data_15102 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15102 _Entry.Title ; IKs producing slow voltage-gated potassium channel subunit beta, KCNE1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-01-19 _Entry.Accession_date 2007-01-19 _Entry.Last_release_date 2007-10-17 _Entry.Original_release_date 2007-10-17 _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 'human being voltage-gated potassium channel subunit beta, KCNE1' _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 Changlin Tian . . . 15102 2 'Hak jun' Kim . . . 15102 3 Charles Sanders . . . 15102 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15102 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 336 15102 '15N chemical shifts' 112 15102 '1H chemical shifts' 499 15102 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2007-10-17 2007-01-19 original author . 15102 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15102 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17892302 _Citation.Full_citation . _Citation.Title 'Preparation, Functional Characterization, and NMR Studies of Human KCNE1, a Voltage-Gated Potassium Channel Accessory Subunit Associated with Deafness and Long QT Syndrome(,)' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 46 _Citation.Journal_issue 41 _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 11459 _Citation.Page_last 11472 _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 Changlin Tian . . . 15102 1 2 Carlos Vanoye . G. . 15102 1 3 Congbao Kang . . . 15102 1 4 Richard Welch . C. . 15102 1 5 Hak Kim . Jun . 15102 1 6 Alfred George . L. Jr. 15102 1 7 Charles Sanders . R. . 15102 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15102 _Assembly.ID 1 _Assembly.Name KCNE1 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic . _Assembly.Thiol_state . _Assembly.Molecular_mass 35.0 _Assembly.Enzyme_commission_number . _Assembly.Details 'KCNE1 in detergent micelles' _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 KCNE1 1 $KCNE1 A . yes native no no . . . 15102 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_KCNE1 _Entity.Sf_category entity _Entity.Sf_framecode KCNE1 _Entity.Entry_ID 15102 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name KCNE1 _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 ; MILSNTTAVTPFLTKLWQET VQQGGNMSGLARRSPRSGDG KLEALYVLMVLGFFGFFTLG IMLSYIRSKKLEHSNDPFNV YIESDAWQEKDKAYVQARVL ESYKSCYVVENHLAIEQPNT HLPETKPSP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 129 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2K21 . "Nmr Structure Of Human Kcne1 In Lmpg Micelles At Ph 6.0 And 40 Degree C" . . . . . 100.00 138 100.00 100.00 1.40e-90 . . . . 15102 1 2 no DBJ BAG36319 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 129 99.22 100.00 2.10e-90 . . . . 15102 1 3 no DBJ BAG65181 . "unnamed protein product [Homo sapiens]" . . . . . 79.84 103 98.06 99.03 7.92e-69 . . . . 15102 1 4 no DBJ BAG73568 . "potassium voltage-gated channel, Isk-related family, member 1 [synthetic construct]" . . . . . 100.00 129 99.22 100.00 2.10e-90 . . . . 15102 1 5 no EMBL CAG46556 . "KCNE1 [Homo sapiens]" . . . . . 100.00 129 99.22 100.00 2.10e-90 . . . . 15102 1 6 no GB AAA36129 . "IsK protein [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 7 no GB AAA58418 . "cardiac delayed rectifier potassium channel protein [Homo sapiens]" . . . . . 100.00 129 99.22 100.00 2.10e-90 . . . . 15102 1 8 no GB AAA63905 . "delayed rectifier potassium channel [Homo sapiens]" . . . . . 100.00 129 99.22 100.00 2.10e-90 . . . . 15102 1 9 no GB AAD25096 . "delayed rectifier potassium channel subunit IsK [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 10 no GB AAH36452 . "KCNE1 protein [Homo sapiens]" . . . . . 81.40 105 98.10 99.05 4.63e-69 . . . . 15102 1 11 no REF NP_000210 . "potassium voltage-gated channel subfamily E member 1 [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 12 no REF NP_001121140 . "potassium voltage-gated channel subfamily E member 1 [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 13 no REF NP_001121141 . "potassium voltage-gated channel subfamily E member 1 [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 14 no REF NP_001121142 . "potassium voltage-gated channel subfamily E member 1 [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 15 no REF NP_001257331 . "potassium voltage-gated channel subfamily E member 1 [Homo sapiens]" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 1 16 no SP P15382 . "RecName: Full=Potassium voltage-gated channel subfamily E member 1; AltName: Full=Delayed rectifier potassium channel subunit I" . . . . . 100.00 129 98.45 99.22 1.71e-89 . . . . 15102 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 . 15102 1 2 . ILE . 15102 1 3 . LEU . 15102 1 4 . SER . 15102 1 5 . ASN . 15102 1 6 . THR . 15102 1 7 . THR . 15102 1 8 . ALA . 15102 1 9 . VAL . 15102 1 10 . THR . 15102 1 11 . PRO . 15102 1 12 . PHE . 15102 1 13 . LEU . 15102 1 14 . THR . 15102 1 15 . LYS . 15102 1 16 . LEU . 15102 1 17 . TRP . 15102 1 18 . GLN . 15102 1 19 . GLU . 15102 1 20 . THR . 15102 1 21 . VAL . 15102 1 22 . GLN . 15102 1 23 . GLN . 15102 1 24 . GLY . 15102 1 25 . GLY . 15102 1 26 . ASN . 15102 1 27 . MET . 15102 1 28 . SER . 15102 1 29 . GLY . 15102 1 30 . LEU . 15102 1 31 . ALA . 15102 1 32 . ARG . 15102 1 33 . ARG . 15102 1 34 . SER . 15102 1 35 . PRO . 15102 1 36 . ARG . 15102 1 37 . SER . 15102 1 38 . GLY . 15102 1 39 . ASP . 15102 1 40 . GLY . 15102 1 41 . LYS . 15102 1 42 . LEU . 15102 1 43 . GLU . 15102 1 44 . ALA . 15102 1 45 . LEU . 15102 1 46 . TYR . 15102 1 47 . VAL . 15102 1 48 . LEU . 15102 1 49 . MET . 15102 1 50 . VAL . 15102 1 51 . LEU . 15102 1 52 . GLY . 15102 1 53 . PHE . 15102 1 54 . PHE . 15102 1 55 . GLY . 15102 1 56 . PHE . 15102 1 57 . PHE . 15102 1 58 . THR . 15102 1 59 . LEU . 15102 1 60 . GLY . 15102 1 61 . ILE . 15102 1 62 . MET . 15102 1 63 . LEU . 15102 1 64 . SER . 15102 1 65 . TYR . 15102 1 66 . ILE . 15102 1 67 . ARG . 15102 1 68 . SER . 15102 1 69 . LYS . 15102 1 70 . LYS . 15102 1 71 . LEU . 15102 1 72 . GLU . 15102 1 73 . HIS . 15102 1 74 . SER . 15102 1 75 . ASN . 15102 1 76 . ASP . 15102 1 77 . PRO . 15102 1 78 . PHE . 15102 1 79 . ASN . 15102 1 80 . VAL . 15102 1 81 . TYR . 15102 1 82 . ILE . 15102 1 83 . GLU . 15102 1 84 . SER . 15102 1 85 . ASP . 15102 1 86 . ALA . 15102 1 87 . TRP . 15102 1 88 . GLN . 15102 1 89 . GLU . 15102 1 90 . LYS . 15102 1 91 . ASP . 15102 1 92 . LYS . 15102 1 93 . ALA . 15102 1 94 . TYR . 15102 1 95 . VAL . 15102 1 96 . GLN . 15102 1 97 . ALA . 15102 1 98 . ARG . 15102 1 99 . VAL . 15102 1 100 . LEU . 15102 1 101 . GLU . 15102 1 102 . SER . 15102 1 103 . TYR . 15102 1 104 . LYS . 15102 1 105 . SER . 15102 1 106 . CYS . 15102 1 107 . TYR . 15102 1 108 . VAL . 15102 1 109 . VAL . 15102 1 110 . GLU . 15102 1 111 . ASN . 15102 1 112 . HIS . 15102 1 113 . LEU . 15102 1 114 . ALA . 15102 1 115 . ILE . 15102 1 116 . GLU . 15102 1 117 . GLN . 15102 1 118 . PRO . 15102 1 119 . ASN . 15102 1 120 . THR . 15102 1 121 . HIS . 15102 1 122 . LEU . 15102 1 123 . PRO . 15102 1 124 . GLU . 15102 1 125 . THR . 15102 1 126 . LYS . 15102 1 127 . PRO . 15102 1 128 . SER . 15102 1 129 . PRO . 15102 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 15102 1 . ILE 2 2 15102 1 . LEU 3 3 15102 1 . SER 4 4 15102 1 . ASN 5 5 15102 1 . THR 6 6 15102 1 . THR 7 7 15102 1 . ALA 8 8 15102 1 . VAL 9 9 15102 1 . THR 10 10 15102 1 . PRO 11 11 15102 1 . PHE 12 12 15102 1 . LEU 13 13 15102 1 . THR 14 14 15102 1 . LYS 15 15 15102 1 . LEU 16 16 15102 1 . TRP 17 17 15102 1 . GLN 18 18 15102 1 . GLU 19 19 15102 1 . THR 20 20 15102 1 . VAL 21 21 15102 1 . GLN 22 22 15102 1 . GLN 23 23 15102 1 . GLY 24 24 15102 1 . GLY 25 25 15102 1 . ASN 26 26 15102 1 . MET 27 27 15102 1 . SER 28 28 15102 1 . GLY 29 29 15102 1 . LEU 30 30 15102 1 . ALA 31 31 15102 1 . ARG 32 32 15102 1 . ARG 33 33 15102 1 . SER 34 34 15102 1 . PRO 35 35 15102 1 . ARG 36 36 15102 1 . SER 37 37 15102 1 . GLY 38 38 15102 1 . ASP 39 39 15102 1 . GLY 40 40 15102 1 . LYS 41 41 15102 1 . LEU 42 42 15102 1 . GLU 43 43 15102 1 . ALA 44 44 15102 1 . LEU 45 45 15102 1 . TYR 46 46 15102 1 . VAL 47 47 15102 1 . LEU 48 48 15102 1 . MET 49 49 15102 1 . VAL 50 50 15102 1 . LEU 51 51 15102 1 . GLY 52 52 15102 1 . PHE 53 53 15102 1 . PHE 54 54 15102 1 . GLY 55 55 15102 1 . PHE 56 56 15102 1 . PHE 57 57 15102 1 . THR 58 58 15102 1 . LEU 59 59 15102 1 . GLY 60 60 15102 1 . ILE 61 61 15102 1 . MET 62 62 15102 1 . LEU 63 63 15102 1 . SER 64 64 15102 1 . TYR 65 65 15102 1 . ILE 66 66 15102 1 . ARG 67 67 15102 1 . SER 68 68 15102 1 . LYS 69 69 15102 1 . LYS 70 70 15102 1 . LEU 71 71 15102 1 . GLU 72 72 15102 1 . HIS 73 73 15102 1 . SER 74 74 15102 1 . ASN 75 75 15102 1 . ASP 76 76 15102 1 . PRO 77 77 15102 1 . PHE 78 78 15102 1 . ASN 79 79 15102 1 . VAL 80 80 15102 1 . TYR 81 81 15102 1 . ILE 82 82 15102 1 . GLU 83 83 15102 1 . SER 84 84 15102 1 . ASP 85 85 15102 1 . ALA 86 86 15102 1 . TRP 87 87 15102 1 . GLN 88 88 15102 1 . GLU 89 89 15102 1 . LYS 90 90 15102 1 . ASP 91 91 15102 1 . LYS 92 92 15102 1 . ALA 93 93 15102 1 . TYR 94 94 15102 1 . VAL 95 95 15102 1 . GLN 96 96 15102 1 . ALA 97 97 15102 1 . ARG 98 98 15102 1 . VAL 99 99 15102 1 . LEU 100 100 15102 1 . GLU 101 101 15102 1 . SER 102 102 15102 1 . TYR 103 103 15102 1 . LYS 104 104 15102 1 . SER 105 105 15102 1 . CYS 106 106 15102 1 . TYR 107 107 15102 1 . VAL 108 108 15102 1 . VAL 109 109 15102 1 . GLU 110 110 15102 1 . ASN 111 111 15102 1 . HIS 112 112 15102 1 . LEU 113 113 15102 1 . ALA 114 114 15102 1 . ILE 115 115 15102 1 . GLU 116 116 15102 1 . GLN 117 117 15102 1 . PRO 118 118 15102 1 . ASN 119 119 15102 1 . THR 120 120 15102 1 . HIS 121 121 15102 1 . LEU 122 122 15102 1 . PRO 123 123 15102 1 . GLU 124 124 15102 1 . THR 125 125 15102 1 . LYS 126 126 15102 1 . PRO 127 127 15102 1 . SER 128 128 15102 1 . PRO 129 129 15102 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 15102 _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 $KCNE1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 15102 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 15102 _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 $KCNE1 . 'recombinant technology' 'Escherichia coli' . . . . . 'BL21(DE3) CodonPlus RP' . . . . . . . . . . . . . . . pET16b . . . 'With the overhead sequence MGHHHHHHG uncleaved before wild type KCNE1 sequence' . . 15102 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15102 _Sample.ID 1 _Sample.Type micelle _Sample.Sub_type . _Sample.Details 'KCNE1 in LMPG detergent micelles' _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 KCNE1 '[U-100% 13C; U-100% 15N; 80% 2H]' . . 1 $KCNE1 . . 1 . . mM . . . . 15102 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 15102 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.25 . M 15102 1 pH 6.0 . pH 15102 1 pressure 1 . atm 15102 1 temperature 313 . K 15102 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15102 _Software.ID 1 _Software.Name NMRPipe _Software.Version 6.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15102 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 15102 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_nmr_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmr_spectrometer_1 _NMR_spectrometer.Entry_ID 15102 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'NMR facility in University of Georgia' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_nmr_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmr_spectrometer_2 _NMR_spectrometer.Entry_ID 15102 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'Vanderbilt University' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_nmr_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode nmr_spectrometer_3 _NMR_spectrometer.Entry_ID 15102 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'Vanderbilt University' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15102 _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 . 900 'NMR facility in University of Georgia' . . 15102 1 2 spectrometer_2 Bruker AMX . 800 'Vanderbilt University' . . 15102 1 3 spectrometer_3 Bruker AMX . 600 'Vanderbilt University' . . 15102 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 15102 _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 . . . . . . . . . . . . . . . . . . . . . 15102 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15102 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15102 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15102 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 15102 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details 'DSS as 0 ppm 1H chemical shift' 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 . . . . . . . . . 15102 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15102 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15102 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 15102 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15102 1 2 '3D HNCO' . . . 15102 1 3 '3D HNCA' . . . 15102 1 4 '3D HNCACB' . . . 15102 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID '2H isotope effect' 'all 13C' . . . 15102 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRPipe . . 15102 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 8.301 0.02 . 1 . . . . 1 MET H . 15102 1 2 . 1 1 1 1 MET HA H 1 4.346 0.02 . 1 . . . . 1 MET HA . 15102 1 3 . 1 1 1 1 MET HB2 H 1 1.98383 0.02 . 1 . . . . 1 MET QB . 15102 1 4 . 1 1 1 1 MET HB3 H 1 1.98383 0.02 . 1 . . . . 1 MET QB . 15102 1 5 . 1 1 1 1 MET HG2 H 1 2.441 0.02 . 1 . . . . 1 MET QG . 15102 1 6 . 1 1 1 1 MET HG3 H 1 2.441 0.02 . 1 . . . . 1 MET QG . 15102 1 7 . 1 1 1 1 MET C C 13 176.381 0.1 . 1 . . . . 1 MET C . 15102 1 8 . 1 1 1 1 MET CA C 13 55.801 0.1 . 1 . . . . 1 MET CA . 15102 1 9 . 1 1 1 1 MET CB C 13 32.122 0.1 . 1 . . . . 1 MET CB . 15102 1 10 . 1 1 1 1 MET N N 15 119.823 0.2 . 1 . . . . 1 MET N . 15102 1 11 . 1 1 2 2 ILE H H 1 8.075 0.02 . 1 . . . . 2 ILE H . 15102 1 12 . 1 1 2 2 ILE HA H 1 3.966 0.02 . 1 . . . . 2 ILE HA . 15102 1 13 . 1 1 2 2 ILE HB H 1 1.844 0.02 . 1 . . . . 2 ILE HB . 15102 1 14 . 1 1 2 2 ILE HG12 H 1 1.451 0.02 . 1 . . . . 2 ILE QG1 . 15102 1 15 . 1 1 2 2 ILE HG13 H 1 1.451 0.02 . 1 . . . . 2 ILE QG1 . 15102 1 16 . 1 1 2 2 ILE HG21 H 1 1.067 0.02 . 1 . . . . 2 ILE QG2 . 15102 1 17 . 1 1 2 2 ILE HG22 H 1 1.067 0.02 . 1 . . . . 2 ILE QG2 . 15102 1 18 . 1 1 2 2 ILE HG23 H 1 1.067 0.02 . 1 . . . . 2 ILE QG2 . 15102 1 19 . 1 1 2 2 ILE HD11 H 1 0.793 0.02 . 1 . . . . 2 ILE QD1 . 15102 1 20 . 1 1 2 2 ILE HD12 H 1 0.793 0.02 . 1 . . . . 2 ILE QD1 . 15102 1 21 . 1 1 2 2 ILE HD13 H 1 0.793 0.02 . 1 . . . . 2 ILE QD1 . 15102 1 22 . 1 1 2 2 ILE C C 13 176.150 0.1 . 1 . . . . 2 ILE C . 15102 1 23 . 1 1 2 2 ILE CA C 13 62.014 0.1 . 1 . . . . 2 ILE CA . 15102 1 24 . 1 1 2 2 ILE CB C 13 37.414 0.1 . 1 . . . . 2 ILE CB . 15102 1 25 . 1 1 2 2 ILE N N 15 119.834 0.2 . 1 . . . . 2 ILE N . 15102 1 26 . 1 1 3 3 LEU H H 1 8.065 0.02 . 1 . . . . 3 LEU H . 15102 1 27 . 1 1 3 3 LEU HA H 1 4.223 0.02 . 1 . . . . 3 LEU HA . 15102 1 28 . 1 1 3 3 LEU HB2 H 1 1.568 0.02 . 1 . . . . 3 LEU QB . 15102 1 29 . 1 1 3 3 LEU HB3 H 1 1.568 0.02 . 1 . . . . 3 LEU QB . 15102 1 30 . 1 1 3 3 LEU HD11 H 1 0.797 0.02 . 1 . . . . 3 LEU QQD . 15102 1 31 . 1 1 3 3 LEU HD12 H 1 0.797 0.02 . 1 . . . . 3 LEU QQD . 15102 1 32 . 1 1 3 3 LEU HD13 H 1 0.797 0.02 . 1 . . . . 3 LEU QQD . 15102 1 33 . 1 1 3 3 LEU HD21 H 1 0.797 0.02 . 1 . . . . 3 LEU QQD . 15102 1 34 . 1 1 3 3 LEU HD22 H 1 0.797 0.02 . 1 . . . . 3 LEU QQD . 15102 1 35 . 1 1 3 3 LEU HD23 H 1 0.797 0.02 . 1 . . . . 3 LEU QQD . 15102 1 36 . 1 1 3 3 LEU C C 13 177.239 0.1 . 1 . . . . 3 LEU C . 15102 1 37 . 1 1 3 3 LEU CA C 13 55.164 0.1 . 1 . . . . 3 LEU CA . 15102 1 38 . 1 1 3 3 LEU CB C 13 40.875 0.1 . 1 . . . . 3 LEU CB . 15102 1 39 . 1 1 3 3 LEU N N 15 121.150 0.2 . 1 . . . . 3 LEU N . 15102 1 40 . 1 1 4 4 SER H H 1 8.090 0.02 . 1 . . . . 4 SER H . 15102 1 41 . 1 1 4 4 SER HA H 1 4.302 0.02 . 1 . . . . 4 SER HA . 15102 1 42 . 1 1 4 4 SER HB2 H 1 3.839 0.02 . 2 . . . . 4 SER HB2 . 15102 1 43 . 1 1 4 4 SER HB3 H 1 3.804 0.02 . 2 . . . . 4 SER HB3 . 15102 1 44 . 1 1 4 4 SER C C 13 174.701 0.1 . 1 . . . . 4 SER C . 15102 1 45 . 1 1 4 4 SER CA C 13 58.993 0.1 . 1 . . . . 4 SER CA . 15102 1 46 . 1 1 4 4 SER CB C 13 62.954 0.1 . 1 . . . . 4 SER CB . 15102 1 47 . 1 1 4 4 SER N N 15 114.138 0.2 . 1 . . . . 4 SER N . 15102 1 48 . 1 1 5 5 ASN H H 1 8.139 0.02 . 1 . . . . 5 ASN H . 15102 1 49 . 1 1 5 5 ASN HA H 1 4.788 0.02 . 1 . . . . 5 ASN HA . 15102 1 50 . 1 1 5 5 ASN HB2 H 1 2.850 0.02 . 2 . . . . 5 ASN HB2 . 15102 1 51 . 1 1 5 5 ASN HB3 H 1 2.710 0.02 . 2 . . . . 5 ASN HB3 . 15102 1 52 . 1 1 5 5 ASN C C 13 175.650 0.1 . 1 . . . . 5 ASN C . 15102 1 53 . 1 1 5 5 ASN CA C 13 53.413 0.1 . 1 . . . . 5 ASN CA . 15102 1 54 . 1 1 5 5 ASN CB C 13 38.357 0.1 . 1 . . . . 5 ASN CB . 15102 1 55 . 1 1 5 5 ASN N N 15 118.587 0.2 . 1 . . . . 5 ASN N . 15102 1 56 . 1 1 6 6 THR H H 1 8.152 0.02 . 1 . . . . 6 THR H . 15102 1 57 . 1 1 6 6 THR HB H 1 4.233 0.02 . 1 . . . . 6 THR HB . 15102 1 58 . 1 1 6 6 THR HG21 H 1 1.156 0.02 . 1 . . . . 6 THR QG2 . 15102 1 59 . 1 1 6 6 THR HG22 H 1 1.156 0.02 . 1 . . . . 6 THR QG2 . 15102 1 60 . 1 1 6 6 THR HG23 H 1 1.156 0.02 . 1 . . . . 6 THR QG2 . 15102 1 61 . 1 1 6 6 THR C C 13 175.945 0.1 . 1 . . . . 6 THR C . 15102 1 62 . 1 1 6 6 THR CA C 13 63.513 0.1 . 1 . . . . 6 THR CA . 15102 1 63 . 1 1 6 6 THR CB C 13 68.228 0.1 . 1 . . . . 6 THR CB . 15102 1 64 . 1 1 6 6 THR N N 15 112.303 0.2 . 1 . . . . 6 THR N . 15102 1 65 . 1 1 7 7 THR H H 1 7.963 0.02 . 1 . . . . 7 THR H . 15102 1 66 . 1 1 7 7 THR HB H 1 4.2449 0.02 . 1 . . . . 7 THR HB . 15102 1 67 . 1 1 7 7 THR HG21 H 1 1.200 0.02 . 1 . . . . 7 THR QG2 . 15102 1 68 . 1 1 7 7 THR HG22 H 1 1.200 0.02 . 1 . . . . 7 THR QG2 . 15102 1 69 . 1 1 7 7 THR HG23 H 1 1.200 0.02 . 1 . . . . 7 THR QG2 . 15102 1 70 . 1 1 7 7 THR C C 13 175.255 0.1 . 1 . . . . 7 THR C . 15102 1 71 . 1 1 7 7 THR CA C 13 63.491 0.1 . 1 . . . . 7 THR CA . 15102 1 72 . 1 1 7 7 THR CB C 13 68.689 0.1 . 1 . . . . 7 THR CB . 15102 1 73 . 1 1 7 7 THR N N 15 114.661 0.2 . 1 . . . . 7 THR N . 15102 1 74 . 1 1 8 8 ALA H H 1 8.031 0.02 . 1 . . . . 8 ALA H . 15102 1 75 . 1 1 8 8 ALA HB1 H 1 1.406 0.02 . 1 . . . . 8 ALA QB . 15102 1 76 . 1 1 8 8 ALA HB2 H 1 1.406 0.02 . 1 . . . . 8 ALA QB . 15102 1 77 . 1 1 8 8 ALA HB3 H 1 1.406 0.02 . 1 . . . . 8 ALA QB . 15102 1 78 . 1 1 8 8 ALA C C 13 178.197 0.1 . 1 . . . . 8 ALA C . 15102 1 79 . 1 1 8 8 ALA CA C 13 52.891 0.1 . 1 . . . . 8 ALA CA . 15102 1 80 . 1 1 8 8 ALA CB C 13 18.595 0.1 . 1 . . . . 8 ALA CB . 15102 1 81 . 1 1 8 8 ALA N N 15 122.803 0.2 . 1 . . . . 8 ALA N . 15102 1 82 . 1 1 9 9 VAL H H 1 7.786 0.02 . 1 . . . . 9 VAL H . 15102 1 83 . 1 1 9 9 VAL HB H 1 2.175 0.02 . 1 . . . . 9 VAL HB . 15102 1 84 . 1 1 9 9 VAL HG11 H 1 0.969 0.02 . 1 . . . . 9 VAL QQG . 15102 1 85 . 1 1 9 9 VAL HG12 H 1 0.969 0.02 . 1 . . . . 9 VAL QQG . 15102 1 86 . 1 1 9 9 VAL HG13 H 1 0.969 0.02 . 1 . . . . 9 VAL QQG . 15102 1 87 . 1 1 9 9 VAL HG21 H 1 0.969 0.02 . 1 . . . . 9 VAL QQG . 15102 1 88 . 1 1 9 9 VAL HG22 H 1 0.969 0.02 . 1 . . . . 9 VAL QQG . 15102 1 89 . 1 1 9 9 VAL HG23 H 1 0.969 0.02 . 1 . . . . 9 VAL QQG . 15102 1 90 . 1 1 9 9 VAL C C 13 176.709 0.1 . 1 . . . . 9 VAL C . 15102 1 91 . 1 1 9 9 VAL CA C 13 63.375 0.1 . 1 . . . . 9 VAL CA . 15102 1 92 . 1 1 9 9 VAL CB C 13 31.680 0.1 . 1 . . . . 9 VAL CB . 15102 1 93 . 1 1 9 9 VAL N N 15 113.428 0.2 . 1 . . . . 9 VAL N . 15102 1 94 . 1 1 10 10 THR H H 1 8.155 0.02 . 1 . . . . 10 THR H . 15102 1 95 . 1 1 10 10 THR CA C 13 67.581 0.1 . 1 . . . . 10 THR CA . 15102 1 96 . 1 1 10 10 THR CB C 13 66.744 0.1 . 1 . . . . 10 THR CB . 15102 1 97 . 1 1 10 10 THR N N 15 115.932 0.2 . 1 . . . . 10 THR N . 15102 1 98 . 1 1 11 11 PRO HD2 H 1 3.584 0.02 . 1 . . . . 11 PRO QD . 15102 1 99 . 1 1 11 11 PRO HD3 H 1 3.584 0.02 . 1 . . . . 11 PRO QD . 15102 1 100 . 1 1 11 11 PRO C C 13 178.946 0.1 . 1 . . . . 11 PRO C . 15102 1 101 . 1 1 11 11 PRO CA C 13 65.715 0.1 . 1 . . . . 11 PRO CA . 15102 1 102 . 1 1 11 11 PRO CB C 13 30.134 0.1 . 1 . . . . 11 PRO CB . 15102 1 103 . 1 1 12 12 PHE H H 1 7.516 0.02 . 1 . . . . 12 PHE H . 15102 1 104 . 1 1 12 12 PHE HB2 H 1 3.260 0.02 . 2 . . . . 12 PHE HB2 . 15102 1 105 . 1 1 12 12 PHE HB3 H 1 3.122 0.02 . 2 . . . . 12 PHE HB3 . 15102 1 106 . 1 1 12 12 PHE C C 13 177.174 0.1 . 1 . . . . 12 PHE C . 15102 1 107 . 1 1 12 12 PHE CA C 13 60.562 0.1 . 1 . . . . 12 PHE CA . 15102 1 108 . 1 1 12 12 PHE CB C 13 38.593 0.1 . 1 . . . . 12 PHE CB . 15102 1 109 . 1 1 12 12 PHE N N 15 117.208 0.2 . 1 . . . . 12 PHE N . 15102 1 110 . 1 1 13 13 LEU H H 1 8.116 0.02 . 1 . . . . 13 LEU H . 15102 1 111 . 1 1 13 13 LEU HB2 H 1 1.892 0.02 . 1 . . . . 13 LEU QB . 15102 1 112 . 1 1 13 13 LEU HB3 H 1 1.892 0.02 . 1 . . . . 13 LEU QB . 15102 1 113 . 1 1 13 13 LEU HD11 H 1 0.857 0.02 . 1 . . . . 13 LEU QQD . 15102 1 114 . 1 1 13 13 LEU HD12 H 1 0.857 0.02 . 1 . . . . 13 LEU QQD . 15102 1 115 . 1 1 13 13 LEU HD13 H 1 0.857 0.02 . 1 . . . . 13 LEU QQD . 15102 1 116 . 1 1 13 13 LEU HD21 H 1 0.857 0.02 . 1 . . . . 13 LEU QQD . 15102 1 117 . 1 1 13 13 LEU HD22 H 1 0.857 0.02 . 1 . . . . 13 LEU QQD . 15102 1 118 . 1 1 13 13 LEU HD23 H 1 0.857 0.02 . 1 . . . . 13 LEU QQD . 15102 1 119 . 1 1 13 13 LEU C C 13 178.503 0.1 . 1 . . . . 13 LEU C . 15102 1 120 . 1 1 13 13 LEU CA C 13 57.268 0.1 . 1 . . . . 13 LEU CA . 15102 1 121 . 1 1 13 13 LEU CB C 13 40.754 0.1 . 1 . . . . 13 LEU CB . 15102 1 122 . 1 1 13 13 LEU N N 15 117.972 0.2 . 1 . . . . 13 LEU N . 15102 1 123 . 1 1 14 14 THR H H 1 8.418 0.02 . 1 . . . . 14 THR H . 15102 1 124 . 1 1 14 14 THR HB H 1 4.205 0.02 . 1 . . . . 14 THR HB . 15102 1 125 . 1 1 14 14 THR HG21 H 1 1.178 0.02 . 1 . . . . 14 THR QG2 . 15102 1 126 . 1 1 14 14 THR HG22 H 1 1.178 0.02 . 1 . . . . 14 THR QG2 . 15102 1 127 . 1 1 14 14 THR HG23 H 1 1.178 0.02 . 1 . . . . 14 THR QG2 . 15102 1 128 . 1 1 14 14 THR C C 13 176.369 0.1 . 1 . . . . 14 THR C . 15102 1 129 . 1 1 14 14 THR CA C 13 66.395 0.1 . 1 . . . . 14 THR CA . 15102 1 130 . 1 1 14 14 THR CB C 13 67.799 0.1 . 1 . . . . 14 THR CB . 15102 1 131 . 1 1 14 14 THR N N 15 113.407 0.2 . 1 . . . . 14 THR N . 15102 1 132 . 1 1 15 15 LYS H H 1 7.629 0.02 . 1 . . . . 15 LYS H . 15102 1 133 . 1 1 15 15 LYS HB2 H 1 1.827 0.02 . 1 . . . . 15 LYS QB . 15102 1 134 . 1 1 15 15 LYS HB3 H 1 1.827 0.02 . 1 . . . . 15 LYS QB . 15102 1 135 . 1 1 15 15 LYS C C 13 178.423 0.1 . 1 . . . . 15 LYS C . 15102 1 136 . 1 1 15 15 LYS CA C 13 58.828 0.1 . 1 . . . . 15 LYS CA . 15102 1 137 . 1 1 15 15 LYS CB C 13 31.119 0.1 . 1 . . . . 15 LYS CB . 15102 1 138 . 1 1 15 15 LYS N N 15 122.373 0.2 . 1 . . . . 15 LYS N . 15102 1 139 . 1 1 16 16 LEU H H 1 7.936 0.02 . 1 . . . . 16 LEU H . 15102 1 140 . 1 1 16 16 LEU HB2 H 1 1.49239 0.02 . 1 . . . . 16 LEU QB . 15102 1 141 . 1 1 16 16 LEU HB3 H 1 1.49239 0.02 . 1 . . . . 16 LEU QB . 15102 1 142 . 1 1 16 16 LEU HG H 1 1.515 0.02 . 1 . . . . 16 LEU HG . 15102 1 143 . 1 1 16 16 LEU HD11 H 1 0.739 0.02 . 1 . . . . 16 LEU QQD . 15102 1 144 . 1 1 16 16 LEU HD12 H 1 0.739 0.02 . 1 . . . . 16 LEU QQD . 15102 1 145 . 1 1 16 16 LEU HD13 H 1 0.739 0.02 . 1 . . . . 16 LEU QQD . 15102 1 146 . 1 1 16 16 LEU HD21 H 1 0.739 0.02 . 1 . . . . 16 LEU QQD . 15102 1 147 . 1 1 16 16 LEU HD22 H 1 0.739 0.02 . 1 . . . . 16 LEU QQD . 15102 1 148 . 1 1 16 16 LEU HD23 H 1 0.739 0.02 . 1 . . . . 16 LEU QQD . 15102 1 149 . 1 1 16 16 LEU C C 13 179.891 0.1 . 1 . . . . 16 LEU C . 15102 1 150 . 1 1 16 16 LEU CA C 13 57.502 0.1 . 1 . . . . 16 LEU CA . 15102 1 151 . 1 1 16 16 LEU CB C 13 40.885 0.1 . 1 . . . . 16 LEU CB . 15102 1 152 . 1 1 16 16 LEU N N 15 119.172 0.2 . 1 . . . . 16 LEU N . 15102 1 153 . 1 1 17 17 TRP H H 1 8.570 0.02 . 1 . . . . 17 TRP H . 15102 1 154 . 1 1 17 17 TRP HB2 H 1 3.440 0.02 . 2 . . . . 17 TRP HB2 . 15102 1 155 . 1 1 17 17 TRP HB3 H 1 3.269 0.02 . 2 . . . . 17 TRP HB3 . 15102 1 156 . 1 1 17 17 TRP C C 13 177.248 0.1 . 1 . . . . 17 TRP C . 15102 1 157 . 1 1 17 17 TRP CA C 13 59.987 0.1 . 1 . . . . 17 TRP CA . 15102 1 158 . 1 1 17 17 TRP CB C 13 28.919 0.1 . 1 . . . . 17 TRP CB . 15102 1 159 . 1 1 17 17 TRP N N 15 121.176 0.2 . 1 . . . . 17 TRP N . 15102 1 160 . 1 1 18 18 GLN H H 1 8.382 0.02 . 1 . . . . 18 GLN H . 15102 1 161 . 1 1 18 18 GLN HA H 1 4.275 0.02 . 1 . . . . 18 GLN HA . 15102 1 162 . 1 1 18 18 GLN HB2 H 1 1.964 0.02 . 2 . . . . 18 GLN HB2 . 15102 1 163 . 1 1 18 18 GLN HB3 H 1 1.877 0.02 . 2 . . . . 18 GLN HB3 . 15102 1 164 . 1 1 18 18 GLN HG2 H 1 2.203 0.02 . 1 . . . . 18 GLN QG . 15102 1 165 . 1 1 18 18 GLN HG3 H 1 2.203 0.02 . 1 . . . . 18 GLN QG . 15102 1 166 . 1 1 18 18 GLN C C 13 178.750 0.1 . 1 . . . . 18 GLN C . 15102 1 167 . 1 1 18 18 GLN CA C 13 58.524 0.1 . 1 . . . . 18 GLN CA . 15102 1 168 . 1 1 18 18 GLN CB C 13 27.645 0.1 . 1 . . . . 18 GLN CB . 15102 1 169 . 1 1 18 18 GLN N N 15 116.901 0.2 . 1 . . . . 18 GLN N . 15102 1 170 . 1 1 19 19 GLU H H 1 8.276 0.02 . 1 . . . . 19 GLU H . 15102 1 171 . 1 1 19 19 GLU HB2 H 1 2.018 0.02 . 1 . . . . 19 GLU QB . 15102 1 172 . 1 1 19 19 GLU HB3 H 1 2.018 0.02 . 1 . . . . 19 GLU QB . 15102 1 173 . 1 1 19 19 GLU HG2 H 1 2.314 0.02 . 1 . . . . 19 GLU QG . 15102 1 174 . 1 1 19 19 GLU HG3 H 1 2.314 0.02 . 1 . . . . 19 GLU QG . 15102 1 175 . 1 1 19 19 GLU C C 13 177.861 0.1 . 1 . . . . 19 GLU C . 15102 1 176 . 1 1 19 19 GLU CA C 13 57.765 0.1 . 1 . . . . 19 GLU CA . 15102 1 177 . 1 1 19 19 GLU CB C 13 28.458 0.1 . 1 . . . . 19 GLU CB . 15102 1 178 . 1 1 19 19 GLU N N 15 116.051 0.2 . 1 . . . . 19 GLU N . 15102 1 179 . 1 1 20 20 THR H H 1 7.830 0.02 . 1 . . . . 20 THR H . 15102 1 180 . 1 1 20 20 THR HB H 1 4.032 0.02 . 1 . . . . 20 THR HB . 15102 1 181 . 1 1 20 20 THR HG21 H 1 1.189 0.02 . 1 . . . . 20 THR QG2 . 15102 1 182 . 1 1 20 20 THR HG22 H 1 1.189 0.02 . 1 . . . . 20 THR QG2 . 15102 1 183 . 1 1 20 20 THR HG23 H 1 1.189 0.02 . 1 . . . . 20 THR QG2 . 15102 1 184 . 1 1 20 20 THR C C 13 175.936 0.1 . 1 . . . . 20 THR C . 15102 1 185 . 1 1 20 20 THR CA C 13 65.319 0.1 . 1 . . . . 20 THR CA . 15102 1 186 . 1 1 20 20 THR CB C 13 68.111 0.1 . 1 . . . . 20 THR CB . 15102 1 187 . 1 1 20 20 THR N N 15 114.517 0.2 . 1 . . . . 20 THR N . 15102 1 188 . 1 1 21 21 VAL H H 1 7.942 0.02 . 1 . . . . 21 VAL H . 15102 1 189 . 1 1 21 21 VAL HA H 1 3.459 0.02 . 1 . . . . 21 VAL HA . 15102 1 190 . 1 1 21 21 VAL HG11 H 1 0.435 0.02 . 1 . . . . 21 VAL QG1 . 15102 1 191 . 1 1 21 21 VAL HG12 H 1 0.435 0.02 . 1 . . . . 21 VAL QG1 . 15102 1 192 . 1 1 21 21 VAL HG13 H 1 0.435 0.02 . 1 . . . . 21 VAL QG1 . 15102 1 193 . 1 1 21 21 VAL HG21 H 1 0.287 0.02 . 1 . . . . 21 VAL QG2 . 15102 1 194 . 1 1 21 21 VAL HG22 H 1 0.287 0.02 . 1 . . . . 21 VAL QG2 . 15102 1 195 . 1 1 21 21 VAL HG23 H 1 0.287 0.02 . 1 . . . . 21 VAL QG2 . 15102 1 196 . 1 1 21 21 VAL C C 13 177.781 0.1 . 1 . . . . 21 VAL C . 15102 1 197 . 1 1 21 21 VAL CA C 13 64.536 0.1 . 1 . . . . 21 VAL CA . 15102 1 198 . 1 1 21 21 VAL CB C 13 30.609 0.1 . 1 . . . . 21 VAL CB . 15102 1 199 . 1 1 21 21 VAL N N 15 119.476 0.2 . 1 . . . . 21 VAL N . 15102 1 200 . 1 1 22 22 GLN H H 1 7.606 0.02 . 1 . . . . 22 GLN H . 15102 1 201 . 1 1 22 22 GLN HA H 1 3.989 0.02 . 1 . . . . 22 GLN HA . 15102 1 202 . 1 1 22 22 GLN HB2 H 1 1.979 0.02 . 1 . . . . 22 GLN QB . 15102 1 203 . 1 1 22 22 GLN HB3 H 1 1.979 0.02 . 1 . . . . 22 GLN QB . 15102 1 204 . 1 1 22 22 GLN HG2 H 1 2.229 0.02 . 1 . . . . 22 GLN QG . 15102 1 205 . 1 1 22 22 GLN HG3 H 1 2.229 0.02 . 1 . . . . 22 GLN QG . 15102 1 206 . 1 1 22 22 GLN C C 13 177.303 0.1 . 1 . . . . 22 GLN C . 15102 1 207 . 1 1 22 22 GLN CA C 13 57.141 0.1 . 1 . . . . 22 GLN CA . 15102 1 208 . 1 1 22 22 GLN CB C 13 27.931 0.1 . 1 . . . . 22 GLN CB . 15102 1 209 . 1 1 22 22 GLN N N 15 117.928 0.2 . 1 . . . . 22 GLN N . 15102 1 210 . 1 1 23 23 GLN H H 1 7.892 0.02 . 1 . . . . 23 GLN H . 15102 1 211 . 1 1 23 23 GLN HA H 1 4.176 0.02 . 1 . . . . 23 GLN HA . 15102 1 212 . 1 1 23 23 GLN HB2 H 1 1.926 0.02 . 1 . . . . 23 GLN QB . 15102 1 213 . 1 1 23 23 GLN HB3 H 1 1.926 0.02 . 1 . . . . 23 GLN QB . 15102 1 214 . 1 1 23 23 GLN HG2 H 1 2.306 0.02 . 1 . . . . 23 GLN QG . 15102 1 215 . 1 1 23 23 GLN HG3 H 1 2.306 0.02 . 1 . . . . 23 GLN QG . 15102 1 216 . 1 1 23 23 GLN C C 13 177.186 0.1 . 1 . . . . 23 GLN C . 15102 1 217 . 1 1 23 23 GLN CA C 13 55.941 0.1 . 1 . . . . 23 GLN CA . 15102 1 218 . 1 1 23 23 GLN CB C 13 27.783 0.1 . 1 . . . . 23 GLN CB . 15102 1 219 . 1 1 23 23 GLN N N 15 117.070 0.2 . 1 . . . . 23 GLN N . 15102 1 220 . 1 1 24 24 GLY H H 1 8.146 0.02 . 1 . . . . 24 GLY H . 15102 1 221 . 1 1 24 24 GLY HA2 H 1 3.793 0.02 . 1 . . . . 24 GLY QA . 15102 1 222 . 1 1 24 24 GLY HA3 H 1 3.793 0.02 . 1 . . . . 24 GLY QA . 15102 1 223 . 1 1 24 24 GLY C C 13 174.794 0.1 . 1 . . . . 24 GLY C . 15102 1 224 . 1 1 24 24 GLY CA C 13 45.790 0.1 . 1 . . . . 24 GLY CA . 15102 1 225 . 1 1 24 24 GLY N N 15 107.935 0.2 . 1 . . . . 24 GLY N . 15102 1 226 . 1 1 25 25 GLY H H 1 8.178 0.02 . 1 . . . . 25 GLY H . 15102 1 227 . 1 1 25 25 GLY HA2 H 1 3.825 0.02 . 1 . . . . 25 GLY QA . 15102 1 228 . 1 1 25 25 GLY HA3 H 1 3.825 0.02 . 1 . . . . 25 GLY QA . 15102 1 229 . 1 1 25 25 GLY C C 13 174.383 0.1 . 1 . . . . 25 GLY C . 15102 1 230 . 1 1 25 25 GLY CA C 13 45.427 0.1 . 1 . . . . 25 GLY CA . 15102 1 231 . 1 1 25 25 GLY N N 15 107.908 0.2 . 1 . . . . 25 GLY N . 15102 1 232 . 1 1 26 26 ASN H H 1 8.183 0.02 . 1 . . . . 26 ASN H . 15102 1 233 . 1 1 26 26 ASN HA H 1 4.621 0.02 . 1 . . . . 26 ASN HA . 15102 1 234 . 1 1 26 26 ASN HB2 H 1 2.779 0.02 . 1 . . . . 26 ASN QB . 15102 1 235 . 1 1 26 26 ASN HB3 H 1 2.779 0.02 . 1 . . . . 26 ASN QB . 15102 1 236 . 1 1 26 26 ASN C C 13 176.054 0.1 . 1 . . . . 26 ASN C . 15102 1 237 . 1 1 26 26 ASN CA C 13 53.526 0.1 . 1 . . . . 26 ASN CA . 15102 1 238 . 1 1 26 26 ASN CB C 13 38.104 0.1 . 1 . . . . 26 ASN CB . 15102 1 239 . 1 1 26 26 ASN N N 15 118.379 0.2 . 1 . . . . 26 ASN N . 15102 1 240 . 1 1 27 27 MET H H 1 8.399 0.02 . 1 . . . . 27 MET H . 15102 1 241 . 1 1 27 27 MET HA H 1 4.334 0.02 . 1 . . . . 27 MET HA . 15102 1 242 . 1 1 27 27 MET HG2 H 1 2.536 0.02 . 2 . . . . 27 MET HG2 . 15102 1 243 . 1 1 27 27 MET HG3 H 1 2.416 0.02 . 2 . . . . 27 MET HG3 . 15102 1 244 . 1 1 27 27 MET HE1 H 1 2.027 0.02 . 1 . . . . 27 MET QE . 15102 1 245 . 1 1 27 27 MET HE2 H 1 2.027 0.02 . 1 . . . . 27 MET QE . 15102 1 246 . 1 1 27 27 MET HE3 H 1 2.027 0.02 . 1 . . . . 27 MET QE . 15102 1 247 . 1 1 27 27 MET C C 13 176.818 0.1 . 1 . . . . 27 MET C . 15102 1 248 . 1 1 27 27 MET CA C 13 56.111 0.1 . 1 . . . . 27 MET CA . 15102 1 249 . 1 1 27 27 MET CB C 13 31.841 0.1 . 1 . . . . 27 MET CB . 15102 1 250 . 1 1 27 27 MET N N 15 119.398 0.2 . 1 . . . . 27 MET N . 15102 1 251 . 1 1 28 28 SER H H 1 8.189 0.02 . 1 . . . . 28 SER H . 15102 1 252 . 1 1 28 28 SER HB2 H 1 3.841 0.02 . 1 . . . . 28 SER QB . 15102 1 253 . 1 1 28 28 SER HB3 H 1 3.841 0.02 . 1 . . . . 28 SER QB . 15102 1 254 . 1 1 28 28 SER C C 13 175.766 0.1 . 1 . . . . 28 SER C . 15102 1 255 . 1 1 28 28 SER CA C 13 59.923 0.1 . 1 . . . . 28 SER CA . 15102 1 256 . 1 1 28 28 SER CB C 13 62.577 0.1 . 1 . . . . 28 SER CB . 15102 1 257 . 1 1 28 28 SER N N 15 114.719 0.2 . 1 . . . . 28 SER N . 15102 1 258 . 1 1 29 29 GLY H H 1 8.282 0.02 . 1 . . . . 29 GLY H . 15102 1 259 . 1 1 29 29 GLY HA2 H 1 3.844 0.02 . 1 . . . . 29 GLY QA . 15102 1 260 . 1 1 29 29 GLY HA3 H 1 3.844 0.02 . 1 . . . . 29 GLY QA . 15102 1 261 . 1 1 29 29 GLY C C 13 175.177 0.1 . 1 . . . . 29 GLY C . 15102 1 262 . 1 1 29 29 GLY CA C 13 45.700 0.1 . 1 . . . . 29 GLY CA . 15102 1 263 . 1 1 29 29 GLY N N 15 109.355 0.2 . 1 . . . . 29 GLY N . 15102 1 264 . 1 1 30 30 LEU H H 1 7.801 0.02 . 1 . . . . 30 LEU H . 15102 1 265 . 1 1 30 30 LEU HA H 1 4.080 0.02 . 1 . . . . 30 LEU HA . 15102 1 266 . 1 1 30 30 LEU HB2 H 1 1.67047 0.02 . 2 . . . . 30 LEU HB2 . 15102 1 267 . 1 1 30 30 LEU HB3 H 1 1.50048 0.02 . 2 . . . . 30 LEU HB3 . 15102 1 268 . 1 1 30 30 LEU HG H 1 1.499 0.02 . 1 . . . . 30 LEU HG . 15102 1 269 . 1 1 30 30 LEU HD11 H 1 0.810 0.02 . 1 . . . . 30 LEU QQD . 15102 1 270 . 1 1 30 30 LEU HD12 H 1 0.810 0.02 . 1 . . . . 30 LEU QQD . 15102 1 271 . 1 1 30 30 LEU HD13 H 1 0.810 0.02 . 1 . . . . 30 LEU QQD . 15102 1 272 . 1 1 30 30 LEU HD21 H 1 0.810 0.02 . 1 . . . . 30 LEU QQD . 15102 1 273 . 1 1 30 30 LEU HD22 H 1 0.810 0.02 . 1 . . . . 30 LEU QQD . 15102 1 274 . 1 1 30 30 LEU HD23 H 1 0.810 0.02 . 1 . . . . 30 LEU QQD . 15102 1 275 . 1 1 30 30 LEU C C 13 177.289 0.1 . 1 . . . . 30 LEU C . 15102 1 276 . 1 1 30 30 LEU CA C 13 55.951 0.1 . 1 . . . . 30 LEU CA . 15102 1 277 . 1 1 30 30 LEU CB C 13 41.191 0.1 . 1 . . . . 30 LEU CB . 15102 1 278 . 1 1 30 30 LEU N N 15 120.667 0.2 . 1 . . . . 30 LEU N . 15102 1 279 . 1 1 31 31 ALA H H 1 7.897 0.02 . 1 . . . . 31 ALA H . 15102 1 280 . 1 1 31 31 ALA HB1 H 1 1.329 0.02 . 1 . . . . 31 ALA QB . 15102 1 281 . 1 1 31 31 ALA HB2 H 1 1.329 0.02 . 1 . . . . 31 ALA QB . 15102 1 282 . 1 1 31 31 ALA HB3 H 1 1.329 0.02 . 1 . . . . 31 ALA QB . 15102 1 283 . 1 1 31 31 ALA C C 13 177.727 0.1 . 1 . . . . 31 ALA C . 15102 1 284 . 1 1 31 31 ALA CA C 13 52.681 0.1 . 1 . . . . 31 ALA CA . 15102 1 285 . 1 1 31 31 ALA CB C 13 18.009 0.1 . 1 . . . . 31 ALA CB . 15102 1 286 . 1 1 31 31 ALA N N 15 119.861 0.2 . 1 . . . . 31 ALA N . 15102 1 287 . 1 1 32 32 ARG H H 1 7.795 0.02 . 1 . . . . 32 ARG H . 15102 1 288 . 1 1 32 32 ARG HB2 H 1 1.728 0.02 . 2 . . . . 32 ARG HB2 . 15102 1 289 . 1 1 32 32 ARG HB3 H 1 1.591 0.02 . 2 . . . . 32 ARG HB3 . 15102 1 290 . 1 1 32 32 ARG C C 13 176.225 0.1 . 1 . . . . 32 ARG C . 15102 1 291 . 1 1 32 32 ARG CA C 13 55.948 0.1 . 1 . . . . 32 ARG CA . 15102 1 292 . 1 1 32 32 ARG CB C 13 29.605 0.1 . 1 . . . . 32 ARG CB . 15102 1 293 . 1 1 32 32 ARG N N 15 116.855 0.2 . 1 . . . . 32 ARG N . 15102 1 294 . 1 1 33 33 ARG H H 1 7.942 0.02 . 1 . . . . 33 ARG H . 15102 1 295 . 1 1 33 33 ARG C C 13 175.471 0.1 . 1 . . . . 33 ARG C . 15102 1 296 . 1 1 33 33 ARG CA C 13 55.270 0.1 . 1 . . . . 33 ARG CA . 15102 1 297 . 1 1 33 33 ARG CB C 13 29.868 0.1 . 1 . . . . 33 ARG CB . 15102 1 298 . 1 1 33 33 ARG N N 15 119.476 0.2 . 1 . . . . 33 ARG N . 15102 1 299 . 1 1 34 34 SER H H 1 8.055 0.02 . 1 . . . . 34 SER H . 15102 1 300 . 1 1 34 34 SER HB2 H 1 3.838 0.02 . 1 . . . . 34 SER QB . 15102 1 301 . 1 1 34 34 SER HB3 H 1 3.838 0.02 . 1 . . . . 34 SER QB . 15102 1 302 . 1 1 34 34 SER CA C 13 56.067 0.1 . 1 . . . . 34 SER CA . 15102 1 303 . 1 1 34 34 SER CB C 13 62.956 0.1 . 1 . . . . 34 SER CB . 15102 1 304 . 1 1 34 34 SER N N 15 116.290 0.2 . 1 . . . . 34 SER N . 15102 1 305 . 1 1 35 35 PRO HA H 1 4.124 0.02 . 1 . . . . 35 PRO HA . 15102 1 306 . 1 1 35 35 PRO HB2 H 1 1.673 0.02 . 2 . . . . 35 PRO HB2 . 15102 1 307 . 1 1 35 35 PRO HB3 H 1 1.534 0.02 . 2 . . . . 35 PRO HB3 . 15102 1 308 . 1 1 35 35 PRO HG2 H 1 1.298 0.02 . 1 . . . . 35 PRO QG . 15102 1 309 . 1 1 35 35 PRO HG3 H 1 1.298 0.02 . 1 . . . . 35 PRO QG . 15102 1 310 . 1 1 35 35 PRO HD2 H 1 2.851 0.02 . 1 . . . . 35 PRO QD . 15102 1 311 . 1 1 35 35 PRO HD3 H 1 2.851 0.02 . 1 . . . . 35 PRO QD . 15102 1 312 . 1 1 35 35 PRO C C 13 176.415 0.1 . 1 . . . . 35 PRO C . 15102 1 313 . 1 1 35 35 PRO CA C 13 62.988 0.1 . 1 . . . . 35 PRO CA . 15102 1 314 . 1 1 35 35 PRO CB C 13 31.057 0.1 . 1 . . . . 35 PRO CB . 15102 1 315 . 1 1 36 36 ARG H H 1 8.333 0.02 . 1 . . . . 36 ARG H . 15102 1 316 . 1 1 36 36 ARG HA H 1 4.345 0.02 . 1 . . . . 36 ARG HA . 15102 1 317 . 1 1 36 36 ARG HB2 H 1 1.667 0.02 . 2 . . . . 36 ARG HB2 . 15102 1 318 . 1 1 36 36 ARG HB3 H 1 1.803 0.02 . 2 . . . . 36 ARG HB3 . 15102 1 319 . 1 1 36 36 ARG HG2 H 1 1.540 0.02 . 1 . . . . 36 ARG QG . 15102 1 320 . 1 1 36 36 ARG HG3 H 1 1.540 0.02 . 1 . . . . 36 ARG QG . 15102 1 321 . 1 1 36 36 ARG HD2 H 1 3.102 0.02 . 1 . . . . 36 ARG QD . 15102 1 322 . 1 1 36 36 ARG HD3 H 1 3.102 0.02 . 1 . . . . 36 ARG QD . 15102 1 323 . 1 1 36 36 ARG C C 13 176.241 0.1 . 1 . . . . 36 ARG C . 15102 1 324 . 1 1 36 36 ARG CA C 13 55.373 0.1 . 1 . . . . 36 ARG CA . 15102 1 325 . 1 1 36 36 ARG CB C 13 30.086 0.1 . 1 . . . . 36 ARG CB . 15102 1 326 . 1 1 36 36 ARG N N 15 119.666 0.2 . 1 . . . . 36 ARG N . 15102 1 327 . 1 1 37 37 SER H H 1 8.344 0.02 . 1 . . . . 37 SER H . 15102 1 328 . 1 1 37 37 SER HB2 H 1 3.898 0.02 . 2 . . . . 37 SER HB2 . 15102 1 329 . 1 1 37 37 SER HB3 H 1 3.790 0.02 . 2 . . . . 37 SER HB3 . 15102 1 330 . 1 1 37 37 SER C C 13 175.123 0.1 . 1 . . . . 37 SER C . 15102 1 331 . 1 1 37 37 SER CA C 13 58.082 0.1 . 1 . . . . 37 SER CA . 15102 1 332 . 1 1 37 37 SER CB C 13 63.469 0.1 . 1 . . . . 37 SER CB . 15102 1 333 . 1 1 37 37 SER N N 15 115.986 0.2 . 1 . . . . 37 SER N . 15102 1 334 . 1 1 38 38 GLY H H 1 8.522 0.02 . 1 . . . . 38 GLY H . 15102 1 335 . 1 1 38 38 GLY HA2 H 1 3.909 0.02 . 1 . . . . 38 GLY QA . 15102 1 336 . 1 1 38 38 GLY HA3 H 1 3.909 0.02 . 1 . . . . 38 GLY QA . 15102 1 337 . 1 1 38 38 GLY C C 13 174.027 0.1 . 1 . . . . 38 GLY C . 15102 1 338 . 1 1 38 38 GLY CA C 13 45.331 0.1 . 1 . . . . 38 GLY CA . 15102 1 339 . 1 1 38 38 GLY N N 15 110.719 0.2 . 1 . . . . 38 GLY N . 15102 1 340 . 1 1 39 39 ASP H H 1 8.156 0.02 . 1 . . . . 39 ASP H . 15102 1 341 . 1 1 39 39 ASP HA H 1 4.563 0.02 . 1 . . . . 39 ASP HA . 15102 1 342 . 1 1 39 39 ASP HB2 H 1 2.646 0.02 . 1 . . . . 39 ASP QB . 15102 1 343 . 1 1 39 39 ASP HB3 H 1 2.646 0.02 . 1 . . . . 39 ASP QB . 15102 1 344 . 1 1 39 39 ASP C C 13 176.787 0.1 . 1 . . . . 39 ASP C . 15102 1 345 . 1 1 39 39 ASP CA C 13 53.844 0.1 . 1 . . . . 39 ASP CA . 15102 1 346 . 1 1 39 39 ASP CB C 13 40.484 0.1 . 1 . . . . 39 ASP CB . 15102 1 347 . 1 1 39 39 ASP N N 15 119.663 0.2 . 1 . . . . 39 ASP N . 15102 1 348 . 1 1 40 40 GLY H H 1 8.464 0.02 . 1 . . . . 40 GLY H . 15102 1 349 . 1 1 40 40 GLY HA2 H 1 3.821 0.02 . 1 . . . . 40 GLY QA . 15102 1 350 . 1 1 40 40 GLY HA3 H 1 3.821 0.02 . 1 . . . . 40 GLY QA . 15102 1 351 . 1 1 40 40 GLY C C 13 174.786 0.1 . 1 . . . . 40 GLY C . 15102 1 352 . 1 1 40 40 GLY CA C 13 45.917 0.1 . 1 . . . . 40 GLY CA . 15102 1 353 . 1 1 40 40 GLY N N 15 109.532 0.2 . 1 . . . . 40 GLY N . 15102 1 354 . 1 1 41 41 LYS H H 1 8.123 0.02 . 1 . . . . 41 LYS H . 15102 1 355 . 1 1 41 41 LYS HG2 H 1 1.382 0.02 . 1 . . . . 41 LYS QG . 15102 1 356 . 1 1 41 41 LYS HG3 H 1 1.382 0.02 . 1 . . . . 41 LYS QG . 15102 1 357 . 1 1 41 41 LYS HD2 H 1 1.749 0.02 . 1 . . . . 41 LYS QD . 15102 1 358 . 1 1 41 41 LYS HD3 H 1 1.749 0.02 . 1 . . . . 41 LYS QD . 15102 1 359 . 1 1 41 41 LYS C C 13 177.259 0.1 . 1 . . . . 41 LYS C . 15102 1 360 . 1 1 41 41 LYS CA C 13 57.848 0.1 . 1 . . . . 41 LYS CA . 15102 1 361 . 1 1 41 41 LYS CB C 13 31.679 0.1 . 1 . . . . 41 LYS CB . 15102 1 362 . 1 1 41 41 LYS N N 15 120.329 0.2 . 1 . . . . 41 LYS N . 15102 1 363 . 1 1 42 42 LEU H H 1 8.075 0.02 . 1 . . . . 42 LEU H . 15102 1 364 . 1 1 42 42 LEU C C 13 176.844 0.1 . 1 . . . . 42 LEU C . 15102 1 365 . 1 1 42 42 LEU CA C 13 56.198 0.1 . 1 . . . . 42 LEU CA . 15102 1 366 . 1 1 42 42 LEU N N 15 119.834 0.2 . 1 . . . . 42 LEU N . 15102 1 367 . 1 1 43 43 GLU H H 1 8.124 0.02 . 1 . . . . 43 GLU H . 15102 1 368 . 1 1 43 43 GLU CA C 13 58.411 0.1 . 1 . . . . 43 GLU CA . 15102 1 369 . 1 1 43 43 GLU N N 15 120.860 0.2 . 1 . . . . 43 GLU N . 15102 1 370 . 1 1 44 44 ALA C C 13 177.142 0.1 . 1 . . . . 44 ALA C . 15102 1 371 . 1 1 44 44 ALA CA C 13 52.109 0.1 . 1 . . . . 44 ALA CA . 15102 1 372 . 1 1 44 44 ALA CB C 13 18.489 0.1 . 1 . . . . 44 ALA CB . 15102 1 373 . 1 1 45 45 LEU H H 1 7.852 0.02 . 1 . . . . 45 LEU H . 15102 1 374 . 1 1 45 45 LEU C C 13 176.338 0.1 . 1 . . . . 45 LEU C . 15102 1 375 . 1 1 45 45 LEU CA C 13 55.498 0.1 . 1 . . . . 45 LEU CA . 15102 1 376 . 1 1 45 45 LEU CB C 13 29.753 0.1 . 1 . . . . 45 LEU CB . 15102 1 377 . 1 1 45 45 LEU N N 15 117.694 0.2 . 1 . . . . 45 LEU N . 15102 1 378 . 1 1 46 46 TYR H H 1 7.892 0.02 . 1 . . . . 46 TYR H . 15102 1 379 . 1 1 46 46 TYR HA H 1 4.383 0.02 . 1 . . . . 46 TYR HA . 15102 1 380 . 1 1 46 46 TYR HB2 H 1 2.670 0.02 . 1 . . . . 46 TYR QB . 15102 1 381 . 1 1 46 46 TYR HB3 H 1 2.670 0.02 . 1 . . . . 46 TYR QB . 15102 1 382 . 1 1 46 46 TYR C C 13 177.789 0.1 . 1 . . . . 46 TYR C . 15102 1 383 . 1 1 46 46 TYR CA C 13 58.900 0.1 . 1 . . . . 46 TYR CA . 15102 1 384 . 1 1 46 46 TYR N N 15 120.873 0.2 . 1 . . . . 46 TYR N . 15102 1 385 . 1 1 47 47 VAL H H 1 8.057 0.02 . 1 . . . . 47 VAL H . 15102 1 386 . 1 1 47 47 VAL C C 13 177.868 0.1 . 1 . . . . 47 VAL C . 15102 1 387 . 1 1 47 47 VAL CA C 13 66.746 0.1 . 1 . . . . 47 VAL CA . 15102 1 388 . 1 1 47 47 VAL CB C 13 30.603 0.1 . 1 . . . . 47 VAL CB . 15102 1 389 . 1 1 47 47 VAL N N 15 118.541 0.2 . 1 . . . . 47 VAL N . 15102 1 390 . 1 1 48 48 LEU H H 1 8.467 0.02 . 1 . . . . 48 LEU H . 15102 1 391 . 1 1 48 48 LEU HD11 H 1 0.790 0.02 . 1 . . . . 48 LEU QQD . 15102 1 392 . 1 1 48 48 LEU HD12 H 1 0.790 0.02 . 1 . . . . 48 LEU QQD . 15102 1 393 . 1 1 48 48 LEU HD13 H 1 0.790 0.02 . 1 . . . . 48 LEU QQD . 15102 1 394 . 1 1 48 48 LEU HD21 H 1 0.790 0.02 . 1 . . . . 48 LEU QQD . 15102 1 395 . 1 1 48 48 LEU HD22 H 1 0.790 0.02 . 1 . . . . 48 LEU QQD . 15102 1 396 . 1 1 48 48 LEU HD23 H 1 0.790 0.02 . 1 . . . . 48 LEU QQD . 15102 1 397 . 1 1 48 48 LEU C C 13 178.579 0.1 . 1 . . . . 48 LEU C . 15102 1 398 . 1 1 48 48 LEU CA C 13 57.845 0.1 . 1 . . . . 48 LEU CA . 15102 1 399 . 1 1 48 48 LEU CB C 13 40.512 0.1 . 1 . . . . 48 LEU CB . 15102 1 400 . 1 1 48 48 LEU N N 15 118.746 0.2 . 1 . . . . 48 LEU N . 15102 1 401 . 1 1 49 49 MET H H 1 8.320 0.02 . 1 . . . . 49 MET H . 15102 1 402 . 1 1 49 49 MET CA C 13 58.982 0.1 . 1 . . . . 49 MET CA . 15102 1 403 . 1 1 49 49 MET N N 15 116.903 0.2 . 1 . . . . 49 MET N . 15102 1 404 . 1 1 50 50 VAL C C 13 176.312 0.1 . 1 . . . . 50 VAL C . 15102 1 405 . 1 1 50 50 VAL CA C 13 67.110 0.1 . 1 . . . . 50 VAL CA . 15102 1 406 . 1 1 51 51 LEU H H 1 8.166 0.02 . 1 . . . . 51 LEU H . 15102 1 407 . 1 1 51 51 LEU C C 13 179.154 0.1 . 1 . . . . 51 LEU C . 15102 1 408 . 1 1 51 51 LEU CA C 13 57.679 0.1 . 1 . . . . 51 LEU CA . 15102 1 409 . 1 1 51 51 LEU CB C 13 40.428 0.1 . 1 . . . . 51 LEU CB . 15102 1 410 . 1 1 51 51 LEU N N 15 121.032 0.2 . 1 . . . . 51 LEU N . 15102 1 411 . 1 1 52 52 GLY H H 1 8.871 0.02 . 1 . . . . 52 GLY H . 15102 1 412 . 1 1 52 52 GLY C C 13 174.684 0.1 . 1 . . . . 52 GLY C . 15102 1 413 . 1 1 52 52 GLY CA C 13 46.944 0.1 . 1 . . . . 52 GLY CA . 15102 1 414 . 1 1 52 52 GLY N N 15 106.337 0.2 . 1 . . . . 52 GLY N . 15102 1 415 . 1 1 53 53 PHE H H 1 8.591 0.02 . 1 . . . . 53 PHE H . 15102 1 416 . 1 1 53 53 PHE HB2 H 1 3.100 0.02 . 1 . . . . 53 PHE QB . 15102 1 417 . 1 1 53 53 PHE HB3 H 1 3.100 0.02 . 1 . . . . 53 PHE QB . 15102 1 418 . 1 1 53 53 PHE C C 13 177.288 0.1 . 1 . . . . 53 PHE C . 15102 1 419 . 1 1 53 53 PHE CA C 13 61.716 0.1 . 1 . . . . 53 PHE CA . 15102 1 420 . 1 1 53 53 PHE CB C 13 38.203 0.1 . 1 . . . . 53 PHE CB . 15102 1 421 . 1 1 53 53 PHE N N 15 121.321 0.2 . 1 . . . . 53 PHE N . 15102 1 422 . 1 1 54 54 PHE H H 1 8.709 0.02 . 1 . . . . 54 PHE H . 15102 1 423 . 1 1 54 54 PHE HB2 H 1 3.107 0.02 . 1 . . . . 54 PHE QB . 15102 1 424 . 1 1 54 54 PHE HB3 H 1 3.107 0.02 . 1 . . . . 54 PHE QB . 15102 1 425 . 1 1 54 54 PHE C C 13 179.168 0.1 . 1 . . . . 54 PHE C . 15102 1 426 . 1 1 54 54 PHE CA C 13 61.494 0.1 . 1 . . . . 54 PHE CA . 15102 1 427 . 1 1 54 54 PHE CB C 13 37.986 0.1 . 1 . . . . 54 PHE CB . 15102 1 428 . 1 1 54 54 PHE N N 15 117.430 0.2 . 1 . . . . 54 PHE N . 15102 1 429 . 1 1 55 55 GLY H H 1 9.197 0.02 . 1 . . . . 55 GLY H . 15102 1 430 . 1 1 55 55 GLY C C 13 173.811 0.1 . 1 . . . . 55 GLY C . 15102 1 431 . 1 1 55 55 GLY CA C 13 47.112 0.1 . 1 . . . . 55 GLY CA . 15102 1 432 . 1 1 55 55 GLY N N 15 109.945 0.2 . 1 . . . . 55 GLY N . 15102 1 433 . 1 1 56 56 PHE H H 1 8.573 0.02 . 1 . . . . 56 PHE H . 15102 1 434 . 1 1 56 56 PHE HB2 H 1 3.004 0.02 . 1 . . . . 56 PHE QB . 15102 1 435 . 1 1 56 56 PHE HB3 H 1 3.004 0.02 . 1 . . . . 56 PHE QB . 15102 1 436 . 1 1 56 56 PHE C C 13 177.282 0.1 . 1 . . . . 56 PHE C . 15102 1 437 . 1 1 56 56 PHE CA C 13 61.321 0.1 . 1 . . . . 56 PHE CA . 15102 1 438 . 1 1 56 56 PHE CB C 13 38.142 0.1 . 1 . . . . 56 PHE CB . 15102 1 439 . 1 1 56 56 PHE N N 15 121.059 0.2 . 1 . . . . 56 PHE N . 15102 1 440 . 1 1 57 57 PHE H H 1 8.502 0.02 . 1 . . . . 57 PHE H . 15102 1 441 . 1 1 57 57 PHE C C 13 177.187 0.1 . 1 . . . . 57 PHE C . 15102 1 442 . 1 1 57 57 PHE CA C 13 60.919 0.1 . 1 . . . . 57 PHE CA . 15102 1 443 . 1 1 57 57 PHE N N 15 118.159 0.2 . 1 . . . . 57 PHE N . 15102 1 444 . 1 1 58 58 THR H H 1 8.085 0.02 . 1 . . . . 58 THR H . 15102 1 445 . 1 1 58 58 THR C C 13 177.491 0.1 . 1 . . . . 58 THR C . 15102 1 446 . 1 1 58 58 THR CA C 13 65.580 0.1 . 1 . . . . 58 THR CA . 15102 1 447 . 1 1 58 58 THR N N 15 118.723 0.2 . 1 . . . . 58 THR N . 15102 1 448 . 1 1 59 59 LEU H H 1 8.183 0.02 . 1 . . . . 59 LEU H . 15102 1 449 . 1 1 59 59 LEU C C 13 175.698 0.1 . 1 . . . . 59 LEU C . 15102 1 450 . 1 1 59 59 LEU CA C 13 57.854 0.1 . 1 . . . . 59 LEU CA . 15102 1 451 . 1 1 59 59 LEU N N 15 118.379 0.2 . 1 . . . . 59 LEU N . 15102 1 452 . 1 1 60 60 GLY H H 1 8.320 0.02 . 1 . . . . 60 GLY H . 15102 1 453 . 1 1 60 60 GLY C C 13 174.837 0.1 . 1 . . . . 60 GLY C . 15102 1 454 . 1 1 60 60 GLY CA C 13 47.180 0.1 . 1 . . . . 60 GLY CA . 15102 1 455 . 1 1 60 60 GLY N N 15 105.629 0.2 . 1 . . . . 60 GLY N . 15102 1 456 . 1 1 61 61 ILE H H 1 8.180 0.02 . 1 . . . . 61 ILE H . 15102 1 457 . 1 1 61 61 ILE CA C 13 58.080 0.1 . 1 . . . . 61 ILE CA . 15102 1 458 . 1 1 61 61 ILE N N 15 120.363 0.2 . 1 . . . . 61 ILE N . 15102 1 459 . 1 1 62 62 MET HG2 H 1 2.568 0.02 . 1 . . . . 62 MET QG . 15102 1 460 . 1 1 62 62 MET HG3 H 1 2.568 0.02 . 1 . . . . 62 MET QG . 15102 1 461 . 1 1 62 62 MET HE1 H 1 2.327 0.02 . 1 . . . . 62 MET QE . 15102 1 462 . 1 1 62 62 MET HE2 H 1 2.327 0.02 . 1 . . . . 62 MET QE . 15102 1 463 . 1 1 62 62 MET HE3 H 1 2.327 0.02 . 1 . . . . 62 MET QE . 15102 1 464 . 1 1 62 62 MET C C 13 178.272 0.1 . 1 . . . . 62 MET C . 15102 1 465 . 1 1 62 62 MET CA C 13 58.759 0.1 . 1 . . . . 62 MET CA . 15102 1 466 . 1 1 63 63 LEU H H 1 8.776 0.02 . 1 . . . . 63 LEU H . 15102 1 467 . 1 1 63 63 LEU HD11 H 1 0.764 0.02 . 1 . . . . 63 LEU QQD . 15102 1 468 . 1 1 63 63 LEU HD12 H 1 0.764 0.02 . 1 . . . . 63 LEU QQD . 15102 1 469 . 1 1 63 63 LEU HD13 H 1 0.764 0.02 . 1 . . . . 63 LEU QQD . 15102 1 470 . 1 1 63 63 LEU HD21 H 1 0.764 0.02 . 1 . . . . 63 LEU QQD . 15102 1 471 . 1 1 63 63 LEU HD22 H 1 0.764 0.02 . 1 . . . . 63 LEU QQD . 15102 1 472 . 1 1 63 63 LEU HD23 H 1 0.764 0.02 . 1 . . . . 63 LEU QQD . 15102 1 473 . 1 1 63 63 LEU C C 13 179.063 0.1 . 1 . . . . 63 LEU C . 15102 1 474 . 1 1 63 63 LEU CA C 13 57.554 0.1 . 1 . . . . 63 LEU CA . 15102 1 475 . 1 1 63 63 LEU CB C 13 40.483 0.1 . 1 . . . . 63 LEU CB . 15102 1 476 . 1 1 63 63 LEU N N 15 118.080 0.2 . 1 . . . . 63 LEU N . 15102 1 477 . 1 1 64 64 SER H H 1 7.997 0.02 . 1 . . . . 64 SER H . 15102 1 478 . 1 1 64 64 SER HB2 H 1 3.984 0.02 . 1 . . . . 64 SER QB . 15102 1 479 . 1 1 64 64 SER HB3 H 1 3.984 0.02 . 1 . . . . 64 SER QB . 15102 1 480 . 1 1 64 64 SER C C 13 176.653 0.1 . 1 . . . . 64 SER C . 15102 1 481 . 1 1 64 64 SER CA C 13 61.856 0.1 . 1 . . . . 64 SER CA . 15102 1 482 . 1 1 64 64 SER CB C 13 62.288 0.1 . 1 . . . . 64 SER CB . 15102 1 483 . 1 1 64 64 SER N N 15 114.469 0.2 . 1 . . . . 64 SER N . 15102 1 484 . 1 1 65 65 TYR H H 1 8.355 0.02 . 1 . . . . 65 TYR H . 15102 1 485 . 1 1 65 65 TYR HB2 H 1 3.143 0.02 . 1 . . . . 65 TYR QB . 15102 1 486 . 1 1 65 65 TYR HB3 H 1 3.143 0.02 . 1 . . . . 65 TYR QB . 15102 1 487 . 1 1 65 65 TYR C C 13 177.868 0.1 . 1 . . . . 65 TYR C . 15102 1 488 . 1 1 65 65 TYR CA C 13 61.145 0.1 . 1 . . . . 65 TYR CA . 15102 1 489 . 1 1 65 65 TYR CB C 13 37.734 0.1 . 1 . . . . 65 TYR CB . 15102 1 490 . 1 1 65 65 TYR N N 15 123.099 0.2 . 1 . . . . 65 TYR N . 15102 1 491 . 1 1 66 66 ILE H H 1 8.468 0.02 . 1 . . . . 66 ILE H . 15102 1 492 . 1 1 66 66 ILE HB H 1 1.799 0.02 . 1 . . . . 66 ILE HB . 15102 1 493 . 1 1 66 66 ILE HD11 H 1 0.823 0.02 . 1 . . . . 66 ILE QD1 . 15102 1 494 . 1 1 66 66 ILE HD12 H 1 0.823 0.02 . 1 . . . . 66 ILE QD1 . 15102 1 495 . 1 1 66 66 ILE HD13 H 1 0.823 0.02 . 1 . . . . 66 ILE QD1 . 15102 1 496 . 1 1 66 66 ILE C C 13 178.105 0.1 . 1 . . . . 66 ILE C . 15102 1 497 . 1 1 66 66 ILE CA C 13 64.438 0.1 . 1 . . . . 66 ILE CA . 15102 1 498 . 1 1 66 66 ILE CB C 13 37.042 0.1 . 1 . . . . 66 ILE CB . 15102 1 499 . 1 1 66 66 ILE N N 15 119.005 0.2 . 1 . . . . 66 ILE N . 15102 1 500 . 1 1 67 67 ARG H H 1 8.245 0.02 . 1 . . . . 67 ARG H . 15102 1 501 . 1 1 67 67 ARG C C 13 177.918 0.1 . 1 . . . . 67 ARG C . 15102 1 502 . 1 1 67 67 ARG CA C 13 58.434 0.1 . 1 . . . . 67 ARG CA . 15102 1 503 . 1 1 67 67 ARG CB C 13 28.913 0.1 . 1 . . . . 67 ARG CB . 15102 1 504 . 1 1 67 67 ARG N N 15 118.744 0.2 . 1 . . . . 67 ARG N . 15102 1 505 . 1 1 68 68 SER H H 1 7.899 0.02 . 1 . . . . 68 SER H . 15102 1 506 . 1 1 68 68 SER HB2 H 1 3.906 0.02 . 1 . . . . 68 SER QB . 15102 1 507 . 1 1 68 68 SER HB3 H 1 3.906 0.02 . 1 . . . . 68 SER QB . 15102 1 508 . 1 1 68 68 SER C C 13 175.751 0.1 . 1 . . . . 68 SER C . 15102 1 509 . 1 1 68 68 SER CA C 13 60.440 0.1 . 1 . . . . 68 SER CA . 15102 1 510 . 1 1 68 68 SER CB C 13 62.519 0.1 . 1 . . . . 68 SER CB . 15102 1 511 . 1 1 68 68 SER N N 15 114.056 0.2 . 1 . . . . 68 SER N . 15102 1 512 . 1 1 69 69 LYS H H 1 7.751 0.02 . 1 . . . . 69 LYS H . 15102 1 513 . 1 1 69 69 LYS C C 13 177.579 0.1 . 1 . . . . 69 LYS C . 15102 1 514 . 1 1 69 69 LYS CA C 13 56.236 0.1 . 1 . . . . 69 LYS CA . 15102 1 515 . 1 1 69 69 LYS CB C 13 30.765 0.1 . 1 . . . . 69 LYS CB . 15102 1 516 . 1 1 69 69 LYS N N 15 120.394 0.2 . 1 . . . . 69 LYS N . 15102 1 517 . 1 1 70 70 LYS H H 1 7.887 0.02 . 1 . . . . 70 LYS H . 15102 1 518 . 1 1 70 70 LYS HB2 H 1 1.740 0.02 . 2 . . . . 70 LYS HB2 . 15102 1 519 . 1 1 70 70 LYS HB3 H 1 1.613 0.02 . 2 . . . . 70 LYS HB3 . 15102 1 520 . 1 1 70 70 LYS HG2 H 1 1.328 0.02 . 1 . . . . 70 LYS QG . 15102 1 521 . 1 1 70 70 LYS HG3 H 1 1.328 0.02 . 1 . . . . 70 LYS QG . 15102 1 522 . 1 1 70 70 LYS C C 13 177.454 0.1 . 1 . . . . 70 LYS C . 15102 1 523 . 1 1 70 70 LYS CA C 13 56.671 0.1 . 1 . . . . 70 LYS CA . 15102 1 524 . 1 1 70 70 LYS CB C 13 31.311 0.1 . 1 . . . . 70 LYS CB . 15102 1 525 . 1 1 70 70 LYS N N 15 118.737 0.2 . 1 . . . . 70 LYS N . 15102 1 526 . 1 1 71 71 LEU H H 1 7.897 0.02 . 1 . . . . 71 LEU H . 15102 1 527 . 1 1 71 71 LEU C C 13 177.629 0.1 . 1 . . . . 71 LEU C . 15102 1 528 . 1 1 71 71 LEU CA C 13 55.128 0.1 . 1 . . . . 71 LEU CA . 15102 1 529 . 1 1 71 71 LEU CB C 13 41.164 0.1 . 1 . . . . 71 LEU CB . 15102 1 530 . 1 1 71 71 LEU N N 15 120.056 0.2 . 1 . . . . 71 LEU N . 15102 1 531 . 1 1 72 72 GLU H H 1 8.070 0.02 . 1 . . . . 72 GLU H . 15102 1 532 . 1 1 72 72 GLU HB2 H 1 2.161 0.02 . 2 . . . . 72 GLU HB2 . 15102 1 533 . 1 1 72 72 GLU HB3 H 1 2.059 0.02 . 2 . . . . 72 GLU HB3 . 15102 1 534 . 1 1 72 72 GLU C C 13 177.134 0.1 . 1 . . . . 72 GLU C . 15102 1 535 . 1 1 72 72 GLU CA C 13 56.522 0.1 . 1 . . . . 72 GLU CA . 15102 1 536 . 1 1 72 72 GLU CB C 13 29.075 0.1 . 1 . . . . 72 GLU CB . 15102 1 537 . 1 1 72 72 GLU N N 15 119.437 0.2 . 1 . . . . 72 GLU N . 15102 1 538 . 1 1 73 73 HIS H H 1 8.244 0.02 . 1 . . . . 73 HIS H . 15102 1 539 . 1 1 73 73 HIS HB2 H 1 3.226 0.02 . 2 . . . . 73 HIS HB2 . 15102 1 540 . 1 1 73 73 HIS HB3 H 1 3.070 0.02 . 2 . . . . 73 HIS HB3 . 15102 1 541 . 1 1 73 73 HIS C C 13 174.599 0.1 . 1 . . . . 73 HIS C . 15102 1 542 . 1 1 73 73 HIS CA C 13 55.053 0.1 . 1 . . . . 73 HIS CA . 15102 1 543 . 1 1 73 73 HIS CB C 13 28.202 0.1 . 1 . . . . 73 HIS CB . 15102 1 544 . 1 1 73 73 HIS N N 15 117.400 0.2 . 1 . . . . 73 HIS N . 15102 1 545 . 1 1 74 74 SER H H 1 8.194 0.02 . 1 . . . . 74 SER H . 15102 1 546 . 1 1 74 74 SER HB2 H 1 3.778 0.02 . 1 . . . . 74 SER QB . 15102 1 547 . 1 1 74 74 SER HB3 H 1 3.778 0.02 . 1 . . . . 74 SER QB . 15102 1 548 . 1 1 74 74 SER C C 13 174.152 0.1 . 1 . . . . 74 SER C . 15102 1 549 . 1 1 74 74 SER CA C 13 58.467 0.1 . 1 . . . . 74 SER CA . 15102 1 550 . 1 1 74 74 SER CB C 13 63.016 0.1 . 1 . . . . 74 SER CB . 15102 1 551 . 1 1 74 74 SER N N 15 115.821 0.2 . 1 . . . . 74 SER N . 15102 1 552 . 1 1 75 75 ASN H H 1 8.450 0.02 . 1 . . . . 75 ASN H . 15102 1 553 . 1 1 75 75 ASN HA H 1 4.672 0.02 . 1 . . . . 75 ASN HA . 15102 1 554 . 1 1 75 75 ASN HB2 H 1 2.747 0.02 . 2 . . . . 75 ASN HB2 . 15102 1 555 . 1 1 75 75 ASN HB3 H 1 2.638 0.02 . 2 . . . . 75 ASN HB3 . 15102 1 556 . 1 1 75 75 ASN C C 13 174.306 0.1 . 1 . . . . 75 ASN C . 15102 1 557 . 1 1 75 75 ASN CA C 13 52.680 0.1 . 1 . . . . 75 ASN CA . 15102 1 558 . 1 1 75 75 ASN CB C 13 38.439 0.1 . 1 . . . . 75 ASN CB . 15102 1 559 . 1 1 75 75 ASN N N 15 119.899 0.2 . 1 . . . . 75 ASN N . 15102 1 560 . 1 1 76 76 ASP H H 1 8.063 0.02 . 1 . . . . 76 ASP H . 15102 1 561 . 1 1 76 76 ASP CA C 13 52.056 0.1 . 1 . . . . 76 ASP CA . 15102 1 562 . 1 1 76 76 ASP CB C 13 40.614 0.1 . 1 . . . . 76 ASP CB . 15102 1 563 . 1 1 76 76 ASP N N 15 120.802 0.2 . 1 . . . . 76 ASP N . 15102 1 564 . 1 1 77 77 PRO HA H 1 4.247 0.02 . 1 . . . . 77 PRO HA . 15102 1 565 . 1 1 77 77 PRO HB2 H 1 2.048 0.02 . 2 . . . . 77 PRO HB2 . 15102 1 566 . 1 1 77 77 PRO HB3 H 1 1.797 0.02 . 2 . . . . 77 PRO HB3 . 15102 1 567 . 1 1 77 77 PRO HG2 H 1 1.551 0.02 . 1 . . . . 77 PRO QG . 15102 1 568 . 1 1 77 77 PRO HG3 H 1 1.551 0.02 . 1 . . . . 77 PRO QG . 15102 1 569 . 1 1 77 77 PRO HD2 H 1 3.680 0.02 . 2 . . . . 77 PRO HD2 . 15102 1 570 . 1 1 77 77 PRO HD3 H 1 3.571 0.02 . 2 . . . . 77 PRO HD3 . 15102 1 571 . 1 1 77 77 PRO C C 13 176.766 0.1 . 1 . . . . 77 PRO C . 15102 1 572 . 1 1 77 77 PRO CA C 13 63.636 0.1 . 1 . . . . 77 PRO CA . 15102 1 573 . 1 1 78 78 PHE H H 1 8.244 0.02 . 1 . . . . 78 PHE H . 15102 1 574 . 1 1 78 78 PHE HB2 H 1 3.079 0.02 . 2 . . . . 78 PHE HB2 . 15102 1 575 . 1 1 78 78 PHE HB3 H 1 2.972 0.02 . 2 . . . . 78 PHE HB3 . 15102 1 576 . 1 1 78 78 PHE C C 13 175.801 0.1 . 1 . . . . 78 PHE C . 15102 1 577 . 1 1 78 78 PHE CA C 13 58.469 0.1 . 1 . . . . 78 PHE CA . 15102 1 578 . 1 1 78 78 PHE N N 15 117.400 0.2 . 1 . . . . 78 PHE N . 15102 1 579 . 1 1 79 79 ASN H H 1 8.009 0.02 . 1 . . . . 79 ASN H . 15102 1 580 . 1 1 79 79 ASN HA H 1 4.430 0.02 . 1 . . . . 79 ASN HA . 15102 1 581 . 1 1 79 79 ASN HB2 H 1 2.662 0.02 . 1 . . . . 79 ASN QB . 15102 1 582 . 1 1 79 79 ASN HB3 H 1 2.662 0.02 . 1 . . . . 79 ASN QB . 15102 1 583 . 1 1 79 79 ASN C C 13 175.647 0.1 . 1 . . . . 79 ASN C . 15102 1 584 . 1 1 79 79 ASN CA C 13 54.323 0.1 . 1 . . . . 79 ASN CA . 15102 1 585 . 1 1 79 79 ASN CB C 13 38.264 0.1 . 1 . . . . 79 ASN CB . 15102 1 586 . 1 1 79 79 ASN N N 15 118.694 0.2 . 1 . . . . 79 ASN N . 15102 1 587 . 1 1 80 80 VAL H H 1 7.824 0.02 . 1 . . . . 80 VAL H . 15102 1 588 . 1 1 80 80 VAL HG11 H 1 0.867 0.02 . 1 . . . . 80 VAL QG1 . 15102 1 589 . 1 1 80 80 VAL HG12 H 1 0.867 0.02 . 1 . . . . 80 VAL QG1 . 15102 1 590 . 1 1 80 80 VAL HG13 H 1 0.867 0.02 . 1 . . . . 80 VAL QG1 . 15102 1 591 . 1 1 80 80 VAL HG21 H 1 0.751 0.02 . 1 . . . . 80 VAL QG2 . 15102 1 592 . 1 1 80 80 VAL HG22 H 1 0.751 0.02 . 1 . . . . 80 VAL QG2 . 15102 1 593 . 1 1 80 80 VAL HG23 H 1 0.751 0.02 . 1 . . . . 80 VAL QG2 . 15102 1 594 . 1 1 80 80 VAL C C 13 176.948 0.1 . 1 . . . . 80 VAL C . 15102 1 595 . 1 1 80 80 VAL CA C 13 63.169 0.1 . 1 . . . . 80 VAL CA . 15102 1 596 . 1 1 80 80 VAL CB C 13 31.690 0.1 . 1 . . . . 80 VAL CB . 15102 1 597 . 1 1 80 80 VAL N N 15 118.040 0.2 . 1 . . . . 80 VAL N . 15102 1 598 . 1 1 81 81 TYR H H 1 8.224 0.02 . 1 . . . . 81 TYR H . 15102 1 599 . 1 1 81 81 TYR HB2 H 1 3.101 0.02 . 2 . . . . 81 TYR HB2 . 15102 1 600 . 1 1 81 81 TYR HB3 H 1 3.173 0.02 . 2 . . . . 81 TYR HB3 . 15102 1 601 . 1 1 81 81 TYR C C 13 175.510 0.1 . 1 . . . . 81 TYR C . 15102 1 602 . 1 1 81 81 TYR CA C 13 57.963 0.1 . 1 . . . . 81 TYR CA . 15102 1 603 . 1 1 81 81 TYR CB C 13 38.263 0.1 . 1 . . . . 81 TYR CB . 15102 1 604 . 1 1 81 81 TYR N N 15 117.572 0.2 . 1 . . . . 81 TYR N . 15102 1 605 . 1 1 82 82 ILE H H 1 7.942 0.02 . 1 . . . . 82 ILE H . 15102 1 606 . 1 1 82 82 ILE CA C 13 53.161 0.1 . 1 . . . . 82 ILE CA . 15102 1 607 . 1 1 82 82 ILE CB C 13 38.356 0.1 . 1 . . . . 82 ILE CB . 15102 1 608 . 1 1 82 82 ILE N N 15 119.476 0.2 . 1 . . . . 82 ILE N . 15102 1 609 . 1 1 83 83 GLU C C 13 176.455 0.1 . 1 . . . . 83 GLU C . 15102 1 610 . 1 1 83 83 GLU CA C 13 56.111 0.1 . 1 . . . . 83 GLU CA . 15102 1 611 . 1 1 83 83 GLU CB C 13 28.815 0.1 . 1 . . . . 83 GLU CB . 15102 1 612 . 1 1 84 84 SER H H 1 7.995 0.02 . 1 . . . . 84 SER H . 15102 1 613 . 1 1 84 84 SER HB2 H 1 3.949 0.02 . 1 . . . . 84 SER QB . 15102 1 614 . 1 1 84 84 SER HB3 H 1 3.949 0.02 . 1 . . . . 84 SER QB . 15102 1 615 . 1 1 84 84 SER C C 13 174.695 0.1 . 1 . . . . 84 SER C . 15102 1 616 . 1 1 84 84 SER CA C 13 58.452 0.1 . 1 . . . . 84 SER CA . 15102 1 617 . 1 1 84 84 SER CB C 13 63.562 0.1 . 1 . . . . 84 SER CB . 15102 1 618 . 1 1 84 84 SER N N 15 115.821 0.2 . 1 . . . . 84 SER N . 15102 1 619 . 1 1 85 85 ASP H H 1 8.402 0.02 . 1 . . . . 85 ASP H . 15102 1 620 . 1 1 85 85 ASP HA H 1 4.460 0.02 . 1 . . . . 85 ASP HA . 15102 1 621 . 1 1 85 85 ASP HB2 H 1 2.584 0.02 . 1 . . . . 85 ASP QB . 15102 1 622 . 1 1 85 85 ASP HB3 H 1 2.584 0.02 . 1 . . . . 85 ASP QB . 15102 1 623 . 1 1 85 85 ASP C C 13 176.536 0.1 . 1 . . . . 85 ASP C . 15102 1 624 . 1 1 85 85 ASP CA C 13 54.820 0.1 . 1 . . . . 85 ASP CA . 15102 1 625 . 1 1 85 85 ASP CB C 13 39.941 0.1 . 1 . . . . 85 ASP CB . 15102 1 626 . 1 1 85 85 ASP N N 15 121.342 0.2 . 1 . . . . 85 ASP N . 15102 1 627 . 1 1 86 86 ALA H H 1 8.006 0.02 . 1 . . . . 86 ALA H . 15102 1 628 . 1 1 86 86 ALA HB1 H 1 1.222 0.02 . 1 . . . . 86 ALA QB . 15102 1 629 . 1 1 86 86 ALA HB2 H 1 1.222 0.02 . 1 . . . . 86 ALA QB . 15102 1 630 . 1 1 86 86 ALA HB3 H 1 1.222 0.02 . 1 . . . . 86 ALA QB . 15102 1 631 . 1 1 86 86 ALA C C 13 178.278 0.1 . 1 . . . . 86 ALA C . 15102 1 632 . 1 1 86 86 ALA CA C 13 53.392 0.1 . 1 . . . . 86 ALA CA . 15102 1 633 . 1 1 86 86 ALA CB C 13 18.018 0.1 . 1 . . . . 86 ALA CB . 15102 1 634 . 1 1 86 86 ALA N N 15 122.063 0.2 . 1 . . . . 86 ALA N . 15102 1 635 . 1 1 87 87 TRP H H 1 7.794 0.02 . 1 . . . . 87 TRP H . 15102 1 636 . 1 1 87 87 TRP CA C 13 57.605 0.1 . 1 . . . . 87 TRP CA . 15102 1 637 . 1 1 87 87 TRP CB C 13 28.930 0.1 . 1 . . . . 87 TRP CB . 15102 1 638 . 1 1 87 87 TRP N N 15 117.903 0.2 . 1 . . . . 87 TRP N . 15102 1 639 . 1 1 90 90 LYS C C 13 175.222 0.1 . 1 . . . . 90 LYS C . 15102 1 640 . 1 1 90 90 LYS CA C 13 55.522 0.1 . 1 . . . . 90 LYS CA . 15102 1 641 . 1 1 90 90 LYS CB C 13 29.846 0.1 . 1 . . . . 90 LYS CB . 15102 1 642 . 1 1 91 91 ASP H H 1 7.998 0.02 . 1 . . . . 91 ASP H . 15102 1 643 . 1 1 91 91 ASP CA C 13 55.522 0.1 . 1 . . . . 91 ASP CA . 15102 1 644 . 1 1 91 91 ASP N N 15 116.002 0.2 . 1 . . . . 91 ASP N . 15102 1 645 . 1 1 92 92 LYS C C 13 175.750 0.1 . 1 . . . . 92 LYS C . 15102 1 646 . 1 1 93 93 ALA H H 1 7.984 0.02 . 1 . . . . 93 ALA H . 15102 1 647 . 1 1 93 93 ALA HB1 H 1 1.357 0.02 . 1 . . . . 93 ALA QB . 15102 1 648 . 1 1 93 93 ALA HB2 H 1 1.357 0.02 . 1 . . . . 93 ALA QB . 15102 1 649 . 1 1 93 93 ALA HB3 H 1 1.357 0.02 . 1 . . . . 93 ALA QB . 15102 1 650 . 1 1 93 93 ALA C C 13 179.632 0.1 . 1 . . . . 93 ALA C . 15102 1 651 . 1 1 93 93 ALA CA C 13 53.763 0.1 . 1 . . . . 93 ALA CA . 15102 1 652 . 1 1 93 93 ALA N N 15 118.995 0.2 . 1 . . . . 93 ALA N . 15102 1 653 . 1 1 94 94 TYR H H 1 7.848 0.02 . 1 . . . . 94 TYR H . 15102 1 654 . 1 1 94 94 TYR HB2 H 1 3.145 0.02 . 1 . . . . 94 TYR QB . 15102 1 655 . 1 1 94 94 TYR HB3 H 1 3.145 0.02 . 1 . . . . 94 TYR QB . 15102 1 656 . 1 1 94 94 TYR C C 13 177.987 0.1 . 1 . . . . 94 TYR C . 15102 1 657 . 1 1 94 94 TYR CA C 13 60.180 0.1 . 1 . . . . 94 TYR CA . 15102 1 658 . 1 1 94 94 TYR CB C 13 36.863 0.1 . 1 . . . . 94 TYR CB . 15102 1 659 . 1 1 94 94 TYR N N 15 119.107 0.2 . 1 . . . . 94 TYR N . 15102 1 660 . 1 1 95 95 VAL H H 1 7.907 0.02 . 1 . . . . 95 VAL H . 15102 1 661 . 1 1 95 95 VAL HB H 1 2.281 0.02 . 1 . . . . 95 VAL HB . 15102 1 662 . 1 1 95 95 VAL HG11 H 1 1.03964 0.02 . 1 . . . . 95 VAL QG1 . 15102 1 663 . 1 1 95 95 VAL HG12 H 1 1.03964 0.02 . 1 . . . . 95 VAL QG1 . 15102 1 664 . 1 1 95 95 VAL HG13 H 1 1.03964 0.02 . 1 . . . . 95 VAL QG1 . 15102 1 665 . 1 1 95 95 VAL HG21 H 1 0.85713 0.02 . 1 . . . . 95 VAL QG2 . 15102 1 666 . 1 1 95 95 VAL HG22 H 1 0.85713 0.02 . 1 . . . . 95 VAL QG2 . 15102 1 667 . 1 1 95 95 VAL HG23 H 1 0.85713 0.02 . 1 . . . . 95 VAL QG2 . 15102 1 668 . 1 1 95 95 VAL C C 13 177.278 0.1 . 1 . . . . 95 VAL C . 15102 1 669 . 1 1 95 95 VAL CA C 13 66.621 0.1 . 1 . . . . 95 VAL CA . 15102 1 670 . 1 1 95 95 VAL CB C 13 30.458 0.1 . 1 . . . . 95 VAL CB . 15102 1 671 . 1 1 95 95 VAL N N 15 117.529 0.2 . 1 . . . . 95 VAL N . 15102 1 672 . 1 1 96 96 GLN H H 1 8.334 0.02 . 1 . . . . 96 GLN H . 15102 1 673 . 1 1 96 96 GLN N N 15 117.755 0.02 . 1 . . . . 96 GLN N . 15102 1 674 . 1 1 97 97 ALA HB1 H 1 1.370 0.02 . 1 . . . . 97 ALA QB . 15102 1 675 . 1 1 97 97 ALA HB2 H 1 1.370 0.02 . 1 . . . . 97 ALA QB . 15102 1 676 . 1 1 97 97 ALA HB3 H 1 1.370 0.02 . 1 . . . . 97 ALA QB . 15102 1 677 . 1 1 97 97 ALA C C 13 179.862 0.1 . 1 . . . . 97 ALA C . 15102 1 678 . 1 1 97 97 ALA CA C 13 54.212 0.1 . 1 . . . . 97 ALA CA . 15102 1 679 . 1 1 97 97 ALA CB C 13 17.405 0.1 . 1 . . . . 97 ALA CB . 15102 1 680 . 1 1 98 98 ARG H H 1 7.983 0.02 . 1 . . . . 98 ARG H . 15102 1 681 . 1 1 98 98 ARG HB2 H 1 1.724 0.02 . 1 . . . . 98 ARG QB . 15102 1 682 . 1 1 98 98 ARG HB3 H 1 1.724 0.02 . 1 . . . . 98 ARG QB . 15102 1 683 . 1 1 98 98 ARG C C 13 179.248 0.1 . 1 . . . . 98 ARG C . 15102 1 684 . 1 1 98 98 ARG CA C 13 57.269 0.1 . 1 . . . . 98 ARG CA . 15102 1 685 . 1 1 98 98 ARG CB C 13 28.900 0.1 . 1 . . . . 98 ARG CB . 15102 1 686 . 1 1 98 98 ARG N N 15 116.963 0.2 . 1 . . . . 98 ARG N . 15102 1 687 . 1 1 99 99 VAL H H 1 8.281 0.02 . 1 . . . . 99 VAL H . 15102 1 688 . 1 1 99 99 VAL HG11 H 1 0.963 0.02 . 1 . . . . 99 VAL QQG . 15102 1 689 . 1 1 99 99 VAL HG12 H 1 0.963 0.02 . 1 . . . . 99 VAL QQG . 15102 1 690 . 1 1 99 99 VAL HG13 H 1 0.963 0.02 . 1 . . . . 99 VAL QQG . 15102 1 691 . 1 1 99 99 VAL HG21 H 1 0.963 0.02 . 1 . . . . 99 VAL QQG . 15102 1 692 . 1 1 99 99 VAL HG22 H 1 0.963 0.02 . 1 . . . . 99 VAL QQG . 15102 1 693 . 1 1 99 99 VAL HG23 H 1 0.963 0.02 . 1 . . . . 99 VAL QQG . 15102 1 694 . 1 1 99 99 VAL C C 13 177.486 0.1 . 1 . . . . 99 VAL C . 15102 1 695 . 1 1 99 99 VAL CA C 13 65.701 0.1 . 1 . . . . 99 VAL CA . 15102 1 696 . 1 1 99 99 VAL CB C 13 28.975 0.1 . 1 . . . . 99 VAL CB . 15102 1 697 . 1 1 99 99 VAL N N 15 119.972 0.2 . 1 . . . . 99 VAL N . 15102 1 698 . 1 1 100 100 LEU H H 1 8.123 0.02 . 1 . . . . 100 LEU H . 15102 1 699 . 1 1 100 100 LEU C C 13 178.924 0.1 . 1 . . . . 100 LEU C . 15102 1 700 . 1 1 100 100 LEU CA C 13 57.369 0.1 . 1 . . . . 100 LEU CA . 15102 1 701 . 1 1 100 100 LEU N N 15 119.742 0.2 . 1 . . . . 100 LEU N . 15102 1 702 . 1 1 101 101 GLU H H 1 8.136 0.02 . 1 . . . . 101 GLU H . 15102 1 703 . 1 1 101 101 GLU HA H 1 4.028 0.02 . 1 . . . . 101 GLU HA . 15102 1 704 . 1 1 101 101 GLU HB2 H 1 2.049 0.02 . 1 . . . . 101 GLU QB . 15102 1 705 . 1 1 101 101 GLU HB3 H 1 2.049 0.02 . 1 . . . . 101 GLU QB . 15102 1 706 . 1 1 101 101 GLU HG2 H 1 2.292 0.02 . 1 . . . . 101 GLU QG . 15102 1 707 . 1 1 101 101 GLU HG3 H 1 2.292 0.02 . 1 . . . . 101 GLU QG . 15102 1 708 . 1 1 101 101 GLU C C 13 178.928 0.1 . 1 . . . . 101 GLU C . 15102 1 709 . 1 1 101 101 GLU CA C 13 58.203 0.1 . 1 . . . . 101 GLU CA . 15102 1 710 . 1 1 101 101 GLU CB C 13 28.663 0.1 . 1 . . . . 101 GLU CB . 15102 1 711 . 1 1 101 101 GLU N N 15 117.547 0.2 . 1 . . . . 101 GLU N . 15102 1 712 . 1 1 102 102 SER H H 1 7.925 0.02 . 1 . . . . 102 SER H . 15102 1 713 . 1 1 102 102 SER HB2 H 1 3.797 0.02 . 2 . . . . 102 SER HB2 . 15102 1 714 . 1 1 102 102 SER HB3 H 1 3.938 0.02 . 2 . . . . 102 SER HB3 . 15102 1 715 . 1 1 102 102 SER C C 13 175.483 0.1 . 1 . . . . 102 SER C . 15102 1 716 . 1 1 102 102 SER CA C 13 61.245 0.1 . 1 . . . . 102 SER CA . 15102 1 717 . 1 1 102 102 SER CB C 13 62.503 0.1 . 1 . . . . 102 SER CB . 15102 1 718 . 1 1 102 102 SER N N 15 115.375 0.2 . 1 . . . . 102 SER N . 15102 1 719 . 1 1 103 103 TYR H H 1 8.175 0.02 . 1 . . . . 103 TYR H . 15102 1 720 . 1 1 103 103 TYR HB2 H 1 2.979 0.02 . 2 . . . . 103 TYR HB2 . 15102 1 721 . 1 1 103 103 TYR HB3 H 1 3.135 0.02 . 2 . . . . 103 TYR HB3 . 15102 1 722 . 1 1 103 103 TYR C C 13 176.599 0.1 . 1 . . . . 103 TYR C . 15102 1 723 . 1 1 103 103 TYR CA C 13 60.105 0.1 . 1 . . . . 103 TYR CA . 15102 1 724 . 1 1 103 103 TYR N N 15 121.680 0.2 . 1 . . . . 103 TYR N . 15102 1 725 . 1 1 104 104 LYS H H 1 8.012 0.02 . 1 . . . . 104 LYS H . 15102 1 726 . 1 1 104 104 LYS HB2 H 1 1.780 0.02 . 1 . . . . 104 LYS QB . 15102 1 727 . 1 1 104 104 LYS HB3 H 1 1.780 0.02 . 1 . . . . 104 LYS QB . 15102 1 728 . 1 1 104 104 LYS HG2 H 1 1.367 0.02 . 1 . . . . 104 LYS QG . 15102 1 729 . 1 1 104 104 LYS HG3 H 1 1.367 0.02 . 1 . . . . 104 LYS QG . 15102 1 730 . 1 1 104 104 LYS C C 13 177.540 0.1 . 1 . . . . 104 LYS C . 15102 1 731 . 1 1 104 104 LYS CA C 13 58.077 0.1 . 1 . . . . 104 LYS CA . 15102 1 732 . 1 1 104 104 LYS CB C 13 31.356 0.1 . 1 . . . . 104 LYS CB . 15102 1 733 . 1 1 104 104 LYS N N 15 118.415 0.2 . 1 . . . . 104 LYS N . 15102 1 734 . 1 1 105 105 SER H H 1 7.904 0.02 . 1 . . . . 105 SER H . 15102 1 735 . 1 1 105 105 SER HB2 H 1 3.930 0.02 . 1 . . . . 105 SER QB . 15102 1 736 . 1 1 105 105 SER HB3 H 1 3.930 0.02 . 1 . . . . 105 SER QB . 15102 1 737 . 1 1 105 105 SER C C 13 174.843 0.1 . 1 . . . . 105 SER C . 15102 1 738 . 1 1 105 105 SER CA C 13 59.404 0.1 . 1 . . . . 105 SER CA . 15102 1 739 . 1 1 105 105 SER CB C 13 62.838 0.1 . 1 . . . . 105 SER CB . 15102 1 740 . 1 1 105 105 SER N N 15 113.299 0.2 . 1 . . . . 105 SER N . 15102 1 741 . 1 1 106 106 CYS H H 1 7.782 0.02 . 1 . . . . 106 CYS H . 15102 1 742 . 1 1 106 106 CYS HA H 1 4.454 0.02 . 1 . . . . 106 CYS HA . 15102 1 743 . 1 1 106 106 CYS HB2 H 1 2.609 0.02 . 2 . . . . 106 CYS HB2 . 15102 1 744 . 1 1 106 106 CYS HB3 H 1 2.523 0.02 . 2 . . . . 106 CYS HB3 . 15102 1 745 . 1 1 106 106 CYS C C 13 174.485 0.1 . 1 . . . . 106 CYS C . 15102 1 746 . 1 1 106 106 CYS CA C 13 59.775 0.1 . 1 . . . . 106 CYS CA . 15102 1 747 . 1 1 106 106 CYS CB C 13 27.344 0.1 . 1 . . . . 106 CYS CB . 15102 1 748 . 1 1 106 106 CYS N N 15 118.447 0.2 . 1 . . . . 106 CYS N . 15102 1 749 . 1 1 107 107 TYR H H 1 7.977 0.02 . 1 . . . . 107 TYR H . 15102 1 750 . 1 1 107 107 TYR HB2 H 1 2.701 0.02 . 2 . . . . 107 TYR HB2 . 15102 1 751 . 1 1 107 107 TYR HB3 H 1 2.874 0.02 . 2 . . . . 107 TYR HB3 . 15102 1 752 . 1 1 107 107 TYR C C 13 175.439 0.1 . 1 . . . . 107 TYR C . 15102 1 753 . 1 1 107 107 TYR CA C 13 58.456 0.1 . 1 . . . . 107 TYR CA . 15102 1 754 . 1 1 107 107 TYR CB C 13 38.012 0.1 . 1 . . . . 107 TYR CB . 15102 1 755 . 1 1 107 107 TYR N N 15 120.148 0.2 . 1 . . . . 107 TYR N . 15102 1 756 . 1 1 108 108 VAL H H 1 7.711 0.02 . 1 . . . . 108 VAL H . 15102 1 757 . 1 1 108 108 VAL HA H 1 3.915 0.02 . 1 . . . . 108 VAL HA . 15102 1 758 . 1 1 108 108 VAL HG11 H 1 0.805 0.02 . 1 . . . . 108 VAL QQG . 15102 1 759 . 1 1 108 108 VAL HG12 H 1 0.805 0.02 . 1 . . . . 108 VAL QQG . 15102 1 760 . 1 1 108 108 VAL HG13 H 1 0.805 0.02 . 1 . . . . 108 VAL QQG . 15102 1 761 . 1 1 108 108 VAL HG21 H 1 0.805 0.02 . 1 . . . . 108 VAL QQG . 15102 1 762 . 1 1 108 108 VAL HG22 H 1 0.805 0.02 . 1 . . . . 108 VAL QQG . 15102 1 763 . 1 1 108 108 VAL HG23 H 1 0.805 0.02 . 1 . . . . 108 VAL QQG . 15102 1 764 . 1 1 108 108 VAL C C 13 176.153 0.1 . 1 . . . . 108 VAL C . 15102 1 765 . 1 1 108 108 VAL CA C 13 62.573 0.1 . 1 . . . . 108 VAL CA . 15102 1 766 . 1 1 108 108 VAL CB C 13 31.496 0.1 . 1 . . . . 108 VAL CB . 15102 1 767 . 1 1 108 108 VAL N N 15 119.796 0.2 . 1 . . . . 108 VAL N . 15102 1 768 . 1 1 109 109 VAL H H 1 7.864 0.02 . 1 . . . . 109 VAL H . 15102 1 769 . 1 1 109 109 VAL HA H 1 3.905 0.02 . 1 . . . . 109 VAL HA . 15102 1 770 . 1 1 109 109 VAL HB H 1 2.150 0.02 . 1 . . . . 109 VAL HB . 15102 1 771 . 1 1 109 109 VAL HG11 H 1 0.811 0.02 . 1 . . . . 109 VAL QQG . 15102 1 772 . 1 1 109 109 VAL HG12 H 1 0.811 0.02 . 1 . . . . 109 VAL QQG . 15102 1 773 . 1 1 109 109 VAL HG13 H 1 0.811 0.02 . 1 . . . . 109 VAL QQG . 15102 1 774 . 1 1 109 109 VAL HG21 H 1 0.811 0.02 . 1 . . . . 109 VAL QQG . 15102 1 775 . 1 1 109 109 VAL HG22 H 1 0.811 0.02 . 1 . . . . 109 VAL QQG . 15102 1 776 . 1 1 109 109 VAL HG23 H 1 0.811 0.02 . 1 . . . . 109 VAL QQG . 15102 1 777 . 1 1 109 109 VAL C C 13 176.317 0.1 . 1 . . . . 109 VAL C . 15102 1 778 . 1 1 109 109 VAL CA C 13 62.562 0.1 . 1 . . . . 109 VAL CA . 15102 1 779 . 1 1 109 109 VAL CB C 13 31.586 0.1 . 1 . . . . 109 VAL CB . 15102 1 780 . 1 1 109 109 VAL N N 15 121.946 0.2 . 1 . . . . 109 VAL N . 15102 1 781 . 1 1 110 110 GLU H H 1 8.319 0.02 . 1 . . . . 110 GLU H . 15102 1 782 . 1 1 110 110 GLU HG2 H 1 2.175 0.02 . 1 . . . . 110 GLU QG . 15102 1 783 . 1 1 110 110 GLU HG3 H 1 2.175 0.02 . 1 . . . . 110 GLU QG . 15102 1 784 . 1 1 110 110 GLU C C 13 177.056 0.1 . 1 . . . . 110 GLU C . 15102 1 785 . 1 1 110 110 GLU CA C 13 56.549 0.1 . 1 . . . . 110 GLU CA . 15102 1 786 . 1 1 110 110 GLU CB C 13 29.010 0.1 . 1 . . . . 110 GLU CB . 15102 1 787 . 1 1 110 110 GLU N N 15 122.447 0.2 . 1 . . . . 110 GLU N . 15102 1 788 . 1 1 111 111 ASN H H 1 7.878 0.02 . 1 . . . . 111 ASN H . 15102 1 789 . 1 1 111 111 ASN HB2 H 1 2.911 0.02 . 1 . . . . 111 ASN QB . 15102 1 790 . 1 1 111 111 ASN HB3 H 1 2.911 0.02 . 1 . . . . 111 ASN QB . 15102 1 791 . 1 1 111 111 ASN CA C 13 52.226 0.1 . 1 . . . . 111 ASN CA . 15102 1 792 . 1 1 111 111 ASN CB C 13 41.114 0.1 . 1 . . . . 111 ASN CB . 15102 1 793 . 1 1 111 111 ASN N N 15 120.281 0.2 . 1 . . . . 111 ASN N . 15102 1 794 . 1 1 112 112 HIS HA H 1 4.672 0.02 . 1 . . . . 112 HIS HA . 15102 1 795 . 1 1 112 112 HIS HB2 H 1 2.731 0.02 . 2 . . . . 112 HIS HB2 . 15102 1 796 . 1 1 112 112 HIS HB3 H 1 2.618 0.02 . 2 . . . . 112 HIS HB3 . 15102 1 797 . 1 1 112 112 HIS C C 13 174.265 0.1 . 1 . . . . 112 HIS C . 15102 1 798 . 1 1 112 112 HIS CA C 13 55.523 0.1 . 1 . . . . 112 HIS CA . 15102 1 799 . 1 1 112 112 HIS CB C 13 28.553 0.1 . 1 . . . . 112 HIS CB . 15102 1 800 . 1 1 113 113 LEU H H 1 8.087 0.02 . 1 . . . . 113 LEU H . 15102 1 801 . 1 1 113 113 LEU HA H 1 4.250 0.02 . 1 . . . . 113 LEU HA . 15102 1 802 . 1 1 113 113 LEU HB2 H 1 1.478 0.02 . 1 . . . . 113 LEU QB . 15102 1 803 . 1 1 113 113 LEU HB3 H 1 1.478 0.02 . 1 . . . . 113 LEU QB . 15102 1 804 . 1 1 113 113 LEU HG H 1 1.567 0.02 . 1 . . . . 113 LEU HG . 15102 1 805 . 1 1 113 113 LEU HD11 H 1 0.784 0.02 . 1 . . . . 113 LEU QQD . 15102 1 806 . 1 1 113 113 LEU HD12 H 1 0.784 0.02 . 1 . . . . 113 LEU QQD . 15102 1 807 . 1 1 113 113 LEU HD13 H 1 0.784 0.02 . 1 . . . . 113 LEU QQD . 15102 1 808 . 1 1 113 113 LEU HD21 H 1 0.784 0.02 . 1 . . . . 113 LEU QQD . 15102 1 809 . 1 1 113 113 LEU HD22 H 1 0.784 0.02 . 1 . . . . 113 LEU QQD . 15102 1 810 . 1 1 113 113 LEU HD23 H 1 0.784 0.02 . 1 . . . . 113 LEU QQD . 15102 1 811 . 1 1 113 113 LEU C C 13 176.628 0.1 . 1 . . . . 113 LEU C . 15102 1 812 . 1 1 113 113 LEU CA C 13 54.820 0.1 . 1 . . . . 113 LEU CA . 15102 1 813 . 1 1 113 113 LEU CB C 13 41.369 0.1 . 1 . . . . 113 LEU CB . 15102 1 814 . 1 1 113 113 LEU N N 15 121.478 0.2 . 1 . . . . 113 LEU N . 15102 1 815 . 1 1 114 114 ALA H H 1 8.129 0.02 . 1 . . . . 114 ALA H . 15102 1 816 . 1 1 114 114 ALA HB1 H 1 1.263 0.02 . 1 . . . . 114 ALA QB . 15102 1 817 . 1 1 114 114 ALA HB2 H 1 1.263 0.02 . 1 . . . . 114 ALA QB . 15102 1 818 . 1 1 114 114 ALA HB3 H 1 1.263 0.02 . 1 . . . . 114 ALA QB . 15102 1 819 . 1 1 114 114 ALA C C 13 177.184 0.1 . 1 . . . . 114 ALA C . 15102 1 820 . 1 1 114 114 ALA CA C 13 51.873 0.1 . 1 . . . . 114 ALA CA . 15102 1 821 . 1 1 114 114 ALA CB C 13 18.256 0.1 . 1 . . . . 114 ALA CB . 15102 1 822 . 1 1 114 114 ALA N N 15 124.203 0.2 . 1 . . . . 114 ALA N . 15102 1 823 . 1 1 115 115 ILE H H 1 7.873 0.02 . 1 . . . . 115 ILE H . 15102 1 824 . 1 1 115 115 ILE HA H 1 4.072 0.02 . 1 . . . . 115 ILE HA . 15102 1 825 . 1 1 115 115 ILE HB H 1 1.749 0.02 . 1 . . . . 115 ILE HB . 15102 1 826 . 1 1 115 115 ILE HG12 H 1 1.507 0.02 . 2 . . . . 115 ILE HG12 . 15102 1 827 . 1 1 115 115 ILE HG21 H 1 1.047 0.02 . 1 . . . . 115 ILE QG2 . 15102 1 828 . 1 1 115 115 ILE HG22 H 1 1.047 0.02 . 1 . . . . 115 ILE QG2 . 15102 1 829 . 1 1 115 115 ILE HG23 H 1 1.047 0.02 . 1 . . . . 115 ILE QG2 . 15102 1 830 . 1 1 115 115 ILE HD11 H 1 0.790 0.02 . 1 . . . . 115 ILE QD1 . 15102 1 831 . 1 1 115 115 ILE HD12 H 1 0.790 0.02 . 1 . . . . 115 ILE QD1 . 15102 1 832 . 1 1 115 115 ILE HD13 H 1 0.790 0.02 . 1 . . . . 115 ILE QD1 . 15102 1 833 . 1 1 115 115 ILE C C 13 176.040 0.1 . 1 . . . . 115 ILE C . 15102 1 834 . 1 1 115 115 ILE CA C 13 60.558 0.1 . 1 . . . . 115 ILE CA . 15102 1 835 . 1 1 115 115 ILE CB C 13 37.986 0.1 . 1 . . . . 115 ILE CB . 15102 1 836 . 1 1 115 115 ILE N N 15 118.938 0.2 . 1 . . . . 115 ILE N . 15102 1 837 . 1 1 116 116 GLU H H 1 8.304 0.02 . 1 . . . . 116 GLU H . 15102 1 838 . 1 1 116 116 GLU HA H 1 4.209 0.02 . 1 . . . . 116 GLU HA . 15102 1 839 . 1 1 116 116 GLU HB2 H 1 1.955 0.02 . 2 . . . . 116 GLU HB2 . 15102 1 840 . 1 1 116 116 GLU HB3 H 1 1.843 0.02 . 2 . . . . 116 GLU HB3 . 15102 1 841 . 1 1 116 116 GLU HG2 H 1 2.135 0.02 . 1 . . . . 116 GLU QG . 15102 1 842 . 1 1 116 116 GLU HG3 H 1 2.135 0.02 . 1 . . . . 116 GLU QG . 15102 1 843 . 1 1 116 116 GLU C C 13 175.927 0.1 . 1 . . . . 116 GLU C . 15102 1 844 . 1 1 116 116 GLU CA C 13 55.744 0.1 . 1 . . . . 116 GLU CA . 15102 1 845 . 1 1 116 116 GLU CB C 13 29.519 0.1 . 1 . . . . 116 GLU CB . 15102 1 846 . 1 1 116 116 GLU N N 15 124.103 0.2 . 1 . . . . 116 GLU N . 15102 1 847 . 1 1 117 117 GLN H H 1 8.357 0.02 . 1 . . . . 117 GLN H . 15102 1 848 . 1 1 117 117 GLN HG2 H 1 2.295 0.02 . 1 . . . . 117 GLN QG . 15102 1 849 . 1 1 117 117 GLN HG3 H 1 2.295 0.02 . 1 . . . . 117 GLN QG . 15102 1 850 . 1 1 117 117 GLN CA C 13 53.161 0.1 . 1 . . . . 117 GLN CA . 15102 1 851 . 1 1 117 117 GLN CB C 13 28.185 0.1 . 1 . . . . 117 GLN CB . 15102 1 852 . 1 1 117 117 GLN N N 15 122.310 0.2 . 1 . . . . 117 GLN N . 15102 1 853 . 1 1 118 118 PRO HA H 1 4.325 0.02 . 1 . . . . 118 PRO HA . 15102 1 854 . 1 1 118 118 PRO HB2 H 1 2.176 0.02 . 2 . . . . 118 PRO HB2 . 15102 1 855 . 1 1 118 118 PRO HB3 H 1 1.920 0.02 . 2 . . . . 118 PRO HB3 . 15102 1 856 . 1 1 118 118 PRO HG2 H 1 1.813 0.02 . 1 . . . . 118 PRO QG . 15102 1 857 . 1 1 118 118 PRO HG3 H 1 1.813 0.02 . 1 . . . . 118 PRO QG . 15102 1 858 . 1 1 118 118 PRO HD2 H 1 3.656 0.02 . 2 . . . . 118 PRO HD2 . 15102 1 859 . 1 1 118 118 PRO HD3 H 1 3.587 0.02 . 2 . . . . 118 PRO HD3 . 15102 1 860 . 1 1 118 118 PRO C C 13 176.654 0.1 . 1 . . . . 118 PRO C . 15102 1 861 . 1 1 118 118 PRO CA C 13 62.892 0.1 . 1 . . . . 118 PRO CA . 15102 1 862 . 1 1 118 118 PRO CB C 13 31.213 0.1 . 1 . . . . 118 PRO CB . 15102 1 863 . 1 1 119 119 ASN H H 1 8.502 0.02 . 1 . . . . 119 ASN H . 15102 1 864 . 1 1 119 119 ASN HA H 1 4.617 0.02 . 1 . . . . 119 ASN HA . 15102 1 865 . 1 1 119 119 ASN HB2 H 1 2.725 0.02 . 1 . . . . 119 ASN QB . 15102 1 866 . 1 1 119 119 ASN HB3 H 1 2.725 0.02 . 1 . . . . 119 ASN QB . 15102 1 867 . 1 1 119 119 ASN C C 13 175.423 0.1 . 1 . . . . 119 ASN C . 15102 1 868 . 1 1 119 119 ASN CA C 13 52.931 0.1 . 1 . . . . 119 ASN CA . 15102 1 869 . 1 1 119 119 ASN CB C 13 38.099 0.1 . 1 . . . . 119 ASN CB . 15102 1 870 . 1 1 119 119 ASN N N 15 118.159 0.2 . 1 . . . . 119 ASN N . 15102 1 871 . 1 1 120 120 THR H H 1 7.973 0.02 . 1 . . . . 120 THR H . 15102 1 872 . 1 1 120 120 THR HB H 1 4.105 0.02 . 1 . . . . 120 THR HB . 15102 1 873 . 1 1 120 120 THR HG21 H 1 1.061 0.02 . 1 . . . . 120 THR QG2 . 15102 1 874 . 1 1 120 120 THR HG22 H 1 1.061 0.02 . 1 . . . . 120 THR QG2 . 15102 1 875 . 1 1 120 120 THR HG23 H 1 1.061 0.02 . 1 . . . . 120 THR QG2 . 15102 1 876 . 1 1 120 120 THR C C 13 174.140 0.1 . 1 . . . . 120 THR C . 15102 1 877 . 1 1 120 120 THR CA C 13 61.480 0.1 . 1 . . . . 120 THR CA . 15102 1 878 . 1 1 120 120 THR CB C 13 69.051 0.1 . 1 . . . . 120 THR CB . 15102 1 879 . 1 1 120 120 THR N N 15 113.598 0.2 . 1 . . . . 120 THR N . 15102 1 880 . 1 1 121 121 HIS H H 1 8.358 0.02 . 1 . . . . 121 HIS H . 15102 1 881 . 1 1 121 121 HIS HB2 H 1 3.105 0.02 . 2 . . . . 121 HIS HB2 . 15102 1 882 . 1 1 121 121 HIS HB3 H 1 3.016 0.02 . 2 . . . . 121 HIS HB3 . 15102 1 883 . 1 1 121 121 HIS C C 13 174.047 0.1 . 1 . . . . 121 HIS C . 15102 1 884 . 1 1 121 121 HIS CA C 13 54.778 0.1 . 1 . . . . 121 HIS CA . 15102 1 885 . 1 1 121 121 HIS CB C 13 28.507 0.1 . 1 . . . . 121 HIS CB . 15102 1 886 . 1 1 121 121 HIS N N 15 120.453 0.2 . 1 . . . . 121 HIS N . 15102 1 887 . 1 1 122 122 LEU H H 1 8.204 0.02 . 1 . . . . 122 LEU H . 15102 1 888 . 1 1 122 122 LEU HD11 H 1 0.965 0.02 . 1 . . . . 122 LEU QQD . 15102 1 889 . 1 1 122 122 LEU HD12 H 1 0.965 0.02 . 1 . . . . 122 LEU QQD . 15102 1 890 . 1 1 122 122 LEU HD13 H 1 0.965 0.02 . 1 . . . . 122 LEU QQD . 15102 1 891 . 1 1 122 122 LEU HD21 H 1 0.965 0.02 . 1 . . . . 122 LEU QQD . 15102 1 892 . 1 1 122 122 LEU HD22 H 1 0.965 0.02 . 1 . . . . 122 LEU QQD . 15102 1 893 . 1 1 122 122 LEU HD23 H 1 0.965 0.02 . 1 . . . . 122 LEU QQD . 15102 1 894 . 1 1 122 122 LEU CA C 13 52.799 0.1 . 1 . . . . 122 LEU CA . 15102 1 895 . 1 1 122 122 LEU CB C 13 40.498 0.1 . 1 . . . . 122 LEU CB . 15102 1 896 . 1 1 122 122 LEU N N 15 124.823 0.2 . 1 . . . . 122 LEU N . 15102 1 897 . 1 1 123 123 PRO HA H 1 4.315 0.02 . 1 . . . . 123 PRO HA . 15102 1 898 . 1 1 123 123 PRO HB2 H 1 2.193 0.02 . 2 . . . . 123 PRO HB2 . 15102 1 899 . 1 1 123 123 PRO HB3 H 1 1.943 0.02 . 2 . . . . 123 PRO HB3 . 15102 1 900 . 1 1 123 123 PRO HG2 H 1 1.826 0.02 . 1 . . . . 123 PRO QG . 15102 1 901 . 1 1 123 123 PRO HG3 H 1 1.826 0.02 . 1 . . . . 123 PRO QG . 15102 1 902 . 1 1 123 123 PRO HD2 H 1 3.694 0.02 . 2 . . . . 123 PRO HD2 . 15102 1 903 . 1 1 123 123 PRO HD3 H 1 3.533 0.02 . 2 . . . . 123 PRO HD3 . 15102 1 904 . 1 1 123 123 PRO C C 13 176.774 0.1 . 1 . . . . 123 PRO C . 15102 1 905 . 1 1 123 123 PRO CA C 13 62.674 0.1 . 1 . . . . 123 PRO CA . 15102 1 906 . 1 1 123 123 PRO CB C 13 31.101 0.1 . 1 . . . . 123 PRO CB . 15102 1 907 . 1 1 124 124 GLU H H 1 8.451 0.02 . 1 . . . . 124 GLU H . 15102 1 908 . 1 1 124 124 GLU HA H 1 4.220 0.02 . 1 . . . . 124 GLU HA . 15102 1 909 . 1 1 124 124 GLU HB2 H 1 1.978 0.02 . 2 . . . . 124 GLU HB2 . 15102 1 910 . 1 1 124 124 GLU HB3 H 1 1.879 0.02 . 2 . . . . 124 GLU HB3 . 15102 1 911 . 1 1 124 124 GLU HG2 H 1 2.174 0.02 . 1 . . . . 124 GLU QG . 15102 1 912 . 1 1 124 124 GLU HG3 H 1 2.174 0.02 . 1 . . . . 124 GLU QG . 15102 1 913 . 1 1 124 124 GLU C C 13 176.523 0.1 . 1 . . . . 124 GLU C . 15102 1 914 . 1 1 124 124 GLU CA C 13 56.110 0.1 . 1 . . . . 124 GLU CA . 15102 1 915 . 1 1 124 124 GLU CB C 13 29.539 0.1 . 1 . . . . 124 GLU CB . 15102 1 916 . 1 1 124 124 GLU N N 15 120.764 0.2 . 1 . . . . 124 GLU N . 15102 1 917 . 1 1 125 125 THR H H 1 8.155 0.02 . 1 . . . . 125 THR H . 15102 1 918 . 1 1 125 125 THR HA H 1 4.215 0.02 . 1 . . . . 125 THR HA . 15102 1 919 . 1 1 125 125 THR HB H 1 4.056 0.02 . 1 . . . . 125 THR HB . 15102 1 920 . 1 1 125 125 THR HG21 H 1 1.084 0.02 . 1 . . . . 125 THR QG2 . 15102 1 921 . 1 1 125 125 THR HG22 H 1 1.084 0.02 . 1 . . . . 125 THR QG2 . 15102 1 922 . 1 1 125 125 THR HG23 H 1 1.084 0.02 . 1 . . . . 125 THR QG2 . 15102 1 923 . 1 1 125 125 THR C C 13 174.080 0.1 . 1 . . . . 125 THR C . 15102 1 924 . 1 1 125 125 THR CA C 13 61.340 0.1 . 1 . . . . 125 THR CA . 15102 1 925 . 1 1 125 125 THR CB C 13 69.231 0.1 . 1 . . . . 125 THR CB . 15102 1 926 . 1 1 125 125 THR N N 15 115.932 0.2 . 1 . . . . 125 THR N . 15102 1 927 . 1 1 126 126 LYS H H 1 8.310 0.02 . 1 . . . . 126 LYS H . 15102 1 928 . 1 1 126 126 LYS CA C 13 53.643 0.1 . 1 . . . . 126 LYS CA . 15102 1 929 . 1 1 126 126 LYS CB C 13 31.717 0.1 . 1 . . . . 126 LYS CB . 15102 1 930 . 1 1 126 126 LYS N N 15 125.108 0.2 . 1 . . . . 126 LYS N . 15102 1 931 . 1 1 127 127 PRO HA H 1 4.357 0.02 . 1 . . . . 127 PRO HA . 15102 1 932 . 1 1 127 127 PRO HB2 H 1 2.182 0.02 . 2 . . . . 127 PRO HB2 . 15102 1 933 . 1 1 127 127 PRO HB3 H 1 1.931 0.02 . 2 . . . . 127 PRO HB3 . 15102 1 934 . 1 1 127 127 PRO HG2 H 1 1.818 0.02 . 1 . . . . 127 PRO QG . 15102 1 935 . 1 1 127 127 PRO HG3 H 1 1.818 0.02 . 1 . . . . 127 PRO QG . 15102 1 936 . 1 1 127 127 PRO HD2 H 1 3.708 0.02 . 2 . . . . 127 PRO HD2 . 15102 1 937 . 1 1 127 127 PRO HD3 H 1 3.560 0.02 . 2 . . . . 127 PRO HD3 . 15102 1 938 . 1 1 127 127 PRO C C 13 176.563 0.1 . 1 . . . . 127 PRO C . 15102 1 939 . 1 1 127 127 PRO CA C 13 62.665 0.1 . 1 . . . . 127 PRO CA . 15102 1 940 . 1 1 127 127 PRO CB C 13 31.336 0.1 . 1 . . . . 127 PRO CB . 15102 1 941 . 1 1 128 128 SER H H 1 8.244 0.02 . 1 . . . . 128 SER H . 15102 1 942 . 1 1 128 128 SER HB2 H 1 3.839 0.02 . 2 . . . . 128 SER HB2 . 15102 1 943 . 1 1 128 128 SER HB3 H 1 3.743 0.02 . 2 . . . . 128 SER HB3 . 15102 1 944 . 1 1 128 128 SER C C 13 175.753 0.1 . 1 . . . . 128 SER C . 15102 1 945 . 1 1 128 128 SER CA C 13 55.868 0.1 . 1 . . . . 128 SER CA . 15102 1 946 . 1 1 128 128 SER CB C 13 62.879 0.1 . 1 . . . . 128 SER CB . 15102 1 947 . 1 1 128 128 SER N N 15 117.400 0.2 . 1 . . . . 128 SER N . 15102 1 stop_ save_