 878 . 1 1 77 77 VAL HG12 H 1 1.13 0.01 . 2 . . . . 77 VAL MG1 . 15782 1 879 . 1 1 77 77 VAL HG13 H 1 1.13 0.01 . 2 . . . . 77 VAL MG1 . 15782 1 880 . 1 1 77 77 VAL HG21 H 1 0.89 0.01 . 2 . . . . 77 VAL MG2 . 15782 1 881 . 1 1 77 77 VAL HG22 H 1 0.89 0.01 . 2 . . . . 77 VAL MG2 . 15782 1 882 . 1 1 77 77 VAL HG23 H 1 0.89 0.01 . 2 . . . . 77 VAL MG2 . 15782 1 883 . 1 1 77 77 VAL C C 13 175.9 0.1 . 1 . . . . 77 VAL C . 15782 1 884 . 1 1 77 77 VAL CA C 13 61.6 0.2 . 1 . . . . 77 VAL CA . 15782 1 885 . 1 1 77 77 VAL CB C 13 35.1 0.2 . 1 . . . . 77 VAL CB . 15782 1 886 . 1 1 77 77 VAL CG1 C 13 22.3 0.2 . 2 . . . . 77 VAL CG1 . 15782 1 887 . 1 1 77 77 VAL CG2 C 13 21.3 0.2 . 2 . . . . 77 VAL CG2 . 15782 1 888 . 1 1 77 77 VAL N N 15 122.6 0.1 . 1 . . . . 77 VAL N . 15782 1 889 . 1 1 78 78 SER H H 1 8.53 0.01 . 1 . . . . 78 SER H . 15782 1 890 . 1 1 78 78 SER HA H 1 5.12 0.01 . 1 . . . . 78 SER HA . 15782 1 891 . 1 1 78 78 SER HB2 H 1 3.73 0.01 . 2 . . . . 78 SER HB2 . 15782 1 892 . 1 1 78 78 SER HB3 H 1 3.66 0.01 . 2 . . . . 78 SER HB3 . 15782 1 893 . 1 1 78 78 SER C C 13 177.4 0.1 . 1 . . . . 78 SER C . 15782 1 894 . 1 1 78 78 SER CA C 13 57.6 0.2 . 1 . . . . 78 SER CA . 15782 1 895 . 1 1 78 78 SER CB C 13 64.1 0.2 . 1 . . . . 78 SER CB . 15782 1 896 . 1 1 78 78 SER N N 15 122.5 0.1 . 1 . . . . 78 SER N . 15782 1 897 . 1 1 79 79 ILE H H 1 9.24 0.01 . 1 . . . . 79 ILE H . 15782 1 898 . 1 1 79 79 ILE HA H 1 4.18 0.01 . 1 . . . . 79 ILE HA . 15782 1 899 . 1 1 79 79 ILE HB H 1 1.50 0.01 . 1 . . . . 79 ILE HB . 15782 1 900 . 1 1 79 79 ILE HD11 H 1 0.55 0.01 . 1 . . . . 79 ILE MD . 15782 1 901 . 1 1 79 79 ILE HD12 H 1 0.55 0.01 . 1 . . . . 79 ILE MD . 15782 1 902 . 1 1 79 79 ILE HD13 H 1 0.55 0.01 . 1 . . . . 79 ILE MD . 15782 1 903 . 1 1 79 79 ILE HG12 H 1 1.42 0.01 . 2 . . . . 79 ILE HG12 . 15782 1 904 . 1 1 79 79 ILE HG13 H 1 0.62 0.01 . 2 . . . . 79 ILE HG13 . 15782 1 905 . 1 1 79 79 ILE HG21 H 1 0.20 0.01 . 1 . . . . 79 ILE MG . 15782 1 906 . 1 1 79 79 ILE HG22 H 1 0.20 0.01 . 1 . . . . 79 ILE MG . 15782 1 907 . 1 1 79 79 ILE HG23 H 1 0.20 0.01 . 1 . . . . 79 ILE MG . 15782 1 908 . 1 1 79 79 ILE C C 13 177.4 0.1 . 1 . . . . 79 ILE C . 15782 1 909 . 1 1 79 79 ILE CA C 13 60.5 0.2 . 1 . . . . 79 ILE CA . 15782 1 910 . 1 1 79 79 ILE CB C 13 41.0 0.2 . 1 . . . . 79 ILE CB . 15782 1 911 . 1 1 79 79 ILE CD1 C 13 14.3 0.2 . 1 . . . . 79 ILE CD1 . 15782 1 912 . 1 1 79 79 ILE CG1 C 13 27.6 0.2 . 1 . . . . 79 ILE CG1 . 15782 1 913 . 1 1 79 79 ILE CG2 C 13 18.6 0.2 . 1 . . . . 79 ILE CG2 . 15782 1 914 . 1 1 79 79 ILE N N 15 126.8 0.1 . 1 . . . . 79 ILE N . 15782 1 915 . 1 1 80 80 GLU H H 1 8.65 0.01 . 1 . . . . 80 GLU H . 15782 1 916 . 1 1 80 80 GLU HA H 1 5.52 0.01 . 1 . . . . 80 GLU HA . 15782 1 917 . 1 1 80 80 GLU HB2 H 1 1.66 0.01 . 2 . . . . 80 GLU HB2 . 15782 1 918 . 1 1 80 80 GLU HB3 H 1 1.66 0.01 . 2 . . . . 80 GLU HB3 . 15782 1 919 . 1 1 80 80 GLU HG2 H 1 2.19 0.01 . 2 . . . . 80 GLU HG2 . 15782 1 920 . 1 1 80 80 GLU HG3 H 1 1.89 0.01 . 2 . . . . 80 GLU HG3 . 15782 1 921 . 1 1 80 80 GLU C C 13 175.6 0.1 . 1 . . . . 80 GLU C . 15782 1 922 . 1 1 80 80 GLU CA C 13 54.0 0.2 . 1 . . . . 80 GLU CA . 15782 1 923 . 1 1 80 80 GLU CB C 13 32.7 0.2 . 1 . . . . 80 GLU CB . 15782 1 924 . 1 1 80 80 GLU CG C 13 36.6 0.2 . 1 . . . . 80 GLU CG . 15782 1 925 . 1 1 80 80 GLU N N 15 127.4 0.1 . 1 . . . . 80 GLU N . 15782 1 926 . 1 1 81 81 ALA H H 1 8.87 0.01 . 1 . . . . 81 ALA H . 15782 1 927 . 1 1 81 81 ALA HA H 1 4.96 0.01 . 1 . . . . 81 ALA HA . 15782 1 928 . 1 1 81 81 ALA HB1 H 1 1.11 0.01 . 1 . . . . 81 ALA MB . 15782 1 929 . 1 1 81 81 ALA HB2 H 1 1.11 0.01 . 1 . . . . 81 ALA MB . 15782 1 930 . 1 1 81 81 ALA HB3 H 1 1.11 0.01 . 1 . . . . 81 ALA MB . 15782 1 931 . 1 1 81 81 ALA C C 13 176.0 0.1 . 1 . . . . 81 ALA C . 15782 1 932 . 1 1 81 81 ALA CA C 13 50.5 0.2 . 1 . . . . 81 ALA CA . 15782 1 933 . 1 1 81 81 ALA CB C 13 13.6 0.2 . 1 . . . . 81 ALA CB . 15782 1 934 . 1 1 81 81 ALA N N 15 127.9 0.1 . 1 . . . . 81 ALA N . 15782 1 935 . 1 1 82 82 LYS H H 1 8.88 0.01 . 1 . . . . 82 LYS H . 15782 1 936 . 1 1 82 82 LYS HA H 1 4.86 0.01 . 1 . . . . 82 LYS HA . 15782 1 937 . 1 1 82 82 LYS HB2 H 1 1.94 0.01 . 2 . . . . 82 LYS HB2 . 15782 1 938 . 1 1 82 82 LYS HB3 H 1 1.94 0.01 . 2 . . . . 82 LYS HB3 . 15782 1 939 . 1 1 82 82 LYS HD2 H 1 1.61 0.01 . 2 . . . . 82 LYS HD2 . 15782 1 940 . 1 1 82 82 LYS HD3 H 1 1.61 0.01 . 2 . . . . 82 LYS HD3 . 15782 1 941 . 1 1 82 82 LYS HG2 H 1 1.47 0.01 . 2 . . . . 82 LYS HG2 . 15782 1 942 . 1 1 82 82 LYS HG3 H 1 1.33 0.01 . 2 . . . . 82 LYS HG3 . 15782 1 943 . 1 1 82 82 LYS C C 13 177.8 0.1 . 1 . . . . 82 LYS C . 15782 1 944 . 1 1 82 82 LYS CA C 13 53.4 0.2 . 1 . . . . 82 LYS CA . 15782 1 945 . 1 1 82 82 LYS CB C 13 33.6 0.2 . 1 . . . . 82 LYS CB . 15782 1 946 . 1 1 82 82 LYS N N 15 122.5 0.2 . 1 . . . . 82 LYS N . 15782 1 947 . 1 1 84 84 PRO HA H 1 4.46 0.01 . 1 . . . . 84 PRO HA . 15782 1 948 . 1 1 84 84 PRO HB2 H 1 2.17 0.01 . 2 . . . . 84 PRO HB2 . 15782 1 949 . 1 1 84 84 PRO HB3 H 1 2.08 0.01 . 2 . . . . 84 PRO HB3 . 15782 1 950 . 1 1 84 84 PRO HG2 H 1 1.86 0.01 . 2 . . . . 84 PRO HG2 . 15782 1 951 . 1 1 84 84 PRO C C 13 175.2 0.1 . 1 . . . . 84 PRO C . 15782 1 952 . 1 1 84 84 PRO CA C 13 62.1 0.2 . 1 . . . . 84 PRO CA . 15782 1 953 . 1 1 84 84 PRO CB C 13 32.6 0.2 . 1 . . . . 84 PRO CB . 15782 1 954 . 1 1 85 85 PHE H H 1 8.22 0.02 . 1 . . . . 85 PHE H . 15782 1 955 . 1 1 85 85 PHE HA H 1 4.24 0.02 . 1 . . . . 85 PHE HA . 15782 1 956 . 1 1 85 85 PHE HB2 H 1 3.07 0.02 . 2 . . . . 85 PHE HB2 . 15782 1 957 . 1 1 85 85 PHE HB3 H 1 2.95 0.02 . 2 . . . . 85 PHE HB3 . 15782 1 958 . 1 1 85 85 PHE HD1 H 1 7.26 0.02 . 1 . . . . 85 PHE HD1 . 15782 1 959 . 1 1 85 85 PHE HD2 H 1 7.26 0.02 . 1 . . . . 85 PHE HD2 . 15782 1 960 . 1 1 85 85 PHE HE1 H 1 7.40 0.02 . 1 . . . . 85 PHE HE1 . 15782 1 961 . 1 1 85 85 PHE HE2 H 1 7.40 0.02 . 1 . . . . 85 PHE HE2 . 15782 1 962 . 1 1 85 85 PHE HZ H 1 7.34 0.02 . 1 . . . . 85 PHE HZ . 15782 1 963 . 1 1 85 85 PHE C C 13 174.3 0.1 . 1 . . . . 85 PHE C . 15782 1 964 . 1 1 85 85 PHE CA C 13 59.7 0.01 . 1 . . . . 85 PHE CA . 15782 1 965 . 1 1 85 85 PHE CB C 13 39.8 0.01 . 1 . . . . 85 PHE CB . 15782 1 966 . 1 1 85 85 PHE N N 15 118.5 0.1 . 1 . . . . 85 PHE N . 15782 1 967 . 1 1 86 86 GLY H H 1 8.55 0.01 . 1 . . . . 86 GLY H . 15782 1 968 . 1 1 86 86 GLY HA2 H 1 4.11 0.01 . 2 . . . . 86 GLY HA2 . 15782 1 969 . 1 1 86 86 GLY HA3 H 1 3.34 0.01 . 2 . . . . 86 GLY HA3 . 15782 1 970 . 1 1 86 86 GLY C C 13 177.0 0.1 . 1 . . . . 86 GLY C . 15782 1 971 . 1 1 86 86 GLY CA C 13 44.7 0.2 . 1 . . . . 86 GLY CA . 15782 1 972 . 1 1 86 86 GLY N N 15 111.5 0.1 . 1 . . . . 86 GLY N . 15782 1 973 . 1 1 87 87 GLU H H 1 8.75 0.01 . 1 . . . . 87 GLU H . 15782 1 974 . 1 1 87 87 GLU HA H 1 4.59 0.01 . 1 . . . . 87 GLU HA . 15782 1 975 . 1 1 87 87 GLU HB2 H 1 1.95 0.01 . 1 . . . . 87 GLU HB2 . 15782 1 976 . 1 1 87 87 GLU HB3 H 1 1.95 0.01 . 1 . . . . 87 GLU HB3 . 15782 1 977 . 1 1 87 87 GLU HG2 H 1 2.10 0.01 . 1 . . . . 87 GLU HG2 . 15782 1 978 . 1 1 87 87 GLU HG3 H 1 2.10 0.01 . 1 . . . . 87 GLU HG3 . 15782 1 979 . 1 1 87 87 GLU C C 13 175.0 0.1 . 1 . . . . 87 GLU C . 15782 1 980 . 1 1 87 87 GLU CA C 13 56.4 0.2 . 1 . . . . 87 GLU CA . 15782 1 981 . 1 1 87 87 GLU CB C 13 30.4 0.2 . 1 . . . . 87 GLU CB . 15782 1 982 . 1 1 87 87 GLU CG C 13 36.3 0.2 . 1 . . . . 87 GLU CG . 15782 1 983 . 1 1 87 87 GLU N N 15 125.4 0.1 . 1 . . . . 87 GLU N . 15782 1 984 . 1 1 88 88 SER H H 1 8.56 0.01 . 1 . . . . 88 SER H . 15782 1 985 . 1 1 88 88 SER HA H 1 4.66 0.01 . 1 . . . . 88 SER HA . 15782 1 986 . 1 1 88 88 SER HB2 H 1 3.83 0.01 . 2 . . . . 88 SER HB2 . 15782 1 987 . 1 1 88 88 SER HB3 H 1 3.74 0.01 . 2 . . . . 88 SER HB3 . 15782 1 988 . 1 1 88 88 SER C C 13 178.7 0.1 . 1 . . . . 88 SER C . 15782 1 989 . 1 1 88 88 SER CA C 13 58.2 0.2 . 1 . . . . 88 SER CA . 15782 1 990 . 1 1 88 88 SER CB C 13 65.8 0.2 . 1 . . . . 88 SER CB . 15782 1 991 . 1 1 88 88 SER N N 15 119.4 0.1 . 1 . . . . 88 SER N . 15782 1 992 . 1 1 89 89 TYR H H 1 8.72 0.01 . 1 . . . . 89 TYR H . 15782 1 993 . 1 1 89 89 TYR HA H 1 5.40 0.02 . 1 . . . . 89 TYR HA . 15782 1 994 . 1 1 89 89 TYR HB2 H 1 2.63 0.02 . 2 . . . . 89 TYR HB2 . 15782 1 995 . 1 1 89 89 TYR HB3 H 1 2.51 0.02 . 2 . . . . 89 TYR HB3 . 15782 1 996 . 1 1 89 89 TYR HD1 H 1 6.88 0.02 . 3 . . . . 89 TYR HD1 . 15782 1 997 . 1 1 89 89 TYR HD2 H 1 6.88 0.02 . 3 . . . . 89 TYR HD2 . 15782 1 998 . 1 1 89 89 TYR HE1 H 1 6.76 0.02 . 3 . . . . 89 TYR HE1 . 15782 1 999 . 1 1 89 89 TYR HE2 H 1 6.76 0.02 . 3 . . . . 89 TYR HE2 . 15782 1 1000 . 1 1 89 89 TYR C C 13 175.1 0.1 . 1 . . . . 89 TYR C . 15782 1 1001 . 1 1 89 89 TYR CA C 13 55.6 0.2 . 1 . . . . 89 TYR CA . 15782 1 1002 . 1 1 89 89 TYR CB C 13 41.7 0.2 . 1 . . . . 89 TYR CB . 15782 1 1003 . 1 1 89 89 TYR N N 15 116.0 0.1 . 1 . . . . 89 TYR N . 15782 1 1004 . 1 1 90 90 ILE H H 1 9.24 0.01 . 1 . . . . 90 ILE H . 15782 1 1005 . 1 1 90 90 ILE HA H 1 4.23 0.01 . 1 . . . . 90 ILE HA . 15782 1 1006 . 1 1 90 90 ILE HB H 1 1.65 0.01 . 1 . . . . 90 ILE HB . 15782 1 1007 . 1 1 90 90 ILE HD11 H 1 0.55 0.01 . 1 . . . . 90 ILE MD . 15782 1 1008 . 1 1 90 90 ILE HD12 H 1 0.55 0.01 . 1 . . . . 90 ILE MD . 15782 1 1009 . 1 1 90 90 ILE HD13 H 1 0.55 0.01 . 1 . . . . 90 ILE MD . 15782 1 1010 . 1 1 90 90 ILE HG12 H 1 1.57 0.01 . 2 . . . . 90 ILE HG12 . 15782 1 1011 . 1 1 90 90 ILE HG13 H 1 0.82 0.01 . 2 . . . . 90 ILE HG13 . 15782 1 1012 . 1 1 90 90 ILE HG21 H 1 0.61 0.01 . 1 . . . . 90 ILE MG . 15782 1 1013 . 1 1 90 90 ILE HG22 H 1 0.61 0.01 . 1 . . . . 90 ILE MG . 15782 1 1014 . 1 1 90 90 ILE HG23 H 1 0.61 0.01 . 1 . . . . 90 ILE MG . 15782 1 1015 . 1 1 90 90 ILE C C 13 176.9 0.1 . 1 . . . . 90 ILE C . 15782 1 1016 . 1 1 90 90 ILE CA C 13 61.0 0.2 . 1 . . . . 90 ILE CA . 15782 1 1017 . 1 1 90 90 ILE CB C 13 40.4 0.2 . 1 . . . . 90 ILE CB . 15782 1 1018 . 1 1 90 90 ILE CD1 C 13 13.9 0.2 . 1 . . . . 90 ILE CD1 . 15782 1 1019 . 1 1 90 90 ILE CG1 C 13 28.2 0.2 . 1 . . . . 90 ILE CG1 . 15782 1 1020 . 1 1 90 90 ILE CG2 C 13 18.3 0.2 . 1 . . . . 90 ILE CG2 . 15782 1 1021 . 1 1 90 90 ILE N N 15 124.7 0.1 . 1 . . . . 90 ILE N . 15782 1 1022 . 1 1 91 91 VAL H H 1 8.62 0.01 . 1 . . . . 91 VAL H . 15782 1 1023 . 1 1 91 91 VAL HA H 1 5.06 0.02 . 1 . . . . 91 VAL HA . 15782 1 1024 . 1 1 91 91 VAL HB H 1 1.82 0.02 . 1 . . . . 91 VAL HB . 15782 1 1025 . 1 1 91 91 VAL HG11 H 1 0.65 0.02 . 2 . . . . 91 VAL MG1 . 15782 1 1026 . 1 1 91 91 VAL HG12 H 1 0.65 0.02 . 2 . . . . 91 VAL MG1 . 15782 1 1027 . 1 1 91 91 VAL HG13 H 1 0.65 0.02 . 2 . . . . 91 VAL MG1 . 15782 1 1028 . 1 1 91 91 VAL HG21 H 1 0.61 0.02 . 2 . . . . 91 VAL MG2 . 15782 1 1029 . 1 1 91 91 VAL HG22 H 1 0.61 0.02 . 2 . . . . 91 VAL MG2 . 15782 1 1030 . 1 1 91 91 VAL HG23 H 1 0.61 0.02 . 2 . . . . 91 VAL MG2 . 15782 1 1031 . 1 1 91 91 VAL C C 13 175.3 0.1 . 1 . . . . 91 VAL C . 15782 1 1032 . 1 1 91 91 VAL CA C 13 61.2 0.2 . 1 . . . . 91 VAL CA . 15782 1 1033 . 1 1 91 91 VAL CB C 13 32.8 0.2 . 1 . . . . 91 VAL CB . 15782 1 1034 . 1 1 91 91 VAL CG1 C 13 21.8 0.2 . 2 . . . . 91 VAL CG1 . 15782 1 1035 . 1 1 91 91 VAL CG2 C 13 20.8 0.2 . 2 . . . . 91 VAL CG2 . 15782 1 1036 . 1 1 91 91 VAL N N 15 128.4 0.1 . 1 . . . . 91 VAL N . 15782 1 1037 . 1 1 92 92 VAL H H 1 8.90 0.01 . 1 . . . . 92 VAL H . 15782 1 1038 . 1 1 92 92 VAL HA H 1 4.47 0.01 . 1 . . . . 92 VAL HA . 15782 1 1039 . 1 1 92 92 VAL HB H 1 1.83 0.01 . 1 . . . . 92 VAL HB . 15782 1 1040 . 1 1 92 92 VAL HG11 H 1 0.16 0.01 . 2 . . . . 92 VAL MG1 . 15782 1 1041 . 1 1 92 92 VAL HG12 H 1 0.16 0.01 . 2 . . . . 92 VAL MG1 . 15782 1 1042 . 1 1 92 92 VAL HG13 H 1 0.16 0.01 . 2 . . . . 92 VAL MG1 . 15782 1 1043 . 1 1 92 92 VAL HG21 H 1 0.67 0.01 . 2 . . . . 92 VAL MG2 . 15782 1 1044 . 1 1 92 92 VAL HG22 H 1 0.67 0.01 . 2 . . . . 92 VAL MG2 . 15782 1 1045 . 1 1 92 92 VAL HG23 H 1 0.67 0.01 . 2 . . . . 92 VAL MG2 . 15782 1 1046 . 1 1 92 92 VAL C C 13 175.4 0.1 . 1 . . . . 92 VAL C . 15782 1 1047 . 1 1 92 92 VAL CA C 13 61.1 0.2 . 1 . . . . 92 VAL CA . 15782 1 1048 . 1 1 92 92 VAL CB C 13 33.6 0.2 . 1 . . . . 92 VAL CB . 15782 1 1049 . 1 1 92 92 VAL CG1 C 13 21.6 0.2 . 2 . . . . 92 VAL CG1 . 15782 1 1050 . 1 1 92 92 VAL CG2 C 13 20.6 0.2 . 2 . . . . 92 VAL CG2 . 15782 1 1051 . 1 1 92 92 VAL N N 15 128.5 0.1 . 1 . . . . 92 VAL N . 15782 1 1052 . 1 1 93 93 GLY H H 1 8.52 0.01 . 1 . . . . 93 GLY H . 15782 1 1053 . 1 1 93 93 GLY HA2 H 1 5.01 0.02 . 2 . . . . 93 GLY HA2 . 15782 1 1054 . 1 1 93 93 GLY HA3 H 1 3.75 0.02 . 2 . . . . 93 GLY HA3 . 15782 1 1055 . 1 1 93 93 GLY C C 13 179.0 0.1 . 1 . . . . 93 GLY C . 15782 1 1056 . 1 1 93 93 GLY CA C 13 43.6 0.2 . 1 . . . . 93 GLY CA . 15782 1 1057 . 1 1 93 93 GLY N N 15 113.3 0.1 . 1 . . . . 93 GLY N . 15782 1 1058 . 1 1 94 94 ALA H H 1 8.61 0.01 . 1 . . . . 94 ALA H . 15782 1 1059 . 1 1 94 94 ALA HA H 1 4.75 0.02 . 1 . . . . 94 ALA HA . 15782 1 1060 . 1 1 94 94 ALA HB1 H 1 1.43 0.02 . 1 . . . . 94 ALA MB . 15782 1 1061 . 1 1 94 94 ALA HB2 H 1 1.43 0.02 . 1 . . . . 94 ALA MB . 15782 1 1062 . 1 1 94 94 ALA HB3 H 1 1.43 0.02 . 1 . . . . 94 ALA MB . 15782 1 1063 . 1 1 94 94 ALA C C 13 172.3 0.1 . 1 . . . . 94 ALA C . 15782 1 1064 . 1 1 94 94 ALA CA C 13 50.9 0.2 . 1 . . . . 94 ALA CA . 15782 1 1065 . 1 1 94 94 ALA CB C 13 22.7 0.2 . 1 . . . . 94 ALA CB . 15782 1 1066 . 1 1 94 94 ALA N N 15 121.4 0.1 . 1 . . . . 94 ALA N . 15782 1 1067 . 1 1 95 95 GLY H H 1 8.59 0.01 . 1 . . . . 95 GLY H . 15782 1 1068 . 1 1 95 95 GLY HA2 H 1 4.19 0.02 . 2 . . . . 95 GLY HA2 . 15782 1 1069 . 1 1 95 95 GLY HA3 H 1 3.88 0.02 . 2 . . . . 95 GLY HA3 . 15782 1 1070 . 1 1 95 95 GLY C C 13 175.2 0.1 . 1 . . . . 95 GLY C . 15782 1 1071 . 1 1 95 95 GLY CA C 13 45.3 0.2 . 1 . . . . 95 GLY CA . 15782 1 1072 . 1 1 95 95 GLY N N 15 108.9 0.1 . 1 . . . . 95 GLY N . 15782 1 1073 . 1 1 96 96 GLU H H 1 8.88 0.01 . 1 . . . . 96 GLU H . 15782 1 1074 . 1 1 96 96 GLU HA H 1 4.11 0.01 . 1 . . . . 96 GLU HA . 15782 1 1075 . 1 1 96 96 GLU HB2 H 1 2.09 0.01 . 1 . . . . 96 GLU HB2 . 15782 1 1076 . 1 1 96 96 GLU HB3 H 1 2.09 0.01 . 1 . . . . 96 GLU HB3 . 15782 1 1077 . 1 1 96 96 GLU HG2 H 1 2.34 0.01 . 1 . . . . 96 GLU HG2 . 15782 1 1078 . 1 1 96 96 GLU HG3 H 1 2.34 0.01 . 1 . . . . 96 GLU HG3 . 15782 1 1079 . 1 1 96 96 GLU C C 13 172.9 0.1 . 1 . . . . 96 GLU C . 15782 1 1080 . 1 1 96 96 GLU CA C 13 58.8 0.2 . 1 . . . . 96 GLU CA . 15782 1 1081 . 1 1 96 96 GLU CB C 13 29.9 0.2 . 1 . . . . 96 GLU CB . 15782 1 1082 . 1 1 96 96 GLU CG C 13 36.5 0.2 . 1 . . . . 96 GLU CG . 15782 1 1083 . 1 1 96 96 GLU N N 15 121.8 0.1 . 1 . . . . 96 GLU N . 15782 1 1084 . 1 1 97 97 LYS H H 1 8.32 0.01 . 1 . . . . 97 LYS H . 15782 1 1085 . 1 1 97 97 LYS HA H 1 4.47 0.01 . 1 . . . . 97 LYS HA . 15782 1 1086 . 1 1 97 97 LYS HB2 H 1 2.13 0.01 . 2 . . . . 97 LYS HB2 . 15782 1 1087 . 1 1 97 97 LYS HB3 H 1 1.81 0.01 . 2 . . . . 97 LYS HB3 . 15782 1 1088 . 1 1 97 97 LYS HD2 H 1 1.69 0.01 . 2 . . . . 97 LYS HD2 . 15782 1 1089 . 1 1 97 97 LYS HD3 H 1 1.69 0.01 . 2 . . . . 97 LYS HD3 . 15782 1 1090 . 1 1 97 97 LYS HE2 H 1 3.01 0.01 . 2 . . . . 97 LYS HE2 . 15782 1 1091 . 1 1 97 97 LYS HE3 H 1 3.01 0.01 . 2 . . . . 97 LYS HE3 . 15782 1 1092 . 1 1 97 97 LYS HG2 H 1 1.51 0.01 . 2 . . . . 97 LYS HG2 . 15782 1 1093 . 1 1 97 97 LYS HG3 H 1 1.38 0.01 . 2 . . . . 97 LYS HG3 . 15782 1 1094 . 1 1 97 97 LYS C C 13 174.8 0.1 . 1 . . . . 97 LYS C . 15782 1 1095 . 1 1 97 97 LYS CA C 13 55.2 0.2 . 1 . . . . 97 LYS CA . 15782 1 1096 . 1 1 97 97 LYS CB C 13 31.6 0.2 . 1 . . . . 97 LYS CB . 15782 1 1097 . 1 1 97 97 LYS CD C 13 29.0 0.2 . 1 . . . . 97 LYS CD . 15782 1 1098 . 1 1 97 97 LYS CE C 13 42.3 0.2 . 1 . . . . 97 LYS CE . 15782 1 1099 . 1 1 97 97 LYS CG C 13 25.4 0.2 . 1 . . . . 97 LYS CG . 15782 1 1100 . 1 1 97 97 LYS N N 15 117.6 0.1 . 1 . . . . 97 LYS N . 15782 1 1101 . 1 1 98 98 ALA H H 1 7.07 0.01 . 1 . . . . 98 ALA H . 15782 1 1102 . 1 1 98 98 ALA HA H 1 4.08 0.01 . 1 . . . . 98 ALA HA . 15782 1 1103 . 1 1 98 98 ALA HB1 H 1 0.99 0.01 . 1 . . . . 98 ALA MB . 15782 1 1104 . 1 1 98 98 ALA HB2 H 1 0.99 0.01 . 1 . . . . 98 ALA MB . 15782 1 1105 . 1 1 98 98 ALA HB3 H 1 0.99 0.01 . 1 . . . . 98 ALA MB . 15782 1 1106 . 1 1 98 98 ALA C C 13 174.0 0.1 . 1 . . . . 98 ALA C . 15782 1 1107 . 1 1 98 98 ALA CA C 13 53.4 0.2 . 1 . . . . 98 ALA CA . 15782 1 1108 . 1 1 98 98 ALA CB C 13 19.0 0.2 . 1 . . . . 98 ALA CB . 15782 1 1109 . 1 1 98 98 ALA N N 15 123.6 0.1 . 1 . . . . 98 ALA N . 15782 1 1110 . 1 1 99 99 LEU H H 1 8.68 0.01 . 1 . . . . 99 LEU H . 15782 1 1111 . 1 1 99 99 LEU HA H 1 4.40 0.01 . 1 . . . . 99 LEU HA . 15782 1 1112 . 1 1 99 99 LEU HB2 H 1 1.80 0.01 . 2 . . . . 99 LEU HB2 . 15782 1 1113 . 1 1 99 99 LEU HB3 H 1 1.80 0.01 . 2 . . . . 99 LEU HB3 . 15782 1 1114 . 1 1 99 99 LEU HD11 H 1 0.96 0.01 . 2 . . . . 99 LEU MD1 . 15782 1 1115 . 1 1 99 99 LEU HD12 H 1 0.96 0.01 . 2 . . . . 99 LEU MD1 . 15782 1 1116 . 1 1 99 99 LEU HD13 H 1 0.96 0.01 . 2 . . . . 99 LEU MD1 . 15782 1 1117 . 1 1 99 99 LEU HD21 H 1 0.87 0.01 . 2 . . . . 99 LEU MD2 . 15782 1 1118 . 1 1 99 99 LEU HD22 H 1 0.87 0.01 . 2 . . . . 99 LEU MD2 . 15782 1 1119 . 1 1 99 99 LEU HD23 H 1 0.87 0.01 . 2 . . . . 99 LEU MD2 . 15782 1 1120 . 1 1 99 99 LEU HG H 1 1.57 0.01 . 1 . . . . 99 LEU HG . 15782 1 1121 . 1 1 99 99 LEU C C 13 176.4 0.01 . 1 . . . . 99 LEU C . 15782 1 1122 . 1 1 99 99 LEU CA C 13 54.7 0.2 . 1 . . . . 99 LEU CA . 15782 1 1123 . 1 1 99 99 LEU CB C 13 42.9 0.2 . 1 . . . . 99 LEU CB . 15782 1 1124 . 1 1 99 99 LEU CD1 C 13 24.7 0.2 . 1 . . . . 99 LEU CD1 . 15782 1 1125 . 1 1 99 99 LEU CD2 C 13 24.7 0.2 . 1 . . . . 99 LEU CD2 . 15782 1 1126 . 1 1 99 99 LEU CG C 13 27.3 0.2 . 1 . . . . 99 LEU CG . 15782 1 1127 . 1 1 99 99 LEU N N 15 125.8 0.1 . 1 . . . . 99 LEU N . 15782 1 1128 . 1 1 100 100 LYS H H 1 8.42 0.01 . 1 . . . . 100 LYS H . 15782 1 1129 . 1 1 100 100 LYS HA H 1 5.00 0.02 . 1 . . . . 100 LYS HA . 15782 1 1130 . 1 1 100 100 LYS HB2 H 1 1.61 0.02 . 2 . . . . 100 LYS HB2 . 15782 1 1131 . 1 1 100 100 LYS HB3 H 1 1.55 0.02 . 2 . . . . 100 LYS HB3 . 15782 1 1132 . 1 1 100 100 LYS HD2 H 1 1.35 0.02 . 2 . . . . 100 LYS HD2 . 15782 1 1133 . 1 1 100 100 LYS HD3 H 1 1.35 0.02 . 2 . . . . 100 LYS HD3 . 15782 1 1134 . 1 1 100 100 LYS HE2 H 1 2.39 0.02 . 2 . . . . 100 LYS HE2 . 15782 1 1135 . 1 1 100 100 LYS HE3 H 1 2.32 0.02 . 2 . . . . 100 LYS HE3 . 15782 1 1136 . 1 1 100 100 LYS HG2 H 1 1.13 0.02 . 2 . . . . 100 LYS HG2 . 15782 1 1137 . 1 1 100 100 LYS HG3 H 1 1.08 0.02 . 2 . . . . 100 LYS HG3 . 15782 1 1138 . 1 1 100 100 LYS C C 13 175.4 0.1 . 1 . . . . 100 LYS C . 15782 1 1139 . 1 1 100 100 LYS CA C 13 55.5 0.2 . 1 . . . . 100 LYS CA . 15782 1 1140 . 1 1 100 100 LYS CB C 13 33.7 0.2 . 1 . . . . 100 LYS CB . 15782 1 1141 . 1 1 100 100 LYS CD C 13 29.5 0.2 . 1 . . . . 100 LYS CD . 15782 1 1142 . 1 1 100 100 LYS CE C 13 41.5 0.2 . 1 . . . . 100 LYS CE . 15782 1 1143 . 1 1 100 100 LYS CG C 13 25.6 0.2 . 1 . . . . 100 LYS CG . 15782 1 1144 . 1 1 100 100 LYS N N 15 127.1 0.1 . 1 . . . . 100 LYS N . 15782 1 1145 . 1 1 101 101 LEU H H 1 9.48 0.01 . 1 . . . . 101 LEU H . 15782 1 1146 . 1 1 101 101 LEU HA H 1 4.82 0.01 . 1 . . . . 101 LEU HA . 15782 1 1147 . 1 1 101 101 LEU HB2 H 1 1.94 0.01 . 2 . . . . 101 LEU HB2 . 15782 1 1148 . 1 1 101 101 LEU HB3 H 1 1.63 0.01 . 2 . . . . 101 LEU HB3 . 15782 1 1149 . 1 1 101 101 LEU HD11 H 1 0.83 0.01 . 2 . . . . 101 LEU MD1 . 15782 1 1150 . 1 1 101 101 LEU HD12 H 1 0.83 0.01 . 2 . . . . 101 LEU MD1 . 15782 1 1151 . 1 1 101 101 LEU HD13 H 1 0.83 0.01 . 2 . . . . 101 LEU MD1 . 15782 1 1152 . 1 1 101 101 LEU HD21 H 1 0.99 0.01 . 2 . . . . 101 LEU MD2 . 15782 1 1153 . 1 1 101 101 LEU HD22 H 1 0.99 0.01 . 2 . . . . 101 LEU MD2 . 15782 1 1154 . 1 1 101 101 LEU HD23 H 1 0.99 0.01 . 2 . . . . 101 LEU MD2 . 15782 1 1155 . 1 1 101 101 LEU HG H 1 1.67 0.01 . 1 . . . . 101 LEU HG . 15782 1 1156 . 1 1 101 101 LEU C C 13 174.7 0.1 . 1 . . . . 101 LEU C . 15782 1 1157 . 1 1 101 101 LEU CA C 13 53.5 0.2 . 1 . . . . 101 LEU CA . 15782 1 1158 . 1 1 101 101 LEU CB C 13 43.6 0.2 . 1 . . . . 101 LEU CB . 15782 1 1159 . 1 1 101 101 LEU CD1 C 13 26.6 0.2 . 2 . . . . 101 LEU CD1 . 15782 1 1160 . 1 1 101 101 LEU CD2 C 13 24.5 0.2 . 2 . . . . 101 LEU CD2 . 15782 1 1161 . 1 1 101 101 LEU CG C 13 26.6 0.2 . 1 . . . . 101 LEU CG . 15782 1 1162 . 1 1 101 101 LEU N N 15 128.1 0.1 . 1 . . . . 101 LEU N . 15782 1 1163 . 1 1 102 102 SER H H 1 8.66 0.01 . 1 . . . . 102 SER H . 15782 1 1164 . 1 1 102 102 SER HA H 1 4.66 0.01 . 1 . . . . 102 SER HA . 15782 1 1165 . 1 1 102 102 SER HB2 H 1 3.78 0.01 . 2 . . . . 102 SER HB2 . 15782 1 1166 . 1 1 102 102 SER HB3 H 1 3.78 0.01 . 2 . . . . 102 SER HB3 . 15782 1 1167 . 1 1 102 102 SER C C 13 177.2 0.1 . 1 . . . . 102 SER C . 15782 1 1168 . 1 1 102 102 SER CA C 13 58.1 0.2 . 1 . . . . 102 SER CA . 15782 1 1169 . 1 1 102 102 SER CB C 13 64.4 0.2 . 1 . . . . 102 SER CB . 15782 1 1170 . 1 1 102 102 SER N N 15 119.1 0.2 . 1 . . . . 102 SER N . 15782 1 1171 . 1 1 103 103 TRP H H 1 8.61 0.01 . 1 . . . . 103 TRP H . 15782 1 1172 . 1 1 103 103 TRP HA H 1 4.76 0.02 . 1 . . . . 103 TRP HA . 15782 1 1173 . 1 1 103 103 TRP HB2 H 1 2.95 0.02 . 1 . . . . 103 TRP HB2 . 15782 1 1174 . 1 1 103 103 TRP HB3 H 1 2.95 0.02 . 1 . . . . 103 TRP HB3 . 15782 1 1175 . 1 1 103 103 TRP HD1 H 1 7.07 0.02 . 1 . . . . 103 TRP HD1 . 15782 1 1176 . 1 1 103 103 TRP HE1 H 1 10.11 0.02 . 1 . . . . 103 TRP HE1 . 15782 1 1177 . 1 1 103 103 TRP HE3 H 1 7.68 0.02 . 1 . . . . 103 TRP HE3 . 15782 1 1178 . 1 1 103 103 TRP HH2 H 1 7.15 0.02 . 1 . . . . 103 TRP HH2 . 15782 1 1179 . 1 1 103 103 TRP HZ2 H 1 7.41 0.02 . 1 . . . . 103 TRP HZ2 . 15782 1 1180 . 1 1 103 103 TRP HZ3 H 1 7.08 0.02 . 1 . . . . 103 TRP HZ3 . 15782 1 1181 . 1 1 103 103 TRP C C 13 177.6 0.1 . 1 . . . . 103 TRP C . 15782 1 1182 . 1 1 103 103 TRP CA C 13 56.8 0.2 . 1 . . . . 103 TRP CA . 15782 1 1183 . 1 1 103 103 TRP CB C 13 32.3 0.2 . 1 . . . . 103 TRP CB . 15782 1 1184 . 1 1 103 103 TRP N N 15 125.1 0.1 . 1 . . . . 103 TRP N . 15782 1 1185 . 1 1 103 103 TRP NE1 N 15 129.2 0.1 . 1 . . . . 103 TRP NE1 . 15782 1 1186 . 1 1 104 104 PHE H H 1 6.82 0.01 . 1 . . . . 104 PHE H . 15782 1 1187 . 1 1 104 104 PHE HA H 1 4.71 0.02 . 1 . . . . 104 PHE HA . 15782 1 1188 . 1 1 104 104 PHE HB2 H 1 2.75 0.02 . 2 . . . . 104 PHE HB2 . 15782 1 1189 . 1 1 104 104 PHE HB3 H 1 2.66 0.02 . 2 . . . . 104 PHE HB3 . 15782 1 1190 . 1 1 104 104 PHE HD1 H 1 6.95 0.02 . 3 . . . . 104 PHE HD1 . 15782 1 1191 . 1 1 104 104 PHE HD2 H 1 6.95 0.02 . 3 . . . . 104 PHE HD2 . 15782 1 1192 . 1 1 104 104 PHE HE1 H 1 7.23 0.02 . 3 . . . . 104 PHE HE1 . 15782 1 1193 . 1 1 104 104 PHE HE2 H 1 7.23 0.02 . 3 . . . . 104 PHE HE2 . 15782 1 1194 . 1 1 104 104 PHE HZ H 1 7.27 0.02 . 1 . . . . 104 PHE HZ . 15782 1 1195 . 1 1 104 104 PHE C C 13 177.3 0.1 . 1 . . . . 104 PHE C . 15782 1 1196 . 1 1 104 104 PHE CA C 13 56.3 0.2 . 1 . . . . 104 PHE CA . 15782 1 1197 . 1 1 104 104 PHE CB C 13 40.8 0.2 . 1 . . . . 104 PHE CB . 15782 1 1198 . 1 1 104 104 PHE N N 15 124.8 0.1 . 1 . . . . 104 PHE N . 15782 1 1199 . 1 1 105 105 LYS H H 1 7.82 0.01 . 1 . . . . 105 LYS H . 15782 1 1200 . 1 1 105 105 LYS HA H 1 4.29 0.01 . 1 . . . . 105 LYS HA . 15782 1 1201 . 1 1 105 105 LYS HB2 H 1 1.94 0.02 . 2 . . . . 105 LYS HB2 . 15782 1 1202 . 1 1 105 105 LYS HB3 H 1 1.47 0.02 . 2 . . . . 105 LYS HB3 . 15782 1 1203 . 1 1 105 105 LYS HD2 H 1 2.24 0.02 . 2 . . . . 105 LYS HD2 . 15782 1 1204 . 1 1 105 105 LYS HD3 H 1 1.94 0.02 . 2 . . . . 105 LYS HD3 . 15782 1 1205 . 1 1 105 105 LYS HG2 H 1 1.34 0.02 . 2 . . . . 105 LYS HG2 . 15782 1 1206 . 1 1 105 105 LYS HG3 H 1 1.34 0.02 . 2 . . . . 105 LYS HG3 . 15782 1 1207 . 1 1 105 105 LYS C C 13 175.3 0.2 . 1 . . . . 105 LYS C . 15782 1 1208 . 1 1 105 105 LYS CA C 13 55.0 0.2 . 1 . . . . 105 LYS CA . 15782 1 1209 . 1 1 105 105 LYS CB C 13 34.1 0.2 . 1 . . . . 105 LYS CB . 15782 1 1210 . 1 1 105 105 LYS CD C 13 29.3 0.2 . 1 . . . . 105 LYS CD . 15782 1 1211 . 1 1 105 105 LYS CG C 13 24.8 0.2 . 1 . . . . 105 LYS CG . 15782 1 1212 . 1 1 105 105 LYS N N 15 127.5 0.1 . 1 . . . . 105 LYS N . 15782 1 1213 . 1 1 106 106 LYS H H 1 8.55 0.01 . 1 . . . . 106 LYS H . 15782 1 1214 . 1 1 106 106 LYS HA H 1 4.16 0.02 . 1 . . . . 106 LYS HA . 15782 1 1215 . 1 1 106 106 LYS HB2 H 1 1.81 0.02 . 2 . . . . 106 LYS HB2 . 15782 1 1216 . 1 1 106 106 LYS HB3 H 1 1.81 0.02 . 2 . . . . 106 LYS HB3 . 15782 1 1217 . 1 1 106 106 LYS HD2 H 1 1.69 0.02 . 2 . . . . 106 LYS HD2 . 15782 1 1218 . 1 1 106 106 LYS HD3 H 1 1.69 0.02 . 2 . . . . 106 LYS HD3 . 15782 1 1219 . 1 1 106 106 LYS HE2 H 1 3.00 0.02 . 2 . . . . 106 LYS HE2 . 15782 1 1220 . 1 1 106 106 LYS HE3 H 1 3.00 0.02 . 2 . . . . 106 LYS HE3 . 15782 1 1221 . 1 1 106 106 LYS HG2 H 1 1.46 0.02 . 2 . . . . 106 LYS HG2 . 15782 1 1222 . 1 1 106 106 LYS HG3 H 1 1.46 0.02 . 2 . . . . 106 LYS HG3 . 15782 1 1223 . 1 1 106 106 LYS C C 13 174.2 0.1 . 1 . . . . 106 LYS C . 15782 1 1224 . 1 1 106 106 LYS CA C 13 56.8 0.2 . 1 . . . . 106 LYS CA . 15782 1 1225 . 1 1 106 106 LYS CB C 13 33.5 0.2 . 1 . . . . 106 LYS CB . 15782 1 1226 . 1 1 106 106 LYS CD C 13 29.4 0.2 . 1 . . . . 106 LYS CD . 15782 1 1227 . 1 1 106 106 LYS CE C 13 42.3 0.2 . 1 . . . . 106 LYS CE . 15782 1 1228 . 1 1 106 106 LYS CG C 13 24.9 0.2 . 1 . . . . 106 LYS CG . 15782 1 1229 . 1 1 106 106 LYS N N 15 127.7 0.1 . 1 . . . . 106 LYS N . 15782 1 1230 . 1 1 107 107 GLY H H 1 8.44 0.01 . 1 . . . . 107 GLY H . 15782 1 1231 . 1 1 107 107 GLY HA2 H 1 4.01 0.03 . 2 . . . . 107 GLY HA2 . 15782 1 1232 . 1 1 107 107 GLY HA3 H 1 3.94 0.03 . 2 . . . . 107 GLY HA3 . 15782 1 1233 . 1 1 107 107 GLY C C 13 177.0 0.1 . 1 . . . . 107 GLY C . 15782 1 1234 . 1 1 107 107 GLY CA C 13 45.1 0.2 . 1 . . . . 107 GLY CA . 15782 1 1235 . 1 1 107 107 GLY N N 15 110.4 0.1 . 1 . . . . 107 GLY N . 15782 1 1236 . 1 1 108 108 SER H H 1 8.07 0.01 . 1 . . . . 108 SER H . 15782 1 1237 . 1 1 108 108 SER HA H 1 4.35 0.01 . 1 . . . . 108 SER HA . 15782 1 1238 . 1 1 108 108 SER HB2 H 1 3.83 0.01 . 2 . . . . 108 SER HB2 . 15782 1 1239 . 1 1 108 108 SER HB3 H 1 3.77 0.01 . 2 . . . . 108 SER HB3 . 15782 1 1240 . 1 1 108 108 SER C C 13 176.3 0.1 . 1 . . . . 108 SER C . 15782 1 1241 . 1 1 108 108 SER CA C 13 58.1 0.2 . 1 . . . . 108 SER CA . 15782 1 1242 . 1 1 108 108 SER CB C 13 63.9 0.2 . 1 . . . . 108 SER CB . 15782 1 1243 . 1 1 108 108 SER N N 15 115.5 0.1 . 1 . . . . 108 SER N . 15782 1 1244 . 1 1 109 109 SER H H 1 8.40 0.01 . 1 . . . . 109 SER H . 15782 1 1245 . 1 1 109 109 SER HA H 1 4.44 0.01 . 1 . . . . 109 SER HA . 15782 1 1246 . 1 1 109 109 SER HB2 H 1 3.87 0.01 . 2 . . . . 109 SER HB2 . 15782 1 1247 . 1 1 109 109 SER HB3 H 1 3.85 0.01 . 2 . . . . 109 SER HB3 . 15782 1 1248 . 1 1 109 109 SER C C 13 176.3 0.1 . 1 . . . . 109 SER C . 15782 1 1249 . 1 1 109 109 SER CA C 13 58.3 0.2 . 1 . . . . 109 SER CA . 15782 1 1250 . 1 1 109 109 SER CB C 13 63.6 0.2 . 1 . . . . 109 SER CB . 15782 1 1251 . 1 1 109 109 SER N N 15 118.6 0.1 . 1 . . . . 109 SER N . 15782 1 1252 . 1 1 110 110 ILE H H 1 8.08 0.01 . 1 . . . . 110 ILE H . 15782 1 1253 . 1 1 110 110 ILE HA H 1 4.21 0.01 . 1 . . . . 110 ILE HA . 15782 1 1254 . 1 1 110 110 ILE HB H 1 1.90 0.01 . 1 . . . . 110 ILE HB . 15782 1 1255 . 1 1 110 110 ILE HD11 H 1 0.87 0.01 . 1 . . . . 110 ILE MD . 15782 1 1256 . 1 1 110 110 ILE HD12 H 1 0.87 0.01 . 1 . . . . 110 ILE MD . 15782 1 1257 . 1 1 110 110 ILE HD13 H 1 0.87 0.01 . 1 . . . . 110 ILE MD . 15782 1 1258 . 1 1 110 110 ILE HG12 H 1 1.47 0.01 . 2 . . . . 110 ILE HG12 . 15782 1 1259 . 1 1 110 110 ILE HG13 H 1 1.19 0.01 . 2 . . . . 110 ILE HG13 . 15782 1 1260 . 1 1 110 110 ILE HG21 H 1 0.92 0.01 . 1 . . . . 110 ILE MG . 15782 1 1261 . 1 1 110 110 ILE HG22 H 1 0.92 0.01 . 1 . . . . 110 ILE MG . 15782 1 1262 . 1 1 110 110 ILE HG23 H 1 0.92 0.01 . 1 . . . . 110 ILE MG . 15782 1 1263 . 1 1 110 110 ILE C C 13 174.1 0.1 . 1 . . . . 110 ILE C . 15782 1 1264 . 1 1 110 110 ILE CA C 13 61.6 0.2 . 1 . . . . 110 ILE CA . 15782 1 1265 . 1 1 110 110 ILE CB C 13 38.8 0.2 . 1 . . . . 110 ILE CB . 15782 1 1266 . 1 1 110 110 ILE CD1 C 13 13.1 0.2 . 1 . . . . 110 ILE CD1 . 15782 1 1267 . 1 1 110 110 ILE CG1 C 13 27.5 0.2 . 1 . . . . 110 ILE CG1 . 15782 1 1268 . 1 1 110 110 ILE CG2 C 13 17.6 0.2 . 1 . . . . 110 ILE CG2 . 15782 1 1269 . 1 1 110 110 ILE N N 15 122.5 0.1 . 1 . . . . 110 ILE N . 15782 1 1270 . 1 1 111 111 GLY H H 1 8.41 0.01 . 1 . . . . 111 GLY H . 15782 1 1271 . 1 1 111 111 GLY HA2 H 1 3.95 0.01 . 2 . . . . 111 GLY HA2 . 15782 1 1272 . 1 1 111 111 GLY HA3 H 1 3.95 0.01 . 2 . . . . 111 GLY HA3 . 15782 1 1273 . 1 1 111 111 GLY C C 13 177.7 0.1 . 1 . . . . 111 GLY C . 15782 1 1274 . 1 1 111 111 GLY CA C 13 45.5 0.2 . 1 . . . . 111 GLY CA . 15782 1 1275 . 1 1 111 111 GLY N N 15 113.9 0.1 . 1 . . . . 111 GLY N . 15782 1 1276 . 1 1 112 112 LYS H H 1 7.76 0.01 . 1 . . . . 112 LYS H . 15782 1 1277 . 1 1 112 112 LYS HA H 1 4.21 0.01 . 1 . . . . 112 LYS HA . 15782 1 1278 . 1 1 112 112 LYS HB2 H 1 1.83 0.01 . 2 . . . . 112 LYS HB2 . 15782 1 1279 . 1 1 112 112 LYS HB3 H 1 1.69 0.01 . 2 . . . . 112 LYS HB3 . 15782 1 1280 . 1 1 112 112 LYS HD2 H 1 1.70 0.01 . 2 . . . . 112 LYS HD2 . 15782 1 1281 . 1 1 112 112 LYS HD3 H 1 1.70 0.01 . 2 . . . . 112 LYS HD3 . 15782 1 1282 . 1 1 112 112 LYS HE2 H 1 2.98 0.01 . 2 . . . . 112 LYS HE2 . 15782 1 1283 . 1 1 112 112 LYS HE3 H 1 2.98 0.01 . 2 . . . . 112 LYS HE3 . 15782 1 1284 . 1 1 112 112 LYS HG2 H 1 1.38 0.01 . 2 . . . . 112 LYS HG2 . 15782 1 1285 . 1 1 112 112 LYS HG3 H 1 1.38 0.01 . 2 . . . . 112 LYS HG3 . 15782 1 1286 . 1 1 112 112 LYS C C 13 169.4 0.1 . 1 . . . . 112 LYS C . 15782 1 1287 . 1 1 112 112 LYS CA C 13 57.7 0.2 . 1 . . . . 112 LYS CA . 15782 1 1288 . 1 1 112 112 LYS CB C 13 33.9 0.2 . 1 . . . . 112 LYS CB . 15782 1 1289 . 1 1 112 112 LYS CG C 13 24.6 0.2 . 1 . . . . 112 LYS CG . 15782 1 1290 . 1 1 112 112 LYS N N 15 126.6 0.2 . 1 . . . . 112 LYS N . 15782 1 stop_ save_