data_17578 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17578 _Entry.Title ; Solution structure of the S. cerevisiae H/ACA RNP protein Nhp2p-S82W mutant ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-04-07 _Entry.Accession_date 2011-04-07 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Bon-Kyung Koo . . . 17578 2 Chin-Ju Park . . . 17578 3 Cesar Fernandez . F. . 17578 4 Nicholas Chim . . . 17578 5 Yi Ding . . . 17578 6 Guillaume Chanfreau . . . 17578 7 Juli Feigon . . . 17578 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 17578 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID L7Ae . 17578 Nhp2p . 17578 'NMR solution structure' . 17578 scaRNP . 17578 snoRNP . 17578 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17578 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 351 17578 '15N chemical shifts' 114 17578 '1H chemical shifts' 643 17578 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-05-14 2011-04-07 update BMRB 'update entry citation' 17578 1 . . 2011-06-30 2011-04-07 original author 'original release' 17578 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17579 'H/ACA RNP protein Nhp2p' 17578 PDB 2LBW 'BMRB Entry Tracking System' 17578 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17578 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21708174 _Citation.Full_citation . _Citation.Title 'Structure of H/ACA RNP protein Nhp2p reveals cis/trans isomerization of a conserved proline at the RNA and Nop10 binding interface.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 411 _Citation.Journal_issue 5 _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 927 _Citation.Page_last 942 _Citation.Year 2011 _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 Bon-Kyung Koo . . . 17578 1 2 Chin-Ju Park . . . 17578 1 3 Cesar Fernandez . F. . 17578 1 4 Nicholas Chim . . . 17578 1 5 Yi Ding . . . 17578 1 6 Guillaume Chanfreau . . . 17578 1 7 Juli Feigon . . . 17578 1 stop_ save_ save_1 _Citation.Sf_category citations _Citation.Sf_framecode 1 _Citation.Entry_ID 17578 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16943774 _Citation.Full_citation . _Citation.Title 'Crystal structure of an H/ACA box ribonucleoprotein particle' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Nature _Citation.Journal_name_full . _Citation.Journal_volume 443 _Citation.Journal_issue 21 _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 302 _Citation.Page_last 307 _Citation.Year 2006 _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 Ling Li . . . 17578 2 2 Keqiong Ye . . . 17578 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17578 _Assembly.ID 1 _Assembly.Name 'H/ACA RNP protein Nhp2p-S82W mutant' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'H/ACA RNP protein Nhp2p-S82W mutant' 1 $Nhp2p-S82W A . yes native no no . . . 17578 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Nhp2p-S82W _Entity.Sf_category entity _Entity.Sf_framecode Nhp2p-S82W _Entity.Entry_ID 17578 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Nhp2p-S82W _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SKKLNKKVLKTVKKASKAKN VKRGVKEVVKALRKGEKGLV VIAGDIWPADVISHIPVLCE DHSVPYIFIPSKQDLGAAGA TKRPTSVVFIVPGSNKKKDG KNKEEEYKESFNEVVKEVQA L ; _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 121 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13306.792 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 BMRB 17579 . Nhp2p . . . . . 100.00 121 99.17 99.17 5.37e-76 . . . . 17578 1 2 no PDB 2LBW . "Solution Structure Of The S. Cerevisiae HACA RNP PROTEIN NHP2P-S82w Mutant" . . . . . 100.00 121 100.00 100.00 1.73e-77 . . . . 17578 1 3 no PDB 2LBX . "Solution Structure Of The S. Cerevisiae HACA RNP PROTEIN NHP2P" . . . . . 100.00 121 99.17 99.17 5.37e-76 . . . . 17578 1 4 no DBJ GAA22045 . "K7_Nhp2p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 5 no EMBL CAA40885 . "high mobility group-like nuclear protein 2 [Saccharomyces cerevisiae]" . . . . . 100.00 173 99.17 99.17 6.75e-76 . . . . 17578 1 6 no EMBL CAA67483 . "high-mobility-group-like protein [Saccharomyces cerevisiae]" . . . . . 100.00 173 99.17 99.17 6.75e-76 . . . . 17578 1 7 no EMBL CAA98786 . "NHP2 [Saccharomyces cerevisiae]" . . . . . 100.00 173 99.17 99.17 6.75e-76 . . . . 17578 1 8 no EMBL CAY79077 . "Nhp2p [Saccharomyces cerevisiae EC1118]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 9 no GB AHY74809 . "Nhp2p [Saccharomyces cerevisiae YJM993]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 10 no GB AJP37550 . "Nhp2p [Saccharomyces cerevisiae YJM1078]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 11 no GB AJU57662 . "Nhp2p [Saccharomyces cerevisiae YJM189]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 12 no GB AJU58365 . "Nhp2p [Saccharomyces cerevisiae YJM193]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 13 no GB AJU59054 . "Nhp2p [Saccharomyces cerevisiae YJM195]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 14 no REF NP_010073 . "snoRNA-binding protein NHP2 [Saccharomyces cerevisiae S288c]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 15 no SP P32495 . "RecName: Full=H/ACA ribonucleoprotein complex subunit 2; AltName: Full=H/ACA snoRNP protein NHP2; AltName: Full=High mobility g" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 1 16 no TPG DAA11656 . "TPA: snoRNA-binding protein NHP2 [Saccharomyces cerevisiae S288c]" . . . . . 100.00 156 99.17 99.17 9.21e-76 . . . . 17578 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 36 SER . 17578 1 2 37 LYS . 17578 1 3 38 LYS . 17578 1 4 39 LEU . 17578 1 5 40 ASN . 17578 1 6 41 LYS . 17578 1 7 42 LYS . 17578 1 8 43 VAL . 17578 1 9 44 LEU . 17578 1 10 45 LYS . 17578 1 11 46 THR . 17578 1 12 47 VAL . 17578 1 13 48 LYS . 17578 1 14 49 LYS . 17578 1 15 50 ALA . 17578 1 16 51 SER . 17578 1 17 52 LYS . 17578 1 18 53 ALA . 17578 1 19 54 LYS . 17578 1 20 55 ASN . 17578 1 21 56 VAL . 17578 1 22 57 LYS . 17578 1 23 58 ARG . 17578 1 24 59 GLY . 17578 1 25 60 VAL . 17578 1 26 61 LYS . 17578 1 27 62 GLU . 17578 1 28 63 VAL . 17578 1 29 64 VAL . 17578 1 30 65 LYS . 17578 1 31 66 ALA . 17578 1 32 67 LEU . 17578 1 33 68 ARG . 17578 1 34 69 LYS . 17578 1 35 70 GLY . 17578 1 36 71 GLU . 17578 1 37 72 LYS . 17578 1 38 73 GLY . 17578 1 39 74 LEU . 17578 1 40 75 VAL . 17578 1 41 76 VAL . 17578 1 42 77 ILE . 17578 1 43 78 ALA . 17578 1 44 79 GLY . 17578 1 45 80 ASP . 17578 1 46 81 ILE . 17578 1 47 82 TRP . 17578 1 48 83 PRO . 17578 1 49 84 ALA . 17578 1 50 85 ASP . 17578 1 51 86 VAL . 17578 1 52 87 ILE . 17578 1 53 88 SER . 17578 1 54 89 HIS . 17578 1 55 90 ILE . 17578 1 56 91 PRO . 17578 1 57 92 VAL . 17578 1 58 93 LEU . 17578 1 59 94 CYS . 17578 1 60 95 GLU . 17578 1 61 96 ASP . 17578 1 62 97 HIS . 17578 1 63 98 SER . 17578 1 64 99 VAL . 17578 1 65 100 PRO . 17578 1 66 101 TYR . 17578 1 67 102 ILE . 17578 1 68 103 PHE . 17578 1 69 104 ILE . 17578 1 70 105 PRO . 17578 1 71 106 SER . 17578 1 72 107 LYS . 17578 1 73 108 GLN . 17578 1 74 109 ASP . 17578 1 75 110 LEU . 17578 1 76 111 GLY . 17578 1 77 112 ALA . 17578 1 78 113 ALA . 17578 1 79 114 GLY . 17578 1 80 115 ALA . 17578 1 81 116 THR . 17578 1 82 117 LYS . 17578 1 83 118 ARG . 17578 1 84 119 PRO . 17578 1 85 120 THR . 17578 1 86 121 SER . 17578 1 87 122 VAL . 17578 1 88 123 VAL . 17578 1 89 124 PHE . 17578 1 90 125 ILE . 17578 1 91 126 VAL . 17578 1 92 127 PRO . 17578 1 93 128 GLY . 17578 1 94 129 SER . 17578 1 95 130 ASN . 17578 1 96 131 LYS . 17578 1 97 132 LYS . 17578 1 98 133 LYS . 17578 1 99 134 ASP . 17578 1 100 135 GLY . 17578 1 101 136 LYS . 17578 1 102 137 ASN . 17578 1 103 138 LYS . 17578 1 104 139 GLU . 17578 1 105 140 GLU . 17578 1 106 141 GLU . 17578 1 107 142 TYR . 17578 1 108 143 LYS . 17578 1 109 144 GLU . 17578 1 110 145 SER . 17578 1 111 146 PHE . 17578 1 112 147 ASN . 17578 1 113 148 GLU . 17578 1 114 149 VAL . 17578 1 115 150 VAL . 17578 1 116 151 LYS . 17578 1 117 152 GLU . 17578 1 118 153 VAL . 17578 1 119 154 GLN . 17578 1 120 155 ALA . 17578 1 121 156 LEU . 17578 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 . SER 1 1 17578 1 . LYS 2 2 17578 1 . LYS 3 3 17578 1 . LEU 4 4 17578 1 . ASN 5 5 17578 1 . LYS 6 6 17578 1 . LYS 7 7 17578 1 . VAL 8 8 17578 1 . LEU 9 9 17578 1 . LYS 10 10 17578 1 . THR 11 11 17578 1 . VAL 12 12 17578 1 . LYS 13 13 17578 1 . LYS 14 14 17578 1 . ALA 15 15 17578 1 . SER 16 16 17578 1 . LYS 17 17 17578 1 . ALA 18 18 17578 1 . LYS 19 19 17578 1 . ASN 20 20 17578 1 . VAL 21 21 17578 1 . LYS 22 22 17578 1 . ARG 23 23 17578 1 . GLY 24 24 17578 1 . VAL 25 25 17578 1 . LYS 26 26 17578 1 . GLU 27 27 17578 1 . VAL 28 28 17578 1 . VAL 29 29 17578 1 . LYS 30 30 17578 1 . ALA 31 31 17578 1 . LEU 32 32 17578 1 . ARG 33 33 17578 1 . LYS 34 34 17578 1 . GLY 35 35 17578 1 . GLU 36 36 17578 1 . LYS 37 37 17578 1 . GLY 38 38 17578 1 . LEU 39 39 17578 1 . VAL 40 40 17578 1 . VAL 41 41 17578 1 . ILE 42 42 17578 1 . ALA 43 43 17578 1 . GLY 44 44 17578 1 . ASP 45 45 17578 1 . ILE 46 46 17578 1 . TRP 47 47 17578 1 . PRO 48 48 17578 1 . ALA 49 49 17578 1 . ASP 50 50 17578 1 . VAL 51 51 17578 1 . ILE 52 52 17578 1 . SER 53 53 17578 1 . HIS 54 54 17578 1 . ILE 55 55 17578 1 . PRO 56 56 17578 1 . VAL 57 57 17578 1 . LEU 58 58 17578 1 . CYS 59 59 17578 1 . GLU 60 60 17578 1 . ASP 61 61 17578 1 . HIS 62 62 17578 1 . SER 63 63 17578 1 . VAL 64 64 17578 1 . PRO 65 65 17578 1 . TYR 66 66 17578 1 . ILE 67 67 17578 1 . PHE 68 68 17578 1 . ILE 69 69 17578 1 . PRO 70 70 17578 1 . SER 71 71 17578 1 . LYS 72 72 17578 1 . GLN 73 73 17578 1 . ASP 74 74 17578 1 . LEU 75 75 17578 1 . GLY 76 76 17578 1 . ALA 77 77 17578 1 . ALA 78 78 17578 1 . GLY 79 79 17578 1 . ALA 80 80 17578 1 . THR 81 81 17578 1 . LYS 82 82 17578 1 . ARG 83 83 17578 1 . PRO 84 84 17578 1 . THR 85 85 17578 1 . SER 86 86 17578 1 . VAL 87 87 17578 1 . VAL 88 88 17578 1 . PHE 89 89 17578 1 . ILE 90 90 17578 1 . VAL 91 91 17578 1 . PRO 92 92 17578 1 . GLY 93 93 17578 1 . SER 94 94 17578 1 . ASN 95 95 17578 1 . LYS 96 96 17578 1 . LYS 97 97 17578 1 . LYS 98 98 17578 1 . ASP 99 99 17578 1 . GLY 100 100 17578 1 . LYS 101 101 17578 1 . ASN 102 102 17578 1 . LYS 103 103 17578 1 . GLU 104 104 17578 1 . GLU 105 105 17578 1 . GLU 106 106 17578 1 . TYR 107 107 17578 1 . LYS 108 108 17578 1 . GLU 109 109 17578 1 . SER 110 110 17578 1 . PHE 111 111 17578 1 . ASN 112 112 17578 1 . GLU 113 113 17578 1 . VAL 114 114 17578 1 . VAL 115 115 17578 1 . LYS 116 116 17578 1 . GLU 117 117 17578 1 . VAL 118 118 17578 1 . GLN 119 119 17578 1 . ALA 120 120 17578 1 . LEU 121 121 17578 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 17578 _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 $Nhp2p-S82W . 4932 organism . 'Saccharomyces cerevisiae' 'baker's yeast' . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . . . . . . . . . 17578 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 17578 _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 $Nhp2p-S82W . 'recombinant technology' 'Saccharomyces cerevisiae' . . . Saccharomyces cerevisiae . . . . . . . . . . . . . . . . pET24a . . . . . . 17578 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_13C_15N_sample _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_sample _Sample.Entry_ID 17578 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HEPES '[U-13C; U-15N]' . . . . . . 20 . . mM . . . . 17578 1 2 'potassium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 17578 1 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17578 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17578 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17578 1 stop_ save_ save_15N_sample _Sample.Sf_category sample _Sample.Sf_framecode 15N_sample _Sample.Entry_ID 17578 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HEPES [U-15N] . . . . . . 20 . . mM . . . . 17578 2 2 'potassium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 17578 2 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17578 2 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17578 2 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17578 2 stop_ save_ save_13C_15N_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_sample_2 _Sample.Entry_ID 17578 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HEPES '[U-13C; U-15N]' . . . . . . 20 . . mM . . . . 17578 3 2 'potassium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 17578 3 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17578 3 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17578 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17578 _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' 0.2 . M 17578 1 pH 7.4 . pH 17578 1 pressure 1 . atm 17578 1 temperature 298 . K 17578 1 stop_ save_ ############################ # Computer software used # ############################ save_cyana _Software.Sf_category software _Software.Sf_framecode cyana _Software.Entry_ID 17578 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17578 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17578 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17578 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17578 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17578 2 'data analysis' 17578 2 'peak picking' 17578 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17578 _Software.ID 3 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17578 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17578 3 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID 17578 _Software.ID 4 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . 17578 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17578 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 17578 _Software.ID 5 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 17578 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 17578 5 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 17578 _Software.ID 6 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17578 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17578 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17578 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17578 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17578 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 800 . . . 17578 1 2 spectrometer_2 Bruker DRX . 600 . . . 17578 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 17578 _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 '3D HNCACB' no . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 3 '3D HNCO' no . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 4 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 6 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $13C_15N_sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 9 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 1 10 '3D C(CO)NH' no . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17578 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 17578 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 17578 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17578 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17578 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 17578 _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 '3D HNCACB' . . . 17578 1 2 '3D CBCA(CO)NH' . . . 17578 1 3 '3D HNCO' . . . 17578 1 4 '3D HBHA(CO)NH' . . . 17578 1 5 '3D HCCH-TOCSY' . . . 17578 1 8 '2D 1H-15N HSQC' . . . 17578 1 10 '3D C(CO)NH' . . . 17578 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 SER HA H 1 4.720 0.03 . 1 . . . A 36 SER HA . 17578 1 2 . 1 1 1 1 SER HB3 H 1 3.985 0.03 . 2 . . . A 36 SER HB3 . 17578 1 3 . 1 1 1 1 SER H H 1 8.122 0.03 . 1 . . . A 36 SER H1 . 17578 1 4 . 1 1 1 1 SER C C 13 179.339 0.30 . 1 . . . A 36 SER C . 17578 1 5 . 1 1 1 1 SER CA C 13 61.702 0.30 . 1 . . . A 36 SER CA . 17578 1 6 . 1 1 1 1 SER N N 15 116.162 0.30 . 1 . . . A 36 SER N . 17578 1 7 . 1 1 2 2 LYS H H 1 7.786 0.03 . 1 . . . A 37 LYS H . 17578 1 8 . 1 1 2 2 LYS HA H 1 4.064 0.03 . 1 . . . A 37 LYS HA . 17578 1 9 . 1 1 2 2 LYS HB2 H 1 1.943 0.03 . 2 . . . A 37 LYS HB2 . 17578 1 10 . 1 1 2 2 LYS HG2 H 1 1.543 0.03 . 2 . . . A 37 LYS HG2 . 17578 1 11 . 1 1 2 2 LYS N N 15 124.035 0.30 . 1 . . . A 37 LYS N . 17578 1 12 . 1 1 3 3 LYS HA H 1 4.026 0.03 . 1 . . . A 38 LYS HA . 17578 1 13 . 1 1 3 3 LYS HB2 H 1 1.759 0.03 . 2 . . . A 38 LYS HB2 . 17578 1 14 . 1 1 3 3 LYS HG2 H 1 1.402 0.03 . 2 . . . A 38 LYS HG2 . 17578 1 15 . 1 1 3 3 LYS C C 13 179.176 0.30 . 1 . . . A 38 LYS C . 17578 1 16 . 1 1 3 3 LYS CA C 13 59.781 0.30 . 1 . . . A 38 LYS CA . 17578 1 17 . 1 1 3 3 LYS CB C 13 32.626 0.30 . 1 . . . A 38 LYS CB . 17578 1 18 . 1 1 3 3 LYS CG C 13 25.503 0.30 . 1 . . . A 38 LYS CG . 17578 1 19 . 1 1 4 4 LEU H H 1 7.877 0.03 . 1 . . . A 39 LEU H . 17578 1 20 . 1 1 4 4 LEU HA H 1 4.159 0.03 . 1 . . . A 39 LEU HA . 17578 1 21 . 1 1 4 4 LEU HB2 H 1 1.811 0.03 . 2 . . . A 39 LEU HB2 . 17578 1 22 . 1 1 4 4 LEU HG H 1 1.479 0.03 . 1 . . . A 39 LEU HG . 17578 1 23 . 1 1 4 4 LEU HD11 H 1 0.888 0.03 . 4 . . . A 39 LEU HD11 . 17578 1 24 . 1 1 4 4 LEU HD12 H 1 0.888 0.03 . 4 . . . A 39 LEU HD12 . 17578 1 25 . 1 1 4 4 LEU HD13 H 1 0.888 0.03 . 4 . . . A 39 LEU HD13 . 17578 1 26 . 1 1 4 4 LEU HD21 H 1 0.857 0.03 . 4 . . . A 39 LEU HD21 . 17578 1 27 . 1 1 4 4 LEU HD22 H 1 0.857 0.03 . 4 . . . A 39 LEU HD22 . 17578 1 28 . 1 1 4 4 LEU HD23 H 1 0.857 0.03 . 4 . . . A 39 LEU HD23 . 17578 1 29 . 1 1 4 4 LEU C C 13 178.232 0.30 . 1 . . . A 39 LEU C . 17578 1 30 . 1 1 4 4 LEU CA C 13 57.470 0.30 . 1 . . . A 39 LEU CA . 17578 1 31 . 1 1 4 4 LEU CB C 13 40.343 0.30 . 1 . . . A 39 LEU CB . 17578 1 32 . 1 1 4 4 LEU CG C 13 26.574 0.30 . 1 . . . A 39 LEU CG . 17578 1 33 . 1 1 4 4 LEU N N 15 122.003 0.30 . 1 . . . A 39 LEU N . 17578 1 34 . 1 1 5 5 ASN H H 1 9.313 0.03 . 1 . . . A 40 ASN H . 17578 1 35 . 1 1 5 5 ASN HA H 1 3.997 0.03 . 1 . . . A 40 ASN HA . 17578 1 36 . 1 1 5 5 ASN HB2 H 1 2.850 0.03 . 2 . . . A 40 ASN HB2 . 17578 1 37 . 1 1 5 5 ASN HB3 H 1 2.473 0.03 . 2 . . . A 40 ASN HB3 . 17578 1 38 . 1 1 5 5 ASN HD22 H 1 7.509 0.03 . 2 . . . A 40 ASN HD22 . 17578 1 39 . 1 1 5 5 ASN C C 13 176.054 0.30 . 1 . . . A 40 ASN C . 17578 1 40 . 1 1 5 5 ASN CA C 13 57.622 0.30 . 1 . . . A 40 ASN CA . 17578 1 41 . 1 1 5 5 ASN CB C 13 40.113 0.30 . 1 . . . A 40 ASN CB . 17578 1 42 . 1 1 5 5 ASN N N 15 118.692 0.30 . 1 . . . A 40 ASN N . 17578 1 43 . 1 1 5 5 ASN ND2 N 15 111.540 0.30 . 1 . . . A 40 ASN ND2 . 17578 1 44 . 1 1 6 6 LYS H H 1 7.230 0.03 . 1 . . . A 41 LYS H . 17578 1 45 . 1 1 6 6 LYS HA H 1 3.928 0.03 . 1 . . . A 41 LYS HA . 17578 1 46 . 1 1 6 6 LYS HB2 H 1 1.916 0.03 . 2 . . . A 41 LYS HB2 . 17578 1 47 . 1 1 6 6 LYS HG2 H 1 1.534 0.03 . 2 . . . A 41 LYS HG2 . 17578 1 48 . 1 1 6 6 LYS HD2 H 1 1.691 0.03 . 2 . . . A 41 LYS HD2 . 17578 1 49 . 1 1 6 6 LYS HE2 H 1 2.907 0.03 . 2 . . . A 41 LYS HE2 . 17578 1 50 . 1 1 6 6 LYS C C 13 179.133 0.30 . 1 . . . A 41 LYS C . 17578 1 51 . 1 1 6 6 LYS CA C 13 59.909 0.30 . 1 . . . A 41 LYS CA . 17578 1 52 . 1 1 6 6 LYS CB C 13 32.256 0.30 . 1 . . . A 41 LYS CB . 17578 1 53 . 1 1 6 6 LYS CG C 13 25.433 0.30 . 1 . . . A 41 LYS CG . 17578 1 54 . 1 1 6 6 LYS CD C 13 29.220 0.30 . 1 . . . A 41 LYS CD . 17578 1 55 . 1 1 6 6 LYS N N 15 115.497 0.30 . 1 . . . A 41 LYS N . 17578 1 56 . 1 1 7 7 LYS H H 1 7.367 0.03 . 1 . . . A 42 LYS H . 17578 1 57 . 1 1 7 7 LYS HA H 1 4.040 0.03 . 1 . . . A 42 LYS HA . 17578 1 58 . 1 1 7 7 LYS HB2 H 1 1.872 0.03 . 2 . . . A 42 LYS HB2 . 17578 1 59 . 1 1 7 7 LYS HG2 H 1 1.390 0.03 . 2 . . . A 42 LYS HG2 . 17578 1 60 . 1 1 7 7 LYS HE2 H 1 2.853 0.03 . 2 . . . A 42 LYS HE2 . 17578 1 61 . 1 1 7 7 LYS C C 13 180.272 0.30 . 1 . . . A 42 LYS C . 17578 1 62 . 1 1 7 7 LYS CA C 13 59.988 0.30 . 1 . . . A 42 LYS CA . 17578 1 63 . 1 1 7 7 LYS CB C 13 33.462 0.30 . 1 . . . A 42 LYS CB . 17578 1 64 . 1 1 7 7 LYS CG C 13 25.501 0.30 . 1 . . . A 42 LYS CG . 17578 1 65 . 1 1 7 7 LYS N N 15 118.961 0.30 . 1 . . . A 42 LYS N . 17578 1 66 . 1 1 8 8 VAL H H 1 9.215 0.03 . 1 . . . A 43 VAL H . 17578 1 67 . 1 1 8 8 VAL HA H 1 3.303 0.03 . 1 . . . A 43 VAL HA . 17578 1 68 . 1 1 8 8 VAL HB H 1 2.199 0.03 . 1 . . . A 43 VAL HB . 17578 1 69 . 1 1 8 8 VAL HG11 H 1 0.816 0.03 . 4 . . . A 43 VAL HG11 . 17578 1 70 . 1 1 8 8 VAL HG12 H 1 0.816 0.03 . 4 . . . A 43 VAL HG12 . 17578 1 71 . 1 1 8 8 VAL HG13 H 1 0.816 0.03 . 4 . . . A 43 VAL HG13 . 17578 1 72 . 1 1 8 8 VAL HG21 H 1 0.722 0.03 . 4 . . . A 43 VAL HG21 . 17578 1 73 . 1 1 8 8 VAL HG22 H 1 0.722 0.03 . 4 . . . A 43 VAL HG22 . 17578 1 74 . 1 1 8 8 VAL HG23 H 1 0.722 0.03 . 4 . . . A 43 VAL HG23 . 17578 1 75 . 1 1 8 8 VAL CA C 13 67.430 0.30 . 1 . . . A 43 VAL CA . 17578 1 76 . 1 1 8 8 VAL CB C 13 31.374 0.30 . 1 . . . A 43 VAL CB . 17578 1 77 . 1 1 8 8 VAL CG2 C 13 23.016 0.30 . 2 . . . A 43 VAL CG2 . 17578 1 78 . 1 1 8 8 VAL N N 15 122.400 0.30 . 1 . . . A 43 VAL N . 17578 1 79 . 1 1 9 9 LEU H H 1 8.471 0.03 . 1 . . . A 44 LEU H . 17578 1 80 . 1 1 9 9 LEU HA H 1 3.833 0.03 . 1 . . . A 44 LEU HA . 17578 1 81 . 1 1 9 9 LEU HB2 H 1 1.858 0.03 . 2 . . . A 44 LEU HB2 . 17578 1 82 . 1 1 9 9 LEU HB3 H 1 1.357 0.03 . 2 . . . A 44 LEU HB3 . 17578 1 83 . 1 1 9 9 LEU HG H 1 1.339 0.03 . 1 . . . A 44 LEU HG . 17578 1 84 . 1 1 9 9 LEU HD11 H 1 0.862 0.03 . 4 . . . A 44 LEU HD11 . 17578 1 85 . 1 1 9 9 LEU HD12 H 1 0.862 0.03 . 4 . . . A 44 LEU HD12 . 17578 1 86 . 1 1 9 9 LEU HD13 H 1 0.862 0.03 . 4 . . . A 44 LEU HD13 . 17578 1 87 . 1 1 9 9 LEU HD21 H 1 0.665 0.03 . 4 . . . A 44 LEU HD21 . 17578 1 88 . 1 1 9 9 LEU HD22 H 1 0.665 0.03 . 4 . . . A 44 LEU HD22 . 17578 1 89 . 1 1 9 9 LEU HD23 H 1 0.665 0.03 . 4 . . . A 44 LEU HD23 . 17578 1 90 . 1 1 9 9 LEU CA C 13 58.453 0.30 . 1 . . . A 44 LEU CA . 17578 1 91 . 1 1 9 9 LEU CB C 13 41.171 0.30 . 1 . . . A 44 LEU CB . 17578 1 92 . 1 1 9 9 LEU CG C 13 27.044 0.30 . 1 . . . A 44 LEU CG . 17578 1 93 . 1 1 9 9 LEU CD1 C 13 26.512 0.30 . 2 . . . A 44 LEU CD1 . 17578 1 94 . 1 1 9 9 LEU N N 15 119.626 0.30 . 1 . . . A 44 LEU N . 17578 1 95 . 1 1 10 10 LYS H H 1 7.883 0.03 . 1 . . . A 45 LYS H . 17578 1 96 . 1 1 10 10 LYS HA H 1 4.026 0.03 . 1 . . . A 45 LYS HA . 17578 1 97 . 1 1 10 10 LYS HB2 H 1 1.917 0.03 . 2 . . . A 45 LYS HB2 . 17578 1 98 . 1 1 10 10 LYS HG2 H 1 1.618 0.03 . 2 . . . A 45 LYS HG2 . 17578 1 99 . 1 1 10 10 LYS HG3 H 1 1.382 0.03 . 2 . . . A 45 LYS HG3 . 17578 1 100 . 1 1 10 10 LYS HD2 H 1 1.663 0.03 . 2 . . . A 45 LYS HD2 . 17578 1 101 . 1 1 10 10 LYS HE2 H 1 3.019 0.03 . 2 . . . A 45 LYS HE2 . 17578 1 102 . 1 1 10 10 LYS CA C 13 59.919 0.30 . 1 . . . A 45 LYS CA . 17578 1 103 . 1 1 10 10 LYS CB C 13 32.430 0.30 . 1 . . . A 45 LYS CB . 17578 1 104 . 1 1 10 10 LYS CG C 13 25.375 0.30 . 1 . . . A 45 LYS CG . 17578 1 105 . 1 1 10 10 LYS N N 15 119.761 0.30 . 1 . . . A 45 LYS N . 17578 1 106 . 1 1 11 11 THR H H 1 7.805 0.03 . 1 . . . A 46 THR H . 17578 1 107 . 1 1 11 11 THR HA H 1 4.339 0.03 . 1 . . . A 46 THR HA . 17578 1 108 . 1 1 11 11 THR HB H 1 3.832 0.03 . 1 . . . A 46 THR HB . 17578 1 109 . 1 1 11 11 THR HG21 H 1 1.355 0.03 . 1 . . . A 46 THR HG21 . 17578 1 110 . 1 1 11 11 THR HG22 H 1 1.355 0.03 . 1 . . . A 46 THR HG22 . 17578 1 111 . 1 1 11 11 THR HG23 H 1 1.355 0.03 . 1 . . . A 46 THR HG23 . 17578 1 112 . 1 1 11 11 THR C C 13 175.987 0.30 . 1 . . . A 46 THR C . 17578 1 113 . 1 1 11 11 THR CB C 13 68.013 0.30 . 1 . . . A 46 THR CB . 17578 1 114 . 1 1 11 11 THR CG2 C 13 21.840 0.30 . 1 . . . A 46 THR CG2 . 17578 1 115 . 1 1 11 11 THR N N 15 116.469 0.30 . 1 . . . A 46 THR N . 17578 1 116 . 1 1 12 12 VAL H H 1 8.782 0.03 . 1 . . . A 47 VAL H . 17578 1 117 . 1 1 12 12 VAL HA H 1 3.232 0.03 . 1 . . . A 47 VAL HA . 17578 1 118 . 1 1 12 12 VAL HB H 1 2.180 0.03 . 1 . . . A 47 VAL HB . 17578 1 119 . 1 1 12 12 VAL HG11 H 1 0.899 0.03 . 4 . . . A 47 VAL HG11 . 17578 1 120 . 1 1 12 12 VAL HG12 H 1 0.899 0.03 . 4 . . . A 47 VAL HG12 . 17578 1 121 . 1 1 12 12 VAL HG13 H 1 0.899 0.03 . 4 . . . A 47 VAL HG13 . 17578 1 122 . 1 1 12 12 VAL HG21 H 1 0.732 0.03 . 4 . . . A 47 VAL HG21 . 17578 1 123 . 1 1 12 12 VAL HG22 H 1 0.732 0.03 . 4 . . . A 47 VAL HG22 . 17578 1 124 . 1 1 12 12 VAL HG23 H 1 0.732 0.03 . 4 . . . A 47 VAL HG23 . 17578 1 125 . 1 1 12 12 VAL CA C 13 67.331 0.30 . 1 . . . A 47 VAL CA . 17578 1 126 . 1 1 12 12 VAL CB C 13 31.438 0.30 . 1 . . . A 47 VAL CB . 17578 1 127 . 1 1 12 12 VAL CG1 C 13 23.852 0.30 . 2 . . . A 47 VAL CG1 . 17578 1 128 . 1 1 12 12 VAL CG2 C 13 19.283 0.30 . 2 . . . A 47 VAL CG2 . 17578 1 129 . 1 1 12 12 VAL N N 15 121.907 0.30 . 1 . . . A 47 VAL N . 17578 1 130 . 1 1 13 13 LYS H H 1 8.171 0.03 . 1 . . . A 48 LYS H . 17578 1 131 . 1 1 13 13 LYS HA H 1 4.258 0.03 . 1 . . . A 48 LYS HA . 17578 1 132 . 1 1 13 13 LYS HB2 H 1 1.965 0.03 . 2 . . . A 48 LYS HB2 . 17578 1 133 . 1 1 13 13 LYS HG2 H 1 1.409 0.03 . 2 . . . A 48 LYS HG2 . 17578 1 134 . 1 1 13 13 LYS HD2 H 1 1.661 0.03 . 2 . . . A 48 LYS HD2 . 17578 1 135 . 1 1 13 13 LYS C C 13 179.808 0.30 . 1 . . . A 48 LYS C . 17578 1 136 . 1 1 13 13 LYS CA C 13 59.999 0.30 . 1 . . . A 48 LYS CA . 17578 1 137 . 1 1 13 13 LYS CB C 13 32.553 0.30 . 1 . . . A 48 LYS CB . 17578 1 138 . 1 1 13 13 LYS CG C 13 24.555 0.30 . 1 . . . A 48 LYS CG . 17578 1 139 . 1 1 13 13 LYS CD C 13 29.512 0.30 . 1 . . . A 48 LYS CD . 17578 1 140 . 1 1 13 13 LYS N N 15 122.393 0.30 . 1 . . . A 48 LYS N . 17578 1 141 . 1 1 14 14 LYS H H 1 7.941 0.03 . 1 . . . A 49 LYS H . 17578 1 142 . 1 1 14 14 LYS HA H 1 3.973 0.03 . 1 . . . A 49 LYS HA . 17578 1 143 . 1 1 14 14 LYS HB2 H 1 1.682 0.03 . 2 . . . A 49 LYS HB2 . 17578 1 144 . 1 1 14 14 LYS HG2 H 1 1.500 0.03 . 2 . . . A 49 LYS HG2 . 17578 1 145 . 1 1 14 14 LYS HE2 H 1 2.983 0.03 . 2 . . . A 49 LYS HE2 . 17578 1 146 . 1 1 14 14 LYS CA C 13 59.811 0.30 . 1 . . . A 49 LYS CA . 17578 1 147 . 1 1 14 14 LYS CB C 13 33.389 0.30 . 1 . . . A 49 LYS CB . 17578 1 148 . 1 1 14 14 LYS CG C 13 25.932 0.30 . 1 . . . A 49 LYS CG . 17578 1 149 . 1 1 14 14 LYS N N 15 118.852 0.30 . 1 . . . A 49 LYS N . 17578 1 150 . 1 1 15 15 ALA H H 1 8.544 0.03 . 1 . . . A 50 ALA H . 17578 1 151 . 1 1 15 15 ALA HA H 1 3.496 0.03 . 1 . . . A 50 ALA HA . 17578 1 152 . 1 1 15 15 ALA HB1 H 1 0.850 0.03 . 1 . . . A 50 ALA HB1 . 17578 1 153 . 1 1 15 15 ALA HB2 H 1 0.850 0.03 . 1 . . . A 50 ALA HB2 . 17578 1 154 . 1 1 15 15 ALA HB3 H 1 0.850 0.03 . 1 . . . A 50 ALA HB3 . 17578 1 155 . 1 1 15 15 ALA CA C 13 54.709 0.30 . 1 . . . A 50 ALA CA . 17578 1 156 . 1 1 15 15 ALA CB C 13 18.917 0.30 . 1 . . . A 50 ALA CB . 17578 1 157 . 1 1 15 15 ALA N N 15 122.047 0.30 . 1 . . . A 50 ALA N . 17578 1 158 . 1 1 16 16 SER H H 1 8.551 0.03 . 1 . . . A 51 SER H . 17578 1 159 . 1 1 16 16 SER HA H 1 4.730 0.03 . 1 . . . A 51 SER HA . 17578 1 160 . 1 1 16 16 SER HB2 H 1 4.092 0.03 . 2 . . . A 51 SER HB2 . 17578 1 161 . 1 1 16 16 SER HB3 H 1 3.954 0.03 . 2 . . . A 51 SER HB3 . 17578 1 162 . 1 1 16 16 SER C C 13 178.560 0.30 . 1 . . . A 51 SER C . 17578 1 163 . 1 1 16 16 SER CA C 13 61.680 0.30 . 1 . . . A 51 SER CA . 17578 1 164 . 1 1 16 16 SER CB C 13 62.551 0.30 . 1 . . . A 51 SER CB . 17578 1 165 . 1 1 16 16 SER N N 15 116.561 0.30 . 1 . . . A 51 SER N . 17578 1 166 . 1 1 17 17 LYS H H 1 7.578 0.03 . 1 . . . A 52 LYS H . 17578 1 167 . 1 1 17 17 LYS HA H 1 4.072 0.03 . 1 . . . A 52 LYS HA . 17578 1 168 . 1 1 17 17 LYS HB2 H 1 1.942 0.03 . 2 . . . A 52 LYS HB2 . 17578 1 169 . 1 1 17 17 LYS HG2 H 1 1.551 0.03 . 2 . . . A 52 LYS HG2 . 17578 1 170 . 1 1 17 17 LYS HE2 H 1 3.112 0.03 . 2 . . . A 52 LYS HE2 . 17578 1 171 . 1 1 17 17 LYS C C 13 177.377 0.30 . 1 . . . A 52 LYS C . 17578 1 172 . 1 1 17 17 LYS CA C 13 58.931 0.30 . 1 . . . A 52 LYS CA . 17578 1 173 . 1 1 17 17 LYS CB C 13 31.961 0.30 . 1 . . . A 52 LYS CB . 17578 1 174 . 1 1 17 17 LYS CG C 13 24.885 0.30 . 1 . . . A 52 LYS CG . 17578 1 175 . 1 1 17 17 LYS CD C 13 29.168 0.30 . 1 . . . A 52 LYS CD . 17578 1 176 . 1 1 17 17 LYS N N 15 124.890 0.30 . 1 . . . A 52 LYS N . 17578 1 177 . 1 1 18 18 ALA H H 1 7.112 0.03 . 1 . . . A 53 ALA H . 17578 1 178 . 1 1 18 18 ALA HA H 1 4.285 0.03 . 1 . . . A 53 ALA HA . 17578 1 179 . 1 1 18 18 ALA HB1 H 1 1.456 0.03 . 1 . . . A 53 ALA HB1 . 17578 1 180 . 1 1 18 18 ALA HB2 H 1 1.456 0.03 . 1 . . . A 53 ALA HB2 . 17578 1 181 . 1 1 18 18 ALA HB3 H 1 1.456 0.03 . 1 . . . A 53 ALA HB3 . 17578 1 182 . 1 1 18 18 ALA C C 13 175.061 0.30 . 1 . . . A 53 ALA C . 17578 1 183 . 1 1 18 18 ALA CA C 13 51.822 0.30 . 1 . . . A 53 ALA CA . 17578 1 184 . 1 1 18 18 ALA CB C 13 19.390 0.30 . 1 . . . A 53 ALA CB . 17578 1 185 . 1 1 18 18 ALA N N 15 118.628 0.30 . 1 . . . A 53 ALA N . 17578 1 186 . 1 1 19 19 LYS H H 1 7.653 0.03 . 1 . . . A 54 LYS H . 17578 1 187 . 1 1 19 19 LYS HA H 1 4.026 0.03 . 1 . . . A 54 LYS HA . 17578 1 188 . 1 1 19 19 LYS HB2 H 1 1.936 0.03 . 2 . . . A 54 LYS HB2 . 17578 1 189 . 1 1 19 19 LYS HG2 H 1 1.385 0.03 . 2 . . . A 54 LYS HG2 . 17578 1 190 . 1 1 19 19 LYS HE2 H 1 2.966 0.03 . 2 . . . A 54 LYS HE2 . 17578 1 191 . 1 1 19 19 LYS CA C 13 57.222 0.30 . 1 . . . A 54 LYS CA . 17578 1 192 . 1 1 19 19 LYS CB C 13 28.387 0.30 . 1 . . . A 54 LYS CB . 17578 1 193 . 1 1 19 19 LYS CG C 13 25.089 0.30 . 1 . . . A 54 LYS CG . 17578 1 194 . 1 1 19 19 LYS N N 15 111.984 0.30 . 1 . . . A 54 LYS N . 17578 1 195 . 1 1 20 20 ASN H H 1 8.118 0.03 . 1 . . . A 55 ASN H . 17578 1 196 . 1 1 20 20 ASN HA H 1 5.102 0.03 . 1 . . . A 55 ASN HA . 17578 1 197 . 1 1 20 20 ASN HB2 H 1 3.351 0.03 . 2 . . . A 55 ASN HB2 . 17578 1 198 . 1 1 20 20 ASN C C 13 172.975 0.30 . 1 . . . A 55 ASN C . 17578 1 199 . 1 1 20 20 ASN CA C 13 51.215 0.30 . 1 . . . A 55 ASN CA . 17578 1 200 . 1 1 20 20 ASN CB C 13 40.316 0.30 . 1 . . . A 55 ASN CB . 17578 1 201 . 1 1 20 20 ASN N N 15 116.088 0.30 . 1 . . . A 55 ASN N . 17578 1 202 . 1 1 21 21 VAL H H 1 7.628 0.03 . 1 . . . A 56 VAL H . 17578 1 203 . 1 1 21 21 VAL HA H 1 4.938 0.03 . 1 . . . A 56 VAL HA . 17578 1 204 . 1 1 21 21 VAL HB H 1 1.804 0.03 . 1 . . . A 56 VAL HB . 17578 1 205 . 1 1 21 21 VAL HG11 H 1 0.694 0.03 . 4 . . . A 56 VAL HG11 . 17578 1 206 . 1 1 21 21 VAL HG12 H 1 0.694 0.03 . 4 . . . A 56 VAL HG12 . 17578 1 207 . 1 1 21 21 VAL HG13 H 1 0.694 0.03 . 4 . . . A 56 VAL HG13 . 17578 1 208 . 1 1 21 21 VAL HG21 H 1 0.660 0.03 . 4 . . . A 56 VAL HG21 . 17578 1 209 . 1 1 21 21 VAL HG22 H 1 0.660 0.03 . 4 . . . A 56 VAL HG22 . 17578 1 210 . 1 1 21 21 VAL HG23 H 1 0.660 0.03 . 4 . . . A 56 VAL HG23 . 17578 1 211 . 1 1 21 21 VAL C C 13 175.409 0.30 . 1 . . . A 56 VAL C . 17578 1 212 . 1 1 21 21 VAL CA C 13 60.901 0.30 . 1 . . . A 56 VAL CA . 17578 1 213 . 1 1 21 21 VAL CB C 13 35.368 0.30 . 1 . . . A 56 VAL CB . 17578 1 214 . 1 1 21 21 VAL CG1 C 13 22.406 0.30 . 2 . . . A 56 VAL CG1 . 17578 1 215 . 1 1 21 21 VAL N N 15 114.959 0.30 . 1 . . . A 56 VAL N . 17578 1 216 . 1 1 22 22 LYS H H 1 8.987 0.03 . 1 . . . A 57 LYS H . 17578 1 217 . 1 1 22 22 LYS HA H 1 4.712 0.03 . 1 . . . A 57 LYS HA . 17578 1 218 . 1 1 22 22 LYS HB2 H 1 1.834 0.03 . 2 . . . A 57 LYS HB2 . 17578 1 219 . 1 1 22 22 LYS HB3 H 1 1.598 0.03 . 2 . . . A 57 LYS HB3 . 17578 1 220 . 1 1 22 22 LYS HG2 H 1 1.402 0.03 . 2 . . . A 57 LYS HG2 . 17578 1 221 . 1 1 22 22 LYS HE2 H 1 2.962 0.03 . 2 . . . A 57 LYS HE2 . 17578 1 222 . 1 1 22 22 LYS C C 13 175.394 0.30 . 1 . . . A 57 LYS C . 17578 1 223 . 1 1 22 22 LYS CA C 13 54.485 0.30 . 1 . . . A 57 LYS CA . 17578 1 224 . 1 1 22 22 LYS CB C 13 33.669 0.30 . 1 . . . A 57 LYS CB . 17578 1 225 . 1 1 22 22 LYS CG C 13 25.171 0.30 . 1 . . . A 57 LYS CG . 17578 1 226 . 1 1 22 22 LYS CD C 13 28.763 0.30 . 1 . . . A 57 LYS CD . 17578 1 227 . 1 1 22 22 LYS N N 15 126.485 0.30 . 1 . . . A 57 LYS N . 17578 1 228 . 1 1 23 23 ARG H H 1 9.024 0.03 . 1 . . . A 58 ARG H . 17578 1 229 . 1 1 23 23 ARG HA H 1 4.837 0.03 . 1 . . . A 58 ARG HA . 17578 1 230 . 1 1 23 23 ARG HB2 H 1 1.759 0.03 . 2 . . . A 58 ARG HB2 . 17578 1 231 . 1 1 23 23 ARG HB3 H 1 1.720 0.03 . 2 . . . A 58 ARG HB3 . 17578 1 232 . 1 1 23 23 ARG HG2 H 1 1.551 0.03 . 2 . . . A 58 ARG HG2 . 17578 1 233 . 1 1 23 23 ARG HG3 H 1 1.430 0.03 . 2 . . . A 58 ARG HG3 . 17578 1 234 . 1 1 23 23 ARG HD2 H 1 3.206 0.03 . 2 . . . A 58 ARG HD2 . 17578 1 235 . 1 1 23 23 ARG C C 13 175.930 0.30 . 1 . . . A 58 ARG C . 17578 1 236 . 1 1 23 23 ARG CA C 13 55.872 0.30 . 1 . . . A 58 ARG CA . 17578 1 237 . 1 1 23 23 ARG CB C 13 33.513 0.30 . 1 . . . A 58 ARG CB . 17578 1 238 . 1 1 23 23 ARG CG C 13 27.885 0.30 . 1 . . . A 58 ARG CG . 17578 1 239 . 1 1 23 23 ARG CD C 13 43.456 0.30 . 1 . . . A 58 ARG CD . 17578 1 240 . 1 1 23 23 ARG N N 15 122.011 0.30 . 1 . . . A 58 ARG N . 17578 1 241 . 1 1 24 24 GLY H H 1 8.315 0.03 . 1 . . . A 59 GLY H . 17578 1 242 . 1 1 24 24 GLY HA2 H 1 4.502 0.03 . 2 . . . A 59 GLY HA2 . 17578 1 243 . 1 1 24 24 GLY HA3 H 1 4.088 0.03 . 2 . . . A 59 GLY HA3 . 17578 1 244 . 1 1 24 24 GLY CA C 13 44.790 0.30 . 1 . . . A 59 GLY CA . 17578 1 245 . 1 1 24 24 GLY N N 15 111.007 0.30 . 1 . . . A 59 GLY N . 17578 1 246 . 1 1 25 25 VAL H H 1 8.152 0.03 . 1 . . . A 60 VAL H . 17578 1 247 . 1 1 25 25 VAL HA H 1 3.156 0.03 . 1 . . . A 60 VAL HA . 17578 1 248 . 1 1 25 25 VAL HB H 1 2.029 0.03 . 1 . . . A 60 VAL HB . 17578 1 249 . 1 1 25 25 VAL HG11 H 1 1.070 0.03 . 4 . . . A 60 VAL HG11 . 17578 1 250 . 1 1 25 25 VAL HG12 H 1 1.070 0.03 . 4 . . . A 60 VAL HG12 . 17578 1 251 . 1 1 25 25 VAL HG13 H 1 1.070 0.03 . 4 . . . A 60 VAL HG13 . 17578 1 252 . 1 1 25 25 VAL HG21 H 1 1.035 0.03 . 4 . . . A 60 VAL HG21 . 17578 1 253 . 1 1 25 25 VAL HG22 H 1 1.035 0.03 . 4 . . . A 60 VAL HG22 . 17578 1 254 . 1 1 25 25 VAL HG23 H 1 1.035 0.03 . 4 . . . A 60 VAL HG23 . 17578 1 255 . 1 1 25 25 VAL C C 13 176.562 0.30 . 1 . . . A 60 VAL C . 17578 1 256 . 1 1 25 25 VAL CA C 13 68.037 0.30 . 1 . . . A 60 VAL CA . 17578 1 257 . 1 1 25 25 VAL CB C 13 32.050 0.30 . 1 . . . A 60 VAL CB . 17578 1 258 . 1 1 25 25 VAL CG1 C 13 23.034 0.30 . 2 . . . A 60 VAL CG1 . 17578 1 259 . 1 1 25 25 VAL CG2 C 13 21.464 0.30 . 2 . . . A 60 VAL CG2 . 17578 1 260 . 1 1 25 25 VAL N N 15 119.423 0.30 . 1 . . . A 60 VAL N . 17578 1 261 . 1 1 26 26 LYS H H 1 8.156 0.03 . 1 . . . A 61 LYS H . 17578 1 262 . 1 1 26 26 LYS HA H 1 3.919 0.03 . 1 . . . A 61 LYS HA . 17578 1 263 . 1 1 26 26 LYS HB2 H 1 1.822 0.03 . 2 . . . A 61 LYS HB2 . 17578 1 264 . 1 1 26 26 LYS HG2 H 1 1.537 0.03 . 2 . . . A 61 LYS HG2 . 17578 1 265 . 1 1 26 26 LYS HE2 H 1 2.984 0.03 . 2 . . . A 61 LYS HE2 . 17578 1 266 . 1 1 26 26 LYS C C 13 180.130 0.30 . 1 . . . A 61 LYS C . 17578 1 267 . 1 1 26 26 LYS CA C 13 60.157 0.30 . 1 . . . A 61 LYS CA . 17578 1 268 . 1 1 26 26 LYS CB C 13 32.041 0.30 . 1 . . . A 61 LYS CB . 17578 1 269 . 1 1 26 26 LYS CG C 13 25.409 0.30 . 1 . . . A 61 LYS CG . 17578 1 270 . 1 1 26 26 LYS CE C 13 42.017 0.30 . 1 . . . A 61 LYS CE . 17578 1 271 . 1 1 26 26 LYS N N 15 117.316 0.30 . 1 . . . A 61 LYS N . 17578 1 272 . 1 1 27 27 GLU H H 1 8.531 0.03 . 1 . . . A 62 GLU H . 17578 1 273 . 1 1 27 27 GLU HA H 1 3.961 0.03 . 1 . . . A 62 GLU HA . 17578 1 274 . 1 1 27 27 GLU HB2 H 1 1.942 0.03 . 2 . . . A 62 GLU HB2 . 17578 1 275 . 1 1 27 27 GLU HG2 H 1 2.528 0.03 . 2 . . . A 62 GLU HG2 . 17578 1 276 . 1 1 27 27 GLU HG3 H 1 2.325 0.03 . 2 . . . A 62 GLU HG3 . 17578 1 277 . 1 1 27 27 GLU CA C 13 58.787 0.30 . 1 . . . A 62 GLU CA . 17578 1 278 . 1 1 27 27 GLU CB C 13 29.843 0.30 . 1 . . . A 62 GLU CB . 17578 1 279 . 1 1 27 27 GLU CG C 13 37.129 0.30 . 1 . . . A 62 GLU CG . 17578 1 280 . 1 1 27 27 GLU N N 15 117.535 0.30 . 1 . . . A 62 GLU N . 17578 1 281 . 1 1 28 28 VAL H H 1 8.255 0.03 . 1 . . . A 63 VAL H . 17578 1 282 . 1 1 28 28 VAL HA H 1 3.498 0.03 . 1 . . . A 63 VAL HA . 17578 1 283 . 1 1 28 28 VAL HB H 1 1.940 0.03 . 1 . . . A 63 VAL HB . 17578 1 284 . 1 1 28 28 VAL HG11 H 1 0.899 0.03 . 4 . . . A 63 VAL HG11 . 17578 1 285 . 1 1 28 28 VAL HG12 H 1 0.899 0.03 . 4 . . . A 63 VAL HG12 . 17578 1 286 . 1 1 28 28 VAL HG13 H 1 0.899 0.03 . 4 . . . A 63 VAL HG13 . 17578 1 287 . 1 1 28 28 VAL HG21 H 1 0.572 0.03 . 4 . . . A 63 VAL HG21 . 17578 1 288 . 1 1 28 28 VAL HG22 H 1 0.572 0.03 . 4 . . . A 63 VAL HG22 . 17578 1 289 . 1 1 28 28 VAL HG23 H 1 0.572 0.03 . 4 . . . A 63 VAL HG23 . 17578 1 290 . 1 1 28 28 VAL CA C 13 68.099 0.30 . 1 . . . A 63 VAL CA . 17578 1 291 . 1 1 28 28 VAL CB C 13 31.376 0.30 . 1 . . . A 63 VAL CB . 17578 1 292 . 1 1 28 28 VAL CG1 C 13 24.650 0.30 . 2 . . . A 63 VAL CG1 . 17578 1 293 . 1 1 28 28 VAL CG2 C 13 20.364 0.30 . 2 . . . A 63 VAL CG2 . 17578 1 294 . 1 1 28 28 VAL N N 15 120.589 0.30 . 1 . . . A 63 VAL N . 17578 1 295 . 1 1 29 29 VAL H H 1 8.535 0.03 . 1 . . . A 64 VAL H . 17578 1 296 . 1 1 29 29 VAL HA H 1 3.359 0.03 . 1 . . . A 64 VAL HA . 17578 1 297 . 1 1 29 29 VAL HB H 1 2.064 0.03 . 1 . . . A 64 VAL HB . 17578 1 298 . 1 1 29 29 VAL HG11 H 1 0.934 0.03 . 4 . . . A 64 VAL HG11 . 17578 1 299 . 1 1 29 29 VAL HG12 H 1 0.934 0.03 . 4 . . . A 64 VAL HG12 . 17578 1 300 . 1 1 29 29 VAL HG13 H 1 0.934 0.03 . 4 . . . A 64 VAL HG13 . 17578 1 301 . 1 1 29 29 VAL HG21 H 1 0.868 0.03 . 4 . . . A 64 VAL HG21 . 17578 1 302 . 1 1 29 29 VAL HG22 H 1 0.868 0.03 . 4 . . . A 64 VAL HG22 . 17578 1 303 . 1 1 29 29 VAL HG23 H 1 0.868 0.03 . 4 . . . A 64 VAL HG23 . 17578 1 304 . 1 1 29 29 VAL C C 13 177.549 0.30 . 1 . . . A 64 VAL C . 17578 1 305 . 1 1 29 29 VAL CA C 13 67.456 0.30 . 1 . . . A 64 VAL CA . 17578 1 306 . 1 1 29 29 VAL CB C 13 31.233 0.30 . 1 . . . A 64 VAL CB . 17578 1 307 . 1 1 29 29 VAL CG1 C 13 23.606 0.30 . 2 . . . A 64 VAL CG1 . 17578 1 308 . 1 1 29 29 VAL CG2 C 13 21.155 0.30 . 2 . . . A 64 VAL CG2 . 17578 1 309 . 1 1 29 29 VAL N N 15 118.570 0.30 . 1 . . . A 64 VAL N . 17578 1 310 . 1 1 30 30 LYS H H 1 7.538 0.03 . 1 . . . A 65 LYS H . 17578 1 311 . 1 1 30 30 LYS HA H 1 3.875 0.03 . 1 . . . A 65 LYS HA . 17578 1 312 . 1 1 30 30 LYS HB2 H 1 1.840 0.03 . 2 . . . A 65 LYS HB2 . 17578 1 313 . 1 1 30 30 LYS HG2 H 1 1.536 0.03 . 2 . . . A 65 LYS HG2 . 17578 1 314 . 1 1 30 30 LYS HG3 H 1 1.321 0.03 . 2 . . . A 65 LYS HG3 . 17578 1 315 . 1 1 30 30 LYS HE2 H 1 2.906 0.03 . 2 . . . A 65 LYS HE2 . 17578 1 316 . 1 1 30 30 LYS CA C 13 59.811 0.30 . 1 . . . A 65 LYS CA . 17578 1 317 . 1 1 30 30 LYS CB C 13 32.715 0.30 . 1 . . . A 65 LYS CB . 17578 1 318 . 1 1 30 30 LYS CG C 13 25.096 0.30 . 1 . . . A 65 LYS CG . 17578 1 319 . 1 1 30 30 LYS N N 15 117.926 0.30 . 1 . . . A 65 LYS N . 17578 1 320 . 1 1 31 31 ALA H H 1 7.496 0.03 . 1 . . . A 66 ALA H . 17578 1 321 . 1 1 31 31 ALA HA H 1 4.071 0.03 . 1 . . . A 66 ALA HA . 17578 1 322 . 1 1 31 31 ALA HB1 H 1 1.489 0.03 . 1 . . . A 66 ALA HB1 . 17578 1 323 . 1 1 31 31 ALA HB2 H 1 1.489 0.03 . 1 . . . A 66 ALA HB2 . 17578 1 324 . 1 1 31 31 ALA HB3 H 1 1.489 0.03 . 1 . . . A 66 ALA HB3 . 17578 1 325 . 1 1 31 31 ALA C C 13 179.596 0.30 . 1 . . . A 66 ALA C . 17578 1 326 . 1 1 31 31 ALA CA C 13 55.051 0.30 . 1 . . . A 66 ALA CA . 17578 1 327 . 1 1 31 31 ALA CB C 13 18.901 0.30 . 1 . . . A 66 ALA CB . 17578 1 328 . 1 1 31 31 ALA N N 15 120.475 0.30 . 1 . . . A 66 ALA N . 17578 1 329 . 1 1 32 32 LEU H H 1 8.376 0.03 . 1 . . . A 67 LEU H . 17578 1 330 . 1 1 32 32 LEU HA H 1 3.854 0.03 . 1 . . . A 67 LEU HA . 17578 1 331 . 1 1 32 32 LEU HB2 H 1 1.811 0.03 . 2 . . . A 67 LEU HB2 . 17578 1 332 . 1 1 32 32 LEU HB3 H 1 0.658 0.03 . 2 . . . A 67 LEU HB3 . 17578 1 333 . 1 1 32 32 LEU HG H 1 3.155 0.03 . 1 . . . A 67 LEU HG . 17578 1 334 . 1 1 32 32 LEU HD21 H 1 0.443 0.03 . 4 . . . A 67 LEU HD21 . 17578 1 335 . 1 1 32 32 LEU HD22 H 1 0.443 0.03 . 4 . . . A 67 LEU HD22 . 17578 1 336 . 1 1 32 32 LEU HD23 H 1 0.443 0.03 . 4 . . . A 67 LEU HD23 . 17578 1 337 . 1 1 32 32 LEU CA C 13 57.859 0.30 . 1 . . . A 67 LEU CA . 17578 1 338 . 1 1 32 32 LEU CB C 13 42.442 0.30 . 1 . . . A 67 LEU CB . 17578 1 339 . 1 1 32 32 LEU CG C 13 26.721 0.30 . 1 . . . A 67 LEU CG . 17578 1 340 . 1 1 32 32 LEU CD2 C 13 21.869 0.30 . 2 . . . A 67 LEU CD2 . 17578 1 341 . 1 1 32 32 LEU N N 15 119.357 0.30 . 1 . . . A 67 LEU N . 17578 1 342 . 1 1 33 33 ARG H H 1 8.091 0.03 . 1 . . . A 68 ARG H . 17578 1 343 . 1 1 33 33 ARG HA H 1 3.802 0.03 . 1 . . . A 68 ARG HA . 17578 1 344 . 1 1 33 33 ARG HB2 H 1 1.824 0.03 . 2 . . . A 68 ARG HB2 . 17578 1 345 . 1 1 33 33 ARG HG2 H 1 1.404 0.03 . 2 . . . A 68 ARG HG2 . 17578 1 346 . 1 1 33 33 ARG HD2 H 1 3.147 0.03 . 2 . . . A 68 ARG HD2 . 17578 1 347 . 1 1 33 33 ARG CA C 13 59.306 0.30 . 1 . . . A 68 ARG CA . 17578 1 348 . 1 1 33 33 ARG CB C 13 29.759 0.30 . 1 . . . A 68 ARG CB . 17578 1 349 . 1 1 33 33 ARG CG C 13 28.812 0.30 . 1 . . . A 68 ARG CG . 17578 1 350 . 1 1 33 33 ARG CD C 13 43.704 0.30 . 1 . . . A 68 ARG CD . 17578 1 351 . 1 1 33 33 ARG N N 15 116.045 0.30 . 1 . . . A 68 ARG N . 17578 1 352 . 1 1 34 34 LYS H H 1 7.616 0.03 . 1 . . . A 69 LYS H . 17578 1 353 . 1 1 34 34 LYS HA H 1 4.255 0.03 . 1 . . . A 69 LYS HA . 17578 1 354 . 1 1 34 34 LYS HB2 H 1 1.965 0.03 . 2 . . . A 69 LYS HB2 . 17578 1 355 . 1 1 34 34 LYS HG2 H 1 1.580 0.03 . 2 . . . A 69 LYS HG2 . 17578 1 356 . 1 1 34 34 LYS HD2 H 1 1.662 0.03 . 2 . . . A 69 LYS HD2 . 17578 1 357 . 1 1 34 34 LYS HE2 H 1 2.968 0.03 . 2 . . . A 69 LYS HE2 . 17578 1 358 . 1 1 34 34 LYS C C 13 176.831 0.30 . 1 . . . A 69 LYS C . 17578 1 359 . 1 1 34 34 LYS CA C 13 56.548 0.30 . 1 . . . A 69 LYS CA . 17578 1 360 . 1 1 34 34 LYS CB C 13 32.710 0.30 . 1 . . . A 69 LYS CB . 17578 1 361 . 1 1 34 34 LYS CG C 13 25.087 0.30 . 1 . . . A 69 LYS CG . 17578 1 362 . 1 1 34 34 LYS CD C 13 29.158 0.30 . 1 . . . A 69 LYS CD . 17578 1 363 . 1 1 34 34 LYS N N 15 117.845 0.30 . 1 . . . A 69 LYS N . 17578 1 364 . 1 1 35 35 GLY H H 1 7.739 0.03 . 1 . . . A 70 GLY H . 17578 1 365 . 1 1 35 35 GLY HA2 H 1 4.252 0.03 . 2 . . . A 70 GLY HA2 . 17578 1 366 . 1 1 35 35 GLY HA3 H 1 3.867 0.03 . 2 . . . A 70 GLY HA3 . 17578 1 367 . 1 1 35 35 GLY CA C 13 45.537 0.30 . 1 . . . A 70 GLY CA . 17578 1 368 . 1 1 35 35 GLY N N 15 106.783 0.30 . 1 . . . A 70 GLY N . 17578 1 369 . 1 1 36 36 GLU H H 1 7.698 0.03 . 1 . . . A 71 GLU H . 17578 1 370 . 1 1 36 36 GLU HA H 1 4.226 0.03 . 1 . . . A 71 GLU HA . 17578 1 371 . 1 1 36 36 GLU HB2 H 1 1.813 0.03 . 2 . . . A 71 GLU HB2 . 17578 1 372 . 1 1 36 36 GLU HB3 H 1 1.579 0.03 . 2 . . . A 71 GLU HB3 . 17578 1 373 . 1 1 36 36 GLU HG2 H 1 2.181 0.03 . 2 . . . A 71 GLU HG2 . 17578 1 374 . 1 1 36 36 GLU C C 13 175.400 0.30 . 1 . . . A 71 GLU C . 17578 1 375 . 1 1 36 36 GLU CA C 13 57.414 0.30 . 1 . . . A 71 GLU CA . 17578 1 376 . 1 1 36 36 GLU CB C 13 29.442 0.30 . 1 . . . A 71 GLU CB . 17578 1 377 . 1 1 36 36 GLU CG C 13 36.831 0.30 . 1 . . . A 71 GLU CG . 17578 1 378 . 1 1 36 36 GLU N N 15 119.424 0.30 . 1 . . . A 71 GLU N . 17578 1 379 . 1 1 37 37 LYS H H 1 8.223 0.03 . 1 . . . A 72 LYS H . 17578 1 380 . 1 1 37 37 LYS HA H 1 4.903 0.03 . 1 . . . A 72 LYS HA . 17578 1 381 . 1 1 37 37 LYS HB2 H 1 2.130 0.03 . 2 . . . A 72 LYS HB2 . 17578 1 382 . 1 1 37 37 LYS HB3 H 1 1.739 0.03 . 2 . . . A 72 LYS HB3 . 17578 1 383 . 1 1 37 37 LYS HG2 H 1 1.572 0.03 . 2 . . . A 72 LYS HG2 . 17578 1 384 . 1 1 37 37 LYS HD2 H 1 1.709 0.03 . 2 . . . A 72 LYS HD2 . 17578 1 385 . 1 1 37 37 LYS HE2 H 1 3.003 0.03 . 2 . . . A 72 LYS HE2 . 17578 1 386 . 1 1 37 37 LYS C C 13 175.809 0.30 . 1 . . . A 72 LYS C . 17578 1 387 . 1 1 37 37 LYS CA C 13 53.791 0.30 . 1 . . . A 72 LYS CA . 17578 1 388 . 1 1 37 37 LYS CB C 13 34.781 0.30 . 1 . . . A 72 LYS CB . 17578 1 389 . 1 1 37 37 LYS CG C 13 24.538 0.30 . 1 . . . A 72 LYS CG . 17578 1 390 . 1 1 37 37 LYS N N 15 118.290 0.30 . 1 . . . A 72 LYS N . 17578 1 391 . 1 1 38 38 GLY H H 1 7.217 0.03 . 1 . . . A 73 GLY H . 17578 1 392 . 1 1 38 38 GLY HA2 H 1 4.119 0.03 . 2 . . . A 73 GLY HA2 . 17578 1 393 . 1 1 38 38 GLY HA3 H 1 3.820 0.03 . 2 . . . A 73 GLY HA3 . 17578 1 394 . 1 1 38 38 GLY C C 13 171.884 0.30 . 1 . . . A 73 GLY C . 17578 1 395 . 1 1 38 38 GLY CA C 13 46.360 0.30 . 1 . . . A 73 GLY CA . 17578 1 396 . 1 1 38 38 GLY N N 15 104.682 0.30 . 1 . . . A 73 GLY N . 17578 1 397 . 1 1 39 39 LEU H H 1 8.945 0.03 . 1 . . . A 74 LEU H . 17578 1 398 . 1 1 39 39 LEU HA H 1 4.994 0.03 . 1 . . . A 74 LEU HA . 17578 1 399 . 1 1 39 39 LEU HB2 H 1 1.801 0.03 . 2 . . . A 74 LEU HB2 . 17578 1 400 . 1 1 39 39 LEU HB3 H 1 1.373 0.03 . 2 . . . A 74 LEU HB3 . 17578 1 401 . 1 1 39 39 LEU HG H 1 1.347 0.03 . 1 . . . A 74 LEU HG . 17578 1 402 . 1 1 39 39 LEU HD11 H 1 0.702 0.03 . 4 . . . A 74 LEU HD11 . 17578 1 403 . 1 1 39 39 LEU HD12 H 1 0.702 0.03 . 4 . . . A 74 LEU HD12 . 17578 1 404 . 1 1 39 39 LEU HD13 H 1 0.702 0.03 . 4 . . . A 74 LEU HD13 . 17578 1 405 . 1 1 39 39 LEU HD21 H 1 0.606 0.03 . 4 . . . A 74 LEU HD21 . 17578 1 406 . 1 1 39 39 LEU HD22 H 1 0.606 0.03 . 4 . . . A 74 LEU HD22 . 17578 1 407 . 1 1 39 39 LEU HD23 H 1 0.606 0.03 . 4 . . . A 74 LEU HD23 . 17578 1 408 . 1 1 39 39 LEU C C 13 174.380 0.30 . 1 . . . A 74 LEU C . 17578 1 409 . 1 1 39 39 LEU CA C 13 54.363 0.30 . 1 . . . A 74 LEU CA . 17578 1 410 . 1 1 39 39 LEU CB C 13 47.028 0.30 . 1 . . . A 74 LEU CB . 17578 1 411 . 1 1 39 39 LEU CD2 C 13 26.438 0.30 . 2 . . . A 74 LEU CD2 . 17578 1 412 . 1 1 39 39 LEU N N 15 125.372 0.30 . 1 . . . A 74 LEU N . 17578 1 413 . 1 1 40 40 VAL H H 1 8.551 0.03 . 1 . . . A 75 VAL H . 17578 1 414 . 1 1 40 40 VAL HA H 1 4.644 0.03 . 1 . . . A 75 VAL HA . 17578 1 415 . 1 1 40 40 VAL HB H 1 1.796 0.03 . 1 . . . A 75 VAL HB . 17578 1 416 . 1 1 40 40 VAL HG11 H 1 0.458 0.03 . 4 . . . A 75 VAL HG11 . 17578 1 417 . 1 1 40 40 VAL HG12 H 1 0.458 0.03 . 4 . . . A 75 VAL HG12 . 17578 1 418 . 1 1 40 40 VAL HG13 H 1 0.458 0.03 . 4 . . . A 75 VAL HG13 . 17578 1 419 . 1 1 40 40 VAL HG21 H 1 0.154 0.03 . 4 . . . A 75 VAL HG21 . 17578 1 420 . 1 1 40 40 VAL HG22 H 1 0.154 0.03 . 4 . . . A 75 VAL HG22 . 17578 1 421 . 1 1 40 40 VAL HG23 H 1 0.154 0.03 . 4 . . . A 75 VAL HG23 . 17578 1 422 . 1 1 40 40 VAL C C 13 173.667 0.30 . 1 . . . A 75 VAL C . 17578 1 423 . 1 1 40 40 VAL CA C 13 62.273 0.30 . 1 . . . A 75 VAL CA . 17578 1 424 . 1 1 40 40 VAL CB C 13 32.591 0.30 . 1 . . . A 75 VAL CB . 17578 1 425 . 1 1 40 40 VAL CG1 C 13 21.708 0.30 . 2 . . . A 75 VAL CG1 . 17578 1 426 . 1 1 40 40 VAL CG2 C 13 23.727 0.30 . 2 . . . A 75 VAL CG2 . 17578 1 427 . 1 1 40 40 VAL N N 15 130.967 0.30 . 1 . . . A 75 VAL N . 17578 1 428 . 1 1 41 41 VAL H H 1 8.804 0.03 . 1 . . . A 76 VAL H . 17578 1 429 . 1 1 41 41 VAL HA H 1 4.660 0.03 . 1 . . . A 76 VAL HA . 17578 1 430 . 1 1 41 41 VAL HB H 1 2.988 0.03 . 1 . . . A 76 VAL HB . 17578 1 431 . 1 1 41 41 VAL HG11 H 1 0.697 0.03 . 4 . . . A 76 VAL HG11 . 17578 1 432 . 1 1 41 41 VAL HG12 H 1 0.697 0.03 . 4 . . . A 76 VAL HG12 . 17578 1 433 . 1 1 41 41 VAL HG13 H 1 0.697 0.03 . 4 . . . A 76 VAL HG13 . 17578 1 434 . 1 1 41 41 VAL HG21 H 1 0.574 0.03 . 4 . . . A 76 VAL HG21 . 17578 1 435 . 1 1 41 41 VAL HG22 H 1 0.574 0.03 . 4 . . . A 76 VAL HG22 . 17578 1 436 . 1 1 41 41 VAL HG23 H 1 0.574 0.03 . 4 . . . A 76 VAL HG23 . 17578 1 437 . 1 1 41 41 VAL C C 13 173.669 0.30 . 1 . . . A 76 VAL C . 17578 1 438 . 1 1 41 41 VAL CA C 13 60.899 0.30 . 1 . . . A 76 VAL CA . 17578 1 439 . 1 1 41 41 VAL CB C 13 33.346 0.30 . 1 . . . A 76 VAL CB . 17578 1 440 . 1 1 41 41 VAL CG1 C 13 23.139 0.30 . 2 . . . A 76 VAL CG1 . 17578 1 441 . 1 1 41 41 VAL CG2 C 13 20.047 0.30 . 2 . . . A 76 VAL CG2 . 17578 1 442 . 1 1 41 41 VAL N N 15 127.493 0.30 . 1 . . . A 76 VAL N . 17578 1 443 . 1 1 42 42 ILE H H 1 8.613 0.03 . 1 . . . A 77 ILE H . 17578 1 444 . 1 1 42 42 ILE HA H 1 4.444 0.03 . 1 . . . A 77 ILE HA . 17578 1 445 . 1 1 42 42 ILE HB H 1 0.536 0.03 . 1 . . . A 77 ILE HB . 17578 1 446 . 1 1 42 42 ILE HG12 H 1 1.169 0.03 . 2 . . . A 77 ILE HG12 . 17578 1 447 . 1 1 42 42 ILE HG13 H 1 0.323 0.03 . 2 . . . A 77 ILE HG13 . 17578 1 448 . 1 1 42 42 ILE HG21 H 1 0.872 0.03 . 1 . . . A 77 ILE HG21 . 17578 1 449 . 1 1 42 42 ILE HG22 H 1 0.872 0.03 . 1 . . . A 77 ILE HG22 . 17578 1 450 . 1 1 42 42 ILE HG23 H 1 0.872 0.03 . 1 . . . A 77 ILE HG23 . 17578 1 451 . 1 1 42 42 ILE HD11 H 1 -0.002 0.03 . 4 . . . A 77 ILE HD11 . 17578 1 452 . 1 1 42 42 ILE HD12 H 1 -0.002 0.03 . 4 . . . A 77 ILE HD12 . 17578 1 453 . 1 1 42 42 ILE HD13 H 1 -0.002 0.03 . 4 . . . A 77 ILE HD13 . 17578 1 454 . 1 1 42 42 ILE C C 13 174.817 0.30 . 1 . . . A 77 ILE C . 17578 1 455 . 1 1 42 42 ILE CA C 13 59.700 0.30 . 1 . . . A 77 ILE CA . 17578 1 456 . 1 1 42 42 ILE CB C 13 39.977 0.30 . 1 . . . A 77 ILE CB . 17578 1 457 . 1 1 42 42 ILE CG1 C 13 28.342 0.30 . 1 . . . A 77 ILE CG1 . 17578 1 458 . 1 1 42 42 ILE CG2 C 13 19.826 0.30 . 1 . . . A 77 ILE CG2 . 17578 1 459 . 1 1 42 42 ILE N N 15 125.646 0.30 . 1 . . . A 77 ILE N . 17578 1 460 . 1 1 43 43 ALA H H 1 8.565 0.03 . 1 . . . A 78 ALA H . 17578 1 461 . 1 1 43 43 ALA HA H 1 4.459 0.03 . 1 . . . A 78 ALA HA . 17578 1 462 . 1 1 43 43 ALA HB1 H 1 1.484 0.03 . 1 . . . A 78 ALA HB1 . 17578 1 463 . 1 1 43 43 ALA HB2 H 1 1.484 0.03 . 1 . . . A 78 ALA HB2 . 17578 1 464 . 1 1 43 43 ALA HB3 H 1 1.484 0.03 . 1 . . . A 78 ALA HB3 . 17578 1 465 . 1 1 43 43 ALA C C 13 177.584 0.30 . 1 . . . A 78 ALA C . 17578 1 466 . 1 1 43 43 ALA CA C 13 52.372 0.30 . 1 . . . A 78 ALA CA . 17578 1 467 . 1 1 43 43 ALA CB C 13 19.504 0.30 . 1 . . . A 78 ALA CB . 17578 1 468 . 1 1 43 43 ALA N N 15 128.691 0.30 . 1 . . . A 78 ALA N . 17578 1 469 . 1 1 44 44 GLY H H 1 9.083 0.03 . 1 . . . A 79 GLY H . 17578 1 470 . 1 1 44 44 GLY HA2 H 1 4.288 0.03 . 2 . . . A 79 GLY HA2 . 17578 1 471 . 1 1 44 44 GLY HA3 H 1 3.384 0.03 . 2 . . . A 79 GLY HA3 . 17578 1 472 . 1 1 44 44 GLY C C 13 173.252 0.30 . 1 . . . A 79 GLY C . 17578 1 473 . 1 1 44 44 GLY CA C 13 45.764 0.30 . 1 . . . A 79 GLY CA . 17578 1 474 . 1 1 44 44 GLY N N 15 103.957 0.30 . 1 . . . A 79 GLY N . 17578 1 475 . 1 1 45 45 ASP H H 1 8.695 0.03 . 1 . . . A 80 ASP H . 17578 1 476 . 1 1 45 45 ASP HA H 1 4.918 0.03 . 1 . . . A 80 ASP HA . 17578 1 477 . 1 1 45 45 ASP HB2 H 1 2.944 0.03 . 2 . . . A 80 ASP HB2 . 17578 1 478 . 1 1 45 45 ASP HB3 H 1 2.619 0.03 . 2 . . . A 80 ASP HB3 . 17578 1 479 . 1 1 45 45 ASP CA C 13 52.689 0.30 . 1 . . . A 80 ASP CA . 17578 1 480 . 1 1 45 45 ASP CB C 13 39.118 0.30 . 1 . . . A 80 ASP CB . 17578 1 481 . 1 1 45 45 ASP N N 15 118.632 0.30 . 1 . . . A 80 ASP N . 17578 1 482 . 1 1 46 46 ILE H H 1 6.730 0.03 . 1 . . . A 81 ILE H . 17578 1 483 . 1 1 46 46 ILE HA H 1 4.179 0.03 . 1 . . . A 81 ILE HA . 17578 1 484 . 1 1 46 46 ILE HB H 1 1.812 0.03 . 1 . . . A 81 ILE HB . 17578 1 485 . 1 1 46 46 ILE HG12 H 1 1.395 0.03 . 2 . . . A 81 ILE HG12 . 17578 1 486 . 1 1 46 46 ILE HG21 H 1 0.945 0.03 . 1 . . . A 81 ILE HG21 . 17578 1 487 . 1 1 46 46 ILE HG22 H 1 0.945 0.03 . 1 . . . A 81 ILE HG22 . 17578 1 488 . 1 1 46 46 ILE HG23 H 1 0.945 0.03 . 1 . . . A 81 ILE HG23 . 17578 1 489 . 1 1 46 46 ILE HD11 H 1 0.922 0.03 . 4 . . . A 81 ILE HD11 . 17578 1 490 . 1 1 46 46 ILE HD12 H 1 0.922 0.03 . 4 . . . A 81 ILE HD12 . 17578 1 491 . 1 1 46 46 ILE HD13 H 1 0.922 0.03 . 4 . . . A 81 ILE HD13 . 17578 1 492 . 1 1 46 46 ILE C C 13 172.890 0.30 . 1 . . . A 81 ILE C . 17578 1 493 . 1 1 46 46 ILE CA C 13 59.242 0.30 . 1 . . . A 81 ILE CA . 17578 1 494 . 1 1 46 46 ILE CB C 13 39.253 0.30 . 1 . . . A 81 ILE CB . 17578 1 495 . 1 1 46 46 ILE CG1 C 13 27.813 0.30 . 1 . . . A 81 ILE CG1 . 17578 1 496 . 1 1 46 46 ILE CG2 C 13 18.233 0.30 . 1 . . . A 81 ILE CG2 . 17578 1 497 . 1 1 46 46 ILE N N 15 117.935 0.30 . 1 . . . A 81 ILE N . 17578 1 498 . 1 1 47 47 TRP H H 1 7.804 0.03 . 1 . . . A 82 TRP H . 17578 1 499 . 1 1 47 47 TRP HA H 1 4.587 0.03 . 1 . . . A 82 TRP HA . 17578 1 500 . 1 1 47 47 TRP HB2 H 1 3.146 0.03 . 2 . . . A 82 TRP HB2 . 17578 1 501 . 1 1 47 47 TRP HD1 H 1 7.222 0.03 . 1 . . . A 82 TRP HD1 . 17578 1 502 . 1 1 47 47 TRP HE1 H 1 10.216 0.03 . 1 . . . A 82 TRP HE1 . 17578 1 503 . 1 1 47 47 TRP CA C 13 55.386 0.30 . 1 . . . A 82 TRP CA . 17578 1 504 . 1 1 47 47 TRP CB C 13 32.147 0.30 . 1 . . . A 82 TRP CB . 17578 1 505 . 1 1 47 47 TRP N N 15 123.585 0.30 . 1 . . . A 82 TRP N . 17578 1 506 . 1 1 47 47 TRP NE1 N 15 129.730 0.30 . 1 . . . A 82 TRP NE1 . 17578 1 507 . 1 1 48 48 PRO HA H 1 4.248 0.03 . 1 . . . A 83 PRO HA . 17578 1 508 . 1 1 48 48 PRO HB3 H 1 1.797 0.03 . 2 . . . A 83 PRO HB3 . 17578 1 509 . 1 1 48 48 PRO HG2 H 1 1.272 0.03 . 2 . . . A 83 PRO HG2 . 17578 1 510 . 1 1 48 48 PRO HD2 H 1 3.617 0.03 . 2 . . . A 83 PRO HD2 . 17578 1 511 . 1 1 48 48 PRO CA C 13 62.712 0.30 . 1 . . . A 83 PRO CA . 17578 1 512 . 1 1 48 48 PRO CB C 13 34.011 0.30 . 1 . . . A 83 PRO CB . 17578 1 513 . 1 1 48 48 PRO CG C 13 24.780 0.30 . 1 . . . A 83 PRO CG . 17578 1 514 . 1 1 49 49 ALA H H 1 8.198 0.03 . 1 . . . A 84 ALA H . 17578 1 515 . 1 1 49 49 ALA HA H 1 3.969 0.03 . 1 . . . A 84 ALA HA . 17578 1 516 . 1 1 49 49 ALA HB1 H 1 1.316 0.03 . 1 . . . A 84 ALA HB1 . 17578 1 517 . 1 1 49 49 ALA HB2 H 1 1.316 0.03 . 1 . . . A 84 ALA HB2 . 17578 1 518 . 1 1 49 49 ALA HB3 H 1 1.316 0.03 . 1 . . . A 84 ALA HB3 . 17578 1 519 . 1 1 49 49 ALA CA C 13 54.183 0.30 . 1 . . . A 84 ALA CA . 17578 1 520 . 1 1 49 49 ALA CB C 13 19.404 0.30 . 1 . . . A 84 ALA CB . 17578 1 521 . 1 1 49 49 ALA N N 15 121.827 0.30 . 1 . . . A 84 ALA N . 17578 1 522 . 1 1 50 50 ASP H H 1 8.008 0.03 . 1 . . . A 85 ASP H . 17578 1 523 . 1 1 50 50 ASP HA H 1 4.301 0.03 . 1 . . . A 85 ASP HA . 17578 1 524 . 1 1 50 50 ASP HB2 H 1 2.565 0.03 . 2 . . . A 85 ASP HB2 . 17578 1 525 . 1 1 50 50 ASP C C 13 177.428 0.30 . 1 . . . A 85 ASP C . 17578 1 526 . 1 1 50 50 ASP CA C 13 55.777 0.30 . 1 . . . A 85 ASP CA . 17578 1 527 . 1 1 50 50 ASP CB C 13 40.060 0.30 . 1 . . . A 85 ASP CB . 17578 1 528 . 1 1 50 50 ASP N N 15 114.049 0.30 . 1 . . . A 85 ASP N . 17578 1 529 . 1 1 51 51 VAL H H 1 7.542 0.03 . 1 . . . A 86 VAL H . 17578 1 530 . 1 1 51 51 VAL HA H 1 3.841 0.03 . 1 . . . A 86 VAL HA . 17578 1 531 . 1 1 51 51 VAL HB H 1 2.064 0.03 . 1 . . . A 86 VAL HB . 17578 1 532 . 1 1 51 51 VAL HG11 H 1 1.007 0.03 . 4 . . . A 86 VAL HG11 . 17578 1 533 . 1 1 51 51 VAL HG12 H 1 1.007 0.03 . 4 . . . A 86 VAL HG12 . 17578 1 534 . 1 1 51 51 VAL HG13 H 1 1.007 0.03 . 4 . . . A 86 VAL HG13 . 17578 1 535 . 1 1 51 51 VAL HG21 H 1 0.971 0.03 . 4 . . . A 86 VAL HG21 . 17578 1 536 . 1 1 51 51 VAL HG22 H 1 0.971 0.03 . 4 . . . A 86 VAL HG22 . 17578 1 537 . 1 1 51 51 VAL HG23 H 1 0.971 0.03 . 4 . . . A 86 VAL HG23 . 17578 1 538 . 1 1 51 51 VAL C C 13 176.231 0.30 . 1 . . . A 86 VAL C . 17578 1 539 . 1 1 51 51 VAL CA C 13 65.332 0.30 . 1 . . . A 86 VAL CA . 17578 1 540 . 1 1 51 51 VAL CB C 13 32.123 0.30 . 1 . . . A 86 VAL CB . 17578 1 541 . 1 1 51 51 VAL CG1 C 13 21.572 0.30 . 2 . . . A 86 VAL CG1 . 17578 1 542 . 1 1 51 51 VAL N N 15 116.790 0.30 . 1 . . . A 86 VAL N . 17578 1 543 . 1 1 52 52 ILE H H 1 7.310 0.03 . 1 . . . A 87 ILE H . 17578 1 544 . 1 1 52 52 ILE HA H 1 4.638 0.03 . 1 . . . A 87 ILE HA . 17578 1 545 . 1 1 52 52 ILE HB H 1 2.111 0.03 . 1 . . . A 87 ILE HB . 17578 1 546 . 1 1 52 52 ILE HG12 H 1 1.448 0.03 . 2 . . . A 87 ILE HG12 . 17578 1 547 . 1 1 52 52 ILE HG13 H 1 1.277 0.03 . 2 . . . A 87 ILE HG13 . 17578 1 548 . 1 1 52 52 ILE HG21 H 1 1.020 0.03 . 1 . . . A 87 ILE HG21 . 17578 1 549 . 1 1 52 52 ILE HG22 H 1 1.020 0.03 . 1 . . . A 87 ILE HG22 . 17578 1 550 . 1 1 52 52 ILE HG23 H 1 1.020 0.03 . 1 . . . A 87 ILE HG23 . 17578 1 551 . 1 1 52 52 ILE HD11 H 1 0.897 0.03 . 4 . . . A 87 ILE HD11 . 17578 1 552 . 1 1 52 52 ILE HD12 H 1 0.897 0.03 . 4 . . . A 87 ILE HD12 . 17578 1 553 . 1 1 52 52 ILE HD13 H 1 0.897 0.03 . 4 . . . A 87 ILE HD13 . 17578 1 554 . 1 1 52 52 ILE C C 13 178.026 0.30 . 1 . . . A 87 ILE C . 17578 1 555 . 1 1 52 52 ILE CA C 13 59.806 0.30 . 1 . . . A 87 ILE CA . 17578 1 556 . 1 1 52 52 ILE CB C 13 40.742 0.30 . 1 . . . A 87 ILE CB . 17578 1 557 . 1 1 52 52 ILE CG2 C 13 20.269 0.30 . 1 . . . A 87 ILE CG2 . 17578 1 558 . 1 1 52 52 ILE N N 15 107.529 0.30 . 1 . . . A 87 ILE N . 17578 1 559 . 1 1 53 53 SER H H 1 7.827 0.03 . 1 . . . A 88 SER H . 17578 1 560 . 1 1 53 53 SER HA H 1 4.566 0.03 . 1 . . . A 88 SER HA . 17578 1 561 . 1 1 53 53 SER HB3 H 1 3.658 0.03 . 2 . . . A 88 SER HB3 . 17578 1 562 . 1 1 53 53 SER CA C 13 61.760 0.30 . 1 . . . A 88 SER CA . 17578 1 563 . 1 1 53 53 SER CB C 13 62.391 0.30 . 1 . . . A 88 SER CB . 17578 1 564 . 1 1 53 53 SER N N 15 116.004 0.30 . 1 . . . A 88 SER N . 17578 1 565 . 1 1 54 54 HIS HA H 1 4.572 0.03 . 1 . . . A 89 HIS HA . 17578 1 566 . 1 1 54 54 HIS HB2 H 1 2.969 0.03 . 2 . . . A 89 HIS HB2 . 17578 1 567 . 1 1 54 54 HIS HD2 H 1 6.885 0.03 . 1 . . . A 89 HIS HD2 . 17578 1 568 . 1 1 54 54 HIS CA C 13 56.789 0.30 . 1 . . . A 89 HIS CA . 17578 1 569 . 1 1 54 54 HIS CB C 13 30.527 0.30 . 1 . . . A 89 HIS CB . 17578 1 570 . 1 1 55 55 ILE H H 1 7.764 0.03 . 1 . . . A 90 ILE H . 17578 1 571 . 1 1 55 55 ILE HA H 1 3.512 0.03 . 1 . . . A 90 ILE HA . 17578 1 572 . 1 1 55 55 ILE HB H 1 2.005 0.03 . 1 . . . A 90 ILE HB . 17578 1 573 . 1 1 55 55 ILE HG21 H 1 0.520 0.03 . 1 . . . A 90 ILE HG21 . 17578 1 574 . 1 1 55 55 ILE HG22 H 1 0.520 0.03 . 1 . . . A 90 ILE HG22 . 17578 1 575 . 1 1 55 55 ILE HG23 H 1 0.520 0.03 . 1 . . . A 90 ILE HG23 . 17578 1 576 . 1 1 55 55 ILE HD11 H 1 0.413 0.03 . 4 . . . A 90 ILE HD11 . 17578 1 577 . 1 1 55 55 ILE HD12 H 1 0.413 0.03 . 4 . . . A 90 ILE HD12 . 17578 1 578 . 1 1 55 55 ILE HD13 H 1 0.413 0.03 . 4 . . . A 90 ILE HD13 . 17578 1 579 . 1 1 55 55 ILE CA C 13 65.424 0.30 . 1 . . . A 90 ILE CA . 17578 1 580 . 1 1 55 55 ILE CB C 13 34.176 0.30 . 1 . . . A 90 ILE CB . 17578 1 581 . 1 1 55 55 ILE N N 15 120.579 0.30 . 1 . . . A 90 ILE N . 17578 1 582 . 1 1 56 56 PRO HA H 1 2.942 0.03 . 1 . . . A 91 PRO HA . 17578 1 583 . 1 1 56 56 PRO HB3 H 1 1.660 0.03 . 2 . . . A 91 PRO HB3 . 17578 1 584 . 1 1 56 56 PRO HG2 H 1 1.400 0.03 . 2 . . . A 91 PRO HG2 . 17578 1 585 . 1 1 56 56 PRO C C 13 177.032 0.30 . 1 . . . A 91 PRO C . 17578 1 586 . 1 1 56 56 PRO CA C 13 66.842 0.30 . 1 . . . A 91 PRO CA . 17578 1 587 . 1 1 56 56 PRO CB C 13 31.206 0.30 . 1 . . . A 91 PRO CB . 17578 1 588 . 1 1 56 56 PRO CG C 13 29.086 0.30 . 1 . . . A 91 PRO CG . 17578 1 589 . 1 1 57 57 VAL H H 1 6.497 0.03 . 1 . . . A 92 VAL H . 17578 1 590 . 1 1 57 57 VAL HA H 1 3.574 0.03 . 1 . . . A 92 VAL HA . 17578 1 591 . 1 1 57 57 VAL HB H 1 1.977 0.03 . 1 . . . A 92 VAL HB . 17578 1 592 . 1 1 57 57 VAL HG11 H 1 0.971 0.03 . 4 . . . A 92 VAL HG11 . 17578 1 593 . 1 1 57 57 VAL HG12 H 1 0.971 0.03 . 4 . . . A 92 VAL HG12 . 17578 1 594 . 1 1 57 57 VAL HG13 H 1 0.971 0.03 . 4 . . . A 92 VAL HG13 . 17578 1 595 . 1 1 57 57 VAL HG21 H 1 0.923 0.03 . 4 . . . A 92 VAL HG21 . 17578 1 596 . 1 1 57 57 VAL HG22 H 1 0.923 0.03 . 4 . . . A 92 VAL HG22 . 17578 1 597 . 1 1 57 57 VAL HG23 H 1 0.923 0.03 . 4 . . . A 92 VAL HG23 . 17578 1 598 . 1 1 57 57 VAL CA C 13 65.900 0.30 . 1 . . . A 92 VAL CA . 17578 1 599 . 1 1 57 57 VAL CB C 13 31.600 0.30 . 1 . . . A 92 VAL CB . 17578 1 600 . 1 1 57 57 VAL CG1 C 13 22.169 0.30 . 2 . . . A 92 VAL CG1 . 17578 1 601 . 1 1 57 57 VAL N N 15 114.379 0.30 . 1 . . . A 92 VAL N . 17578 1 602 . 1 1 58 58 LEU H H 1 7.460 0.03 . 1 . . . A 93 LEU H . 17578 1 603 . 1 1 58 58 LEU HA H 1 4.227 0.03 . 1 . . . A 93 LEU HA . 17578 1 604 . 1 1 58 58 LEU HB2 H 1 1.781 0.03 . 2 . . . A 93 LEU HB2 . 17578 1 605 . 1 1 58 58 LEU HB3 H 1 1.501 0.03 . 2 . . . A 93 LEU HB3 . 17578 1 606 . 1 1 58 58 LEU HG H 1 1.068 0.03 . 1 . . . A 93 LEU HG . 17578 1 607 . 1 1 58 58 LEU HD11 H 1 0.955 0.03 . 4 . . . A 93 LEU HD11 . 17578 1 608 . 1 1 58 58 LEU HD12 H 1 0.955 0.03 . 4 . . . A 93 LEU HD12 . 17578 1 609 . 1 1 58 58 LEU HD13 H 1 0.955 0.03 . 4 . . . A 93 LEU HD13 . 17578 1 610 . 1 1 58 58 LEU HD21 H 1 0.464 0.03 . 4 . . . A 93 LEU HD21 . 17578 1 611 . 1 1 58 58 LEU HD22 H 1 0.464 0.03 . 4 . . . A 93 LEU HD22 . 17578 1 612 . 1 1 58 58 LEU HD23 H 1 0.464 0.03 . 4 . . . A 93 LEU HD23 . 17578 1 613 . 1 1 58 58 LEU C C 13 180.251 0.30 . 1 . . . A 93 LEU C . 17578 1 614 . 1 1 58 58 LEU CA C 13 57.838 0.30 . 1 . . . A 93 LEU CA . 17578 1 615 . 1 1 58 58 LEU CB C 13 43.172 0.30 . 1 . . . A 93 LEU CB . 17578 1 616 . 1 1 58 58 LEU CD1 C 13 25.926 0.30 . 2 . . . A 93 LEU CD1 . 17578 1 617 . 1 1 58 58 LEU N N 15 120.522 0.30 . 1 . . . A 93 LEU N . 17578 1 618 . 1 1 59 59 CYS H H 1 8.335 0.03 . 1 . . . A 94 CYS H . 17578 1 619 . 1 1 59 59 CYS HA H 1 3.867 0.03 . 1 . . . A 94 CYS HA . 17578 1 620 . 1 1 59 59 CYS HB2 H 1 2.835 0.03 . 2 . . . A 94 CYS HB2 . 17578 1 621 . 1 1 59 59 CYS HG H 1 1.825 0.03 . 1 . . . A 94 CYS HG . 17578 1 622 . 1 1 59 59 CYS C C 13 176.362 0.30 . 1 . . . A 94 CYS C . 17578 1 623 . 1 1 59 59 CYS CA C 13 65.379 0.30 . 1 . . . A 94 CYS CA . 17578 1 624 . 1 1 59 59 CYS CB C 13 26.344 0.30 . 1 . . . A 94 CYS CB . 17578 1 625 . 1 1 59 59 CYS N N 15 117.195 0.30 . 1 . . . A 94 CYS N . 17578 1 626 . 1 1 60 60 GLU H H 1 8.235 0.03 . 1 . . . A 95 GLU H . 17578 1 627 . 1 1 60 60 GLU HA H 1 4.209 0.03 . 1 . . . A 95 GLU HA . 17578 1 628 . 1 1 60 60 GLU HB2 H 1 2.178 0.03 . 2 . . . A 95 GLU HB2 . 17578 1 629 . 1 1 60 60 GLU HG2 H 1 2.447 0.03 . 2 . . . A 95 GLU HG2 . 17578 1 630 . 1 1 60 60 GLU CA C 13 59.760 0.30 . 1 . . . A 95 GLU CA . 17578 1 631 . 1 1 60 60 GLU CB C 13 29.201 0.30 . 1 . . . A 95 GLU CB . 17578 1 632 . 1 1 60 60 GLU CG C 13 36.610 0.30 . 1 . . . A 95 GLU CG . 17578 1 633 . 1 1 60 60 GLU N N 15 120.777 0.30 . 1 . . . A 95 GLU N . 17578 1 634 . 1 1 61 61 ASP H H 1 8.509 0.03 . 1 . . . A 96 ASP H . 17578 1 635 . 1 1 61 61 ASP HA H 1 4.292 0.03 . 1 . . . A 96 ASP HA . 17578 1 636 . 1 1 61 61 ASP HB2 H 1 2.789 0.03 . 2 . . . A 96 ASP HB2 . 17578 1 637 . 1 1 61 61 ASP HB3 H 1 2.334 0.03 . 2 . . . A 96 ASP HB3 . 17578 1 638 . 1 1 61 61 ASP C C 13 177.890 0.30 . 1 . . . A 96 ASP C . 17578 1 639 . 1 1 61 61 ASP CA C 13 57.235 0.30 . 1 . . . A 96 ASP CA . 17578 1 640 . 1 1 61 61 ASP CB C 13 40.580 0.30 . 1 . . . A 96 ASP CB . 17578 1 641 . 1 1 61 61 ASP N N 15 120.910 0.30 . 1 . . . A 96 ASP N . 17578 1 642 . 1 1 62 62 HIS H H 1 7.635 0.03 . 1 . . . A 97 HIS H . 17578 1 643 . 1 1 62 62 HIS HA H 1 4.495 0.03 . 1 . . . A 97 HIS HA . 17578 1 644 . 1 1 62 62 HIS HB2 H 1 2.719 0.03 . 2 . . . A 97 HIS HB2 . 17578 1 645 . 1 1 62 62 HIS HD2 H 1 7.052 0.03 . 1 . . . A 97 HIS HD2 . 17578 1 646 . 1 1 62 62 HIS C C 13 173.548 0.30 . 1 . . . A 97 HIS C . 17578 1 647 . 1 1 62 62 HIS CA C 13 57.290 0.30 . 1 . . . A 97 HIS CA . 17578 1 648 . 1 1 62 62 HIS CB C 13 29.997 0.30 . 1 . . . A 97 HIS CB . 17578 1 649 . 1 1 62 62 HIS N N 15 115.923 0.30 . 1 . . . A 97 HIS N . 17578 1 650 . 1 1 63 63 SER H H 1 7.888 0.03 . 1 . . . A 98 SER H . 17578 1 651 . 1 1 63 63 SER HA H 1 4.489 0.03 . 1 . . . A 98 SER HA . 17578 1 652 . 1 1 63 63 SER HB2 H 1 4.109 0.03 . 2 . . . A 98 SER HB2 . 17578 1 653 . 1 1 63 63 SER C C 13 173.949 0.30 . 1 . . . A 98 SER C . 17578 1 654 . 1 1 63 63 SER CA C 13 58.842 0.30 . 1 . . . A 98 SER CA . 17578 1 655 . 1 1 63 63 SER CB C 13 61.396 0.30 . 1 . . . A 98 SER CB . 17578 1 656 . 1 1 63 63 SER N N 15 114.634 0.30 . 1 . . . A 98 SER N . 17578 1 657 . 1 1 64 64 VAL H H 1 8.590 0.03 . 1 . . . A 99 VAL H . 17578 1 658 . 1 1 64 64 VAL HA H 1 4.721 0.03 . 1 . . . A 99 VAL HA . 17578 1 659 . 1 1 64 64 VAL HB H 1 1.665 0.03 . 1 . . . A 99 VAL HB . 17578 1 660 . 1 1 64 64 VAL HG11 H 1 1.106 0.03 . 4 . . . A 99 VAL HG11 . 17578 1 661 . 1 1 64 64 VAL HG12 H 1 1.106 0.03 . 4 . . . A 99 VAL HG12 . 17578 1 662 . 1 1 64 64 VAL HG13 H 1 1.106 0.03 . 4 . . . A 99 VAL HG13 . 17578 1 663 . 1 1 64 64 VAL HG21 H 1 0.985 0.03 . 4 . . . A 99 VAL HG21 . 17578 1 664 . 1 1 64 64 VAL HG22 H 1 0.985 0.03 . 4 . . . A 99 VAL HG22 . 17578 1 665 . 1 1 64 64 VAL HG23 H 1 0.985 0.03 . 4 . . . A 99 VAL HG23 . 17578 1 666 . 1 1 64 64 VAL CA C 13 58.978 0.30 . 1 . . . A 99 VAL CA . 17578 1 667 . 1 1 64 64 VAL CB C 13 35.228 0.30 . 1 . . . A 99 VAL CB . 17578 1 668 . 1 1 64 64 VAL CG1 C 13 22.941 0.30 . 2 . . . A 99 VAL CG1 . 17578 1 669 . 1 1 64 64 VAL CG2 C 13 21.311 0.30 . 2 . . . A 99 VAL CG2 . 17578 1 670 . 1 1 64 64 VAL N N 15 123.090 0.30 . 1 . . . A 99 VAL N . 17578 1 671 . 1 1 65 65 PRO HA H 1 4.263 0.03 . 1 . . . A 100 PRO HA . 17578 1 672 . 1 1 65 65 PRO HB2 H 1 1.683 0.03 . 2 . . . A 100 PRO HB2 . 17578 1 673 . 1 1 65 65 PRO HB3 H 1 2.095 0.03 . 2 . . . A 100 PRO HB3 . 17578 1 674 . 1 1 65 65 PRO HG2 H 1 1.678 0.03 . 2 . . . A 100 PRO HG2 . 17578 1 675 . 1 1 65 65 PRO HD2 H 1 3.570 0.03 . 2 . . . A 100 PRO HD2 . 17578 1 676 . 1 1 65 65 PRO C C 13 173.191 0.30 . 1 . . . A 100 PRO C . 17578 1 677 . 1 1 65 65 PRO CA C 13 63.427 0.30 . 1 . . . A 100 PRO CA . 17578 1 678 . 1 1 65 65 PRO CB C 13 31.863 0.30 . 1 . . . A 100 PRO CB . 17578 1 679 . 1 1 65 65 PRO CG C 13 27.231 0.30 . 1 . . . A 100 PRO CG . 17578 1 680 . 1 1 66 66 TYR H H 1 6.243 0.03 . 1 . . . A 101 TYR H . 17578 1 681 . 1 1 66 66 TYR HA H 1 5.925 0.03 . 1 . . . A 101 TYR HA . 17578 1 682 . 1 1 66 66 TYR HB2 H 1 3.008 0.03 . 2 . . . A 101 TYR HB2 . 17578 1 683 . 1 1 66 66 TYR HB3 H 1 2.256 0.03 . 2 . . . A 101 TYR HB3 . 17578 1 684 . 1 1 66 66 TYR HD2 H 1 6.957 0.03 . 3 . . . A 101 TYR HD2 . 17578 1 685 . 1 1 66 66 TYR HE2 H 1 6.747 0.03 . 3 . . . A 101 TYR HE2 . 17578 1 686 . 1 1 66 66 TYR CA C 13 53.501 0.30 . 1 . . . A 101 TYR CA . 17578 1 687 . 1 1 66 66 TYR CB C 13 41.793 0.30 . 1 . . . A 101 TYR CB . 17578 1 688 . 1 1 66 66 TYR N N 15 114.702 0.30 . 1 . . . A 101 TYR N . 17578 1 689 . 1 1 67 67 ILE H H 1 7.986 0.03 . 1 . . . A 102 ILE H . 17578 1 690 . 1 1 67 67 ILE HA H 1 4.502 0.03 . 1 . . . A 102 ILE HA . 17578 1 691 . 1 1 67 67 ILE HB H 1 1.736 0.03 . 1 . . . A 102 ILE HB . 17578 1 692 . 1 1 67 67 ILE HG21 H 1 1.361 0.03 . 1 . . . A 102 ILE HG21 . 17578 1 693 . 1 1 67 67 ILE HG22 H 1 1.361 0.03 . 1 . . . A 102 ILE HG22 . 17578 1 694 . 1 1 67 67 ILE HG23 H 1 1.361 0.03 . 1 . . . A 102 ILE HG23 . 17578 1 695 . 1 1 67 67 ILE HD11 H 1 0.801 0.03 . 4 . . . A 102 ILE HD11 . 17578 1 696 . 1 1 67 67 ILE HD12 H 1 0.801 0.03 . 4 . . . A 102 ILE HD12 . 17578 1 697 . 1 1 67 67 ILE HD13 H 1 0.801 0.03 . 4 . . . A 102 ILE HD13 . 17578 1 698 . 1 1 67 67 ILE C C 13 172.358 0.30 . 1 . . . A 102 ILE C . 17578 1 699 . 1 1 67 67 ILE CA C 13 55.442 0.30 . 1 . . . A 102 ILE CA . 17578 1 700 . 1 1 67 67 ILE CB C 13 43.124 0.30 . 1 . . . A 102 ILE CB . 17578 1 701 . 1 1 67 67 ILE CD1 C 13 18.789 0.30 . 1 . . . A 102 ILE CD1 . 17578 1 702 . 1 1 67 67 ILE N N 15 111.885 0.30 . 1 . . . A 102 ILE N . 17578 1 703 . 1 1 68 68 PHE H H 1 8.108 0.03 . 1 . . . A 103 PHE H . 17578 1 704 . 1 1 68 68 PHE HA H 1 5.087 0.03 . 1 . . . A 103 PHE HA . 17578 1 705 . 1 1 68 68 PHE HB2 H 1 3.065 0.03 . 2 . . . A 103 PHE HB2 . 17578 1 706 . 1 1 68 68 PHE HD1 H 1 7.228 0.03 . 3 . . . A 103 PHE HD1 . 17578 1 707 . 1 1 68 68 PHE C C 13 176.173 0.30 . 1 . . . A 103 PHE C . 17578 1 708 . 1 1 68 68 PHE CA C 13 56.103 0.30 . 1 . . . A 103 PHE CA . 17578 1 709 . 1 1 68 68 PHE CB C 13 39.891 0.30 . 1 . . . A 103 PHE CB . 17578 1 710 . 1 1 68 68 PHE N N 15 122.274 0.30 . 1 . . . A 103 PHE N . 17578 1 711 . 1 1 69 69 ILE H H 1 8.843 0.03 . 1 . . . A 104 ILE H . 17578 1 712 . 1 1 69 69 ILE HA H 1 4.927 0.03 . 1 . . . A 104 ILE HA . 17578 1 713 . 1 1 69 69 ILE HB H 1 2.441 0.03 . 1 . . . A 104 ILE HB . 17578 1 714 . 1 1 69 69 ILE HG12 H 1 1.299 0.03 . 2 . . . A 104 ILE HG12 . 17578 1 715 . 1 1 69 69 ILE HG21 H 1 0.828 0.03 . 1 . . . A 104 ILE HG21 . 17578 1 716 . 1 1 69 69 ILE HG22 H 1 0.828 0.03 . 1 . . . A 104 ILE HG22 . 17578 1 717 . 1 1 69 69 ILE HG23 H 1 0.828 0.03 . 1 . . . A 104 ILE HG23 . 17578 1 718 . 1 1 69 69 ILE CA C 13 57.831 0.30 . 1 . . . A 104 ILE CA . 17578 1 719 . 1 1 69 69 ILE CB C 13 38.302 0.30 . 1 . . . A 104 ILE CB . 17578 1 720 . 1 1 69 69 ILE CG2 C 13 18.723 0.30 . 1 . . . A 104 ILE CG2 . 17578 1 721 . 1 1 69 69 ILE N N 15 114.613 0.30 . 1 . . . A 104 ILE N . 17578 1 722 . 1 1 70 70 PRO HA H 1 4.093 0.03 . 1 . . . A 105 PRO HA . 17578 1 723 . 1 1 70 70 PRO HB3 H 1 1.930 0.03 . 2 . . . A 105 PRO HB3 . 17578 1 724 . 1 1 70 70 PRO HG2 H 1 1.388 0.03 . 2 . . . A 105 PRO HG2 . 17578 1 725 . 1 1 70 70 PRO CA C 13 66.439 0.30 . 1 . . . A 105 PRO CA . 17578 1 726 . 1 1 70 70 PRO CB C 13 32.879 0.30 . 1 . . . A 105 PRO CB . 17578 1 727 . 1 1 70 70 PRO CG C 13 25.551 0.30 . 1 . . . A 105 PRO CG . 17578 1 728 . 1 1 71 71 SER H H 1 7.548 0.03 . 1 . . . A 106 SER H . 17578 1 729 . 1 1 71 71 SER HA H 1 5.227 0.03 . 1 . . . A 106 SER HA . 17578 1 730 . 1 1 71 71 SER HB2 H 1 3.796 0.03 . 2 . . . A 106 SER HB2 . 17578 1 731 . 1 1 71 71 SER HB3 H 1 3.656 0.03 . 2 . . . A 106 SER HB3 . 17578 1 732 . 1 1 71 71 SER CA C 13 55.373 0.30 . 1 . . . A 106 SER CA . 17578 1 733 . 1 1 71 71 SER CB C 13 64.696 0.30 . 1 . . . A 106 SER CB . 17578 1 734 . 1 1 71 71 SER N N 15 106.896 0.30 . 1 . . . A 106 SER N . 17578 1 735 . 1 1 72 72 LYS H H 1 8.328 0.03 . 1 . . . A 107 LYS H . 17578 1 736 . 1 1 72 72 LYS HA H 1 4.191 0.03 . 1 . . . A 107 LYS HA . 17578 1 737 . 1 1 72 72 LYS HB2 H 1 1.845 0.03 . 2 . . . A 107 LYS HB2 . 17578 1 738 . 1 1 72 72 LYS HG2 H 1 1.421 0.03 . 2 . . . A 107 LYS HG2 . 17578 1 739 . 1 1 72 72 LYS HE2 H 1 2.961 0.03 . 2 . . . A 107 LYS HE2 . 17578 1 740 . 1 1 72 72 LYS CA C 13 58.623 0.30 . 1 . . . A 107 LYS CA . 17578 1 741 . 1 1 72 72 LYS CB C 13 30.957 0.30 . 1 . . . A 107 LYS CB . 17578 1 742 . 1 1 72 72 LYS CG C 13 24.925 0.30 . 1 . . . A 107 LYS CG . 17578 1 743 . 1 1 72 72 LYS N N 15 119.881 0.30 . 1 . . . A 107 LYS N . 17578 1 744 . 1 1 73 73 GLN H H 1 8.543 0.03 . 1 . . . A 108 GLN H . 17578 1 745 . 1 1 73 73 GLN HA H 1 4.013 0.03 . 1 . . . A 108 GLN HA . 17578 1 746 . 1 1 73 73 GLN HB2 H 1 1.937 0.03 . 2 . . . A 108 GLN HB2 . 17578 1 747 . 1 1 73 73 GLN HG2 H 1 2.382 0.03 . 2 . . . A 108 GLN HG2 . 17578 1 748 . 1 1 73 73 GLN CA C 13 58.621 0.30 . 1 . . . A 108 GLN CA . 17578 1 749 . 1 1 73 73 GLN CB C 13 28.331 0.30 . 1 . . . A 108 GLN CB . 17578 1 750 . 1 1 73 73 GLN CG C 13 33.791 0.30 . 1 . . . A 108 GLN CG . 17578 1 751 . 1 1 73 73 GLN N N 15 123.720 0.30 . 1 . . . A 108 GLN N . 17578 1 752 . 1 1 74 74 ASP H H 1 7.998 0.03 . 1 . . . A 109 ASP H . 17578 1 753 . 1 1 74 74 ASP HA H 1 4.353 0.03 . 1 . . . A 109 ASP HA . 17578 1 754 . 1 1 74 74 ASP HB2 H 1 2.906 0.03 . 2 . . . A 109 ASP HB2 . 17578 1 755 . 1 1 74 74 ASP HB3 H 1 2.693 0.03 . 2 . . . A 109 ASP HB3 . 17578 1 756 . 1 1 74 74 ASP CA C 13 56.941 0.30 . 1 . . . A 109 ASP CA . 17578 1 757 . 1 1 74 74 ASP CB C 13 40.403 0.30 . 1 . . . A 109 ASP CB . 17578 1 758 . 1 1 74 74 ASP N N 15 121.068 0.30 . 1 . . . A 109 ASP N . 17578 1 759 . 1 1 75 75 LEU H H 1 7.999 0.03 . 1 . . . A 110 LEU H . 17578 1 760 . 1 1 75 75 LEU HA H 1 3.967 0.03 . 1 . . . A 110 LEU HA . 17578 1 761 . 1 1 75 75 LEU HB2 H 1 1.995 0.03 . 2 . . . A 110 LEU HB2 . 17578 1 762 . 1 1 75 75 LEU HB3 H 1 1.510 0.03 . 2 . . . A 110 LEU HB3 . 17578 1 763 . 1 1 75 75 LEU HD11 H 1 0.789 0.03 . 4 . . . A 110 LEU HD11 . 17578 1 764 . 1 1 75 75 LEU HD12 H 1 0.789 0.03 . 4 . . . A 110 LEU HD12 . 17578 1 765 . 1 1 75 75 LEU HD13 H 1 0.789 0.03 . 4 . . . A 110 LEU HD13 . 17578 1 766 . 1 1 75 75 LEU HD21 H 1 0.667 0.03 . 4 . . . A 110 LEU HD21 . 17578 1 767 . 1 1 75 75 LEU HD22 H 1 0.667 0.03 . 4 . . . A 110 LEU HD22 . 17578 1 768 . 1 1 75 75 LEU HD23 H 1 0.667 0.03 . 4 . . . A 110 LEU HD23 . 17578 1 769 . 1 1 75 75 LEU C C 13 178.753 0.30 . 1 . . . A 110 LEU C . 17578 1 770 . 1 1 75 75 LEU CA C 13 57.080 0.30 . 1 . . . A 110 LEU CA . 17578 1 771 . 1 1 75 75 LEU CB C 13 41.235 0.30 . 1 . . . A 110 LEU CB . 17578 1 772 . 1 1 75 75 LEU CD1 C 13 26.167 0.30 . 2 . . . A 110 LEU CD1 . 17578 1 773 . 1 1 75 75 LEU N N 15 120.670 0.30 . 1 . . . A 110 LEU N . 17578 1 774 . 1 1 76 76 GLY H H 1 8.012 0.03 . 1 . . . A 111 GLY H . 17578 1 775 . 1 1 76 76 GLY HA2 H 1 3.927 0.03 . 2 . . . A 111 GLY HA2 . 17578 1 776 . 1 1 76 76 GLY HA3 H 1 3.826 0.03 . 2 . . . A 111 GLY HA3 . 17578 1 777 . 1 1 76 76 GLY C C 13 175.517 0.30 . 1 . . . A 111 GLY C . 17578 1 778 . 1 1 76 76 GLY CA C 13 46.745 0.30 . 1 . . . A 111 GLY CA . 17578 1 779 . 1 1 76 76 GLY N N 15 105.512 0.30 . 1 . . . A 111 GLY N . 17578 1 780 . 1 1 77 77 ALA H H 1 7.785 0.03 . 1 . . . A 112 ALA H . 17578 1 781 . 1 1 77 77 ALA HA H 1 4.180 0.03 . 1 . . . A 112 ALA HA . 17578 1 782 . 1 1 77 77 ALA HB1 H 1 1.447 0.03 . 1 . . . A 112 ALA HB1 . 17578 1 783 . 1 1 77 77 ALA HB2 H 1 1.447 0.03 . 1 . . . A 112 ALA HB2 . 17578 1 784 . 1 1 77 77 ALA HB3 H 1 1.447 0.03 . 1 . . . A 112 ALA HB3 . 17578 1 785 . 1 1 77 77 ALA CA C 13 53.652 0.30 . 1 . . . A 112 ALA CA . 17578 1 786 . 1 1 77 77 ALA CB C 13 18.482 0.30 . 1 . . . A 112 ALA CB . 17578 1 787 . 1 1 77 77 ALA N N 15 122.891 0.30 . 1 . . . A 112 ALA N . 17578 1 788 . 1 1 78 78 ALA H H 1 7.787 0.03 . 1 . . . A 113 ALA H . 17578 1 789 . 1 1 78 78 ALA HA H 1 4.213 0.03 . 1 . . . A 113 ALA HA . 17578 1 790 . 1 1 78 78 ALA HB1 H 1 1.429 0.03 . 1 . . . A 113 ALA HB1 . 17578 1 791 . 1 1 78 78 ALA HB2 H 1 1.429 0.03 . 1 . . . A 113 ALA HB2 . 17578 1 792 . 1 1 78 78 ALA HB3 H 1 1.429 0.03 . 1 . . . A 113 ALA HB3 . 17578 1 793 . 1 1 78 78 ALA CA C 13 53.503 0.30 . 1 . . . A 113 ALA CA . 17578 1 794 . 1 1 78 78 ALA CB C 13 18.897 0.30 . 1 . . . A 113 ALA CB . 17578 1 795 . 1 1 78 78 ALA N N 15 121.205 0.30 . 1 . . . A 113 ALA N . 17578 1 796 . 1 1 79 79 GLY H H 1 7.756 0.03 . 1 . . . A 114 GLY H . 17578 1 797 . 1 1 79 79 GLY HA2 H 1 3.646 0.03 . 2 . . . A 114 GLY HA2 . 17578 1 798 . 1 1 79 79 GLY HA3 H 1 4.155 0.03 . 2 . . . A 114 GLY HA3 . 17578 1 799 . 1 1 79 79 GLY CA C 13 44.764 0.30 . 1 . . . A 114 GLY CA . 17578 1 800 . 1 1 79 79 GLY N N 15 104.082 0.30 . 1 . . . A 114 GLY N . 17578 1 801 . 1 1 80 80 ALA HA H 1 4.061 0.03 . 1 . . . A 115 ALA HA . 17578 1 802 . 1 1 80 80 ALA HB1 H 1 1.323 0.03 . 1 . . . A 115 ALA HB1 . 17578 1 803 . 1 1 80 80 ALA HB2 H 1 1.323 0.03 . 1 . . . A 115 ALA HB2 . 17578 1 804 . 1 1 80 80 ALA HB3 H 1 1.323 0.03 . 1 . . . A 115 ALA HB3 . 17578 1 805 . 1 1 80 80 ALA CA C 13 53.192 0.30 . 1 . . . A 115 ALA CA . 17578 1 806 . 1 1 80 80 ALA CB C 13 19.493 0.30 . 1 . . . A 115 ALA CB . 17578 1 807 . 1 1 81 81 THR H H 1 8.121 0.03 . 1 . . . A 116 THR H . 17578 1 808 . 1 1 81 81 THR HB H 1 3.907 0.03 . 1 . . . A 116 THR HB . 17578 1 809 . 1 1 81 81 THR HG21 H 1 0.881 0.03 . 1 . . . A 116 THR HG21 . 17578 1 810 . 1 1 81 81 THR HG22 H 1 0.881 0.03 . 1 . . . A 116 THR HG22 . 17578 1 811 . 1 1 81 81 THR HG23 H 1 0.881 0.03 . 1 . . . A 116 THR HG23 . 17578 1 812 . 1 1 81 81 THR CA C 13 57.223 0.30 . 1 . . . A 116 THR CA . 17578 1 813 . 1 1 81 81 THR CB C 13 64.784 0.30 . 1 . . . A 116 THR CB . 17578 1 814 . 1 1 81 81 THR N N 15 116.258 0.30 . 1 . . . A 116 THR N . 17578 1 815 . 1 1 83 83 ARG H H 1 8.128 0.03 . 1 . . . A 118 ARG H . 17578 1 816 . 1 1 83 83 ARG N N 15 122.269 0.30 . 1 . . . A 118 ARG N . 17578 1 817 . 1 1 85 85 THR H H 1 8.127 0.03 . 1 . . . A 120 THR H . 17578 1 818 . 1 1 85 85 THR C C 13 172.729 0.30 . 1 . . . A 120 THR C . 17578 1 819 . 1 1 85 85 THR N N 15 120.171 0.30 . 1 . . . A 120 THR N . 17578 1 820 . 1 1 86 86 SER H H 1 7.045 0.03 . 1 . . . A 121 SER H . 17578 1 821 . 1 1 86 86 SER HA H 1 4.280 0.03 . 1 . . . A 121 SER HA . 17578 1 822 . 1 1 86 86 SER HB2 H 1 3.831 0.03 . 2 . . . A 121 SER HB2 . 17578 1 823 . 1 1 86 86 SER CA C 13 59.573 0.30 . 1 . . . A 121 SER CA . 17578 1 824 . 1 1 86 86 SER CB C 13 64.384 0.30 . 1 . . . A 121 SER CB . 17578 1 825 . 1 1 86 86 SER N N 15 115.808 0.30 . 1 . . . A 121 SER N . 17578 1 826 . 1 1 87 87 VAL H H 1 7.082 0.03 . 1 . . . A 122 VAL H . 17578 1 827 . 1 1 87 87 VAL HA H 1 5.203 0.03 . 1 . . . A 122 VAL HA . 17578 1 828 . 1 1 87 87 VAL HB H 1 2.114 0.03 . 1 . . . A 122 VAL HB . 17578 1 829 . 1 1 87 87 VAL HG11 H 1 0.800 0.03 . 4 . . . A 122 VAL HG11 . 17578 1 830 . 1 1 87 87 VAL HG12 H 1 0.800 0.03 . 4 . . . A 122 VAL HG12 . 17578 1 831 . 1 1 87 87 VAL HG13 H 1 0.800 0.03 . 4 . . . A 122 VAL HG13 . 17578 1 832 . 1 1 87 87 VAL HG21 H 1 0.684 0.03 . 4 . . . A 122 VAL HG21 . 17578 1 833 . 1 1 87 87 VAL HG22 H 1 0.684 0.03 . 4 . . . A 122 VAL HG22 . 17578 1 834 . 1 1 87 87 VAL HG23 H 1 0.684 0.03 . 4 . . . A 122 VAL HG23 . 17578 1 835 . 1 1 87 87 VAL CA C 13 59.412 0.30 . 1 . . . A 122 VAL CA . 17578 1 836 . 1 1 87 87 VAL CB C 13 32.729 0.30 . 1 . . . A 122 VAL CB . 17578 1 837 . 1 1 87 87 VAL CG1 C 13 23.378 0.30 . 2 . . . A 122 VAL CG1 . 17578 1 838 . 1 1 87 87 VAL CG2 C 13 18.852 0.30 . 2 . . . A 122 VAL CG2 . 17578 1 839 . 1 1 87 87 VAL N N 15 115.790 0.30 . 1 . . . A 122 VAL N . 17578 1 840 . 1 1 88 88 VAL H H 1 8.948 0.03 . 1 . . . A 123 VAL H . 17578 1 841 . 1 1 88 88 VAL HA H 1 5.097 0.03 . 1 . . . A 123 VAL HA . 17578 1 842 . 1 1 88 88 VAL HB H 1 2.041 0.03 . 1 . . . A 123 VAL HB . 17578 1 843 . 1 1 88 88 VAL HG11 H 1 0.806 0.03 . 4 . . . A 123 VAL HG11 . 17578 1 844 . 1 1 88 88 VAL HG12 H 1 0.806 0.03 . 4 . . . A 123 VAL HG12 . 17578 1 845 . 1 1 88 88 VAL HG13 H 1 0.806 0.03 . 4 . . . A 123 VAL HG13 . 17578 1 846 . 1 1 88 88 VAL HG21 H 1 0.777 0.03 . 4 . . . A 123 VAL HG21 . 17578 1 847 . 1 1 88 88 VAL HG22 H 1 0.777 0.03 . 4 . . . A 123 VAL HG22 . 17578 1 848 . 1 1 88 88 VAL HG23 H 1 0.777 0.03 . 4 . . . A 123 VAL HG23 . 17578 1 849 . 1 1 88 88 VAL C C 13 172.990 0.30 . 1 . . . A 123 VAL C . 17578 1 850 . 1 1 88 88 VAL CA C 13 58.925 0.30 . 1 . . . A 123 VAL CA . 17578 1 851 . 1 1 88 88 VAL CB C 13 35.929 0.30 . 1 . . . A 123 VAL CB . 17578 1 852 . 1 1 88 88 VAL CG1 C 13 22.241 0.30 . 2 . . . A 123 VAL CG1 . 17578 1 853 . 1 1 88 88 VAL CG2 C 13 20.882 0.30 . 2 . . . A 123 VAL CG2 . 17578 1 854 . 1 1 88 88 VAL N N 15 119.313 0.30 . 1 . . . A 123 VAL N . 17578 1 855 . 1 1 89 89 PHE H H 1 9.065 0.03 . 1 . . . A 124 PHE H . 17578 1 856 . 1 1 89 89 PHE HA H 1 5.641 0.03 . 1 . . . A 124 PHE HA . 17578 1 857 . 1 1 89 89 PHE HB2 H 1 3.124 0.03 . 2 . . . A 124 PHE HB2 . 17578 1 858 . 1 1 89 89 PHE HB3 H 1 2.960 0.03 . 2 . . . A 124 PHE HB3 . 17578 1 859 . 1 1 89 89 PHE HD1 H 1 6.908 0.03 . 3 . . . A 124 PHE HD1 . 17578 1 860 . 1 1 89 89 PHE C C 13 174.686 0.30 . 1 . . . A 124 PHE C . 17578 1 861 . 1 1 89 89 PHE CA C 13 52.579 0.30 . 1 . . . A 124 PHE CA . 17578 1 862 . 1 1 89 89 PHE CB C 13 42.392 0.30 . 1 . . . A 124 PHE CB . 17578 1 863 . 1 1 89 89 PHE N N 15 122.616 0.30 . 1 . . . A 124 PHE N . 17578 1 864 . 1 1 90 90 ILE H H 1 9.498 0.03 . 1 . . . A 125 ILE H . 17578 1 865 . 1 1 90 90 ILE HA H 1 4.268 0.03 . 1 . . . A 125 ILE HA . 17578 1 866 . 1 1 90 90 ILE HB H 1 2.078 0.03 . 1 . . . A 125 ILE HB . 17578 1 867 . 1 1 90 90 ILE HG12 H 1 1.707 0.03 . 2 . . . A 125 ILE HG12 . 17578 1 868 . 1 1 90 90 ILE HG13 H 1 1.343 0.03 . 2 . . . A 125 ILE HG13 . 17578 1 869 . 1 1 90 90 ILE HG21 H 1 0.873 0.03 . 1 . . . A 125 ILE HG21 . 17578 1 870 . 1 1 90 90 ILE HG22 H 1 0.873 0.03 . 1 . . . A 125 ILE HG22 . 17578 1 871 . 1 1 90 90 ILE HG23 H 1 0.873 0.03 . 1 . . . A 125 ILE HG23 . 17578 1 872 . 1 1 90 90 ILE HD11 H 1 0.661 0.03 . 4 . . . A 125 ILE HD11 . 17578 1 873 . 1 1 90 90 ILE HD12 H 1 0.661 0.03 . 4 . . . A 125 ILE HD12 . 17578 1 874 . 1 1 90 90 ILE HD13 H 1 0.661 0.03 . 4 . . . A 125 ILE HD13 . 17578 1 875 . 1 1 90 90 ILE C C 13 173.652 0.30 . 1 . . . A 125 ILE C . 17578 1 876 . 1 1 90 90 ILE CA C 13 61.605 0.30 . 1 . . . A 125 ILE CA . 17578 1 877 . 1 1 90 90 ILE CB C 13 39.533 0.30 . 1 . . . A 125 ILE CB . 17578 1 878 . 1 1 90 90 ILE CD1 C 13 18.766 0.30 . 1 . . . A 125 ILE CD1 . 17578 1 879 . 1 1 90 90 ILE N N 15 127.599 0.30 . 1 . . . A 125 ILE N . 17578 1 880 . 1 1 91 91 VAL H H 1 8.169 0.03 . 1 . . . A 126 VAL H . 17578 1 881 . 1 1 91 91 VAL HA H 1 4.595 0.03 . 1 . . . A 126 VAL HA . 17578 1 882 . 1 1 91 91 VAL HB H 1 1.523 0.03 . 1 . . . A 126 VAL HB . 17578 1 883 . 1 1 91 91 VAL HG11 H 1 0.607 0.03 . 4 . . . A 126 VAL HG11 . 17578 1 884 . 1 1 91 91 VAL HG12 H 1 0.607 0.03 . 4 . . . A 126 VAL HG12 . 17578 1 885 . 1 1 91 91 VAL HG13 H 1 0.607 0.03 . 4 . . . A 126 VAL HG13 . 17578 1 886 . 1 1 91 91 VAL HG21 H 1 -0.298 0.03 . 4 . . . A 126 VAL HG21 . 17578 1 887 . 1 1 91 91 VAL HG22 H 1 -0.298 0.03 . 4 . . . A 126 VAL HG22 . 17578 1 888 . 1 1 91 91 VAL HG23 H 1 -0.298 0.03 . 4 . . . A 126 VAL HG23 . 17578 1 889 . 1 1 91 91 VAL CA C 13 58.380 0.30 . 1 . . . A 126 VAL CA . 17578 1 890 . 1 1 91 91 VAL CB C 13 32.597 0.30 . 1 . . . A 126 VAL CB . 17578 1 891 . 1 1 91 91 VAL CG1 C 13 21.090 0.30 . 2 . . . A 126 VAL CG1 . 17578 1 892 . 1 1 91 91 VAL CG2 C 13 18.077 0.30 . 2 . . . A 126 VAL CG2 . 17578 1 893 . 1 1 91 91 VAL N N 15 126.693 0.30 . 1 . . . A 126 VAL N . 17578 1 894 . 1 1 92 92 PRO HA H 1 4.044 0.03 . 1 . . . A 127 PRO HA . 17578 1 895 . 1 1 92 92 PRO HB3 H 1 1.802 0.03 . 2 . . . A 127 PRO HB3 . 17578 1 896 . 1 1 92 92 PRO HG2 H 1 1.581 0.03 . 2 . . . A 127 PRO HG2 . 17578 1 897 . 1 1 92 92 PRO CA C 13 63.380 0.30 . 1 . . . A 127 PRO CA . 17578 1 898 . 1 1 92 92 PRO CB C 13 31.735 0.30 . 1 . . . A 127 PRO CB . 17578 1 899 . 1 1 92 92 PRO CG C 13 25.421 0.30 . 1 . . . A 127 PRO CG . 17578 1 900 . 1 1 93 93 GLY H H 1 8.022 0.03 . 1 . . . A 128 GLY H . 17578 1 901 . 1 1 93 93 GLY HA2 H 1 4.708 0.03 . 2 . . . A 128 GLY HA2 . 17578 1 902 . 1 1 93 93 GLY HA3 H 1 3.920 0.03 . 2 . . . A 128 GLY HA3 . 17578 1 903 . 1 1 93 93 GLY CA C 13 45.443 0.30 . 1 . . . A 128 GLY CA . 17578 1 904 . 1 1 93 93 GLY N N 15 108.589 0.30 . 1 . . . A 128 GLY N . 17578 1 905 . 1 1 94 94 SER H H 1 7.992 0.03 . 1 . . . A 129 SER H . 17578 1 906 . 1 1 94 94 SER N N 15 113.115 0.30 . 1 . . . A 129 SER N . 17578 1 907 . 1 1 95 95 ASN H H 1 8.313 0.03 . 1 . . . A 130 ASN H . 17578 1 908 . 1 1 95 95 ASN C C 13 178.419 0.30 . 1 . . . A 130 ASN C . 17578 1 909 . 1 1 95 95 ASN CA C 13 57.337 0.30 . 1 . . . A 130 ASN CA . 17578 1 910 . 1 1 95 95 ASN CB C 13 41.958 0.30 . 1 . . . A 130 ASN CB . 17578 1 911 . 1 1 95 95 ASN N N 15 120.738 0.30 . 1 . . . A 130 ASN N . 17578 1 912 . 1 1 96 96 LYS H H 1 7.881 0.03 . 1 . . . A 131 LYS H . 17578 1 913 . 1 1 96 96 LYS HA H 1 4.021 0.03 . 1 . . . A 131 LYS HA . 17578 1 914 . 1 1 96 96 LYS HB2 H 1 2.000 0.03 . 2 . . . A 131 LYS HB2 . 17578 1 915 . 1 1 96 96 LYS CA C 13 58.749 0.30 . 1 . . . A 131 LYS CA . 17578 1 916 . 1 1 96 96 LYS CB C 13 29.565 0.30 . 1 . . . A 131 LYS CB . 17578 1 917 . 1 1 96 96 LYS N N 15 119.159 0.30 . 1 . . . A 131 LYS N . 17578 1 918 . 1 1 97 97 LYS H H 1 7.765 0.03 . 1 . . . A 132 LYS H . 17578 1 919 . 1 1 97 97 LYS CA C 13 58.413 0.30 . 1 . . . A 132 LYS CA . 17578 1 920 . 1 1 97 97 LYS CB C 13 30.694 0.30 . 1 . . . A 132 LYS CB . 17578 1 921 . 1 1 97 97 LYS N N 15 117.399 0.30 . 1 . . . A 132 LYS N . 17578 1 922 . 1 1 98 98 LYS H H 1 8.070 0.03 . 1 . . . A 133 LYS H . 17578 1 923 . 1 1 98 98 LYS CA C 13 58.266 0.30 . 1 . . . A 133 LYS CA . 17578 1 924 . 1 1 98 98 LYS CB C 13 30.981 0.30 . 1 . . . A 133 LYS CB . 17578 1 925 . 1 1 98 98 LYS N N 15 119.160 0.30 . 1 . . . A 133 LYS N . 17578 1 926 . 1 1 99 99 ASP H H 1 8.255 0.03 . 1 . . . A 134 ASP H . 17578 1 927 . 1 1 99 99 ASP CA C 13 55.586 0.30 . 1 . . . A 134 ASP CA . 17578 1 928 . 1 1 99 99 ASP CB C 13 41.898 0.30 . 1 . . . A 134 ASP CB . 17578 1 929 . 1 1 99 99 ASP N N 15 120.602 0.30 . 1 . . . A 134 ASP N . 17578 1 930 . 1 1 100 100 GLY H H 1 8.451 0.03 . 1 . . . A 135 GLY H . 17578 1 931 . 1 1 100 100 GLY HA2 H 1 4.717 0.03 . 2 . . . A 135 GLY HA2 . 17578 1 932 . 1 1 100 100 GLY HA3 H 1 3.918 0.03 . 2 . . . A 135 GLY HA3 . 17578 1 933 . 1 1 100 100 GLY CA C 13 45.536 0.30 . 1 . . . A 135 GLY CA . 17578 1 934 . 1 1 100 100 GLY N N 15 108.785 0.30 . 1 . . . A 135 GLY N . 17578 1 935 . 1 1 101 101 LYS H H 1 8.127 0.03 . 1 . . . A 136 LYS H . 17578 1 936 . 1 1 101 101 LYS N N 15 120.171 0.30 . 1 . . . A 136 LYS N . 17578 1 937 . 1 1 102 102 ASN H H 1 8.481 0.03 . 1 . . . A 137 ASN H . 17578 1 938 . 1 1 102 102 ASN HD21 H 1 6.950 0.03 . 2 . . . A 137 ASN HD21 . 17578 1 939 . 1 1 102 102 ASN HD22 H 1 7.654 0.03 . 2 . . . A 137 ASN HD22 . 17578 1 940 . 1 1 102 102 ASN N N 15 118.588 0.30 . 1 . . . A 137 ASN N . 17578 1 941 . 1 1 102 102 ASN ND2 N 15 113.242 0.30 . 1 . . . A 137 ASN ND2 . 17578 1 942 . 1 1 103 103 LYS H H 1 8.318 0.03 . 1 . . . A 138 LYS H . 17578 1 943 . 1 1 103 103 LYS HA H 1 4.241 0.03 . 1 . . . A 138 LYS HA . 17578 1 944 . 1 1 103 103 LYS HB2 H 1 1.809 0.03 . 2 . . . A 138 LYS HB2 . 17578 1 945 . 1 1 103 103 LYS HG2 H 1 1.588 0.03 . 2 . . . A 138 LYS HG2 . 17578 1 946 . 1 1 103 103 LYS HE2 H 1 2.805 0.03 . 2 . . . A 138 LYS HE2 . 17578 1 947 . 1 1 103 103 LYS CA C 13 56.760 0.30 . 1 . . . A 138 LYS CA . 17578 1 948 . 1 1 103 103 LYS CB C 13 32.691 0.30 . 1 . . . A 138 LYS CB . 17578 1 949 . 1 1 103 103 LYS CG C 13 24.830 0.30 . 1 . . . A 138 LYS CG . 17578 1 950 . 1 1 103 103 LYS CD C 13 29.106 0.30 . 1 . . . A 138 LYS CD . 17578 1 951 . 1 1 103 103 LYS N N 15 121.739 0.30 . 1 . . . A 138 LYS N . 17578 1 952 . 1 1 104 104 GLU H H 1 8.478 0.03 . 1 . . . A 139 GLU H . 17578 1 953 . 1 1 104 104 GLU CA C 13 57.235 0.30 . 1 . . . A 139 GLU CA . 17578 1 954 . 1 1 104 104 GLU CB C 13 29.893 0.30 . 1 . . . A 139 GLU CB . 17578 1 955 . 1 1 104 104 GLU N N 15 120.980 0.30 . 1 . . . A 139 GLU N . 17578 1 956 . 1 1 107 107 TYR H H 1 7.992 0.03 . 1 . . . A 142 TYR H . 17578 1 957 . 1 1 107 107 TYR HA H 1 5.023 0.03 . 1 . . . A 142 TYR HA . 17578 1 958 . 1 1 107 107 TYR HB2 H 1 3.329 0.03 . 2 . . . A 142 TYR HB2 . 17578 1 959 . 1 1 107 107 TYR HB3 H 1 2.760 0.03 . 2 . . . A 142 TYR HB3 . 17578 1 960 . 1 1 107 107 TYR HD2 H 1 7.079 0.03 . 3 . . . A 142 TYR HD2 . 17578 1 961 . 1 1 107 107 TYR C C 13 175.419 0.30 . 1 . . . A 142 TYR C . 17578 1 962 . 1 1 107 107 TYR CA C 13 57.200 0.30 . 1 . . . A 142 TYR CA . 17578 1 963 . 1 1 107 107 TYR CB C 13 39.165 0.30 . 1 . . . A 142 TYR CB . 17578 1 964 . 1 1 107 107 TYR N N 15 119.214 0.30 . 1 . . . A 142 TYR N . 17578 1 965 . 1 1 108 108 LYS H H 1 7.377 0.03 . 1 . . . A 143 LYS H . 17578 1 966 . 1 1 108 108 LYS HA H 1 3.628 0.03 . 1 . . . A 143 LYS HA . 17578 1 967 . 1 1 108 108 LYS HB2 H 1 1.686 0.03 . 2 . . . A 143 LYS HB2 . 17578 1 968 . 1 1 108 108 LYS HG2 H 1 1.271 0.03 . 2 . . . A 143 LYS HG2 . 17578 1 969 . 1 1 108 108 LYS CA C 13 59.619 0.30 . 1 . . . A 143 LYS CA . 17578 1 970 . 1 1 108 108 LYS CB C 13 31.869 0.30 . 1 . . . A 143 LYS CB . 17578 1 971 . 1 1 108 108 LYS CG C 13 24.398 0.30 . 1 . . . A 143 LYS CG . 17578 1 972 . 1 1 108 108 LYS N N 15 123.500 0.30 . 1 . . . A 143 LYS N . 17578 1 973 . 1 1 109 109 GLU H H 1 8.583 0.03 . 1 . . . A 144 GLU H . 17578 1 974 . 1 1 109 109 GLU HA H 1 4.735 0.03 . 1 . . . A 144 GLU HA . 17578 1 975 . 1 1 109 109 GLU HB2 H 1 2.069 0.03 . 2 . . . A 144 GLU HB2 . 17578 1 976 . 1 1 109 109 GLU HG2 H 1 2.322 0.03 . 2 . . . A 144 GLU HG2 . 17578 1 977 . 1 1 109 109 GLU CA C 13 59.865 0.30 . 1 . . . A 144 GLU CA . 17578 1 978 . 1 1 109 109 GLU CB C 13 29.004 0.30 . 1 . . . A 144 GLU CB . 17578 1 979 . 1 1 109 109 GLU N N 15 118.669 0.30 . 1 . . . A 144 GLU N . 17578 1 980 . 1 1 110 110 SER H H 1 8.117 0.03 . 1 . . . A 145 SER H . 17578 1 981 . 1 1 110 110 SER HA H 1 4.448 0.03 . 1 . . . A 145 SER HA . 17578 1 982 . 1 1 110 110 SER HB2 H 1 4.382 0.03 . 2 . . . A 145 SER HB2 . 17578 1 983 . 1 1 110 110 SER HB3 H 1 4.195 0.03 . 2 . . . A 145 SER HB3 . 17578 1 984 . 1 1 110 110 SER CB C 13 64.178 0.30 . 1 . . . A 145 SER CB . 17578 1 985 . 1 1 110 110 SER N N 15 116.081 0.30 . 1 . . . A 145 SER N . 17578 1 986 . 1 1 111 111 PHE H H 1 8.553 0.03 . 1 . . . A 146 PHE H . 17578 1 987 . 1 1 111 111 PHE HA H 1 4.022 0.03 . 1 . . . A 146 PHE HA . 17578 1 988 . 1 1 111 111 PHE HB2 H 1 3.359 0.03 . 2 . . . A 146 PHE HB2 . 17578 1 989 . 1 1 111 111 PHE HB3 H 1 3.123 0.03 . 2 . . . A 146 PHE HB3 . 17578 1 990 . 1 1 111 111 PHE HD1 H 1 7.108 0.03 . 3 . . . A 146 PHE HD1 . 17578 1 991 . 1 1 111 111 PHE HD2 H 1 7.227 0.03 . 3 . . . A 146 PHE HD2 . 17578 1 992 . 1 1 111 111 PHE C C 13 175.751 0.30 . 1 . . . A 146 PHE C . 17578 1 993 . 1 1 111 111 PHE CA C 13 62.159 0.30 . 1 . . . A 146 PHE CA . 17578 1 994 . 1 1 111 111 PHE CB C 13 39.533 0.30 . 1 . . . A 146 PHE CB . 17578 1 995 . 1 1 111 111 PHE N N 15 122.134 0.30 . 1 . . . A 146 PHE N . 17578 1 996 . 1 1 112 112 ASN H H 1 8.809 0.03 . 1 . . . A 147 ASN H . 17578 1 997 . 1 1 112 112 ASN HA H 1 4.269 0.03 . 1 . . . A 147 ASN HA . 17578 1 998 . 1 1 112 112 ASN HB2 H 1 2.994 0.03 . 2 . . . A 147 ASN HB2 . 17578 1 999 . 1 1 112 112 ASN HB3 H 1 2.771 0.03 . 2 . . . A 147 ASN HB3 . 17578 1 1000 . 1 1 112 112 ASN HD21 H 1 6.828 0.03 . 2 . . . A 147 ASN HD21 . 17578 1 1001 . 1 1 112 112 ASN HD22 H 1 7.649 0.03 . 2 . . . A 147 ASN HD22 . 17578 1 1002 . 1 1 112 112 ASN CA C 13 55.881 0.30 . 1 . . . A 147 ASN CA . 17578 1 1003 . 1 1 112 112 ASN CB C 13 37.663 0.30 . 1 . . . A 147 ASN CB . 17578 1 1004 . 1 1 112 112 ASN N N 15 117.856 0.30 . 1 . . . A 147 ASN N . 17578 1 1005 . 1 1 112 112 ASN ND2 N 15 110.972 0.30 . 1 . . . A 147 ASN ND2 . 17578 1 1006 . 1 1 113 113 GLU H H 1 7.778 0.03 . 1 . . . A 148 GLU H . 17578 1 1007 . 1 1 113 113 GLU HA H 1 4.021 0.03 . 1 . . . A 148 GLU HA . 17578 1 1008 . 1 1 113 113 GLU HB2 H 1 2.137 0.03 . 2 . . . A 148 GLU HB2 . 17578 1 1009 . 1 1 113 113 GLU HG2 H 1 2.454 0.03 . 2 . . . A 148 GLU HG2 . 17578 1 1010 . 1 1 113 113 GLU CA C 13 59.385 0.30 . 1 . . . A 148 GLU CA . 17578 1 1011 . 1 1 113 113 GLU CB C 13 29.784 0.30 . 1 . . . A 148 GLU CB . 17578 1 1012 . 1 1 113 113 GLU CG C 13 36.453 0.30 . 1 . . . A 148 GLU CG . 17578 1 1013 . 1 1 113 113 GLU N N 15 119.708 0.30 . 1 . . . A 148 GLU N . 17578 1 1014 . 1 1 114 114 VAL H H 1 8.023 0.03 . 1 . . . A 149 VAL H . 17578 1 1015 . 1 1 114 114 VAL HA H 1 3.556 0.03 . 1 . . . A 149 VAL HA . 17578 1 1016 . 1 1 114 114 VAL HB H 1 2.103 0.03 . 1 . . . A 149 VAL HB . 17578 1 1017 . 1 1 114 114 VAL HG11 H 1 0.924 0.03 . 4 . . . A 149 VAL HG11 . 17578 1 1018 . 1 1 114 114 VAL HG12 H 1 0.924 0.03 . 4 . . . A 149 VAL HG12 . 17578 1 1019 . 1 1 114 114 VAL HG13 H 1 0.924 0.03 . 4 . . . A 149 VAL HG13 . 17578 1 1020 . 1 1 114 114 VAL HG21 H 1 0.723 0.03 . 4 . . . A 149 VAL HG21 . 17578 1 1021 . 1 1 114 114 VAL HG22 H 1 0.723 0.03 . 4 . . . A 149 VAL HG22 . 17578 1 1022 . 1 1 114 114 VAL HG23 H 1 0.723 0.03 . 4 . . . A 149 VAL HG23 . 17578 1 1023 . 1 1 114 114 VAL CA C 13 66.625 0.30 . 1 . . . A 149 VAL CA . 17578 1 1024 . 1 1 114 114 VAL CB C 13 31.368 0.30 . 1 . . . A 149 VAL CB . 17578 1 1025 . 1 1 114 114 VAL CG1 C 13 23.918 0.30 . 2 . . . A 149 VAL CG1 . 17578 1 1026 . 1 1 114 114 VAL CG2 C 13 23.146 0.30 . 2 . . . A 149 VAL CG2 . 17578 1 1027 . 1 1 114 114 VAL N N 15 119.680 0.30 . 1 . . . A 149 VAL N . 17578 1 1028 . 1 1 115 115 VAL H H 1 8.480 0.03 . 1 . . . A 150 VAL H . 17578 1 1029 . 1 1 115 115 VAL HA H 1 3.163 0.03 . 1 . . . A 150 VAL HA . 17578 1 1030 . 1 1 115 115 VAL HB H 1 1.713 0.03 . 1 . . . A 150 VAL HB . 17578 1 1031 . 1 1 115 115 VAL HG11 H 1 0.365 0.03 . 4 . . . A 150 VAL HG11 . 17578 1 1032 . 1 1 115 115 VAL HG12 H 1 0.365 0.03 . 4 . . . A 150 VAL HG12 . 17578 1 1033 . 1 1 115 115 VAL HG13 H 1 0.365 0.03 . 4 . . . A 150 VAL HG13 . 17578 1 1034 . 1 1 115 115 VAL HG21 H 1 0.759 0.03 . 4 . . . A 150 VAL HG21 . 17578 1 1035 . 1 1 115 115 VAL HG22 H 1 0.759 0.03 . 4 . . . A 150 VAL HG22 . 17578 1 1036 . 1 1 115 115 VAL HG23 H 1 0.759 0.03 . 4 . . . A 150 VAL HG23 . 17578 1 1037 . 1 1 115 115 VAL C C 13 177.270 0.30 . 1 . . . A 150 VAL C . 17578 1 1038 . 1 1 115 115 VAL CA C 13 67.984 0.30 . 1 . . . A 150 VAL CA . 17578 1 1039 . 1 1 115 115 VAL CB C 13 30.848 0.30 . 1 . . . A 150 VAL CB . 17578 1 1040 . 1 1 115 115 VAL CG1 C 13 24.191 0.30 . 2 . . . A 150 VAL CG1 . 17578 1 1041 . 1 1 115 115 VAL CG2 C 13 21.734 0.30 . 2 . . . A 150 VAL CG2 . 17578 1 1042 . 1 1 115 115 VAL N N 15 119.684 0.30 . 1 . . . A 150 VAL N . 17578 1 1043 . 1 1 116 116 LYS H H 1 7.584 0.03 . 1 . . . A 151 LYS H . 17578 1 1044 . 1 1 116 116 LYS HA H 1 4.027 0.03 . 1 . . . A 151 LYS HA . 17578 1 1045 . 1 1 116 116 LYS HB2 H 1 1.862 0.03 . 2 . . . A 151 LYS HB2 . 17578 1 1046 . 1 1 116 116 LYS HG2 H 1 1.601 0.03 . 2 . . . A 151 LYS HG2 . 17578 1 1047 . 1 1 116 116 LYS HD2 H 1 1.739 0.03 . 2 . . . A 151 LYS HD2 . 17578 1 1048 . 1 1 116 116 LYS CA C 13 59.691 0.30 . 1 . . . A 151 LYS CA . 17578 1 1049 . 1 1 116 116 LYS CB C 13 32.346 0.30 . 1 . . . A 151 LYS CB . 17578 1 1050 . 1 1 116 116 LYS CG C 13 25.312 0.30 . 1 . . . A 151 LYS CG . 17578 1 1051 . 1 1 116 116 LYS CD C 13 29.523 0.30 . 1 . . . A 151 LYS CD . 17578 1 1052 . 1 1 116 116 LYS N N 15 118.648 0.30 . 1 . . . A 151 LYS N . 17578 1 1053 . 1 1 117 117 GLU H H 1 7.528 0.03 . 1 . . . A 152 GLU H . 17578 1 1054 . 1 1 117 117 GLU HA H 1 4.046 0.03 . 1 . . . A 152 GLU HA . 17578 1 1055 . 1 1 117 117 GLU HB2 H 1 2.074 0.03 . 2 . . . A 152 GLU HB2 . 17578 1 1056 . 1 1 117 117 GLU HG2 H 1 2.426 0.03 . 2 . . . A 152 GLU HG2 . 17578 1 1057 . 1 1 117 117 GLU CA C 13 59.932 0.30 . 1 . . . A 152 GLU CA . 17578 1 1058 . 1 1 117 117 GLU CB C 13 29.663 0.30 . 1 . . . A 152 GLU CB . 17578 1 1059 . 1 1 117 117 GLU CG C 13 36.709 0.30 . 1 . . . A 152 GLU CG . 17578 1 1060 . 1 1 117 117 GLU N N 15 120.177 0.30 . 1 . . . A 152 GLU N . 17578 1 1061 . 1 1 118 118 VAL H H 1 8.665 0.03 . 1 . . . A 153 VAL H . 17578 1 1062 . 1 1 118 118 VAL HA H 1 3.421 0.03 . 1 . . . A 153 VAL HA . 17578 1 1063 . 1 1 118 118 VAL HB H 1 2.027 0.03 . 1 . . . A 153 VAL HB . 17578 1 1064 . 1 1 118 118 VAL HG11 H 1 0.873 0.03 . 4 . . . A 153 VAL HG11 . 17578 1 1065 . 1 1 118 118 VAL HG12 H 1 0.873 0.03 . 4 . . . A 153 VAL HG12 . 17578 1 1066 . 1 1 118 118 VAL HG13 H 1 0.873 0.03 . 4 . . . A 153 VAL HG13 . 17578 1 1067 . 1 1 118 118 VAL HG21 H 1 0.711 0.03 . 4 . . . A 153 VAL HG21 . 17578 1 1068 . 1 1 118 118 VAL HG22 H 1 0.711 0.03 . 4 . . . A 153 VAL HG22 . 17578 1 1069 . 1 1 118 118 VAL HG23 H 1 0.711 0.03 . 4 . . . A 153 VAL HG23 . 17578 1 1070 . 1 1 118 118 VAL CA C 13 67.196 0.30 . 1 . . . A 153 VAL CA . 17578 1 1071 . 1 1 118 118 VAL CB C 13 31.600 0.30 . 1 . . . A 153 VAL CB . 17578 1 1072 . 1 1 118 118 VAL CG2 C 13 23.455 0.30 . 2 . . . A 153 VAL CG2 . 17578 1 1073 . 1 1 118 118 VAL N N 15 120.413 0.30 . 1 . . . A 153 VAL N . 17578 1 1074 . 1 1 119 119 GLN H H 1 8.950 0.03 . 1 . . . A 154 GLN H . 17578 1 1075 . 1 1 119 119 GLN HA H 1 3.982 0.03 . 1 . . . A 154 GLN HA . 17578 1 1076 . 1 1 119 119 GLN HB2 H 1 2.227 0.03 . 2 . . . A 154 GLN HB2 . 17578 1 1077 . 1 1 119 119 GLN HB3 H 1 3.369 0.03 . 2 . . . A 154 GLN HB3 . 17578 1 1078 . 1 1 119 119 GLN HG2 H 1 2.493 0.03 . 2 . . . A 154 GLN HG2 . 17578 1 1079 . 1 1 119 119 GLN HG3 H 1 2.290 0.03 . 2 . . . A 154 GLN HG3 . 17578 1 1080 . 1 1 119 119 GLN HE21 H 1 6.826 0.03 . 2 . . . A 154 GLN HE21 . 17578 1 1081 . 1 1 119 119 GLN HE22 H 1 7.508 0.03 . 2 . . . A 154 GLN HE22 . 17578 1 1082 . 1 1 119 119 GLN CA C 13 59.651 0.30 . 1 . . . A 154 GLN CA . 17578 1 1083 . 1 1 119 119 GLN CB C 13 28.478 0.30 . 1 . . . A 154 GLN CB . 17578 1 1084 . 1 1 119 119 GLN CG C 13 34.571 0.30 . 1 . . . A 154 GLN CG . 17578 1 1085 . 1 1 119 119 GLN N N 15 118.232 0.30 . 1 . . . A 154 GLN N . 17578 1 1086 . 1 1 119 119 GLN NE2 N 15 111.888 0.30 . 1 . . . A 154 GLN NE2 . 17578 1 1087 . 1 1 120 120 ALA H H 1 7.486 0.03 . 1 . . . A 155 ALA H . 17578 1 1088 . 1 1 120 120 ALA HA H 1 4.223 0.03 . 1 . . . A 155 ALA HA . 17578 1 1089 . 1 1 120 120 ALA HB1 H 1 1.498 0.03 . 1 . . . A 155 ALA HB1 . 17578 1 1090 . 1 1 120 120 ALA HB2 H 1 1.498 0.03 . 1 . . . A 155 ALA HB2 . 17578 1 1091 . 1 1 120 120 ALA HB3 H 1 1.498 0.03 . 1 . . . A 155 ALA HB3 . 17578 1 1092 . 1 1 120 120 ALA CA C 13 55.071 0.30 . 1 . . . A 155 ALA CA . 17578 1 1093 . 1 1 120 120 ALA CB C 13 17.952 0.30 . 1 . . . A 155 ALA CB . 17578 1 1094 . 1 1 120 120 ALA N N 15 120.568 0.30 . 1 . . . A 155 ALA N . 17578 1 1095 . 1 1 121 121 LEU H H 1 7.781 0.03 . 1 . . . A 156 LEU H . 17578 1 1096 . 1 1 121 121 LEU HA H 1 4.187 0.03 . 1 . . . A 156 LEU HA . 17578 1 1097 . 1 1 121 121 LEU HB2 H 1 2.051 0.03 . 2 . . . A 156 LEU HB2 . 17578 1 1098 . 1 1 121 121 LEU HG H 1 1.462 0.03 . 1 . . . A 156 LEU HG . 17578 1 1099 . 1 1 121 121 LEU HD11 H 1 0.894 0.03 . 4 . . . A 156 LEU HD11 . 17578 1 1100 . 1 1 121 121 LEU HD12 H 1 0.894 0.03 . 4 . . . A 156 LEU HD12 . 17578 1 1101 . 1 1 121 121 LEU HD13 H 1 0.894 0.03 . 4 . . . A 156 LEU HD13 . 17578 1 1102 . 1 1 121 121 LEU HD21 H 1 0.851 0.03 . 4 . . . A 156 LEU HD21 . 17578 1 1103 . 1 1 121 121 LEU HD22 H 1 0.851 0.03 . 4 . . . A 156 LEU HD22 . 17578 1 1104 . 1 1 121 121 LEU HD23 H 1 0.851 0.03 . 4 . . . A 156 LEU HD23 . 17578 1 1105 . 1 1 121 121 LEU CA C 13 57.413 0.30 . 1 . . . A 156 LEU CA . 17578 1 1106 . 1 1 121 121 LEU CB C 13 42.287 0.30 . 1 . . . A 156 LEU CB . 17578 1 1107 . 1 1 121 121 LEU CD1 C 13 26.399 0.30 . 2 . . . A 156 LEU CD1 . 17578 1 1108 . 1 1 121 121 LEU N N 15 119.586 0.30 . 1 . . . A 156 LEU N . 17578 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 23 17578 1 1 24 17578 1 1 25 17578 1 1 26 17578 1 1 27 17578 1 1 28 17578 1 2 84 17578 1 2 85 17578 1 2 86 17578 1 2 87 17578 1 2 88 17578 1 2 89 17578 1 3 334 17578 1 3 335 17578 1 3 336 17578 1 4 402 17578 1 4 403 17578 1 4 404 17578 1 4 405 17578 1 4 406 17578 1 4 407 17578 1 5 607 17578 1 5 608 17578 1 5 609 17578 1 5 610 17578 1 5 611 17578 1 5 612 17578 1 6 763 17578 1 6 764 17578 1 6 765 17578 1 6 766 17578 1 6 767 17578 1 6 768 17578 1 7 1099 17578 1 7 1100 17578 1 7 1101 17578 1 7 1102 17578 1 7 1103 17578 1 7 1104 17578 1 8 69 17578 1 8 70 17578 1 8 71 17578 1 8 72 17578 1 8 73 17578 1 8 74 17578 1 9 119 17578 1 9 120 17578 1 9 121 17578 1 9 122 17578 1 9 123 17578 1 9 124 17578 1 10 205 17578 1 10 206 17578 1 10 207 17578 1 10 208 17578 1 10 209 17578 1 10 210 17578 1 11 249 17578 1 11 250 17578 1 11 251 17578 1 11 252 17578 1 11 253 17578 1 11 254 17578 1 12 284 17578 1 12 285 17578 1 12 286 17578 1 12 287 17578 1 12 288 17578 1 12 289 17578 1 13 298 17578 1 13 299 17578 1 13 300 17578 1 13 301 17578 1 13 302 17578 1 13 303 17578 1 14 416 17578 1 14 417 17578 1 14 418 17578 1 14 419 17578 1 14 420 17578 1 14 421 17578 1 15 431 17578 1 15 432 17578 1 15 433 17578 1 15 434 17578 1 15 435 17578 1 15 436 17578 1 16 532 17578 1 16 533 17578 1 16 534 17578 1 16 535 17578 1 16 536 17578 1 16 537 17578 1 17 592 17578 1 17 593 17578 1 17 594 17578 1 17 595 17578 1 17 596 17578 1 17 597 17578 1 18 660 17578 1 18 661 17578 1 18 662 17578 1 18 663 17578 1 18 664 17578 1 18 665 17578 1 19 829 17578 1 19 830 17578 1 19 831 17578 1 19 832 17578 1 19 833 17578 1 19 834 17578 1 20 843 17578 1 20 844 17578 1 20 845 17578 1 20 846 17578 1 20 847 17578 1 20 848 17578 1 21 883 17578 1 21 884 17578 1 21 885 17578 1 21 886 17578 1 21 887 17578 1 21 888 17578 1 22 1017 17578 1 22 1018 17578 1 22 1019 17578 1 22 1020 17578 1 22 1021 17578 1 22 1022 17578 1 23 1031 17578 1 23 1032 17578 1 23 1033 17578 1 23 1034 17578 1 23 1035 17578 1 23 1036 17578 1 24 1064 17578 1 24 1065 17578 1 24 1066 17578 1 24 1067 17578 1 24 1068 17578 1 24 1069 17578 1 25 451 17578 1 25 452 17578 1 25 453 17578 1 26 489 17578 1 26 490 17578 1 26 491 17578 1 27 551 17578 1 27 552 17578 1 27 553 17578 1 28 576 17578 1 28 577 17578 1 28 578 17578 1 29 695 17578 1 29 696 17578 1 29 697 17578 1 30 872 17578 1 30 873 17578 1 30 874 17578 1 stop_ save_