data_15660 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15660 _Entry.Title ; NMR assignment of the arenaviral protein Z from Lassa fever virus ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-02-15 _Entry.Accession_date 2008-02-15 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.112 _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 Laurent Volpon . . . 15660 2 Michael Osborne . J. . 15660 3 Katherine Borden . L.B. . 15660 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15660 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 351 15660 '15N chemical shifts' 84 15660 '1H chemical shifts' 516 15660 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 5 . . 2011-06-13 2008-02-15 update author 'update related PDB entry' 15660 4 . . 2010-04-09 2008-02-15 update author 'update citation' 15660 3 . . 2010-01-27 2008-02-15 update author 'update chemical shifts' 15660 2 . . 2009-08-13 2008-02-15 update BMRB 'added PubMed ID' 15660 1 . . 2008-06-05 2008-02-15 original author 'original release' 15660 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KO5 Structure 15660 PDB 2M1S 'BMRB Entry Tracking System' 15660 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15660 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20212144 _Citation.Full_citation . _Citation.Title 'Structural characterization of the Z RING-eIF4E complex reveals a distinct mode of control for eIF4E' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U. S. A.' _Citation.Journal_name_full . _Citation.Journal_volume 107 _Citation.Journal_issue 12 _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 5441 _Citation.Page_last 5446 _Citation.Year 2010 _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 Laurent Volpon . . . 15660 1 2 Michael Osborne . J. . 15660 1 3 Althea Capul . A. . 15660 1 4 Juan 'de la Torre' . C. . 15660 1 5 Katherine Borden . L.B. . 15660 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID LFV-Z 15660 1 'RING domain' 15660 1 stop_ save_ save_entry_citation_2 _Citation.Sf_category citations _Citation.Sf_framecode entry_citation_2 _Citation.Entry_ID 15660 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18958179 _Citation.Full_citation . _Citation.Title 'NMR assignment of the arenaviral protein Z from Lassa fever virus' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 2 _Citation.Journal_issue 1 _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 81 _Citation.Page_last 84 _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 Laurent Volpon . . . 15660 2 2 Michael Osborne . J. . 15660 2 3 Katherine Borden . L.B. . 15660 2 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID LFV-Z 15660 2 'RING domain' 15660 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15660 _Assembly.ID 1 _Assembly.Name LFV-Z _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 11458 _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 LFV-Z 1 $LFV-Z A . yes native no no . . . 15660 1 2 ZN 2 $ZN B . no . no no . . . 15660 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_LFV-Z _Entity.Sf_category entity _Entity.Sf_framecode LFV-Z _Entity.Entry_ID 15660 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name LFV-Z _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 ; MGNKQAKAPESKDSPRASLI PDATHLGPQFCKSCWFENKG LVECNNHYLCLNCLTLLLSV SNRCPICKMPLPTKLRPSAA PTAPPTGAADSIRPPPYSP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 99 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2M1S . "Nmr Assignment Of The Arenaviral Protein Z From Lassa Fever Virus" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 2 no GB AAC05816 . "Z protein [Lassa mammarenavirus]" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 3 no GB AAC05818 . "ring-finger protein [Lassa mammarenavirus]" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 4 no GB AAT49001 . "Z protein [Lassa mammarenavirus]" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 5 no GB ADY11072 . "Z protein [Lassa mammarenavirus]" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 6 no GB ADY11074 . "Z protein [Lassa mammarenavirus]" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 7 no REF NP_694871 . "Z protein [Lassa mammarenavirus]" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 1 8 no SP O73557 . "RecName: Full=RING finger protein Z; Short=Protein Z; AltName: Full=Zinc-binding protein" . . . . . 100.00 99 100.00 100.00 4.70e-64 . . . . 15660 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 . 15660 1 2 . GLY . 15660 1 3 . ASN . 15660 1 4 . LYS . 15660 1 5 . GLN . 15660 1 6 . ALA . 15660 1 7 . LYS . 15660 1 8 . ALA . 15660 1 9 . PRO . 15660 1 10 . GLU . 15660 1 11 . SER . 15660 1 12 . LYS . 15660 1 13 . ASP . 15660 1 14 . SER . 15660 1 15 . PRO . 15660 1 16 . ARG . 15660 1 17 . ALA . 15660 1 18 . SER . 15660 1 19 . LEU . 15660 1 20 . ILE . 15660 1 21 . PRO . 15660 1 22 . ASP . 15660 1 23 . ALA . 15660 1 24 . THR . 15660 1 25 . HIS . 15660 1 26 . LEU . 15660 1 27 . GLY . 15660 1 28 . PRO . 15660 1 29 . GLN . 15660 1 30 . PHE . 15660 1 31 . CYS . 15660 1 32 . LYS . 15660 1 33 . SER . 15660 1 34 . CYS . 15660 1 35 . TRP . 15660 1 36 . PHE . 15660 1 37 . GLU . 15660 1 38 . ASN . 15660 1 39 . LYS . 15660 1 40 . GLY . 15660 1 41 . LEU . 15660 1 42 . VAL . 15660 1 43 . GLU . 15660 1 44 . CYS . 15660 1 45 . ASN . 15660 1 46 . ASN . 15660 1 47 . HIS . 15660 1 48 . TYR . 15660 1 49 . LEU . 15660 1 50 . CYS . 15660 1 51 . LEU . 15660 1 52 . ASN . 15660 1 53 . CYS . 15660 1 54 . LEU . 15660 1 55 . THR . 15660 1 56 . LEU . 15660 1 57 . LEU . 15660 1 58 . LEU . 15660 1 59 . SER . 15660 1 60 . VAL . 15660 1 61 . SER . 15660 1 62 . ASN . 15660 1 63 . ARG . 15660 1 64 . CYS . 15660 1 65 . PRO . 15660 1 66 . ILE . 15660 1 67 . CYS . 15660 1 68 . LYS . 15660 1 69 . MET . 15660 1 70 . PRO . 15660 1 71 . LEU . 15660 1 72 . PRO . 15660 1 73 . THR . 15660 1 74 . LYS . 15660 1 75 . LEU . 15660 1 76 . ARG . 15660 1 77 . PRO . 15660 1 78 . SER . 15660 1 79 . ALA . 15660 1 80 . ALA . 15660 1 81 . PRO . 15660 1 82 . THR . 15660 1 83 . ALA . 15660 1 84 . PRO . 15660 1 85 . PRO . 15660 1 86 . THR . 15660 1 87 . GLY . 15660 1 88 . ALA . 15660 1 89 . ALA . 15660 1 90 . ASP . 15660 1 91 . SER . 15660 1 92 . ILE . 15660 1 93 . ARG . 15660 1 94 . PRO . 15660 1 95 . PRO . 15660 1 96 . PRO . 15660 1 97 . TYR . 15660 1 98 . SER . 15660 1 99 . PRO . 15660 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 15660 1 . GLY 2 2 15660 1 . ASN 3 3 15660 1 . LYS 4 4 15660 1 . GLN 5 5 15660 1 . ALA 6 6 15660 1 . LYS 7 7 15660 1 . ALA 8 8 15660 1 . PRO 9 9 15660 1 . GLU 10 10 15660 1 . SER 11 11 15660 1 . LYS 12 12 15660 1 . ASP 13 13 15660 1 . SER 14 14 15660 1 . PRO 15 15 15660 1 . ARG 16 16 15660 1 . ALA 17 17 15660 1 . SER 18 18 15660 1 . LEU 19 19 15660 1 . ILE 20 20 15660 1 . PRO 21 21 15660 1 . ASP 22 22 15660 1 . ALA 23 23 15660 1 . THR 24 24 15660 1 . HIS 25 25 15660 1 . LEU 26 26 15660 1 . GLY 27 27 15660 1 . PRO 28 28 15660 1 . GLN 29 29 15660 1 . PHE 30 30 15660 1 . CYS 31 31 15660 1 . LYS 32 32 15660 1 . SER 33 33 15660 1 . CYS 34 34 15660 1 . TRP 35 35 15660 1 . PHE 36 36 15660 1 . GLU 37 37 15660 1 . ASN 38 38 15660 1 . LYS 39 39 15660 1 . GLY 40 40 15660 1 . LEU 41 41 15660 1 . VAL 42 42 15660 1 . GLU 43 43 15660 1 . CYS 44 44 15660 1 . ASN 45 45 15660 1 . ASN 46 46 15660 1 . HIS 47 47 15660 1 . TYR 48 48 15660 1 . LEU 49 49 15660 1 . CYS 50 50 15660 1 . LEU 51 51 15660 1 . ASN 52 52 15660 1 . CYS 53 53 15660 1 . LEU 54 54 15660 1 . THR 55 55 15660 1 . LEU 56 56 15660 1 . LEU 57 57 15660 1 . LEU 58 58 15660 1 . SER 59 59 15660 1 . VAL 60 60 15660 1 . SER 61 61 15660 1 . ASN 62 62 15660 1 . ARG 63 63 15660 1 . CYS 64 64 15660 1 . PRO 65 65 15660 1 . ILE 66 66 15660 1 . CYS 67 67 15660 1 . LYS 68 68 15660 1 . MET 69 69 15660 1 . PRO 70 70 15660 1 . LEU 71 71 15660 1 . PRO 72 72 15660 1 . THR 73 73 15660 1 . LYS 74 74 15660 1 . LEU 75 75 15660 1 . ARG 76 76 15660 1 . PRO 77 77 15660 1 . SER 78 78 15660 1 . ALA 79 79 15660 1 . ALA 80 80 15660 1 . PRO 81 81 15660 1 . THR 82 82 15660 1 . ALA 83 83 15660 1 . PRO 84 84 15660 1 . PRO 85 85 15660 1 . THR 86 86 15660 1 . GLY 87 87 15660 1 . ALA 88 88 15660 1 . ALA 89 89 15660 1 . ASP 90 90 15660 1 . SER 91 91 15660 1 . ILE 92 92 15660 1 . ARG 93 93 15660 1 . PRO 94 94 15660 1 . PRO 95 95 15660 1 . PRO 96 96 15660 1 . TYR 97 97 15660 1 . SER 98 98 15660 1 . PRO 99 99 15660 1 stop_ save_ save_ZN _Entity.Sf_category entity _Entity.Sf_framecode ZN _Entity.Entry_ID 15660 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ZN . 15660 2 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 15660 _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 $LFV-Z . 11620 virus . 'Arenaviru Lassa virus' 'Arenaviru Lassa virus' . . Viruses . Arenavirus 'Lassa virus' . . . . . . . . . . . . . . . . . . . . . 15660 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 15660 _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 $LFV-Z . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 DE3' . . . . . . . . . . . . . . . pGEX-6p1 . . . . . . 15660 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 15660 _Chem_comp.ID ZN _Chem_comp.Provenance . _Chem_comp.Name 'ZINC ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code . _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag . _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag . _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site . _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Aug 21 03:50:37 2007 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/Zn/q+2 INCHI InChi 1 15660 ZN [Zn++] SMILES_CANONICAL CACTVS 2.87 15660 ZN [Zn+2] SMILES OpenEye/OEToolkits 1.4.2 15660 ZN [Zn+2] SMILES_CANONICAL OpenEye/OEToolkits 1.4.2 15660 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID 'zinc(+2) cation' 'SYSTEMATIC NAME' OpenEye/Lexichem 1.4 15660 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN . ZN . . ZN . N . 2 . . . . no no . . . . . . . . . . . . . . . 15660 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15660 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 LFV-Z '[U-100% 15N]' . . 1 $LFV-Z . . 0.2 . . mM . . . . 15660 1 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 15660 1 3 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 15660 1 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 15660 1 5 'zinc sulfate' 'natural abundance' . . . . . . 0.05 . . mM . . . . 15660 1 6 TCEP 'natural abundance' . . . . . . 0.05 . . mM . . . . 15660 1 7 D2O . . . . . . . 7 . . % . . . . 15660 1 8 H2O 'natural abundance' . . . . . . 93 . . % . . . . 15660 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15660 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 LFV-Z '[U-100% 13C; U-100% 15N]' . . 1 $LFV-Z . . 0.2 . . mM . . . . 15660 2 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 15660 2 3 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 15660 2 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 15660 2 5 'zinc sulfate' 'natural abundance' . . . . . . 0.05 . . mM . . . . 15660 2 6 TCEP 'natural abundance' . . . . . . 0.05 . . mM . . . . 15660 2 7 D2O . . . . . . . 7 . . % . . . . 15660 2 8 H2O 'natural abundance' . . . . . . 93 . . % . . . . 15660 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 15660 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 LFV-Z '[U-100% 13C; U-100% 15N]' . . 1 $LFV-Z . . 0.2 . . mM . . . . 15660 3 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 15660 3 3 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 15660 3 4 'sodium azide' 'natural abundance' . . . . . . 3 . . mM . . . . 15660 3 5 'zinc sulfate' 'natural abundance' . . . . . . 0.05 . . mM . . . . 15660 3 6 TCEP 'natural abundance' . . . . . . 0.05 . . mM . . . . 15660 3 7 D2O . . . . . . . 100 . . % . . . . 15660 3 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 15660 _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' 0.25 . M 15660 1 pH 7.2 . pH 15660 1 pressure 1 . atm 15660 1 temperature 293 . K 15660 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 15660 _Software.ID 1 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15660 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15660 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15660 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15660 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15660 2 'data analysis' 15660 2 'peak picking' 15660 2 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 15660 _NMR_spectrometer.ID 1 _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 15660 _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 . 600 . . . 15660 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 15660 _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 . . . . . . . . . . . . . . . . 15660 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 3 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 5 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 6 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 9 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 11 '2D (HB)CB(CGCD)HD' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 12 '2D (HB)CB(CGCDCE)HE' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 1 13 '3D C(CO)NH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15660 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 15660 _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 0.0 external indirect 0.101329118 . . . . . . . . . 15660 1 H 1 DSS protons . . . . ppm 0.0 external direct 1.0 . . . . . . . . . 15660 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.251449530 . . . . . . . . . 15660 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 15660 _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 0.03 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 15660 1 2 '2D 1H-13C HSQC' . . . 15660 1 3 '3D 1H-15N TOCSY' . . . 15660 1 4 '3D 1H-15N NOESY' . . . 15660 1 6 '3D HNCACB' . . . 15660 1 7 '3D CBCA(CO)NH' . . . 15660 1 8 '3D HCCH-TOCSY' . . . 15660 1 9 '3D HNCO' . . . 15660 1 10 '3D HBHA(CO)NH' . . . 15660 1 11 '2D (HB)CB(CGCD)HD' . . . 15660 1 12 '2D (HB)CB(CGCDCE)HE' . . . 15660 1 13 '3D C(CO)NH-TOCSY' . . . 15660 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 2 2 GLY HA2 H 1 4.01 0.03 . 2 . . . . 2 GLY HA2 . 15660 1 2 . 1 1 2 2 GLY HA3 H 1 4.04 0.03 . 2 . . . . 2 GLY HA3 . 15660 1 3 . 1 1 2 2 GLY C C 13 174.4 0.3 . 1 . . . . 2 GLY C . 15660 1 4 . 1 1 2 2 GLY CA C 13 45.15 0.3 . 1 . . . . 2 GLY CA . 15660 1 5 . 1 1 3 3 ASN H H 1 8.16 0.03 . 1 . . . . 3 ASN H . 15660 1 6 . 1 1 3 3 ASN CA C 13 53.87 0.3 . 1 . . . . 3 ASN CA . 15660 1 7 . 1 1 3 3 ASN CB C 13 40.77 0.3 . 1 . . . . 3 ASN CB . 15660 1 8 . 1 1 3 3 ASN N N 15 117.6 0.2 . 1 . . . . 3 ASN N . 15660 1 9 . 1 1 6 6 ALA HA H 1 4.31 0.03 . 1 . . . . 6 ALA HA . 15660 1 10 . 1 1 6 6 ALA HB1 H 1 1.39 0.03 . 1 . . . . 6 ALA HB1 . 15660 1 11 . 1 1 6 6 ALA HB2 H 1 1.39 0.03 . 1 . . . . 6 ALA HB2 . 15660 1 12 . 1 1 6 6 ALA HB3 H 1 1.39 0.03 . 1 . . . . 6 ALA HB3 . 15660 1 13 . 1 1 6 6 ALA C C 13 177.9 0.3 . 1 . . . . 6 ALA C . 15660 1 14 . 1 1 6 6 ALA CA C 13 52.3 0.3 . 1 . . . . 6 ALA CA . 15660 1 15 . 1 1 6 6 ALA CB C 13 19.45 0.3 . 1 . . . . 6 ALA CB . 15660 1 16 . 1 1 7 7 LYS H H 1 8.32 0.03 . 1 . . . . 7 LYS H . 15660 1 17 . 1 1 7 7 LYS HA H 1 4.3 0.03 . 1 . . . . 7 LYS HA . 15660 1 18 . 1 1 7 7 LYS HB2 H 1 1.79 0.03 . 2 . . . . 7 LYS HB2 . 15660 1 19 . 1 1 7 7 LYS HB3 H 1 1.76 0.03 . 2 . . . . 7 LYS HB3 . 15660 1 20 . 1 1 7 7 LYS HD2 H 1 1.71 0.03 . 2 . . . . 7 LYS HD2 . 15660 1 21 . 1 1 7 7 LYS HE2 H 1 3.03 0.03 . 2 . . . . 7 LYS HE2 . 15660 1 22 . 1 1 7 7 LYS HG2 H 1 1.46 0.03 . 2 . . . . 7 LYS HG2 . 15660 1 23 . 1 1 7 7 LYS C C 13 176.4 0.3 . 1 . . . . 7 LYS C . 15660 1 24 . 1 1 7 7 LYS CA C 13 55.88 0.3 . 1 . . . . 7 LYS CA . 15660 1 25 . 1 1 7 7 LYS CB C 13 33.35 0.3 . 1 . . . . 7 LYS CB . 15660 1 26 . 1 1 7 7 LYS CD C 13 29.13 0.3 . 1 . . . . 7 LYS CD . 15660 1 27 . 1 1 7 7 LYS CE C 13 42.2 0.3 . 1 . . . . 7 LYS CE . 15660 1 28 . 1 1 7 7 LYS CG C 13 24.64 0.3 . 1 . . . . 7 LYS CG . 15660 1 29 . 1 1 7 7 LYS N N 15 119.8 0.2 . 1 . . . . 7 LYS N . 15660 1 30 . 1 1 8 8 ALA H H 1 8.44 0.03 . 1 . . . . 8 ALA H . 15660 1 31 . 1 1 8 8 ALA N N 15 126.9 0.2 . 1 . . . . 8 ALA N . 15660 1 32 . 1 1 12 12 LYS HA H 1 4.36 0.03 . 1 . . . . 12 LYS HA . 15660 1 33 . 1 1 12 12 LYS HB2 H 1 1.84 0.03 . 2 . . . . 12 LYS HB2 . 15660 1 34 . 1 1 12 12 LYS HB3 H 1 1.8 0.03 . 2 . . . . 12 LYS HB3 . 15660 1 35 . 1 1 12 12 LYS C C 13 176.8 0.3 . 1 . . . . 12 LYS C . 15660 1 36 . 1 1 12 12 LYS CA C 13 56.54 0.3 . 1 . . . . 12 LYS CA . 15660 1 37 . 1 1 12 12 LYS CB C 13 32.74 0.3 . 1 . . . . 12 LYS CB . 15660 1 38 . 1 1 12 12 LYS CD C 13 29.05 0.3 . 1 . . . . 12 LYS CD . 15660 1 39 . 1 1 12 12 LYS CE C 13 42.17 0.3 . 1 . . . . 12 LYS CE . 15660 1 40 . 1 1 12 12 LYS CG C 13 24.63 0.3 . 1 . . . . 12 LYS CG . 15660 1 41 . 1 1 13 13 ASP H H 1 8.33 0.03 . 1 . . . . 13 ASP H . 15660 1 42 . 1 1 13 13 ASP HA H 1 4.65 0.03 . 1 . . . . 13 ASP HA . 15660 1 43 . 1 1 13 13 ASP HB2 H 1 2.69 0.03 . 2 . . . . 13 ASP HB2 . 15660 1 44 . 1 1 13 13 ASP HB3 H 1 2.6 0.03 . 2 . . . . 13 ASP HB3 . 15660 1 45 . 1 1 13 13 ASP C C 13 176.4 0.3 . 1 . . . . 13 ASP C . 15660 1 46 . 1 1 13 13 ASP CA C 13 54.29 0.3 . 1 . . . . 13 ASP CA . 15660 1 47 . 1 1 13 13 ASP CB C 13 41.28 0.3 . 1 . . . . 13 ASP CB . 15660 1 48 . 1 1 13 13 ASP N N 15 119.3 0.2 . 1 . . . . 13 ASP N . 15660 1 49 . 1 1 14 14 SER H H 1 8.17 0.03 . 1 . . . . 14 SER H . 15660 1 50 . 1 1 14 14 SER CA C 13 56.37 0.3 . 1 . . . . 14 SER CA . 15660 1 51 . 1 1 14 14 SER CB C 13 63.35 0.3 . 1 . . . . 14 SER CB . 15660 1 52 . 1 1 14 14 SER N N 15 115.8 0.2 . 1 . . . . 14 SER N . 15660 1 53 . 1 1 15 15 PRO HA H 1 4.43 0.03 . 1 . . . . 15 PRO HA . 15660 1 54 . 1 1 15 15 PRO HB2 H 1 2.35 0.03 . 2 . . . . 15 PRO HB2 . 15660 1 55 . 1 1 15 15 PRO HB3 H 1 1.92 0.03 . 2 . . . . 15 PRO HB3 . 15660 1 56 . 1 1 15 15 PRO C C 13 177.6 0.3 . 1 . . . . 15 PRO C . 15660 1 57 . 1 1 15 15 PRO CA C 13 63.25 0.3 . 1 . . . . 15 PRO CA . 15660 1 58 . 1 1 15 15 PRO CB C 13 32.15 0.3 . 1 . . . . 15 PRO CB . 15660 1 59 . 1 1 15 15 PRO CD C 13 50.87 0.3 . 1 . . . . 15 PRO CD . 15660 1 60 . 1 1 15 15 PRO CG C 13 27.43 0.3 . 1 . . . . 15 PRO CG . 15660 1 61 . 1 1 16 16 ARG H H 1 8.43 0.03 . 1 . . . . 16 ARG H . 15660 1 62 . 1 1 16 16 ARG HA H 1 4.3 0.03 . 1 . . . . 16 ARG HA . 15660 1 63 . 1 1 16 16 ARG HB2 H 1 1.85 0.03 . 2 . . . . 16 ARG HB2 . 15660 1 64 . 1 1 16 16 ARG HB3 H 1 1.76 0.03 . 2 . . . . 16 ARG HB3 . 15660 1 65 . 1 1 16 16 ARG HD2 H 1 3.22 0.03 . 2 . . . . 16 ARG HD2 . 15660 1 66 . 1 1 16 16 ARG HG2 H 1 1.7 0.03 . 2 . . . . 16 ARG HG2 . 15660 1 67 . 1 1 16 16 ARG C C 13 176.7 0.3 . 1 . . . . 16 ARG C . 15660 1 68 . 1 1 16 16 ARG CA C 13 56.05 0.3 . 1 . . . . 16 ARG CA . 15660 1 69 . 1 1 16 16 ARG CB C 13 30.87 0.3 . 1 . . . . 16 ARG CB . 15660 1 70 . 1 1 16 16 ARG CD C 13 43.36 0.3 . 1 . . . . 16 ARG CD . 15660 1 71 . 1 1 16 16 ARG CG C 13 27.05 0.3 . 1 . . . . 16 ARG CG . 15660 1 72 . 1 1 16 16 ARG N N 15 119.9 0.2 . 1 . . . . 16 ARG N . 15660 1 73 . 1 1 17 17 ALA H H 1 8.35 0.03 . 1 . . . . 17 ALA H . 15660 1 74 . 1 1 17 17 ALA HA H 1 4.34 0.03 . 1 . . . . 17 ALA HA . 15660 1 75 . 1 1 17 17 ALA HB1 H 1 1.41 0.03 . 1 . . . . 17 ALA HB1 . 15660 1 76 . 1 1 17 17 ALA HB2 H 1 1.41 0.03 . 1 . . . . 17 ALA HB2 . 15660 1 77 . 1 1 17 17 ALA HB3 H 1 1.41 0.03 . 1 . . . . 17 ALA HB3 . 15660 1 78 . 1 1 17 17 ALA C C 13 177.1 0.3 . 1 . . . . 17 ALA C . 15660 1 79 . 1 1 17 17 ALA CA C 13 52.5 0.3 . 1 . . . . 17 ALA CA . 15660 1 80 . 1 1 17 17 ALA CB C 13 19.28 0.3 . 1 . . . . 17 ALA CB . 15660 1 81 . 1 1 17 17 ALA N N 15 123.8 0.2 . 1 . . . . 17 ALA N . 15660 1 82 . 1 1 18 18 SER H H 1 7.96 0.03 . 1 . . . . 18 SER H . 15660 1 83 . 1 1 18 18 SER HA H 1 4.43 0.03 . 1 . . . . 18 SER HA . 15660 1 84 . 1 1 18 18 SER HB2 H 1 3.92 0.03 . 2 . . . . 18 SER HB2 . 15660 1 85 . 1 1 18 18 SER HB3 H 1 3.86 0.03 . 2 . . . . 18 SER HB3 . 15660 1 86 . 1 1 18 18 SER C C 13 174.8 0.3 . 1 . . . . 18 SER C . 15660 1 87 . 1 1 18 18 SER CA C 13 58.08 0.3 . 1 . . . . 18 SER CA . 15660 1 88 . 1 1 18 18 SER CB C 13 63.91 0.3 . 1 . . . . 18 SER CB . 15660 1 89 . 1 1 18 18 SER N N 15 124.7 0.2 . 1 . . . . 18 SER N . 15660 1 90 . 1 1 19 19 LEU H H 1 8.26 0.03 . 1 . . . . 19 LEU H . 15660 1 91 . 1 1 19 19 LEU HA H 1 4.36 0.03 . 1 . . . . 19 LEU HA . 15660 1 92 . 1 1 19 19 LEU HB2 H 1 1.61 0.03 . 2 . . . . 19 LEU HB2 . 15660 1 93 . 1 1 19 19 LEU HD11 H 1 0.88 0.03 . 2 . . . . 19 LEU HD11 . 15660 1 94 . 1 1 19 19 LEU HD12 H 1 0.88 0.03 . 2 . . . . 19 LEU HD12 . 15660 1 95 . 1 1 19 19 LEU HD13 H 1 0.88 0.03 . 2 . . . . 19 LEU HD13 . 15660 1 96 . 1 1 19 19 LEU HD21 H 1 0.95 0.03 . 2 . . . . 19 LEU HD21 . 15660 1 97 . 1 1 19 19 LEU HD22 H 1 0.95 0.03 . 2 . . . . 19 LEU HD22 . 15660 1 98 . 1 1 19 19 LEU HD23 H 1 0.95 0.03 . 2 . . . . 19 LEU HD23 . 15660 1 99 . 1 1 19 19 LEU C C 13 177.4 0.3 . 1 . . . . 19 LEU C . 15660 1 100 . 1 1 19 19 LEU CA C 13 55.11 0.3 . 1 . . . . 19 LEU CA . 15660 1 101 . 1 1 19 19 LEU CB C 13 42.41 0.3 . 1 . . . . 19 LEU CB . 15660 1 102 . 1 1 19 19 LEU CD1 C 13 23.47 0.3 . 2 . . . . 19 LEU CD1 . 15660 1 103 . 1 1 19 19 LEU CD2 C 13 24.94 0.3 . 2 . . . . 19 LEU CD2 . 15660 1 104 . 1 1 19 19 LEU CG C 13 27.03 0.3 . 1 . . . . 19 LEU CG . 15660 1 105 . 1 1 19 19 LEU N N 15 122.8 0.2 . 1 . . . . 19 LEU N . 15660 1 106 . 1 1 20 20 ILE H H 1 8.16 0.03 . 1 . . . . 20 ILE H . 15660 1 107 . 1 1 20 20 ILE HA H 1 4.46 0.03 . 1 . . . . 20 ILE HA . 15660 1 108 . 1 1 20 20 ILE HB H 1 1.88 0.03 . 1 . . . . 20 ILE HB . 15660 1 109 . 1 1 20 20 ILE HD11 H 1 0.87 0.03 . 1 . . . . 20 ILE HD11 . 15660 1 110 . 1 1 20 20 ILE HD12 H 1 0.87 0.03 . 1 . . . . 20 ILE HD12 . 15660 1 111 . 1 1 20 20 ILE HD13 H 1 0.87 0.03 . 1 . . . . 20 ILE HD13 . 15660 1 112 . 1 1 20 20 ILE HG12 H 1 1.51 0.03 . 2 . . . . 20 ILE HG12 . 15660 1 113 . 1 1 20 20 ILE HG13 H 1 1.18 0.03 . 2 . . . . 20 ILE HG13 . 15660 1 114 . 1 1 20 20 ILE HG21 H 1 0.96 0.03 . 1 . . . . 20 ILE HG21 . 15660 1 115 . 1 1 20 20 ILE HG22 H 1 0.96 0.03 . 1 . . . . 20 ILE HG22 . 15660 1 116 . 1 1 20 20 ILE HG23 H 1 0.96 0.03 . 1 . . . . 20 ILE HG23 . 15660 1 117 . 1 1 20 20 ILE CA C 13 58.35 0.3 . 1 . . . . 20 ILE CA . 15660 1 118 . 1 1 20 20 ILE CB C 13 38.45 0.3 . 1 . . . . 20 ILE CB . 15660 1 119 . 1 1 20 20 ILE CD1 C 13 12.66 0.3 . 1 . . . . 20 ILE CD1 . 15660 1 120 . 1 1 20 20 ILE CG1 C 13 27.02 0.3 . 1 . . . . 20 ILE CG1 . 15660 1 121 . 1 1 20 20 ILE CG2 C 13 17.14 0.3 . 1 . . . . 20 ILE CG2 . 15660 1 122 . 1 1 20 20 ILE N N 15 121.9 0.2 . 1 . . . . 20 ILE N . 15660 1 123 . 1 1 21 21 PRO HA H 1 4.36 0.03 . 1 . . . . 21 PRO HA . 15660 1 124 . 1 1 21 21 PRO HB2 H 1 2.25 0.03 . 2 . . . . 21 PRO HB2 . 15660 1 125 . 1 1 21 21 PRO HB3 H 1 1.88 0.03 . 2 . . . . 21 PRO HB3 . 15660 1 126 . 1 1 21 21 PRO C C 13 177 0.3 . 1 . . . . 21 PRO C . 15660 1 127 . 1 1 21 21 PRO CA C 13 63.29 0.3 . 1 . . . . 21 PRO CA . 15660 1 128 . 1 1 21 21 PRO CB C 13 32.19 0.3 . 1 . . . . 21 PRO CB . 15660 1 129 . 1 1 21 21 PRO CD C 13 51.13 0.3 . 1 . . . . 21 PRO CD . 15660 1 130 . 1 1 21 21 PRO CG C 13 27.28 0.3 . 1 . . . . 21 PRO CG . 15660 1 131 . 1 1 22 22 ASP H H 1 8.37 0.03 . 1 . . . . 22 ASP H . 15660 1 132 . 1 1 22 22 ASP HA H 1 4.55 0.03 . 1 . . . . 22 ASP HA . 15660 1 133 . 1 1 22 22 ASP HB2 H 1 2.69 0.03 . 2 . . . . 22 ASP HB2 . 15660 1 134 . 1 1 22 22 ASP HB3 H 1 2.66 0.03 . 2 . . . . 22 ASP HB3 . 15660 1 135 . 1 1 22 22 ASP C C 13 176.7 0.3 . 1 . . . . 22 ASP C . 15660 1 136 . 1 1 22 22 ASP CA C 13 54.32 0.3 . 1 . . . . 22 ASP CA . 15660 1 137 . 1 1 22 22 ASP CB C 13 41.32 0.3 . 1 . . . . 22 ASP CB . 15660 1 138 . 1 1 22 22 ASP N N 15 119.5 0.2 . 1 . . . . 22 ASP N . 15660 1 139 . 1 1 23 23 ALA H H 1 8.4 0.03 . 1 . . . . 23 ALA H . 15660 1 140 . 1 1 23 23 ALA HA H 1 4.39 0.03 . 1 . . . . 23 ALA HA . 15660 1 141 . 1 1 23 23 ALA HB1 H 1 1.39 0.03 . 1 . . . . 23 ALA HB1 . 15660 1 142 . 1 1 23 23 ALA HB2 H 1 1.39 0.03 . 1 . . . . 23 ALA HB2 . 15660 1 143 . 1 1 23 23 ALA HB3 H 1 1.39 0.03 . 1 . . . . 23 ALA HB3 . 15660 1 144 . 1 1 23 23 ALA C C 13 178.9 0.3 . 1 . . . . 23 ALA C . 15660 1 145 . 1 1 23 23 ALA CA C 13 52.53 0.3 . 1 . . . . 23 ALA CA . 15660 1 146 . 1 1 23 23 ALA CB C 13 19.4 0.3 . 1 . . . . 23 ALA CB . 15660 1 147 . 1 1 23 23 ALA N N 15 123.6 0.2 . 1 . . . . 23 ALA N . 15660 1 148 . 1 1 24 24 THR H H 1 8.36 0.03 . 1 . . . . 24 THR H . 15660 1 149 . 1 1 24 24 THR HA H 1 4.24 0.03 . 1 . . . . 24 THR HA . 15660 1 150 . 1 1 24 24 THR HB H 1 4.22 0.03 . 1 . . . . 24 THR HB . 15660 1 151 . 1 1 24 24 THR HG21 H 1 1.17 0.03 . 1 . . . . 24 THR HG21 . 15660 1 152 . 1 1 24 24 THR HG22 H 1 1.17 0.03 . 1 . . . . 24 THR HG22 . 15660 1 153 . 1 1 24 24 THR HG23 H 1 1.17 0.03 . 1 . . . . 24 THR HG23 . 15660 1 154 . 1 1 24 24 THR CA C 13 62.79 0.3 . 1 . . . . 24 THR CA . 15660 1 155 . 1 1 24 24 THR CB C 13 69.65 0.3 . 1 . . . . 24 THR CB . 15660 1 156 . 1 1 24 24 THR CG2 C 13 21.75 0.3 . 1 . . . . 24 THR CG2 . 15660 1 157 . 1 1 24 24 THR N N 15 112.3 0.2 . 1 . . . . 24 THR N . 15660 1 158 . 1 1 25 25 HIS HA H 1 4.6 0.03 . 1 . . . . 25 HIS HA . 15660 1 159 . 1 1 25 25 HIS HB2 H 1 3.12 0.03 . 2 . . . . 25 HIS HB2 . 15660 1 160 . 1 1 25 25 HIS HB3 H 1 3.14 0.03 . 2 . . . . 25 HIS HB3 . 15660 1 161 . 1 1 25 25 HIS HD2 H 1 6.98 0.03 . 1 . . . . 25 HIS HD2 . 15660 1 162 . 1 1 25 25 HIS HE1 H 1 7.79 0.03 . 1 . . . . 25 HIS HE1 . 15660 1 163 . 1 1 25 25 HIS C C 13 175.9 0.3 . 1 . . . . 25 HIS C . 15660 1 164 . 1 1 25 25 HIS CA C 13 57.02 0.3 . 1 . . . . 25 HIS CA . 15660 1 165 . 1 1 25 25 HIS CB C 13 30.45 0.3 . 1 . . . . 25 HIS CB . 15660 1 166 . 1 1 25 25 HIS CD2 C 13 118.6 0.3 . 1 . . . . 25 HIS CD2 . 15660 1 167 . 1 1 25 25 HIS CE1 C 13 137.2 0.3 . 1 . . . . 25 HIS CE1 . 15660 1 168 . 1 1 25 25 HIS ND1 N 15 223.3 0.2 . 1 . . . . 25 HIS ND1 . 15660 1 169 . 1 1 25 25 HIS NE2 N 15 176.4 0.2 . 1 . . . . 25 HIS NE2 . 15660 1 170 . 1 1 26 26 LEU H H 1 7.86 0.03 . 1 . . . . 26 LEU H . 15660 1 171 . 1 1 26 26 LEU HA H 1 4.1 0.03 . 1 . . . . 26 LEU HA . 15660 1 172 . 1 1 26 26 LEU HB2 H 1 1.39 0.03 . 2 . . . . 26 LEU HB2 . 15660 1 173 . 1 1 26 26 LEU HB3 H 1 1.14 0.03 . 2 . . . . 26 LEU HB3 . 15660 1 174 . 1 1 26 26 LEU HD11 H 1 0.53 0.03 . 2 . . . . 26 LEU HD11 . 15660 1 175 . 1 1 26 26 LEU HD12 H 1 0.53 0.03 . 2 . . . . 26 LEU HD12 . 15660 1 176 . 1 1 26 26 LEU HD13 H 1 0.53 0.03 . 2 . . . . 26 LEU HD13 . 15660 1 177 . 1 1 26 26 LEU HD21 H 1 0.48 0.03 . 2 . . . . 26 LEU HD21 . 15660 1 178 . 1 1 26 26 LEU HD22 H 1 0.48 0.03 . 2 . . . . 26 LEU HD22 . 15660 1 179 . 1 1 26 26 LEU HD23 H 1 0.48 0.03 . 2 . . . . 26 LEU HD23 . 15660 1 180 . 1 1 26 26 LEU HG H 1 1.06 0.03 . 1 . . . . 26 LEU HG . 15660 1 181 . 1 1 26 26 LEU C C 13 177.6 0.3 . 1 . . . . 26 LEU C . 15660 1 182 . 1 1 26 26 LEU CA C 13 55.03 0.3 . 1 . . . . 26 LEU CA . 15660 1 183 . 1 1 26 26 LEU CB C 13 42.12 0.3 . 1 . . . . 26 LEU CB . 15660 1 184 . 1 1 26 26 LEU CD1 C 13 24.88 0.3 . 2 . . . . 26 LEU CD1 . 15660 1 185 . 1 1 26 26 LEU CD2 C 13 23.1 0.3 . 2 . . . . 26 LEU CD2 . 15660 1 186 . 1 1 26 26 LEU CG C 13 26.82 0.3 . 1 . . . . 26 LEU CG . 15660 1 187 . 1 1 26 26 LEU N N 15 121.2 0.2 . 1 . . . . 26 LEU N . 15660 1 188 . 1 1 27 27 GLY H H 1 7.83 0.03 . 1 . . . . 27 GLY H . 15660 1 189 . 1 1 27 27 GLY HA2 H 1 4.27 0.03 . 2 . . . . 27 GLY HA2 . 15660 1 190 . 1 1 27 27 GLY HA3 H 1 3.99 0.03 . 2 . . . . 27 GLY HA3 . 15660 1 191 . 1 1 27 27 GLY CA C 13 44.59 0.3 . 1 . . . . 27 GLY CA . 15660 1 192 . 1 1 27 27 GLY N N 15 106.1 0.2 . 1 . . . . 27 GLY N . 15660 1 193 . 1 1 28 28 PRO HA H 1 4.43 0.03 . 1 . . . . 28 PRO HA . 15660 1 194 . 1 1 28 28 PRO HB2 H 1 2.41 0.03 . 2 . . . . 28 PRO HB2 . 15660 1 195 . 1 1 28 28 PRO HD2 H 1 3.74 0.03 . 2 . . . . 28 PRO HD2 . 15660 1 196 . 1 1 28 28 PRO HG2 H 1 2.18 0.03 . 2 . . . . 28 PRO HG2 . 15660 1 197 . 1 1 28 28 PRO HG3 H 1 2.14 0.03 . 2 . . . . 28 PRO HG3 . 15660 1 198 . 1 1 28 28 PRO C C 13 177.7 0.3 . 1 . . . . 28 PRO C . 15660 1 199 . 1 1 28 28 PRO CA C 13 63.2 0.3 . 1 . . . . 28 PRO CA . 15660 1 200 . 1 1 28 28 PRO CB C 13 32.34 0.3 . 1 . . . . 28 PRO CB . 15660 1 201 . 1 1 28 28 PRO CD C 13 49.88 0.3 . 1 . . . . 28 PRO CD . 15660 1 202 . 1 1 28 28 PRO CG C 13 27.55 0.3 . 1 . . . . 28 PRO CG . 15660 1 203 . 1 1 29 29 GLN H H 1 8.45 0.03 . 1 . . . . 29 GLN H . 15660 1 204 . 1 1 29 29 GLN HA H 1 3.9 0.03 . 1 . . . . 29 GLN HA . 15660 1 205 . 1 1 29 29 GLN HB2 H 1 1.64 0.03 . 2 . . . . 29 GLN HB2 . 15660 1 206 . 1 1 29 29 GLN HB3 H 1 1.47 0.03 . 2 . . . . 29 GLN HB3 . 15660 1 207 . 1 1 29 29 GLN HE21 H 1 7.17 0.03 . 2 . . . . 29 GLN HE21 . 15660 1 208 . 1 1 29 29 GLN HE22 H 1 6.75 0.03 . 2 . . . . 29 GLN HE22 . 15660 1 209 . 1 1 29 29 GLN HG2 H 1 2.07 0.03 . 2 . . . . 29 GLN HG2 . 15660 1 210 . 1 1 29 29 GLN HG3 H 1 1.91 0.03 . 2 . . . . 29 GLN HG3 . 15660 1 211 . 1 1 29 29 GLN C C 13 173.8 0.3 . 1 . . . . 29 GLN C . 15660 1 212 . 1 1 29 29 GLN CA C 13 55.27 0.3 . 1 . . . . 29 GLN CA . 15660 1 213 . 1 1 29 29 GLN CB C 13 27.72 0.3 . 1 . . . . 29 GLN CB . 15660 1 214 . 1 1 29 29 GLN CG C 13 33.68 0.3 . 1 . . . . 29 GLN CG . 15660 1 215 . 1 1 29 29 GLN N N 15 120.2 0.2 . 1 . . . . 29 GLN N . 15660 1 216 . 1 1 29 29 GLN NE2 N 15 110.8 0.2 . 1 . . . . 29 GLN NE2 . 15660 1 217 . 1 1 30 30 PHE H H 1 7.52 0.03 . 1 . . . . 30 PHE H . 15660 1 218 . 1 1 30 30 PHE HA H 1 4.71 0.03 . 1 . . . . 30 PHE HA . 15660 1 219 . 1 1 30 30 PHE HB2 H 1 2.86 0.03 . 2 . . . . 30 PHE HB2 . 15660 1 220 . 1 1 30 30 PHE HB3 H 1 2.53 0.03 . 2 . . . . 30 PHE HB3 . 15660 1 221 . 1 1 30 30 PHE HD1 H 1 6.84 0.03 . 3 . . . . 30 PHE HD1 . 15660 1 222 . 1 1 30 30 PHE HE1 H 1 7.01 0.03 . 3 . . . . 30 PHE HE1 . 15660 1 223 . 1 1 30 30 PHE C C 13 173.9 0.3 . 1 . . . . 30 PHE C . 15660 1 224 . 1 1 30 30 PHE CA C 13 56.12 0.3 . 1 . . . . 30 PHE CA . 15660 1 225 . 1 1 30 30 PHE CB C 13 42.09 0.3 . 1 . . . . 30 PHE CB . 15660 1 226 . 1 1 30 30 PHE CD1 C 13 131.5 0.3 . 3 . . . . 30 PHE CD1 . 15660 1 227 . 1 1 30 30 PHE CE1 C 13 129.8 0.3 . 3 . . . . 30 PHE CE1 . 15660 1 228 . 1 1 30 30 PHE N N 15 117.9 0.2 . 1 . . . . 30 PHE N . 15660 1 229 . 1 1 31 31 CYS H H 1 8.39 0.03 . 1 . . . . 31 CYS H . 15660 1 230 . 1 1 31 31 CYS HA H 1 3.81 0.03 . 1 . . . . 31 CYS HA . 15660 1 231 . 1 1 31 31 CYS HB2 H 1 3.53 0.03 . 2 . . . . 31 CYS HB2 . 15660 1 232 . 1 1 31 31 CYS HB3 H 1 2.63 0.03 . 2 . . . . 31 CYS HB3 . 15660 1 233 . 1 1 31 31 CYS C C 13 176.5 0.3 . 1 . . . . 31 CYS C . 15660 1 234 . 1 1 31 31 CYS CA C 13 59.77 0.3 . 1 . . . . 31 CYS CA . 15660 1 235 . 1 1 31 31 CYS CB C 13 31.83 0.3 . 1 . . . . 31 CYS CB . 15660 1 236 . 1 1 31 31 CYS N N 15 121.5 0.2 . 1 . . . . 31 CYS N . 15660 1 237 . 1 1 32 32 LYS H H 1 7.91 0.03 . 1 . . . . 32 LYS H . 15660 1 238 . 1 1 32 32 LYS HA H 1 3.79 0.03 . 1 . . . . 32 LYS HA . 15660 1 239 . 1 1 32 32 LYS HB2 H 1 2.24 0.03 . 2 . . . . 32 LYS HB2 . 15660 1 240 . 1 1 32 32 LYS HB3 H 1 1.67 0.03 . 2 . . . . 32 LYS HB3 . 15660 1 241 . 1 1 32 32 LYS HD2 H 1 1.48 0.03 . 2 . . . . 32 LYS HD2 . 15660 1 242 . 1 1 32 32 LYS HE2 H 1 3.06 0.03 . 2 . . . . 32 LYS HE2 . 15660 1 243 . 1 1 32 32 LYS HE3 H 1 3.03 0.03 . 2 . . . . 32 LYS HE3 . 15660 1 244 . 1 1 32 32 LYS HG2 H 1 1.54 0.03 . 2 . . . . 32 LYS HG2 . 15660 1 245 . 1 1 32 32 LYS C C 13 175.1 0.3 . 1 . . . . 32 LYS C . 15660 1 246 . 1 1 32 32 LYS CA C 13 56.92 0.3 . 1 . . . . 32 LYS CA . 15660 1 247 . 1 1 32 32 LYS CB C 13 33.79 0.3 . 1 . . . . 32 LYS CB . 15660 1 248 . 1 1 32 32 LYS CD C 13 29.69 0.3 . 1 . . . . 32 LYS CD . 15660 1 249 . 1 1 32 32 LYS CE C 13 42.34 0.3 . 1 . . . . 32 LYS CE . 15660 1 250 . 1 1 32 32 LYS CG C 13 27.36 0.3 . 1 . . . . 32 LYS CG . 15660 1 251 . 1 1 32 32 LYS N N 15 129.2 0.2 . 1 . . . . 32 LYS N . 15660 1 252 . 1 1 33 33 SER H H 1 8.88 0.03 . 1 . . . . 33 SER H . 15660 1 253 . 1 1 33 33 SER HA H 1 4.55 0.03 . 1 . . . . 33 SER HA . 15660 1 254 . 1 1 33 33 SER HB2 H 1 3.48 0.03 . 2 . . . . 33 SER HB2 . 15660 1 255 . 1 1 33 33 SER HB3 H 1 3.46 0.03 . 2 . . . . 33 SER HB3 . 15660 1 256 . 1 1 33 33 SER C C 13 175.6 0.3 . 1 . . . . 33 SER C . 15660 1 257 . 1 1 33 33 SER CA C 13 59.71 0.3 . 1 . . . . 33 SER CA . 15660 1 258 . 1 1 33 33 SER CB C 13 61.68 0.3 . 1 . . . . 33 SER CB . 15660 1 259 . 1 1 33 33 SER N N 15 112.2 0.2 . 1 . . . . 33 SER N . 15660 1 260 . 1 1 34 34 CYS H H 1 8.46 0.03 . 1 . . . . 34 CYS H . 15660 1 261 . 1 1 34 34 CYS HA H 1 4.86 0.03 . 1 . . . . 34 CYS HA . 15660 1 262 . 1 1 34 34 CYS HB2 H 1 3.31 0.03 . 2 . . . . 34 CYS HB2 . 15660 1 263 . 1 1 34 34 CYS HB3 H 1 2.64 0.03 . 2 . . . . 34 CYS HB3 . 15660 1 264 . 1 1 34 34 CYS C C 13 177.3 0.3 . 1 . . . . 34 CYS C . 15660 1 265 . 1 1 34 34 CYS CA C 13 58.92 0.3 . 1 . . . . 34 CYS CA . 15660 1 266 . 1 1 34 34 CYS CB C 13 32.5 0.3 . 1 . . . . 34 CYS CB . 15660 1 267 . 1 1 34 34 CYS N N 15 116.7 0.2 . 1 . . . . 34 CYS N . 15660 1 268 . 1 1 35 35 TRP H H 1 7.97 0.03 . 1 . . . . 35 TRP H . 15660 1 269 . 1 1 35 35 TRP HA H 1 4.47 0.03 . 1 . . . . 35 TRP HA . 15660 1 270 . 1 1 35 35 TRP HB2 H 1 3.32 0.03 . 2 . . . . 35 TRP HB2 . 15660 1 271 . 1 1 35 35 TRP HB3 H 1 3.27 0.03 . 2 . . . . 35 TRP HB3 . 15660 1 272 . 1 1 35 35 TRP HD1 H 1 6.86 0.03 . 1 . . . . 35 TRP HD1 . 15660 1 273 . 1 1 35 35 TRP HE1 H 1 9.69 0.03 . 1 . . . . 35 TRP HE1 . 15660 1 274 . 1 1 35 35 TRP HE3 H 1 7.4 0.03 . 1 . . . . 35 TRP HE3 . 15660 1 275 . 1 1 35 35 TRP HH2 H 1 7.22 0.03 . 1 . . . . 35 TRP HH2 . 15660 1 276 . 1 1 35 35 TRP HZ2 H 1 7.48 0.03 . 1 . . . . 35 TRP HZ2 . 15660 1 277 . 1 1 35 35 TRP HZ3 H 1 7.18 0.03 . 1 . . . . 35 TRP HZ3 . 15660 1 278 . 1 1 35 35 TRP C C 13 177.1 0.3 . 1 . . . . 35 TRP C . 15660 1 279 . 1 1 35 35 TRP CA C 13 61.04 0.3 . 1 . . . . 35 TRP CA . 15660 1 280 . 1 1 35 35 TRP CB C 13 27.02 0.3 . 1 . . . . 35 TRP CB . 15660 1 281 . 1 1 35 35 TRP CD1 C 13 125.7 0.3 . 1 . . . . 35 TRP CD1 . 15660 1 282 . 1 1 35 35 TRP CE3 C 13 119.9 0.3 . 1 . . . . 35 TRP CE3 . 15660 1 283 . 1 1 35 35 TRP CH2 C 13 123.4 0.3 . 1 . . . . 35 TRP CH2 . 15660 1 284 . 1 1 35 35 TRP CZ2 C 13 113.8 0.3 . 1 . . . . 35 TRP CZ2 . 15660 1 285 . 1 1 35 35 TRP CZ3 C 13 128.6 0.3 . 1 . . . . 35 TRP CZ3 . 15660 1 286 . 1 1 35 35 TRP N N 15 120.7 0.2 . 1 . . . . 35 TRP N . 15660 1 287 . 1 1 35 35 TRP NE1 N 15 127.6 0.2 . 1 . . . . 35 TRP NE1 . 15660 1 288 . 1 1 36 36 PHE H H 1 8.44 0.03 . 1 . . . . 36 PHE H . 15660 1 289 . 1 1 36 36 PHE HA H 1 4.73 0.03 . 1 . . . . 36 PHE HA . 15660 1 290 . 1 1 36 36 PHE HB2 H 1 3.29 0.03 . 2 . . . . 36 PHE HB2 . 15660 1 291 . 1 1 36 36 PHE HB3 H 1 3.23 0.03 . 2 . . . . 36 PHE HB3 . 15660 1 292 . 1 1 36 36 PHE HD1 H 1 7.39 0.03 . 3 . . . . 36 PHE HD1 . 15660 1 293 . 1 1 36 36 PHE HE1 H 1 7.45 0.03 . 3 . . . . 36 PHE HE1 . 15660 1 294 . 1 1 36 36 PHE C C 13 176.7 0.3 . 1 . . . . 36 PHE C . 15660 1 295 . 1 1 36 36 PHE CA C 13 58.91 0.3 . 1 . . . . 36 PHE CA . 15660 1 296 . 1 1 36 36 PHE CB C 13 40.86 0.3 . 1 . . . . 36 PHE CB . 15660 1 297 . 1 1 36 36 PHE CD1 C 13 131.1 0.3 . 3 . . . . 36 PHE CD1 . 15660 1 298 . 1 1 36 36 PHE CE1 C 13 130.9 0.3 . 3 . . . . 36 PHE CE1 . 15660 1 299 . 1 1 36 36 PHE N N 15 116.6 0.2 . 1 . . . . 36 PHE N . 15660 1 300 . 1 1 37 37 GLU H H 1 7.51 0.03 . 1 . . . . 37 GLU H . 15660 1 301 . 1 1 37 37 GLU HA H 1 4.37 0.03 . 1 . . . . 37 GLU HA . 15660 1 302 . 1 1 37 37 GLU HB2 H 1 1.99 0.03 . 2 . . . . 37 GLU HB2 . 15660 1 303 . 1 1 37 37 GLU HB3 H 1 1.93 0.03 . 2 . . . . 37 GLU HB3 . 15660 1 304 . 1 1 37 37 GLU HG2 H 1 2.57 0.03 . 2 . . . . 37 GLU HG2 . 15660 1 305 . 1 1 37 37 GLU HG3 H 1 2.56 0.03 . 2 . . . . 37 GLU HG3 . 15660 1 306 . 1 1 37 37 GLU C C 13 175.5 0.3 . 1 . . . . 37 GLU C . 15660 1 307 . 1 1 37 37 GLU CA C 13 56.82 0.3 . 1 . . . . 37 GLU CA . 15660 1 308 . 1 1 37 37 GLU CB C 13 31.98 0.3 . 1 . . . . 37 GLU CB . 15660 1 309 . 1 1 37 37 GLU CG C 13 37.07 0.3 . 1 . . . . 37 GLU CG . 15660 1 310 . 1 1 37 37 GLU N N 15 120.6 0.2 . 1 . . . . 37 GLU N . 15660 1 311 . 1 1 38 38 ASN H H 1 8.34 0.03 . 1 . . . . 38 ASN H . 15660 1 312 . 1 1 38 38 ASN HA H 1 4.71 0.03 . 1 . . . . 38 ASN HA . 15660 1 313 . 1 1 38 38 ASN HB2 H 1 3.02 0.03 . 2 . . . . 38 ASN HB2 . 15660 1 314 . 1 1 38 38 ASN HB3 H 1 2.51 0.03 . 2 . . . . 38 ASN HB3 . 15660 1 315 . 1 1 38 38 ASN HD21 H 1 7.34 0.03 . 2 . . . . 38 ASN HD21 . 15660 1 316 . 1 1 38 38 ASN HD22 H 1 6.83 0.03 . 2 . . . . 38 ASN HD22 . 15660 1 317 . 1 1 38 38 ASN C C 13 174.6 0.3 . 1 . . . . 38 ASN C . 15660 1 318 . 1 1 38 38 ASN CA C 13 52.47 0.3 . 1 . . . . 38 ASN CA . 15660 1 319 . 1 1 38 38 ASN CB C 13 39.59 0.3 . 1 . . . . 38 ASN CB . 15660 1 320 . 1 1 38 38 ASN N N 15 120.8 0.2 . 1 . . . . 38 ASN N . 15660 1 321 . 1 1 38 38 ASN ND2 N 15 110.4 0.2 . 1 . . . . 38 ASN ND2 . 15660 1 322 . 1 1 39 39 LYS H H 1 8.82 0.03 . 1 . . . . 39 LYS H . 15660 1 323 . 1 1 39 39 LYS HA H 1 4.56 0.03 . 1 . . . . 39 LYS HA . 15660 1 324 . 1 1 39 39 LYS HB2 H 1 1.84 0.03 . 2 . . . . 39 LYS HB2 . 15660 1 325 . 1 1 39 39 LYS HB3 H 1 1.79 0.03 . 2 . . . . 39 LYS HB3 . 15660 1 326 . 1 1 39 39 LYS HD2 H 1 1.72 0.03 . 2 . . . . 39 LYS HD2 . 15660 1 327 . 1 1 39 39 LYS HE2 H 1 3.08 0.03 . 2 . . . . 39 LYS HE2 . 15660 1 328 . 1 1 39 39 LYS HG2 H 1 1.55 0.03 . 2 . . . . 39 LYS HG2 . 15660 1 329 . 1 1 39 39 LYS HG3 H 1 1.46 0.03 . 2 . . . . 39 LYS HG3 . 15660 1 330 . 1 1 39 39 LYS C C 13 177 0.3 . 1 . . . . 39 LYS C . 15660 1 331 . 1 1 39 39 LYS CA C 13 55.27 0.3 . 1 . . . . 39 LYS CA . 15660 1 332 . 1 1 39 39 LYS CB C 13 34.07 0.3 . 1 . . . . 39 LYS CB . 15660 1 333 . 1 1 39 39 LYS CD C 13 28.78 0.3 . 1 . . . . 39 LYS CD . 15660 1 334 . 1 1 39 39 LYS CE C 13 41.88 0.3 . 1 . . . . 39 LYS CE . 15660 1 335 . 1 1 39 39 LYS CG C 13 24.06 0.3 . 1 . . . . 39 LYS CG . 15660 1 336 . 1 1 39 39 LYS N N 15 121 0.2 . 1 . . . . 39 LYS N . 15660 1 337 . 1 1 40 40 GLY H H 1 8.62 0.03 . 1 . . . . 40 GLY H . 15660 1 338 . 1 1 40 40 GLY HA2 H 1 3.81 0.03 . 2 . . . . 40 GLY HA2 . 15660 1 339 . 1 1 40 40 GLY HA3 H 1 3.78 0.03 . 2 . . . . 40 GLY HA3 . 15660 1 340 . 1 1 40 40 GLY C C 13 175.3 0.3 . 1 . . . . 40 GLY C . 15660 1 341 . 1 1 40 40 GLY CA C 13 46.98 0.3 . 1 . . . . 40 GLY CA . 15660 1 342 . 1 1 40 40 GLY N N 15 109.6 0.2 . 1 . . . . 40 GLY N . 15660 1 343 . 1 1 41 41 LEU H H 1 7.83 0.03 . 1 . . . . 41 LEU H . 15660 1 344 . 1 1 41 41 LEU HA H 1 4.4 0.03 . 1 . . . . 41 LEU HA . 15660 1 345 . 1 1 41 41 LEU HB2 H 1 1.03 0.03 . 2 . . . . 41 LEU HB2 . 15660 1 346 . 1 1 41 41 LEU HB3 H 1 1.47 0.03 . 2 . . . . 41 LEU HB3 . 15660 1 347 . 1 1 41 41 LEU HD11 H 1 0.38 0.03 . 2 . . . . 41 LEU HD11 . 15660 1 348 . 1 1 41 41 LEU HD12 H 1 0.38 0.03 . 2 . . . . 41 LEU HD12 . 15660 1 349 . 1 1 41 41 LEU HD13 H 1 0.38 0.03 . 2 . . . . 41 LEU HD13 . 15660 1 350 . 1 1 41 41 LEU HD21 H 1 0.06 0.03 . 2 . . . . 41 LEU HD21 . 15660 1 351 . 1 1 41 41 LEU HD22 H 1 0.06 0.03 . 2 . . . . 41 LEU HD22 . 15660 1 352 . 1 1 41 41 LEU HD23 H 1 0.06 0.03 . 2 . . . . 41 LEU HD23 . 15660 1 353 . 1 1 41 41 LEU HG H 1 1.14 0.03 . 1 . . . . 41 LEU HG . 15660 1 354 . 1 1 41 41 LEU C C 13 177.9 0.3 . 1 . . . . 41 LEU C . 15660 1 355 . 1 1 41 41 LEU CA C 13 54.37 0.3 . 1 . . . . 41 LEU CA . 15660 1 356 . 1 1 41 41 LEU CB C 13 42.7 0.3 . 1 . . . . 41 LEU CB . 15660 1 357 . 1 1 41 41 LEU CD1 C 13 21.73 0.3 . 2 . . . . 41 LEU CD1 . 15660 1 358 . 1 1 41 41 LEU CD2 C 13 24.93 0.3 . 2 . . . . 41 LEU CD2 . 15660 1 359 . 1 1 41 41 LEU CG C 13 26.09 0.3 . 1 . . . . 41 LEU CG . 15660 1 360 . 1 1 41 41 LEU N N 15 115 0.2 . 1 . . . . 41 LEU N . 15660 1 361 . 1 1 42 42 VAL H H 1 9.4 0.03 . 1 . . . . 42 VAL H . 15660 1 362 . 1 1 42 42 VAL HA H 1 4.45 0.03 . 1 . . . . 42 VAL HA . 15660 1 363 . 1 1 42 42 VAL HB H 1 2.04 0.03 . 1 . . . . 42 VAL HB . 15660 1 364 . 1 1 42 42 VAL HG11 H 1 0.82 0.03 . 2 . . . . 42 VAL HG11 . 15660 1 365 . 1 1 42 42 VAL HG12 H 1 0.82 0.03 . 2 . . . . 42 VAL HG12 . 15660 1 366 . 1 1 42 42 VAL HG13 H 1 0.82 0.03 . 2 . . . . 42 VAL HG13 . 15660 1 367 . 1 1 42 42 VAL HG21 H 1 0.9 0.03 . 2 . . . . 42 VAL HG21 . 15660 1 368 . 1 1 42 42 VAL HG22 H 1 0.9 0.03 . 2 . . . . 42 VAL HG22 . 15660 1 369 . 1 1 42 42 VAL HG23 H 1 0.9 0.03 . 2 . . . . 42 VAL HG23 . 15660 1 370 . 1 1 42 42 VAL C C 13 175.5 0.3 . 1 . . . . 42 VAL C . 15660 1 371 . 1 1 42 42 VAL CA C 13 59.77 0.3 . 1 . . . . 42 VAL CA . 15660 1 372 . 1 1 42 42 VAL CB C 13 34.61 0.3 . 1 . . . . 42 VAL CB . 15660 1 373 . 1 1 42 42 VAL CG1 C 13 19.93 0.3 . 2 . . . . 42 VAL CG1 . 15660 1 374 . 1 1 42 42 VAL CG2 C 13 21.44 0.3 . 2 . . . . 42 VAL CG2 . 15660 1 375 . 1 1 42 42 VAL N N 15 118 0.2 . 1 . . . . 42 VAL N . 15660 1 376 . 1 1 43 43 GLU H H 1 8.61 0.03 . 1 . . . . 43 GLU H . 15660 1 377 . 1 1 43 43 GLU HA H 1 3.82 0.03 . 1 . . . . 43 GLU HA . 15660 1 378 . 1 1 43 43 GLU HB2 H 1 1.84 0.03 . 2 . . . . 43 GLU HB2 . 15660 1 379 . 1 1 43 43 GLU HB3 H 1 1.78 0.03 . 2 . . . . 43 GLU HB3 . 15660 1 380 . 1 1 43 43 GLU HG2 H 1 2.08 0.03 . 2 . . . . 43 GLU HG2 . 15660 1 381 . 1 1 43 43 GLU HG3 H 1 2.03 0.03 . 2 . . . . 43 GLU HG3 . 15660 1 382 . 1 1 43 43 GLU C C 13 175.7 0.3 . 1 . . . . 43 GLU C . 15660 1 383 . 1 1 43 43 GLU CA C 13 57.34 0.3 . 1 . . . . 43 GLU CA . 15660 1 384 . 1 1 43 43 GLU CB C 13 30.35 0.3 . 1 . . . . 43 GLU CB . 15660 1 385 . 1 1 43 43 GLU CG C 13 36.63 0.3 . 1 . . . . 43 GLU CG . 15660 1 386 . 1 1 43 43 GLU N N 15 123.1 0.2 . 1 . . . . 43 GLU N . 15660 1 387 . 1 1 44 44 CYS H H 1 8.34 0.03 . 1 . . . . 44 CYS H . 15660 1 388 . 1 1 44 44 CYS HA H 1 4.19 0.03 . 1 . . . . 44 CYS HA . 15660 1 389 . 1 1 44 44 CYS HB2 H 1 1.96 0.03 . 2 . . . . 44 CYS HB2 . 15660 1 390 . 1 1 44 44 CYS HB3 H 1 1.24 0.03 . 2 . . . . 44 CYS HB3 . 15660 1 391 . 1 1 44 44 CYS C C 13 175.3 0.3 . 1 . . . . 44 CYS C . 15660 1 392 . 1 1 44 44 CYS CA C 13 57.95 0.3 . 1 . . . . 44 CYS CA . 15660 1 393 . 1 1 44 44 CYS CB C 13 28.33 0.3 . 1 . . . . 44 CYS CB . 15660 1 394 . 1 1 44 44 CYS N N 15 128.8 0.2 . 1 . . . . 44 CYS N . 15660 1 395 . 1 1 45 45 ASN H H 1 8.82 0.03 . 1 . . . . 45 ASN H . 15660 1 396 . 1 1 45 45 ASN HA H 1 4.17 0.03 . 1 . . . . 45 ASN HA . 15660 1 397 . 1 1 45 45 ASN HB2 H 1 3.45 0.03 . 2 . . . . 45 ASN HB2 . 15660 1 398 . 1 1 45 45 ASN HB3 H 1 3.03 0.03 . 2 . . . . 45 ASN HB3 . 15660 1 399 . 1 1 45 45 ASN HD21 H 1 7.74 0.03 . 2 . . . . 45 ASN HD21 . 15660 1 400 . 1 1 45 45 ASN HD22 H 1 7.15 0.03 . 2 . . . . 45 ASN HD22 . 15660 1 401 . 1 1 45 45 ASN C C 13 174.6 0.3 . 1 . . . . 45 ASN C . 15660 1 402 . 1 1 45 45 ASN CA C 13 56.86 0.3 . 1 . . . . 45 ASN CA . 15660 1 403 . 1 1 45 45 ASN CB C 13 39.57 0.3 . 1 . . . . 45 ASN CB . 15660 1 404 . 1 1 45 45 ASN N N 15 119 0.2 . 1 . . . . 45 ASN N . 15660 1 405 . 1 1 45 45 ASN ND2 N 15 120.6 0.2 . 1 . . . . 45 ASN ND2 . 15660 1 406 . 1 1 46 46 ASN H H 1 8.04 0.03 . 1 . . . . 46 ASN H . 15660 1 407 . 1 1 46 46 ASN HA H 1 4.52 0.03 . 1 . . . . 46 ASN HA . 15660 1 408 . 1 1 46 46 ASN HB2 H 1 3.17 0.03 . 2 . . . . 46 ASN HB2 . 15660 1 409 . 1 1 46 46 ASN HB3 H 1 2.81 0.03 . 2 . . . . 46 ASN HB3 . 15660 1 410 . 1 1 46 46 ASN HD21 H 1 7.54 0.03 . 2 . . . . 46 ASN HD21 . 15660 1 411 . 1 1 46 46 ASN HD22 H 1 6.78 0.03 . 2 . . . . 46 ASN HD22 . 15660 1 412 . 1 1 46 46 ASN C C 13 174 0.3 . 1 . . . . 46 ASN C . 15660 1 413 . 1 1 46 46 ASN CA C 13 52.87 0.3 . 1 . . . . 46 ASN CA . 15660 1 414 . 1 1 46 46 ASN CB C 13 37.84 0.3 . 1 . . . . 46 ASN CB . 15660 1 415 . 1 1 46 46 ASN N N 15 117 0.2 . 1 . . . . 46 ASN N . 15660 1 416 . 1 1 46 46 ASN ND2 N 15 109.4 0.2 . 1 . . . . 46 ASN ND2 . 15660 1 417 . 1 1 47 47 HIS H H 1 7.52 0.03 . 1 . . . . 47 HIS H . 15660 1 418 . 1 1 47 47 HIS HA H 1 4.72 0.03 . 1 . . . . 47 HIS HA . 15660 1 419 . 1 1 47 47 HIS HB2 H 1 3.41 0.03 . 2 . . . . 47 HIS HB2 . 15660 1 420 . 1 1 47 47 HIS HB3 H 1 3.32 0.03 . 2 . . . . 47 HIS HB3 . 15660 1 421 . 1 1 47 47 HIS HD2 H 1 7.51 0.03 . 1 . . . . 47 HIS HD2 . 15660 1 422 . 1 1 47 47 HIS HE1 H 1 7.35 0.03 . 1 . . . . 47 HIS HE1 . 15660 1 423 . 1 1 47 47 HIS C C 13 171.9 0.3 . 1 . . . . 47 HIS C . 15660 1 424 . 1 1 47 47 HIS CA C 13 54.44 0.3 . 1 . . . . 47 HIS CA . 15660 1 425 . 1 1 47 47 HIS CB C 13 30 0.3 . 1 . . . . 47 HIS CB . 15660 1 426 . 1 1 47 47 HIS CD2 C 13 130.5 0.3 . 1 . . . . 47 HIS CD2 . 15660 1 427 . 1 1 47 47 HIS CE1 C 13 137.7 0.3 . 1 . . . . 47 HIS CE1 . 15660 1 428 . 1 1 47 47 HIS N N 15 112.7 0.2 . 1 . . . . 47 HIS N . 15660 1 429 . 1 1 47 47 HIS ND1 N 15 168.7 0.2 . 1 . . . . 47 HIS ND1 . 15660 1 430 . 1 1 47 47 HIS NE2 N 15 218.2 0.2 . 1 . . . . 47 HIS NE2 . 15660 1 431 . 1 1 48 48 TYR H H 1 9.91 0.03 . 1 . . . . 48 TYR H . 15660 1 432 . 1 1 48 48 TYR HA H 1 5.31 0.03 . 1 . . . . 48 TYR HA . 15660 1 433 . 1 1 48 48 TYR HB2 H 1 2.93 0.03 . 1 . . . . 48 TYR HB2 . 15660 1 434 . 1 1 48 48 TYR HB3 H 1 2.71 0.03 . 1 . . . . 48 TYR HB3 . 15660 1 435 . 1 1 48 48 TYR HD1 H 1 6.85 0.03 . 3 . . . . 48 TYR HD1 . 15660 1 436 . 1 1 48 48 TYR HE1 H 1 6.59 0.03 . 3 . . . . 48 TYR HE1 . 15660 1 437 . 1 1 48 48 TYR C C 13 178.9 0.3 . 1 . . . . 48 TYR C . 15660 1 438 . 1 1 48 48 TYR CA C 13 57.4 0.3 . 1 . . . . 48 TYR CA . 15660 1 439 . 1 1 48 48 TYR CB C 13 42.43 0.3 . 1 . . . . 48 TYR CB . 15660 1 440 . 1 1 48 48 TYR CD1 C 13 132.2 0.3 . 3 . . . . 48 TYR CD1 . 15660 1 441 . 1 1 48 48 TYR CE1 C 13 117.6 0.3 . 3 . . . . 48 TYR CE1 . 15660 1 442 . 1 1 48 48 TYR N N 15 115.8 0.2 . 1 . . . . 48 TYR N . 15660 1 443 . 1 1 49 49 LEU H H 1 9.37 0.03 . 1 . . . . 49 LEU H . 15660 1 444 . 1 1 49 49 LEU HA H 1 5.91 0.03 . 1 . . . . 49 LEU HA . 15660 1 445 . 1 1 49 49 LEU HB2 H 1 1.64 0.03 . 2 . . . . 49 LEU HB2 . 15660 1 446 . 1 1 49 49 LEU HB3 H 1 1.5 0.03 . 2 . . . . 49 LEU HB3 . 15660 1 447 . 1 1 49 49 LEU HD11 H 1 1.05 0.03 . 2 . . . . 49 LEU HD11 . 15660 1 448 . 1 1 49 49 LEU HD12 H 1 1.05 0.03 . 2 . . . . 49 LEU HD12 . 15660 1 449 . 1 1 49 49 LEU HD13 H 1 1.05 0.03 . 2 . . . . 49 LEU HD13 . 15660 1 450 . 1 1 49 49 LEU HD21 H 1 1.22 0.03 . 2 . . . . 49 LEU HD21 . 15660 1 451 . 1 1 49 49 LEU HD22 H 1 1.22 0.03 . 2 . . . . 49 LEU HD22 . 15660 1 452 . 1 1 49 49 LEU HD23 H 1 1.22 0.03 . 2 . . . . 49 LEU HD23 . 15660 1 453 . 1 1 49 49 LEU HG H 1 1.51 0.03 . 1 . . . . 49 LEU HG . 15660 1 454 . 1 1 49 49 LEU C C 13 175.5 0.3 . 1 . . . . 49 LEU C . 15660 1 455 . 1 1 49 49 LEU CA C 13 54.01 0.3 . 1 . . . . 49 LEU CA . 15660 1 456 . 1 1 49 49 LEU CB C 13 48.67 0.3 . 1 . . . . 49 LEU CB . 15660 1 457 . 1 1 49 49 LEU CD1 C 13 27.88 0.3 . 2 . . . . 49 LEU CD1 . 15660 1 458 . 1 1 49 49 LEU CD2 C 13 25.21 0.3 . 2 . . . . 49 LEU CD2 . 15660 1 459 . 1 1 49 49 LEU CG C 13 24.64 0.3 . 1 . . . . 49 LEU CG . 15660 1 460 . 1 1 49 49 LEU N N 15 123.7 0.2 . 1 . . . . 49 LEU N . 15660 1 461 . 1 1 50 50 CYS H H 1 9.91 0.03 . 1 . . . . 50 CYS H . 15660 1 462 . 1 1 50 50 CYS HA H 1 5.09 0.03 . 1 . . . . 50 CYS HA . 15660 1 463 . 1 1 50 50 CYS HB2 H 1 3.54 0.03 . 2 . . . . 50 CYS HB2 . 15660 1 464 . 1 1 50 50 CYS HB3 H 1 2.62 0.03 . 2 . . . . 50 CYS HB3 . 15660 1 465 . 1 1 50 50 CYS C C 13 175.8 0.3 . 1 . . . . 50 CYS C . 15660 1 466 . 1 1 50 50 CYS CA C 13 57.11 0.3 . 1 . . . . 50 CYS CA . 15660 1 467 . 1 1 50 50 CYS CB C 13 32.05 0.3 . 1 . . . . 50 CYS CB . 15660 1 468 . 1 1 50 50 CYS N N 15 120.3 0.2 . 1 . . . . 50 CYS N . 15660 1 469 . 1 1 51 51 LEU H H 1 8.5 0.03 . 1 . . . . 51 LEU H . 15660 1 470 . 1 1 51 51 LEU HA H 1 4.06 0.03 . 1 . . . . 51 LEU HA . 15660 1 471 . 1 1 51 51 LEU HB2 H 1 1.63 0.03 . 2 . . . . 51 LEU HB2 . 15660 1 472 . 1 1 51 51 LEU HB3 H 1 1.78 0.03 . 2 . . . . 51 LEU HB3 . 15660 1 473 . 1 1 51 51 LEU HD11 H 1 0.91 0.03 . 2 . . . . 51 LEU HD11 . 15660 1 474 . 1 1 51 51 LEU HD12 H 1 0.91 0.03 . 2 . . . . 51 LEU HD12 . 15660 1 475 . 1 1 51 51 LEU HD13 H 1 0.91 0.03 . 2 . . . . 51 LEU HD13 . 15660 1 476 . 1 1 51 51 LEU HD21 H 1 0.97 0.03 . 2 . . . . 51 LEU HD21 . 15660 1 477 . 1 1 51 51 LEU HD22 H 1 0.97 0.03 . 2 . . . . 51 LEU HD22 . 15660 1 478 . 1 1 51 51 LEU HD23 H 1 0.97 0.03 . 2 . . . . 51 LEU HD23 . 15660 1 479 . 1 1 51 51 LEU HG H 1 1.85 0.03 . 1 . . . . 51 LEU HG . 15660 1 480 . 1 1 51 51 LEU C C 13 180.4 0.3 . 1 . . . . 51 LEU C . 15660 1 481 . 1 1 51 51 LEU CA C 13 58.12 0.3 . 1 . . . . 51 LEU CA . 15660 1 482 . 1 1 51 51 LEU CB C 13 41.67 0.3 . 1 . . . . 51 LEU CB . 15660 1 483 . 1 1 51 51 LEU CD1 C 13 24.25 0.3 . 2 . . . . 51 LEU CD1 . 15660 1 484 . 1 1 51 51 LEU CD2 C 13 24.37 0.3 . 2 . . . . 51 LEU CD2 . 15660 1 485 . 1 1 51 51 LEU CG C 13 27.1 0.3 . 1 . . . . 51 LEU CG . 15660 1 486 . 1 1 51 51 LEU N N 15 119.2 0.2 . 1 . . . . 51 LEU N . 15660 1 487 . 1 1 52 52 ASN H H 1 8.52 0.03 . 1 . . . . 52 ASN H . 15660 1 488 . 1 1 52 52 ASN HA H 1 4.49 0.03 . 1 . . . . 52 ASN HA . 15660 1 489 . 1 1 52 52 ASN HB2 H 1 3.04 0.03 . 2 . . . . 52 ASN HB2 . 15660 1 490 . 1 1 52 52 ASN HB3 H 1 2.98 0.03 . 2 . . . . 52 ASN HB3 . 15660 1 491 . 1 1 52 52 ASN HD21 H 1 8.06 0.03 . 2 . . . . 52 ASN HD21 . 15660 1 492 . 1 1 52 52 ASN HD22 H 1 7.02 0.03 . 2 . . . . 52 ASN HD22 . 15660 1 493 . 1 1 52 52 ASN C C 13 178.7 0.3 . 1 . . . . 52 ASN C . 15660 1 494 . 1 1 52 52 ASN CA C 13 57.2 0.3 . 1 . . . . 52 ASN CA . 15660 1 495 . 1 1 52 52 ASN CB C 13 38.62 0.3 . 1 . . . . 52 ASN CB . 15660 1 496 . 1 1 52 52 ASN N N 15 119.3 0.2 . 1 . . . . 52 ASN N . 15660 1 497 . 1 1 52 52 ASN ND2 N 15 114 0.2 . 1 . . . . 52 ASN ND2 . 15660 1 498 . 1 1 53 53 CYS H H 1 9.34 0.03 . 1 . . . . 53 CYS H . 15660 1 499 . 1 1 53 53 CYS HA H 1 4.05 0.03 . 1 . . . . 53 CYS HA . 15660 1 500 . 1 1 53 53 CYS HB2 H 1 3.12 0.03 . 2 . . . . 53 CYS HB2 . 15660 1 501 . 1 1 53 53 CYS HB3 H 1 2.76 0.03 . 2 . . . . 53 CYS HB3 . 15660 1 502 . 1 1 53 53 CYS C C 13 177.9 0.3 . 1 . . . . 53 CYS C . 15660 1 503 . 1 1 53 53 CYS CA C 13 65.62 0.3 . 1 . . . . 53 CYS CA . 15660 1 504 . 1 1 53 53 CYS CB C 13 29.13 0.3 . 1 . . . . 53 CYS CB . 15660 1 505 . 1 1 53 53 CYS N N 15 123.1 0.2 . 1 . . . . 53 CYS N . 15660 1 506 . 1 1 54 54 LEU H H 1 8.97 0.03 . 1 . . . . 54 LEU H . 15660 1 507 . 1 1 54 54 LEU HA H 1 4.06 0.03 . 1 . . . . 54 LEU HA . 15660 1 508 . 1 1 54 54 LEU HB2 H 1 2.1 0.03 . 2 . . . . 54 LEU HB2 . 15660 1 509 . 1 1 54 54 LEU HB3 H 1 1.43 0.03 . 2 . . . . 54 LEU HB3 . 15660 1 510 . 1 1 54 54 LEU HD11 H 1 1.01 0.03 . 2 . . . . 54 LEU HD11 . 15660 1 511 . 1 1 54 54 LEU HD12 H 1 1.01 0.03 . 2 . . . . 54 LEU HD12 . 15660 1 512 . 1 1 54 54 LEU HD13 H 1 1.01 0.03 . 2 . . . . 54 LEU HD13 . 15660 1 513 . 1 1 54 54 LEU HD21 H 1 0.89 0.03 . 2 . . . . 54 LEU HD21 . 15660 1 514 . 1 1 54 54 LEU HD22 H 1 0.89 0.03 . 2 . . . . 54 LEU HD22 . 15660 1 515 . 1 1 54 54 LEU HD23 H 1 0.89 0.03 . 2 . . . . 54 LEU HD23 . 15660 1 516 . 1 1 54 54 LEU HG H 1 1.62 0.03 . 1 . . . . 54 LEU HG . 15660 1 517 . 1 1 54 54 LEU C C 13 178 0.3 . 1 . . . . 54 LEU C . 15660 1 518 . 1 1 54 54 LEU CA C 13 58.86 0.3 . 1 . . . . 54 LEU CA . 15660 1 519 . 1 1 54 54 LEU CB C 13 42.19 0.3 . 1 . . . . 54 LEU CB . 15660 1 520 . 1 1 54 54 LEU CD1 C 13 24.38 0.3 . 2 . . . . 54 LEU CD1 . 15660 1 521 . 1 1 54 54 LEU CD2 C 13 26.7 0.3 . 2 . . . . 54 LEU CD2 . 15660 1 522 . 1 1 54 54 LEU CG C 13 27.35 0.3 . 1 . . . . 54 LEU CG . 15660 1 523 . 1 1 54 54 LEU N N 15 119 0.2 . 1 . . . . 54 LEU N . 15660 1 524 . 1 1 55 55 THR H H 1 8.08 0.03 . 1 . . . . 55 THR H . 15660 1 525 . 1 1 55 55 THR HA H 1 3.79 0.03 . 1 . . . . 55 THR HA . 15660 1 526 . 1 1 55 55 THR HB H 1 4.36 0.03 . 1 . . . . 55 THR HB . 15660 1 527 . 1 1 55 55 THR HG21 H 1 1.26 0.03 . 1 . . . . 55 THR HG21 . 15660 1 528 . 1 1 55 55 THR HG22 H 1 1.26 0.03 . 1 . . . . 55 THR HG22 . 15660 1 529 . 1 1 55 55 THR HG23 H 1 1.26 0.03 . 1 . . . . 55 THR HG23 . 15660 1 530 . 1 1 55 55 THR C C 13 177.4 0.3 . 1 . . . . 55 THR C . 15660 1 531 . 1 1 55 55 THR CA C 13 67.11 0.3 . 1 . . . . 55 THR CA . 15660 1 532 . 1 1 55 55 THR CB C 13 68.96 0.3 . 1 . . . . 55 THR CB . 15660 1 533 . 1 1 55 55 THR CG2 C 13 21.22 0.3 . 1 . . . . 55 THR CG2 . 15660 1 534 . 1 1 55 55 THR N N 15 112.1 0.2 . 1 . . . . 55 THR N . 15660 1 535 . 1 1 56 56 LEU H H 1 7.73 0.03 . 1 . . . . 56 LEU H . 15660 1 536 . 1 1 56 56 LEU HA H 1 4.11 0.03 . 1 . . . . 56 LEU HA . 15660 1 537 . 1 1 56 56 LEU HB2 H 1 1.86 0.03 . 2 . . . . 56 LEU HB2 . 15660 1 538 . 1 1 56 56 LEU HB3 H 1 1.72 0.03 . 2 . . . . 56 LEU HB3 . 15660 1 539 . 1 1 56 56 LEU HD11 H 1 0.93 0.03 . 2 . . . . 56 LEU HD11 . 15660 1 540 . 1 1 56 56 LEU HD12 H 1 0.93 0.03 . 2 . . . . 56 LEU HD12 . 15660 1 541 . 1 1 56 56 LEU HD13 H 1 0.93 0.03 . 2 . . . . 56 LEU HD13 . 15660 1 542 . 1 1 56 56 LEU HD21 H 1 0.88 0.03 . 2 . . . . 56 LEU HD21 . 15660 1 543 . 1 1 56 56 LEU HD22 H 1 0.88 0.03 . 2 . . . . 56 LEU HD22 . 15660 1 544 . 1 1 56 56 LEU HD23 H 1 0.88 0.03 . 2 . . . . 56 LEU HD23 . 15660 1 545 . 1 1 56 56 LEU HG H 1 1.75 0.03 . 1 . . . . 56 LEU HG . 15660 1 546 . 1 1 56 56 LEU C C 13 181.3 0.3 . 1 . . . . 56 LEU C . 15660 1 547 . 1 1 56 56 LEU CA C 13 58.2 0.3 . 1 . . . . 56 LEU CA . 15660 1 548 . 1 1 56 56 LEU CB C 13 42.02 0.3 . 1 . . . . 56 LEU CB . 15660 1 549 . 1 1 56 56 LEU CD1 C 13 24.56 0.3 . 2 . . . . 56 LEU CD1 . 15660 1 550 . 1 1 56 56 LEU CD2 C 13 24.04 0.3 . 2 . . . . 56 LEU CD2 . 15660 1 551 . 1 1 56 56 LEU CG C 13 27.03 0.3 . 1 . . . . 56 LEU CG . 15660 1 552 . 1 1 56 56 LEU N N 15 121.9 0.2 . 1 . . . . 56 LEU N . 15660 1 553 . 1 1 57 57 LEU H H 1 9.1 0.03 . 1 . . . . 57 LEU H . 15660 1 554 . 1 1 57 57 LEU HA H 1 4.08 0.03 . 1 . . . . 57 LEU HA . 15660 1 555 . 1 1 57 57 LEU HB2 H 1 1.99 0.03 . 2 . . . . 57 LEU HB2 . 15660 1 556 . 1 1 57 57 LEU HB3 H 1 1.74 0.03 . 2 . . . . 57 LEU HB3 . 15660 1 557 . 1 1 57 57 LEU HD11 H 1 0.98 0.03 . 2 . . . . 57 LEU HD11 . 15660 1 558 . 1 1 57 57 LEU HD12 H 1 0.98 0.03 . 2 . . . . 57 LEU HD12 . 15660 1 559 . 1 1 57 57 LEU HD13 H 1 0.98 0.03 . 2 . . . . 57 LEU HD13 . 15660 1 560 . 1 1 57 57 LEU HD21 H 1 1 0.03 . 2 . . . . 57 LEU HD21 . 15660 1 561 . 1 1 57 57 LEU HD22 H 1 1 0.03 . 2 . . . . 57 LEU HD22 . 15660 1 562 . 1 1 57 57 LEU HD23 H 1 1 0.03 . 2 . . . . 57 LEU HD23 . 15660 1 563 . 1 1 57 57 LEU HG H 1 2.08 0.03 . 1 . . . . 57 LEU HG . 15660 1 564 . 1 1 57 57 LEU C C 13 181 0.3 . 1 . . . . 57 LEU C . 15660 1 565 . 1 1 57 57 LEU CA C 13 58.5 0.3 . 1 . . . . 57 LEU CA . 15660 1 566 . 1 1 57 57 LEU CB C 13 41.22 0.3 . 1 . . . . 57 LEU CB . 15660 1 567 . 1 1 57 57 LEU CD1 C 13 22.9 0.3 . 2 . . . . 57 LEU CD1 . 15660 1 568 . 1 1 57 57 LEU CD2 C 13 25.7 0.3 . 2 . . . . 57 LEU CD2 . 15660 1 569 . 1 1 57 57 LEU CG C 13 27.24 0.3 . 1 . . . . 57 LEU CG . 15660 1 570 . 1 1 57 57 LEU N N 15 122 0.2 . 1 . . . . 57 LEU N . 15660 1 571 . 1 1 58 58 LEU H H 1 8.67 0.03 . 1 . . . . 58 LEU H . 15660 1 572 . 1 1 58 58 LEU HA H 1 4.44 0.03 . 1 . . . . 58 LEU HA . 15660 1 573 . 1 1 58 58 LEU HB2 H 1 1.92 0.03 . 2 . . . . 58 LEU HB2 . 15660 1 574 . 1 1 58 58 LEU HB3 H 1 1.41 0.03 . 2 . . . . 58 LEU HB3 . 15660 1 575 . 1 1 58 58 LEU HD11 H 1 0.92 0.03 . 2 . . . . 58 LEU HD11 . 15660 1 576 . 1 1 58 58 LEU HD12 H 1 0.92 0.03 . 2 . . . . 58 LEU HD12 . 15660 1 577 . 1 1 58 58 LEU HD13 H 1 0.92 0.03 . 2 . . . . 58 LEU HD13 . 15660 1 578 . 1 1 58 58 LEU HD21 H 1 0.93 0.03 . 2 . . . . 58 LEU HD21 . 15660 1 579 . 1 1 58 58 LEU HD22 H 1 0.93 0.03 . 2 . . . . 58 LEU HD22 . 15660 1 580 . 1 1 58 58 LEU HD23 H 1 0.93 0.03 . 2 . . . . 58 LEU HD23 . 15660 1 581 . 1 1 58 58 LEU HG H 1 1.82 0.03 . 1 . . . . 58 LEU HG . 15660 1 582 . 1 1 58 58 LEU C C 13 179.3 0.3 . 1 . . . . 58 LEU C . 15660 1 583 . 1 1 58 58 LEU CA C 13 56.68 0.3 . 1 . . . . 58 LEU CA . 15660 1 584 . 1 1 58 58 LEU CB C 13 43.07 0.3 . 1 . . . . 58 LEU CB . 15660 1 585 . 1 1 58 58 LEU CD1 C 13 25.87 0.3 . 2 . . . . 58 LEU CD1 . 15660 1 586 . 1 1 58 58 LEU CD2 C 13 24.38 0.3 . 2 . . . . 58 LEU CD2 . 15660 1 587 . 1 1 58 58 LEU CG C 13 27.63 0.3 . 1 . . . . 58 LEU CG . 15660 1 588 . 1 1 58 58 LEU N N 15 119.9 0.2 . 1 . . . . 58 LEU N . 15660 1 589 . 1 1 59 59 SER H H 1 7.51 0.03 . 1 . . . . 59 SER H . 15660 1 590 . 1 1 59 59 SER HA H 1 4.32 0.03 . 1 . . . . 59 SER HA . 15660 1 591 . 1 1 59 59 SER HB2 H 1 4.09 0.03 . 2 . . . . 59 SER HB2 . 15660 1 592 . 1 1 59 59 SER HB3 H 1 4.04 0.03 . 2 . . . . 59 SER HB3 . 15660 1 593 . 1 1 59 59 SER C C 13 175.1 0.3 . 1 . . . . 59 SER C . 15660 1 594 . 1 1 59 59 SER CA C 13 60.51 0.3 . 1 . . . . 59 SER CA . 15660 1 595 . 1 1 59 59 SER CB C 13 63.39 0.3 . 1 . . . . 59 SER CB . 15660 1 596 . 1 1 59 59 SER N N 15 111.6 0.2 . 1 . . . . 59 SER N . 15660 1 597 . 1 1 60 60 VAL H H 1 7.58 0.03 . 1 . . . . 60 VAL H . 15660 1 598 . 1 1 60 60 VAL HA H 1 4.13 0.03 . 1 . . . . 60 VAL HA . 15660 1 599 . 1 1 60 60 VAL HB H 1 2.24 0.03 . 1 . . . . 60 VAL HB . 15660 1 600 . 1 1 60 60 VAL HG11 H 1 1.04 0.03 . 2 . . . . 60 VAL HG11 . 15660 1 601 . 1 1 60 60 VAL HG12 H 1 1.04 0.03 . 2 . . . . 60 VAL HG12 . 15660 1 602 . 1 1 60 60 VAL HG13 H 1 1.04 0.03 . 2 . . . . 60 VAL HG13 . 15660 1 603 . 1 1 60 60 VAL HG21 H 1 1.01 0.03 . 2 . . . . 60 VAL HG21 . 15660 1 604 . 1 1 60 60 VAL HG22 H 1 1.01 0.03 . 2 . . . . 60 VAL HG22 . 15660 1 605 . 1 1 60 60 VAL HG23 H 1 1.01 0.03 . 2 . . . . 60 VAL HG23 . 15660 1 606 . 1 1 60 60 VAL C C 13 176.8 0.3 . 1 . . . . 60 VAL C . 15660 1 607 . 1 1 60 60 VAL CA C 13 63.93 0.3 . 1 . . . . 60 VAL CA . 15660 1 608 . 1 1 60 60 VAL CB C 13 33.51 0.3 . 1 . . . . 60 VAL CB . 15660 1 609 . 1 1 60 60 VAL CG1 C 13 20.84 0.3 . 2 . . . . 60 VAL CG1 . 15660 1 610 . 1 1 60 60 VAL CG2 C 13 21.58 0.3 . 2 . . . . 60 VAL CG2 . 15660 1 611 . 1 1 60 60 VAL N N 15 119.3 0.2 . 1 . . . . 60 VAL N . 15660 1 612 . 1 1 61 61 SER H H 1 8.16 0.03 . 1 . . . . 61 SER H . 15660 1 613 . 1 1 61 61 SER HA H 1 4.57 0.03 . 1 . . . . 61 SER HA . 15660 1 614 . 1 1 61 61 SER HB2 H 1 4.08 0.03 . 2 . . . . 61 SER HB2 . 15660 1 615 . 1 1 61 61 SER HB3 H 1 3.77 0.03 . 2 . . . . 61 SER HB3 . 15660 1 616 . 1 1 61 61 SER C C 13 172.2 0.3 . 1 . . . . 61 SER C . 15660 1 617 . 1 1 61 61 SER CA C 13 57.22 0.3 . 1 . . . . 61 SER CA . 15660 1 618 . 1 1 61 61 SER CB C 13 63.89 0.3 . 1 . . . . 61 SER CB . 15660 1 619 . 1 1 61 61 SER N N 15 112.7 0.2 . 1 . . . . 61 SER N . 15660 1 620 . 1 1 62 62 ASN H H 1 8.19 0.03 . 1 . . . . 62 ASN H . 15660 1 621 . 1 1 62 62 ASN HA H 1 4.76 0.03 . 1 . . . . 62 ASN HA . 15660 1 622 . 1 1 62 62 ASN HB2 H 1 2.87 0.03 . 2 . . . . 62 ASN HB2 . 15660 1 623 . 1 1 62 62 ASN HB3 H 1 2.84 0.03 . 2 . . . . 62 ASN HB3 . 15660 1 624 . 1 1 62 62 ASN HD21 H 1 7.63 0.03 . 2 . . . . 62 ASN HD21 . 15660 1 625 . 1 1 62 62 ASN HD22 H 1 6.94 0.03 . 2 . . . . 62 ASN HD22 . 15660 1 626 . 1 1 62 62 ASN C C 13 175.9 0.3 . 1 . . . . 62 ASN C . 15660 1 627 . 1 1 62 62 ASN CA C 13 53.8 0.3 . 1 . . . . 62 ASN CA . 15660 1 628 . 1 1 62 62 ASN CB C 13 38.39 0.3 . 1 . . . . 62 ASN CB . 15660 1 629 . 1 1 62 62 ASN N N 15 115.7 0.2 . 1 . . . . 62 ASN N . 15660 1 630 . 1 1 62 62 ASN ND2 N 15 111.6 0.2 . 1 . . . . 62 ASN ND2 . 15660 1 631 . 1 1 63 63 ARG H H 1 8.49 0.03 . 1 . . . . 63 ARG H . 15660 1 632 . 1 1 63 63 ARG HA H 1 4.3 0.03 . 1 . . . . 63 ARG HA . 15660 1 633 . 1 1 63 63 ARG HB2 H 1 1.58 0.03 . 2 . . . . 63 ARG HB2 . 15660 1 634 . 1 1 63 63 ARG HB3 H 1 1.53 0.03 . 2 . . . . 63 ARG HB3 . 15660 1 635 . 1 1 63 63 ARG HD2 H 1 3 0.03 . 2 . . . . 63 ARG HD2 . 15660 1 636 . 1 1 63 63 ARG HG2 H 1 1.28 0.03 . 2 . . . . 63 ARG HG2 . 15660 1 637 . 1 1 63 63 ARG HG3 H 1 1.22 0.03 . 2 . . . . 63 ARG HG3 . 15660 1 638 . 1 1 63 63 ARG C C 13 175.1 0.3 . 1 . . . . 63 ARG C . 15660 1 639 . 1 1 63 63 ARG CA C 13 55.09 0.3 . 1 . . . . 63 ARG CA . 15660 1 640 . 1 1 63 63 ARG CB C 13 32.22 0.3 . 1 . . . . 63 ARG CB . 15660 1 641 . 1 1 63 63 ARG CD C 13 43.3 0.3 . 1 . . . . 63 ARG CD . 15660 1 642 . 1 1 63 63 ARG CG C 13 27.16 0.3 . 1 . . . . 63 ARG CG . 15660 1 643 . 1 1 63 63 ARG N N 15 121.4 0.2 . 1 . . . . 63 ARG N . 15660 1 644 . 1 1 64 64 CYS H H 1 9.08 0.03 . 1 . . . . 64 CYS H . 15660 1 645 . 1 1 64 64 CYS HA H 1 4.46 0.03 . 1 . . . . 64 CYS HA . 15660 1 646 . 1 1 64 64 CYS HB2 H 1 3.54 0.03 . 2 . . . . 64 CYS HB2 . 15660 1 647 . 1 1 64 64 CYS HB3 H 1 2.63 0.03 . 2 . . . . 64 CYS HB3 . 15660 1 648 . 1 1 64 64 CYS CA C 13 56.83 0.3 . 1 . . . . 64 CYS CA . 15660 1 649 . 1 1 64 64 CYS CB C 13 31.95 0.3 . 1 . . . . 64 CYS CB . 15660 1 650 . 1 1 64 64 CYS N N 15 131.1 0.2 . 1 . . . . 64 CYS N . 15660 1 651 . 1 1 65 65 PRO HA H 1 4.59 0.03 . 1 . . . . 65 PRO HA . 15660 1 652 . 1 1 65 65 PRO HB2 H 1 2.07 0.03 . 2 . . . . 65 PRO HB2 . 15660 1 653 . 1 1 65 65 PRO HG2 H 1 2.33 0.03 . 2 . . . . 65 PRO HG2 . 15660 1 654 . 1 1 65 65 PRO C C 13 177.3 0.3 . 1 . . . . 65 PRO C . 15660 1 655 . 1 1 65 65 PRO CA C 13 64.22 0.3 . 1 . . . . 65 PRO CA . 15660 1 656 . 1 1 65 65 PRO CB C 13 31.64 0.3 . 1 . . . . 65 PRO CB . 15660 1 657 . 1 1 65 65 PRO CD C 13 50.72 0.3 . 1 . . . . 65 PRO CD . 15660 1 658 . 1 1 65 65 PRO CG C 13 26.79 0.3 . 1 . . . . 65 PRO CG . 15660 1 659 . 1 1 66 66 ILE H H 1 9.55 0.03 . 1 . . . . 66 ILE H . 15660 1 660 . 1 1 66 66 ILE HA H 1 3.84 0.03 . 1 . . . . 66 ILE HA . 15660 1 661 . 1 1 66 66 ILE HB H 1 1.75 0.03 . 1 . . . . 66 ILE HB . 15660 1 662 . 1 1 66 66 ILE HD11 H 1 0.28 0.03 . 1 . . . . 66 ILE HD11 . 15660 1 663 . 1 1 66 66 ILE HD12 H 1 0.28 0.03 . 1 . . . . 66 ILE HD12 . 15660 1 664 . 1 1 66 66 ILE HD13 H 1 0.28 0.03 . 1 . . . . 66 ILE HD13 . 15660 1 665 . 1 1 66 66 ILE HG12 H 1 1.35 0.03 . 2 . . . . 66 ILE HG12 . 15660 1 666 . 1 1 66 66 ILE HG13 H 1 1.11 0.03 . 2 . . . . 66 ILE HG13 . 15660 1 667 . 1 1 66 66 ILE HG21 H 1 0.62 0.03 . 1 . . . . 66 ILE HG21 . 15660 1 668 . 1 1 66 66 ILE HG22 H 1 0.62 0.03 . 1 . . . . 66 ILE HG22 . 15660 1 669 . 1 1 66 66 ILE HG23 H 1 0.62 0.03 . 1 . . . . 66 ILE HG23 . 15660 1 670 . 1 1 66 66 ILE C C 13 177.7 0.3 . 1 . . . . 66 ILE C . 15660 1 671 . 1 1 66 66 ILE CA C 13 63.71 0.3 . 1 . . . . 66 ILE CA . 15660 1 672 . 1 1 66 66 ILE CB C 13 38.15 0.3 . 1 . . . . 66 ILE CB . 15660 1 673 . 1 1 66 66 ILE CD1 C 13 16.85 0.3 . 1 . . . . 66 ILE CD1 . 15660 1 674 . 1 1 66 66 ILE CG1 C 13 28.53 0.3 . 1 . . . . 66 ILE CG1 . 15660 1 675 . 1 1 66 66 ILE CG2 C 13 13.72 0.3 . 1 . . . . 66 ILE CG2 . 15660 1 676 . 1 1 66 66 ILE N N 15 124.5 0.2 . 1 . . . . 66 ILE N . 15660 1 677 . 1 1 67 67 CYS H H 1 8.88 0.03 . 1 . . . . 67 CYS H . 15660 1 678 . 1 1 67 67 CYS HA H 1 4.85 0.03 . 1 . . . . 67 CYS HA . 15660 1 679 . 1 1 67 67 CYS HB2 H 1 3.34 0.03 . 2 . . . . 67 CYS HB2 . 15660 1 680 . 1 1 67 67 CYS HB3 H 1 3.09 0.03 . 2 . . . . 67 CYS HB3 . 15660 1 681 . 1 1 67 67 CYS C C 13 176.5 0.3 . 1 . . . . 67 CYS C . 15660 1 682 . 1 1 67 67 CYS CA C 13 58.61 0.3 . 1 . . . . 67 CYS CA . 15660 1 683 . 1 1 67 67 CYS CB C 13 32.34 0.3 . 1 . . . . 67 CYS CB . 15660 1 684 . 1 1 67 67 CYS N N 15 119.5 0.2 . 1 . . . . 67 CYS N . 15660 1 685 . 1 1 68 68 LYS H H 1 7.7 0.03 . 1 . . . . 68 LYS H . 15660 1 686 . 1 1 68 68 LYS HA H 1 4.16 0.03 . 1 . . . . 68 LYS HA . 15660 1 687 . 1 1 68 68 LYS HB2 H 1 2.22 0.03 . 2 . . . . 68 LYS HB2 . 15660 1 688 . 1 1 68 68 LYS HB3 H 1 1.99 0.03 . 2 . . . . 68 LYS HB3 . 15660 1 689 . 1 1 68 68 LYS HD2 H 1 1.57 0.03 . 2 . . . . 68 LYS HD2 . 15660 1 690 . 1 1 68 68 LYS HE2 H 1 3.03 0.03 . 2 . . . . 68 LYS HE2 . 15660 1 691 . 1 1 68 68 LYS HE3 H 1 2.95 0.03 . 2 . . . . 68 LYS HE3 . 15660 1 692 . 1 1 68 68 LYS HG2 H 1 1.31 0.03 . 2 . . . . 68 LYS HG2 . 15660 1 693 . 1 1 68 68 LYS HG3 H 1 1.23 0.03 . 2 . . . . 68 LYS HG3 . 15660 1 694 . 1 1 68 68 LYS C C 13 175.7 0.3 . 1 . . . . 68 LYS C . 15660 1 695 . 1 1 68 68 LYS CA C 13 58.03 0.3 . 1 . . . . 68 LYS CA . 15660 1 696 . 1 1 68 68 LYS CB C 13 28.69 0.3 . 1 . . . . 68 LYS CB . 15660 1 697 . 1 1 68 68 LYS CD C 13 28.8 0.3 . 1 . . . . 68 LYS CD . 15660 1 698 . 1 1 68 68 LYS CE C 13 42.6 0.3 . 1 . . . . 68 LYS CE . 15660 1 699 . 1 1 68 68 LYS CG C 13 25.48 0.3 . 1 . . . . 68 LYS CG . 15660 1 700 . 1 1 68 68 LYS N N 15 115.6 0.2 . 1 . . . . 68 LYS N . 15660 1 701 . 1 1 69 69 MET H H 1 8.17 0.03 . 1 . . . . 69 MET H . 15660 1 702 . 1 1 69 69 MET HA H 1 4.95 0.03 . 1 . . . . 69 MET HA . 15660 1 703 . 1 1 69 69 MET HB2 H 1 2.61 0.03 . 2 . . . . 69 MET HB2 . 15660 1 704 . 1 1 69 69 MET HG2 H 1 2.48 0.03 . 2 . . . . 69 MET HG2 . 15660 1 705 . 1 1 69 69 MET HG3 H 1 2.04 0.03 . 2 . . . . 69 MET HG3 . 15660 1 706 . 1 1 69 69 MET CA C 13 53.59 0.3 . 1 . . . . 69 MET CA . 15660 1 707 . 1 1 69 69 MET CB C 13 32.9 0.3 . 1 . . . . 69 MET CB . 15660 1 708 . 1 1 69 69 MET CG C 13 32.36 0.3 . 1 . . . . 69 MET CG . 15660 1 709 . 1 1 69 69 MET N N 15 120.7 0.2 . 1 . . . . 69 MET N . 15660 1 710 . 1 1 70 70 PRO HA H 1 4.5 0.03 . 1 . . . . 70 PRO HA . 15660 1 711 . 1 1 70 70 PRO HB2 H 1 2.33 0.03 . 2 . . . . 70 PRO HB2 . 15660 1 712 . 1 1 70 70 PRO HB3 H 1 1.82 0.03 . 2 . . . . 70 PRO HB3 . 15660 1 713 . 1 1 70 70 PRO HD2 H 1 3.82 0.03 . 2 . . . . 70 PRO HD2 . 15660 1 714 . 1 1 70 70 PRO HD3 H 1 3.64 0.03 . 2 . . . . 70 PRO HD3 . 15660 1 715 . 1 1 70 70 PRO HG2 H 1 2.18 0.03 . 2 . . . . 70 PRO HG2 . 15660 1 716 . 1 1 70 70 PRO HG3 H 1 1.86 0.03 . 2 . . . . 70 PRO HG3 . 15660 1 717 . 1 1 70 70 PRO C C 13 177.5 0.3 . 1 . . . . 70 PRO C . 15660 1 718 . 1 1 70 70 PRO CA C 13 63.94 0.3 . 1 . . . . 70 PRO CA . 15660 1 719 . 1 1 70 70 PRO CB C 13 31.66 0.3 . 1 . . . . 70 PRO CB . 15660 1 720 . 1 1 70 70 PRO CD C 13 50.84 0.3 . 1 . . . . 70 PRO CD . 15660 1 721 . 1 1 70 70 PRO CG C 13 28.44 0.3 . 1 . . . . 70 PRO CG . 15660 1 722 . 1 1 71 71 LEU H H 1 8.28 0.03 . 1 . . . . 71 LEU H . 15660 1 723 . 1 1 71 71 LEU HA H 1 4.29 0.03 . 1 . . . . 71 LEU HA . 15660 1 724 . 1 1 71 71 LEU HB2 H 1 1.51 0.03 . 2 . . . . 71 LEU HB2 . 15660 1 725 . 1 1 71 71 LEU HB3 H 1 1.24 0.03 . 2 . . . . 71 LEU HB3 . 15660 1 726 . 1 1 71 71 LEU HD11 H 1 0.88 0.03 . 2 . . . . 71 LEU HD11 . 15660 1 727 . 1 1 71 71 LEU HD12 H 1 0.88 0.03 . 2 . . . . 71 LEU HD12 . 15660 1 728 . 1 1 71 71 LEU HD13 H 1 0.88 0.03 . 2 . . . . 71 LEU HD13 . 15660 1 729 . 1 1 71 71 LEU HD21 H 1 0.85 0.03 . 2 . . . . 71 LEU HD21 . 15660 1 730 . 1 1 71 71 LEU HD22 H 1 0.85 0.03 . 2 . . . . 71 LEU HD22 . 15660 1 731 . 1 1 71 71 LEU HD23 H 1 0.85 0.03 . 2 . . . . 71 LEU HD23 . 15660 1 732 . 1 1 71 71 LEU HG H 1 1.43 0.03 . 1 . . . . 71 LEU HG . 15660 1 733 . 1 1 71 71 LEU CA C 13 53.96 0.3 . 1 . . . . 71 LEU CA . 15660 1 734 . 1 1 71 71 LEU CB C 13 42.32 0.3 . 1 . . . . 71 LEU CB . 15660 1 735 . 1 1 71 71 LEU N N 15 125.3 0.2 . 1 . . . . 71 LEU N . 15660 1 736 . 1 1 72 72 PRO HA H 1 4.54 0.03 . 1 . . . . 72 PRO HA . 15660 1 737 . 1 1 72 72 PRO HB2 H 1 2.33 0.03 . 2 . . . . 72 PRO HB2 . 15660 1 738 . 1 1 72 72 PRO HB3 H 1 1.98 0.03 . 2 . . . . 72 PRO HB3 . 15660 1 739 . 1 1 72 72 PRO HD2 H 1 3.85 0.03 . 2 . . . . 72 PRO HD2 . 15660 1 740 . 1 1 72 72 PRO HD3 H 1 3.7 0.03 . 2 . . . . 72 PRO HD3 . 15660 1 741 . 1 1 72 72 PRO HG2 H 1 2.08 0.03 . 2 . . . . 72 PRO HG2 . 15660 1 742 . 1 1 72 72 PRO C C 13 177.6 0.3 . 1 . . . . 72 PRO C . 15660 1 743 . 1 1 72 72 PRO CA C 13 63.03 0.3 . 1 . . . . 72 PRO CA . 15660 1 744 . 1 1 72 72 PRO CB C 13 32.12 0.3 . 1 . . . . 72 PRO CB . 15660 1 745 . 1 1 72 72 PRO CD C 13 50.55 0.3 . 1 . . . . 72 PRO CD . 15660 1 746 . 1 1 72 72 PRO CG C 13 27.39 0.3 . 1 . . . . 72 PRO CG . 15660 1 747 . 1 1 73 73 THR H H 1 8.26 0.03 . 1 . . . . 73 THR H . 15660 1 748 . 1 1 73 73 THR HA H 1 4.3 0.03 . 1 . . . . 73 THR HA . 15660 1 749 . 1 1 73 73 THR HB H 1 4.47 0.03 . 1 . . . . 73 THR HB . 15660 1 750 . 1 1 73 73 THR HG21 H 1 1.23 0.03 . 1 . . . . 73 THR HG21 . 15660 1 751 . 1 1 73 73 THR HG22 H 1 1.23 0.03 . 1 . . . . 73 THR HG22 . 15660 1 752 . 1 1 73 73 THR HG23 H 1 1.23 0.03 . 1 . . . . 73 THR HG23 . 15660 1 753 . 1 1 73 73 THR C C 13 175.7 0.3 . 1 . . . . 73 THR C . 15660 1 754 . 1 1 73 73 THR CA C 13 61.56 0.3 . 1 . . . . 73 THR CA . 15660 1 755 . 1 1 73 73 THR CB C 13 69.9 0.3 . 1 . . . . 73 THR CB . 15660 1 756 . 1 1 73 73 THR CG2 C 13 21.78 0.3 . 1 . . . . 73 THR CG2 . 15660 1 757 . 1 1 73 73 THR N N 15 113.5 0.2 . 1 . . . . 73 THR N . 15660 1 758 . 1 1 74 74 LYS H H 1 8.06 0.03 . 1 . . . . 74 LYS H . 15660 1 759 . 1 1 74 74 LYS HA H 1 4.32 0.03 . 1 . . . . 74 LYS HA . 15660 1 760 . 1 1 74 74 LYS HB2 H 1 1.82 0.03 . 2 . . . . 74 LYS HB2 . 15660 1 761 . 1 1 74 74 LYS HB3 H 1 1.76 0.03 . 2 . . . . 74 LYS HB3 . 15660 1 762 . 1 1 74 74 LYS HD2 H 1 1.72 0.03 . 2 . . . . 74 LYS HD2 . 15660 1 763 . 1 1 74 74 LYS HE2 H 1 3.01 0.03 . 2 . . . . 74 LYS HE2 . 15660 1 764 . 1 1 74 74 LYS HE3 H 1 3.03 0.03 . 2 . . . . 74 LYS HE3 . 15660 1 765 . 1 1 74 74 LYS HG2 H 1 1.46 0.03 . 2 . . . . 74 LYS HG2 . 15660 1 766 . 1 1 74 74 LYS HG3 H 1 1.44 0.03 . 2 . . . . 74 LYS HG3 . 15660 1 767 . 1 1 74 74 LYS C C 13 176.6 0.3 . 1 . . . . 74 LYS C . 15660 1 768 . 1 1 74 74 LYS CA C 13 56.32 0.3 . 1 . . . . 74 LYS CA . 15660 1 769 . 1 1 74 74 LYS CB C 13 32.81 0.3 . 1 . . . . 74 LYS CB . 15660 1 770 . 1 1 74 74 LYS CD C 13 29.23 0.3 . 1 . . . . 74 LYS CD . 15660 1 771 . 1 1 74 74 LYS CE C 13 42.22 0.3 . 1 . . . . 74 LYS CE . 15660 1 772 . 1 1 74 74 LYS CG C 13 24.73 0.3 . 1 . . . . 74 LYS CG . 15660 1 773 . 1 1 74 74 LYS N N 15 120.7 0.2 . 1 . . . . 74 LYS N . 15660 1 774 . 1 1 75 75 LEU H H 1 8.23 0.03 . 1 . . . . 75 LEU H . 15660 1 775 . 1 1 75 75 LEU HA H 1 4.34 0.03 . 1 . . . . 75 LEU HA . 15660 1 776 . 1 1 75 75 LEU HB2 H 1 1.64 0.03 . 2 . . . . 75 LEU HB2 . 15660 1 777 . 1 1 75 75 LEU HB3 H 1 1.57 0.03 . 2 . . . . 75 LEU HB3 . 15660 1 778 . 1 1 75 75 LEU HD11 H 1 0.84 0.03 . 2 . . . . 75 LEU HD11 . 15660 1 779 . 1 1 75 75 LEU HD12 H 1 0.84 0.03 . 2 . . . . 75 LEU HD12 . 15660 1 780 . 1 1 75 75 LEU HD13 H 1 0.84 0.03 . 2 . . . . 75 LEU HD13 . 15660 1 781 . 1 1 75 75 LEU HD21 H 1 0.92 0.03 . 2 . . . . 75 LEU HD21 . 15660 1 782 . 1 1 75 75 LEU HD22 H 1 0.92 0.03 . 2 . . . . 75 LEU HD22 . 15660 1 783 . 1 1 75 75 LEU HD23 H 1 0.92 0.03 . 2 . . . . 75 LEU HD23 . 15660 1 784 . 1 1 75 75 LEU HG H 1 1.62 0.03 . 1 . . . . 75 LEU HG . 15660 1 785 . 1 1 75 75 LEU C C 13 177.2 0.3 . 1 . . . . 75 LEU C . 15660 1 786 . 1 1 75 75 LEU CA C 13 54.73 0.3 . 1 . . . . 75 LEU CA . 15660 1 787 . 1 1 75 75 LEU CB C 13 42.06 0.3 . 1 . . . . 75 LEU CB . 15660 1 788 . 1 1 75 75 LEU CD1 C 13 23.4 0.3 . 2 . . . . 75 LEU CD1 . 15660 1 789 . 1 1 75 75 LEU CD2 C 13 25.15 0.3 . 2 . . . . 75 LEU CD2 . 15660 1 790 . 1 1 75 75 LEU CG C 13 27.12 0.3 . 1 . . . . 75 LEU CG . 15660 1 791 . 1 1 75 75 LEU N N 15 121.4 0.2 . 1 . . . . 75 LEU N . 15660 1 792 . 1 1 76 76 ARG H H 1 8.2 0.03 . 1 . . . . 76 ARG H . 15660 1 793 . 1 1 76 76 ARG HA H 1 4.65 0.03 . 1 . . . . 76 ARG HA . 15660 1 794 . 1 1 76 76 ARG HB2 H 1 1.86 0.03 . 2 . . . . 76 ARG HB2 . 15660 1 795 . 1 1 76 76 ARG HB3 H 1 1.74 0.03 . 2 . . . . 76 ARG HB3 . 15660 1 796 . 1 1 76 76 ARG HD2 H 1 3.23 0.03 . 2 . . . . 76 ARG HD2 . 15660 1 797 . 1 1 76 76 ARG CA C 13 53.64 0.3 . 1 . . . . 76 ARG CA . 15660 1 798 . 1 1 76 76 ARG CB C 13 30.43 0.3 . 1 . . . . 76 ARG CB . 15660 1 799 . 1 1 76 76 ARG CD C 13 43.35 0.3 . 1 . . . . 76 ARG CD . 15660 1 800 . 1 1 76 76 ARG N N 15 121.1 0.2 . 1 . . . . 76 ARG N . 15660 1 801 . 1 1 79 79 ALA HA H 1 4.37 0.03 . 1 . . . . 79 ALA HA . 15660 1 802 . 1 1 79 79 ALA HB1 H 1 1.39 0.03 . 1 . . . . 79 ALA HB1 . 15660 1 803 . 1 1 79 79 ALA HB2 H 1 1.39 0.03 . 1 . . . . 79 ALA HB2 . 15660 1 804 . 1 1 79 79 ALA HB3 H 1 1.39 0.03 . 1 . . . . 79 ALA HB3 . 15660 1 805 . 1 1 79 79 ALA C C 13 177.4 0.3 . 1 . . . . 79 ALA C . 15660 1 806 . 1 1 79 79 ALA CA C 13 51.98 0.3 . 1 . . . . 79 ALA CA . 15660 1 807 . 1 1 79 79 ALA CB C 13 19.56 0.3 . 1 . . . . 79 ALA CB . 15660 1 808 . 1 1 80 80 ALA H H 1 8.29 0.03 . 1 . . . . 80 ALA H . 15660 1 809 . 1 1 80 80 ALA HA H 1 4.58 0.03 . 1 . . . . 80 ALA HA . 15660 1 810 . 1 1 80 80 ALA HB1 H 1 1.37 0.03 . 1 . . . . 80 ALA HB1 . 15660 1 811 . 1 1 80 80 ALA HB2 H 1 1.37 0.03 . 1 . . . . 80 ALA HB2 . 15660 1 812 . 1 1 80 80 ALA HB3 H 1 1.37 0.03 . 1 . . . . 80 ALA HB3 . 15660 1 813 . 1 1 80 80 ALA CA C 13 50.52 0.3 . 1 . . . . 80 ALA CA . 15660 1 814 . 1 1 80 80 ALA CB C 13 18.18 0.3 . 1 . . . . 80 ALA CB . 15660 1 815 . 1 1 80 80 ALA N N 15 123.7 0.2 . 1 . . . . 80 ALA N . 15660 1 816 . 1 1 81 81 PRO HA H 1 4.55 0.03 . 1 . . . . 81 PRO HA . 15660 1 817 . 1 1 81 81 PRO HB2 H 1 2.32 0.03 . 2 . . . . 81 PRO HB2 . 15660 1 818 . 1 1 81 81 PRO HB3 H 1 1.95 0.03 . 2 . . . . 81 PRO HB3 . 15660 1 819 . 1 1 81 81 PRO C C 13 176.2 0.3 . 1 . . . . 81 PRO C . 15660 1 820 . 1 1 81 81 PRO CA C 13 62.73 0.3 . 1 . . . . 81 PRO CA . 15660 1 821 . 1 1 81 81 PRO CB C 13 32.09 0.3 . 1 . . . . 81 PRO CB . 15660 1 822 . 1 1 81 81 PRO CD C 13 50.55 0.3 . 1 . . . . 81 PRO CD . 15660 1 823 . 1 1 81 81 PRO CG C 13 27.34 0.3 . 1 . . . . 81 PRO CG . 15660 1 824 . 1 1 82 82 THR H H 1 7.96 0.03 . 1 . . . . 82 THR H . 15660 1 825 . 1 1 82 82 THR HA H 1 4.27 0.03 . 1 . . . . 82 THR HA . 15660 1 826 . 1 1 82 82 THR HB H 1 4.26 0.03 . 1 . . . . 82 THR HB . 15660 1 827 . 1 1 82 82 THR HG21 H 1 1.24 0.03 . 1 . . . . 82 THR HG21 . 15660 1 828 . 1 1 82 82 THR HG22 H 1 1.24 0.03 . 1 . . . . 82 THR HG22 . 15660 1 829 . 1 1 82 82 THR HG23 H 1 1.24 0.03 . 1 . . . . 82 THR HG23 . 15660 1 830 . 1 1 82 82 THR C C 13 174.5 0.3 . 1 . . . . 82 THR C . 15660 1 831 . 1 1 82 82 THR CA C 13 61.63 0.3 . 1 . . . . 82 THR CA . 15660 1 832 . 1 1 82 82 THR CB C 13 69.91 0.3 . 1 . . . . 82 THR CB . 15660 1 833 . 1 1 82 82 THR CG2 C 13 21.72 0.3 . 1 . . . . 82 THR CG2 . 15660 1 834 . 1 1 82 82 THR N N 15 109.3 0.2 . 1 . . . . 82 THR N . 15660 1 835 . 1 1 83 83 ALA H H 1 8.32 0.03 . 1 . . . . 83 ALA H . 15660 1 836 . 1 1 83 83 ALA HA H 1 4.64 0.03 . 1 . . . . 83 ALA HA . 15660 1 837 . 1 1 83 83 ALA HB1 H 1 1.36 0.03 . 1 . . . . 83 ALA HB1 . 15660 1 838 . 1 1 83 83 ALA HB2 H 1 1.36 0.03 . 1 . . . . 83 ALA HB2 . 15660 1 839 . 1 1 83 83 ALA HB3 H 1 1.36 0.03 . 1 . . . . 83 ALA HB3 . 15660 1 840 . 1 1 83 83 ALA CA C 13 50.33 0.3 . 1 . . . . 83 ALA CA . 15660 1 841 . 1 1 83 83 ALA CB C 13 18.41 0.3 . 1 . . . . 83 ALA CB . 15660 1 842 . 1 1 83 83 ALA N N 15 126.7 0.2 . 1 . . . . 83 ALA N . 15660 1 843 . 1 1 85 85 PRO HA H 1 4.52 0.03 . 1 . . . . 85 PRO HA . 15660 1 844 . 1 1 85 85 PRO HB2 H 1 2.33 0.03 . 2 . . . . 85 PRO HB2 . 15660 1 845 . 1 1 85 85 PRO HB3 H 1 1.98 0.03 . 2 . . . . 85 PRO HB3 . 15660 1 846 . 1 1 85 85 PRO C C 13 177.8 0.3 . 1 . . . . 85 PRO C . 15660 1 847 . 1 1 85 85 PRO CA C 13 63.03 0.3 . 1 . . . . 85 PRO CA . 15660 1 848 . 1 1 85 85 PRO CB C 13 32.21 0.3 . 1 . . . . 85 PRO CB . 15660 1 849 . 1 1 85 85 PRO CD C 13 50.53 0.3 . 1 . . . . 85 PRO CD . 15660 1 850 . 1 1 85 85 PRO CG C 13 27.39 0.3 . 1 . . . . 85 PRO CG . 15660 1 851 . 1 1 86 86 THR H H 1 8.29 0.03 . 1 . . . . 86 THR H . 15660 1 852 . 1 1 86 86 THR HA H 1 4.33 0.03 . 1 . . . . 86 THR HA . 15660 1 853 . 1 1 86 86 THR HB H 1 4.28 0.03 . 1 . . . . 86 THR HB . 15660 1 854 . 1 1 86 86 THR HG21 H 1 1.26 0.03 . 1 . . . . 86 THR HG21 . 15660 1 855 . 1 1 86 86 THR HG22 H 1 1.26 0.03 . 1 . . . . 86 THR HG22 . 15660 1 856 . 1 1 86 86 THR HG23 H 1 1.26 0.03 . 1 . . . . 86 THR HG23 . 15660 1 857 . 1 1 86 86 THR C C 13 175.8 0.3 . 1 . . . . 86 THR C . 15660 1 858 . 1 1 86 86 THR CA C 13 61.96 0.3 . 1 . . . . 86 THR CA . 15660 1 859 . 1 1 86 86 THR CB C 13 69.71 0.3 . 1 . . . . 86 THR CB . 15660 1 860 . 1 1 86 86 THR CG2 C 13 21.64 0.3 . 1 . . . . 86 THR CG2 . 15660 1 861 . 1 1 86 86 THR N N 15 112.7 0.2 . 1 . . . . 86 THR N . 15660 1 862 . 1 1 87 87 GLY H H 1 8.47 0.03 . 1 . . . . 87 GLY H . 15660 1 863 . 1 1 87 87 GLY HA2 H 1 3.94 0.03 . 2 . . . . 87 GLY HA2 . 15660 1 864 . 1 1 87 87 GLY HA3 H 1 3.98 0.03 . 2 . . . . 87 GLY HA3 . 15660 1 865 . 1 1 87 87 GLY C C 13 174.4 0.3 . 1 . . . . 87 GLY C . 15660 1 866 . 1 1 87 87 GLY CA C 13 45.21 0.3 . 1 . . . . 87 GLY CA . 15660 1 867 . 1 1 87 87 GLY N N 15 110.2 0.2 . 1 . . . . 87 GLY N . 15660 1 868 . 1 1 88 88 ALA H H 1 8.24 0.03 . 1 . . . . 88 ALA H . 15660 1 869 . 1 1 88 88 ALA HA H 1 4.34 0.03 . 1 . . . . 88 ALA HA . 15660 1 870 . 1 1 88 88 ALA HB1 H 1 1.41 0.03 . 1 . . . . 88 ALA HB1 . 15660 1 871 . 1 1 88 88 ALA HB2 H 1 1.41 0.03 . 1 . . . . 88 ALA HB2 . 15660 1 872 . 1 1 88 88 ALA HB3 H 1 1.41 0.03 . 1 . . . . 88 ALA HB3 . 15660 1 873 . 1 1 88 88 ALA C C 13 178.4 0.3 . 1 . . . . 88 ALA C . 15660 1 874 . 1 1 88 88 ALA CA C 13 52.58 0.3 . 1 . . . . 88 ALA CA . 15660 1 875 . 1 1 88 88 ALA CB C 13 19.43 0.3 . 1 . . . . 88 ALA CB . 15660 1 876 . 1 1 88 88 ALA N N 15 122.8 0.2 . 1 . . . . 88 ALA N . 15660 1 877 . 1 1 89 89 ALA H H 1 8.44 0.03 . 1 . . . . 89 ALA H . 15660 1 878 . 1 1 89 89 ALA HA H 1 4.3 0.03 . 1 . . . . 89 ALA HA . 15660 1 879 . 1 1 89 89 ALA HB1 H 1 1.42 0.03 . 1 . . . . 89 ALA HB1 . 15660 1 880 . 1 1 89 89 ALA HB2 H 1 1.42 0.03 . 1 . . . . 89 ALA HB2 . 15660 1 881 . 1 1 89 89 ALA HB3 H 1 1.42 0.03 . 1 . . . . 89 ALA HB3 . 15660 1 882 . 1 1 89 89 ALA C C 13 178.2 0.3 . 1 . . . . 89 ALA C . 15660 1 883 . 1 1 89 89 ALA CA C 13 52.78 0.3 . 1 . . . . 89 ALA CA . 15660 1 884 . 1 1 89 89 ALA CB C 13 18.93 0.3 . 1 . . . . 89 ALA CB . 15660 1 885 . 1 1 89 89 ALA N N 15 122 0.2 . 1 . . . . 89 ALA N . 15660 1 886 . 1 1 90 90 ASP H H 1 8.27 0.03 . 1 . . . . 90 ASP H . 15660 1 887 . 1 1 90 90 ASP HA H 1 4.59 0.03 . 1 . . . . 90 ASP HA . 15660 1 888 . 1 1 90 90 ASP HB2 H 1 2.67 0.03 . 2 . . . . 90 ASP HB2 . 15660 1 889 . 1 1 90 90 ASP HB3 H 1 2.69 0.03 . 2 . . . . 90 ASP HB3 . 15660 1 890 . 1 1 90 90 ASP C C 13 176.9 0.3 . 1 . . . . 90 ASP C . 15660 1 891 . 1 1 90 90 ASP CA C 13 54.36 0.3 . 1 . . . . 90 ASP CA . 15660 1 892 . 1 1 90 90 ASP CB C 13 41.06 0.3 . 1 . . . . 90 ASP CB . 15660 1 893 . 1 1 90 90 ASP N N 15 117.5 0.2 . 1 . . . . 90 ASP N . 15660 1 894 . 1 1 91 91 SER H H 1 8.12 0.03 . 1 . . . . 91 SER H . 15660 1 895 . 1 1 91 91 SER HA H 1 4.44 0.03 . 1 . . . . 91 SER HA . 15660 1 896 . 1 1 91 91 SER HB2 H 1 3.89 0.03 . 2 . . . . 91 SER HB2 . 15660 1 897 . 1 1 91 91 SER HB3 H 1 3.86 0.03 . 2 . . . . 91 SER HB3 . 15660 1 898 . 1 1 91 91 SER C C 13 174.8 0.3 . 1 . . . . 91 SER C . 15660 1 899 . 1 1 91 91 SER CA C 13 58.44 0.3 . 1 . . . . 91 SER CA . 15660 1 900 . 1 1 91 91 SER CB C 13 63.85 0.3 . 1 . . . . 91 SER CB . 15660 1 901 . 1 1 91 91 SER N N 15 114.1 0.2 . 1 . . . . 91 SER N . 15660 1 902 . 1 1 92 92 ILE H H 1 8.11 0.03 . 1 . . . . 92 ILE H . 15660 1 903 . 1 1 92 92 ILE HA H 1 4.19 0.03 . 1 . . . . 92 ILE HA . 15660 1 904 . 1 1 92 92 ILE HB H 1 1.89 0.03 . 1 . . . . 92 ILE HB . 15660 1 905 . 1 1 92 92 ILE HD11 H 1 0.88 0.03 . 1 . . . . 92 ILE HD11 . 15660 1 906 . 1 1 92 92 ILE HD12 H 1 0.88 0.03 . 1 . . . . 92 ILE HD12 . 15660 1 907 . 1 1 92 92 ILE HD13 H 1 0.88 0.03 . 1 . . . . 92 ILE HD13 . 15660 1 908 . 1 1 92 92 ILE HG12 H 1 1.22 0.03 . 2 . . . . 92 ILE HG12 . 15660 1 909 . 1 1 92 92 ILE HG13 H 1 1.51 0.03 . 2 . . . . 92 ILE HG13 . 15660 1 910 . 1 1 92 92 ILE HG21 H 1 0.91 0.03 . 1 . . . . 92 ILE HG21 . 15660 1 911 . 1 1 92 92 ILE HG22 H 1 0.91 0.03 . 1 . . . . 92 ILE HG22 . 15660 1 912 . 1 1 92 92 ILE HG23 H 1 0.91 0.03 . 1 . . . . 92 ILE HG23 . 15660 1 913 . 1 1 92 92 ILE C C 13 176.5 0.3 . 1 . . . . 92 ILE C . 15660 1 914 . 1 1 92 92 ILE CA C 13 61.17 0.3 . 1 . . . . 92 ILE CA . 15660 1 915 . 1 1 92 92 ILE CB C 13 38.47 0.3 . 1 . . . . 92 ILE CB . 15660 1 916 . 1 1 92 92 ILE CD1 C 13 12.75 0.3 . 1 . . . . 92 ILE CD1 . 15660 1 917 . 1 1 92 92 ILE CG1 C 13 27.32 0.3 . 1 . . . . 92 ILE CG1 . 15660 1 918 . 1 1 92 92 ILE CG2 C 13 17.47 0.3 . 1 . . . . 92 ILE CG2 . 15660 1 919 . 1 1 92 92 ILE N N 15 121 0.2 . 1 . . . . 92 ILE N . 15660 1 920 . 1 1 93 93 ARG H H 1 8.39 0.03 . 1 . . . . 93 ARG H . 15660 1 921 . 1 1 93 93 ARG HA H 1 4.64 0.03 . 1 . . . . 93 ARG HA . 15660 1 922 . 1 1 93 93 ARG CA C 13 53.57 0.3 . 1 . . . . 93 ARG CA . 15660 1 923 . 1 1 93 93 ARG CB C 13 30.23 0.3 . 1 . . . . 93 ARG CB . 15660 1 924 . 1 1 93 93 ARG N N 15 125.4 0.2 . 1 . . . . 93 ARG N . 15660 1 925 . 1 1 96 96 PRO HA H 1 4.41 0.03 . 1 . . . . 96 PRO HA . 15660 1 926 . 1 1 96 96 PRO HB2 H 1 2.25 0.03 . 2 . . . . 96 PRO HB2 . 15660 1 927 . 1 1 96 96 PRO HB3 H 1 1.86 0.03 . 2 . . . . 96 PRO HB3 . 15660 1 928 . 1 1 96 96 PRO C C 13 177 0.3 . 1 . . . . 96 PRO C . 15660 1 929 . 1 1 96 96 PRO CA C 13 62.75 0.3 . 1 . . . . 96 PRO CA . 15660 1 930 . 1 1 96 96 PRO CB C 13 31.91 0.3 . 1 . . . . 96 PRO CB . 15660 1 931 . 1 1 96 96 PRO CD C 13 50.44 0.3 . 1 . . . . 96 PRO CD . 15660 1 932 . 1 1 96 96 PRO CG C 13 27.25 0.3 . 1 . . . . 96 PRO CG . 15660 1 933 . 1 1 97 97 TYR H H 1 8.18 0.03 . 1 . . . . 97 TYR H . 15660 1 934 . 1 1 97 97 TYR HA H 1 4.55 0.03 . 1 . . . . 97 TYR HA . 15660 1 935 . 1 1 97 97 TYR HB2 H 1 3.05 0.03 . 2 . . . . 97 TYR HB2 . 15660 1 936 . 1 1 97 97 TYR HB3 H 1 2.95 0.03 . 2 . . . . 97 TYR HB3 . 15660 1 937 . 1 1 97 97 TYR HD1 H 1 7.09 0.03 . 3 . . . . 97 TYR HD1 . 15660 1 938 . 1 1 97 97 TYR HE1 H 1 6.81 0.03 . 3 . . . . 97 TYR HE1 . 15660 1 939 . 1 1 97 97 TYR C C 13 175.7 0.3 . 1 . . . . 97 TYR C . 15660 1 940 . 1 1 97 97 TYR CA C 13 57.74 0.3 . 1 . . . . 97 TYR CA . 15660 1 941 . 1 1 97 97 TYR CB C 13 38.86 0.3 . 1 . . . . 97 TYR CB . 15660 1 942 . 1 1 97 97 TYR CD1 C 13 132.3 0.3 . 3 . . . . 97 TYR CD1 . 15660 1 943 . 1 1 97 97 TYR CE1 C 13 117.2 0.3 . 3 . . . . 97 TYR CE1 . 15660 1 944 . 1 1 97 97 TYR N N 15 119.4 0.2 . 1 . . . . 97 TYR N . 15660 1 945 . 1 1 98 98 SER H H 1 8.05 0.03 . 1 . . . . 98 SER H . 15660 1 946 . 1 1 98 98 SER HA H 1 4.67 0.03 . 1 . . . . 98 SER HA . 15660 1 947 . 1 1 98 98 SER HB2 H 1 3.81 0.03 . 2 . . . . 98 SER HB2 . 15660 1 948 . 1 1 98 98 SER HB3 H 1 3.69 0.03 . 2 . . . . 98 SER HB3 . 15660 1 949 . 1 1 98 98 SER CA C 13 55.61 0.3 . 1 . . . . 98 SER CA . 15660 1 950 . 1 1 98 98 SER CB C 13 63.79 0.3 . 1 . . . . 98 SER CB . 15660 1 951 . 1 1 98 98 SER N N 15 119.7 0.2 . 1 . . . . 98 SER N . 15660 1 stop_ save_