data_15034 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15034 _Entry.Title ; 1H,13C and 15N NMR Assignments of the Yellow Fever Envelope Protein Domain III ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-11-16 _Entry.Accession_date 2006-11-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 David Volk . E. . 15034 2 Sai Gandham . Hari . 15034 3 Fiona May . J. . 15034 4 Alan Barrett . D.T. . 15034 5 David Gorenstein . G. . 15034 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Sealy Center for Structural Biology' . 15034 2 . 'University of Texas Medical Branch' . 15034 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15034 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 462 15034 '15N chemical shifts' 111 15034 '1H chemical shifts' 768 15034 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 2 . . 2009-08-31 2006-11-16 update BMRB 'complete entry citation' 15034 1 . . 2007-06-27 2006-11-16 original author 'original release' 15034 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15034 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636823 _Citation.Full_citation . _Citation.Title 'NMR assignments of the yellow fever virus envelope protein domain III' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 1 _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 49 _Citation.Page_last 50 _Citation.Year 2007 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 David Volk . E. . 15034 1 2 Sai Gandham . H.A. . 15034 1 3 Fiona May . J. . 15034 1 4 Anjenique Anderson . . . 15034 1 5 Alan Barrett . D.T. . 15034 1 6 David Gorenstein . G. . 15034 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Envelope Protein' 15034 1 Flavivirus 15034 1 NMR 15034 1 'Yellow Fever' 15034 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15034 _Assembly.ID 1 _Assembly.Name 'YFED3 monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds yes _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic . _Assembly.Thiol_state . _Assembly.Molecular_mass 12600 _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 'YFED3 monomer' 1 $YFED3 A . yes native no no . . . 15034 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 'YFED3 monomer' 1 CYS 14 14 SG . 1 'YFED3 monomer' 1 CYS 44 44 SG . 'YFED3 monomer' 14 CYS SG . 'YFED3 monomer' 44 CYS SG 15034 1 stop_ loop_ _Entity_deleted_atom.ID _Entity_deleted_atom.Entity_atom_list_ID _Entity_deleted_atom.Entity_assembly_ID _Entity_deleted_atom.Entity_ID _Entity_deleted_atom.Comp_ID _Entity_deleted_atom.Comp_index_ID _Entity_deleted_atom.Seq_ID _Entity_deleted_atom.Atom_ID _Entity_deleted_atom.Auth_entity_assembly_ID _Entity_deleted_atom.Auth_seq_ID _Entity_deleted_atom.Auth_comp_ID _Entity_deleted_atom.Auth_atom_ID _Entity_deleted_atom.Entry_ID _Entity_deleted_atom.Assembly_ID . . 1 1 CYS 14 14 HG . 14 CYS HG 15034 1 . . 1 1 CYS 44 44 HG . 44 CYS HG 15034 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'envelope virus' 15034 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_YFED3 _Entity.Sf_category entity _Entity.Sf_framecode YFED3 _Entity.Entry_ID 15034 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name YFED3 _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 ; MSALTLKGTSYKMCTDKMSF VKNPTDTGHGTVVMQVKVPK GAPCKIPVIVADDLTAAINK GILVTVNPIASTNDDEVLIE VNPPFGDSYIIVGTGDSRLT YQWHKEGSSIGK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'All residues (1-112) represent natural amino acids in the YF-ED3' _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 112 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'Domain III for the yellow fever virus envelope protein' _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 2JQM . "Yellow Fever Envelope Protein Domain Iii Nmr Structure (S288-K398)" . . . . . 100.00 112 100.00 100.00 1.74e-74 . . . . 15034 1 2 no PDB 2JV6 . "Yf Ed3 Protein Nmr Structure" . . . . . 100.00 112 100.00 100.00 1.74e-74 . . . . 15034 1 3 no GB AAA92693 . "envelope protein, partial [Yellow fever virus]" . . . . . 100.00 493 99.11 100.00 3.00e-70 . . . . 15034 1 4 no GB AAA92694 . "envelope protein, partial [Yellow fever virus]" . . . . . 100.00 493 97.32 100.00 7.50e-70 . . . . 15034 1 5 no GB AAA92695 . "envelope protein, partial [Yellow fever virus]" . . . . . 100.00 493 98.21 100.00 5.00e-70 . . . . 15034 1 6 no GB AAA92698 . "envelope protein, partial [Yellow fever virus]" . . . . . 100.00 493 99.11 100.00 2.58e-70 . . . . 15034 1 7 no GB AAA92699 . "envelope protein, partial [Yellow fever virus]" . . . . . 100.00 493 97.32 99.11 5.44e-69 . . . . 15034 1 8 no SP Q074N0 . "RecName: Full=Genome polyprotein; Contains: RecName: Full=Capsid protein C; AltName: Full=Core protein; Contains: RecName: Full" . . . . . 100.00 3412 98.21 100.00 6.03e-68 . . . . 15034 1 9 no SP Q1X880 . "RecName: Full=Genome polyprotein; Contains: RecName: Full=Capsid protein C; AltName: Full=Core protein; Contains: RecName: Full" . . . . . 100.00 3412 98.21 100.00 7.11e-68 . . . . 15034 1 10 no SP Q1X881 . "RecName: Full=Genome polyprotein; Contains: RecName: Full=Capsid protein C; AltName: Full=Core protein; Contains: RecName: Full" . . . . . 100.00 3412 98.21 100.00 5.53e-68 . . . . 15034 1 11 no SP Q6DV88 . "RecName: Full=Genome polyprotein; Contains: RecName: Full=Capsid protein C; AltName: Full=Core protein; Contains: RecName: Full" . . . . . 100.00 3411 99.11 100.00 2.34e-68 . . . . 15034 1 12 no SP Q6J3P1 . "RecName: Full=Genome polyprotein; Contains: RecName: Full=Capsid protein C; AltName: Full=Core protein; Contains: RecName: Full" . . . . . 100.00 3411 99.11 100.00 2.08e-68 . . . . 15034 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Viral Envelope' 15034 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 . 15034 1 2 . SER . 15034 1 3 . ALA . 15034 1 4 . LEU . 15034 1 5 . THR . 15034 1 6 . LEU . 15034 1 7 . LYS . 15034 1 8 . GLY . 15034 1 9 . THR . 15034 1 10 . SER . 15034 1 11 . TYR . 15034 1 12 . LYS . 15034 1 13 . MET . 15034 1 14 . CYS . 15034 1 15 . THR . 15034 1 16 . ASP . 15034 1 17 . LYS . 15034 1 18 . MET . 15034 1 19 . SER . 15034 1 20 . PHE . 15034 1 21 . VAL . 15034 1 22 . LYS . 15034 1 23 . ASN . 15034 1 24 . PRO . 15034 1 25 . THR . 15034 1 26 . ASP . 15034 1 27 . THR . 15034 1 28 . GLY . 15034 1 29 . HIS . 15034 1 30 . GLY . 15034 1 31 . THR . 15034 1 32 . VAL . 15034 1 33 . VAL . 15034 1 34 . MET . 15034 1 35 . GLN . 15034 1 36 . VAL . 15034 1 37 . LYS . 15034 1 38 . VAL . 15034 1 39 . PRO . 15034 1 40 . LYS . 15034 1 41 . GLY . 15034 1 42 . ALA . 15034 1 43 . PRO . 15034 1 44 . CYS . 15034 1 45 . LYS . 15034 1 46 . ILE . 15034 1 47 . PRO . 15034 1 48 . VAL . 15034 1 49 . ILE . 15034 1 50 . VAL . 15034 1 51 . ALA . 15034 1 52 . ASP . 15034 1 53 . ASP . 15034 1 54 . LEU . 15034 1 55 . THR . 15034 1 56 . ALA . 15034 1 57 . ALA . 15034 1 58 . ILE . 15034 1 59 . ASN . 15034 1 60 . LYS . 15034 1 61 . GLY . 15034 1 62 . ILE . 15034 1 63 . LEU . 15034 1 64 . VAL . 15034 1 65 . THR . 15034 1 66 . VAL . 15034 1 67 . ASN . 15034 1 68 . PRO . 15034 1 69 . ILE . 15034 1 70 . ALA . 15034 1 71 . SER . 15034 1 72 . THR . 15034 1 73 . ASN . 15034 1 74 . ASP . 15034 1 75 . ASP . 15034 1 76 . GLU . 15034 1 77 . VAL . 15034 1 78 . LEU . 15034 1 79 . ILE . 15034 1 80 . GLU . 15034 1 81 . VAL . 15034 1 82 . ASN . 15034 1 83 . PRO . 15034 1 84 . PRO . 15034 1 85 . PHE . 15034 1 86 . GLY . 15034 1 87 . ASP . 15034 1 88 . SER . 15034 1 89 . TYR . 15034 1 90 . ILE . 15034 1 91 . ILE . 15034 1 92 . VAL . 15034 1 93 . GLY . 15034 1 94 . THR . 15034 1 95 . GLY . 15034 1 96 . ASP . 15034 1 97 . SER . 15034 1 98 . ARG . 15034 1 99 . LEU . 15034 1 100 . THR . 15034 1 101 . TYR . 15034 1 102 . GLN . 15034 1 103 . TRP . 15034 1 104 . HIS . 15034 1 105 . LYS . 15034 1 106 . GLU . 15034 1 107 . GLY . 15034 1 108 . SER . 15034 1 109 . SER . 15034 1 110 . ILE . 15034 1 111 . GLY . 15034 1 112 . LYS . 15034 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 15034 1 . SER 2 2 15034 1 . ALA 3 3 15034 1 . LEU 4 4 15034 1 . THR 5 5 15034 1 . LEU 6 6 15034 1 . LYS 7 7 15034 1 . GLY 8 8 15034 1 . THR 9 9 15034 1 . SER 10 10 15034 1 . TYR 11 11 15034 1 . LYS 12 12 15034 1 . MET 13 13 15034 1 . CYS 14 14 15034 1 . THR 15 15 15034 1 . ASP 16 16 15034 1 . LYS 17 17 15034 1 . MET 18 18 15034 1 . SER 19 19 15034 1 . PHE 20 20 15034 1 . VAL 21 21 15034 1 . LYS 22 22 15034 1 . ASN 23 23 15034 1 . PRO 24 24 15034 1 . THR 25 25 15034 1 . ASP 26 26 15034 1 . THR 27 27 15034 1 . GLY 28 28 15034 1 . HIS 29 29 15034 1 . GLY 30 30 15034 1 . THR 31 31 15034 1 . VAL 32 32 15034 1 . VAL 33 33 15034 1 . MET 34 34 15034 1 . GLN 35 35 15034 1 . VAL 36 36 15034 1 . LYS 37 37 15034 1 . VAL 38 38 15034 1 . PRO 39 39 15034 1 . LYS 40 40 15034 1 . GLY 41 41 15034 1 . ALA 42 42 15034 1 . PRO 43 43 15034 1 . CYS 44 44 15034 1 . LYS 45 45 15034 1 . ILE 46 46 15034 1 . PRO 47 47 15034 1 . VAL 48 48 15034 1 . ILE 49 49 15034 1 . VAL 50 50 15034 1 . ALA 51 51 15034 1 . ASP 52 52 15034 1 . ASP 53 53 15034 1 . LEU 54 54 15034 1 . THR 55 55 15034 1 . ALA 56 56 15034 1 . ALA 57 57 15034 1 . ILE 58 58 15034 1 . ASN 59 59 15034 1 . LYS 60 60 15034 1 . GLY 61 61 15034 1 . ILE 62 62 15034 1 . LEU 63 63 15034 1 . VAL 64 64 15034 1 . THR 65 65 15034 1 . VAL 66 66 15034 1 . ASN 67 67 15034 1 . PRO 68 68 15034 1 . ILE 69 69 15034 1 . ALA 70 70 15034 1 . SER 71 71 15034 1 . THR 72 72 15034 1 . ASN 73 73 15034 1 . ASP 74 74 15034 1 . ASP 75 75 15034 1 . GLU 76 76 15034 1 . VAL 77 77 15034 1 . LEU 78 78 15034 1 . ILE 79 79 15034 1 . GLU 80 80 15034 1 . VAL 81 81 15034 1 . ASN 82 82 15034 1 . PRO 83 83 15034 1 . PRO 84 84 15034 1 . PHE 85 85 15034 1 . GLY 86 86 15034 1 . ASP 87 87 15034 1 . SER 88 88 15034 1 . TYR 89 89 15034 1 . ILE 90 90 15034 1 . ILE 91 91 15034 1 . VAL 92 92 15034 1 . GLY 93 93 15034 1 . THR 94 94 15034 1 . GLY 95 95 15034 1 . ASP 96 96 15034 1 . SER 97 97 15034 1 . ARG 98 98 15034 1 . LEU 99 99 15034 1 . THR 100 100 15034 1 . TYR 101 101 15034 1 . GLN 102 102 15034 1 . TRP 103 103 15034 1 . HIS 104 104 15034 1 . LYS 105 105 15034 1 . GLU 106 106 15034 1 . GLY 107 107 15034 1 . SER 108 108 15034 1 . SER 109 109 15034 1 . ILE 110 110 15034 1 . GLY 111 111 15034 1 . LYS 112 112 15034 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 15034 _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 $YFED3 . 11089 virus . 'Flaviviridae, Yellow Fever' 'Yellow fever virus' . . Viruses . Flavivirus 'Yellow fever virus' Asibi . . . . . . . . . . . . . . . . . . . . 15034 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 15034 _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 $YFED3 . 'recombinant technology' 'Escherichia coli' . . . . . . . . . . . . . . . . . . . . . pET . . . . . . 15034 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15034 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 YFED3 '[U-98% 13C; U-98% 15N]' . . 1 $YFED3 . . . 0.1 0.3 mM . . . . 15034 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15034 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.05 . M 15034 1 pH 5.8 . pH 15034 1 pressure 1 . atm 15034 1 temperature 298 . K 15034 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 15034 _Software.ID 1 _Software.Name VNMRJ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 15034 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15034 1 'data analysis' 15034 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15034 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 600_cryo _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15034 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 15034 _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 . . . 15034 1 2 spectrometer_2 Varian INOVA . 750 . . . 15034 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 15034 _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 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15034 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15034 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15034 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15034 1 5 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15034 1 6 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15034 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15034 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15034 1 9 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15034 1 10 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15034 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 15034 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 15034 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $entry_citation . . 1 $entry_citation 15034 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 15034 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 15034 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.25 _Assigned_chem_shift_list.Chem_shift_15N_err 0.10 _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 4 '3D CBCA(CO)NH' . . . 15034 1 5 '3D H(CCO)NH' . . . 15034 1 6 '3D C(CO)NH' . . . 15034 1 7 '3D HCCH-TOCSY' . . . 15034 1 10 '3D HNCACB' . . . 15034 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 SER HA H 1 4.12 0.01 . 1 . . . . 2 SER HA . 15034 1 2 . 1 1 2 2 SER HB2 H 1 3.98 0.01 . 1 . . . . 2 SER HB2 . 15034 1 3 . 1 1 2 2 SER HB3 H 1 3.98 0.01 . 1 . . . . 2 SER HB3 . 15034 1 4 . 1 1 2 2 SER CA C 13 57.53 0.25 . 1 . . . . 2 SER CA . 15034 1 5 . 1 1 2 2 SER CB C 13 63.56 0.25 . 1 . . . . 2 SER CB . 15034 1 6 . 1 1 3 3 ALA H H 1 8.70 0.01 . 1 . . . . 3 ALA H . 15034 1 7 . 1 1 3 3 ALA HA H 1 4.36 0.01 . 1 . . . . 3 ALA HA . 15034 1 8 . 1 1 3 3 ALA HB1 H 1 1.39 0.01 . 1 . . . . 3 ALA HB . 15034 1 9 . 1 1 3 3 ALA HB2 H 1 1.39 0.01 . 1 . . . . 3 ALA HB . 15034 1 10 . 1 1 3 3 ALA HB3 H 1 1.39 0.01 . 1 . . . . 3 ALA HB . 15034 1 11 . 1 1 3 3 ALA C C 13 177.51 0.1 . 1 . . . . 3 ALA C . 15034 1 12 . 1 1 3 3 ALA CA C 13 52.85 0.25 . 1 . . . . 3 ALA CA . 15034 1 13 . 1 1 3 3 ALA CB C 13 19.57 0.25 . 1 . . . . 3 ALA CB . 15034 1 14 . 1 1 3 3 ALA N N 15 125.30 0.1 . 1 . . . . 3 ALA N . 15034 1 15 . 1 1 4 4 LEU H H 1 8.26 0.01 . 1 . . . . 4 LEU H . 15034 1 16 . 1 1 4 4 LEU HA H 1 4.35 0.01 . 1 . . . . 4 LEU HA . 15034 1 17 . 1 1 4 4 LEU HB2 H 1 1.60 0.01 . 1 . . . . 4 LEU HB2 . 15034 1 18 . 1 1 4 4 LEU HB3 H 1 1.60 0.01 . 1 . . . . 4 LEU HB3 . 15034 1 19 . 1 1 4 4 LEU HG H 1 1.60 0.01 . 1 . . . . 4 LEU HG . 15034 1 20 . 1 1 4 4 LEU HD11 H 1 0.90 0.01 . 1 . . . . 4 LEU HD1 . 15034 1 21 . 1 1 4 4 LEU HD12 H 1 0.90 0.01 . 1 . . . . 4 LEU HD1 . 15034 1 22 . 1 1 4 4 LEU HD13 H 1 0.90 0.01 . 1 . . . . 4 LEU HD1 . 15034 1 23 . 1 1 4 4 LEU HD21 H 1 0.84 0.01 . 1 . . . . 4 LEU HD2 . 15034 1 24 . 1 1 4 4 LEU HD22 H 1 0.84 0.01 . 1 . . . . 4 LEU HD2 . 15034 1 25 . 1 1 4 4 LEU HD23 H 1 0.84 0.01 . 1 . . . . 4 LEU HD2 . 15034 1 26 . 1 1 4 4 LEU C C 13 177.55 0.1 . 1 . . . . 4 LEU C . 15034 1 27 . 1 1 4 4 LEU CA C 13 55.55 0.25 . 1 . . . . 4 LEU CA . 15034 1 28 . 1 1 4 4 LEU CB C 13 42.52 0.25 . 1 . . . . 4 LEU CB . 15034 1 29 . 1 1 4 4 LEU CG C 13 27.06 0.25 . 1 . . . . 4 LEU CG . 15034 1 30 . 1 1 4 4 LEU CD1 C 13 24.84 0.25 . 2 . . . . 4 LEU CD1 . 15034 1 31 . 1 1 4 4 LEU CD2 C 13 23.66 0.25 . 2 . . . . 4 LEU CD2 . 15034 1 32 . 1 1 4 4 LEU N N 15 122.11 0.1 . 1 . . . . 4 LEU N . 15034 1 33 . 1 1 5 5 THR H H 1 8.06 0.01 . 1 . . . . 5 THR H . 15034 1 34 . 1 1 5 5 THR HA H 1 4.29 0.01 . 1 . . . . 5 THR HA . 15034 1 35 . 1 1 5 5 THR HB H 1 4.17 0.01 . 1 . . . . 5 THR HB . 15034 1 36 . 1 1 5 5 THR HG21 H 1 1.16 0.01 . 1 . . . . 5 THR HG2 . 15034 1 37 . 1 1 5 5 THR HG22 H 1 1.16 0.01 . 1 . . . . 5 THR HG2 . 15034 1 38 . 1 1 5 5 THR HG23 H 1 1.16 0.01 . 1 . . . . 5 THR HG2 . 15034 1 39 . 1 1 5 5 THR C C 13 174.41 0.1 . 1 . . . . 5 THR C . 15034 1 40 . 1 1 5 5 THR CA C 13 61.86 0.25 . 1 . . . . 5 THR CA . 15034 1 41 . 1 1 5 5 THR CB C 13 69.83 0.25 . 1 . . . . 5 THR CB . 15034 1 42 . 1 1 5 5 THR CG2 C 13 21.67 0.25 . 1 . . . . 5 THR CG2 . 15034 1 43 . 1 1 5 5 THR N N 15 116.12 0.1 . 1 . . . . 5 THR N . 15034 1 44 . 1 1 6 6 LEU H H 1 8.21 0.01 . 1 . . . . 6 LEU H . 15034 1 45 . 1 1 6 6 LEU HA H 1 4.34 0.01 . 1 . . . . 6 LEU HA . 15034 1 46 . 1 1 6 6 LEU HB2 H 1 1.59 0.01 . 1 . . . . 6 LEU HB2 . 15034 1 47 . 1 1 6 6 LEU HB3 H 1 1.55 0.01 . 1 . . . . 6 LEU HB3 . 15034 1 48 . 1 1 6 6 LEU HG H 1 1.59 0.01 . 1 . . . . 6 LEU HG . 15034 1 49 . 1 1 6 6 LEU HD11 H 1 0.88 0.01 . 1 . . . . 6 LEU HD1 . 15034 1 50 . 1 1 6 6 LEU HD12 H 1 0.88 0.01 . 1 . . . . 6 LEU HD1 . 15034 1 51 . 1 1 6 6 LEU HD13 H 1 0.88 0.01 . 1 . . . . 6 LEU HD1 . 15034 1 52 . 1 1 6 6 LEU HD21 H 1 0.83 0.01 . 1 . . . . 6 LEU HD2 . 15034 1 53 . 1 1 6 6 LEU HD22 H 1 0.83 0.01 . 1 . . . . 6 LEU HD2 . 15034 1 54 . 1 1 6 6 LEU HD23 H 1 0.83 0.01 . 1 . . . . 6 LEU HD2 . 15034 1 55 . 1 1 6 6 LEU C C 13 177.29 0.1 . 1 . . . . 6 LEU C . 15034 1 56 . 1 1 6 6 LEU CA C 13 55.31 0.25 . 1 . . . . 6 LEU CA . 15034 1 57 . 1 1 6 6 LEU CB C 13 42.48 0.25 . 1 . . . . 6 LEU CB . 15034 1 58 . 1 1 6 6 LEU CG C 13 27.00 0.25 . 1 . . . . 6 LEU CG . 15034 1 59 . 1 1 6 6 LEU CD1 C 13 24.97 0.25 . 2 . . . . 6 LEU CD1 . 15034 1 60 . 1 1 6 6 LEU CD2 C 13 23.55 0.25 . 2 . . . . 6 LEU CD2 . 15034 1 61 . 1 1 6 6 LEU N N 15 125.61 0.1 . 1 . . . . 6 LEU N . 15034 1 62 . 1 1 7 7 LYS H H 1 8.28 0.01 . 1 . . . . 7 LYS H . 15034 1 63 . 1 1 7 7 LYS HA H 1 4.27 0.01 . 1 . . . . 7 LYS HA . 15034 1 64 . 1 1 7 7 LYS HB2 H 1 1.79 0.01 . 1 . . . . 7 LYS HB2 . 15034 1 65 . 1 1 7 7 LYS HB3 H 1 1.79 0.01 . 1 . . . . 7 LYS HB3 . 15034 1 66 . 1 1 7 7 LYS HG2 H 1 1.47 0.01 . 1 . . . . 7 LYS HG2 . 15034 1 67 . 1 1 7 7 LYS HG3 H 1 1.39 0.01 . 1 . . . . 7 LYS HG3 . 15034 1 68 . 1 1 7 7 LYS HD2 H 1 1.66 0.01 . 1 . . . . 7 LYS HD2 . 15034 1 69 . 1 1 7 7 LYS HD3 H 1 1.66 0.01 . 1 . . . . 7 LYS HD3 . 15034 1 70 . 1 1 7 7 LYS HE2 H 1 2.97 0.01 . 1 . . . . 7 LYS HE2 . 15034 1 71 . 1 1 7 7 LYS HE3 H 1 2.97 0.01 . 1 . . . . 7 LYS HE3 . 15034 1 72 . 1 1 7 7 LYS C C 13 177.08 0.1 . 1 . . . . 7 LYS C . 15034 1 73 . 1 1 7 7 LYS CA C 13 56.63 0.25 . 1 . . . . 7 LYS CA . 15034 1 74 . 1 1 7 7 LYS CB C 13 33.08 0.25 . 1 . . . . 7 LYS CB . 15034 1 75 . 1 1 7 7 LYS CG C 13 24.77 0.25 . 1 . . . . 7 LYS CG . 15034 1 76 . 1 1 7 7 LYS CD C 13 29.17 0.25 . 1 . . . . 7 LYS CD . 15034 1 77 . 1 1 7 7 LYS CE C 13 42.26 0.25 . 1 . . . . 7 LYS CE . 15034 1 78 . 1 1 7 7 LYS N N 15 122.99 0.1 . 1 . . . . 7 LYS N . 15034 1 79 . 1 1 8 8 GLY H H 1 8.35 0.01 . 1 . . . . 8 GLY H . 15034 1 80 . 1 1 8 8 GLY HA2 H 1 3.87 0.01 . 1 . . . . 8 GLY HA2 . 15034 1 81 . 1 1 8 8 GLY HA3 H 1 3.87 0.01 . 1 . . . . 8 GLY HA3 . 15034 1 82 . 1 1 8 8 GLY C C 13 174.22 0.1 . 1 . . . . 8 GLY C . 15034 1 83 . 1 1 8 8 GLY CA C 13 45.47 0.25 . 1 . . . . 8 GLY CA . 15034 1 84 . 1 1 8 8 GLY N N 15 110.67 0.1 . 1 . . . . 8 GLY N . 15034 1 85 . 1 1 9 9 THR H H 1 7.90 0.01 . 1 . . . . 9 THR H . 15034 1 86 . 1 1 9 9 THR HA H 1 4.23 0.01 . 1 . . . . 9 THR HA . 15034 1 87 . 1 1 9 9 THR HB H 1 4.06 0.01 . 1 . . . . 9 THR HB . 15034 1 88 . 1 1 9 9 THR HG21 H 1 1.02 0.01 . 1 . . . . 9 THR HG2 . 15034 1 89 . 1 1 9 9 THR HG22 H 1 1.02 0.01 . 1 . . . . 9 THR HG2 . 15034 1 90 . 1 1 9 9 THR HG23 H 1 1.02 0.01 . 1 . . . . 9 THR HG2 . 15034 1 91 . 1 1 9 9 THR C C 13 174.30 0.1 . 1 . . . . 9 THR C . 15034 1 92 . 1 1 9 9 THR CA C 13 62.14 0.25 . 1 . . . . 9 THR CA . 15034 1 93 . 1 1 9 9 THR CB C 13 70.14 0.25 . 1 . . . . 9 THR CB . 15034 1 94 . 1 1 9 9 THR CG2 C 13 21.5 0.25 . 1 . . . . 9 THR CG2 . 15034 1 95 . 1 1 9 9 THR N N 15 114.15 0.1 . 1 . . . . 9 THR N . 15034 1 96 . 1 1 10 10 SER H H 1 8.15 0.01 . 1 . . . . 10 SER H . 15034 1 97 . 1 1 10 10 SER HA H 1 4.45 0.01 . 1 . . . . 10 SER HA . 15034 1 98 . 1 1 10 10 SER HB2 H 1 3.73 0.01 . 1 . . . . 10 SER HB2 . 15034 1 99 . 1 1 10 10 SER HB3 H 1 3.73 0.01 . 1 . . . . 10 SER HB3 . 15034 1 100 . 1 1 10 10 SER C C 13 173.77 0.1 . 1 . . . . 10 SER C . 15034 1 101 . 1 1 10 10 SER CA C 13 57.81 0.25 . 1 . . . . 10 SER CA . 15034 1 102 . 1 1 10 10 SER CB C 13 63.78 0.25 . 1 . . . . 10 SER CB . 15034 1 103 . 1 1 10 10 SER N N 15 118.98 0.1 . 1 . . . . 10 SER N . 15034 1 104 . 1 1 11 11 TYR H H 1 8.02 0.01 . 1 . . . . 11 TYR H . 15034 1 105 . 1 1 11 11 TYR HA H 1 4.59 0.01 . 1 . . . . 11 TYR HA . 15034 1 106 . 1 1 11 11 TYR HB2 H 1 2.98 0.01 . 2 . . . . 11 TYR HB2 . 15034 1 107 . 1 1 11 11 TYR HB3 H 1 2.61 0.01 . 2 . . . . 11 TYR HB3 . 15034 1 108 . 1 1 11 11 TYR HD1 H 1 6.95 0.02 . 1 . . . . 11 TYR HD1 . 15034 1 109 . 1 1 11 11 TYR HD2 H 1 6.95 0.02 . 1 . . . . 11 TYR HD2 . 15034 1 110 . 1 1 11 11 TYR HE1 H 1 6.71 0.02 . 1 . . . . 11 TYR HE1 . 15034 1 111 . 1 1 11 11 TYR HE2 H 1 6.71 0.02 . 1 . . . . 11 TYR HE2 . 15034 1 112 . 1 1 11 11 TYR C C 13 176.05 0.1 . 1 . . . . 11 TYR C . 15034 1 113 . 1 1 11 11 TYR CA C 13 57.65 0.25 . 1 . . . . 11 TYR CA . 15034 1 114 . 1 1 11 11 TYR CB C 13 40.53 0.25 . 1 . . . . 11 TYR CB . 15034 1 115 . 1 1 11 11 TYR CD1 C 13 132.53 0.2 . 1 . . . . 11 TYR CD1 . 15034 1 116 . 1 1 11 11 TYR CD2 C 13 132.53 0.2 . 1 . . . . 11 TYR CD2 . 15034 1 117 . 1 1 11 11 TYR CE1 C 13 118.3 0.2 . 1 . . . . 11 TYR CE1 . 15034 1 118 . 1 1 11 11 TYR CE2 C 13 118.3 0.2 . 1 . . . . 11 TYR CE2 . 15034 1 119 . 1 1 11 11 TYR N N 15 122.39 0.1 . 1 . . . . 11 TYR N . 15034 1 120 . 1 1 12 12 LYS H H 1 8.67 0.01 . 1 . . . . 12 LYS H . 15034 1 121 . 1 1 12 12 LYS HA H 1 4.37 0.01 . 1 . . . . 12 LYS HA . 15034 1 122 . 1 1 12 12 LYS HB2 H 1 1.90 0.01 . 1 . . . . 12 LYS HB2 . 15034 1 123 . 1 1 12 12 LYS HB3 H 1 1.90 0.01 . 1 . . . . 12 LYS HB3 . 15034 1 124 . 1 1 12 12 LYS HG2 H 1 1.57 0.01 . 1 . . . . 12 LYS HG2 . 15034 1 125 . 1 1 12 12 LYS HG3 H 1 1.42 0.01 . 1 . . . . 12 LYS HG3 . 15034 1 126 . 1 1 12 12 LYS HD2 H 1 1.73 0.01 . 1 . . . . 12 LYS HD2 . 15034 1 127 . 1 1 12 12 LYS HD3 H 1 1.73 0.01 . 1 . . . . 12 LYS HD3 . 15034 1 128 . 1 1 12 12 LYS HE2 H 1 3.05 0.01 . 1 . . . . 12 LYS HE2 . 15034 1 129 . 1 1 12 12 LYS HE3 H 1 3.05 0.01 . 1 . . . . 12 LYS HE3 . 15034 1 130 . 1 1 12 12 LYS C C 13 176.06 0.1 . 1 . . . . 12 LYS C . 15034 1 131 . 1 1 12 12 LYS CA C 13 55.45 0.25 . 1 . . . . 12 LYS CA . 15034 1 132 . 1 1 12 12 LYS CB C 13 33.45 0.25 . 1 . . . . 12 LYS CB . 15034 1 133 . 1 1 12 12 LYS CG C 13 24.29 0.25 . 1 . . . . 12 LYS CG . 15034 1 134 . 1 1 12 12 LYS CD C 13 29.24 0.25 . 1 . . . . 12 LYS CD . 15034 1 135 . 1 1 12 12 LYS CE C 13 42.37 0.25 . 1 . . . . 12 LYS CE . 15034 1 136 . 1 1 12 12 LYS N N 15 122.62 0.1 . 1 . . . . 12 LYS N . 15034 1 137 . 1 1 13 13 MET H H 1 8.56 0.01 . 1 . . . . 13 MET H . 15034 1 138 . 1 1 13 13 MET HA H 1 5.07 0.01 . 1 . . . . 13 MET HA . 15034 1 139 . 1 1 13 13 MET HB2 H 1 2.01 0.01 . 1 . . . . 13 MET HB2 . 15034 1 140 . 1 1 13 13 MET HB3 H 1 1.85 0.01 . 1 . . . . 13 MET HB3 . 15034 1 141 . 1 1 13 13 MET HG2 H 1 2.73 0.01 . 1 . . . . 13 MET HG2 . 15034 1 142 . 1 1 13 13 MET HG3 H 1 2.62 0.01 . 1 . . . . 13 MET HG3 . 15034 1 143 . 1 1 13 13 MET C C 13 177.96 0.1 . 1 . . . . 13 MET C . 15034 1 144 . 1 1 13 13 MET CA C 13 55.43 0.25 . 1 . . . . 13 MET CA . 15034 1 145 . 1 1 13 13 MET CB C 13 32.69 0.25 . 1 . . . . 13 MET CB . 15034 1 146 . 1 1 13 13 MET CG C 13 32.33 0.25 . 1 . . . . 13 MET CG . 15034 1 147 . 1 1 13 13 MET N N 15 120.64 0.1 . 1 . . . . 13 MET N . 15034 1 148 . 1 1 14 14 CYS H H 1 9.26 0.01 . 1 . . . . 14 CYS H . 15034 1 149 . 1 1 14 14 CYS HA H 1 4.71 0.01 . 1 . . . . 14 CYS HA . 15034 1 150 . 1 1 14 14 CYS HB2 H 1 3.50 0.01 . 2 . . . . 14 CYS HB2 . 15034 1 151 . 1 1 14 14 CYS HB3 H 1 2.47 0.01 . 2 . . . . 14 CYS HB3 . 15034 1 152 . 1 1 14 14 CYS C C 13 175.08 0.1 . 1 . . . . 14 CYS C . 15034 1 153 . 1 1 14 14 CYS CA C 13 54.94 0.25 . 1 . . . . 14 CYS CA . 15034 1 154 . 1 1 14 14 CYS CB C 13 40.20 0.25 . 1 . . . . 14 CYS CB . 15034 1 155 . 1 1 14 14 CYS N N 15 123.54 0.1 . 1 . . . . 14 CYS N . 15034 1 156 . 1 1 15 15 THR H H 1 8.16 0.01 . 1 . . . . 15 THR H . 15034 1 157 . 1 1 15 15 THR HA H 1 4.47 0.01 . 1 . . . . 15 THR HA . 15034 1 158 . 1 1 15 15 THR HB H 1 4.34 0.01 . 1 . . . . 15 THR HB . 15034 1 159 . 1 1 15 15 THR HG21 H 1 1.10 0.01 . 1 . . . . 15 THR HG2 . 15034 1 160 . 1 1 15 15 THR HG22 H 1 1.10 0.01 . 1 . . . . 15 THR HG2 . 15034 1 161 . 1 1 15 15 THR HG23 H 1 1.10 0.01 . 1 . . . . 15 THR HG2 . 15034 1 162 . 1 1 15 15 THR C C 13 174.76 0.1 . 1 . . . . 15 THR C . 15034 1 163 . 1 1 15 15 THR CA C 13 61.51 0.25 . 1 . . . . 15 THR CA . 15034 1 164 . 1 1 15 15 THR CB C 13 70.15 0.25 . 1 . . . . 15 THR CB . 15034 1 165 . 1 1 15 15 THR CG2 C 13 21.52 0.25 . 1 . . . . 15 THR CG2 . 15034 1 166 . 1 1 15 15 THR N N 15 113.72 0.1 . 1 . . . . 15 THR N . 15034 1 167 . 1 1 16 16 ASP H H 1 8.11 0.01 . 1 . . . . 16 ASP H . 15034 1 168 . 1 1 16 16 ASP HA H 1 4.73 0.01 . 1 . . . . 16 ASP HA . 15034 1 169 . 1 1 16 16 ASP HB2 H 1 2.60 0.01 . 2 . . . . 16 ASP HB2 . 15034 1 170 . 1 1 16 16 ASP HB3 H 1 2.44 0.01 . 2 . . . . 16 ASP HB3 . 15034 1 171 . 1 1 16 16 ASP C C 13 174.76 0.1 . 1 . . . . 16 ASP C . 15034 1 172 . 1 1 16 16 ASP CA C 13 54.21 0.25 . 1 . . . . 16 ASP CA . 15034 1 173 . 1 1 16 16 ASP CB C 13 43.25 0.25 . 1 . . . . 16 ASP CB . 15034 1 174 . 1 1 16 16 ASP N N 15 124.59 0.1 . 1 . . . . 16 ASP N . 15034 1 175 . 1 1 17 17 LYS H H 1 8.40 0.01 . 1 . . . . 17 LYS H . 15034 1 176 . 1 1 17 17 LYS HA H 1 4.08 0.01 . 1 . . . . 17 LYS HA . 15034 1 177 . 1 1 17 17 LYS HB2 H 1 1.86 0.01 . 1 . . . . 17 LYS HB2 . 15034 1 178 . 1 1 17 17 LYS HB3 H 1 1.80 0.01 . 1 . . . . 17 LYS HB3 . 15034 1 179 . 1 1 17 17 LYS HG2 H 1 1.52 0.01 . 1 . . . . 17 LYS HG2 . 15034 1 180 . 1 1 17 17 LYS HG3 H 1 1.45 0.01 . 1 . . . . 17 LYS HG3 . 15034 1 181 . 1 1 17 17 LYS HD2 H 1 1.73 0.01 . 1 . . . . 17 LYS HD2 . 15034 1 182 . 1 1 17 17 LYS HD3 H 1 1.68 0.01 . 1 . . . . 17 LYS HD3 . 15034 1 183 . 1 1 17 17 LYS HE2 H 1 3.01 0.01 . 1 . . . . 17 LYS HE2 . 15034 1 184 . 1 1 17 17 LYS HE3 H 1 3.01 0.01 . 1 . . . . 17 LYS HE3 . 15034 1 185 . 1 1 17 17 LYS C C 13 176.16 0.1 . 1 . . . . 17 LYS C . 15034 1 186 . 1 1 17 17 LYS CA C 13 58.12 0.25 . 1 . . . . 17 LYS CA . 15034 1 187 . 1 1 17 17 LYS CB C 13 32.68 0.25 . 1 . . . . 17 LYS CB . 15034 1 188 . 1 1 17 17 LYS CG C 13 24.86 0.25 . 1 . . . . 17 LYS CG . 15034 1 189 . 1 1 17 17 LYS CD C 13 29.41 0.25 . 1 . . . . 17 LYS CD . 15034 1 190 . 1 1 17 17 LYS CE C 13 42.22 0.25 . 1 . . . . 17 LYS CE . 15034 1 191 . 1 1 17 17 LYS N N 15 119.89 0.1 . 1 . . . . 17 LYS N . 15034 1 192 . 1 1 18 18 MET H H 1 8.79 0.01 . 1 . . . . 18 MET H . 15034 1 193 . 1 1 18 18 MET HA H 1 4.67 0.01 . 1 . . . . 18 MET HA . 15034 1 194 . 1 1 18 18 MET HB2 H 1 1.73 0.01 . 1 . . . . 18 MET HB2 . 15034 1 195 . 1 1 18 18 MET HB3 H 1 1.89 0.01 . 1 . . . . 18 MET HB3 . 15034 1 196 . 1 1 18 18 MET HG2 H 1 2.55 0.01 . 1 . . . . 18 MET HG2 . 15034 1 197 . 1 1 18 18 MET HG3 H 1 2.55 0.01 . 1 . . . . 18 MET HG3 . 15034 1 198 . 1 1 18 18 MET C C 13 174.15 0.1 . 1 . . . . 18 MET C . 15034 1 199 . 1 1 18 18 MET CA C 13 55.17 0.25 . 1 . . . . 18 MET CA . 15034 1 200 . 1 1 18 18 MET CB C 13 36.43 0.25 . 1 . . . . 18 MET CB . 15034 1 201 . 1 1 18 18 MET CG C 13 32.79 0.25 . 1 . . . . 18 MET CG . 15034 1 202 . 1 1 18 18 MET N N 15 127.84 0.1 . 1 . . . . 18 MET N . 15034 1 203 . 1 1 19 19 SER H H 1 7.85 0.01 . 1 . . . . 19 SER H . 15034 1 204 . 1 1 19 19 SER HA H 1 4.68 0.01 . 1 . . . . 19 SER HA . 15034 1 205 . 1 1 19 19 SER HB2 H 1 3.73 0.01 . 1 . . . . 19 SER HB2 . 15034 1 206 . 1 1 19 19 SER HB3 H 1 3.69 0.01 . 1 . . . . 19 SER HB3 . 15034 1 207 . 1 1 19 19 SER C C 13 173.83 0.1 . 1 . . . . 19 SER C . 15034 1 208 . 1 1 19 19 SER CA C 13 57.40 0.25 . 1 . . . . 19 SER CA . 15034 1 209 . 1 1 19 19 SER CB C 13 66.07 0.25 . 1 . . . . 19 SER CB . 15034 1 210 . 1 1 19 19 SER N N 15 109.88 0.1 . 1 . . . . 19 SER N . 15034 1 211 . 1 1 20 20 PHE H H 1 9.045 0.01 . 1 . . . . 20 PHE H . 15034 1 212 . 1 1 20 20 PHE HA H 1 5.03 0.01 . 1 . . . . 20 PHE HA . 15034 1 213 . 1 1 20 20 PHE HB2 H 1 3.01 0.01 . 2 . . . . 20 PHE HB2 . 15034 1 214 . 1 1 20 20 PHE HB3 H 1 2.82 0.01 . 2 . . . . 20 PHE HB3 . 15034 1 215 . 1 1 20 20 PHE HZ H 1 7.34 0.02 . 5 . . . . 20 PHE HZ . 15034 1 216 . 1 1 20 20 PHE C C 13 177.29 0.1 . 1 . . . . 20 PHE C . 15034 1 217 . 1 1 20 20 PHE CA C 13 58.80 0.25 . 1 . . . . 20 PHE CA . 15034 1 218 . 1 1 20 20 PHE CB C 13 39.33 0.25 . 1 . . . . 20 PHE CB . 15034 1 219 . 1 1 20 20 PHE CZ C 13 131.4 0.2 . 5 . . . . 20 PHE CZ . 15034 1 220 . 1 1 20 20 PHE N N 15 120.61 0.1 . 1 . . . . 20 PHE N . 15034 1 221 . 1 1 21 21 VAL H H 1 8.74 0.1 . 1 . . . . 21 VAL H . 15034 1 222 . 1 1 21 21 VAL HA H 1 4.16 0.01 . 1 . . . . 21 VAL HA . 15034 1 223 . 1 1 21 21 VAL HB H 1 1.82 0.01 . 1 . . . . 21 VAL HB . 15034 1 224 . 1 1 21 21 VAL HG11 H 1 0.87 0.01 . 2 . . . . 21 VAL HG1 . 15034 1 225 . 1 1 21 21 VAL HG12 H 1 0.87 0.01 . 2 . . . . 21 VAL HG1 . 15034 1 226 . 1 1 21 21 VAL HG13 H 1 0.87 0.01 . 2 . . . . 21 VAL HG1 . 15034 1 227 . 1 1 21 21 VAL HG21 H 1 0.76 0.01 . 2 . . . . 21 VAL HG2 . 15034 1 228 . 1 1 21 21 VAL HG22 H 1 0.76 0.01 . 2 . . . . 21 VAL HG2 . 15034 1 229 . 1 1 21 21 VAL HG23 H 1 0.76 0.01 . 2 . . . . 21 VAL HG2 . 15034 1 230 . 1 1 21 21 VAL C C 13 176.56 0.1 . 1 . . . . 21 VAL C . 15034 1 231 . 1 1 21 21 VAL CA C 13 63.44 0.25 . 1 . . . . 21 VAL CA . 15034 1 232 . 1 1 21 21 VAL CB C 13 32.79 0.25 . 1 . . . . 21 VAL CB . 15034 1 233 . 1 1 21 21 VAL CG1 C 13 21.56 0.25 . 1 . . . . 21 VAL CG1 . 15034 1 234 . 1 1 21 21 VAL CG2 C 13 21.56 0.25 . 1 . . . . 21 VAL CG2 . 15034 1 235 . 1 1 21 21 VAL N N 15 122.97 0.1 . 1 . . . . 21 VAL N . 15034 1 236 . 1 1 22 22 LYS H H 1 7.58 0.01 . 1 . . . . 22 LYS H . 15034 1 237 . 1 1 22 22 LYS HA H 1 4.46 0.01 . 1 . . . . 22 LYS HA . 15034 1 238 . 1 1 22 22 LYS HB2 H 1 1.63 0.01 . 1 . . . . 22 LYS HB2 . 15034 1 239 . 1 1 22 22 LYS HB3 H 1 1.63 0.01 . 1 . . . . 22 LYS HB3 . 15034 1 240 . 1 1 22 22 LYS HG2 H 1 1.39 0.01 . 1 . . . . 22 LYS HG2 . 15034 1 241 . 1 1 22 22 LYS HG3 H 1 1.39 0.01 . 1 . . . . 22 LYS HG3 . 15034 1 242 . 1 1 22 22 LYS HD2 H 1 1.55 0.01 . 1 . . . . 22 LYS HD2 . 15034 1 243 . 1 1 22 22 LYS HD3 H 1 1.63 0.01 . 1 . . . . 22 LYS HD3 . 15034 1 244 . 1 1 22 22 LYS HE2 H 1 2.88 0.01 . 1 . . . . 22 LYS HE2 . 15034 1 245 . 1 1 22 22 LYS HE3 H 1 2.88 0.01 . 1 . . . . 22 LYS HE3 . 15034 1 246 . 1 1 22 22 LYS C C 13 175.69 0.1 . 1 . . . . 22 LYS C . 15034 1 247 . 1 1 22 22 LYS CA C 13 56.14 0.25 . 1 . . . . 22 LYS CA . 15034 1 248 . 1 1 22 22 LYS CB C 13 35.39 0.25 . 1 . . . . 22 LYS CB . 15034 1 249 . 1 1 22 22 LYS CG C 13 24.44 0.25 . 1 . . . . 22 LYS CG . 15034 1 250 . 1 1 22 22 LYS CD C 13 29.42 0.25 . 1 . . . . 22 LYS CD . 15034 1 251 . 1 1 22 22 LYS CE C 13 42.01 0.25 . 1 . . . . 22 LYS CE . 15034 1 252 . 1 1 22 22 LYS N N 15 120.21 0.1 . 1 . . . . 22 LYS N . 15034 1 253 . 1 1 23 23 ASN H H 1 8.65 0.01 . 1 . . . . 23 ASN H . 15034 1 254 . 1 1 23 23 ASN HA H 1 3.87 0.01 . 1 . . . . 23 ASN HA . 15034 1 255 . 1 1 23 23 ASN HB2 H 1 2.42 0.01 . 2 . . . . 23 ASN HB2 . 15034 1 256 . 1 1 23 23 ASN HB3 H 1 2.13 0.01 . 2 . . . . 23 ASN HB3 . 15034 1 257 . 1 1 23 23 ASN HD21 H 1 7.46 0.01 . 1 . . . . 23 ASN HD21 . 15034 1 258 . 1 1 23 23 ASN HD22 H 1 6.89 0.01 . 1 . . . . 23 ASN HD22 . 15034 1 259 . 1 1 23 23 ASN CA C 13 51.79 0.25 . 1 . . . . 23 ASN CA . 15034 1 260 . 1 1 23 23 ASN CB C 13 36.66 0.25 . 1 . . . . 23 ASN CB . 15034 1 261 . 1 1 23 23 ASN N N 15 125.02 0.1 . 1 . . . . 23 ASN N . 15034 1 262 . 1 1 23 23 ASN ND2 N 15 111.48 0.1 . 1 . . . . 23 ASN ND2 . 15034 1 263 . 1 1 24 24 PRO HA H 1 4.06 0.01 . 1 . . . . 24 PRO HA . 15034 1 264 . 1 1 24 24 PRO HB2 H 1 1.23 0.01 . 1 . . . . 24 PRO HB2 . 15034 1 265 . 1 1 24 24 PRO HB3 H 1 1.16 0.01 . 1 . . . . 24 PRO HB3 . 15034 1 266 . 1 1 24 24 PRO HG2 H 1 1.27 0.01 . 2 . . . . 24 PRO HG2 . 15034 1 267 . 1 1 24 24 PRO HG3 H 1 1.33 0.01 . 2 . . . . 24 PRO HG3 . 15034 1 268 . 1 1 24 24 PRO HD2 H 1 1.65 0.01 . 2 . . . . 24 PRO HD2 . 15034 1 269 . 1 1 24 24 PRO HD3 H 1 1.46 0.01 . 2 . . . . 24 PRO HD3 . 15034 1 270 . 1 1 24 24 PRO C C 13 174.12 0.1 . 1 . . . . 24 PRO C . 15034 1 271 . 1 1 24 24 PRO CA C 13 63.8 0.25 . 1 . . . . 24 PRO CA . 15034 1 272 . 1 1 24 24 PRO CB C 13 31.3 0.25 . 1 . . . . 24 PRO CB . 15034 1 273 . 1 1 24 24 PRO CG C 13 27.44 0.25 . 1 . . . . 24 PRO CG . 15034 1 274 . 1 1 24 24 PRO CD C 13 48.2 0.25 . 1 . . . . 24 PRO CD . 15034 1 275 . 1 1 25 25 THR H H 1 8.80 0.01 . 1 . . . . 25 THR H . 15034 1 276 . 1 1 25 25 THR HA H 1 4.65 0.01 . 1 . . . . 25 THR HA . 15034 1 277 . 1 1 25 25 THR HB H 1 3.86 0.01 . 1 . . . . 25 THR HB . 15034 1 278 . 1 1 25 25 THR HG21 H 1 1.19 0.01 . 1 . . . . 25 THR HG2 . 15034 1 279 . 1 1 25 25 THR HG22 H 1 1.19 0.01 . 1 . . . . 25 THR HG2 . 15034 1 280 . 1 1 25 25 THR HG23 H 1 1.19 0.01 . 1 . . . . 25 THR HG2 . 15034 1 281 . 1 1 25 25 THR C C 13 172.34 0.1 . 1 . . . . 25 THR C . 15034 1 282 . 1 1 25 25 THR CA C 13 61.85 0.25 . 1 . . . . 25 THR CA . 15034 1 283 . 1 1 25 25 THR CB C 13 72.58 0.25 . 1 . . . . 25 THR CB . 15034 1 284 . 1 1 25 25 THR CG2 C 13 20.52 0.25 . 1 . . . . 25 THR CG2 . 15034 1 285 . 1 1 25 25 THR N N 15 120.49 0.1 . 1 . . . . 25 THR N . 15034 1 286 . 1 1 26 26 ASP H H 1 9.01 0.01 . 1 . . . . 26 ASP H . 15034 1 287 . 1 1 26 26 ASP HA H 1 4.80 0.01 . 1 . . . . 26 ASP HA . 15034 1 288 . 1 1 26 26 ASP HB2 H 1 2.99 0.01 . 1 . . . . 26 ASP HB2 . 15034 1 289 . 1 1 26 26 ASP HB3 H 1 2.99 0.01 . 1 . . . . 26 ASP HB3 . 15034 1 290 . 1 1 26 26 ASP C C 13 177.87 0.1 . 1 . . . . 26 ASP C . 15034 1 291 . 1 1 26 26 ASP CA C 13 54.64 0.25 . 1 . . . . 26 ASP CA . 15034 1 292 . 1 1 26 26 ASP CB C 13 42.53 0.25 . 1 . . . . 26 ASP CB . 15034 1 293 . 1 1 26 26 ASP N N 15 126.97 0.1 . 1 . . . . 26 ASP N . 15034 1 294 . 1 1 27 27 THR H H 1 8.47 0.01 . 1 . . . . 27 THR H . 15034 1 295 . 1 1 27 27 THR HA H 1 4.05 0.01 . 1 . . . . 27 THR HA . 15034 1 296 . 1 1 27 27 THR HB H 1 4.05 0.01 . 1 . . . . 27 THR HB . 15034 1 297 . 1 1 27 27 THR HG21 H 1 1.01 0.01 . 1 . . . . 27 THR HG2 . 15034 1 298 . 1 1 27 27 THR HG22 H 1 1.01 0.01 . 1 . . . . 27 THR HG2 . 15034 1 299 . 1 1 27 27 THR HG23 H 1 1.01 0.01 . 1 . . . . 27 THR HG2 . 15034 1 300 . 1 1 27 27 THR C C 13 176.62 0.1 . 1 . . . . 27 THR C . 15034 1 301 . 1 1 27 27 THR CA C 13 62.67 0.25 . 1 . . . . 27 THR CA . 15034 1 302 . 1 1 27 27 THR CB C 13 71.4 0.25 . 1 . . . . 27 THR CB . 15034 1 303 . 1 1 27 27 THR CG2 C 13 21.92 0.25 . 1 . . . . 27 THR CG2 . 15034 1 304 . 1 1 27 27 THR N N 15 118.15 0.1 . 1 . . . . 27 THR N . 15034 1 305 . 1 1 28 28 GLY H H 1 9.16 0.01 . 1 . . . . 28 GLY H . 15034 1 306 . 1 1 28 28 GLY HA2 H 1 4.37 0.01 . 2 . . . . 28 GLY HA2 . 15034 1 307 . 1 1 28 28 GLY HA3 H 1 3.79 0.01 . 1 . . . . 28 GLY HA3 . 15034 1 308 . 1 1 28 28 GLY C C 13 174.43 0.1 . 1 . . . . 28 GLY C . 15034 1 309 . 1 1 28 28 GLY CA C 13 45.36 0.25 . 1 . . . . 28 GLY CA . 15034 1 310 . 1 1 28 28 GLY N N 15 111.00 0.1 . 1 . . . . 28 GLY N . 15034 1 311 . 1 1 29 29 HIS H H 1 7.52 0.01 . 1 . . . . 29 HIS H . 15034 1 312 . 1 1 29 29 HIS HA H 1 5.14 0.01 . 1 . . . . 29 HIS HA . 15034 1 313 . 1 1 29 29 HIS HB2 H 1 3.36 0.01 . 2 . . . . 29 HIS HB2 . 15034 1 314 . 1 1 29 29 HIS HB3 H 1 3.07 0.01 . 2 . . . . 29 HIS HB3 . 15034 1 315 . 1 1 29 29 HIS HD2 H 1 7.04 0.02 . 1 . . . . 29 HIS HD2 . 15034 1 316 . 1 1 29 29 HIS HE1 H 1 8.54 0.01 . 5 . . . . 29 HIS HE1 . 15034 1 317 . 1 1 29 29 HIS C C 13 175.32 0.1 . 1 . . . . 29 HIS C . 15034 1 318 . 1 1 29 29 HIS CA C 13 54.01 0.25 . 1 . . . . 29 HIS CA . 15034 1 319 . 1 1 29 29 HIS CB C 13 27.77 0.25 . 1 . . . . 29 HIS CB . 15034 1 320 . 1 1 29 29 HIS CD2 C 13 120.78 0.1 . 1 . . . . 29 HIS CD2 . 15034 1 321 . 1 1 29 29 HIS CE1 C 13 136.14 0.1 . 5 . . . . 29 HIS CE1 . 15034 1 322 . 1 1 29 29 HIS N N 15 115.64 0.1 . 1 . . . . 29 HIS N . 15034 1 323 . 1 1 30 30 GLY H H 1 9.22 0.01 . 1 . . . . 30 GLY H . 15034 1 324 . 1 1 30 30 GLY HA2 H 1 4.14 0.01 . 2 . . . . 30 GLY HA2 . 15034 1 325 . 1 1 30 30 GLY HA3 H 1 3.76 0.01 . 2 . . . . 30 GLY HA3 . 15034 1 326 . 1 1 30 30 GLY C C 13 173.90 0.1 . 1 . . . . 30 GLY C . 15034 1 327 . 1 1 30 30 GLY CA C 13 46.30 0.25 . 1 . . . . 30 GLY CA . 15034 1 328 . 1 1 30 30 GLY N N 15 110.03 0.1 . 1 . . . . 30 GLY N . 15034 1 329 . 1 1 31 31 THR H H 1 6.64 0.01 . 1 . . . . 31 THR H . 15034 1 330 . 1 1 31 31 THR HA H 1 4.80 0.01 . 1 . . . . 31 THR HA . 15034 1 331 . 1 1 31 31 THR HB H 1 4.18 0.01 . 1 . . . . 31 THR HB . 15034 1 332 . 1 1 31 31 THR HG21 H 1 0.97 0.01 . 1 . . . . 31 THR HG2 . 15034 1 333 . 1 1 31 31 THR HG22 H 1 0.97 0.01 . 1 . . . . 31 THR HG2 . 15034 1 334 . 1 1 31 31 THR HG23 H 1 0.97 0.01 . 1 . . . . 31 THR HG2 . 15034 1 335 . 1 1 31 31 THR C C 13 172.47 0.1 . 1 . . . . 31 THR C . 15034 1 336 . 1 1 31 31 THR CA C 13 58.83 0.25 . 1 . . . . 31 THR CA . 15034 1 337 . 1 1 31 31 THR CB C 13 71.26 0.25 . 1 . . . . 31 THR CB . 15034 1 338 . 1 1 31 31 THR CG2 C 13 22.50 0.25 . 1 . . . . 31 THR CG2 . 15034 1 339 . 1 1 31 31 THR N N 15 106.20 0.1 . 1 . . . . 31 THR N . 15034 1 340 . 1 1 32 32 VAL H H 1 8.84 0.01 . 1 . . . . 32 VAL H . 15034 1 341 . 1 1 32 32 VAL HA H 1 4.56 0.01 . 1 . . . . 32 VAL HA . 15034 1 342 . 1 1 32 32 VAL HB H 1 1.06 0.01 . 1 . . . . 32 VAL HB . 15034 1 343 . 1 1 32 32 VAL HG11 H 1 -0.30 0.01 . 1 . . . . 32 VAL HG1 . 15034 1 344 . 1 1 32 32 VAL HG12 H 1 -0.30 0.01 . 1 . . . . 32 VAL HG1 . 15034 1 345 . 1 1 32 32 VAL HG13 H 1 -0.30 0.01 . 1 . . . . 32 VAL HG1 . 15034 1 346 . 1 1 32 32 VAL HG21 H 1 -0.34 0.01 . 1 . . . . 32 VAL HG2 . 15034 1 347 . 1 1 32 32 VAL HG22 H 1 -0.34 0.01 . 1 . . . . 32 VAL HG2 . 15034 1 348 . 1 1 32 32 VAL HG23 H 1 -0.34 0.01 . 1 . . . . 32 VAL HG2 . 15034 1 349 . 1 1 32 32 VAL C C 13 174.24 0.1 . 1 . . . . 32 VAL C . 15034 1 350 . 1 1 32 32 VAL CA C 13 60.58 0.25 . 1 . . . . 32 VAL CA . 15034 1 351 . 1 1 32 32 VAL CB C 13 34.67 0.25 . 1 . . . . 32 VAL CB . 15034 1 352 . 1 1 32 32 VAL CG1 C 13 21.29 0.25 . 1 . . . . 32 VAL CG1 . 15034 1 353 . 1 1 32 32 VAL CG2 C 13 21.29 0.25 . 1 . . . . 32 VAL CG2 . 15034 1 354 . 1 1 32 32 VAL N N 15 120.15 0.1 . 1 . . . . 32 VAL N . 15034 1 355 . 1 1 33 33 VAL H H 1 8.77 0.01 . 1 . . . . 33 VAL H . 15034 1 356 . 1 1 33 33 VAL HA H 1 5.38 0.01 . 1 . . . . 33 VAL HA . 15034 1 357 . 1 1 33 33 VAL HB H 1 1.64 0.01 . 1 . . . . 33 VAL HB . 15034 1 358 . 1 1 33 33 VAL HG11 H 1 0.83 0.01 . 2 . . . . 33 VAL HG1 . 15034 1 359 . 1 1 33 33 VAL HG12 H 1 0.83 0.01 . 2 . . . . 33 VAL HG1 . 15034 1 360 . 1 1 33 33 VAL HG13 H 1 0.83 0.01 . 2 . . . . 33 VAL HG1 . 15034 1 361 . 1 1 33 33 VAL HG21 H 1 0.71 0.01 . 2 . . . . 33 VAL HG2 . 15034 1 362 . 1 1 33 33 VAL HG22 H 1 0.71 0.01 . 2 . . . . 33 VAL HG2 . 15034 1 363 . 1 1 33 33 VAL HG23 H 1 0.71 0.01 . 2 . . . . 33 VAL HG2 . 15034 1 364 . 1 1 33 33 VAL C C 13 173.37 0.1 . 1 . . . . 33 VAL C . 15034 1 365 . 1 1 33 33 VAL CA C 13 58.77 0.25 . 1 . . . . 33 VAL CA . 15034 1 366 . 1 1 33 33 VAL CB C 13 35.61 0.25 . 1 . . . . 33 VAL CB . 15034 1 367 . 1 1 33 33 VAL CG1 C 13 20.63 0.25 . 1 . . . . 33 VAL CG1 . 15034 1 368 . 1 1 33 33 VAL CG2 C 13 20.63 0.25 . 1 . . . . 33 VAL CG2 . 15034 1 369 . 1 1 33 33 VAL N N 15 123.72 0.1 . 1 . . . . 33 VAL N . 15034 1 370 . 1 1 34 34 MET H H 1 8.76 0.01 . 1 . . . . 34 MET H . 15034 1 371 . 1 1 34 34 MET HA H 1 4.39 0.01 . 1 . . . . 34 MET HA . 15034 1 372 . 1 1 34 34 MET HB2 H 1 2.21 0.01 . 1 . . . . 34 MET HB2 . 15034 1 373 . 1 1 34 34 MET HB3 H 1 2.21 0.01 . 1 . . . . 34 MET HB3 . 15034 1 374 . 1 1 34 34 MET HG2 H 1 2.67 0.01 . 1 . . . . 34 MET HG2 . 15034 1 375 . 1 1 34 34 MET HG3 H 1 2.22 0.01 . 1 . . . . 34 MET HG3 . 15034 1 376 . 1 1 34 34 MET C C 13 172.37 0.1 . 1 . . . . 34 MET C . 15034 1 377 . 1 1 34 34 MET CA C 13 53.89 0.25 . 1 . . . . 34 MET CA . 15034 1 378 . 1 1 34 34 MET CB C 13 36.62 0.25 . 1 . . . . 34 MET CB . 15034 1 379 . 1 1 34 34 MET CG C 13 29.95 0.25 . 1 . . . . 34 MET CG . 15034 1 380 . 1 1 34 34 MET N N 15 122.05 0.1 . 1 . . . . 34 MET N . 15034 1 381 . 1 1 35 35 GLN H H 1 8.74 0.01 . 1 . . . . 35 GLN H . 15034 1 382 . 1 1 35 35 GLN HA H 1 5.48 0.01 . 1 . . . . 35 GLN HA . 15034 1 383 . 1 1 35 35 GLN HB2 H 1 1.70 0.01 . 1 . . . . 35 GLN HB2 . 15034 1 384 . 1 1 35 35 GLN HB3 H 1 1.70 0.01 . 1 . . . . 35 GLN HB3 . 15034 1 385 . 1 1 35 35 GLN HG2 H 1 1.88 0.01 . 1 . . . . 35 GLN HG2 . 15034 1 386 . 1 1 35 35 GLN HG3 H 1 1.88 0.01 . 1 . . . . 35 GLN HG3 . 15034 1 387 . 1 1 35 35 GLN HE21 H 1 6.92 0.01 . 1 . . . . 35 GLN HE21 . 15034 1 388 . 1 1 35 35 GLN HE22 H 1 6.80 0.01 . 1 . . . . 35 GLN HE22 . 15034 1 389 . 1 1 35 35 GLN C C 13 175.24 0.1 . 1 . . . . 35 GLN C . 15034 1 390 . 1 1 35 35 GLN CA C 13 55.20 0.25 . 1 . . . . 35 GLN CA . 15034 1 391 . 1 1 35 35 GLN CB C 13 33.12 0.25 . 1 . . . . 35 GLN CB . 15034 1 392 . 1 1 35 35 GLN CG C 13 34.02 0.25 . 1 . . . . 35 GLN CG . 15034 1 393 . 1 1 35 35 GLN N N 15 120.37 0.1 . 1 . . . . 35 GLN N . 15034 1 394 . 1 1 35 35 GLN NE2 N 15 111.37 0.1 . 1 . . . . 35 GLN NE2 . 15034 1 395 . 1 1 36 36 VAL H H 1 9.11 0.01 . 1 . . . . 36 VAL H . 15034 1 396 . 1 1 36 36 VAL HA H 1 4.83 0.01 . 1 . . . . 36 VAL HA . 15034 1 397 . 1 1 36 36 VAL HB H 1 1.77 0.01 . 1 . . . . 36 VAL HB . 15034 1 398 . 1 1 36 36 VAL HG11 H 1 0.79 0.03 . 2 . . . . 36 VAL HG1 . 15034 1 399 . 1 1 36 36 VAL HG12 H 1 0.79 0.03 . 2 . . . . 36 VAL HG1 . 15034 1 400 . 1 1 36 36 VAL HG13 H 1 0.79 0.03 . 2 . . . . 36 VAL HG1 . 15034 1 401 . 1 1 36 36 VAL HG21 H 1 0.70 0.03 . 2 . . . . 36 VAL HG2 . 15034 1 402 . 1 1 36 36 VAL HG22 H 1 0.70 0.03 . 2 . . . . 36 VAL HG2 . 15034 1 403 . 1 1 36 36 VAL HG23 H 1 0.70 0.03 . 2 . . . . 36 VAL HG2 . 15034 1 404 . 1 1 36 36 VAL CA C 13 60.78 0.25 . 1 . . . . 36 VAL CA . 15034 1 405 . 1 1 36 36 VAL CB C 13 35.60 0.25 . 1 . . . . 36 VAL CB . 15034 1 406 . 1 1 36 36 VAL CG1 C 13 22.15 0.25 . 1 . . . . 36 VAL CG1 . 15034 1 407 . 1 1 36 36 VAL CG2 C 13 22.15 0.25 . 1 . . . . 36 VAL CG2 . 15034 1 408 . 1 1 36 36 VAL N N 15 128.63 0.1 . 1 . . . . 36 VAL N . 15034 1 409 . 1 1 37 37 LYS H H 1 9.32 0.01 . 1 . . . . 37 LYS H . 15034 1 410 . 1 1 37 37 LYS HA H 1 4.12 0.01 . 1 . . . . 37 LYS HA . 15034 1 411 . 1 1 37 37 LYS HB2 H 1 1.89 0.01 . 1 . . . . 37 LYS HB2 . 15034 1 412 . 1 1 37 37 LYS HB3 H 1 1.89 0.01 . 1 . . . . 37 LYS HB3 . 15034 1 413 . 1 1 37 37 LYS HG2 H 1 0.99 0.01 . 1 . . . . 37 LYS HG2 . 15034 1 414 . 1 1 37 37 LYS HG3 H 1 0.99 0.01 . 1 . . . . 37 LYS HG3 . 15034 1 415 . 1 1 37 37 LYS HD2 H 1 1.53 0.01 . 1 . . . . 37 LYS HD2 . 15034 1 416 . 1 1 37 37 LYS HD3 H 1 1.53 0.01 . 1 . . . . 37 LYS HD3 . 15034 1 417 . 1 1 37 37 LYS HE2 H 1 2.87 0.01 . 1 . . . . 37 LYS HE2 . 15034 1 418 . 1 1 37 37 LYS HE3 H 1 2.87 0.01 . 1 . . . . 37 LYS HE3 . 15034 1 419 . 1 1 37 37 LYS C C 13 175.20 0.1 . 1 . . . . 37 LYS C . 15034 1 420 . 1 1 37 37 LYS CA C 13 54.94 0.25 . 1 . . . . 37 LYS CA . 15034 1 421 . 1 1 37 37 LYS CB C 13 35.61 0.25 . 1 . . . . 37 LYS CB . 15034 1 422 . 1 1 37 37 LYS CG C 13 24.9 0.25 . 1 . . . . 37 LYS CG . 15034 1 423 . 1 1 37 37 LYS CD C 13 29.91 0.25 . 1 . . . . 37 LYS CD . 15034 1 424 . 1 1 37 37 LYS CE C 13 41.96 0.25 . 1 . . . . 37 LYS CE . 15034 1 425 . 1 1 37 37 LYS N N 15 128.97 0.1 . 1 . . . . 37 LYS N . 15034 1 426 . 1 1 38 38 VAL H H 1 7.99 0.01 . 1 . . . . 38 VAL H . 15034 1 427 . 1 1 38 38 VAL HA H 1 4.52 0.01 . 1 . . . . 38 VAL HA . 15034 1 428 . 1 1 38 38 VAL HB H 1 1.97 0.01 . 1 . . . . 38 VAL HB . 15034 1 429 . 1 1 38 38 VAL HG11 H 1 1.10 0.01 . 2 . . . . 38 VAL HG1 . 15034 1 430 . 1 1 38 38 VAL HG12 H 1 1.10 0.01 . 2 . . . . 38 VAL HG1 . 15034 1 431 . 1 1 38 38 VAL HG13 H 1 1.10 0.01 . 2 . . . . 38 VAL HG1 . 15034 1 432 . 1 1 38 38 VAL HG21 H 1 1.10 0.01 . 2 . . . . 38 VAL HG2 . 15034 1 433 . 1 1 38 38 VAL HG22 H 1 1.10 0.01 . 2 . . . . 38 VAL HG2 . 15034 1 434 . 1 1 38 38 VAL HG23 H 1 1.10 0.01 . 2 . . . . 38 VAL HG2 . 15034 1 435 . 1 1 38 38 VAL CA C 13 59.36 0.25 . 1 . . . . 38 VAL CA . 15034 1 436 . 1 1 38 38 VAL CB C 13 35.43 0.25 . 1 . . . . 38 VAL CB . 15034 1 437 . 1 1 38 38 VAL N N 15 126.14 0.1 . 1 . . . . 38 VAL N . 15034 1 438 . 1 1 39 39 PRO HA H 1 4.54 0.01 . 1 . . . . 39 PRO HA . 15034 1 439 . 1 1 39 39 PRO HB2 H 1 2.27 0.01 . 2 . . . . 39 PRO HB2 . 15034 1 440 . 1 1 39 39 PRO HB3 H 1 1.98 0.01 . 2 . . . . 39 PRO HB3 . 15034 1 441 . 1 1 39 39 PRO HG2 H 1 1.87 0.01 . 1 . . . . 39 PRO HG2 . 15034 1 442 . 1 1 39 39 PRO HG3 H 1 1.87 0.01 . 1 . . . . 39 PRO HG3 . 15034 1 443 . 1 1 39 39 PRO HD2 H 1 3.92 0.01 . 2 . . . . 39 PRO HD2 . 15034 1 444 . 1 1 39 39 PRO HD3 H 1 3.74 0.01 . 2 . . . . 39 PRO HD3 . 15034 1 445 . 1 1 39 39 PRO C C 13 175.66 0.1 . 1 . . . . 39 PRO C . 15034 1 446 . 1 1 39 39 PRO CA C 13 64.55 0.25 . 1 . . . . 39 PRO CA . 15034 1 447 . 1 1 39 39 PRO CB C 13 33.32 0.25 . 1 . . . . 39 PRO CB . 15034 1 448 . 1 1 39 39 PRO CG C 13 27.40 0.25 . 1 . . . . 39 PRO CG . 15034 1 449 . 1 1 39 39 PRO CD C 13 51.36 0.25 . 1 . . . . 39 PRO CD . 15034 1 450 . 1 1 40 40 LYS H H 1 7.35 0.01 . 1 . . . . 40 LYS H . 15034 1 451 . 1 1 40 40 LYS HA H 1 4.40 0.01 . 1 . . . . 40 LYS HA . 15034 1 452 . 1 1 40 40 LYS HB2 H 1 1.61 0.01 . 2 . . . . 40 LYS HB2 . 15034 1 453 . 1 1 40 40 LYS HB3 H 1 1.53 0.01 . 2 . . . . 40 LYS HB3 . 15034 1 454 . 1 1 40 40 LYS HG2 H 1 1.28 0.01 . 1 . . . . 40 LYS HG2 . 15034 1 455 . 1 1 40 40 LYS HG3 H 1 1.28 0.01 . 1 . . . . 40 LYS HG3 . 15034 1 456 . 1 1 40 40 LYS HD2 H 1 1.61 0.01 . 1 . . . . 40 LYS HD2 . 15034 1 457 . 1 1 40 40 LYS HD3 H 1 1.61 0.01 . 1 . . . . 40 LYS HD3 . 15034 1 458 . 1 1 40 40 LYS HE2 H 1 2.92 0.01 . 1 . . . . 40 LYS HE2 . 15034 1 459 . 1 1 40 40 LYS HE3 H 1 2.92 0.01 . 1 . . . . 40 LYS HE3 . 15034 1 460 . 1 1 40 40 LYS C C 13 174.84 0.1 . 1 . . . . 40 LYS C . 15034 1 461 . 1 1 40 40 LYS CA C 13 55.09 0.25 . 1 . . . . 40 LYS CA . 15034 1 462 . 1 1 40 40 LYS CB C 13 37.10 0.25 . 1 . . . . 40 LYS CB . 15034 1 463 . 1 1 40 40 LYS CG C 13 24.7 0.25 . 1 . . . . 40 LYS CG . 15034 1 464 . 1 1 40 40 LYS CD C 13 29.3 0.25 . 1 . . . . 40 LYS CD . 15034 1 465 . 1 1 40 40 LYS CE C 13 42.2 0.25 . 1 . . . . 40 LYS CE . 15034 1 466 . 1 1 40 40 LYS N N 15 116.08 0.1 . 1 . . . . 40 LYS N . 15034 1 467 . 1 1 41 41 GLY H H 1 8.24 0.01 . 1 . . . . 41 GLY H . 15034 1 468 . 1 1 41 41 GLY HA2 H 1 4.21 0.01 . 2 . . . . 41 GLY HA2 . 15034 1 469 . 1 1 41 41 GLY HA3 H 1 3.53 0.01 . 2 . . . . 41 GLY HA3 . 15034 1 470 . 1 1 41 41 GLY C C 13 174.04 0.1 . 1 . . . . 41 GLY C . 15034 1 471 . 1 1 41 41 GLY CA C 13 45.36 0.25 . 1 . . . . 41 GLY CA . 15034 1 472 . 1 1 41 41 GLY N N 15 108.36 0.1 . 1 . . . . 41 GLY N . 15034 1 473 . 1 1 42 42 ALA H H 1 8.21 0.01 . 1 . . . . 42 ALA H . 15034 1 474 . 1 1 42 42 ALA HA H 1 4.01 0.01 . 1 . . . . 42 ALA HA . 15034 1 475 . 1 1 42 42 ALA HB1 H 1 0.85 0.03 . 1 . . . . 42 ALA HB . 15034 1 476 . 1 1 42 42 ALA HB2 H 1 0.85 0.03 . 1 . . . . 42 ALA HB . 15034 1 477 . 1 1 42 42 ALA HB3 H 1 0.85 0.03 . 1 . . . . 42 ALA HB . 15034 1 478 . 1 1 42 42 ALA CA C 13 50.98 0.25 . 1 . . . . 42 ALA CA . 15034 1 479 . 1 1 42 42 ALA CB C 13 17.09 0.25 . 1 . . . . 42 ALA CB . 15034 1 480 . 1 1 42 42 ALA N N 15 123.59 0.1 . 1 . . . . 42 ALA N . 15034 1 481 . 1 1 43 43 PRO HA H 1 5.10 0.01 . 1 . . . . 43 PRO HA . 15034 1 482 . 1 1 43 43 PRO HB2 H 1 2.33 0.01 . 2 . . . . 43 PRO HB2 . 15034 1 483 . 1 1 43 43 PRO HB3 H 1 1.61 0.01 . 2 . . . . 43 PRO HB3 . 15034 1 484 . 1 1 43 43 PRO HG2 H 1 1.95 0.01 . 1 . . . . 43 PRO HG2 . 15034 1 485 . 1 1 43 43 PRO HG3 H 1 1.95 0.01 . 1 . . . . 43 PRO HG3 . 15034 1 486 . 1 1 43 43 PRO HD2 H 1 3.57 0.01 . 2 . . . . 43 PRO HD2 . 15034 1 487 . 1 1 43 43 PRO HD3 H 1 3.41 0.01 . 2 . . . . 43 PRO HD3 . 15034 1 488 . 1 1 43 43 PRO C C 13 176.10 0.1 . 1 . . . . 43 PRO C . 15034 1 489 . 1 1 43 43 PRO CA C 13 61.13 0.25 . 1 . . . . 43 PRO CA . 15034 1 490 . 1 1 43 43 PRO CB C 13 34.06 0.25 . 1 . . . . 43 PRO CB . 15034 1 491 . 1 1 43 43 PRO CG C 13 25.0 0.25 . 1 . . . . 43 PRO CG . 15034 1 492 . 1 1 43 43 PRO CD C 13 50.91 0.25 . 1 . . . . 43 PRO CD . 15034 1 493 . 1 1 44 44 CYS H H 1 8.79 0.01 . 1 . . . . 44 CYS H . 15034 1 494 . 1 1 44 44 CYS HA H 1 5.09 0.01 . 1 . . . . 44 CYS HA . 15034 1 495 . 1 1 44 44 CYS HB2 H 1 3.47 0.01 . 2 . . . . 44 CYS HB2 . 15034 1 496 . 1 1 44 44 CYS HB3 H 1 2.97 0.01 . 2 . . . . 44 CYS HB3 . 15034 1 497 . 1 1 44 44 CYS C C 13 170.71 0.1 . 1 . . . . 44 CYS C . 15034 1 498 . 1 1 44 44 CYS CA C 13 55.00 0.25 . 1 . . . . 44 CYS CA . 15034 1 499 . 1 1 44 44 CYS CB C 13 43.81 0.25 . 1 . . . . 44 CYS CB . 15034 1 500 . 1 1 44 44 CYS N N 15 118.36 0.1 . 1 . . . . 44 CYS N . 15034 1 501 . 1 1 45 45 LYS H H 1 9.24 0.01 . 1 . . . . 45 LYS H . 15034 1 502 . 1 1 45 45 LYS HA H 1 4.69 0.01 . 1 . . . . 45 LYS HA . 15034 1 503 . 1 1 45 45 LYS HB2 H 1 1.84 0.01 . 2 . . . . 45 LYS HB2 . 15034 1 504 . 1 1 45 45 LYS HB3 H 1 1.46 0.01 . 2 . . . . 45 LYS HB3 . 15034 1 505 . 1 1 45 45 LYS HG2 H 1 1.15 0.01 . 1 . . . . 45 LYS HG2 . 15034 1 506 . 1 1 45 45 LYS HG3 H 1 1.15 0.01 . 1 . . . . 45 LYS HG3 . 15034 1 507 . 1 1 45 45 LYS HD2 H 1 1.60 0.01 . 1 . . . . 45 LYS HD2 . 15034 1 508 . 1 1 45 45 LYS HD3 H 1 1.60 0.01 . 1 . . . . 45 LYS HD3 . 15034 1 509 . 1 1 45 45 LYS HE2 H 1 2.92 0.01 . 1 . . . . 45 LYS HE2 . 15034 1 510 . 1 1 45 45 LYS HE3 H 1 2.92 0.01 . 1 . . . . 45 LYS HE3 . 15034 1 511 . 1 1 45 45 LYS C C 13 175.15 0.1 . 1 . . . . 45 LYS C . 15034 1 512 . 1 1 45 45 LYS CA C 13 54.96 0.25 . 1 . . . . 45 LYS CA . 15034 1 513 . 1 1 45 45 LYS CB C 13 34.67 0.25 . 1 . . . . 45 LYS CB . 15034 1 514 . 1 1 45 45 LYS CG C 13 24.93 0.25 . 1 . . . . 45 LYS CG . 15034 1 515 . 1 1 45 45 LYS CD C 13 29.68 0.25 . 1 . . . . 45 LYS CD . 15034 1 516 . 1 1 45 45 LYS CE C 13 42.36 0.25 . 1 . . . . 45 LYS CE . 15034 1 517 . 1 1 45 45 LYS N N 15 122.02 0.1 . 1 . . . . 45 LYS N . 15034 1 518 . 1 1 46 46 ILE H H 1 8.62 0.01 . 1 . . . . 46 ILE H . 15034 1 519 . 1 1 46 46 ILE HA H 1 4.56 0.01 . 1 . . . . 46 ILE HA . 15034 1 520 . 1 1 46 46 ILE HG12 H 1 1.62 0.01 . 2 . . . . 46 ILE HG1 . 15034 1 521 . 1 1 46 46 ILE HG13 H 1 1.17 0.01 . 2 . . . . 46 ILE HG1 . 15034 1 522 . 1 1 46 46 ILE HG21 H 1 0.80 0.01 . 1 . . . . 46 ILE HG2 . 15034 1 523 . 1 1 46 46 ILE HG22 H 1 0.80 0.01 . 1 . . . . 46 ILE HG2 . 15034 1 524 . 1 1 46 46 ILE HG23 H 1 0.80 0.01 . 1 . . . . 46 ILE HG2 . 15034 1 525 . 1 1 46 46 ILE HD11 H 1 0.64 0.01 . 1 . . . . 46 ILE HD1 . 15034 1 526 . 1 1 46 46 ILE HD12 H 1 0.64 0.01 . 1 . . . . 46 ILE HD1 . 15034 1 527 . 1 1 46 46 ILE HD13 H 1 0.64 0.01 . 1 . . . . 46 ILE HD1 . 15034 1 528 . 1 1 46 46 ILE CA C 13 60.58 0.25 . 1 . . . . 46 ILE CA . 15034 1 529 . 1 1 46 46 ILE CB C 13 40.07 0.25 . 1 . . . . 46 ILE CB . 15034 1 530 . 1 1 46 46 ILE N N 15 131.22 0.01 . 1 . . . . 46 ILE N . 15034 1 531 . 1 1 47 47 PRO HA H 1 4.57 0.01 . 1 . . . . 47 PRO HA . 15034 1 532 . 1 1 47 47 PRO HB2 H 1 2.21 0.01 . 2 . . . . 47 PRO HB2 . 15034 1 533 . 1 1 47 47 PRO HB3 H 1 1.87 0.01 . 2 . . . . 47 PRO HB3 . 15034 1 534 . 1 1 47 47 PRO HG2 H 1 2.06 0.01 . 2 . . . . 47 PRO HG2 . 15034 1 535 . 1 1 47 47 PRO HG3 H 1 2.02 0.01 . 2 . . . . 47 PRO HG3 . 15034 1 536 . 1 1 47 47 PRO HD2 H 1 3.42 0.01 . 1 . . . . 47 PRO HD2 . 15034 1 537 . 1 1 47 47 PRO HD3 H 1 3.42 0.01 . 1 . . . . 47 PRO HD3 . 15034 1 538 . 1 1 47 47 PRO C C 13 175.91 0.1 . 1 . . . . 47 PRO C . 15034 1 539 . 1 1 47 47 PRO CA C 13 62.5 0.25 . 1 . . . . 47 PRO CA . 15034 1 540 . 1 1 47 47 PRO CB C 13 31.1 0.25 . 1 . . . . 47 PRO CB . 15034 1 541 . 1 1 47 47 PRO CG C 13 27.9 0.25 . 1 . . . . 47 PRO CG . 15034 1 542 . 1 1 47 47 PRO CD C 13 51.4 0.25 . 1 . . . . 47 PRO CD . 15034 1 543 . 1 1 48 48 VAL H H 1 7.77 0.01 . 1 . . . . 48 VAL H . 15034 1 544 . 1 1 48 48 VAL HA H 1 5.06 0.01 . 1 . . . . 48 VAL HA . 15034 1 545 . 1 1 48 48 VAL HB H 1 1.89 0.01 . 1 . . . . 48 VAL HB . 15034 1 546 . 1 1 48 48 VAL HG11 H 1 0.85 0.01 . 2 . . . . 48 VAL HG1 . 15034 1 547 . 1 1 48 48 VAL HG12 H 1 0.85 0.01 . 2 . . . . 48 VAL HG1 . 15034 1 548 . 1 1 48 48 VAL HG13 H 1 0.85 0.01 . 2 . . . . 48 VAL HG1 . 15034 1 549 . 1 1 48 48 VAL HG21 H 1 0.70 0.01 . 2 . . . . 48 VAL HG2 . 15034 1 550 . 1 1 48 48 VAL HG22 H 1 0.70 0.01 . 2 . . . . 48 VAL HG2 . 15034 1 551 . 1 1 48 48 VAL HG23 H 1 0.70 0.01 . 2 . . . . 48 VAL HG2 . 15034 1 552 . 1 1 48 48 VAL C C 13 174.23 0.1 . 1 . . . . 48 VAL C . 15034 1 553 . 1 1 48 48 VAL CA C 13 61.14 0.25 . 1 . . . . 48 VAL CA . 15034 1 554 . 1 1 48 48 VAL CB C 13 35.00 0.25 . 1 . . . . 48 VAL CB . 15034 1 555 . 1 1 48 48 VAL CG1 C 13 21.90 0.25 . 2 . . . . 48 VAL CG1 . 15034 1 556 . 1 1 48 48 VAL CG2 C 13 20.30 0.25 . 2 . . . . 48 VAL CG2 . 15034 1 557 . 1 1 48 48 VAL N N 15 123.74 0.1 . 1 . . . . 48 VAL N . 15034 1 558 . 1 1 49 49 ILE H H 1 8.83 0.01 . 1 . . . . 49 ILE H . 15034 1 559 . 1 1 49 49 ILE HA H 1 4.38 0.01 . 1 . . . . 49 ILE HA . 15034 1 560 . 1 1 49 49 ILE HB H 1 1.61 0.01 . 1 . . . . 49 ILE HB . 15034 1 561 . 1 1 49 49 ILE HG12 H 1 1.29 0.01 . 2 . . . . 49 ILE HG12 . 15034 1 562 . 1 1 49 49 ILE HG13 H 1 1.05 0.01 . 2 . . . . 49 ILE HG13 . 15034 1 563 . 1 1 49 49 ILE HG21 H 1 0.88 0.01 . 1 . . . . 49 ILE HG2 . 15034 1 564 . 1 1 49 49 ILE HG22 H 1 0.88 0.01 . 1 . . . . 49 ILE HG2 . 15034 1 565 . 1 1 49 49 ILE HG23 H 1 0.88 0.01 . 1 . . . . 49 ILE HG2 . 15034 1 566 . 1 1 49 49 ILE HD11 H 1 0.72 0.01 . 1 . . . . 49 ILE HD1 . 15034 1 567 . 1 1 49 49 ILE HD12 H 1 0.72 0.01 . 1 . . . . 49 ILE HD1 . 15034 1 568 . 1 1 49 49 ILE HD13 H 1 0.72 0.01 . 1 . . . . 49 ILE HD1 . 15034 1 569 . 1 1 49 49 ILE C C 13 173.53 0.1 . 1 . . . . 49 ILE C . 15034 1 570 . 1 1 49 49 ILE CA C 13 59.73 0.25 . 1 . . . . 49 ILE CA . 15034 1 571 . 1 1 49 49 ILE CB C 13 43.82 0.25 . 1 . . . . 49 ILE CB . 15034 1 572 . 1 1 49 49 ILE CG1 C 13 26.49 0.25 . 1 . . . . 49 ILE CG1 . 15034 1 573 . 1 1 49 49 ILE CG2 C 13 18.08 0.25 . 1 . . . . 49 ILE CG2 . 15034 1 574 . 1 1 49 49 ILE CD1 C 13 14.35 0.25 . 1 . . . . 49 ILE CD1 . 15034 1 575 . 1 1 49 49 ILE N N 15 122.62 0.1 . 1 . . . . 49 ILE N . 15034 1 576 . 1 1 50 50 VAL H H 1 8.38 0.01 . 1 . . . . 50 VAL H . 15034 1 577 . 1 1 50 50 VAL HA H 1 5.15 0.01 . 1 . . . . 50 VAL HA . 15034 1 578 . 1 1 50 50 VAL HB H 1 1.75 0.01 . 1 . . . . 50 VAL HB . 15034 1 579 . 1 1 50 50 VAL HG11 H 1 0.83 0.01 . 2 . . . . 50 VAL HG1 . 15034 1 580 . 1 1 50 50 VAL HG12 H 1 0.83 0.01 . 2 . . . . 50 VAL HG1 . 15034 1 581 . 1 1 50 50 VAL HG13 H 1 0.83 0.01 . 2 . . . . 50 VAL HG1 . 15034 1 582 . 1 1 50 50 VAL HG21 H 1 0.69 0.01 . 2 . . . . 50 VAL HG2 . 15034 1 583 . 1 1 50 50 VAL HG22 H 1 0.69 0.01 . 2 . . . . 50 VAL HG2 . 15034 1 584 . 1 1 50 50 VAL HG23 H 1 0.69 0.01 . 2 . . . . 50 VAL HG2 . 15034 1 585 . 1 1 50 50 VAL C C 13 174.17 0.1 . 1 . . . . 50 VAL C . 15034 1 586 . 1 1 50 50 VAL CA C 13 61.28 0.25 . 1 . . . . 50 VAL CA . 15034 1 587 . 1 1 50 50 VAL CB C 13 32.81 0.25 . 1 . . . . 50 VAL CB . 15034 1 588 . 1 1 50 50 VAL CG1 C 13 22.84 0.25 . 2 . . . . 50 VAL CG1 . 15034 1 589 . 1 1 50 50 VAL CG2 C 13 21.06 0.25 . 2 . . . . 50 VAL CG2 . 15034 1 590 . 1 1 50 50 VAL N N 15 122.27 0.1 . 1 . . . . 50 VAL N . 15034 1 591 . 1 1 51 51 ALA H H 1 9.26 0.01 . 1 . . . . 51 ALA H . 15034 1 592 . 1 1 51 51 ALA HA H 1 5.20 0.01 . 1 . . . . 51 ALA HA . 15034 1 593 . 1 1 51 51 ALA HB1 H 1 1.52 0.01 . 1 . . . . 51 ALA HB . 15034 1 594 . 1 1 51 51 ALA HB2 H 1 1.52 0.01 . 1 . . . . 51 ALA HB . 15034 1 595 . 1 1 51 51 ALA HB3 H 1 1.52 0.01 . 1 . . . . 51 ALA HB . 15034 1 596 . 1 1 51 51 ALA C C 13 176.87 0.1 . 1 . . . . 51 ALA C . 15034 1 597 . 1 1 51 51 ALA CA C 13 50.59 0.25 . 1 . . . . 51 ALA CA . 15034 1 598 . 1 1 51 51 ALA CB C 13 24.35 0.25 . 1 . . . . 51 ALA CB . 15034 1 599 . 1 1 51 51 ALA N N 15 130.02 0.1 . 1 . . . . 51 ALA N . 15034 1 600 . 1 1 52 52 ASP H H 1 9.18 0.01 . 1 . . . . 52 ASP H . 15034 1 601 . 1 1 52 52 ASP HA H 1 4.74 0.01 . 1 . . . . 52 ASP HA . 15034 1 602 . 1 1 52 52 ASP HB2 H 1 2.94 0.01 . 2 . . . . 52 ASP HB2 . 15034 1 603 . 1 1 52 52 ASP HB3 H 1 2.61 0.01 . 2 . . . . 52 ASP HB3 . 15034 1 604 . 1 1 52 52 ASP C C 13 175.74 0.1 . 1 . . . . 52 ASP C . 15034 1 605 . 1 1 52 52 ASP CA C 13 55.11 0.25 . 1 . . . . 52 ASP CA . 15034 1 606 . 1 1 52 52 ASP CB C 13 41.61 0.25 . 1 . . . . 52 ASP CB . 15034 1 607 . 1 1 52 52 ASP N N 15 118.40 0.1 . 1 . . . . 52 ASP N . 15034 1 608 . 1 1 53 53 ASP H H 1 7.54 0.01 . 1 . . . . 53 ASP H . 15034 1 609 . 1 1 53 53 ASP HA H 1 4.73 0.01 . 1 . . . . 53 ASP HA . 15034 1 610 . 1 1 53 53 ASP HB2 H 1 2.80 0.01 . 2 . . . . 53 ASP HB2 . 15034 1 611 . 1 1 53 53 ASP HB3 H 1 2.75 0.01 . 2 . . . . 53 ASP HB3 . 15034 1 612 . 1 1 53 53 ASP C C 13 175.30 0.1 . 1 . . . . 53 ASP C . 15034 1 613 . 1 1 53 53 ASP CA C 13 53.39 0.25 . 1 . . . . 53 ASP CA . 15034 1 614 . 1 1 53 53 ASP CB C 13 43.53 0.25 . 1 . . . . 53 ASP CB . 15034 1 615 . 1 1 53 53 ASP N N 15 117.38 0.1 . 1 . . . . 53 ASP N . 15034 1 616 . 1 1 54 54 LEU H H 1 8.21 0.01 . 1 . . . . 54 LEU H . 15034 1 617 . 1 1 54 54 LEU HA H 1 3.78 0.01 . 1 . . . . 54 LEU HA . 15034 1 618 . 1 1 54 54 LEU HB2 H 1 1.29 0.01 . 2 . . . . 54 LEU HB2 . 15034 1 619 . 1 1 54 54 LEU HB3 H 1 1.23 0.01 . 2 . . . . 54 LEU HB3 . 15034 1 620 . 1 1 54 54 LEU HG H 1 0.52 0.01 . 1 . . . . 54 LEU HG . 15034 1 621 . 1 1 54 54 LEU HD11 H 1 0.65 0.01 . 2 . . . . 54 LEU HD1 . 15034 1 622 . 1 1 54 54 LEU HD12 H 1 0.65 0.01 . 2 . . . . 54 LEU HD1 . 15034 1 623 . 1 1 54 54 LEU HD13 H 1 0.65 0.01 . 2 . . . . 54 LEU HD1 . 15034 1 624 . 1 1 54 54 LEU HD21 H 1 0.36 0.01 . 2 . . . . 54 LEU HD2 . 15034 1 625 . 1 1 54 54 LEU HD22 H 1 0.36 0.01 . 2 . . . . 54 LEU HD2 . 15034 1 626 . 1 1 54 54 LEU HD23 H 1 0.36 0.01 . 2 . . . . 54 LEU HD2 . 15034 1 627 . 1 1 54 54 LEU C C 13 177.94 0.1 . 1 . . . . 54 LEU C . 15034 1 628 . 1 1 54 54 LEU CA C 13 56.35 0.25 . 1 . . . . 54 LEU CA . 15034 1 629 . 1 1 54 54 LEU CB C 13 42.11 0.25 . 1 . . . . 54 LEU CB . 15034 1 630 . 1 1 54 54 LEU CG C 13 24.9 0.25 . 1 . . . . 54 LEU CG . 15034 1 631 . 1 1 54 54 LEU CD1 C 13 26.70 0.25 . 2 . . . . 54 LEU CD1 . 15034 1 632 . 1 1 54 54 LEU CD2 C 13 23.50 0.25 . 2 . . . . 54 LEU CD2 . 15034 1 633 . 1 1 54 54 LEU N N 15 120.60 0.1 . 1 . . . . 54 LEU N . 15034 1 634 . 1 1 55 55 THR H H 1 8.35 0.01 . 1 . . . . 55 THR H . 15034 1 635 . 1 1 55 55 THR HA H 1 4.15 0.01 . 1 . . . . 55 THR HA . 15034 1 636 . 1 1 55 55 THR HB H 1 4.19 0.01 . 1 . . . . 55 THR HB . 15034 1 637 . 1 1 55 55 THR HG21 H 1 1.12 0.01 . 1 . . . . 55 THR HG2 . 15034 1 638 . 1 1 55 55 THR HG22 H 1 1.12 0.01 . 1 . . . . 55 THR HG2 . 15034 1 639 . 1 1 55 55 THR HG23 H 1 1.12 0.01 . 1 . . . . 55 THR HG2 . 15034 1 640 . 1 1 55 55 THR C C 13 175.18 0.1 . 1 . . . . 55 THR C . 15034 1 641 . 1 1 55 55 THR CA C 13 63.74 0.25 . 1 . . . . 55 THR CA . 15034 1 642 . 1 1 55 55 THR CB C 13 69.00 0.25 . 1 . . . . 55 THR CB . 15034 1 643 . 1 1 55 55 THR CG2 C 13 21.70 0.25 . 1 . . . . 55 THR CG2 . 15034 1 644 . 1 1 55 55 THR N N 15 113.53 0.1 . 1 . . . . 55 THR N . 15034 1 645 . 1 1 56 56 ALA H H 1 8.01 0.01 . 1 . . . . 56 ALA H . 15034 1 646 . 1 1 56 56 ALA HA H 1 4.16 0.01 . 1 . . . . 56 ALA HA . 15034 1 647 . 1 1 56 56 ALA HB1 H 1 1.38 0.01 . 1 . . . . 56 ALA HB . 15034 1 648 . 1 1 56 56 ALA HB2 H 1 1.38 0.01 . 1 . . . . 56 ALA HB . 15034 1 649 . 1 1 56 56 ALA HB3 H 1 1.38 0.01 . 1 . . . . 56 ALA HB . 15034 1 650 . 1 1 56 56 ALA C C 13 176.93 0.1 . 1 . . . . 56 ALA C . 15034 1 651 . 1 1 56 56 ALA CA C 13 52.97 0.25 . 1 . . . . 56 ALA CA . 15034 1 652 . 1 1 56 56 ALA CB C 13 19.43 0.25 . 1 . . . . 56 ALA CB . 15034 1 653 . 1 1 56 56 ALA N N 15 126.14 0.1 . 1 . . . . 56 ALA N . 15034 1 654 . 1 1 57 57 ALA H H 1 8.34 0.01 . 1 . . . . 57 ALA H . 15034 1 655 . 1 1 57 57 ALA HA H 1 4.07 0.01 . 1 . . . . 57 ALA HA . 15034 1 656 . 1 1 57 57 ALA HB1 H 1 1.24 0.01 . 1 . . . . 57 ALA HB . 15034 1 657 . 1 1 57 57 ALA HB2 H 1 1.24 0.01 . 1 . . . . 57 ALA HB . 15034 1 658 . 1 1 57 57 ALA HB3 H 1 1.24 0.01 . 1 . . . . 57 ALA HB . 15034 1 659 . 1 1 57 57 ALA C C 13 176.02 0.1 . 1 . . . . 57 ALA C . 15034 1 660 . 1 1 57 57 ALA CA C 13 52.84 0.25 . 1 . . . . 57 ALA CA . 15034 1 661 . 1 1 57 57 ALA CB C 13 18.49 0.25 . 1 . . . . 57 ALA CB . 15034 1 662 . 1 1 57 57 ALA N N 15 121.23 0.1 . 1 . . . . 57 ALA N . 15034 1 663 . 1 1 58 58 ILE H H 1 7.41 0.01 . 1 . . . . 58 ILE H . 15034 1 664 . 1 1 58 58 ILE HA H 1 4.23 0.01 . 1 . . . . 58 ILE HA . 15034 1 665 . 1 1 58 58 ILE HB H 1 1.75 0.01 . 1 . . . . 58 ILE HB . 15034 1 666 . 1 1 58 58 ILE HG12 H 1 1.46 0.01 . 2 . . . . 58 ILE HG12 . 15034 1 667 . 1 1 58 58 ILE HG13 H 1 1.15 0.01 . 2 . . . . 58 ILE HG13 . 15034 1 668 . 1 1 58 58 ILE HG21 H 1 0.87 0.01 . 1 . . . . 58 ILE HG2 . 15034 1 669 . 1 1 58 58 ILE HG22 H 1 0.87 0.01 . 1 . . . . 58 ILE HG2 . 15034 1 670 . 1 1 58 58 ILE HG23 H 1 0.87 0.01 . 1 . . . . 58 ILE HG2 . 15034 1 671 . 1 1 58 58 ILE HD11 H 1 0.85 0.01 . 1 . . . . 58 ILE HD1 . 15034 1 672 . 1 1 58 58 ILE HD12 H 1 0.85 0.01 . 1 . . . . 58 ILE HD1 . 15034 1 673 . 1 1 58 58 ILE HD13 H 1 0.85 0.01 . 1 . . . . 58 ILE HD1 . 15034 1 674 . 1 1 58 58 ILE C C 13 175.99 0.1 . 1 . . . . 58 ILE C . 15034 1 675 . 1 1 58 58 ILE CA C 13 59.86 0.25 . 1 . . . . 58 ILE CA . 15034 1 676 . 1 1 58 58 ILE CB C 13 40.21 0.25 . 1 . . . . 58 ILE CB . 15034 1 677 . 1 1 58 58 ILE CG1 C 13 27.21 0.25 . 1 . . . . 58 ILE CG1 . 15034 1 678 . 1 1 58 58 ILE CG2 C 13 17.20 0.25 . 1 . . . . 58 ILE CG2 . 15034 1 679 . 1 1 58 58 ILE CD1 C 13 12.41 0.25 . 1 . . . . 58 ILE CD1 . 15034 1 680 . 1 1 58 58 ILE N N 15 119.27 0.1 . 1 . . . . 58 ILE N . 15034 1 681 . 1 1 59 59 ASN H H 1 8.99 0.01 . 1 . . . . 59 ASN H . 15034 1 682 . 1 1 59 59 ASN HA H 1 4.60 0.01 . 1 . . . . 59 ASN HA . 15034 1 683 . 1 1 59 59 ASN HB2 H 1 2.99 0.01 . 2 . . . . 59 ASN HB2 . 15034 1 684 . 1 1 59 59 ASN HB3 H 1 2.73 0.01 . 2 . . . . 59 ASN HB3 . 15034 1 685 . 1 1 59 59 ASN HD21 H 1 8.00 0.01 . 1 . . . . 59 ASN HD21 . 15034 1 686 . 1 1 59 59 ASN HD22 H 1 6.71 0.01 . 1 . . . . 59 ASN HD22 . 15034 1 687 . 1 1 59 59 ASN C C 13 175.19 0.1 . 1 . . . . 59 ASN C . 15034 1 688 . 1 1 59 59 ASN CA C 13 54.96 0.25 . 1 . . . . 59 ASN CA . 15034 1 689 . 1 1 59 59 ASN CB C 13 39.30 0.25 . 1 . . . . 59 ASN CB . 15034 1 690 . 1 1 59 59 ASN N N 15 124.38 0.1 . 1 . . . . 59 ASN N . 15034 1 691 . 1 1 59 59 ASN ND2 N 15 116.86 0.1 . 1 . . . . 59 ASN ND2 . 15034 1 692 . 1 1 60 60 LYS H H 1 9.47 0.01 . 1 . . . . 60 LYS H . 15034 1 693 . 1 1 60 60 LYS HA H 1 4.58 0.01 . 1 . . . . 60 LYS HA . 15034 1 694 . 1 1 60 60 LYS HB2 H 1 2.06 0.01 . 2 . . . . 60 LYS HB2 . 15034 1 695 . 1 1 60 60 LYS HB3 H 1 1.54 0.01 . 2 . . . . 60 LYS HB3 . 15034 1 696 . 1 1 60 60 LYS HG2 H 1 1.53 0.01 . 1 . . . . 60 LYS HG2 . 15034 1 697 . 1 1 60 60 LYS HG3 H 1 1.53 0.01 . 1 . . . . 60 LYS HG3 . 15034 1 698 . 1 1 60 60 LYS HD2 H 1 1.70 0.01 . 2 . . . . 60 LYS HD2 . 15034 1 699 . 1 1 60 60 LYS HD3 H 1 1.66 0.01 . 2 . . . . 60 LYS HD3 . 15034 1 700 . 1 1 60 60 LYS HE2 H 1 2.98 0.01 . 1 . . . . 60 LYS HE2 . 15034 1 701 . 1 1 60 60 LYS HE3 H 1 2.98 0.01 . 1 . . . . 60 LYS HE3 . 15034 1 702 . 1 1 60 60 LYS C C 13 176.77 0.1 . 1 . . . . 60 LYS C . 15034 1 703 . 1 1 60 60 LYS CA C 13 55.08 0.25 . 1 . . . . 60 LYS CA . 15034 1 704 . 1 1 60 60 LYS CB C 13 34.70 0.25 . 1 . . . . 60 LYS CB . 15034 1 705 . 1 1 60 60 LYS CG C 13 24.47 0.25 . 1 . . . . 60 LYS CG . 15034 1 706 . 1 1 60 60 LYS CD C 13 28.44 0.25 . 1 . . . . 60 LYS CD . 15034 1 707 . 1 1 60 60 LYS CE C 13 42.00 0.25 . 1 . . . . 60 LYS CE . 15034 1 708 . 1 1 60 60 LYS N N 15 125.91 0.1 . 1 . . . . 60 LYS N . 15034 1 709 . 1 1 61 61 GLY H H 1 7.65 0.01 . 1 . . . . 61 GLY H . 15034 1 710 . 1 1 61 61 GLY HA2 H 1 4.54 0.01 . 2 . . . . 61 GLY HA2 . 15034 1 711 . 1 1 61 61 GLY HA3 H 1 3.20 0.01 . 2 . . . . 61 GLY HA3 . 15034 1 712 . 1 1 61 61 GLY C C 13 171.58 0.1 . 1 . . . . 61 GLY C . 15034 1 713 . 1 1 61 61 GLY CA C 13 43.72 0.25 . 1 . . . . 61 GLY CA . 15034 1 714 . 1 1 61 61 GLY N N 15 106.44 0.1 . 1 . . . . 61 GLY N . 15034 1 715 . 1 1 62 62 ILE H H 1 7.80 0.01 . 1 . . . . 62 ILE H . 15034 1 716 . 1 1 62 62 ILE HA H 1 4.40 0.01 . 1 . . . . 62 ILE HA . 15034 1 717 . 1 1 62 62 ILE HB H 1 1.69 0.01 . 1 . . . . 62 ILE HB . 15034 1 718 . 1 1 62 62 ILE HG12 H 1 1.47 0.01 . 1 . . . . 62 ILE HG12 . 15034 1 719 . 1 1 62 62 ILE HG13 H 1 1.10 0.01 . 1 . . . . 62 ILE HG13 . 15034 1 720 . 1 1 62 62 ILE HG21 H 1 0.78 0.01 . 1 . . . . 62 ILE HG2 . 15034 1 721 . 1 1 62 62 ILE HG22 H 1 0.78 0.01 . 1 . . . . 62 ILE HG2 . 15034 1 722 . 1 1 62 62 ILE HG23 H 1 0.78 0.01 . 1 . . . . 62 ILE HG2 . 15034 1 723 . 1 1 62 62 ILE HD11 H 1 0.79 0.01 . 1 . . . . 62 ILE HD1 . 15034 1 724 . 1 1 62 62 ILE HD12 H 1 0.79 0.01 . 1 . . . . 62 ILE HD1 . 15034 1 725 . 1 1 62 62 ILE HD13 H 1 0.79 0.01 . 1 . . . . 62 ILE HD1 . 15034 1 726 . 1 1 62 62 ILE C C 13 175.91 0.1 . 1 . . . . 62 ILE C . 15034 1 727 . 1 1 62 62 ILE CA C 13 59.88 0.25 . 1 . . . . 62 ILE CA . 15034 1 728 . 1 1 62 62 ILE CB C 13 41.10 0.25 . 1 . . . . 62 ILE CB . 15034 1 729 . 1 1 62 62 ILE CG1 C 13 27.22 0.25 . 1 . . . . 62 ILE CG1 . 15034 1 730 . 1 1 62 62 ILE CG2 C 13 17.15 0.25 . 1 . . . . 62 ILE CG2 . 15034 1 731 . 1 1 62 62 ILE CD1 C 13 12.63 0.25 . 1 . . . . 62 ILE CD1 . 15034 1 732 . 1 1 62 62 ILE N N 15 119.09 0.1 . 1 . . . . 62 ILE N . 15034 1 733 . 1 1 63 63 LEU H H 1 8.96 0.1 . 1 . . . . 63 LEU H . 15034 1 734 . 1 1 63 63 LEU HA H 1 4.23 0.01 . 1 . . . . 63 LEU HA . 15034 1 735 . 1 1 63 63 LEU HB2 H 1 1.70 0.01 . 1 . . . . 63 LEU HB2 . 15034 1 736 . 1 1 63 63 LEU HB3 H 1 1.53 0.01 . 1 . . . . 63 LEU HB3 . 15034 1 737 . 1 1 63 63 LEU HG H 1 1.61 0.01 . 1 . . . . 63 LEU HG . 15034 1 738 . 1 1 63 63 LEU HD11 H 1 0.86 0.01 . 1 . . . . 63 LEU HD1 . 15034 1 739 . 1 1 63 63 LEU HD12 H 1 0.86 0.01 . 1 . . . . 63 LEU HD1 . 15034 1 740 . 1 1 63 63 LEU HD13 H 1 0.86 0.01 . 1 . . . . 63 LEU HD1 . 15034 1 741 . 1 1 63 63 LEU HD21 H 1 0.86 0.01 . 1 . . . . 63 LEU HD2 . 15034 1 742 . 1 1 63 63 LEU HD22 H 1 0.86 0.01 . 1 . . . . 63 LEU HD2 . 15034 1 743 . 1 1 63 63 LEU HD23 H 1 0.86 0.01 . 1 . . . . 63 LEU HD2 . 15034 1 744 . 1 1 63 63 LEU C C 13 175.18 0.1 . 1 . . . . 63 LEU C . 15034 1 745 . 1 1 63 63 LEU CA C 13 55.40 0.25 . 1 . . . . 63 LEU CA . 15034 1 746 . 1 1 63 63 LEU CB C 13 41.16 0.25 . 1 . . . . 63 LEU CB . 15034 1 747 . 1 1 63 63 LEU CG C 13 27.52 0.25 . 1 . . . . 63 LEU CG . 15034 1 748 . 1 1 63 63 LEU CD1 C 13 24.6 0.25 . 1 . . . . 63 LEU CD1 . 15034 1 749 . 1 1 63 63 LEU CD2 C 13 24.6 0.25 . 1 . . . . 63 LEU CD2 . 15034 1 750 . 1 1 63 63 LEU N N 15 130.76 0.1 . 1 . . . . 63 LEU N . 15034 1 751 . 1 1 64 64 VAL H H 1 8.13 0.01 . 1 . . . . 64 VAL H . 15034 1 752 . 1 1 64 64 VAL HA H 1 3.76 0.01 . 1 . . . . 64 VAL HA . 15034 1 753 . 1 1 64 64 VAL HB H 1 1.59 0.01 . 1 . . . . 64 VAL HB . 15034 1 754 . 1 1 64 64 VAL HG11 H 1 0.83 0.01 . 1 . . . . 64 VAL HG1 . 15034 1 755 . 1 1 64 64 VAL HG12 H 1 0.83 0.01 . 1 . . . . 64 VAL HG1 . 15034 1 756 . 1 1 64 64 VAL HG13 H 1 0.83 0.01 . 1 . . . . 64 VAL HG1 . 15034 1 757 . 1 1 64 64 VAL HG21 H 1 0.79 0.01 . 1 . . . . 64 VAL HG2 . 15034 1 758 . 1 1 64 64 VAL HG22 H 1 0.79 0.01 . 1 . . . . 64 VAL HG2 . 15034 1 759 . 1 1 64 64 VAL HG23 H 1 0.79 0.01 . 1 . . . . 64 VAL HG2 . 15034 1 760 . 1 1 64 64 VAL C C 13 177.49 0.1 . 1 . . . . 64 VAL C . 15034 1 761 . 1 1 64 64 VAL CA C 13 64.86 0.25 . 1 . . . . 64 VAL CA . 15034 1 762 . 1 1 64 64 VAL CB C 13 32.1 0.25 . 1 . . . . 64 VAL CB . 15034 1 763 . 1 1 64 64 VAL CG1 C 13 21.25 0.25 . 2 . . . . 64 VAL CG1 . 15034 1 764 . 1 1 64 64 VAL CG2 C 13 20.73 0.25 . 2 . . . . 64 VAL CG2 . 15034 1 765 . 1 1 64 64 VAL N N 15 128.44 0.1 . 1 . . . . 64 VAL N . 15034 1 766 . 1 1 65 65 THR H H 1 7.38 0.01 . 1 . . . . 65 THR H . 15034 1 767 . 1 1 65 65 THR HA H 1 4.24 0.01 . 1 . . . . 65 THR HA . 15034 1 768 . 1 1 65 65 THR HB H 1 4.12 0.01 . 1 . . . . 65 THR HB . 15034 1 769 . 1 1 65 65 THR HG21 H 1 1.24 0.01 . 1 . . . . 65 THR HG2 . 15034 1 770 . 1 1 65 65 THR HG22 H 1 1.24 0.01 . 1 . . . . 65 THR HG2 . 15034 1 771 . 1 1 65 65 THR HG23 H 1 1.24 0.01 . 1 . . . . 65 THR HG2 . 15034 1 772 . 1 1 65 65 THR C C 13 174.53 0.1 . 1 . . . . 65 THR C . 15034 1 773 . 1 1 65 65 THR CA C 13 60.45 0.25 . 1 . . . . 65 THR CA . 15034 1 774 . 1 1 65 65 THR CB C 13 69.66 0.25 . 1 . . . . 65 THR CB . 15034 1 775 . 1 1 65 65 THR CG2 C 13 21.44 0.25 . 1 . . . . 65 THR CG2 . 15034 1 776 . 1 1 65 65 THR N N 15 113.32 0.1 . 1 . . . . 65 THR N . 15034 1 777 . 1 1 66 66 VAL H H 1 7.83 0.01 . 1 . . . . 66 VAL H . 15034 1 778 . 1 1 66 66 VAL HA H 1 3.68 0.01 . 1 . . . . 66 VAL HA . 15034 1 779 . 1 1 66 66 VAL HB H 1 2.01 0.01 . 1 . . . . 66 VAL HB . 15034 1 780 . 1 1 66 66 VAL HG11 H 1 0.94 0.01 . 1 . . . . 66 VAL HG1 . 15034 1 781 . 1 1 66 66 VAL HG12 H 1 0.94 0.01 . 1 . . . . 66 VAL HG1 . 15034 1 782 . 1 1 66 66 VAL HG13 H 1 0.94 0.01 . 1 . . . . 66 VAL HG1 . 15034 1 783 . 1 1 66 66 VAL HG21 H 1 0.97 0.01 . 1 . . . . 66 VAL HG2 . 15034 1 784 . 1 1 66 66 VAL HG22 H 1 0.97 0.01 . 1 . . . . 66 VAL HG2 . 15034 1 785 . 1 1 66 66 VAL HG23 H 1 0.97 0.01 . 1 . . . . 66 VAL HG2 . 15034 1 786 . 1 1 66 66 VAL C C 13 175.72 0.1 . 1 . . . . 66 VAL C . 15034 1 787 . 1 1 66 66 VAL CA C 13 64.34 0.25 . 1 . . . . 66 VAL CA . 15034 1 788 . 1 1 66 66 VAL CB C 13 32.11 0.25 . 1 . . . . 66 VAL CB . 15034 1 789 . 1 1 66 66 VAL CG1 C 13 21.3 0.25 . 2 . . . . 66 VAL CG1 . 15034 1 790 . 1 1 66 66 VAL CG2 C 13 20.7 0.25 . 2 . . . . 66 VAL CG2 . 15034 1 791 . 1 1 66 66 VAL N N 15 123.87 0.1 . 1 . . . . 66 VAL N . 15034 1 792 . 1 1 67 67 ASN H H 1 8.68 0.01 . 1 . . . . 67 ASN H . 15034 1 793 . 1 1 67 67 ASN HA H 1 4.83 0.02 . 1 . . . . 67 ASN HA . 15034 1 794 . 1 1 67 67 ASN HB2 H 1 2.67 0.02 . 2 . . . . 67 ASN HB2 . 15034 1 795 . 1 1 67 67 ASN HB3 H 1 2.58 0.01 . 2 . . . . 67 ASN HB3 . 15034 1 796 . 1 1 67 67 ASN HD21 H 1 7.58 0.01 . 1 . . . . 67 ASN HD21 . 15034 1 797 . 1 1 67 67 ASN HD22 H 1 6.61 0.01 . 1 . . . . 67 ASN HD22 . 15034 1 798 . 1 1 67 67 ASN CA C 13 52.02 0.25 . 1 . . . . 67 ASN CA . 15034 1 799 . 1 1 67 67 ASN CB C 13 39.73 0.25 . 1 . . . . 67 ASN CB . 15034 1 800 . 1 1 67 67 ASN N N 15 118.99 0.1 . 1 . . . . 67 ASN N . 15034 1 801 . 1 1 67 67 ASN ND2 N 15 113.71 0.1 . 1 . . . . 67 ASN ND2 . 15034 1 802 . 1 1 68 68 PRO HA H 1 4.54 0.01 . 1 . . . . 68 PRO HA . 15034 1 803 . 1 1 68 68 PRO HB2 H 1 2.02 0.01 . 1 . . . . 68 PRO HB2 . 15034 1 804 . 1 1 68 68 PRO HB3 H 1 1.91 0.01 . 1 . . . . 68 PRO HB3 . 15034 1 805 . 1 1 68 68 PRO HG2 H 1 2.53 0.01 . 1 . . . . 68 PRO HG2 . 15034 1 806 . 1 1 68 68 PRO HG3 H 1 1.82 0.01 . 1 . . . . 68 PRO HG3 . 15034 1 807 . 1 1 68 68 PRO HD2 H 1 3.63 0.01 . 1 . . . . 68 PRO HD2 . 15034 1 808 . 1 1 68 68 PRO HD3 H 1 3.54 0.01 . 1 . . . . 68 PRO HD3 . 15034 1 809 . 1 1 68 68 PRO C C 13 174.62 0.1 . 1 . . . . 68 PRO C . 15034 1 810 . 1 1 68 68 PRO CA C 13 62.82 0.25 . 1 . . . . 68 PRO CA . 15034 1 811 . 1 1 68 68 PRO CB C 13 30.45 0.25 . 1 . . . . 68 PRO CB . 15034 1 812 . 1 1 68 68 PRO CG C 13 27.47 0.25 . 1 . . . . 68 PRO CG . 15034 1 813 . 1 1 68 68 PRO CD C 13 49.49 0.25 . 1 . . . . 68 PRO CD . 15034 1 814 . 1 1 69 69 ILE H H 1 8.02 0.01 . 1 . . . . 69 ILE H . 15034 1 815 . 1 1 69 69 ILE HA H 1 4.63 0.01 . 1 . . . . 69 ILE HA . 15034 1 816 . 1 1 69 69 ILE HB H 1 1.54 0.01 . 1 . . . . 69 ILE HB . 15034 1 817 . 1 1 69 69 ILE HG12 H 1 1.17 0.01 . 2 . . . . 69 ILE HG12 . 15034 1 818 . 1 1 69 69 ILE HG13 H 1 0.80 0.01 . 2 . . . . 69 ILE HG13 . 15034 1 819 . 1 1 69 69 ILE HG21 H 1 0.40 0.01 . 1 . . . . 69 ILE HG2 . 15034 1 820 . 1 1 69 69 ILE HG22 H 1 0.40 0.01 . 1 . . . . 69 ILE HG2 . 15034 1 821 . 1 1 69 69 ILE HG23 H 1 0.40 0.01 . 1 . . . . 69 ILE HG2 . 15034 1 822 . 1 1 69 69 ILE HD11 H 1 0.45 0.01 . 1 . . . . 69 ILE HD1 . 15034 1 823 . 1 1 69 69 ILE HD12 H 1 0.45 0.01 . 1 . . . . 69 ILE HD1 . 15034 1 824 . 1 1 69 69 ILE HD13 H 1 0.45 0.01 . 1 . . . . 69 ILE HD1 . 15034 1 825 . 1 1 69 69 ILE C C 13 175.18 0.1 . 1 . . . . 69 ILE C . 15034 1 826 . 1 1 69 69 ILE CA C 13 59.29 0.25 . 1 . . . . 69 ILE CA . 15034 1 827 . 1 1 69 69 ILE CB C 13 41.98 0.25 . 1 . . . . 69 ILE CB . 15034 1 828 . 1 1 69 69 ILE CG1 C 13 26.98 0.25 . 1 . . . . 69 ILE CG1 . 15034 1 829 . 1 1 69 69 ILE CG2 C 13 16.67 0.25 . 1 . . . . 69 ILE CG2 . 15034 1 830 . 1 1 69 69 ILE CD1 C 13 12.71 0.25 . 1 . . . . 69 ILE CD1 . 15034 1 831 . 1 1 69 69 ILE N N 15 125.63 0.1 . 1 . . . . 69 ILE N . 15034 1 832 . 1 1 70 70 ALA H H 1 8.72 0.01 . 1 . . . . 70 ALA H . 15034 1 833 . 1 1 70 70 ALA HA H 1 4.64 0.01 . 1 . . . . 70 ALA HA . 15034 1 834 . 1 1 70 70 ALA HB1 H 1 1.37 0.01 . 1 . . . . 70 ALA HB . 15034 1 835 . 1 1 70 70 ALA HB2 H 1 1.37 0.01 . 1 . . . . 70 ALA HB . 15034 1 836 . 1 1 70 70 ALA HB3 H 1 1.37 0.01 . 1 . . . . 70 ALA HB . 15034 1 837 . 1 1 70 70 ALA C C 13 176.21 0.1 . 1 . . . . 70 ALA C . 15034 1 838 . 1 1 70 70 ALA CA C 13 50.38 0.25 . 1 . . . . 70 ALA CA . 15034 1 839 . 1 1 70 70 ALA CB C 13 19.66 0.25 . 1 . . . . 70 ALA CB . 15034 1 840 . 1 1 70 70 ALA N N 15 128.11 0.1 . 1 . . . . 70 ALA N . 15034 1 841 . 1 1 71 71 SER H H 1 9.15 0.01 . 1 . . . . 71 SER H . 15034 1 842 . 1 1 71 71 SER HA H 1 4.24 0.01 . 1 . . . . 71 SER HA . 15034 1 843 . 1 1 71 71 SER HB2 H 1 3.87 0.01 . 1 . . . . 71 SER HB2 . 15034 1 844 . 1 1 71 71 SER HB3 H 1 3.87 0.01 . 1 . . . . 71 SER HB3 . 15034 1 845 . 1 1 71 71 SER C C 13 173.71 0.1 . 1 . . . . 71 SER C . 15034 1 846 . 1 1 71 71 SER CA C 13 60.93 0.25 . 1 . . . . 71 SER CA . 15034 1 847 . 1 1 71 71 SER CB C 13 64.21 0.25 . 1 . . . . 71 SER CB . 15034 1 848 . 1 1 71 71 SER N N 15 121.34 0.1 . 1 . . . . 71 SER N . 15034 1 849 . 1 1 72 72 THR H H 1 7.65 0.01 . 1 . . . . 72 THR H . 15034 1 850 . 1 1 72 72 THR HA H 1 4.22 0.01 . 1 . . . . 72 THR HA . 15034 1 851 . 1 1 72 72 THR HB H 1 3.98 0.01 . 1 . . . . 72 THR HB . 15034 1 852 . 1 1 72 72 THR HG21 H 1 1.11 0.01 . 1 . . . . 72 THR HG2 . 15034 1 853 . 1 1 72 72 THR HG22 H 1 1.11 0.01 . 1 . . . . 72 THR HG2 . 15034 1 854 . 1 1 72 72 THR HG23 H 1 1.11 0.01 . 1 . . . . 72 THR HG2 . 15034 1 855 . 1 1 72 72 THR C C 13 172.73 0.1 . 1 . . . . 72 THR C . 15034 1 856 . 1 1 72 72 THR CA C 13 59.87 0.25 . 1 . . . . 72 THR CA . 15034 1 857 . 1 1 72 72 THR CB C 13 71.00 0.25 . 1 . . . . 72 THR CB . 15034 1 858 . 1 1 72 72 THR N N 15 114.89 0.1 . 1 . . . . 72 THR N . 15034 1 859 . 1 1 73 73 ASN H H 1 8.42 0.01 . 1 . . . . 73 ASN H . 15034 1 860 . 1 1 73 73 ASN HA H 1 4.42 0.01 . 1 . . . . 73 ASN HA . 15034 1 861 . 1 1 73 73 ASN HB2 H 1 2.75 0.01 . 2 . . . . 73 ASN HB2 . 15034 1 862 . 1 1 73 73 ASN HB3 H 1 2.58 0.01 . 2 . . . . 73 ASN HB3 . 15034 1 863 . 1 1 73 73 ASN HD21 H 1 7.30 0.01 . 1 . . . . 73 ASN HD21 . 15034 1 864 . 1 1 73 73 ASN HD22 H 1 6.82 0.01 . 1 . . . . 73 ASN HD22 . 15034 1 865 . 1 1 73 73 ASN C C 13 176.80 0.1 . 1 . . . . 73 ASN C . 15034 1 866 . 1 1 73 73 ASN CA C 13 55.06 0.25 . 1 . . . . 73 ASN CA . 15034 1 867 . 1 1 73 73 ASN CB C 13 37.68 0.25 . 1 . . . . 73 ASN CB . 15034 1 868 . 1 1 73 73 ASN N N 15 124.32 0.1 . 1 . . . . 73 ASN N . 15034 1 869 . 1 1 73 73 ASN ND2 N 15 109.4 0.1 . 1 . . . . 73 ASN ND2 . 15034 1 870 . 1 1 74 74 ASP H H 1 9.32 0.01 . 1 . . . . 74 ASP H . 15034 1 871 . 1 1 74 74 ASP HA H 1 4.00 0.01 . 1 . . . . 74 ASP HA . 15034 1 872 . 1 1 74 74 ASP HB2 H 1 3.07 0.01 . 2 . . . . 74 ASP HB2 . 15034 1 873 . 1 1 74 74 ASP HB3 H 1 2.76 0.01 . 2 . . . . 74 ASP HB3 . 15034 1 874 . 1 1 74 74 ASP C C 13 175.42 0.1 . 1 . . . . 74 ASP C . 15034 1 875 . 1 1 74 74 ASP CA C 13 56.82 0.25 . 1 . . . . 74 ASP CA . 15034 1 876 . 1 1 74 74 ASP CB C 13 39.09 0.25 . 1 . . . . 74 ASP CB . 15034 1 877 . 1 1 74 74 ASP N N 15 117.98 0.1 . 1 . . . . 74 ASP N . 15034 1 878 . 1 1 75 75 ASP H H 1 7.63 0.01 . 1 . . . . 75 ASP H . 15034 1 879 . 1 1 75 75 ASP HA H 1 4.42 0.01 . 1 . . . . 75 ASP HA . 15034 1 880 . 1 1 75 75 ASP HB2 H 1 2.99 0.01 . 1 . . . . 75 ASP HB2 . 15034 1 881 . 1 1 75 75 ASP HB3 H 1 2.48 0.01 . 1 . . . . 75 ASP HB3 . 15034 1 882 . 1 1 75 75 ASP C C 13 174.70 0.1 . 1 . . . . 75 ASP C . 15034 1 883 . 1 1 75 75 ASP CA C 13 55.53 0.25 . 1 . . . . 75 ASP CA . 15034 1 884 . 1 1 75 75 ASP CB C 13 41.90 0.25 . 1 . . . . 75 ASP CB . 15034 1 885 . 1 1 75 75 ASP N N 15 121.2 0.1 . 1 . . . . 75 ASP N . 15034 1 886 . 1 1 76 76 GLU H H 1 8.05 0.01 . 1 . . . . 76 GLU H . 15034 1 887 . 1 1 76 76 GLU HA H 1 4.87 0.01 . 1 . . . . 76 GLU HA . 15034 1 888 . 1 1 76 76 GLU HB2 H 1 1.94 0.01 . 2 . . . . 76 GLU HB2 . 15034 1 889 . 1 1 76 76 GLU HB3 H 1 1.43 0.01 . 2 . . . . 76 GLU HB3 . 15034 1 890 . 1 1 76 76 GLU HG2 H 1 2.45 0.01 . 2 . . . . 76 GLU HG2 . 15034 1 891 . 1 1 76 76 GLU HG3 H 1 1.77 0.01 . 2 . . . . 76 GLU HG3 . 15034 1 892 . 1 1 76 76 GLU C C 13 175.85 0.1 . 1 . . . . 76 GLU C . 15034 1 893 . 1 1 76 76 GLU CA C 13 54.43 0.25 . 1 . . . . 76 GLU CA . 15034 1 894 . 1 1 76 76 GLU CB C 13 30.59 0.25 . 1 . . . . 76 GLU CB . 15034 1 895 . 1 1 76 76 GLU CG C 13 36.29 0.25 . 1 . . . . 76 GLU CG . 15034 1 896 . 1 1 76 76 GLU N N 15 120.63 0.1 . 1 . . . . 76 GLU N . 15034 1 897 . 1 1 77 77 VAL H H 1 9.22 0.01 . 1 . . . . 77 VAL H . 15034 1 898 . 1 1 77 77 VAL HA H 1 4.07 0.01 . 1 . . . . 77 VAL HA . 15034 1 899 . 1 1 77 77 VAL HB H 1 1.77 0.01 . 1 . . . . 77 VAL HB . 15034 1 900 . 1 1 77 77 VAL HG11 H 1 0.82 0.01 . 1 . . . . 77 VAL HG1 . 15034 1 901 . 1 1 77 77 VAL HG12 H 1 0.82 0.01 . 1 . . . . 77 VAL HG1 . 15034 1 902 . 1 1 77 77 VAL HG13 H 1 0.82 0.01 . 1 . . . . 77 VAL HG1 . 15034 1 903 . 1 1 77 77 VAL HG21 H 1 0.75 0.01 . 1 . . . . 77 VAL HG2 . 15034 1 904 . 1 1 77 77 VAL HG22 H 1 0.75 0.01 . 1 . . . . 77 VAL HG2 . 15034 1 905 . 1 1 77 77 VAL HG23 H 1 0.75 0.01 . 1 . . . . 77 VAL HG2 . 15034 1 906 . 1 1 77 77 VAL C C 13 175.26 0.1 . 1 . . . . 77 VAL C . 15034 1 907 . 1 1 77 77 VAL CA C 13 62.43 0.25 . 1 . . . . 77 VAL CA . 15034 1 908 . 1 1 77 77 VAL CB C 13 34.66 0.25 . 1 . . . . 77 VAL CB . 15034 1 909 . 1 1 77 77 VAL CG1 C 13 21.01 0.25 . 1 . . . . 77 VAL CG1 . 15034 1 910 . 1 1 77 77 VAL CG2 C 13 21.01 0.25 . 1 . . . . 77 VAL CG2 . 15034 1 911 . 1 1 77 77 VAL N N 15 127.22 0.1 . 1 . . . . 77 VAL N . 15034 1 912 . 1 1 78 78 LEU H H 1 8.60 0.01 . 1 . . . . 78 LEU H . 15034 1 913 . 1 1 78 78 LEU HA H 1 4.73 0.01 . 1 . . . . 78 LEU HA . 15034 1 914 . 1 1 78 78 LEU HB2 H 1 1.59 0.02 . 1 . . . . 78 LEU HB2 . 15034 1 915 . 1 1 78 78 LEU HB3 H 1 1.59 0.02 . 1 . . . . 78 LEU HB3 . 15034 1 916 . 1 1 78 78 LEU HG H 1 1.51 0.02 . 1 . . . . 78 LEU HG . 15034 1 917 . 1 1 78 78 LEU HD11 H 1 0.82 0.01 . 2 . . . . 78 LEU HD1 . 15034 1 918 . 1 1 78 78 LEU HD12 H 1 0.82 0.01 . 2 . . . . 78 LEU HD1 . 15034 1 919 . 1 1 78 78 LEU HD13 H 1 0.82 0.01 . 2 . . . . 78 LEU HD1 . 15034 1 920 . 1 1 78 78 LEU HD21 H 1 0.77 0.01 . 2 . . . . 78 LEU HD2 . 15034 1 921 . 1 1 78 78 LEU HD22 H 1 0.77 0.01 . 2 . . . . 78 LEU HD2 . 15034 1 922 . 1 1 78 78 LEU HD23 H 1 0.77 0.01 . 2 . . . . 78 LEU HD2 . 15034 1 923 . 1 1 78 78 LEU C C 13 175.89 0.1 . 1 . . . . 78 LEU C . 15034 1 924 . 1 1 78 78 LEU CA C 13 55.31 0.25 . 1 . . . . 78 LEU CA . 15034 1 925 . 1 1 78 78 LEU CB C 13 43.15 0.25 . 1 . . . . 78 LEU CB . 15034 1 926 . 1 1 78 78 LEU CG C 13 27.53 0.25 . 1 . . . . 78 LEU CG . 15034 1 927 . 1 1 78 78 LEU CD1 C 13 24.81 0.25 . 1 . . . . 78 LEU CD1 . 15034 1 928 . 1 1 78 78 LEU CD2 C 13 24.81 0.25 . 1 . . . . 78 LEU CD2 . 15034 1 929 . 1 1 78 78 LEU N N 15 131.67 0.1 . 1 . . . . 78 LEU N . 15034 1 930 . 1 1 79 79 ILE H H 1 8.61 0.01 . 1 . . . . 79 ILE H . 15034 1 931 . 1 1 79 79 ILE HA H 1 4.52 0.01 . 1 . . . . 79 ILE HA . 15034 1 932 . 1 1 79 79 ILE HB H 1 1.42 0.01 . 1 . . . . 79 ILE HB . 15034 1 933 . 1 1 79 79 ILE HG12 H 1 1.61 0.01 . 2 . . . . 79 ILE HG12 . 15034 1 934 . 1 1 79 79 ILE HG13 H 1 1.03 0.01 . 2 . . . . 79 ILE HG13 . 15034 1 935 . 1 1 79 79 ILE HG21 H 1 0.70 0.01 . 1 . . . . 79 ILE HG2 . 15034 1 936 . 1 1 79 79 ILE HG22 H 1 0.70 0.01 . 1 . . . . 79 ILE HG2 . 15034 1 937 . 1 1 79 79 ILE HG23 H 1 0.70 0.01 . 1 . . . . 79 ILE HG2 . 15034 1 938 . 1 1 79 79 ILE HD11 H 1 0.66 0.01 . 1 . . . . 79 ILE HD1 . 15034 1 939 . 1 1 79 79 ILE HD12 H 1 0.66 0.01 . 1 . . . . 79 ILE HD1 . 15034 1 940 . 1 1 79 79 ILE HD13 H 1 0.66 0.01 . 1 . . . . 79 ILE HD1 . 15034 1 941 . 1 1 79 79 ILE C C 13 173.44 0.1 . 1 . . . . 79 ILE C . 15034 1 942 . 1 1 79 79 ILE CA C 13 60.49 0.25 . 1 . . . . 79 ILE CA . 15034 1 943 . 1 1 79 79 ILE CB C 13 41.81 0.25 . 1 . . . . 79 ILE CB . 15034 1 944 . 1 1 79 79 ILE CG1 C 13 27.36 0.25 . 1 . . . . 79 ILE CG1 . 15034 1 945 . 1 1 79 79 ILE CG2 C 13 18.71 0.25 . 1 . . . . 79 ILE CG2 . 15034 1 946 . 1 1 79 79 ILE CD1 C 13 14.43 0.25 . 1 . . . . 79 ILE CD1 . 15034 1 947 . 1 1 79 79 ILE N N 15 124.84 0.1 . 1 . . . . 79 ILE N . 15034 1 948 . 1 1 80 80 GLU H H 1 8.98 0.01 . 1 . . . . 80 GLU H . 15034 1 949 . 1 1 80 80 GLU HA H 1 5.60 0.01 . 1 . . . . 80 GLU HA . 15034 1 950 . 1 1 80 80 GLU HB2 H 1 1.80 0.01 . 2 . . . . 80 GLU HB2 . 15034 1 951 . 1 1 80 80 GLU HB3 H 1 1.72 0.01 . 2 . . . . 80 GLU HB3 . 15034 1 952 . 1 1 80 80 GLU HG2 H 1 2.08 0.01 . 2 . . . . 80 GLU HG2 . 15034 1 953 . 1 1 80 80 GLU HG3 H 1 2.06 0.01 . 2 . . . . 80 GLU HG3 . 15034 1 954 . 1 1 80 80 GLU C C 13 175.92 0.1 . 1 . . . . 80 GLU C . 15034 1 955 . 1 1 80 80 GLU CA C 13 53.78 0.25 . 1 . . . . 80 GLU CA . 15034 1 956 . 1 1 80 80 GLU CB C 13 33.10 0.25 . 1 . . . . 80 GLU CB . 15034 1 957 . 1 1 80 80 GLU CG C 13 36.09 0.25 . 1 . . . . 80 GLU CG . 15034 1 958 . 1 1 80 80 GLU N N 15 129.21 0.1 . 1 . . . . 80 GLU N . 15034 1 959 . 1 1 81 81 VAL H H 1 9.08 0.01 . 1 . . . . 81 VAL H . 15034 1 960 . 1 1 81 81 VAL HA H 1 4.97 0.01 . 1 . . . . 81 VAL HA . 15034 1 961 . 1 1 81 81 VAL HB H 1 1.71 0.01 . 1 . . . . 81 VAL HB . 15034 1 962 . 1 1 81 81 VAL HG11 H 1 0.62 0.01 . 2 . . . . 81 VAL HG1 . 15034 1 963 . 1 1 81 81 VAL HG12 H 1 0.62 0.01 . 2 . . . . 81 VAL HG1 . 15034 1 964 . 1 1 81 81 VAL HG13 H 1 0.62 0.01 . 2 . . . . 81 VAL HG1 . 15034 1 965 . 1 1 81 81 VAL HG21 H 1 0.43 0.01 . 2 . . . . 81 VAL HG2 . 15034 1 966 . 1 1 81 81 VAL HG22 H 1 0.43 0.01 . 2 . . . . 81 VAL HG2 . 15034 1 967 . 1 1 81 81 VAL HG23 H 1 0.43 0.01 . 2 . . . . 81 VAL HG2 . 15034 1 968 . 1 1 81 81 VAL C C 13 172.67 0.1 . 1 . . . . 81 VAL C . 15034 1 969 . 1 1 81 81 VAL CA C 13 58.57 0.25 . 1 . . . . 81 VAL CA . 15034 1 970 . 1 1 81 81 VAL CB C 13 36.44 0.25 . 1 . . . . 81 VAL CB . 15034 1 971 . 1 1 81 81 VAL CG1 C 13 21.55 0.25 . 2 . . . . 81 VAL CG1 . 15034 1 972 . 1 1 81 81 VAL CG2 C 13 19.13 0.25 . 2 . . . . 81 VAL CG2 . 15034 1 973 . 1 1 81 81 VAL N N 15 119.0 0.1 . 1 . . . . 81 VAL N . 15034 1 974 . 1 1 82 82 ASN H H 1 9.44 0.01 . 1 . . . . 82 ASN H . 15034 1 975 . 1 1 82 82 ASN HA H 1 5.18 0.01 . 1 . . . . 82 ASN HA . 15034 1 976 . 1 1 82 82 ASN HB2 H 1 3.15 0.01 . 2 . . . . 82 ASN HB2 . 15034 1 977 . 1 1 82 82 ASN HB3 H 1 2.23 0.01 . 2 . . . . 82 ASN HB3 . 15034 1 978 . 1 1 82 82 ASN HD21 H 1 7.04 0.01 . 1 . . . . 82 ASN HD21 . 15034 1 979 . 1 1 82 82 ASN HD22 H 1 6.35 0.01 . 1 . . . . 82 ASN HD22 . 15034 1 980 . 1 1 82 82 ASN CA C 13 49.25 0.25 . 1 . . . . 82 ASN CA . 15034 1 981 . 1 1 82 82 ASN CB C 13 39.63 0.25 . 1 . . . . 82 ASN CB . 15034 1 982 . 1 1 82 82 ASN N N 15 122.48 0.1 . 1 . . . . 82 ASN N . 15034 1 983 . 1 1 82 82 ASN ND2 N 15 107.24 0.1 . 1 . . . . 82 ASN ND2 . 15034 1 984 . 1 1 83 83 PRO HD2 H 1 3.68 0.01 . 1 . . . . 83 PRO HD . 15034 1 985 . 1 1 83 83 PRO HD3 H 1 3.68 0.01 . 1 . . . . 83 PRO HD . 15034 1 986 . 1 1 84 84 PRO HA H 1 4.48 0.01 . 1 . . . . 84 PRO HA . 15034 1 987 . 1 1 84 84 PRO HB2 H 1 2.16 0.01 . 2 . . . . 84 PRO HB2 . 15034 1 988 . 1 1 84 84 PRO HB3 H 1 2.07 0.01 . 2 . . . . 84 PRO HB3 . 15034 1 989 . 1 1 84 84 PRO HG2 H 1 1.72 0.01 . 2 . . . . 84 PRO HG2 . 15034 1 990 . 1 1 84 84 PRO HG3 H 1 1.69 0.01 . 2 . . . . 84 PRO HG3 . 15034 1 991 . 1 1 84 84 PRO HD2 H 1 3.45 0.01 . 2 . . . . 84 PRO HD2 . 15034 1 992 . 1 1 84 84 PRO HD3 H 1 2.49 0.01 . 2 . . . . 84 PRO HD3 . 15034 1 993 . 1 1 84 84 PRO C C 13 176.08 0.1 . 1 . . . . 84 PRO C . 15034 1 994 . 1 1 84 84 PRO CA C 13 61.83 0.25 . 1 . . . . 84 PRO CA . 15034 1 995 . 1 1 84 84 PRO CB C 13 32.12 0.25 . 1 . . . . 84 PRO CB . 15034 1 996 . 1 1 84 84 PRO CG C 13 26.87 0.25 . 1 . . . . 84 PRO CG . 15034 1 997 . 1 1 84 84 PRO CD C 13 49.52 0.25 . 1 . . . . 84 PRO CD . 15034 1 998 . 1 1 85 85 PHE H H 1 8.14 0.01 . 1 . . . . 85 PHE H . 15034 1 999 . 1 1 85 85 PHE HA H 1 3.92 0.01 . 1 . . . . 85 PHE HA . 15034 1 1000 . 1 1 85 85 PHE HB2 H 1 3.04 0.01 . 2 . . . . 85 PHE HB2 . 15034 1 1001 . 1 1 85 85 PHE HB3 H 1 2.81 0.01 . 2 . . . . 85 PHE HB3 . 15034 1 1002 . 1 1 85 85 PHE HD1 H 1 7.19 0.01 . 1 . . . . 85 PHE HB3 . 15034 1 1003 . 1 1 85 85 PHE HD2 H 1 7.19 0.01 . 1 . . . . 85 PHE HB3 . 15034 1 1004 . 1 1 85 85 PHE HE1 H 1 7.33 0.01 . 1 . . . . 85 PHE HB3 . 15034 1 1005 . 1 1 85 85 PHE HE2 H 1 7.33 0.01 . 1 . . . . 85 PHE HB3 . 15034 1 1006 . 1 1 85 85 PHE HZ H 1 7.19 0.02 . 5 . . . . 85 PHE HZ . 15034 1 1007 . 1 1 85 85 PHE C C 13 176.53 0.1 . 1 . . . . 85 PHE C . 15034 1 1008 . 1 1 85 85 PHE CA C 13 61.03 0.25 . 1 . . . . 85 PHE CA . 15034 1 1009 . 1 1 85 85 PHE CB C 13 39.69 0.25 . 1 . . . . 85 PHE CB . 15034 1 1010 . 1 1 85 85 PHE CD1 C 13 131.2 0.20 . 1 . . . . 85 PHE CD1 . 15034 1 1011 . 1 1 85 85 PHE CD2 C 13 131.2 0.20 . 1 . . . . 85 PHE CD2 . 15034 1 1012 . 1 1 85 85 PHE CZ C 13 131.9 0.02 . 5 . . . . 85 PHE CZ . 15034 1 1013 . 1 1 85 85 PHE N N 15 117.12 0.1 . 1 . . . . 85 PHE N . 15034 1 1014 . 1 1 86 86 GLY H H 1 9.04 0.01 . 1 . . . . 86 GLY H . 15034 1 1015 . 1 1 86 86 GLY HA2 H 1 4.38 0.01 . 1 . . . . 86 GLY HA2 . 15034 1 1016 . 1 1 86 86 GLY HA3 H 1 3.45 0.01 . 1 . . . . 86 GLY HA3 . 15034 1 1017 . 1 1 86 86 GLY C C 13 174.26 0.1 . 1 . . . . 86 GLY C . 15034 1 1018 . 1 1 86 86 GLY CA C 13 44.21 0.25 . 1 . . . . 86 GLY CA . 15034 1 1019 . 1 1 86 86 GLY N N 15 111.24 0.1 . 1 . . . . 86 GLY N . 15034 1 1020 . 1 1 87 87 ASP H H 1 9.02 0.01 . 1 . . . . 87 ASP H . 15034 1 1021 . 1 1 87 87 ASP HA H 1 5.67 0.01 . 1 . . . . 87 ASP HA . 15034 1 1022 . 1 1 87 87 ASP HB2 H 1 2.67 0.01 . 1 . . . . 87 ASP HB2 . 15034 1 1023 . 1 1 87 87 ASP HB3 H 1 2.55 0.01 . 1 . . . . 87 ASP HB3 . 15034 1 1024 . 1 1 87 87 ASP C C 13 175.67 0.1 . 1 . . . . 87 ASP C . 15034 1 1025 . 1 1 87 87 ASP CA C 13 54.63 0.25 . 1 . . . . 87 ASP CA . 15034 1 1026 . 1 1 87 87 ASP CB C 13 42.40 0.25 . 1 . . . . 87 ASP CB . 15034 1 1027 . 1 1 87 87 ASP N N 15 126.74 0.1 . 1 . . . . 87 ASP N . 15034 1 1028 . 1 1 88 88 SER H H 1 9.31 0.01 . 1 . . . . 88 SER H . 15034 1 1029 . 1 1 88 88 SER HA H 1 4.66 0.01 . 1 . . . . 88 SER HA . 15034 1 1030 . 1 1 88 88 SER HB2 H 1 3.61 0.01 . 1 . . . . 88 SER HB2 . 15034 1 1031 . 1 1 88 88 SER HB3 H 1 3.61 0.01 . 1 . . . . 88 SER HB3 . 15034 1 1032 . 1 1 88 88 SER C C 13 172.26 0.1 . 1 . . . . 88 SER C . 15034 1 1033 . 1 1 88 88 SER CA C 13 58.72 0.25 . 1 . . . . 88 SER CA . 15034 1 1034 . 1 1 88 88 SER CB C 13 66.09 0.25 . 1 . . . . 88 SER CB . 15034 1 1035 . 1 1 88 88 SER N N 15 119.73 0.1 . 1 . . . . 88 SER N . 15034 1 1036 . 1 1 89 89 TYR H H 1 9.44 0.01 . 1 . . . . 89 TYR H . 15034 1 1037 . 1 1 89 89 TYR HA H 1 5.00 0.01 . 1 . . . . 89 TYR HA . 15034 1 1038 . 1 1 89 89 TYR HB2 H 1 2.57 0.01 . 2 . . . . 89 TYR HB2 . 15034 1 1039 . 1 1 89 89 TYR HB3 H 1 2.49 0.01 . 2 . . . . 89 TYR HB3 . 15034 1 1040 . 1 1 89 89 TYR HD1 H 1 6.74 0.01 . 1 . . . . 89 TYR HD1 . 15034 1 1041 . 1 1 89 89 TYR HD2 H 1 6.74 0.01 . 1 . . . . 89 TYR HD2 . 15034 1 1042 . 1 1 89 89 TYR HE1 H 1 6.76 0.02 . 1 . . . . 89 TYR HE1 . 15034 1 1043 . 1 1 89 89 TYR HE2 H 1 6.76 0.02 . 1 . . . . 89 TYR HE2 . 15034 1 1044 . 1 1 89 89 TYR C C 13 174.94 0.1 . 1 . . . . 89 TYR C . 15034 1 1045 . 1 1 89 89 TYR CA C 13 57.54 0.25 . 1 . . . . 89 TYR CA . 15034 1 1046 . 1 1 89 89 TYR CB C 13 41.24 0.25 . 1 . . . . 89 TYR CB . 15034 1 1047 . 1 1 89 89 TYR CD1 C 13 132.70 0.2 . 1 . . . . 89 TYR CD1 . 15034 1 1048 . 1 1 89 89 TYR CD2 C 13 132.70 0.2 . 1 . . . . 89 TYR CD2 . 15034 1 1049 . 1 1 89 89 TYR CE1 C 13 118.30 0.2 . 1 . . . . 89 TYR CE1 . 15034 1 1050 . 1 1 89 89 TYR CE2 C 13 118.30 0.2 . 1 . . . . 89 TYR CE2 . 15034 1 1051 . 1 1 89 89 TYR N N 15 117.29 0.1 . 1 . . . . 89 TYR N . 15034 1 1052 . 1 1 90 90 ILE H H 1 9.41 0.01 . 1 . . . . 90 ILE H . 15034 1 1053 . 1 1 90 90 ILE HA H 1 4.25 0.01 . 1 . . . . 90 ILE HA . 15034 1 1054 . 1 1 90 90 ILE HB H 1 2.04 0.01 . 1 . . . . 90 ILE HB . 15034 1 1055 . 1 1 90 90 ILE HG12 H 1 1.80 0.01 . 2 . . . . 90 ILE HG12 . 15034 1 1056 . 1 1 90 90 ILE HG13 H 1 0.75 0.01 . 2 . . . . 90 ILE HG13 . 15034 1 1057 . 1 1 90 90 ILE HG21 H 1 0.72 0.01 . 1 . . . . 90 ILE HG2 . 15034 1 1058 . 1 1 90 90 ILE HG22 H 1 0.72 0.01 . 1 . . . . 90 ILE HG2 . 15034 1 1059 . 1 1 90 90 ILE HG23 H 1 0.72 0.01 . 1 . . . . 90 ILE HG2 . 15034 1 1060 . 1 1 90 90 ILE HD11 H 1 0.48 0.01 . 1 . . . . 90 ILE HD1 . 15034 1 1061 . 1 1 90 90 ILE HD12 H 1 0.48 0.01 . 1 . . . . 90 ILE HD1 . 15034 1 1062 . 1 1 90 90 ILE HD13 H 1 0.48 0.01 . 1 . . . . 90 ILE HD1 . 15034 1 1063 . 1 1 90 90 ILE C C 13 174.98 0.1 . 1 . . . . 90 ILE C . 15034 1 1064 . 1 1 90 90 ILE CA C 13 62.32 0.25 . 1 . . . . 90 ILE CA . 15034 1 1065 . 1 1 90 90 ILE CB C 13 39.18 0.25 . 1 . . . . 90 ILE CB . 15034 1 1066 . 1 1 90 90 ILE CG1 C 13 28.72 0.25 . 1 . . . . 90 ILE CG1 . 15034 1 1067 . 1 1 90 90 ILE CG2 C 13 17.53 0.25 . 1 . . . . 90 ILE CG2 . 15034 1 1068 . 1 1 90 90 ILE CD1 C 13 14.51 0.25 . 1 . . . . 90 ILE CD1 . 15034 1 1069 . 1 1 90 90 ILE N N 15 125.90 0.1 . 1 . . . . 90 ILE N . 15034 1 1070 . 1 1 91 91 ILE H H 1 9.09 0.01 . 1 . . . . 91 ILE H . 15034 1 1071 . 1 1 91 91 ILE HA H 1 5.10 0.01 . 1 . . . . 91 ILE HA . 15034 1 1072 . 1 1 91 91 ILE HB H 1 1.80 0.01 . 1 . . . . 91 ILE HB . 15034 1 1073 . 1 1 91 91 ILE HG12 H 1 1.61 0.01 . 1 . . . . 91 ILE HG12 . 15034 1 1074 . 1 1 91 91 ILE HG13 H 1 1.61 0.01 . 1 . . . . 91 ILE HG13 . 15034 1 1075 . 1 1 91 91 ILE HG21 H 1 0.75 0.01 . 1 . . . . 91 ILE HG2 . 15034 1 1076 . 1 1 91 91 ILE HG22 H 1 0.75 0.01 . 1 . . . . 91 ILE HG2 . 15034 1 1077 . 1 1 91 91 ILE HG23 H 1 0.75 0.01 . 1 . . . . 91 ILE HG2 . 15034 1 1078 . 1 1 91 91 ILE HD11 H 1 0.75 0.01 . 1 . . . . 91 ILE HD1 . 15034 1 1079 . 1 1 91 91 ILE HD12 H 1 0.75 0.01 . 1 . . . . 91 ILE HD1 . 15034 1 1080 . 1 1 91 91 ILE HD13 H 1 0.75 0.01 . 1 . . . . 91 ILE HD1 . 15034 1 1081 . 1 1 91 91 ILE C C 13 175.45 0.1 . 1 . . . . 91 ILE C . 15034 1 1082 . 1 1 91 91 ILE CA C 13 60.74 0.25 . 1 . . . . 91 ILE CA . 15034 1 1083 . 1 1 91 91 ILE CB C 13 39.35 0.25 . 1 . . . . 91 ILE CB . 15034 1 1084 . 1 1 91 91 ILE CG1 C 13 26.63 0.25 . 1 . . . . 91 ILE CG1 . 15034 1 1085 . 1 1 91 91 ILE CG2 C 13 17.26 0.25 . 1 . . . . 91 ILE CG2 . 15034 1 1086 . 1 1 91 91 ILE CD1 C 13 14.42 0.25 . 1 . . . . 91 ILE CD1 . 15034 1 1087 . 1 1 91 91 ILE N N 15 128.74 0.1 . 1 . . . . 91 ILE N . 15034 1 1088 . 1 1 92 92 VAL H H 1 9.10 0.01 . 1 . . . . 92 VAL H . 15034 1 1089 . 1 1 92 92 VAL HA H 1 4.76 0.01 . 1 . . . . 92 VAL HA . 15034 1 1090 . 1 1 92 92 VAL HB H 1 1.80 0.01 . 1 . . . . 92 VAL HB . 15034 1 1091 . 1 1 92 92 VAL HG11 H 1 0.69 0.01 . 1 . . . . 92 VAL HG1 . 15034 1 1092 . 1 1 92 92 VAL HG12 H 1 0.69 0.01 . 1 . . . . 92 VAL HG1 . 15034 1 1093 . 1 1 92 92 VAL HG13 H 1 0.69 0.01 . 1 . . . . 92 VAL HG1 . 15034 1 1094 . 1 1 92 92 VAL HG21 H 1 0.84 0.01 . 1 . . . . 92 VAL HG2 . 15034 1 1095 . 1 1 92 92 VAL HG22 H 1 0.84 0.01 . 1 . . . . 92 VAL HG2 . 15034 1 1096 . 1 1 92 92 VAL HG23 H 1 0.84 0.01 . 1 . . . . 92 VAL HG2 . 15034 1 1097 . 1 1 92 92 VAL C C 13 175.81 0.1 . 1 . . . . 92 VAL C . 15034 1 1098 . 1 1 92 92 VAL CA C 13 60.68 0.25 . 1 . . . . 92 VAL CA . 15034 1 1099 . 1 1 92 92 VAL CB C 13 33.88 0.25 . 1 . . . . 92 VAL CB . 15034 1 1100 . 1 1 92 92 VAL CG1 C 13 21.43 0.25 . 1 . . . . 92 VAL CG1 . 15034 1 1101 . 1 1 92 92 VAL CG2 C 13 21.43 0.25 . 1 . . . . 92 VAL CG2 . 15034 1 1102 . 1 1 92 92 VAL N N 15 130.24 0.1 . 1 . . . . 92 VAL N . 15034 1 1103 . 1 1 93 93 GLY H H 1 8.65 0.01 . 1 . . . . 93 GLY H . 15034 1 1104 . 1 1 93 93 GLY HA2 H 1 4.57 0.01 . 2 . . . . 93 GLY HA2 . 15034 1 1105 . 1 1 93 93 GLY HA3 H 1 3.43 0.01 . 2 . . . . 93 GLY HA3 . 15034 1 1106 . 1 1 93 93 GLY C C 13 172.62 0.1 . 1 . . . . 93 GLY C . 15034 1 1107 . 1 1 93 93 GLY CA C 13 43.99 0.25 . 1 . . . . 93 GLY CA . 15034 1 1108 . 1 1 93 93 GLY N N 15 112.20 0.1 . 1 . . . . 93 GLY N . 15034 1 1109 . 1 1 94 94 THR H H 1 8.14 0.01 . 1 . . . . 94 THR H . 15034 1 1110 . 1 1 94 94 THR HA H 1 4.59 0.01 . 1 . . . . 94 THR HA . 15034 1 1111 . 1 1 94 94 THR HB H 1 3.99 0.01 . 1 . . . . 94 THR HB . 15034 1 1112 . 1 1 94 94 THR HG21 H 1 1.07 0.01 . 1 . . . . 94 THR HG2 . 15034 1 1113 . 1 1 94 94 THR HG22 H 1 1.07 0.01 . 1 . . . . 94 THR HG2 . 15034 1 1114 . 1 1 94 94 THR HG23 H 1 1.07 0.01 . 1 . . . . 94 THR HG2 . 15034 1 1115 . 1 1 94 94 THR C C 13 173.88 0.1 . 1 . . . . 94 THR C . 15034 1 1116 . 1 1 94 94 THR CA C 13 60.50 0.25 . 1 . . . . 94 THR CA . 15034 1 1117 . 1 1 94 94 THR CB C 13 71.75 0.25 . 1 . . . . 94 THR CB . 15034 1 1118 . 1 1 94 94 THR CG2 C 13 21.14 0.25 . 1 . . . . 94 THR CG2 . 15034 1 1119 . 1 1 94 94 THR N N 15 110.01 0.1 . 1 . . . . 94 THR N . 15034 1 1120 . 1 1 95 95 GLY H H 1 8.60 0.01 . 1 . . . . 95 GLY H . 15034 1 1121 . 1 1 95 95 GLY HA2 H 1 4.11 0.01 . 2 . . . . 95 GLY HA2 . 15034 1 1122 . 1 1 95 95 GLY HA3 H 1 3.80 0.01 . 2 . . . . 95 GLY HA3 . 15034 1 1123 . 1 1 95 95 GLY C C 13 175.40 0.1 . 1 . . . . 95 GLY C . 15034 1 1124 . 1 1 95 95 GLY CA C 13 45.41 0.25 . 1 . . . . 95 GLY CA . 15034 1 1125 . 1 1 95 95 GLY N N 15 111.09 0.1 . 1 . . . . 95 GLY N . 15034 1 1126 . 1 1 96 96 ASP H H 1 8.65 0.01 . 1 . . . . 96 ASP H . 15034 1 1127 . 1 1 96 96 ASP HA H 1 4.38 0.01 . 1 . . . . 96 ASP HA . 15034 1 1128 . 1 1 96 96 ASP HB2 H 1 2.70 0.01 . 1 . . . . 96 ASP HB2 . 15034 1 1129 . 1 1 96 96 ASP HB3 H 1 2.66 0.01 . 1 . . . . 96 ASP HB3 . 15034 1 1130 . 1 1 96 96 ASP C C 13 177.42 0.1 . 1 . . . . 96 ASP C . 15034 1 1131 . 1 1 96 96 ASP CA C 13 56.71 0.25 . 1 . . . . 96 ASP CA . 15034 1 1132 . 1 1 96 96 ASP CB C 13 40.78 0.25 . 1 . . . . 96 ASP CB . 15034 1 1133 . 1 1 96 96 ASP N N 15 121.32 0.1 . 1 . . . . 96 ASP N . 15034 1 1134 . 1 1 97 97 SER H H 1 8.11 0.01 . 1 . . . . 97 SER H . 15034 1 1135 . 1 1 97 97 SER HA H 1 4.57 0.01 . 1 . . . . 97 SER HA . 15034 1 1136 . 1 1 97 97 SER HB2 H 1 3.92 0.01 . 1 . . . . 97 SER HB2 . 15034 1 1137 . 1 1 97 97 SER HB3 H 1 3.92 0.01 . 1 . . . . 97 SER HB3 . 15034 1 1138 . 1 1 97 97 SER C C 13 174.38 0.1 . 1 . . . . 97 SER C . 15034 1 1139 . 1 1 97 97 SER CA C 13 57.52 0.25 . 1 . . . . 97 SER CA . 15034 1 1140 . 1 1 97 97 SER CB C 13 63.74 0.25 . 1 . . . . 97 SER CB . 15034 1 1141 . 1 1 97 97 SER N N 15 113.10 0.1 . 1 . . . . 97 SER N . 15034 1 1142 . 1 1 98 98 ARG H H 1 7.23 0.01 . 1 . . . . 98 ARG H . 15034 1 1143 . 1 1 98 98 ARG HA H 1 4.20 0.01 . 1 . . . . 98 ARG HA . 15034 1 1144 . 1 1 98 98 ARG HB2 H 1 1.57 0.01 . 2 . . . . 98 ARG HB2 . 15034 1 1145 . 1 1 98 98 ARG HB3 H 1 1.17 0.01 . 2 . . . . 98 ARG HB3 . 15034 1 1146 . 1 1 98 98 ARG HG2 H 1 1.63 0.01 . 2 . . . . 98 ARG HG2 . 15034 1 1147 . 1 1 98 98 ARG HG3 H 1 1.07 0.01 . 2 . . . . 98 ARG HG3 . 15034 1 1148 . 1 1 98 98 ARG HD2 H 1 3.08 0.01 . 2 . . . . 98 ARG HD2 . 15034 1 1149 . 1 1 98 98 ARG HD3 H 1 2.74 0.01 . 2 . . . . 98 ARG HD3 . 15034 1 1150 . 1 1 98 98 ARG HE H 1 7.04 0.01 . 1 . . . . 98 ARG HE . 15034 1 1151 . 1 1 98 98 ARG HH11 H 1 6.81 0.01 . 2 . . . . 98 ARG HH1 . 15034 1 1152 . 1 1 98 98 ARG HH12 H 1 6.81 0.01 . 2 . . . . 98 ARG HH1 . 15034 1 1153 . 1 1 98 98 ARG HH21 H 1 6.56 0.01 . 2 . . . . 98 ARG HH2 . 15034 1 1154 . 1 1 98 98 ARG HH22 H 1 6.56 0.01 . 2 . . . . 98 ARG HH2 . 15034 1 1155 . 1 1 98 98 ARG C C 13 174.10 0.1 . 1 . . . . 98 ARG C . 15034 1 1156 . 1 1 98 98 ARG CA C 13 56.35 0.25 . 1 . . . . 98 ARG CA . 15034 1 1157 . 1 1 98 98 ARG CB C 13 29.75 0.25 . 1 . . . . 98 ARG CB . 15034 1 1158 . 1 1 98 98 ARG CG C 13 25.55 0.25 . 1 . . . . 98 ARG CG . 15034 1 1159 . 1 1 98 98 ARG CD C 13 44.07 0.25 . 1 . . . . 98 ARG CD . 15034 1 1160 . 1 1 98 98 ARG N N 15 122.10 0.1 . 1 . . . . 98 ARG N . 15034 1 1161 . 1 1 98 98 ARG NE N 15 85.65 0.1 . 1 . . . . 98 ARG NE . 15034 1 1162 . 1 1 99 99 LEU H H 1 9.12 0.01 . 1 . . . . 99 LEU H . 15034 1 1163 . 1 1 99 99 LEU HA H 1 4.66 0.01 . 1 . . . . 99 LEU HA . 15034 1 1164 . 1 1 99 99 LEU HB2 H 1 1.50 0.01 . 1 . . . . 99 LEU HB2 . 15034 1 1165 . 1 1 99 99 LEU HB3 H 1 1.35 0.01 . 1 . . . . 99 LEU HB3 . 15034 1 1166 . 1 1 99 99 LEU HG H 1 1.41 0.01 . 1 . . . . 99 LEU HG . 15034 1 1167 . 1 1 99 99 LEU HD11 H 1 -0.03 0.01 . 2 . . . . 99 LEU HD1 . 15034 1 1168 . 1 1 99 99 LEU HD12 H 1 -0.03 0.01 . 2 . . . . 99 LEU HD1 . 15034 1 1169 . 1 1 99 99 LEU HD13 H 1 -0.03 0.01 . 2 . . . . 99 LEU HD1 . 15034 1 1170 . 1 1 99 99 LEU HD21 H 1 0.60 0.01 . 2 . . . . 99 LEU HD2 . 15034 1 1171 . 1 1 99 99 LEU HD22 H 1 0.60 0.01 . 2 . . . . 99 LEU HD2 . 15034 1 1172 . 1 1 99 99 LEU HD23 H 1 0.60 0.01 . 2 . . . . 99 LEU HD2 . 15034 1 1173 . 1 1 99 99 LEU C C 13 176.67 0.1 . 1 . . . . 99 LEU C . 15034 1 1174 . 1 1 99 99 LEU CA C 13 53.66 0.25 . 1 . . . . 99 LEU CA . 15034 1 1175 . 1 1 99 99 LEU CB C 13 43.58 0.25 . 1 . . . . 99 LEU CB . 15034 1 1176 . 1 1 99 99 LEU CG C 13 26.4 0.25 . 1 . . . . 99 LEU CG . 15034 1 1177 . 1 1 99 99 LEU CD1 C 13 23.58 0.25 . 2 . . . . 99 LEU CD1 . 15034 1 1178 . 1 1 99 99 LEU CD2 C 13 22.19 0.25 . 2 . . . . 99 LEU CD2 . 15034 1 1179 . 1 1 99 99 LEU N N 15 124.63 0.1 . 1 . . . . 99 LEU N . 15034 1 1180 . 1 1 100 100 THR H H 1 8.41 0.01 . 1 . . . . 100 THR H . 15034 1 1181 . 1 1 100 100 THR HA H 1 5.65 0.01 . 1 . . . . 100 THR HA . 15034 1 1182 . 1 1 100 100 THR HB H 1 4.05 0.01 . 1 . . . . 100 THR HB . 15034 1 1183 . 1 1 100 100 THR HG21 H 1 1.08 0.01 . 1 . . . . 100 THR HG2 . 15034 1 1184 . 1 1 100 100 THR HG22 H 1 1.08 0.01 . 1 . . . . 100 THR HG2 . 15034 1 1185 . 1 1 100 100 THR HG23 H 1 1.08 0.01 . 1 . . . . 100 THR HG2 . 15034 1 1186 . 1 1 100 100 THR C C 13 174.46 0.1 . 1 . . . . 100 THR C . 15034 1 1187 . 1 1 100 100 THR CA C 13 60.23 0.25 . 1 . . . . 100 THR CA . 15034 1 1188 . 1 1 100 100 THR CB C 13 72.20 0.25 . 1 . . . . 100 THR CB . 15034 1 1189 . 1 1 100 100 THR CG2 C 13 22.27 0.25 . 1 . . . . 100 THR CG2 . 15034 1 1190 . 1 1 100 100 THR N N 15 113.13 0.1 . 1 . . . . 100 THR N . 15034 1 1191 . 1 1 101 101 TYR H H 1 9.25 0.01 . 1 . . . . 101 TYR H . 15034 1 1192 . 1 1 101 101 TYR HA H 1 4.68 0.01 . 1 . . . . 101 TYR HA . 15034 1 1193 . 1 1 101 101 TYR HB2 H 1 3.11 0.01 . 1 . . . . 101 TYR HB2 . 15034 1 1194 . 1 1 101 101 TYR HB3 H 1 2.81 0.01 . 1 . . . . 101 TYR HB3 . 15034 1 1195 . 1 1 101 101 TYR HD1 H 1 7.13 0.01 . 1 . . . . 101 TYR HD1 . 15034 1 1196 . 1 1 101 101 TYR HD2 H 1 7.13 0.01 . 1 . . . . 101 TYR HD2 . 15034 1 1197 . 1 1 101 101 TYR HE1 H 1 6.95 0.01 . 1 . . . . 101 TYR HE1 . 15034 1 1198 . 1 1 101 101 TYR HE2 H 1 6.95 0.01 . 1 . . . . 101 TYR HE2 . 15034 1 1199 . 1 1 101 101 TYR C C 13 174.81 0.1 . 1 . . . . 101 TYR C . 15034 1 1200 . 1 1 101 101 TYR CA C 13 58.64 0.25 . 1 . . . . 101 TYR CA . 15034 1 1201 . 1 1 101 101 TYR CB C 13 43.84 0.25 . 1 . . . . 101 TYR CB . 15034 1 1202 . 1 1 101 101 TYR CD1 C 13 133.69 0.25 . 1 . . . . 101 TYR CD1 . 15034 1 1203 . 1 1 101 101 TYR CD2 C 13 133.69 0.25 . 1 . . . . 101 TYR CD2 . 15034 1 1204 . 1 1 101 101 TYR CE1 C 13 118.60 0.25 . 1 . . . . 101 TYR CE1 . 15034 1 1205 . 1 1 101 101 TYR CE2 C 13 118.60 0.25 . 1 . . . . 101 TYR CE2 . 15034 1 1206 . 1 1 101 101 TYR N N 15 126.43 0.1 . 1 . . . . 101 TYR N . 15034 1 1207 . 1 1 102 102 GLN H H 1 8.59 0.01 . 1 . . . . 102 GLN H . 15034 1 1208 . 1 1 102 102 GLN HA H 1 4.31 0.01 . 1 . . . . 102 GLN HA . 15034 1 1209 . 1 1 102 102 GLN HB2 H 1 1.76 0.02 . 1 . . . . 102 GLN HB2 . 15034 1 1210 . 1 1 102 102 GLN HB3 H 1 1.76 0.02 . 1 . . . . 102 GLN HB3 . 15034 1 1211 . 1 1 102 102 GLN HG2 H 1 1.91 0.02 . 1 . . . . 102 GLN HG2 . 15034 1 1212 . 1 1 102 102 GLN HG3 H 1 1.91 0.02 . 1 . . . . 102 GLN HG3 . 15034 1 1213 . 1 1 102 102 GLN HE21 H 1 7.11 0.01 . 1 . . . . 102 GLN HE21 . 15034 1 1214 . 1 1 102 102 GLN HE22 H 1 6.67 0.01 . 1 . . . . 102 GLN HE22 . 15034 1 1215 . 1 1 102 102 GLN C C 13 173.63 0.1 . 1 . . . . 102 GLN C . 15034 1 1216 . 1 1 102 102 GLN CA C 13 57.34 0.25 . 1 . . . . 102 GLN CA . 15034 1 1217 . 1 1 102 102 GLN CB C 13 29.64 0.25 . 1 . . . . 102 GLN CB . 15034 1 1218 . 1 1 102 102 GLN CG C 13 34.54 0.25 . 1 . . . . 102 GLN CG . 15034 1 1219 . 1 1 102 102 GLN N N 15 131.22 0.1 . 1 . . . . 102 GLN N . 15034 1 1220 . 1 1 102 102 GLN NE2 N 15 111.8 0.1 . 1 . . . . 102 GLN NE2 . 15034 1 1221 . 1 1 103 103 TRP H H 1 9.19 0.01 . 1 . . . . 103 TRP H . 15034 1 1222 . 1 1 103 103 TRP HA H 1 4.64 0.01 . 1 . . . . 103 TRP HA . 15034 1 1223 . 1 1 103 103 TRP HB2 H 1 3.09 0.01 . 2 . . . . 103 TRP HB2 . 15034 1 1224 . 1 1 103 103 TRP HB3 H 1 2.82 0.01 . 2 . . . . 103 TRP HB3 . 15034 1 1225 . 1 1 103 103 TRP HD1 H 1 6.99 0.01 . 1 . . . . 103 TRP HD1 . 15034 1 1226 . 1 1 103 103 TRP HE1 H 1 10.24 0.01 . 1 . . . . 103 TRP HE1 . 15034 1 1227 . 1 1 103 103 TRP HE3 H 1 7.62 0.01 . 1 . . . . 103 TRP HE3 . 15034 1 1228 . 1 1 103 103 TRP HZ2 H 1 7.41 0.01 . 1 . . . . 103 TRP HZ2 . 15034 1 1229 . 1 1 103 103 TRP HZ3 H 1 7.13 0.01 . 4 . . . . 103 TRP HZ3 . 15034 1 1230 . 1 1 103 103 TRP HH2 H 1 7.04 0.01 . 4 . . . . 103 TRP HH2 . 15034 1 1231 . 1 1 103 103 TRP C C 13 173.12 0.1 . 1 . . . . 103 TRP C . 15034 1 1232 . 1 1 103 103 TRP CA C 13 57.07 0.25 . 1 . . . . 103 TRP CA . 15034 1 1233 . 1 1 103 103 TRP CB C 13 33.52 0.25 . 1 . . . . 103 TRP CB . 15034 1 1234 . 1 1 103 103 TRP CD1 C 13 126.19 0.1 . 1 . . . . 103 TRP CD1 . 15034 1 1235 . 1 1 103 103 TRP CD2 C 13 124.08 0.1 . 4 . . . . 103 TRP CD2 . 15034 1 1236 . 1 1 103 103 TRP CE3 C 13 119.76 0.1 . 1 . . . . 103 TRP CE3 . 15034 1 1237 . 1 1 103 103 TRP CZ2 C 13 115.4 0.2 . 1 . . . . 103 TRP CZ2 . 15034 1 1238 . 1 1 103 103 TRP CH2 C 13 122.32 0.1 . 4 . . . . 103 TRP CE2 . 15034 1 1239 . 1 1 103 103 TRP N N 15 127.24 0.1 . 1 . . . . 103 TRP N . 15034 1 1240 . 1 1 104 104 HIS H H 1 6.60 0.01 . 1 . . . . 104 HIS H . 15034 1 1241 . 1 1 104 104 HIS HA H 1 5.07 0.01 . 1 . . . . 104 HIS HA . 15034 1 1242 . 1 1 104 104 HIS HB2 H 1 2.75 0.01 . 2 . . . . 104 HIS HB2 . 15034 1 1243 . 1 1 104 104 HIS HB3 H 1 2.69 0.01 . 2 . . . . 104 HIS HB3 . 15034 1 1244 . 1 1 104 104 HIS HD2 H 1 7.05 0.01 . 1 . . . . 104 HIS HD2 . 15034 1 1245 . 1 1 104 104 HIS HE1 H 1 8.58 0.01 . 5 . . . . 104 HIS HE1 . 15034 1 1246 . 1 1 104 104 HIS C C 13 171.57 0.1 . 1 . . . . 104 HIS C . 15034 1 1247 . 1 1 104 104 HIS CA C 13 54.48 0.25 . 1 . . . . 104 HIS CA . 15034 1 1248 . 1 1 104 104 HIS CB C 13 30.51 0.25 . 1 . . . . 104 HIS CB . 15034 1 1249 . 1 1 104 104 HIS CD2 C 13 120.78 0.1 . 1 . . . . 104 HIS CD2 . 15034 1 1250 . 1 1 104 104 HIS CE1 C 13 136.13 0.1 . 5 . . . . 104 HIS CE1 . 15034 1 1251 . 1 1 104 104 HIS N N 15 125.21 0.1 . 1 . . . . 104 HIS N . 15034 1 1252 . 1 1 105 105 LYS H H 1 8.89 0.01 . 1 . . . . 105 LYS H . 15034 1 1253 . 1 1 105 105 LYS HA H 1 4.56 0.01 . 1 . . . . 105 LYS HA . 15034 1 1254 . 1 1 105 105 LYS HB2 H 1 2.10 0.01 . 1 . . . . 105 LYS HB2 . 15034 1 1255 . 1 1 105 105 LYS HB3 H 1 2.10 0.01 . 1 . . . . 105 LYS HB3 . 15034 1 1256 . 1 1 105 105 LYS HG2 H 1 1.42 0.01 . 2 . . . . 105 LYS HG2 . 15034 1 1257 . 1 1 105 105 LYS HG3 H 1 1.03 0.01 . 2 . . . . 105 LYS HG3 . 15034 1 1258 . 1 1 105 105 LYS HD2 H 1 1.20 0.01 . 2 . . . . 105 LYS HD2 . 15034 1 1259 . 1 1 105 105 LYS HD3 H 1 1.00 0.01 . 2 . . . . 105 LYS HD3 . 15034 1 1260 . 1 1 105 105 LYS HE2 H 1 2.39 0.01 . 2 . . . . 105 LYS HE2 . 15034 1 1261 . 1 1 105 105 LYS HE3 H 1 1.85 0.01 . 2 . . . . 105 LYS HE3 . 15034 1 1262 . 1 1 105 105 LYS C C 13 175.38 0.1 . 1 . . . . 105 LYS C . 15034 1 1263 . 1 1 105 105 LYS CA C 13 54.75 0.25 . 1 . . . . 105 LYS CA . 15034 1 1264 . 1 1 105 105 LYS CB C 13 35.77 0.25 . 1 . . . . 105 LYS CB . 15034 1 1265 . 1 1 105 105 LYS CG C 13 24.70 0.25 . 1 . . . . 105 LYS CG . 15034 1 1266 . 1 1 105 105 LYS CD C 13 29.90 0.25 . 1 . . . . 105 LYS CD . 15034 1 1267 . 1 1 105 105 LYS CE C 13 41.67 0.25 . 1 . . . . 105 LYS CE . 15034 1 1268 . 1 1 105 105 LYS N N 15 128.86 0.1 . 1 . . . . 105 LYS N . 15034 1 1269 . 1 1 106 106 GLU H H 1 8.89 0.01 . 1 . . . . 106 GLU H . 15034 1 1270 . 1 1 106 106 GLU HA H 1 4.31 0.01 . 1 . . . . 106 GLU HA . 15034 1 1271 . 1 1 106 106 GLU HB2 H 1 2.07 0.01 . 2 . . . . 106 GLU HB2 . 15034 1 1272 . 1 1 106 106 GLU HB3 H 1 1.96 0.01 . 2 . . . . 106 GLU HB3 . 15034 1 1273 . 1 1 106 106 GLU HG2 H 1 2.32 0.01 . 1 . . . . 106 GLU HG2 . 15034 1 1274 . 1 1 106 106 GLU HG3 H 1 2.32 0.01 . 1 . . . . 106 GLU HG3 . 15034 1 1275 . 1 1 106 106 GLU C C 13 175.85 0.1 . 1 . . . . 106 GLU C . 15034 1 1276 . 1 1 106 106 GLU CA C 13 56.36 0.25 . 1 . . . . 106 GLU CA . 15034 1 1277 . 1 1 106 106 GLU CB C 13 31.38 0.25 . 1 . . . . 106 GLU CB . 15034 1 1278 . 1 1 106 106 GLU CG C 13 35.89 0.25 . 1 . . . . 106 GLU CG . 15034 1 1279 . 1 1 106 106 GLU N N 15 129.22 0.1 . 1 . . . . 106 GLU N . 15034 1 1280 . 1 1 107 107 GLY H H 1 8.45 0.01 . 1 . . . . 107 GLY H . 15034 1 1281 . 1 1 107 107 GLY HA2 H 1 3.94 0.01 . 1 . . . . 107 GLY HA2 . 15034 1 1282 . 1 1 107 107 GLY HA3 H 1 3.94 0.01 . 1 . . . . 107 GLY HA3 . 15034 1 1283 . 1 1 107 107 GLY C C 13 173.42 0.1 . 1 . . . . 107 GLY C . 15034 1 1284 . 1 1 107 107 GLY CA C 13 45.09 0.25 . 1 . . . . 107 GLY CA . 15034 1 1285 . 1 1 107 107 GLY N N 15 110.52 0.1 . 1 . . . . 107 GLY N . 15034 1 1286 . 1 1 108 108 SER H H 1 7.98 0.01 . 1 . . . . 108 SER H . 15034 1 1287 . 1 1 108 108 SER HA H 1 4.24 0.01 . 1 . . . . 108 SER HA . 15034 1 1288 . 1 1 108 108 SER HB2 H 1 3.72 0.01 . 2 . . . . 108 SER HB2 . 15034 1 1289 . 1 1 108 108 SER HB3 H 1 3.68 0.01 . 2 . . . . 108 SER HB3 . 15034 1 1290 . 1 1 108 108 SER C C 13 174.34 0.1 . 1 . . . . 108 SER C . 15034 1 1291 . 1 1 108 108 SER CA C 13 57.94 0.25 . 1 . . . . 108 SER CA . 15034 1 1292 . 1 1 108 108 SER CB C 13 64.16 0.25 . 1 . . . . 108 SER CB . 15034 1 1293 . 1 1 108 108 SER N N 15 114.98 0.1 . 1 . . . . 108 SER N . 15034 1 1294 . 1 1 109 109 SER H H 1 8.38 0.01 . 1 . . . . 109 SER H . 15034 1 1295 . 1 1 109 109 SER HA H 1 4.41 0.01 . 1 . . . . 109 SER HA . 15034 1 1296 . 1 1 109 109 SER HB2 H 1 3.87 0.01 . 2 . . . . 109 SER HB2 . 15034 1 1297 . 1 1 109 109 SER HB3 H 1 3.82 0.01 . 2 . . . . 109 SER HB3 . 15034 1 1298 . 1 1 109 109 SER C C 13 174.51 0.1 . 1 . . . . 109 SER C . 15034 1 1299 . 1 1 109 109 SER CA C 13 58.48 0.25 . 1 . . . . 109 SER CA . 15034 1 1300 . 1 1 109 109 SER CB C 13 63.76 0.25 . 1 . . . . 109 SER CB . 15034 1 1301 . 1 1 109 109 SER N N 15 118.50 0.1 . 1 . . . . 109 SER N . 15034 1 1302 . 1 1 110 110 ILE H H 1 8.03 0.01 . 1 . . . . 110 ILE H . 15034 1 1303 . 1 1 110 110 ILE HA H 1 4.18 0.01 . 1 . . . . 110 ILE HA . 15034 1 1304 . 1 1 110 110 ILE HB H 1 1.84 0.01 . 1 . . . . 110 ILE HB . 15034 1 1305 . 1 1 110 110 ILE HG12 H 1 1.43 0.01 . 2 . . . . 110 ILE HG12 . 15034 1 1306 . 1 1 110 110 ILE HG13 H 1 1.16 0.01 . 2 . . . . 110 ILE HG13 . 15034 1 1307 . 1 1 110 110 ILE HG21 H 1 0.88 0.01 . 1 . . . . 110 ILE HG2 . 15034 1 1308 . 1 1 110 110 ILE HG22 H 1 0.88 0.01 . 1 . . . . 110 ILE HG2 . 15034 1 1309 . 1 1 110 110 ILE HG23 H 1 0.88 0.01 . 1 . . . . 110 ILE HG2 . 15034 1 1310 . 1 1 110 110 ILE HD11 H 1 0.83 0.01 . 1 . . . . 110 ILE HD1 . 15034 1 1311 . 1 1 110 110 ILE HD12 H 1 0.83 0.01 . 1 . . . . 110 ILE HD1 . 15034 1 1312 . 1 1 110 110 ILE HD13 H 1 0.83 0.01 . 1 . . . . 110 ILE HD1 . 15034 1 1313 . 1 1 110 110 ILE C C 13 176.7 0.1 . 1 . . . . 110 ILE C . 15034 1 1314 . 1 1 110 110 ILE CA C 13 61.61 0.25 . 1 . . . . 110 ILE CA . 15034 1 1315 . 1 1 110 110 ILE CB C 13 38.76 0.25 . 1 . . . . 110 ILE CB . 15034 1 1316 . 1 1 110 110 ILE CG1 C 13 27.31 0.25 . 1 . . . . 110 ILE CG1 . 15034 1 1317 . 1 1 110 110 ILE CG2 C 13 17.47 0.25 . 1 . . . . 110 ILE CG2 . 15034 1 1318 . 1 1 110 110 ILE CD1 C 13 13.0 0.25 . 1 . . . . 110 ILE CD1 . 15034 1 1319 . 1 1 110 110 ILE N N 15 122.45 0.1 . 1 . . . . 110 ILE N . 15034 1 1320 . 1 1 111 111 GLY H H 1 8.39 0.01 . 1 . . . . 111 GLY H . 15034 1 1321 . 1 1 111 111 GLY HA2 H 1 3.91 0.01 . 1 . . . . 111 GLY HA2 . 15034 1 1322 . 1 1 111 111 GLY HA3 H 1 3.91 0.01 . 1 . . . . 111 GLY HA3 . 15034 1 1323 . 1 1 111 111 GLY C C 13 173.13 0.1 . 1 . . . . 111 GLY C . 15034 1 1324 . 1 1 111 111 GLY CA C 13 45.57 0.25 . 1 . . . . 111 GLY CA . 15034 1 1325 . 1 1 111 111 GLY N N 15 113.87 0.1 . 1 . . . . 111 GLY N . 15034 1 1326 . 1 1 112 112 LYS H H 1 7.74 0.01 . 1 . . . . 112 LYS H . 15034 1 1327 . 1 1 112 112 LYS HA H 1 4.17 0.01 . 1 . . . . 112 LYS HA . 15034 1 1328 . 1 1 112 112 LYS HB2 H 1 1.80 0.01 . 1 . . . . 112 LYS HB2 . 15034 1 1329 . 1 1 112 112 LYS HB3 H 1 1.67 0.01 . 1 . . . . 112 LYS HB3 . 15034 1 1330 . 1 1 112 112 LYS HG2 H 1 1.33 0.01 . 1 . . . . 112 LYS HG2 . 15034 1 1331 . 1 1 112 112 LYS HG3 H 1 1.33 0.01 . 1 . . . . 112 LYS HG3 . 15034 1 1332 . 1 1 112 112 LYS HD2 H 1 1.63 0.01 . 1 . . . . 112 LYS HD2 . 15034 1 1333 . 1 1 112 112 LYS HD3 H 1 1.63 0.01 . 1 . . . . 112 LYS HD3 . 15034 1 1334 . 1 1 112 112 LYS HE2 H 1 2.95 0.01 . 1 . . . . 112 LYS HE2 . 15034 1 1335 . 1 1 112 112 LYS HE3 H 1 2.95 0.01 . 1 . . . . 112 LYS HE3 . 15034 1 1336 . 1 1 112 112 LYS CA C 13 57.55 0.25 . 1 . . . . 112 LYS CA . 15034 1 1337 . 1 1 112 112 LYS CB C 13 33.91 0.25 . 1 . . . . 112 LYS CB . 15034 1 1338 . 1 1 112 112 LYS CG C 13 24.9 0.25 . 1 . . . . 112 LYS CG . 15034 1 1339 . 1 1 112 112 LYS CD C 13 29.4 0.25 . 1 . . . . 112 LYS CD . 15034 1 1340 . 1 1 112 112 LYS CE C 13 42.4 0.25 . 1 . . . . 112 LYS CE . 15034 1 1341 . 1 1 112 112 LYS N N 15 126.58 0.15 . 1 . . . . 112 LYS N . 15034 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 215 15034 1 1 1006 15034 1 2 219 15034 1 2 1012 15034 1 3 316 15034 1 3 1245 15034 1 4 321 15034 1 4 1250 15034 1 5 1229 15034 1 5 1230 15034 1 6 1235 15034 1 6 1238 15034 1 stop_ save_