data_7298 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 7298 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID . 'Ubp-M Znf-UBP domain' 'Structure analysis' 'This study determines the structure of Znf-UBP domain of Ubp-M/USP16.' 7298 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . Znf-UBP 7298 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7298 _Entry.Title ; 1H, 13C, 15N-NMR resonance assignments for Znf-UBP domain of Ubp-M ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-09-20 _Entry.Accession_date 2006-09-20 _Entry.Last_release_date 2008-05-12 _Entry.Original_release_date 2008-05-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 Ming-Tao Pai . . . 7298 2 Pei Zhou . . . 7298 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7298 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 411 7298 '15N chemical shifts' 134 7298 '1H chemical shifts' 861 7298 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2008-05-12 2006-09-20 original author . 7298 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2I50 'BMRB Entry Tracking System' 7298 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7298 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17512543 _Citation.Full_citation . _Citation.Title 'Solution structure of the Ubp-M BUZ domain, a highly specific protein module that recognizes the C-terminal tail of free ubiquitin' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 370 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 290 _Citation.Page_last 302 _Citation.Year 2007 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Ming-Tao Pai . . . 7298 1 2 Shiou-Ru Tzeng . . . 7298 1 3 Jeffrey Kovacs . J. . 7298 1 4 Mignon Keaton . A. . 7298 1 5 Shawn Li . S.-C. . 7298 1 6 Tso-Pang Yao . . . 7298 1 7 Pei Zhou . . . 7298 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7298 _Assembly.ID 1 _Assembly.Name 'Znf-UBP domain of Ubp-M' _Assembly.BMRB_code . _Assembly.Number_of_components 4 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 3 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 7298 1 stop_ 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 'Znf-UBP domain of Ubp-M' 1 $Ubp-M_Znf-UBP_domain . . yes native no no . . . 7298 1 2 'ZINC (II) ION, 1' 2 $ZN . . no native no no . . . 7298 1 3 'ZINC (II) ION, 2' 2 $ZN . . no native no no . . . 7298 1 4 'ZINC (II) ION, 3' 2 $ZN . . no native no no . . . 7298 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'ubiquitin binding domain' 7298 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Ubp-M_Znf-UBP_domain _Entity.Sf_category entity _Entity.Sf_framecode Ubp-M_Znf-UBP_domain _Entity.Entry_ID 7298 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Ubp-M Znf-UBP domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMPVCRHIRKGLEQGNLK KALVNVEWNICQDCKTDNKV KDKAEEETEEKPSVWLCLKC GHQGCGRNSQEQHALKHYLT PRSEPHCLVLSLDNWSVWCY VCDNEVQYCSSNQLGQVVDY VRKQAS ; _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 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2I50 . "Solution Structure Of Ubp-M Znf-Ubp Domain" . . . . . 100.00 126 100.00 100.00 1.91e-86 . . . . 7298 1 2 no DBJ BAD96401 . "ubiquitin specific protease 16 isoform a variant [Homo sapiens]" . . . . . 96.83 823 100.00 100.00 1.69e-80 . . . . 7298 1 3 no DBJ BAD96604 . "ubiquitin specific protease 16 isoform a variant [Homo sapiens]" . . . . . 96.83 823 100.00 100.00 1.45e-80 . . . . 7298 1 4 no DBJ BAE01147 . "unnamed protein product [Macaca fascicularis]" . . . . . 96.03 759 98.35 100.00 1.08e-79 . . . . 7298 1 5 no DBJ BAG57569 . "unnamed protein product [Homo sapiens]" . . . . . 96.83 808 99.18 99.18 9.01e-80 . . . . 7298 1 6 no EMBL CAB90432 . "human ubiquitin processing protease, EC 3.1.2.15 [Homo sapiens]" . . . . . 96.83 823 100.00 100.00 1.45e-80 . . . . 7298 1 7 no GB AAD20949 . "ubiquitin processing protease [Homo sapiens]" . . . . . 96.83 823 100.00 100.00 1.45e-80 . . . . 7298 1 8 no GB AAH30777 . "Ubiquitin specific peptidase 16 [Homo sapiens]" . . . . . 96.83 822 99.18 99.18 1.10e-79 . . . . 7298 1 9 no GB AAR13293 . "USP16 [Homo sapiens]" . . . . . 96.83 408 100.00 100.00 8.85e-84 . . . . 7298 1 10 no GB ABM83321 . "ubiquitin specific peptidase 16 [synthetic construct]" . . . . . 96.83 822 99.18 99.18 1.14e-79 . . . . 7298 1 11 no GB ABM86536 . "ubiquitin specific peptidase 16 [synthetic construct]" . . . . . 96.83 822 99.18 99.18 1.10e-79 . . . . 7298 1 12 no REF NP_001001992 . "ubiquitin carboxyl-terminal hydrolase 16 isoform b [Homo sapiens]" . . . . . 96.83 822 100.00 100.00 1.57e-80 . . . . 7298 1 13 no REF NP_001027582 . "ubiquitin carboxyl-terminal hydrolase 16 isoform a [Homo sapiens]" . . . . . 96.83 823 100.00 100.00 1.45e-80 . . . . 7298 1 14 no REF NP_001247928 . "ubiquitin carboxyl-terminal hydrolase 16 [Macaca mulatta]" . . . . . 96.03 826 98.35 100.00 1.81e-79 . . . . 7298 1 15 no REF NP_006438 . "ubiquitin carboxyl-terminal hydrolase 16 isoform a [Homo sapiens]" . . . . . 96.83 823 100.00 100.00 1.45e-80 . . . . 7298 1 16 no REF XP_001159952 . "PREDICTED: ubiquitin carboxyl-terminal hydrolase 16 isoform X1 [Pan troglodytes]" . . . . . 96.03 826 99.17 100.00 9.92e-80 . . . . 7298 1 17 no SP Q4R6X7 . "RecName: Full=Ubiquitin carboxyl-terminal hydrolase 16; AltName: Full=Deubiquitinating enzyme 16; AltName: Full=Ubiquitin thioe" . . . . . 96.83 826 98.36 100.00 4.25e-80 . . . . 7298 1 18 no SP Q9Y5T5 . "RecName: Full=Ubiquitin carboxyl-terminal hydrolase 16; AltName: Full=Deubiquitinating enzyme 16; AltName: Full=Ubiquitin thioe" . . . . . 96.83 823 100.00 100.00 1.45e-80 . . . . 7298 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 . GLY . 7298 1 2 . SER . 7298 1 3 . HIS . 7298 1 4 . MET . 7298 1 5 . PRO . 7298 1 6 . VAL . 7298 1 7 . CYS . 7298 1 8 . ARG . 7298 1 9 . HIS . 7298 1 10 . ILE . 7298 1 11 . ARG . 7298 1 12 . LYS . 7298 1 13 . GLY . 7298 1 14 . LEU . 7298 1 15 . GLU . 7298 1 16 . GLN . 7298 1 17 . GLY . 7298 1 18 . ASN . 7298 1 19 . LEU . 7298 1 20 . LYS . 7298 1 21 . LYS . 7298 1 22 . ALA . 7298 1 23 . LEU . 7298 1 24 . VAL . 7298 1 25 . ASN . 7298 1 26 . VAL . 7298 1 27 . GLU . 7298 1 28 . TRP . 7298 1 29 . ASN . 7298 1 30 . ILE . 7298 1 31 . CYS . 7298 1 32 . GLN . 7298 1 33 . ASP . 7298 1 34 . CYS . 7298 1 35 . LYS . 7298 1 36 . THR . 7298 1 37 . ASP . 7298 1 38 . ASN . 7298 1 39 . LYS . 7298 1 40 . VAL . 7298 1 41 . LYS . 7298 1 42 . ASP . 7298 1 43 . LYS . 7298 1 44 . ALA . 7298 1 45 . GLU . 7298 1 46 . GLU . 7298 1 47 . GLU . 7298 1 48 . THR . 7298 1 49 . GLU . 7298 1 50 . GLU . 7298 1 51 . LYS . 7298 1 52 . PRO . 7298 1 53 . SER . 7298 1 54 . VAL . 7298 1 55 . TRP . 7298 1 56 . LEU . 7298 1 57 . CYS . 7298 1 58 . LEU . 7298 1 59 . LYS . 7298 1 60 . CYS . 7298 1 61 . GLY . 7298 1 62 . HIS . 7298 1 63 . GLN . 7298 1 64 . GLY . 7298 1 65 . CYS . 7298 1 66 . GLY . 7298 1 67 . ARG . 7298 1 68 . ASN . 7298 1 69 . SER . 7298 1 70 . GLN . 7298 1 71 . GLU . 7298 1 72 . GLN . 7298 1 73 . HIS . 7298 1 74 . ALA . 7298 1 75 . LEU . 7298 1 76 . LYS . 7298 1 77 . HIS . 7298 1 78 . TYR . 7298 1 79 . LEU . 7298 1 80 . THR . 7298 1 81 . PRO . 7298 1 82 . ARG . 7298 1 83 . SER . 7298 1 84 . GLU . 7298 1 85 . PRO . 7298 1 86 . HIS . 7298 1 87 . CYS . 7298 1 88 . LEU . 7298 1 89 . VAL . 7298 1 90 . LEU . 7298 1 91 . SER . 7298 1 92 . LEU . 7298 1 93 . ASP . 7298 1 94 . ASN . 7298 1 95 . TRP . 7298 1 96 . SER . 7298 1 97 . VAL . 7298 1 98 . TRP . 7298 1 99 . CYS . 7298 1 100 . TYR . 7298 1 101 . VAL . 7298 1 102 . CYS . 7298 1 103 . ASP . 7298 1 104 . ASN . 7298 1 105 . GLU . 7298 1 106 . VAL . 7298 1 107 . GLN . 7298 1 108 . TYR . 7298 1 109 . CYS . 7298 1 110 . SER . 7298 1 111 . SER . 7298 1 112 . ASN . 7298 1 113 . GLN . 7298 1 114 . LEU . 7298 1 115 . GLY . 7298 1 116 . GLN . 7298 1 117 . VAL . 7298 1 118 . VAL . 7298 1 119 . ASP . 7298 1 120 . TYR . 7298 1 121 . VAL . 7298 1 122 . ARG . 7298 1 123 . LYS . 7298 1 124 . GLN . 7298 1 125 . ALA . 7298 1 126 . SER . 7298 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 . GLY 1 1 7298 1 . SER 2 2 7298 1 . HIS 3 3 7298 1 . MET 4 4 7298 1 . PRO 5 5 7298 1 . VAL 6 6 7298 1 . CYS 7 7 7298 1 . ARG 8 8 7298 1 . HIS 9 9 7298 1 . ILE 10 10 7298 1 . ARG 11 11 7298 1 . LYS 12 12 7298 1 . GLY 13 13 7298 1 . LEU 14 14 7298 1 . GLU 15 15 7298 1 . GLN 16 16 7298 1 . GLY 17 17 7298 1 . ASN 18 18 7298 1 . LEU 19 19 7298 1 . LYS 20 20 7298 1 . LYS 21 21 7298 1 . ALA 22 22 7298 1 . LEU 23 23 7298 1 . VAL 24 24 7298 1 . ASN 25 25 7298 1 . VAL 26 26 7298 1 . GLU 27 27 7298 1 . TRP 28 28 7298 1 . ASN 29 29 7298 1 . ILE 30 30 7298 1 . CYS 31 31 7298 1 . GLN 32 32 7298 1 . ASP 33 33 7298 1 . CYS 34 34 7298 1 . LYS 35 35 7298 1 . THR 36 36 7298 1 . ASP 37 37 7298 1 . ASN 38 38 7298 1 . LYS 39 39 7298 1 . VAL 40 40 7298 1 . LYS 41 41 7298 1 . ASP 42 42 7298 1 . LYS 43 43 7298 1 . ALA 44 44 7298 1 . GLU 45 45 7298 1 . GLU 46 46 7298 1 . GLU 47 47 7298 1 . THR 48 48 7298 1 . GLU 49 49 7298 1 . GLU 50 50 7298 1 . LYS 51 51 7298 1 . PRO 52 52 7298 1 . SER 53 53 7298 1 . VAL 54 54 7298 1 . TRP 55 55 7298 1 . LEU 56 56 7298 1 . CYS 57 57 7298 1 . LEU 58 58 7298 1 . LYS 59 59 7298 1 . CYS 60 60 7298 1 . GLY 61 61 7298 1 . HIS 62 62 7298 1 . GLN 63 63 7298 1 . GLY 64 64 7298 1 . CYS 65 65 7298 1 . GLY 66 66 7298 1 . ARG 67 67 7298 1 . ASN 68 68 7298 1 . SER 69 69 7298 1 . GLN 70 70 7298 1 . GLU 71 71 7298 1 . GLN 72 72 7298 1 . HIS 73 73 7298 1 . ALA 74 74 7298 1 . LEU 75 75 7298 1 . LYS 76 76 7298 1 . HIS 77 77 7298 1 . TYR 78 78 7298 1 . LEU 79 79 7298 1 . THR 80 80 7298 1 . PRO 81 81 7298 1 . ARG 82 82 7298 1 . SER 83 83 7298 1 . GLU 84 84 7298 1 . PRO 85 85 7298 1 . HIS 86 86 7298 1 . CYS 87 87 7298 1 . LEU 88 88 7298 1 . VAL 89 89 7298 1 . LEU 90 90 7298 1 . SER 91 91 7298 1 . LEU 92 92 7298 1 . ASP 93 93 7298 1 . ASN 94 94 7298 1 . TRP 95 95 7298 1 . SER 96 96 7298 1 . VAL 97 97 7298 1 . TRP 98 98 7298 1 . CYS 99 99 7298 1 . TYR 100 100 7298 1 . VAL 101 101 7298 1 . CYS 102 102 7298 1 . ASP 103 103 7298 1 . ASN 104 104 7298 1 . GLU 105 105 7298 1 . VAL 106 106 7298 1 . GLN 107 107 7298 1 . TYR 108 108 7298 1 . CYS 109 109 7298 1 . SER 110 110 7298 1 . SER 111 111 7298 1 . ASN 112 112 7298 1 . GLN 113 113 7298 1 . LEU 114 114 7298 1 . GLY 115 115 7298 1 . GLN 116 116 7298 1 . VAL 117 117 7298 1 . VAL 118 118 7298 1 . ASP 119 119 7298 1 . TYR 120 120 7298 1 . VAL 121 121 7298 1 . ARG 122 122 7298 1 . LYS 123 123 7298 1 . GLN 124 124 7298 1 . ALA 125 125 7298 1 . SER 126 126 7298 1 stop_ save_ save_ZN _Entity.Sf_category entity _Entity.Sf_framecode ZN _Entity.Entry_ID 7298 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ZN . 7298 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 7298 _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 $Ubp-M_Znf-UBP_domain . 9606 . no . Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 7298 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 7298 _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 $Ubp-M_Znf-UBP_domain . 'recombinant technology' . 'E. coli' . . Escherichia coli BL21 . . . . . . . . . . . . plasmid . . pET15b . . . . . . 7298 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 7298 _Chem_comp.ID ZN _Chem_comp.Provenance . _Chem_comp.Name 'ZINC ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Oct 11 12:28:04 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 7298 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 7298 ZN [Zn++] SMILES CACTVS 3.341 7298 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 7298 ZN [Zn+2] SMILES ACDLabs 10.04 7298 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 7298 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 7298 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 7298 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 7298 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN . ZN . . ZN . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 7298 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_13C_labeled_1 _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_labeled_1 _Sample.Entry_ID 7298 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Ubp-M Znf-UBP domain' '[U-13C; U-15N]' 1 $assembly . . . . 1.0 . . mM . . . . 7298 1 2 phosphate . . . . . . . 25 . . mM . . . . 7298 1 3 KCl . . . . . . . 100 . . mM . . . . 7298 1 4 D2O . . . . . . . 100 . . % . . . . 7298 1 stop_ save_ save_15N_13C_labeled_2 _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C_labeled_2 _Sample.Entry_ID 7298 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Ubp-M Znf-UBP domain' '[U-13C; U-15N]' 1 $assembly . . . . 1.0 . . mM . . . . 7298 2 2 phosphate . . . . . . . 25 . . mM . . . . 7298 2 3 KCl . . . . . . . 100 . . mM . . . . 7298 2 4 D2O . . . . . . . 5 . . % . . . . 7298 2 5 H2O . . . . . . . 95 . . % . . . . 7298 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_condition_1 _Sample_condition_list.Entry_ID 7298 _Sample_condition_list.ID 1 _Sample_condition_list.Details '25 mM phosphate, 100 mM KCl, pH 7.0.' 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 pH 7.0 . pH 7298 1 temperature 300 0.2 K 7298 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 7298 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 7298 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7298 _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 1H15N_HSQC no . . . . . . . . . . 2 $15N_13C_labeled_2 . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 2 HNCA no . . . . . . . . . . . . . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 3 HN(CO)CA no . . . . . . . . . . . . . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 4 HN(CA)CB no . . . . . . . . . . . . . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 5 HN(COCA)CB no . . . . . . . . . . . . . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 6 13C-aliphatic-NOESY no . . . . . . . . . . 1 $15N_13C_labeled_1 . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 7 13C-aromatic-NOESY no . . . . . . . . . . . . . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 8 15N-NOESY no . . . . . . . . . . . . . . . 1 $sample_condition_1 . . . . . . . . . . . . . . . . . . . . . 7298 1 stop_ save_ save_1H15N_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_HSQC _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '1H15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HNCA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCA _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(CO)CA _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(CO)CA _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HN(CO)CA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(CA)CB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(CA)CB _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HN(CA)CB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_HN(COCA)CB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(COCA)CB _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HN(COCA)CB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_13C-aliphatic-NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C-aliphatic-NOESY _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name 13C-aliphatic-NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_13C-aromatic-NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C-aromatic-NOESY _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name 13C-aromatic-NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_15N-NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 15N-NOESY _NMR_spec_expt.Entry_ID 7298 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name 15N-NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7298 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 7298 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 7298 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 7298 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_Znf-UBP _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Znf-UBP _Assigned_chem_shift_list.Entry_ID 7298 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _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 $15N_13C_labeled_1 isotropic 7298 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 3 3 HIS HA H 1 4.695 0.020 . 1 . . . . 3 HIS HA . 7298 1 2 . 1 1 3 3 HIS HB2 H 1 3.111 0.020 . 2 . . . . 3 HIS HB2 . 7298 1 3 . 1 1 3 3 HIS HB3 H 1 3.171 0.020 . 2 . . . . 3 HIS HB3 . 7298 1 4 . 1 1 3 3 HIS HD2 H 1 7.045 0.020 . 1 . . . . 3 HIS HD2 . 7298 1 5 . 1 1 3 3 HIS CA C 13 56.096 0.400 . 1 . . . . 3 HIS CA . 7298 1 6 . 1 1 3 3 HIS CB C 13 30.492 0.400 . 1 . . . . 3 HIS CB . 7298 1 7 . 1 1 4 4 MET HA H 1 4.784 0.020 . 1 . . . . 4 MET HA . 7298 1 8 . 1 1 4 4 MET HB2 H 1 1.920 0.020 . 2 . . . . 4 MET HB2 . 7298 1 9 . 1 1 4 4 MET HB3 H 1 2.033 0.020 . 2 . . . . 4 MET HB3 . 7298 1 10 . 1 1 4 4 MET HG2 H 1 2.503 0.020 . 2 . . . . 4 MET HG2 . 7298 1 11 . 1 1 4 4 MET HG3 H 1 2.576 0.020 . 2 . . . . 4 MET HG3 . 7298 1 12 . 1 1 4 4 MET CA C 13 52.869 0.400 . 1 . . . . 4 MET CA . 7298 1 13 . 1 1 4 4 MET CB C 13 32.232 0.400 . 1 . . . . 4 MET CB . 7298 1 14 . 1 1 4 4 MET CG C 13 31.983 0.400 . 1 . . . . 4 MET CG . 7298 1 15 . 1 1 5 5 PRO HA H 1 4.473 0.020 . 1 . . . . 5 PRO HA . 7298 1 16 . 1 1 5 5 PRO HB2 H 1 1.972 0.020 . 2 . . . . 5 PRO HB2 . 7298 1 17 . 1 1 5 5 PRO HB3 H 1 2.293 0.020 . 2 . . . . 5 PRO HB3 . 7298 1 18 . 1 1 5 5 PRO HG2 H 1 2.030 0.020 . 2 . . . . 5 PRO HG2 . 7298 1 19 . 1 1 5 5 PRO HG3 H 1 2.070 0.020 . 2 . . . . 5 PRO HG3 . 7298 1 20 . 1 1 5 5 PRO HD2 H 1 3.699 0.020 . 2 . . . . 5 PRO HD2 . 7298 1 21 . 1 1 5 5 PRO HD3 H 1 3.773 0.020 . 2 . . . . 5 PRO HD3 . 7298 1 22 . 1 1 5 5 PRO CA C 13 63.056 0.400 . 1 . . . . 5 PRO CA . 7298 1 23 . 1 1 5 5 PRO CB C 13 32.055 0.400 . 1 . . . . 5 PRO CB . 7298 1 24 . 1 1 5 5 PRO CG C 13 27.235 0.400 . 1 . . . . 5 PRO CG . 7298 1 25 . 1 1 5 5 PRO CD C 13 50.585 0.400 . 1 . . . . 5 PRO CD . 7298 1 26 . 1 1 6 6 VAL H H 1 8.106 0.020 . 1 . . . . 6 VAL H . 7298 1 27 . 1 1 6 6 VAL HA H 1 4.131 0.020 . 1 . . . . 6 VAL HA . 7298 1 28 . 1 1 6 6 VAL HB H 1 2.001 0.020 . 1 . . . . 6 VAL HB . 7298 1 29 . 1 1 6 6 VAL HG11 H 1 0.955 0.020 . 2 . . . . 6 VAL HG1 . 7298 1 30 . 1 1 6 6 VAL HG12 H 1 0.955 0.020 . 2 . . . . 6 VAL HG1 . 7298 1 31 . 1 1 6 6 VAL HG13 H 1 0.955 0.020 . 2 . . . . 6 VAL HG1 . 7298 1 32 . 1 1 6 6 VAL HG21 H 1 0.911 0.020 . 2 . . . . 6 VAL HG2 . 7298 1 33 . 1 1 6 6 VAL HG22 H 1 0.911 0.020 . 2 . . . . 6 VAL HG2 . 7298 1 34 . 1 1 6 6 VAL HG23 H 1 0.911 0.020 . 2 . . . . 6 VAL HG2 . 7298 1 35 . 1 1 6 6 VAL CA C 13 61.565 0.400 . 1 . . . . 6 VAL CA . 7298 1 36 . 1 1 6 6 VAL CB C 13 33.578 0.400 . 1 . . . . 6 VAL CB . 7298 1 37 . 1 1 6 6 VAL CG1 C 13 20.550 0.400 . 1 . . . . 6 VAL CG1 . 7298 1 38 . 1 1 6 6 VAL CG2 C 13 20.886 0.400 . 1 . . . . 6 VAL CG2 . 7298 1 39 . 1 1 6 6 VAL N N 15 120.314 0.400 . 1 . . . . 6 VAL N . 7298 1 40 . 1 1 7 7 CYS H H 1 8.233 0.020 . 1 . . . . 7 CYS H . 7298 1 41 . 1 1 7 7 CYS HA H 1 4.125 0.020 . 1 . . . . 7 CYS HA . 7298 1 42 . 1 1 7 7 CYS HB2 H 1 2.811 0.020 . 2 . . . . 7 CYS HB2 . 7298 1 43 . 1 1 7 7 CYS HB3 H 1 2.990 0.020 . 2 . . . . 7 CYS HB3 . 7298 1 44 . 1 1 7 7 CYS CA C 13 61.068 0.400 . 1 . . . . 7 CYS CA . 7298 1 45 . 1 1 7 7 CYS CB C 13 31.293 0.400 . 1 . . . . 7 CYS CB . 7298 1 46 . 1 1 7 7 CYS N N 15 127.747 0.400 . 1 . . . . 7 CYS N . 7298 1 47 . 1 1 8 8 ARG H H 1 7.486 0.020 . 1 . . . . 8 ARG H . 7298 1 48 . 1 1 8 8 ARG HA H 1 4.441 0.020 . 1 . . . . 8 ARG HA . 7298 1 49 . 1 1 8 8 ARG HB2 H 1 1.266 0.020 . 2 . . . . 8 ARG HB2 . 7298 1 50 . 1 1 8 8 ARG HB3 H 1 1.903 0.020 . 2 . . . . 8 ARG HB3 . 7298 1 51 . 1 1 8 8 ARG HG2 H 1 1.378 0.020 . 1 . . . . 8 ARG HG2 . 7298 1 52 . 1 1 8 8 ARG HG3 H 1 1.378 0.020 . 1 . . . . 8 ARG HG3 . 7298 1 53 . 1 1 8 8 ARG HD2 H 1 3.131 0.020 . 1 . . . . 8 ARG HD2 . 7298 1 54 . 1 1 8 8 ARG HD3 H 1 3.131 0.020 . 1 . . . . 8 ARG HD3 . 7298 1 55 . 1 1 8 8 ARG CA C 13 55.350 0.400 . 1 . . . . 8 ARG CA . 7298 1 56 . 1 1 8 8 ARG CB C 13 28.752 0.400 . 1 . . . . 8 ARG CB . 7298 1 57 . 1 1 8 8 ARG CG C 13 26.470 0.400 . 1 . . . . 8 ARG CG . 7298 1 58 . 1 1 8 8 ARG CD C 13 42.970 0.400 . 1 . . . . 8 ARG CD . 7298 1 59 . 1 1 8 8 ARG N N 15 128.176 0.400 . 1 . . . . 8 ARG N . 7298 1 60 . 1 1 9 9 HIS H H 1 10.156 0.020 . 1 . . . . 9 HIS H . 7298 1 61 . 1 1 9 9 HIS HA H 1 4.596 0.020 . 1 . . . . 9 HIS HA . 7298 1 62 . 1 1 9 9 HIS HB2 H 1 3.007 0.020 . 2 . . . . 9 HIS HB2 . 7298 1 63 . 1 1 9 9 HIS HB3 H 1 3.583 0.020 . 2 . . . . 9 HIS HB3 . 7298 1 64 . 1 1 9 9 HIS HD2 H 1 7.192 0.020 . 1 . . . . 9 HIS HD2 . 7298 1 65 . 1 1 9 9 HIS HE1 H 1 8.056 0.020 . 1 . . . . 9 HIS HE1 . 7298 1 66 . 1 1 9 9 HIS CA C 13 57.946 0.400 . 1 . . . . 9 HIS CA . 7298 1 67 . 1 1 9 9 HIS CB C 13 31.293 0.400 . 1 . . . . 9 HIS CB . 7298 1 68 . 1 1 9 9 HIS CD2 C 13 117.694 0.400 . 1 . . . . 9 HIS CD2 . 7298 1 69 . 1 1 9 9 HIS CE1 C 13 138.435 0.400 . 1 . . . . 9 HIS CE1 . 7298 1 70 . 1 1 9 9 HIS N N 15 124.893 0.400 . 1 . . . . 9 HIS N . 7298 1 71 . 1 1 10 10 ILE H H 1 7.281 0.020 . 1 . . . . 10 ILE H . 7298 1 72 . 1 1 10 10 ILE HA H 1 3.679 0.020 . 1 . . . . 10 ILE HA . 7298 1 73 . 1 1 10 10 ILE HB H 1 1.886 0.020 . 1 . . . . 10 ILE HB . 7298 1 74 . 1 1 10 10 ILE HG12 H 1 1.122 0.020 . 2 . . . . 10 ILE HG12 . 7298 1 75 . 1 1 10 10 ILE HG13 H 1 2.022 0.020 . 2 . . . . 10 ILE HG13 . 7298 1 76 . 1 1 10 10 ILE HG21 H 1 0.933 0.020 . 1 . . . . 10 ILE HG2 . 7298 1 77 . 1 1 10 10 ILE HG22 H 1 0.933 0.020 . 1 . . . . 10 ILE HG2 . 7298 1 78 . 1 1 10 10 ILE HG23 H 1 0.933 0.020 . 1 . . . . 10 ILE HG2 . 7298 1 79 . 1 1 10 10 ILE HD11 H 1 1.046 0.020 . 1 . . . . 10 ILE HD1 . 7298 1 80 . 1 1 10 10 ILE HD12 H 1 1.046 0.020 . 1 . . . . 10 ILE HD1 . 7298 1 81 . 1 1 10 10 ILE HD13 H 1 1.046 0.020 . 1 . . . . 10 ILE HD1 . 7298 1 82 . 1 1 10 10 ILE CA C 13 64.799 0.400 . 1 . . . . 10 ILE CA . 7298 1 83 . 1 1 10 10 ILE CB C 13 38.198 0.400 . 1 . . . . 10 ILE CB . 7298 1 84 . 1 1 10 10 ILE CG1 C 13 29.000 0.400 . 1 . . . . 10 ILE CG1 . 7298 1 85 . 1 1 10 10 ILE CG2 C 13 18.062 0.400 . 1 . . . . 10 ILE CG2 . 7298 1 86 . 1 1 10 10 ILE CD1 C 13 13.836 0.400 . 1 . . . . 10 ILE CD1 . 7298 1 87 . 1 1 10 10 ILE N N 15 120.511 0.400 . 1 . . . . 10 ILE N . 7298 1 88 . 1 1 11 11 ARG H H 1 8.102 0.020 . 1 . . . . 11 ARG H . 7298 1 89 . 1 1 11 11 ARG HA H 1 4.092 0.020 . 1 . . . . 11 ARG HA . 7298 1 90 . 1 1 11 11 ARG HB2 H 1 1.905 0.020 . 1 . . . . 11 ARG HB2 . 7298 1 91 . 1 1 11 11 ARG HB3 H 1 1.905 0.020 . 1 . . . . 11 ARG HB3 . 7298 1 92 . 1 1 11 11 ARG HG2 H 1 1.686 0.020 . 2 . . . . 11 ARG HG2 . 7298 1 93 . 1 1 11 11 ARG HG3 H 1 1.766 0.020 . 2 . . . . 11 ARG HG3 . 7298 1 94 . 1 1 11 11 ARG HD2 H 1 3.281 0.020 . 1 . . . . 11 ARG HD2 . 7298 1 95 . 1 1 11 11 ARG HD3 H 1 3.281 0.020 . 1 . . . . 11 ARG HD3 . 7298 1 96 . 1 1 11 11 ARG CA C 13 59.215 0.400 . 1 . . . . 11 ARG CA . 7298 1 97 . 1 1 11 11 ARG CB C 13 29.516 0.400 . 1 . . . . 11 ARG CB . 7298 1 98 . 1 1 11 11 ARG CG C 13 27.486 0.400 . 1 . . . . 11 ARG CG . 7298 1 99 . 1 1 11 11 ARG CD C 13 43.223 0.400 . 1 . . . . 11 ARG CD . 7298 1 100 . 1 1 11 11 ARG N N 15 116.771 0.400 . 1 . . . . 11 ARG N . 7298 1 101 . 1 1 12 12 LYS H H 1 7.858 0.020 . 1 . . . . 12 LYS H . 7298 1 102 . 1 1 12 12 LYS HA H 1 4.399 0.020 . 1 . . . . 12 LYS HA . 7298 1 103 . 1 1 12 12 LYS HB2 H 1 1.948 0.020 . 1 . . . . 12 LYS HB2 . 7298 1 104 . 1 1 12 12 LYS HB3 H 1 1.948 0.020 . 1 . . . . 12 LYS HB3 . 7298 1 105 . 1 1 12 12 LYS HG2 H 1 1.553 0.020 . 2 . . . . 12 LYS HG2 . 7298 1 106 . 1 1 12 12 LYS HG3 H 1 1.643 0.020 . 2 . . . . 12 LYS HG3 . 7298 1 107 . 1 1 12 12 LYS HD2 H 1 1.809 0.020 . 1 . . . . 12 LYS HD2 . 7298 1 108 . 1 1 12 12 LYS HD3 H 1 1.809 0.020 . 1 . . . . 12 LYS HD3 . 7298 1 109 . 1 1 12 12 LYS HE2 H 1 3.094 0.020 . 1 . . . . 12 LYS HE2 . 7298 1 110 . 1 1 12 12 LYS HE3 H 1 3.094 0.020 . 1 . . . . 12 LYS HE3 . 7298 1 111 . 1 1 12 12 LYS CA C 13 56.930 0.400 . 1 . . . . 12 LYS CA . 7298 1 112 . 1 1 12 12 LYS CB C 13 32.562 0.400 . 1 . . . . 12 LYS CB . 7298 1 113 . 1 1 12 12 LYS CG C 13 25.201 0.400 . 1 . . . . 12 LYS CG . 7298 1 114 . 1 1 12 12 LYS CD C 13 29.009 0.400 . 1 . . . . 12 LYS CD . 7298 1 115 . 1 1 12 12 LYS CE C 13 41.700 0.400 . 1 . . . . 12 LYS CE . 7298 1 116 . 1 1 12 12 LYS N N 15 114.911 0.400 . 1 . . . . 12 LYS N . 7298 1 117 . 1 1 13 13 GLY H H 1 8.118 0.020 . 1 . . . . 13 GLY H . 7298 1 118 . 1 1 13 13 GLY HA2 H 1 3.686 0.020 . 2 . . . . 13 GLY HA2 . 7298 1 119 . 1 1 13 13 GLY HA3 H 1 4.407 0.020 . 2 . . . . 13 GLY HA3 . 7298 1 120 . 1 1 13 13 GLY CA C 13 45.898 0.400 . 1 . . . . 13 GLY CA . 7298 1 121 . 1 1 13 13 GLY N N 15 106.362 0.400 . 1 . . . . 13 GLY N . 7298 1 122 . 1 1 14 14 LEU H H 1 7.446 0.020 . 1 . . . . 14 LEU H . 7298 1 123 . 1 1 14 14 LEU HA H 1 4.663 0.020 . 1 . . . . 14 LEU HA . 7298 1 124 . 1 1 14 14 LEU HB2 H 1 1.470 0.020 . 2 . . . . 14 LEU HB2 . 7298 1 125 . 1 1 14 14 LEU HB3 H 1 1.820 0.020 . 2 . . . . 14 LEU HB3 . 7298 1 126 . 1 1 14 14 LEU HG H 1 1.784 0.020 . 1 . . . . 14 LEU HG . 7298 1 127 . 1 1 14 14 LEU HD11 H 1 0.838 0.020 . 2 . . . . 14 LEU HD1 . 7298 1 128 . 1 1 14 14 LEU HD12 H 1 0.838 0.020 . 2 . . . . 14 LEU HD1 . 7298 1 129 . 1 1 14 14 LEU HD13 H 1 0.838 0.020 . 2 . . . . 14 LEU HD1 . 7298 1 130 . 1 1 14 14 LEU HD21 H 1 0.922 0.020 . 2 . . . . 14 LEU HD2 . 7298 1 131 . 1 1 14 14 LEU HD22 H 1 0.922 0.020 . 2 . . . . 14 LEU HD2 . 7298 1 132 . 1 1 14 14 LEU HD23 H 1 0.922 0.020 . 2 . . . . 14 LEU HD2 . 7298 1 133 . 1 1 14 14 LEU CA C 13 53.377 0.400 . 1 . . . . 14 LEU CA . 7298 1 134 . 1 1 14 14 LEU CB C 13 44.746 0.400 . 1 . . . . 14 LEU CB . 7298 1 135 . 1 1 14 14 LEU CG C 13 26.514 0.400 . 1 . . . . 14 LEU CG . 7298 1 136 . 1 1 14 14 LEU CD1 C 13 25.455 0.400 . 1 . . . . 14 LEU CD1 . 7298 1 137 . 1 1 14 14 LEU CD2 C 13 25.455 0.400 . 1 . . . . 14 LEU CD2 . 7298 1 138 . 1 1 14 14 LEU N N 15 119.272 0.400 . 1 . . . . 14 LEU N . 7298 1 139 . 1 1 15 15 GLU H H 1 8.231 0.020 . 1 . . . . 15 GLU H . 7298 1 140 . 1 1 15 15 GLU HA H 1 4.560 0.020 . 1 . . . . 15 GLU HA . 7298 1 141 . 1 1 15 15 GLU HB2 H 1 2.014 0.020 . 2 . . . . 15 GLU HB2 . 7298 1 142 . 1 1 15 15 GLU HB3 H 1 2.374 0.020 . 2 . . . . 15 GLU HB3 . 7298 1 143 . 1 1 15 15 GLU HG2 H 1 2.293 0.020 . 2 . . . . 15 GLU HG2 . 7298 1 144 . 1 1 15 15 GLU HG3 H 1 2.319 0.020 . 2 . . . . 15 GLU HG3 . 7298 1 145 . 1 1 15 15 GLU CA C 13 55.599 0.400 . 1 . . . . 15 GLU CA . 7298 1 146 . 1 1 15 15 GLU CB C 13 30.740 0.400 . 1 . . . . 15 GLU CB . 7298 1 147 . 1 1 15 15 GLU CG C 13 36.706 0.400 . 1 . . . . 15 GLU CG . 7298 1 148 . 1 1 15 15 GLU N N 15 124.686 0.400 . 1 . . . . 15 GLU N . 7298 1 149 . 1 1 16 16 GLN H H 1 9.186 0.020 . 1 . . . . 16 GLN H . 7298 1 150 . 1 1 16 16 GLN HA H 1 3.874 0.020 . 1 . . . . 16 GLN HA . 7298 1 151 . 1 1 16 16 GLN HB2 H 1 2.056 0.020 . 1 . . . . 16 GLN HB2 . 7298 1 152 . 1 1 16 16 GLN HB3 H 1 2.056 0.020 . 1 . . . . 16 GLN HB3 . 7298 1 153 . 1 1 16 16 GLN HG2 H 1 2.227 0.020 . 2 . . . . 16 GLN HG2 . 7298 1 154 . 1 1 16 16 GLN HG3 H 1 2.267 0.020 . 2 . . . . 16 GLN HG3 . 7298 1 155 . 1 1 16 16 GLN HE21 H 1 6.712 0.020 . 2 . . . . 16 GLN HE21 . 7298 1 156 . 1 1 16 16 GLN HE22 H 1 7.116 0.020 . 2 . . . . 16 GLN HE22 . 7298 1 157 . 1 1 16 16 GLN CA C 13 59.225 0.400 . 1 . . . . 16 GLN CA . 7298 1 158 . 1 1 16 16 GLN CB C 13 27.993 0.400 . 1 . . . . 16 GLN CB . 7298 1 159 . 1 1 16 16 GLN CG C 13 33.832 0.400 . 1 . . . . 16 GLN CG . 7298 1 160 . 1 1 16 16 GLN N N 15 123.398 0.400 . 1 . . . . 16 GLN N . 7298 1 161 . 1 1 16 16 GLN NE2 N 15 110.321 0.400 . 1 . . . . 16 GLN NE2 . 7298 1 162 . 1 1 17 17 GLY H H 1 8.843 0.020 . 1 . . . . 17 GLY H . 7298 1 163 . 1 1 17 17 GLY HA2 H 1 3.872 0.020 . 2 . . . . 17 GLY HA2 . 7298 1 164 . 1 1 17 17 GLY HA3 H 1 3.981 0.020 . 2 . . . . 17 GLY HA3 . 7298 1 165 . 1 1 17 17 GLY CA C 13 46.508 0.400 . 1 . . . . 17 GLY CA . 7298 1 166 . 1 1 17 17 GLY N N 15 107.383 0.400 . 1 . . . . 17 GLY N . 7298 1 167 . 1 1 18 18 ASN H H 1 7.942 0.020 . 1 . . . . 18 ASN H . 7298 1 168 . 1 1 18 18 ASN HA H 1 4.709 0.020 . 1 . . . . 18 ASN HA . 7298 1 169 . 1 1 18 18 ASN HB2 H 1 2.912 0.020 . 1 . . . . 18 ASN HB2 . 7298 1 170 . 1 1 18 18 ASN HB3 H 1 2.912 0.020 . 1 . . . . 18 ASN HB3 . 7298 1 171 . 1 1 18 18 ASN HD21 H 1 7.070 0.020 . 2 . . . . 18 ASN HD21 . 7298 1 172 . 1 1 18 18 ASN HD22 H 1 7.697 0.020 . 2 . . . . 18 ASN HD22 . 7298 1 173 . 1 1 18 18 ASN CA C 13 54.378 0.400 . 1 . . . . 18 ASN CA . 7298 1 174 . 1 1 18 18 ASN CB C 13 38.147 0.400 . 1 . . . . 18 ASN CB . 7298 1 175 . 1 1 18 18 ASN N N 15 119.439 0.400 . 1 . . . . 18 ASN N . 7298 1 176 . 1 1 18 18 ASN ND2 N 15 111.778 0.400 . 1 . . . . 18 ASN ND2 . 7298 1 177 . 1 1 19 19 LEU HA H 1 3.851 0.020 . 1 . . . . 19 LEU HA . 7298 1 178 . 1 1 19 19 LEU HB2 H 1 1.649 0.020 . 2 . . . . 19 LEU HB2 . 7298 1 179 . 1 1 19 19 LEU HB3 H 1 1.759 0.020 . 2 . . . . 19 LEU HB3 . 7298 1 180 . 1 1 19 19 LEU HG H 1 1.657 0.020 . 1 . . . . 19 LEU HG . 7298 1 181 . 1 1 19 19 LEU HD11 H 1 0.880 0.020 . 2 . . . . 19 LEU HD1 . 7298 1 182 . 1 1 19 19 LEU HD12 H 1 0.880 0.020 . 2 . . . . 19 LEU HD1 . 7298 1 183 . 1 1 19 19 LEU HD13 H 1 0.880 0.020 . 2 . . . . 19 LEU HD1 . 7298 1 184 . 1 1 19 19 LEU HD21 H 1 0.950 0.020 . 2 . . . . 19 LEU HD2 . 7298 1 185 . 1 1 19 19 LEU HD22 H 1 0.950 0.020 . 2 . . . . 19 LEU HD2 . 7298 1 186 . 1 1 19 19 LEU HD23 H 1 0.950 0.020 . 2 . . . . 19 LEU HD2 . 7298 1 187 . 1 1 19 19 LEU CA C 13 58.085 0.400 . 1 . . . . 19 LEU CA . 7298 1 188 . 1 1 19 19 LEU CB C 13 41.447 0.400 . 1 . . . . 19 LEU CB . 7298 1 189 . 1 1 19 19 LEU CG C 13 26.763 0.400 . 1 . . . . 19 LEU CG . 7298 1 190 . 1 1 19 19 LEU CD1 C 13 24.186 0.400 . 1 . . . . 19 LEU CD1 . 7298 1 191 . 1 1 19 19 LEU CD2 C 13 24.694 0.400 . 1 . . . . 19 LEU CD2 . 7298 1 192 . 1 1 20 20 LYS H H 1 8.044 0.020 . 1 . . . . 20 LYS H . 7298 1 193 . 1 1 20 20 LYS HA H 1 4.008 0.020 . 1 . . . . 20 LYS HA . 7298 1 194 . 1 1 20 20 LYS HB2 H 1 1.785 0.020 . 1 . . . . 20 LYS HB2 . 7298 1 195 . 1 1 20 20 LYS HB3 H 1 1.785 0.020 . 1 . . . . 20 LYS HB3 . 7298 1 196 . 1 1 20 20 LYS HG2 H 1 1.036 0.020 . 2 . . . . 20 LYS HG2 . 7298 1 197 . 1 1 20 20 LYS HG3 H 1 1.466 0.020 . 2 . . . . 20 LYS HG3 . 7298 1 198 . 1 1 20 20 LYS HD2 H 1 1.432 0.020 . 2 . . . . 20 LYS HD2 . 7298 1 199 . 1 1 20 20 LYS HD3 H 1 1.498 0.020 . 2 . . . . 20 LYS HD3 . 7298 1 200 . 1 1 20 20 LYS HE2 H 1 2.378 0.020 . 2 . . . . 20 LYS HE2 . 7298 1 201 . 1 1 20 20 LYS HE3 H 1 2.584 0.020 . 2 . . . . 20 LYS HE3 . 7298 1 202 . 1 1 20 20 LYS CA C 13 59.825 0.400 . 1 . . . . 20 LYS CA . 7298 1 203 . 1 1 20 20 LYS CB C 13 32.302 0.400 . 1 . . . . 20 LYS CB . 7298 1 204 . 1 1 20 20 LYS CG C 13 25.716 0.400 . 1 . . . . 20 LYS CG . 7298 1 205 . 1 1 20 20 LYS CD C 13 29.262 0.400 . 1 . . . . 20 LYS CD . 7298 1 206 . 1 1 20 20 LYS CE C 13 41.445 0.400 . 1 . . . . 20 LYS CE . 7298 1 207 . 1 1 20 20 LYS N N 15 115.528 0.400 . 1 . . . . 20 LYS N . 7298 1 208 . 1 1 21 21 LYS H H 1 7.368 0.020 . 1 . . . . 21 LYS H . 7298 1 209 . 1 1 21 21 LYS HA H 1 4.176 0.020 . 1 . . . . 21 LYS HA . 7298 1 210 . 1 1 21 21 LYS HB2 H 1 1.908 0.020 . 1 . . . . 21 LYS HB2 . 7298 1 211 . 1 1 21 21 LYS HB3 H 1 1.908 0.020 . 1 . . . . 21 LYS HB3 . 7298 1 212 . 1 1 21 21 LYS HG2 H 1 1.490 0.020 . 2 . . . . 21 LYS HG2 . 7298 1 213 . 1 1 21 21 LYS HG3 H 1 1.604 0.020 . 2 . . . . 21 LYS HG3 . 7298 1 214 . 1 1 21 21 LYS HD2 H 1 1.742 0.020 . 1 . . . . 21 LYS HD2 . 7298 1 215 . 1 1 21 21 LYS HD3 H 1 1.742 0.020 . 1 . . . . 21 LYS HD3 . 7298 1 216 . 1 1 21 21 LYS HE2 H 1 3.024 0.020 . 1 . . . . 21 LYS HE2 . 7298 1 217 . 1 1 21 21 LYS HE3 H 1 3.024 0.020 . 1 . . . . 21 LYS HE3 . 7298 1 218 . 1 1 21 21 LYS CA C 13 58.333 0.400 . 1 . . . . 21 LYS CA . 7298 1 219 . 1 1 21 21 LYS CB C 13 32.729 0.400 . 1 . . . . 21 LYS CB . 7298 1 220 . 1 1 21 21 LYS CG C 13 25.023 0.400 . 1 . . . . 21 LYS CG . 7298 1 221 . 1 1 21 21 LYS CD C 13 29.263 0.400 . 1 . . . . 21 LYS CD . 7298 1 222 . 1 1 21 21 LYS CE C 13 41.700 0.400 . 1 . . . . 21 LYS CE . 7298 1 223 . 1 1 21 21 LYS N N 15 116.771 0.400 . 1 . . . . 21 LYS N . 7298 1 224 . 1 1 22 22 ALA H H 1 7.916 0.020 . 1 . . . . 22 ALA H . 7298 1 225 . 1 1 22 22 ALA HA H 1 4.306 0.020 . 1 . . . . 22 ALA HA . 7298 1 226 . 1 1 22 22 ALA HB1 H 1 1.551 0.020 . 1 . . . . 22 ALA HB . 7298 1 227 . 1 1 22 22 ALA HB2 H 1 1.551 0.020 . 1 . . . . 22 ALA HB . 7298 1 228 . 1 1 22 22 ALA HB3 H 1 1.551 0.020 . 1 . . . . 22 ALA HB . 7298 1 229 . 1 1 22 22 ALA CA C 13 53.610 0.400 . 1 . . . . 22 ALA CA . 7298 1 230 . 1 1 22 22 ALA CB C 13 19.617 0.400 . 1 . . . . 22 ALA CB . 7298 1 231 . 1 1 22 22 ALA N N 15 120.522 0.400 . 1 . . . . 22 ALA N . 7298 1 232 . 1 1 23 23 LEU H H 1 7.622 0.020 . 1 . . . . 23 LEU H . 7298 1 233 . 1 1 23 23 LEU HA H 1 4.362 0.020 . 1 . . . . 23 LEU HA . 7298 1 234 . 1 1 23 23 LEU HB2 H 1 1.850 0.020 . 2 . . . . 23 LEU HB2 . 7298 1 235 . 1 1 23 23 LEU HB3 H 1 2.047 0.020 . 2 . . . . 23 LEU HB3 . 7298 1 236 . 1 1 23 23 LEU HG H 1 2.192 0.020 . 1 . . . . 23 LEU HG . 7298 1 237 . 1 1 23 23 LEU HD11 H 1 0.933 0.020 . 2 . . . . 23 LEU HD1 . 7298 1 238 . 1 1 23 23 LEU HD12 H 1 0.933 0.020 . 2 . . . . 23 LEU HD1 . 7298 1 239 . 1 1 23 23 LEU HD13 H 1 0.933 0.020 . 2 . . . . 23 LEU HD1 . 7298 1 240 . 1 1 23 23 LEU HD21 H 1 1.157 0.020 . 2 . . . . 23 LEU HD2 . 7298 1 241 . 1 1 23 23 LEU HD22 H 1 1.157 0.020 . 2 . . . . 23 LEU HD2 . 7298 1 242 . 1 1 23 23 LEU HD23 H 1 1.157 0.020 . 2 . . . . 23 LEU HD2 . 7298 1 243 . 1 1 23 23 LEU CA C 13 54.647 0.400 . 1 . . . . 23 LEU CA . 7298 1 244 . 1 1 23 23 LEU CB C 13 40.685 0.400 . 1 . . . . 23 LEU CB . 7298 1 245 . 1 1 23 23 LEU CG C 13 26.470 0.400 . 1 . . . . 23 LEU CG . 7298 1 246 . 1 1 23 23 LEU CD1 C 13 22.538 0.400 . 1 . . . . 23 LEU CD1 . 7298 1 247 . 1 1 23 23 LEU CD2 C 13 26.470 0.400 . 1 . . . . 23 LEU CD2 . 7298 1 248 . 1 1 23 23 LEU N N 15 115.312 0.400 . 1 . . . . 23 LEU N . 7298 1 249 . 1 1 24 24 VAL H H 1 7.132 0.020 . 1 . . . . 24 VAL H . 7298 1 250 . 1 1 24 24 VAL HA H 1 3.975 0.020 . 1 . . . . 24 VAL HA . 7298 1 251 . 1 1 24 24 VAL HB H 1 2.054 0.020 . 1 . . . . 24 VAL HB . 7298 1 252 . 1 1 24 24 VAL HG11 H 1 1.002 0.020 . 2 . . . . 24 VAL HG1 . 7298 1 253 . 1 1 24 24 VAL HG12 H 1 1.002 0.020 . 2 . . . . 24 VAL HG1 . 7298 1 254 . 1 1 24 24 VAL HG13 H 1 1.002 0.020 . 2 . . . . 24 VAL HG1 . 7298 1 255 . 1 1 24 24 VAL HG21 H 1 1.107 0.020 . 2 . . . . 24 VAL HG2 . 7298 1 256 . 1 1 24 24 VAL HG22 H 1 1.107 0.020 . 2 . . . . 24 VAL HG2 . 7298 1 257 . 1 1 24 24 VAL HG23 H 1 1.107 0.020 . 2 . . . . 24 VAL HG2 . 7298 1 258 . 1 1 24 24 VAL CA C 13 63.530 0.400 . 1 . . . . 24 VAL CA . 7298 1 259 . 1 1 24 24 VAL CB C 13 32.232 0.400 . 1 . . . . 24 VAL CB . 7298 1 260 . 1 1 24 24 VAL CG1 C 13 21.045 0.400 . 1 . . . . 24 VAL CG1 . 7298 1 261 . 1 1 24 24 VAL CG2 C 13 21.294 0.400 . 1 . . . . 24 VAL CG2 . 7298 1 262 . 1 1 24 24 VAL N N 15 119.264 0.400 . 1 . . . . 24 VAL N . 7298 1 263 . 1 1 25 25 ASN H H 1 8.716 0.020 . 1 . . . . 25 ASN H . 7298 1 264 . 1 1 25 25 ASN HA H 1 4.657 0.020 . 1 . . . . 25 ASN HA . 7298 1 265 . 1 1 25 25 ASN HB2 H 1 2.770 0.020 . 2 . . . . 25 ASN HB2 . 7298 1 266 . 1 1 25 25 ASN HB3 H 1 3.001 0.020 . 2 . . . . 25 ASN HB3 . 7298 1 267 . 1 1 25 25 ASN HD21 H 1 6.888 0.020 . 2 . . . . 25 ASN HD21 . 7298 1 268 . 1 1 25 25 ASN HD22 H 1 7.629 0.020 . 2 . . . . 25 ASN HD22 . 7298 1 269 . 1 1 25 25 ASN CA C 13 53.377 0.400 . 1 . . . . 25 ASN CA . 7298 1 270 . 1 1 25 25 ASN CB C 13 37.893 0.400 . 1 . . . . 25 ASN CB . 7298 1 271 . 1 1 25 25 ASN N N 15 120.734 0.400 . 1 . . . . 25 ASN N . 7298 1 272 . 1 1 25 25 ASN ND2 N 15 112.819 0.400 . 1 . . . . 25 ASN ND2 . 7298 1 273 . 1 1 26 26 VAL H H 1 7.331 0.020 . 1 . . . . 26 VAL H . 7298 1 274 . 1 1 26 26 VAL HA H 1 4.100 0.020 . 1 . . . . 26 VAL HA . 7298 1 275 . 1 1 26 26 VAL HB H 1 1.642 0.020 . 1 . . . . 26 VAL HB . 7298 1 276 . 1 1 26 26 VAL HG11 H 1 0.366 0.020 . 2 . . . . 26 VAL HG1 . 7298 1 277 . 1 1 26 26 VAL HG12 H 1 0.366 0.020 . 2 . . . . 26 VAL HG1 . 7298 1 278 . 1 1 26 26 VAL HG13 H 1 0.366 0.020 . 2 . . . . 26 VAL HG1 . 7298 1 279 . 1 1 26 26 VAL HG21 H 1 0.335 0.020 . 2 . . . . 26 VAL HG2 . 7298 1 280 . 1 1 26 26 VAL HG22 H 1 0.335 0.020 . 2 . . . . 26 VAL HG2 . 7298 1 281 . 1 1 26 26 VAL HG23 H 1 0.335 0.020 . 2 . . . . 26 VAL HG2 . 7298 1 282 . 1 1 26 26 VAL CA C 13 60.738 0.400 . 1 . . . . 26 VAL CA . 7298 1 283 . 1 1 26 26 VAL CB C 13 33.832 0.400 . 1 . . . . 26 VAL CB . 7298 1 284 . 1 1 26 26 VAL CG1 C 13 19.878 0.400 . 1 . . . . 26 VAL CG1 . 7298 1 285 . 1 1 26 26 VAL CG2 C 13 20.379 0.400 . 1 . . . . 26 VAL CG2 . 7298 1 286 . 1 1 26 26 VAL N N 15 116.175 0.400 . 1 . . . . 26 VAL N . 7298 1 287 . 1 1 27 27 GLU H H 1 8.145 0.020 . 1 . . . . 27 GLU H . 7298 1 288 . 1 1 27 27 GLU HA H 1 4.395 0.020 . 1 . . . . 27 GLU HA . 7298 1 289 . 1 1 27 27 GLU HB2 H 1 1.786 0.020 . 2 . . . . 27 GLU HB2 . 7298 1 290 . 1 1 27 27 GLU HB3 H 1 1.868 0.020 . 2 . . . . 27 GLU HB3 . 7298 1 291 . 1 1 27 27 GLU HG2 H 1 2.118 0.020 . 2 . . . . 27 GLU HG2 . 7298 1 292 . 1 1 27 27 GLU HG3 H 1 2.244 0.020 . 2 . . . . 27 GLU HG3 . 7298 1 293 . 1 1 27 27 GLU CA C 13 55.102 0.400 . 1 . . . . 27 GLU CA . 7298 1 294 . 1 1 27 27 GLU CB C 13 29.497 0.400 . 1 . . . . 27 GLU CB . 7298 1 295 . 1 1 27 27 GLU CG C 13 36.209 0.400 . 1 . . . . 27 GLU CG . 7298 1 296 . 1 1 27 27 GLU N N 15 124.056 0.400 . 1 . . . . 27 GLU N . 7298 1 297 . 1 1 28 28 TRP H H 1 8.557 0.020 . 1 . . . . 28 TRP H . 7298 1 298 . 1 1 28 28 TRP HA H 1 4.317 0.020 . 1 . . . . 28 TRP HA . 7298 1 299 . 1 1 28 28 TRP HB2 H 1 3.210 0.020 . 2 . . . . 28 TRP HB2 . 7298 1 300 . 1 1 28 28 TRP HB3 H 1 3.293 0.020 . 2 . . . . 28 TRP HB3 . 7298 1 301 . 1 1 28 28 TRP HD1 H 1 7.354 0.020 . 1 . . . . 28 TRP HD1 . 7298 1 302 . 1 1 28 28 TRP HE1 H 1 10.196 0.020 . 1 . . . . 28 TRP HE1 . 7298 1 303 . 1 1 28 28 TRP HE3 H 1 7.496 0.020 . 1 . . . . 28 TRP HE3 . 7298 1 304 . 1 1 28 28 TRP HZ2 H 1 7.404 0.020 . 1 . . . . 28 TRP HZ2 . 7298 1 305 . 1 1 28 28 TRP HZ3 H 1 6.953 0.020 . 1 . . . . 28 TRP HZ3 . 7298 1 306 . 1 1 28 28 TRP HH2 H 1 7.132 0.020 . 1 . . . . 28 TRP HH2 . 7298 1 307 . 1 1 28 28 TRP CA C 13 58.186 0.400 . 1 . . . . 28 TRP CA . 7298 1 308 . 1 1 28 28 TRP CB C 13 30.786 0.400 . 1 . . . . 28 TRP CB . 7298 1 309 . 1 1 28 28 TRP CD1 C 13 127.248 0.400 . 1 . . . . 28 TRP CD1 . 7298 1 310 . 1 1 28 28 TRP CE3 C 13 120.257 0.400 . 1 . . . . 28 TRP CE3 . 7298 1 311 . 1 1 28 28 TRP CZ2 C 13 114.431 0.400 . 1 . . . . 28 TRP CZ2 . 7298 1 312 . 1 1 28 28 TRP CZ3 C 13 120.723 0.400 . 1 . . . . 28 TRP CZ3 . 7298 1 313 . 1 1 28 28 TRP CH2 C 13 124.452 0.400 . 1 . . . . 28 TRP CH2 . 7298 1 314 . 1 1 28 28 TRP N N 15 126.912 0.400 . 1 . . . . 28 TRP N . 7298 1 315 . 1 1 28 28 TRP NE1 N 15 129.058 0.400 . 1 . . . . 28 TRP NE1 . 7298 1 316 . 1 1 29 29 ASN H H 1 8.911 0.020 . 1 . . . . 29 ASN H . 7298 1 317 . 1 1 29 29 ASN HA H 1 3.934 0.020 . 1 . . . . 29 ASN HA . 7298 1 318 . 1 1 29 29 ASN HB2 H 1 2.266 0.020 . 2 . . . . 29 ASN HB2 . 7298 1 319 . 1 1 29 29 ASN HB3 H 1 3.281 0.020 . 2 . . . . 29 ASN HB3 . 7298 1 320 . 1 1 29 29 ASN HD21 H 1 6.445 0.020 . 2 . . . . 29 ASN HD21 . 7298 1 321 . 1 1 29 29 ASN HD22 H 1 7.252 0.020 . 2 . . . . 29 ASN HD22 . 7298 1 322 . 1 1 29 29 ASN CA C 13 53.362 0.400 . 1 . . . . 29 ASN CA . 7298 1 323 . 1 1 29 29 ASN CB C 13 36.370 0.400 . 1 . . . . 29 ASN CB . 7298 1 324 . 1 1 29 29 ASN N N 15 120.097 0.400 . 1 . . . . 29 ASN N . 7298 1 325 . 1 1 29 29 ASN ND2 N 15 107.823 0.400 . 1 . . . . 29 ASN ND2 . 7298 1 326 . 1 1 30 30 ILE H H 1 7.030 0.020 . 1 . . . . 30 ILE H . 7298 1 327 . 1 1 30 30 ILE HA H 1 4.113 0.020 . 1 . . . . 30 ILE HA . 7298 1 328 . 1 1 30 30 ILE HB H 1 1.494 0.020 . 1 . . . . 30 ILE HB . 7298 1 329 . 1 1 30 30 ILE HG12 H 1 1.042 0.020 . 2 . . . . 30 ILE HG12 . 7298 1 330 . 1 1 30 30 ILE HG13 H 1 1.270 0.020 . 2 . . . . 30 ILE HG13 . 7298 1 331 . 1 1 30 30 ILE HG21 H 1 0.659 0.020 . 1 . . . . 30 ILE HG2 . 7298 1 332 . 1 1 30 30 ILE HG22 H 1 0.659 0.020 . 1 . . . . 30 ILE HG2 . 7298 1 333 . 1 1 30 30 ILE HG23 H 1 0.659 0.020 . 1 . . . . 30 ILE HG2 . 7298 1 334 . 1 1 30 30 ILE HD11 H 1 0.748 0.020 . 1 . . . . 30 ILE HD1 . 7298 1 335 . 1 1 30 30 ILE HD12 H 1 0.748 0.020 . 1 . . . . 30 ILE HD1 . 7298 1 336 . 1 1 30 30 ILE HD13 H 1 0.748 0.020 . 1 . . . . 30 ILE HD1 . 7298 1 337 . 1 1 30 30 ILE CA C 13 58.453 0.400 . 1 . . . . 30 ILE CA . 7298 1 338 . 1 1 30 30 ILE CB C 13 41.181 0.400 . 1 . . . . 30 ILE CB . 7298 1 339 . 1 1 30 30 ILE CG1 C 13 26.266 0.400 . 1 . . . . 30 ILE CG1 . 7298 1 340 . 1 1 30 30 ILE CG2 C 13 17.079 0.400 . 1 . . . . 30 ILE CG2 . 7298 1 341 . 1 1 30 30 ILE CD1 C 13 11.850 0.400 . 1 . . . . 30 ILE CD1 . 7298 1 342 . 1 1 30 30 ILE N N 15 116.775 0.400 . 1 . . . . 30 ILE N . 7298 1 343 . 1 1 31 31 CYS H H 1 8.928 0.020 . 1 . . . . 31 CYS H . 7298 1 344 . 1 1 31 31 CYS HA H 1 3.828 0.020 . 1 . . . . 31 CYS HA . 7298 1 345 . 1 1 31 31 CYS HB2 H 1 2.798 0.020 . 2 . . . . 31 CYS HB2 . 7298 1 346 . 1 1 31 31 CYS HB3 H 1 3.060 0.020 . 2 . . . . 31 CYS HB3 . 7298 1 347 . 1 1 31 31 CYS CA C 13 59.079 0.400 . 1 . . . . 31 CYS CA . 7298 1 348 . 1 1 31 31 CYS CB C 13 29.009 0.400 . 1 . . . . 31 CYS CB . 7298 1 349 . 1 1 31 31 CYS N N 15 126.967 0.400 . 1 . . . . 31 CYS N . 7298 1 350 . 1 1 32 32 GLN H H 1 8.124 0.020 . 1 . . . . 32 GLN H . 7298 1 351 . 1 1 32 32 GLN HA H 1 4.062 0.020 . 1 . . . . 32 GLN HA . 7298 1 352 . 1 1 32 32 GLN HB2 H 1 2.043 0.020 . 2 . . . . 32 GLN HB2 . 7298 1 353 . 1 1 32 32 GLN HB3 H 1 2.135 0.020 . 2 . . . . 32 GLN HB3 . 7298 1 354 . 1 1 32 32 GLN HG2 H 1 2.210 0.020 . 2 . . . . 32 GLN HG2 . 7298 1 355 . 1 1 32 32 GLN HG3 H 1 2.297 0.020 . 2 . . . . 32 GLN HG3 . 7298 1 356 . 1 1 32 32 GLN HE21 H 1 7.153 0.020 . 2 . . . . 32 GLN HE21 . 7298 1 357 . 1 1 32 32 GLN HE22 H 1 7.821 0.020 . 2 . . . . 32 GLN HE22 . 7298 1 358 . 1 1 32 32 GLN CA C 13 57.945 0.400 . 1 . . . . 32 GLN CA . 7298 1 359 . 1 1 32 32 GLN CB C 13 29.770 0.400 . 1 . . . . 32 GLN CB . 7298 1 360 . 1 1 32 32 GLN CG C 13 33.832 0.400 . 1 . . . . 32 GLN CG . 7298 1 361 . 1 1 32 32 GLN N N 15 129.446 0.400 . 1 . . . . 32 GLN N . 7298 1 362 . 1 1 32 32 GLN NE2 N 15 113.860 0.400 . 1 . . . . 32 GLN NE2 . 7298 1 363 . 1 1 33 33 ASP H H 1 8.086 0.020 . 1 . . . . 33 ASP H . 7298 1 364 . 1 1 33 33 ASP HA H 1 4.529 0.020 . 1 . . . . 33 ASP HA . 7298 1 365 . 1 1 33 33 ASP HB2 H 1 1.075 0.020 . 2 . . . . 33 ASP HB2 . 7298 1 366 . 1 1 33 33 ASP HB3 H 1 1.663 0.020 . 2 . . . . 33 ASP HB3 . 7298 1 367 . 1 1 33 33 ASP CA C 13 55.915 0.400 . 1 . . . . 33 ASP CA . 7298 1 368 . 1 1 33 33 ASP CB C 13 39.924 0.400 . 1 . . . . 33 ASP CB . 7298 1 369 . 1 1 33 33 ASP N N 15 121.493 0.400 . 1 . . . . 33 ASP N . 7298 1 370 . 1 1 34 34 CYS H H 1 8.316 0.020 . 1 . . . . 34 CYS H . 7298 1 371 . 1 1 34 34 CYS HA H 1 4.268 0.020 . 1 . . . . 34 CYS HA . 7298 1 372 . 1 1 34 34 CYS HB2 H 1 2.834 0.020 . 2 . . . . 34 CYS HB2 . 7298 1 373 . 1 1 34 34 CYS HB3 H 1 3.062 0.020 . 2 . . . . 34 CYS HB3 . 7298 1 374 . 1 1 34 34 CYS CA C 13 64.797 0.400 . 1 . . . . 34 CYS CA . 7298 1 375 . 1 1 34 34 CYS CB C 13 30.243 0.400 . 1 . . . . 34 CYS CB . 7298 1 376 . 1 1 34 34 CYS N N 15 124.892 0.400 . 1 . . . . 34 CYS N . 7298 1 377 . 1 1 35 35 LYS H H 1 7.788 0.020 . 1 . . . . 35 LYS H . 7298 1 378 . 1 1 35 35 LYS HA H 1 4.182 0.020 . 1 . . . . 35 LYS HA . 7298 1 379 . 1 1 35 35 LYS HB2 H 1 1.805 0.020 . 2 . . . . 35 LYS HB2 . 7298 1 380 . 1 1 35 35 LYS HB3 H 1 1.875 0.020 . 2 . . . . 35 LYS HB3 . 7298 1 381 . 1 1 35 35 LYS HG2 H 1 1.404 0.020 . 2 . . . . 35 LYS HG2 . 7298 1 382 . 1 1 35 35 LYS HG3 H 1 1.473 0.020 . 2 . . . . 35 LYS HG3 . 7298 1 383 . 1 1 35 35 LYS HD2 H 1 1.668 0.020 . 1 . . . . 35 LYS HD2 . 7298 1 384 . 1 1 35 35 LYS HD3 H 1 1.668 0.020 . 1 . . . . 35 LYS HD3 . 7298 1 385 . 1 1 35 35 LYS HE2 H 1 2.977 0.020 . 1 . . . . 35 LYS HE2 . 7298 1 386 . 1 1 35 35 LYS HE3 H 1 2.977 0.020 . 1 . . . . 35 LYS HE3 . 7298 1 387 . 1 1 35 35 LYS CA C 13 57.692 0.400 . 1 . . . . 35 LYS CA . 7298 1 388 . 1 1 35 35 LYS CB C 13 32.309 0.400 . 1 . . . . 35 LYS CB . 7298 1 389 . 1 1 35 35 LYS CG C 13 24.526 0.400 . 1 . . . . 35 LYS CG . 7298 1 390 . 1 1 35 35 LYS CD C 13 29.009 0.400 . 1 . . . . 35 LYS CD . 7298 1 391 . 1 1 35 35 LYS CE C 13 41.700 0.400 . 1 . . . . 35 LYS CE . 7298 1 392 . 1 1 35 35 LYS N N 15 119.469 0.400 . 1 . . . . 35 LYS N . 7298 1 393 . 1 1 36 36 THR H H 1 7.836 0.020 . 1 . . . . 36 THR H . 7298 1 394 . 1 1 36 36 THR HA H 1 4.241 0.020 . 1 . . . . 36 THR HA . 7298 1 395 . 1 1 36 36 THR HB H 1 4.321 0.020 . 1 . . . . 36 THR HB . 7298 1 396 . 1 1 36 36 THR HG21 H 1 1.259 0.020 . 1 . . . . 36 THR HG2 . 7298 1 397 . 1 1 36 36 THR HG22 H 1 1.259 0.020 . 1 . . . . 36 THR HG2 . 7298 1 398 . 1 1 36 36 THR HG23 H 1 1.259 0.020 . 1 . . . . 36 THR HG2 . 7298 1 399 . 1 1 36 36 THR CA C 13 62.808 0.400 . 1 . . . . 36 THR CA . 7298 1 400 . 1 1 36 36 THR CB C 13 69.368 0.400 . 1 . . . . 36 THR CB . 7298 1 401 . 1 1 36 36 THR CG2 C 13 21.543 0.400 . 1 . . . . 36 THR CG2 . 7298 1 402 . 1 1 36 36 THR N N 15 113.425 0.400 . 1 . . . . 36 THR N . 7298 1 403 . 1 1 37 37 ASP H H 1 8.043 0.020 . 1 . . . . 37 ASP H . 7298 1 404 . 1 1 37 37 ASP HA H 1 4.626 0.020 . 1 . . . . 37 ASP HA . 7298 1 405 . 1 1 37 37 ASP HB2 H 1 2.725 0.020 . 2 . . . . 37 ASP HB2 . 7298 1 406 . 1 1 37 37 ASP HB3 H 1 2.771 0.020 . 2 . . . . 37 ASP HB3 . 7298 1 407 . 1 1 37 37 ASP CA C 13 54.648 0.400 . 1 . . . . 37 ASP CA . 7298 1 408 . 1 1 37 37 ASP CB C 13 40.939 0.400 . 1 . . . . 37 ASP CB . 7298 1 409 . 1 1 37 37 ASP N N 15 121.982 0.400 . 1 . . . . 37 ASP N . 7298 1 410 . 1 1 38 38 ASN H H 1 8.269 0.020 . 1 . . . . 38 ASN H . 7298 1 411 . 1 1 38 38 ASN HA H 1 4.659 0.020 . 1 . . . . 38 ASN HA . 7298 1 412 . 1 1 38 38 ASN HB2 H 1 2.814 0.020 . 2 . . . . 38 ASN HB2 . 7298 1 413 . 1 1 38 38 ASN HB3 H 1 2.924 0.020 . 2 . . . . 38 ASN HB3 . 7298 1 414 . 1 1 38 38 ASN HD21 H 1 6.920 0.020 . 2 . . . . 38 ASN HD21 . 7298 1 415 . 1 1 38 38 ASN HD22 H 1 7.611 0.020 . 2 . . . . 38 ASN HD22 . 7298 1 416 . 1 1 38 38 ASN CA C 13 53.626 0.400 . 1 . . . . 38 ASN CA . 7298 1 417 . 1 1 38 38 ASN CB C 13 38.147 0.400 . 1 . . . . 38 ASN CB . 7298 1 418 . 1 1 38 38 ASN N N 15 118.856 0.400 . 1 . . . . 38 ASN N . 7298 1 419 . 1 1 38 38 ASN ND2 N 15 112.403 0.400 . 1 . . . . 38 ASN ND2 . 7298 1 420 . 1 1 39 39 LYS H H 1 8.263 0.020 . 1 . . . . 39 LYS H . 7298 1 421 . 1 1 39 39 LYS HA H 1 4.332 0.020 . 1 . . . . 39 LYS HA . 7298 1 422 . 1 1 39 39 LYS HB2 H 1 1.772 0.020 . 2 . . . . 39 LYS HB2 . 7298 1 423 . 1 1 39 39 LYS HB3 H 1 1.864 0.020 . 2 . . . . 39 LYS HB3 . 7298 1 424 . 1 1 39 39 LYS HG2 H 1 1.448 0.020 . 1 . . . . 39 LYS HG2 . 7298 1 425 . 1 1 39 39 LYS HG3 H 1 1.448 0.020 . 1 . . . . 39 LYS HG3 . 7298 1 426 . 1 1 39 39 LYS HD2 H 1 1.702 0.020 . 1 . . . . 39 LYS HD2 . 7298 1 427 . 1 1 39 39 LYS HD3 H 1 1.702 0.020 . 1 . . . . 39 LYS HD3 . 7298 1 428 . 1 1 39 39 LYS HE2 H 1 3.027 0.020 . 1 . . . . 39 LYS HE2 . 7298 1 429 . 1 1 39 39 LYS HE3 H 1 3.027 0.020 . 1 . . . . 39 LYS HE3 . 7298 1 430 . 1 1 39 39 LYS CA C 13 56.520 0.400 . 1 . . . . 39 LYS CA . 7298 1 431 . 1 1 39 39 LYS CB C 13 32.816 0.400 . 1 . . . . 39 LYS CB . 7298 1 432 . 1 1 39 39 LYS CG C 13 24.440 0.400 . 1 . . . . 39 LYS CG . 7298 1 433 . 1 1 39 39 LYS CD C 13 28.755 0.400 . 1 . . . . 39 LYS CD . 7298 1 434 . 1 1 39 39 LYS CE C 13 41.954 0.400 . 1 . . . . 39 LYS CE . 7298 1 435 . 1 1 39 39 LYS N N 15 120.534 0.400 . 1 . . . . 39 LYS N . 7298 1 436 . 1 1 40 40 VAL H H 1 8.089 0.020 . 1 . . . . 40 VAL H . 7298 1 437 . 1 1 40 40 VAL HA H 1 4.082 0.020 . 1 . . . . 40 VAL HA . 7298 1 438 . 1 1 40 40 VAL HB H 1 2.108 0.020 . 1 . . . . 40 VAL HB . 7298 1 439 . 1 1 40 40 VAL HG11 H 1 0.962 0.020 . 2 . . . . 40 VAL HG1 . 7298 1 440 . 1 1 40 40 VAL HG12 H 1 0.962 0.020 . 2 . . . . 40 VAL HG1 . 7298 1 441 . 1 1 40 40 VAL HG13 H 1 0.962 0.020 . 2 . . . . 40 VAL HG1 . 7298 1 442 . 1 1 40 40 VAL HG21 H 1 0.962 0.020 . 2 . . . . 40 VAL HG2 . 7298 1 443 . 1 1 40 40 VAL HG22 H 1 0.962 0.020 . 2 . . . . 40 VAL HG2 . 7298 1 444 . 1 1 40 40 VAL HG23 H 1 0.962 0.020 . 2 . . . . 40 VAL HG2 . 7298 1 445 . 1 1 40 40 VAL CA C 13 62.514 0.400 . 1 . . . . 40 VAL CA . 7298 1 446 . 1 1 40 40 VAL CB C 13 32.480 0.400 . 1 . . . . 40 VAL CB . 7298 1 447 . 1 1 40 40 VAL CG1 C 13 21.045 0.400 . 1 . . . . 40 VAL CG1 . 7298 1 448 . 1 1 40 40 VAL N N 15 120.938 0.400 . 1 . . . . 40 VAL N . 7298 1 449 . 1 1 41 41 LYS H H 1 8.352 0.020 . 1 . . . . 41 LYS H . 7298 1 450 . 1 1 41 41 LYS HA H 1 4.355 0.020 . 1 . . . . 41 LYS HA . 7298 1 451 . 1 1 41 41 LYS HB2 H 1 1.774 0.020 . 2 . . . . 41 LYS HB2 . 7298 1 452 . 1 1 41 41 LYS HB3 H 1 1.857 0.020 . 2 . . . . 41 LYS HB3 . 7298 1 453 . 1 1 41 41 LYS HG2 H 1 1.456 0.020 . 1 . . . . 41 LYS HG2 . 7298 1 454 . 1 1 41 41 LYS HG3 H 1 1.456 0.020 . 1 . . . . 41 LYS HG3 . 7298 1 455 . 1 1 41 41 LYS HD2 H 1 1.708 0.020 . 1 . . . . 41 LYS HD2 . 7298 1 456 . 1 1 41 41 LYS HD3 H 1 1.708 0.020 . 1 . . . . 41 LYS HD3 . 7298 1 457 . 1 1 41 41 LYS HE2 H 1 3.027 0.020 . 1 . . . . 41 LYS HE2 . 7298 1 458 . 1 1 41 41 LYS HE3 H 1 3.027 0.020 . 1 . . . . 41 LYS HE3 . 7298 1 459 . 1 1 41 41 LYS CA C 13 56.160 0.400 . 1 . . . . 41 LYS CA . 7298 1 460 . 1 1 41 41 LYS CB C 13 33.070 0.400 . 1 . . . . 41 LYS CB . 7298 1 461 . 1 1 41 41 LYS CG C 13 24.948 0.400 . 1 . . . . 41 LYS CG . 7298 1 462 . 1 1 41 41 LYS CD C 13 29.009 0.400 . 1 . . . . 41 LYS CD . 7298 1 463 . 1 1 41 41 LYS CE C 13 41.954 0.400 . 1 . . . . 41 LYS CE . 7298 1 464 . 1 1 41 41 LYS N N 15 125.307 0.400 . 1 . . . . 41 LYS N . 7298 1 465 . 1 1 42 42 ASP H H 1 8.421 0.020 . 1 . . . . 42 ASP H . 7298 1 466 . 1 1 42 42 ASP HA H 1 4.565 0.020 . 1 . . . . 42 ASP HA . 7298 1 467 . 1 1 42 42 ASP HB2 H 1 2.649 0.020 . 2 . . . . 42 ASP HB2 . 7298 1 468 . 1 1 42 42 ASP HB3 H 1 2.717 0.020 . 2 . . . . 42 ASP HB3 . 7298 1 469 . 1 1 42 42 ASP CA C 13 54.392 0.400 . 1 . . . . 42 ASP CA . 7298 1 470 . 1 1 42 42 ASP CB C 13 41.193 0.400 . 1 . . . . 42 ASP CB . 7298 1 471 . 1 1 42 42 ASP N N 15 121.807 0.400 . 1 . . . . 42 ASP N . 7298 1 472 . 1 1 43 43 LYS H H 1 8.205 0.020 . 1 . . . . 43 LYS H . 7298 1 473 . 1 1 43 43 LYS HA H 1 4.321 0.020 . 1 . . . . 43 LYS HA . 7298 1 474 . 1 1 43 43 LYS HB2 H 1 1.777 0.020 . 2 . . . . 43 LYS HB2 . 7298 1 475 . 1 1 43 43 LYS HB3 H 1 1.866 0.020 . 2 . . . . 43 LYS HB3 . 7298 1 476 . 1 1 43 43 LYS HG2 H 1 1.446 0.020 . 2 . . . . 43 LYS HG2 . 7298 1 477 . 1 1 43 43 LYS HG3 H 1 1.495 0.020 . 2 . . . . 43 LYS HG3 . 7298 1 478 . 1 1 43 43 LYS HD2 H 1 1.707 0.020 . 1 . . . . 43 LYS HD2 . 7298 1 479 . 1 1 43 43 LYS HD3 H 1 1.707 0.020 . 1 . . . . 43 LYS HD3 . 7298 1 480 . 1 1 43 43 LYS HE2 H 1 3.028 0.020 . 1 . . . . 43 LYS HE2 . 7298 1 481 . 1 1 43 43 LYS HE3 H 1 3.028 0.020 . 1 . . . . 43 LYS HE3 . 7298 1 482 . 1 1 43 43 LYS CA C 13 56.345 0.400 . 1 . . . . 43 LYS CA . 7298 1 483 . 1 1 43 43 LYS CB C 13 33.070 0.400 . 1 . . . . 43 LYS CB . 7298 1 484 . 1 1 43 43 LYS CG C 13 24.693 0.400 . 1 . . . . 43 LYS CG . 7298 1 485 . 1 1 43 43 LYS CD C 13 29.008 0.400 . 1 . . . . 43 LYS CD . 7298 1 486 . 1 1 43 43 LYS CE C 13 41.954 0.400 . 1 . . . . 43 LYS CE . 7298 1 487 . 1 1 43 43 LYS N N 15 121.489 0.400 . 1 . . . . 43 LYS N . 7298 1 488 . 1 1 44 44 ALA H H 1 8.450 0.020 . 1 . . . . 44 ALA H . 7298 1 489 . 1 1 44 44 ALA HA H 1 4.315 0.020 . 1 . . . . 44 ALA HA . 7298 1 490 . 1 1 44 44 ALA HB1 H 1 1.430 0.020 . 1 . . . . 44 ALA HB . 7298 1 491 . 1 1 44 44 ALA HB2 H 1 1.430 0.020 . 1 . . . . 44 ALA HB . 7298 1 492 . 1 1 44 44 ALA HB3 H 1 1.430 0.020 . 1 . . . . 44 ALA HB . 7298 1 493 . 1 1 44 44 ALA CA C 13 52.615 0.400 . 1 . . . . 44 ALA CA . 7298 1 494 . 1 1 44 44 ALA CB C 13 19.057 0.400 . 1 . . . . 44 ALA CB . 7298 1 495 . 1 1 44 44 ALA N N 15 124.883 0.400 . 1 . . . . 44 ALA N . 7298 1 496 . 1 1 45 45 GLU H H 1 8.361 0.020 . 1 . . . . 45 GLU H . 7298 1 497 . 1 1 45 45 GLU HA H 1 4.266 0.020 . 1 . . . . 45 GLU HA . 7298 1 498 . 1 1 45 45 GLU HB2 H 1 1.994 0.020 . 2 . . . . 45 GLU HB2 . 7298 1 499 . 1 1 45 45 GLU HB3 H 1 2.097 0.020 . 2 . . . . 45 GLU HB3 . 7298 1 500 . 1 1 45 45 GLU HG2 H 1 2.297 0.020 . 1 . . . . 45 GLU HG2 . 7298 1 501 . 1 1 45 45 GLU HG3 H 1 2.297 0.020 . 1 . . . . 45 GLU HG3 . 7298 1 502 . 1 1 45 45 GLU CA C 13 56.930 0.400 . 1 . . . . 45 GLU CA . 7298 1 503 . 1 1 45 45 GLU CB C 13 30.278 0.400 . 1 . . . . 45 GLU CB . 7298 1 504 . 1 1 45 45 GLU CG C 13 36.370 0.400 . 1 . . . . 45 GLU CG . 7298 1 505 . 1 1 45 45 GLU N N 15 119.468 0.400 . 1 . . . . 45 GLU N . 7298 1 506 . 1 1 46 46 GLU H H 1 8.337 0.020 . 1 . . . . 46 GLU H . 7298 1 507 . 1 1 46 46 GLU HA H 1 4.271 0.020 . 1 . . . . 46 GLU HA . 7298 1 508 . 1 1 46 46 GLU HB2 H 1 1.990 0.020 . 2 . . . . 46 GLU HB2 . 7298 1 509 . 1 1 46 46 GLU HB3 H 1 2.102 0.020 . 2 . . . . 46 GLU HB3 . 7298 1 510 . 1 1 46 46 GLU HG2 H 1 2.279 0.020 . 1 . . . . 46 GLU HG2 . 7298 1 511 . 1 1 46 46 GLU HG3 H 1 2.279 0.020 . 1 . . . . 46 GLU HG3 . 7298 1 512 . 1 1 46 46 GLU CA C 13 56.677 0.400 . 1 . . . . 46 GLU CA . 7298 1 513 . 1 1 46 46 GLU CB C 13 30.278 0.400 . 1 . . . . 46 GLU CB . 7298 1 514 . 1 1 46 46 GLU CG C 13 36.624 0.400 . 1 . . . . 46 GLU CG . 7298 1 515 . 1 1 46 46 GLU N N 15 120.428 0.400 . 1 . . . . 46 GLU N . 7298 1 516 . 1 1 47 47 GLU H H 1 8.406 0.020 . 1 . . . . 47 GLU H . 7298 1 517 . 1 1 47 47 GLU HA H 1 4.368 0.020 . 1 . . . . 47 GLU HA . 7298 1 518 . 1 1 47 47 GLU HB2 H 1 1.998 0.020 . 2 . . . . 47 GLU HB2 . 7298 1 519 . 1 1 47 47 GLU HB3 H 1 2.104 0.020 . 2 . . . . 47 GLU HB3 . 7298 1 520 . 1 1 47 47 GLU HG2 H 1 2.286 0.020 . 2 . . . . 47 GLU HG2 . 7298 1 521 . 1 1 47 47 GLU HG3 H 1 2.317 0.020 . 2 . . . . 47 GLU HG3 . 7298 1 522 . 1 1 47 47 GLU CA C 13 56.677 0.400 . 1 . . . . 47 GLU CA . 7298 1 523 . 1 1 47 47 GLU CB C 13 30.024 0.400 . 1 . . . . 47 GLU CB . 7298 1 524 . 1 1 47 47 GLU CG C 13 36.624 0.400 . 1 . . . . 47 GLU CG . 7298 1 525 . 1 1 47 47 GLU N N 15 121.354 0.400 . 1 . . . . 47 GLU N . 7298 1 526 . 1 1 48 48 THR H H 1 8.143 0.020 . 1 . . . . 48 THR H . 7298 1 527 . 1 1 48 48 THR HA H 1 4.393 0.020 . 1 . . . . 48 THR HA . 7298 1 528 . 1 1 48 48 THR HB H 1 4.282 0.020 . 1 . . . . 48 THR HB . 7298 1 529 . 1 1 48 48 THR HG21 H 1 1.228 0.020 . 1 . . . . 48 THR HG2 . 7298 1 530 . 1 1 48 48 THR HG22 H 1 1.228 0.020 . 1 . . . . 48 THR HG2 . 7298 1 531 . 1 1 48 48 THR HG23 H 1 1.228 0.020 . 1 . . . . 48 THR HG2 . 7298 1 532 . 1 1 48 48 THR CA C 13 61.499 0.400 . 1 . . . . 48 THR CA . 7298 1 533 . 1 1 48 48 THR CB C 13 69.520 0.400 . 1 . . . . 48 THR CB . 7298 1 534 . 1 1 48 48 THR CG2 C 13 21.294 0.400 . 1 . . . . 48 THR CG2 . 7298 1 535 . 1 1 48 48 THR N N 15 114.283 0.400 . 1 . . . . 48 THR N . 7298 1 536 . 1 1 49 49 GLU H H 1 8.372 0.020 . 1 . . . . 49 GLU H . 7298 1 537 . 1 1 49 49 GLU HA H 1 4.314 0.020 . 1 . . . . 49 GLU HA . 7298 1 538 . 1 1 49 49 GLU HB2 H 1 1.982 0.020 . 2 . . . . 49 GLU HB2 . 7298 1 539 . 1 1 49 49 GLU HB3 H 1 2.093 0.020 . 2 . . . . 49 GLU HB3 . 7298 1 540 . 1 1 49 49 GLU HG2 H 1 2.284 0.020 . 1 . . . . 49 GLU HG2 . 7298 1 541 . 1 1 49 49 GLU HG3 H 1 2.284 0.020 . 1 . . . . 49 GLU HG3 . 7298 1 542 . 1 1 49 49 GLU CA C 13 56.096 0.400 . 1 . . . . 49 GLU CA . 7298 1 543 . 1 1 49 49 GLU CB C 13 30.532 0.400 . 1 . . . . 49 GLU CB . 7298 1 544 . 1 1 49 49 GLU CG C 13 36.116 0.400 . 1 . . . . 49 GLU CG . 7298 1 545 . 1 1 49 49 GLU N N 15 123.020 0.400 . 1 . . . . 49 GLU N . 7298 1 546 . 1 1 50 50 GLU H H 1 8.397 0.020 . 1 . . . . 50 GLU H . 7298 1 547 . 1 1 50 50 GLU HA H 1 4.285 0.020 . 1 . . . . 50 GLU HA . 7298 1 548 . 1 1 50 50 GLU HB2 H 1 1.991 0.020 . 1 . . . . 50 GLU HB2 . 7298 1 549 . 1 1 50 50 GLU HB3 H 1 1.991 0.020 . 1 . . . . 50 GLU HB3 . 7298 1 550 . 1 1 50 50 GLU HG2 H 1 2.224 0.020 . 1 . . . . 50 GLU HG2 . 7298 1 551 . 1 1 50 50 GLU HG3 H 1 2.224 0.020 . 1 . . . . 50 GLU HG3 . 7298 1 552 . 1 1 50 50 GLU CA C 13 55.850 0.400 . 1 . . . . 50 GLU CA . 7298 1 553 . 1 1 50 50 GLU CB C 13 30.278 0.400 . 1 . . . . 50 GLU CB . 7298 1 554 . 1 1 50 50 GLU CG C 13 35.961 0.400 . 1 . . . . 50 GLU CG . 7298 1 555 . 1 1 50 50 GLU N N 15 122.337 0.400 . 1 . . . . 50 GLU N . 7298 1 556 . 1 1 51 51 LYS H H 1 8.524 0.020 . 1 . . . . 51 LYS H . 7298 1 557 . 1 1 51 51 LYS HA H 1 4.626 0.020 . 1 . . . . 51 LYS HA . 7298 1 558 . 1 1 51 51 LYS HB2 H 1 1.762 0.020 . 2 . . . . 51 LYS HB2 . 7298 1 559 . 1 1 51 51 LYS HB3 H 1 1.846 0.020 . 2 . . . . 51 LYS HB3 . 7298 1 560 . 1 1 51 51 LYS HG2 H 1 1.496 0.020 . 1 . . . . 51 LYS HG2 . 7298 1 561 . 1 1 51 51 LYS HG3 H 1 1.496 0.020 . 1 . . . . 51 LYS HG3 . 7298 1 562 . 1 1 51 51 LYS HD2 H 1 1.714 0.020 . 1 . . . . 51 LYS HD2 . 7298 1 563 . 1 1 51 51 LYS HD3 H 1 1.714 0.020 . 1 . . . . 51 LYS HD3 . 7298 1 564 . 1 1 51 51 LYS HE2 H 1 3.029 0.020 . 1 . . . . 51 LYS HE2 . 7298 1 565 . 1 1 51 51 LYS HE3 H 1 3.029 0.020 . 1 . . . . 51 LYS HE3 . 7298 1 566 . 1 1 51 51 LYS CA C 13 53.885 0.400 . 1 . . . . 51 LYS CA . 7298 1 567 . 1 1 51 51 LYS CB C 13 32.232 0.400 . 1 . . . . 51 LYS CB . 7298 1 568 . 1 1 51 51 LYS CG C 13 24.277 0.400 . 1 . . . . 51 LYS CG . 7298 1 569 . 1 1 51 51 LYS CD C 13 29.009 0.400 . 1 . . . . 51 LYS CD . 7298 1 570 . 1 1 51 51 LYS CE C 13 41.954 0.400 . 1 . . . . 51 LYS CE . 7298 1 571 . 1 1 51 51 LYS N N 15 125.307 0.400 . 1 . . . . 51 LYS N . 7298 1 572 . 1 1 52 52 PRO HA H 1 4.546 0.020 . 1 . . . . 52 PRO HA . 7298 1 573 . 1 1 52 52 PRO HB2 H 1 1.863 0.020 . 2 . . . . 52 PRO HB2 . 7298 1 574 . 1 1 52 52 PRO HB3 H 1 2.274 0.020 . 2 . . . . 52 PRO HB3 . 7298 1 575 . 1 1 52 52 PRO HG2 H 1 2.084 0.020 . 1 . . . . 52 PRO HG2 . 7298 1 576 . 1 1 52 52 PRO HG3 H 1 2.084 0.020 . 1 . . . . 52 PRO HG3 . 7298 1 577 . 1 1 52 52 PRO HD2 H 1 3.703 0.020 . 2 . . . . 52 PRO HD2 . 7298 1 578 . 1 1 52 52 PRO HD3 H 1 3.905 0.020 . 2 . . . . 52 PRO HD3 . 7298 1 579 . 1 1 52 52 PRO CA C 13 62.515 0.400 . 1 . . . . 52 PRO CA . 7298 1 580 . 1 1 52 52 PRO CB C 13 32.562 0.400 . 1 . . . . 52 PRO CB . 7298 1 581 . 1 1 52 52 PRO CG C 13 27.232 0.400 . 1 . . . . 52 PRO CG . 7298 1 582 . 1 1 52 52 PRO CD C 13 50.585 0.400 . 1 . . . . 52 PRO CD . 7298 1 583 . 1 1 53 53 SER H H 1 8.698 0.020 . 1 . . . . 53 SER H . 7298 1 584 . 1 1 53 53 SER HA H 1 4.447 0.020 . 1 . . . . 53 SER HA . 7298 1 585 . 1 1 53 53 SER HB2 H 1 3.799 0.020 . 2 . . . . 53 SER HB2 . 7298 1 586 . 1 1 53 53 SER HB3 H 1 3.883 0.020 . 2 . . . . 53 SER HB3 . 7298 1 587 . 1 1 53 53 SER CA C 13 57.934 0.400 . 1 . . . . 53 SER CA . 7298 1 588 . 1 1 53 53 SER CB C 13 64.038 0.400 . 1 . . . . 53 SER CB . 7298 1 589 . 1 1 53 53 SER N N 15 118.407 0.400 . 1 . . . . 53 SER N . 7298 1 590 . 1 1 54 54 VAL H H 1 8.778 0.020 . 1 . . . . 54 VAL H . 7298 1 591 . 1 1 54 54 VAL HA H 1 4.314 0.020 . 1 . . . . 54 VAL HA . 7298 1 592 . 1 1 54 54 VAL HB H 1 1.968 0.020 . 1 . . . . 54 VAL HB . 7298 1 593 . 1 1 54 54 VAL HG11 H 1 0.594 0.020 . 2 . . . . 54 VAL HG1 . 7298 1 594 . 1 1 54 54 VAL HG12 H 1 0.594 0.020 . 2 . . . . 54 VAL HG1 . 7298 1 595 . 1 1 54 54 VAL HG13 H 1 0.594 0.020 . 2 . . . . 54 VAL HG1 . 7298 1 596 . 1 1 54 54 VAL HG21 H 1 0.696 0.020 . 2 . . . . 54 VAL HG2 . 7298 1 597 . 1 1 54 54 VAL HG22 H 1 0.696 0.020 . 2 . . . . 54 VAL HG2 . 7298 1 598 . 1 1 54 54 VAL HG23 H 1 0.696 0.020 . 2 . . . . 54 VAL HG2 . 7298 1 599 . 1 1 54 54 VAL CA C 13 62.538 0.400 . 1 . . . . 54 VAL CA . 7298 1 600 . 1 1 54 54 VAL CB C 13 32.480 0.400 . 1 . . . . 54 VAL CB . 7298 1 601 . 1 1 54 54 VAL CG1 C 13 22.537 0.400 . 1 . . . . 54 VAL CG1 . 7298 1 602 . 1 1 54 54 VAL CG2 C 13 23.034 0.400 . 1 . . . . 54 VAL CG2 . 7298 1 603 . 1 1 54 54 VAL N N 15 124.894 0.400 . 1 . . . . 54 VAL N . 7298 1 604 . 1 1 55 55 TRP H H 1 9.227 0.020 . 1 . . . . 55 TRP H . 7298 1 605 . 1 1 55 55 TRP HA H 1 5.105 0.020 . 1 . . . . 55 TRP HA . 7298 1 606 . 1 1 55 55 TRP HB2 H 1 2.918 0.020 . 2 . . . . 55 TRP HB2 . 7298 1 607 . 1 1 55 55 TRP HB3 H 1 3.028 0.020 . 2 . . . . 55 TRP HB3 . 7298 1 608 . 1 1 55 55 TRP HD1 H 1 7.002 0.020 . 1 . . . . 55 TRP HD1 . 7298 1 609 . 1 1 55 55 TRP HE1 H 1 10.185 0.020 . 1 . . . . 55 TRP HE1 . 7298 1 610 . 1 1 55 55 TRP HE3 H 1 7.209 0.020 . 1 . . . . 55 TRP HE3 . 7298 1 611 . 1 1 55 55 TRP HZ2 H 1 7.294 0.020 . 1 . . . . 55 TRP HZ2 . 7298 1 612 . 1 1 55 55 TRP HZ3 H 1 6.987 0.020 . 1 . . . . 55 TRP HZ3 . 7298 1 613 . 1 1 55 55 TRP HH2 H 1 6.994 0.020 . 1 . . . . 55 TRP HH2 . 7298 1 614 . 1 1 55 55 TRP CA C 13 55.350 0.400 . 1 . . . . 55 TRP CA . 7298 1 615 . 1 1 55 55 TRP CB C 13 30.532 0.400 . 1 . . . . 55 TRP CB . 7298 1 616 . 1 1 55 55 TRP CD1 C 13 125.384 0.400 . 1 . . . . 55 TRP CD1 . 7298 1 617 . 1 1 55 55 TRP CE3 C 13 121.189 0.400 . 1 . . . . 55 TRP CE3 . 7298 1 618 . 1 1 55 55 TRP CZ2 C 13 114.198 0.400 . 1 . . . . 55 TRP CZ2 . 7298 1 619 . 1 1 55 55 TRP CZ3 C 13 123.054 0.400 . 1 . . . . 55 TRP CZ3 . 7298 1 620 . 1 1 55 55 TRP CH2 C 13 124.685 0.400 . 1 . . . . 55 TRP CH2 . 7298 1 621 . 1 1 55 55 TRP N N 15 127.596 0.400 . 1 . . . . 55 TRP N . 7298 1 622 . 1 1 55 55 TRP NE1 N 15 129.682 0.400 . 1 . . . . 55 TRP NE1 . 7298 1 623 . 1 1 56 56 LEU H H 1 9.952 0.020 . 1 . . . . 56 LEU H . 7298 1 624 . 1 1 56 56 LEU HA H 1 5.158 0.020 . 1 . . . . 56 LEU HA . 7298 1 625 . 1 1 56 56 LEU HB2 H 1 1.397 0.020 . 2 . . . . 56 LEU HB2 . 7298 1 626 . 1 1 56 56 LEU HB3 H 1 2.142 0.020 . 2 . . . . 56 LEU HB3 . 7298 1 627 . 1 1 56 56 LEU HG H 1 1.530 0.020 . 1 . . . . 56 LEU HG . 7298 1 628 . 1 1 56 56 LEU HD11 H 1 0.974 0.020 . 2 . . . . 56 LEU HD1 . 7298 1 629 . 1 1 56 56 LEU HD12 H 1 0.974 0.020 . 2 . . . . 56 LEU HD1 . 7298 1 630 . 1 1 56 56 LEU HD13 H 1 0.974 0.020 . 2 . . . . 56 LEU HD1 . 7298 1 631 . 1 1 56 56 LEU HD21 H 1 1.103 0.020 . 2 . . . . 56 LEU HD2 . 7298 1 632 . 1 1 56 56 LEU HD22 H 1 1.103 0.020 . 2 . . . . 56 LEU HD2 . 7298 1 633 . 1 1 56 56 LEU HD23 H 1 1.103 0.020 . 2 . . . . 56 LEU HD2 . 7298 1 634 . 1 1 56 56 LEU CA C 13 53.374 0.400 . 1 . . . . 56 LEU CA . 7298 1 635 . 1 1 56 56 LEU CB C 13 46.401 0.400 . 1 . . . . 56 LEU CB . 7298 1 636 . 1 1 56 56 LEU CG C 13 26.978 0.400 . 1 . . . . 56 LEU CG . 7298 1 637 . 1 1 56 56 LEU CD1 C 13 26.978 0.400 . 1 . . . . 56 LEU CD1 . 7298 1 638 . 1 1 56 56 LEU CD2 C 13 28.006 0.400 . 1 . . . . 56 LEU CD2 . 7298 1 639 . 1 1 56 56 LEU N N 15 128.641 0.400 . 1 . . . . 56 LEU N . 7298 1 640 . 1 1 57 57 CYS H H 1 10.062 0.020 . 1 . . . . 57 CYS H . 7298 1 641 . 1 1 57 57 CYS HA H 1 4.932 0.020 . 1 . . . . 57 CYS HA . 7298 1 642 . 1 1 57 57 CYS HB2 H 1 3.197 0.020 . 2 . . . . 57 CYS HB2 . 7298 1 643 . 1 1 57 57 CYS HB3 H 1 3.497 0.020 . 2 . . . . 57 CYS HB3 . 7298 1 644 . 1 1 57 57 CYS CA C 13 60.525 0.400 . 1 . . . . 57 CYS CA . 7298 1 645 . 1 1 57 57 CYS CB C 13 29.762 0.400 . 1 . . . . 57 CYS CB . 7298 1 646 . 1 1 57 57 CYS N N 15 130.099 0.400 . 1 . . . . 57 CYS N . 7298 1 647 . 1 1 58 58 LEU H H 1 8.552 0.020 . 1 . . . . 58 LEU H . 7298 1 648 . 1 1 58 58 LEU HA H 1 4.413 0.020 . 1 . . . . 58 LEU HA . 7298 1 649 . 1 1 58 58 LEU HB2 H 1 1.879 0.020 . 1 . . . . 58 LEU HB2 . 7298 1 650 . 1 1 58 58 LEU HB3 H 1 1.879 0.020 . 1 . . . . 58 LEU HB3 . 7298 1 651 . 1 1 58 58 LEU HG H 1 1.894 0.020 . 1 . . . . 58 LEU HG . 7298 1 652 . 1 1 58 58 LEU HD11 H 1 0.884 0.020 . 2 . . . . 58 LEU HD1 . 7298 1 653 . 1 1 58 58 LEU HD12 H 1 0.884 0.020 . 2 . . . . 58 LEU HD1 . 7298 1 654 . 1 1 58 58 LEU HD13 H 1 0.884 0.020 . 2 . . . . 58 LEU HD1 . 7298 1 655 . 1 1 58 58 LEU HD21 H 1 0.859 0.020 . 2 . . . . 58 LEU HD2 . 7298 1 656 . 1 1 58 58 LEU HD22 H 1 0.859 0.020 . 2 . . . . 58 LEU HD2 . 7298 1 657 . 1 1 58 58 LEU HD23 H 1 0.859 0.020 . 2 . . . . 58 LEU HD2 . 7298 1 658 . 1 1 58 58 LEU CA C 13 56.394 0.400 . 1 . . . . 58 LEU CA . 7298 1 659 . 1 1 58 58 LEU CB C 13 40.939 0.400 . 1 . . . . 58 LEU CB . 7298 1 660 . 1 1 58 58 LEU CG C 13 26.724 0.400 . 1 . . . . 58 LEU CG . 7298 1 661 . 1 1 58 58 LEU CD1 C 13 22.663 0.400 . 1 . . . . 58 LEU CD1 . 7298 1 662 . 1 1 58 58 LEU CD2 C 13 26.470 0.400 . 1 . . . . 58 LEU CD2 . 7298 1 663 . 1 1 58 58 LEU N N 15 130.515 0.400 . 1 . . . . 58 LEU N . 7298 1 664 . 1 1 59 59 LYS H H 1 8.877 0.020 . 1 . . . . 59 LYS H . 7298 1 665 . 1 1 59 59 LYS HA H 1 4.394 0.020 . 1 . . . . 59 LYS HA . 7298 1 666 . 1 1 59 59 LYS HB2 H 1 1.041 0.020 . 2 . . . . 59 LYS HB2 . 7298 1 667 . 1 1 59 59 LYS HB3 H 1 1.798 0.020 . 2 . . . . 59 LYS HB3 . 7298 1 668 . 1 1 59 59 LYS HG2 H 1 0.689 0.020 . 2 . . . . 59 LYS HG2 . 7298 1 669 . 1 1 59 59 LYS HG3 H 1 1.036 0.020 . 2 . . . . 59 LYS HG3 . 7298 1 670 . 1 1 59 59 LYS HD2 H 1 1.360 0.020 . 2 . . . . 59 LYS HD2 . 7298 1 671 . 1 1 59 59 LYS HD3 H 1 1.534 0.020 . 2 . . . . 59 LYS HD3 . 7298 1 672 . 1 1 59 59 LYS HE2 H 1 2.869 0.020 . 1 . . . . 59 LYS HE2 . 7298 1 673 . 1 1 59 59 LYS HE3 H 1 2.869 0.020 . 1 . . . . 59 LYS HE3 . 7298 1 674 . 1 1 59 59 LYS CA C 13 56.843 0.400 . 1 . . . . 59 LYS CA . 7298 1 675 . 1 1 59 59 LYS CB C 13 33.723 0.400 . 1 . . . . 59 LYS CB . 7298 1 676 . 1 1 59 59 LYS CG C 13 24.186 0.400 . 1 . . . . 59 LYS CG . 7298 1 677 . 1 1 59 59 LYS CD C 13 29.009 0.400 . 1 . . . . 59 LYS CD . 7298 1 678 . 1 1 59 59 LYS CE C 13 42.208 0.400 . 1 . . . . 59 LYS CE . 7298 1 679 . 1 1 59 59 LYS N N 15 120.726 0.400 . 1 . . . . 59 LYS N . 7298 1 680 . 1 1 60 60 CYS H H 1 7.687 0.020 . 1 . . . . 60 CYS H . 7298 1 681 . 1 1 60 60 CYS HA H 1 5.120 0.020 . 1 . . . . 60 CYS HA . 7298 1 682 . 1 1 60 60 CYS HB2 H 1 2.719 0.020 . 2 . . . . 60 CYS HB2 . 7298 1 683 . 1 1 60 60 CYS HB3 H 1 3.581 0.020 . 2 . . . . 60 CYS HB3 . 7298 1 684 . 1 1 60 60 CYS CA C 13 57.684 0.400 . 1 . . . . 60 CYS CA . 7298 1 685 . 1 1 60 60 CYS CB C 13 34.339 0.400 . 1 . . . . 60 CYS CB . 7298 1 686 . 1 1 60 60 CYS N N 15 112.160 0.400 . 1 . . . . 60 CYS N . 7298 1 687 . 1 1 61 61 GLY H H 1 8.551 0.020 . 1 . . . . 61 GLY H . 7298 1 688 . 1 1 61 61 GLY HA2 H 1 3.698 0.020 . 2 . . . . 61 GLY HA2 . 7298 1 689 . 1 1 61 61 GLY HA3 H 1 4.101 0.020 . 2 . . . . 61 GLY HA3 . 7298 1 690 . 1 1 61 61 GLY CA C 13 45.904 0.400 . 1 . . . . 61 GLY CA . 7298 1 691 . 1 1 61 61 GLY N N 15 113.234 0.400 . 1 . . . . 61 GLY N . 7298 1 692 . 1 1 62 62 HIS H H 1 8.297 0.020 . 1 . . . . 62 HIS H . 7298 1 693 . 1 1 62 62 HIS HA H 1 4.324 0.020 . 1 . . . . 62 HIS HA . 7298 1 694 . 1 1 62 62 HIS HB2 H 1 1.995 0.020 . 2 . . . . 62 HIS HB2 . 7298 1 695 . 1 1 62 62 HIS HB3 H 1 3.153 0.020 . 2 . . . . 62 HIS HB3 . 7298 1 696 . 1 1 62 62 HIS HD2 H 1 7.316 0.020 . 1 . . . . 62 HIS HD2 . 7298 1 697 . 1 1 62 62 HIS HE1 H 1 7.549 0.020 . 1 . . . . 62 HIS HE1 . 7298 1 698 . 1 1 62 62 HIS CA C 13 57.934 0.400 . 1 . . . . 62 HIS CA . 7298 1 699 . 1 1 62 62 HIS CB C 13 29.256 0.400 . 1 . . . . 62 HIS CB . 7298 1 700 . 1 1 62 62 HIS CD2 C 13 120.257 0.400 . 1 . . . . 62 HIS CD2 . 7298 1 701 . 1 1 62 62 HIS CE1 C 13 134.473 0.400 . 1 . . . . 62 HIS CE1 . 7298 1 702 . 1 1 62 62 HIS N N 15 120.938 0.400 . 1 . . . . 62 HIS N . 7298 1 703 . 1 1 63 63 GLN H H 1 8.067 0.020 . 1 . . . . 63 GLN H . 7298 1 704 . 1 1 63 63 GLN HA H 1 4.938 0.020 . 1 . . . . 63 GLN HA . 7298 1 705 . 1 1 63 63 GLN HB2 H 1 1.878 0.020 . 1 . . . . 63 GLN HB2 . 7298 1 706 . 1 1 63 63 GLN HB3 H 1 1.878 0.020 . 1 . . . . 63 GLN HB3 . 7298 1 707 . 1 1 63 63 GLN HG2 H 1 1.614 0.020 . 2 . . . . 63 GLN HG2 . 7298 1 708 . 1 1 63 63 GLN HG3 H 1 2.398 0.020 . 2 . . . . 63 GLN HG3 . 7298 1 709 . 1 1 63 63 GLN HE21 H 1 6.350 0.020 . 2 . . . . 63 GLN HE21 . 7298 1 710 . 1 1 63 63 GLN HE22 H 1 7.278 0.020 . 2 . . . . 63 GLN HE22 . 7298 1 711 . 1 1 63 63 GLN CA C 13 55.422 0.400 . 1 . . . . 63 GLN CA . 7298 1 712 . 1 1 63 63 GLN CB C 13 33.070 0.400 . 1 . . . . 63 GLN CB . 7298 1 713 . 1 1 63 63 GLN CG C 13 36.955 0.400 . 1 . . . . 63 GLN CG . 7298 1 714 . 1 1 63 63 GLN N N 15 127.747 0.400 . 1 . . . . 63 GLN N . 7298 1 715 . 1 1 63 63 GLN NE2 N 15 108.447 0.400 . 1 . . . . 63 GLN NE2 . 7298 1 716 . 1 1 64 64 GLY H H 1 8.854 0.020 . 1 . . . . 64 GLY H . 7298 1 717 . 1 1 64 64 GLY HA2 H 1 3.240 0.020 . 2 . . . . 64 GLY HA2 . 7298 1 718 . 1 1 64 64 GLY HA3 H 1 6.385 0.020 . 2 . . . . 64 GLY HA3 . 7298 1 719 . 1 1 64 64 GLY CA C 13 43.724 0.400 . 1 . . . . 64 GLY CA . 7298 1 720 . 1 1 64 64 GLY N N 15 108.447 0.400 . 1 . . . . 64 GLY N . 7298 1 721 . 1 1 65 65 CYS H H 1 9.402 0.020 . 1 . . . . 65 CYS H . 7298 1 722 . 1 1 65 65 CYS HA H 1 5.255 0.020 . 1 . . . . 65 CYS HA . 7298 1 723 . 1 1 65 65 CYS HB2 H 1 3.265 0.020 . 2 . . . . 65 CYS HB2 . 7298 1 724 . 1 1 65 65 CYS HB3 H 1 3.451 0.020 . 2 . . . . 65 CYS HB3 . 7298 1 725 . 1 1 65 65 CYS CA C 13 57.307 0.400 . 1 . . . . 65 CYS CA . 7298 1 726 . 1 1 65 65 CYS CB C 13 30.492 0.400 . 1 . . . . 65 CYS CB . 7298 1 727 . 1 1 65 65 CYS N N 15 123.644 0.400 . 1 . . . . 65 CYS N . 7298 1 728 . 1 1 66 66 GLY H H 1 8.602 0.020 . 1 . . . . 66 GLY H . 7298 1 729 . 1 1 66 66 GLY HA2 H 1 3.762 0.020 . 2 . . . . 66 GLY HA2 . 7298 1 730 . 1 1 66 66 GLY HA3 H 1 3.909 0.020 . 2 . . . . 66 GLY HA3 . 7298 1 731 . 1 1 66 66 GLY CA C 13 45.407 0.400 . 1 . . . . 66 GLY CA . 7298 1 732 . 1 1 66 66 GLY N N 15 106.573 0.400 . 1 . . . . 66 GLY N . 7298 1 733 . 1 1 67 67 ARG H H 1 8.089 0.020 . 1 . . . . 67 ARG H . 7298 1 734 . 1 1 67 67 ARG HA H 1 4.006 0.020 . 1 . . . . 67 ARG HA . 7298 1 735 . 1 1 67 67 ARG HB2 H 1 1.636 0.020 . 1 . . . . 67 ARG HB2 . 7298 1 736 . 1 1 67 67 ARG HB3 H 1 1.636 0.020 . 1 . . . . 67 ARG HB3 . 7298 1 737 . 1 1 67 67 ARG HG2 H 1 1.467 0.020 . 1 . . . . 67 ARG HG2 . 7298 1 738 . 1 1 67 67 ARG HG3 H 1 1.467 0.020 . 1 . . . . 67 ARG HG3 . 7298 1 739 . 1 1 67 67 ARG HD2 H 1 2.933 0.020 . 1 . . . . 67 ARG HD2 . 7298 1 740 . 1 1 67 67 ARG HD3 H 1 2.933 0.020 . 1 . . . . 67 ARG HD3 . 7298 1 741 . 1 1 67 67 ARG CA C 13 58.200 0.400 . 1 . . . . 67 ARG CA . 7298 1 742 . 1 1 67 67 ARG CB C 13 30.024 0.400 . 1 . . . . 67 ARG CB . 7298 1 743 . 1 1 67 67 ARG CG C 13 26.514 0.400 . 1 . . . . 67 ARG CG . 7298 1 744 . 1 1 67 67 ARG CD C 13 42.970 0.400 . 1 . . . . 67 ARG CD . 7298 1 745 . 1 1 67 67 ARG N N 15 121.568 0.400 . 1 . . . . 67 ARG N . 7298 1 746 . 1 1 68 68 ASN H H 1 8.642 0.020 . 1 . . . . 68 ASN H . 7298 1 747 . 1 1 68 68 ASN HA H 1 4.758 0.020 . 1 . . . . 68 ASN HA . 7298 1 748 . 1 1 68 68 ASN HB2 H 1 2.875 0.020 . 2 . . . . 68 ASN HB2 . 7298 1 749 . 1 1 68 68 ASN HB3 H 1 2.943 0.020 . 2 . . . . 68 ASN HB3 . 7298 1 750 . 1 1 68 68 ASN HD21 H 1 6.947 0.020 . 2 . . . . 68 ASN HD21 . 7298 1 751 . 1 1 68 68 ASN HD22 H 1 7.711 0.020 . 2 . . . . 68 ASN HD22 . 7298 1 752 . 1 1 68 68 ASN CA C 13 52.858 0.400 . 1 . . . . 68 ASN CA . 7298 1 753 . 1 1 68 68 ASN CB C 13 36.706 0.400 . 1 . . . . 68 ASN CB . 7298 1 754 . 1 1 68 68 ASN N N 15 116.557 0.400 . 1 . . . . 68 ASN N . 7298 1 755 . 1 1 68 68 ASN ND2 N 15 113.235 0.400 . 1 . . . . 68 ASN ND2 . 7298 1 756 . 1 1 69 69 SER H H 1 7.675 0.020 . 1 . . . . 69 SER H . 7298 1 757 . 1 1 69 69 SER HA H 1 4.646 0.020 . 1 . . . . 69 SER HA . 7298 1 758 . 1 1 69 69 SER HB2 H 1 3.990 0.020 . 2 . . . . 69 SER HB2 . 7298 1 759 . 1 1 69 69 SER HB3 H 1 4.368 0.020 . 2 . . . . 69 SER HB3 . 7298 1 760 . 1 1 69 69 SER CA C 13 57.426 0.400 . 1 . . . . 69 SER CA . 7298 1 761 . 1 1 69 69 SER CB C 13 65.053 0.400 . 1 . . . . 69 SER CB . 7298 1 762 . 1 1 69 69 SER N N 15 115.244 0.400 . 1 . . . . 69 SER N . 7298 1 763 . 1 1 70 70 GLN H H 1 8.795 0.020 . 1 . . . . 70 GLN H . 7298 1 764 . 1 1 70 70 GLN HA H 1 4.113 0.020 . 1 . . . . 70 GLN HA . 7298 1 765 . 1 1 70 70 GLN HB2 H 1 2.028 0.020 . 2 . . . . 70 GLN HB2 . 7298 1 766 . 1 1 70 70 GLN HB3 H 1 2.104 0.020 . 2 . . . . 70 GLN HB3 . 7298 1 767 . 1 1 70 70 GLN HG2 H 1 2.384 0.020 . 1 . . . . 70 GLN HG2 . 7298 1 768 . 1 1 70 70 GLN HG3 H 1 2.384 0.020 . 1 . . . . 70 GLN HG3 . 7298 1 769 . 1 1 70 70 GLN HE21 H 1 6.867 0.020 . 2 . . . . 70 GLN HE21 . 7298 1 770 . 1 1 70 70 GLN HE22 H 1 7.700 0.020 . 2 . . . . 70 GLN HE22 . 7298 1 771 . 1 1 70 70 GLN CA C 13 58.333 0.400 . 1 . . . . 70 GLN CA . 7298 1 772 . 1 1 70 70 GLN CB C 13 29.263 0.400 . 1 . . . . 70 GLN CB . 7298 1 773 . 1 1 70 70 GLN CG C 13 33.832 0.400 . 1 . . . . 70 GLN CG . 7298 1 774 . 1 1 70 70 GLN N N 15 120.513 0.400 . 1 . . . . 70 GLN N . 7298 1 775 . 1 1 70 70 GLN NE2 N 15 112.820 0.400 . 1 . . . . 70 GLN NE2 . 7298 1 776 . 1 1 71 71 GLU H H 1 8.570 0.020 . 1 . . . . 71 GLU H . 7298 1 777 . 1 1 71 71 GLU HA H 1 3.998 0.020 . 1 . . . . 71 GLU HA . 7298 1 778 . 1 1 71 71 GLU HB2 H 1 0.710 0.020 . 2 . . . . 71 GLU HB2 . 7298 1 779 . 1 1 71 71 GLU HB3 H 1 1.101 0.020 . 2 . . . . 71 GLU HB3 . 7298 1 780 . 1 1 71 71 GLU HG2 H 1 2.119 0.020 . 2 . . . . 71 GLU HG2 . 7298 1 781 . 1 1 71 71 GLU HG3 H 1 2.303 0.020 . 2 . . . . 71 GLU HG3 . 7298 1 782 . 1 1 71 71 GLU CA C 13 56.376 0.400 . 1 . . . . 71 GLU CA . 7298 1 783 . 1 1 71 71 GLU CB C 13 29.263 0.400 . 1 . . . . 71 GLU CB . 7298 1 784 . 1 1 71 71 GLU CG C 13 35.355 0.400 . 1 . . . . 71 GLU CG . 7298 1 785 . 1 1 71 71 GLU N N 15 114.693 0.400 . 1 . . . . 71 GLU N . 7298 1 786 . 1 1 72 72 GLN H H 1 7.780 0.020 . 1 . . . . 72 GLN H . 7298 1 787 . 1 1 72 72 GLN HA H 1 3.583 0.020 . 1 . . . . 72 GLN HA . 7298 1 788 . 1 1 72 72 GLN HB2 H 1 2.032 0.020 . 2 . . . . 72 GLN HB2 . 7298 1 789 . 1 1 72 72 GLN HB3 H 1 2.119 0.020 . 2 . . . . 72 GLN HB3 . 7298 1 790 . 1 1 72 72 GLN HG2 H 1 2.117 0.020 . 2 . . . . 72 GLN HG2 . 7298 1 791 . 1 1 72 72 GLN HG3 H 1 2.172 0.020 . 2 . . . . 72 GLN HG3 . 7298 1 792 . 1 1 72 72 GLN HE21 H 1 6.657 0.020 . 2 . . . . 72 GLN HE21 . 7298 1 793 . 1 1 72 72 GLN HE22 H 1 7.574 0.020 . 2 . . . . 72 GLN HE22 . 7298 1 794 . 1 1 72 72 GLN CA C 13 55.559 0.400 . 1 . . . . 72 GLN CA . 7298 1 795 . 1 1 72 72 GLN CB C 13 26.266 0.400 . 1 . . . . 72 GLN CB . 7298 1 796 . 1 1 72 72 GLN CG C 13 33.552 0.400 . 1 . . . . 72 GLN CG . 7298 1 797 . 1 1 72 72 GLN N N 15 114.485 0.400 . 1 . . . . 72 GLN N . 7298 1 798 . 1 1 72 72 GLN NE2 N 15 111.778 0.400 . 1 . . . . 72 GLN NE2 . 7298 1 799 . 1 1 73 73 HIS H H 1 9.259 0.020 . 1 . . . . 73 HIS H . 7298 1 800 . 1 1 73 73 HIS HA H 1 4.368 0.020 . 1 . . . . 73 HIS HA . 7298 1 801 . 1 1 73 73 HIS HB2 H 1 3.749 0.020 . 2 . . . . 73 HIS HB2 . 7298 1 802 . 1 1 73 73 HIS HB3 H 1 4.056 0.020 . 2 . . . . 73 HIS HB3 . 7298 1 803 . 1 1 73 73 HIS HD2 H 1 7.192 0.020 . 1 . . . . 73 HIS HD2 . 7298 1 804 . 1 1 73 73 HIS HE1 H 1 7.984 0.020 . 1 . . . . 73 HIS HE1 . 7298 1 805 . 1 1 73 73 HIS CA C 13 62.311 0.400 . 1 . . . . 73 HIS CA . 7298 1 806 . 1 1 73 73 HIS CB C 13 30.243 0.400 . 1 . . . . 73 HIS CB . 7298 1 807 . 1 1 73 73 HIS CD2 C 13 118.393 0.400 . 1 . . . . 73 HIS CD2 . 7298 1 808 . 1 1 73 73 HIS CE1 C 13 137.969 0.400 . 1 . . . . 73 HIS CE1 . 7298 1 809 . 1 1 73 73 HIS N N 15 118.232 0.400 . 1 . . . . 73 HIS N . 7298 1 810 . 1 1 74 74 ALA H H 1 9.603 0.020 . 1 . . . . 74 ALA H . 7298 1 811 . 1 1 74 74 ALA HA H 1 4.420 0.020 . 1 . . . . 74 ALA HA . 7298 1 812 . 1 1 74 74 ALA HB1 H 1 1.517 0.020 . 1 . . . . 74 ALA HB . 7298 1 813 . 1 1 74 74 ALA HB2 H 1 1.517 0.020 . 1 . . . . 74 ALA HB . 7298 1 814 . 1 1 74 74 ALA HB3 H 1 1.517 0.020 . 1 . . . . 74 ALA HB . 7298 1 815 . 1 1 74 74 ALA CA C 13 56.106 0.400 . 1 . . . . 74 ALA CA . 7298 1 816 . 1 1 74 74 ALA CB C 13 17.565 0.400 . 1 . . . . 74 ALA CB . 7298 1 817 . 1 1 74 74 ALA N N 15 124.892 0.400 . 1 . . . . 74 ALA N . 7298 1 818 . 1 1 75 75 LEU H H 1 8.387 0.020 . 1 . . . . 75 LEU H . 7298 1 819 . 1 1 75 75 LEU HA H 1 3.852 0.020 . 1 . . . . 75 LEU HA . 7298 1 820 . 1 1 75 75 LEU HB2 H 1 1.505 0.020 . 2 . . . . 75 LEU HB2 . 7298 1 821 . 1 1 75 75 LEU HB3 H 1 1.940 0.020 . 2 . . . . 75 LEU HB3 . 7298 1 822 . 1 1 75 75 LEU HG H 1 1.463 0.020 . 1 . . . . 75 LEU HG . 7298 1 823 . 1 1 75 75 LEU HD11 H 1 0.847 0.020 . 2 . . . . 75 LEU HD1 . 7298 1 824 . 1 1 75 75 LEU HD12 H 1 0.847 0.020 . 2 . . . . 75 LEU HD1 . 7298 1 825 . 1 1 75 75 LEU HD13 H 1 0.847 0.020 . 2 . . . . 75 LEU HD1 . 7298 1 826 . 1 1 75 75 LEU HD21 H 1 0.865 0.020 . 2 . . . . 75 LEU HD2 . 7298 1 827 . 1 1 75 75 LEU HD22 H 1 0.865 0.020 . 2 . . . . 75 LEU HD2 . 7298 1 828 . 1 1 75 75 LEU HD23 H 1 0.865 0.020 . 2 . . . . 75 LEU HD2 . 7298 1 829 . 1 1 75 75 LEU CA C 13 57.836 0.400 . 1 . . . . 75 LEU CA . 7298 1 830 . 1 1 75 75 LEU CB C 13 41.181 0.400 . 1 . . . . 75 LEU CB . 7298 1 831 . 1 1 75 75 LEU CG C 13 27.011 0.400 . 1 . . . . 75 LEU CG . 7298 1 832 . 1 1 75 75 LEU CD1 C 13 22.986 0.400 . 1 . . . . 75 LEU CD1 . 7298 1 833 . 1 1 75 75 LEU CD2 C 13 25.520 0.400 . 1 . . . . 75 LEU CD2 . 7298 1 834 . 1 1 75 75 LEU N N 15 124.267 0.400 . 1 . . . . 75 LEU N . 7298 1 835 . 1 1 76 76 LYS H H 1 8.516 0.020 . 1 . . . . 76 LYS H . 7298 1 836 . 1 1 76 76 LYS HA H 1 3.780 0.020 . 1 . . . . 76 LYS HA . 7298 1 837 . 1 1 76 76 LYS HB2 H 1 1.823 0.020 . 2 . . . . 76 LYS HB2 . 7298 1 838 . 1 1 76 76 LYS HB3 H 1 1.976 0.020 . 2 . . . . 76 LYS HB3 . 7298 1 839 . 1 1 76 76 LYS HG2 H 1 1.412 0.020 . 2 . . . . 76 LYS HG2 . 7298 1 840 . 1 1 76 76 LYS HG3 H 1 1.654 0.020 . 2 . . . . 76 LYS HG3 . 7298 1 841 . 1 1 76 76 LYS HD2 H 1 1.622 0.020 . 2 . . . . 76 LYS HD2 . 7298 1 842 . 1 1 76 76 LYS HD3 H 1 1.733 0.020 . 2 . . . . 76 LYS HD3 . 7298 1 843 . 1 1 76 76 LYS HE2 H 1 2.866 0.020 . 2 . . . . 76 LYS HE2 . 7298 1 844 . 1 1 76 76 LYS HE3 H 1 2.997 0.020 . 2 . . . . 76 LYS HE3 . 7298 1 845 . 1 1 76 76 LYS CA C 13 59.722 0.400 . 1 . . . . 76 LYS CA . 7298 1 846 . 1 1 76 76 LYS CB C 13 32.562 0.400 . 1 . . . . 76 LYS CB . 7298 1 847 . 1 1 76 76 LYS CG C 13 26.217 0.400 . 1 . . . . 76 LYS CG . 7298 1 848 . 1 1 76 76 LYS CD C 13 29.249 0.400 . 1 . . . . 76 LYS CD . 7298 1 849 . 1 1 76 76 LYS CE C 13 42.208 0.400 . 1 . . . . 76 LYS CE . 7298 1 850 . 1 1 76 76 LYS N N 15 116.778 0.400 . 1 . . . . 76 LYS N . 7298 1 851 . 1 1 77 77 HIS H H 1 7.917 0.020 . 1 . . . . 77 HIS H . 7298 1 852 . 1 1 77 77 HIS HA H 1 4.083 0.020 . 1 . . . . 77 HIS HA . 7298 1 853 . 1 1 77 77 HIS HB2 H 1 2.613 0.020 . 2 . . . . 77 HIS HB2 . 7298 1 854 . 1 1 77 77 HIS HB3 H 1 3.689 0.020 . 2 . . . . 77 HIS HB3 . 7298 1 855 . 1 1 77 77 HIS HD2 H 1 7.729 0.020 . 1 . . . . 77 HIS HD2 . 7298 1 856 . 1 1 77 77 HIS HE1 H 1 7.929 0.020 . 1 . . . . 77 HIS HE1 . 7298 1 857 . 1 1 77 77 HIS CA C 13 59.600 0.400 . 1 . . . . 77 HIS CA . 7298 1 858 . 1 1 77 77 HIS CB C 13 27.237 0.400 . 1 . . . . 77 HIS CB . 7298 1 859 . 1 1 77 77 HIS CD2 C 13 128.414 0.400 . 1 . . . . 77 HIS CD2 . 7298 1 860 . 1 1 77 77 HIS CE1 C 13 140.299 0.400 . 1 . . . . 77 HIS CE1 . 7298 1 861 . 1 1 77 77 HIS N N 15 117.606 0.400 . 1 . . . . 77 HIS N . 7298 1 862 . 1 1 78 78 TYR H H 1 7.472 0.020 . 1 . . . . 78 TYR H . 7298 1 863 . 1 1 78 78 TYR HA H 1 4.133 0.020 . 1 . . . . 78 TYR HA . 7298 1 864 . 1 1 78 78 TYR HB2 H 1 2.609 0.020 . 2 . . . . 78 TYR HB2 . 7298 1 865 . 1 1 78 78 TYR HB3 H 1 3.111 0.020 . 2 . . . . 78 TYR HB3 . 7298 1 866 . 1 1 78 78 TYR HD1 H 1 6.910 0.020 . 1 . . . . 78 TYR HD1 . 7298 1 867 . 1 1 78 78 TYR HD2 H 1 6.910 0.020 . 1 . . . . 78 TYR HD2 . 7298 1 868 . 1 1 78 78 TYR HE1 H 1 6.620 0.020 . 1 . . . . 78 TYR HE1 . 7298 1 869 . 1 1 78 78 TYR HE2 H 1 6.620 0.020 . 1 . . . . 78 TYR HE2 . 7298 1 870 . 1 1 78 78 TYR CA C 13 60.263 0.400 . 1 . . . . 78 TYR CA . 7298 1 871 . 1 1 78 78 TYR CB C 13 37.452 0.400 . 1 . . . . 78 TYR CB . 7298 1 872 . 1 1 78 78 TYR CD1 C 13 132.142 0.400 . 1 . . . . 78 TYR CD1 . 7298 1 873 . 1 1 78 78 TYR CE1 C 13 117.927 0.400 . 1 . . . . 78 TYR CE1 . 7298 1 874 . 1 1 78 78 TYR N N 15 121.712 0.400 . 1 . . . . 78 TYR N . 7298 1 875 . 1 1 79 79 LEU H H 1 7.917 0.020 . 1 . . . . 79 LEU H . 7298 1 876 . 1 1 79 79 LEU HA H 1 3.422 0.020 . 1 . . . . 79 LEU HA . 7298 1 877 . 1 1 79 79 LEU HB2 H 1 1.377 0.020 . 2 . . . . 79 LEU HB2 . 7298 1 878 . 1 1 79 79 LEU HB3 H 1 1.574 0.020 . 2 . . . . 79 LEU HB3 . 7298 1 879 . 1 1 79 79 LEU HG H 1 1.655 0.020 . 1 . . . . 79 LEU HG . 7298 1 880 . 1 1 79 79 LEU HD11 H 1 0.699 0.020 . 2 . . . . 79 LEU HD1 . 7298 1 881 . 1 1 79 79 LEU HD12 H 1 0.699 0.020 . 2 . . . . 79 LEU HD1 . 7298 1 882 . 1 1 79 79 LEU HD13 H 1 0.699 0.020 . 2 . . . . 79 LEU HD1 . 7298 1 883 . 1 1 79 79 LEU HD21 H 1 0.774 0.020 . 2 . . . . 79 LEU HD2 . 7298 1 884 . 1 1 79 79 LEU HD22 H 1 0.774 0.020 . 2 . . . . 79 LEU HD2 . 7298 1 885 . 1 1 79 79 LEU HD23 H 1 0.774 0.020 . 2 . . . . 79 LEU HD2 . 7298 1 886 . 1 1 79 79 LEU CA C 13 55.145 0.400 . 1 . . . . 79 LEU CA . 7298 1 887 . 1 1 79 79 LEU CB C 13 42.208 0.400 . 1 . . . . 79 LEU CB . 7298 1 888 . 1 1 79 79 LEU CG C 13 25.963 0.400 . 1 . . . . 79 LEU CG . 7298 1 889 . 1 1 79 79 LEU CD1 C 13 22.155 0.400 . 1 . . . . 79 LEU CD1 . 7298 1 890 . 1 1 79 79 LEU CD2 C 13 25.709 0.400 . 1 . . . . 79 LEU CD2 . 7298 1 891 . 1 1 79 79 LEU N N 15 117.816 0.400 . 1 . . . . 79 LEU N . 7298 1 892 . 1 1 80 80 THR H H 1 6.898 0.020 . 1 . . . . 80 THR H . 7298 1 893 . 1 1 80 80 THR HA H 1 4.128 0.020 . 1 . . . . 80 THR HA . 7298 1 894 . 1 1 80 80 THR HB H 1 3.680 0.020 . 1 . . . . 80 THR HB . 7298 1 895 . 1 1 80 80 THR HG21 H 1 1.016 0.020 . 1 . . . . 80 THR HG2 . 7298 1 896 . 1 1 80 80 THR HG22 H 1 1.016 0.020 . 1 . . . . 80 THR HG2 . 7298 1 897 . 1 1 80 80 THR HG23 H 1 1.016 0.020 . 1 . . . . 80 THR HG2 . 7298 1 898 . 1 1 80 80 THR CA C 13 61.510 0.400 . 1 . . . . 80 THR CA . 7298 1 899 . 1 1 80 80 THR CB C 13 70.637 0.400 . 1 . . . . 80 THR CB . 7298 1 900 . 1 1 80 80 THR CG2 C 13 19.554 0.400 . 1 . . . . 80 THR CG2 . 7298 1 901 . 1 1 80 80 THR N N 15 119.485 0.400 . 1 . . . . 80 THR N . 7298 1 902 . 1 1 81 81 PRO HA H 1 4.187 0.020 . 1 . . . . 81 PRO HA . 7298 1 903 . 1 1 81 81 PRO HB2 H 1 1.824 0.020 . 2 . . . . 81 PRO HB2 . 7298 1 904 . 1 1 81 81 PRO HB3 H 1 2.139 0.020 . 2 . . . . 81 PRO HB3 . 7298 1 905 . 1 1 81 81 PRO HG2 H 1 1.849 0.020 . 2 . . . . 81 PRO HG2 . 7298 1 906 . 1 1 81 81 PRO HG3 H 1 2.055 0.020 . 2 . . . . 81 PRO HG3 . 7298 1 907 . 1 1 81 81 PRO HD2 H 1 3.557 0.020 . 2 . . . . 81 PRO HD2 . 7298 1 908 . 1 1 81 81 PRO HD3 H 1 3.922 0.020 . 2 . . . . 81 PRO HD3 . 7298 1 909 . 1 1 81 81 PRO CA C 13 63.784 0.400 . 1 . . . . 81 PRO CA . 7298 1 910 . 1 1 81 81 PRO CB C 13 31.547 0.400 . 1 . . . . 81 PRO CB . 7298 1 911 . 1 1 81 81 PRO CG C 13 27.740 0.400 . 1 . . . . 81 PRO CG . 7298 1 912 . 1 1 81 81 PRO CD C 13 51.092 0.400 . 1 . . . . 81 PRO CD . 7298 1 913 . 1 1 82 82 ARG H H 1 7.847 0.020 . 1 . . . . 82 ARG H . 7298 1 914 . 1 1 82 82 ARG HA H 1 4.566 0.020 . 1 . . . . 82 ARG HA . 7298 1 915 . 1 1 82 82 ARG HB2 H 1 1.522 0.020 . 2 . . . . 82 ARG HB2 . 7298 1 916 . 1 1 82 82 ARG HB3 H 1 2.012 0.020 . 2 . . . . 82 ARG HB3 . 7298 1 917 . 1 1 82 82 ARG HG2 H 1 1.314 0.020 . 2 . . . . 82 ARG HG2 . 7298 1 918 . 1 1 82 82 ARG HG3 H 1 1.473 0.020 . 2 . . . . 82 ARG HG3 . 7298 1 919 . 1 1 82 82 ARG HD2 H 1 2.721 0.020 . 2 . . . . 82 ARG HD2 . 7298 1 920 . 1 1 82 82 ARG HD3 H 1 2.912 0.020 . 2 . . . . 82 ARG HD3 . 7298 1 921 . 1 1 82 82 ARG CA C 13 54.605 0.400 . 1 . . . . 82 ARG CA . 7298 1 922 . 1 1 82 82 ARG CB C 13 34.220 0.400 . 1 . . . . 82 ARG CB . 7298 1 923 . 1 1 82 82 ARG CG C 13 26.763 0.400 . 1 . . . . 82 ARG CG . 7298 1 924 . 1 1 82 82 ARG CD C 13 44.164 0.400 . 1 . . . . 82 ARG CD . 7298 1 925 . 1 1 82 82 ARG N N 15 121.277 0.400 . 1 . . . . 82 ARG N . 7298 1 926 . 1 1 84 84 GLU H H 1 7.529 0.020 . 1 . . . . 84 GLU H . 7298 1 927 . 1 1 84 84 GLU HA H 1 4.955 0.020 . 1 . . . . 84 GLU HA . 7298 1 928 . 1 1 84 84 GLU HB2 H 1 1.998 0.020 . 2 . . . . 84 GLU HB2 . 7298 1 929 . 1 1 84 84 GLU HB3 H 1 2.108 0.020 . 2 . . . . 84 GLU HB3 . 7298 1 930 . 1 1 84 84 GLU HG2 H 1 2.303 0.020 . 1 . . . . 84 GLU HG2 . 7298 1 931 . 1 1 84 84 GLU HG3 H 1 2.303 0.020 . 1 . . . . 84 GLU HG3 . 7298 1 932 . 1 1 84 84 GLU CA C 13 52.616 0.400 . 1 . . . . 84 GLU CA . 7298 1 933 . 1 1 84 84 GLU CB C 13 30.989 0.400 . 1 . . . . 84 GLU CB . 7298 1 934 . 1 1 84 84 GLU CG C 13 35.961 0.400 . 1 . . . . 84 GLU CG . 7298 1 935 . 1 1 84 84 GLU N N 15 119.262 0.400 . 1 . . . . 84 GLU N . 7298 1 936 . 1 1 85 85 PRO HA H 1 4.430 0.020 . 1 . . . . 85 PRO HA . 7298 1 937 . 1 1 85 85 PRO HB2 H 1 1.862 0.020 . 2 . . . . 85 PRO HB2 . 7298 1 938 . 1 1 85 85 PRO HB3 H 1 2.391 0.020 . 2 . . . . 85 PRO HB3 . 7298 1 939 . 1 1 85 85 PRO HG2 H 1 2.125 0.020 . 2 . . . . 85 PRO HG2 . 7298 1 940 . 1 1 85 85 PRO HG3 H 1 2.198 0.020 . 2 . . . . 85 PRO HG3 . 7298 1 941 . 1 1 85 85 PRO HD2 H 1 3.815 0.020 . 2 . . . . 85 PRO HD2 . 7298 1 942 . 1 1 85 85 PRO HD3 H 1 3.860 0.020 . 2 . . . . 85 PRO HD3 . 7298 1 943 . 1 1 85 85 PRO CA C 13 62.768 0.400 . 1 . . . . 85 PRO CA . 7298 1 944 . 1 1 85 85 PRO CB C 13 32.816 0.400 . 1 . . . . 85 PRO CB . 7298 1 945 . 1 1 85 85 PRO CG C 13 27.235 0.400 . 1 . . . . 85 PRO CG . 7298 1 946 . 1 1 85 85 PRO CD C 13 50.627 0.400 . 1 . . . . 85 PRO CD . 7298 1 947 . 1 1 86 86 HIS H H 1 9.147 0.020 . 1 . . . . 86 HIS H . 7298 1 948 . 1 1 86 86 HIS HA H 1 5.174 0.020 . 1 . . . . 86 HIS HA . 7298 1 949 . 1 1 86 86 HIS HB2 H 1 3.072 0.020 . 2 . . . . 86 HIS HB2 . 7298 1 950 . 1 1 86 86 HIS HB3 H 1 3.990 0.020 . 2 . . . . 86 HIS HB3 . 7298 1 951 . 1 1 86 86 HIS HD2 H 1 7.560 0.020 . 1 . . . . 86 HIS HD2 . 7298 1 952 . 1 1 86 86 HIS HE1 H 1 8.096 0.020 . 1 . . . . 86 HIS HE1 . 7298 1 953 . 1 1 86 86 HIS CA C 13 53.859 0.400 . 1 . . . . 86 HIS CA . 7298 1 954 . 1 1 86 86 HIS CB C 13 29.263 0.400 . 1 . . . . 86 HIS CB . 7298 1 955 . 1 1 86 86 HIS CD2 C 13 118.160 0.400 . 1 . . . . 86 HIS CD2 . 7298 1 956 . 1 1 86 86 HIS CE1 C 13 139.134 0.400 . 1 . . . . 86 HIS CE1 . 7298 1 957 . 1 1 86 86 HIS N N 15 124.459 0.400 . 1 . . . . 86 HIS N . 7298 1 958 . 1 1 87 87 CYS H H 1 7.612 0.020 . 1 . . . . 87 CYS H . 7298 1 959 . 1 1 87 87 CYS HA H 1 4.934 0.020 . 1 . . . . 87 CYS HA . 7298 1 960 . 1 1 87 87 CYS HB2 H 1 2.700 0.020 . 2 . . . . 87 CYS HB2 . 7298 1 961 . 1 1 87 87 CYS HB3 H 1 3.481 0.020 . 2 . . . . 87 CYS HB3 . 7298 1 962 . 1 1 87 87 CYS CA C 13 58.333 0.400 . 1 . . . . 87 CYS CA . 7298 1 963 . 1 1 87 87 CYS CB C 13 30.786 0.400 . 1 . . . . 87 CYS CB . 7298 1 964 . 1 1 87 87 CYS N N 15 114.814 0.400 . 1 . . . . 87 CYS N . 7298 1 965 . 1 1 88 88 LEU H H 1 9.476 0.020 . 1 . . . . 88 LEU H . 7298 1 966 . 1 1 88 88 LEU HA H 1 5.748 0.020 . 1 . . . . 88 LEU HA . 7298 1 967 . 1 1 88 88 LEU HB2 H 1 1.495 0.020 . 2 . . . . 88 LEU HB2 . 7298 1 968 . 1 1 88 88 LEU HB3 H 1 1.770 0.020 . 2 . . . . 88 LEU HB3 . 7298 1 969 . 1 1 88 88 LEU HG H 1 1.743 0.020 . 1 . . . . 88 LEU HG . 7298 1 970 . 1 1 88 88 LEU HD11 H 1 0.980 0.020 . 2 . . . . 88 LEU HD1 . 7298 1 971 . 1 1 88 88 LEU HD12 H 1 0.980 0.020 . 2 . . . . 88 LEU HD1 . 7298 1 972 . 1 1 88 88 LEU HD13 H 1 0.980 0.020 . 2 . . . . 88 LEU HD1 . 7298 1 973 . 1 1 88 88 LEU HD21 H 1 0.970 0.020 . 2 . . . . 88 LEU HD2 . 7298 1 974 . 1 1 88 88 LEU HD22 H 1 0.970 0.020 . 2 . . . . 88 LEU HD2 . 7298 1 975 . 1 1 88 88 LEU HD23 H 1 0.970 0.020 . 2 . . . . 88 LEU HD2 . 7298 1 976 . 1 1 88 88 LEU CA C 13 53.873 0.400 . 1 . . . . 88 LEU CA . 7298 1 977 . 1 1 88 88 LEU CB C 13 46.777 0.400 . 1 . . . . 88 LEU CB . 7298 1 978 . 1 1 88 88 LEU CG C 13 28.006 0.400 . 1 . . . . 88 LEU CG . 7298 1 979 . 1 1 88 88 LEU CD1 C 13 25.271 0.400 . 1 . . . . 88 LEU CD1 . 7298 1 980 . 1 1 88 88 LEU CD2 C 13 26.763 0.400 . 1 . . . . 88 LEU CD2 . 7298 1 981 . 1 1 88 88 LEU N N 15 123.447 0.400 . 1 . . . . 88 LEU N . 7298 1 982 . 1 1 89 89 VAL H H 1 8.928 0.020 . 1 . . . . 89 VAL H . 7298 1 983 . 1 1 89 89 VAL HA H 1 5.611 0.020 . 1 . . . . 89 VAL HA . 7298 1 984 . 1 1 89 89 VAL HB H 1 2.359 0.020 . 1 . . . . 89 VAL HB . 7298 1 985 . 1 1 89 89 VAL HG11 H 1 0.901 0.020 . 2 . . . . 89 VAL HG1 . 7298 1 986 . 1 1 89 89 VAL HG12 H 1 0.901 0.020 . 2 . . . . 89 VAL HG1 . 7298 1 987 . 1 1 89 89 VAL HG13 H 1 0.901 0.020 . 2 . . . . 89 VAL HG1 . 7298 1 988 . 1 1 89 89 VAL HG21 H 1 1.349 0.020 . 2 . . . . 89 VAL HG2 . 7298 1 989 . 1 1 89 89 VAL HG22 H 1 1.349 0.020 . 2 . . . . 89 VAL HG2 . 7298 1 990 . 1 1 89 89 VAL HG23 H 1 1.349 0.020 . 2 . . . . 89 VAL HG2 . 7298 1 991 . 1 1 89 89 VAL CA C 13 58.333 0.400 . 1 . . . . 89 VAL CA . 7298 1 992 . 1 1 89 89 VAL CB C 13 37.639 0.400 . 1 . . . . 89 VAL CB . 7298 1 993 . 1 1 89 89 VAL CG1 C 13 20.300 0.400 . 1 . . . . 89 VAL CG1 . 7298 1 994 . 1 1 89 89 VAL CG2 C 13 23.425 0.400 . 1 . . . . 89 VAL CG2 . 7298 1 995 . 1 1 89 89 VAL N N 15 116.724 0.400 . 1 . . . . 89 VAL N . 7298 1 996 . 1 1 90 90 LEU H H 1 9.302 0.020 . 1 . . . . 90 LEU H . 7298 1 997 . 1 1 90 90 LEU HA H 1 5.408 0.020 . 1 . . . . 90 LEU HA . 7298 1 998 . 1 1 90 90 LEU HB2 H 1 1.445 0.020 . 2 . . . . 90 LEU HB2 . 7298 1 999 . 1 1 90 90 LEU HB3 H 1 2.130 0.020 . 2 . . . . 90 LEU HB3 . 7298 1 1000 . 1 1 90 90 LEU HG H 1 1.507 0.020 . 1 . . . . 90 LEU HG . 7298 1 1001 . 1 1 90 90 LEU HD11 H 1 1.103 0.020 . 2 . . . . 90 LEU HD1 . 7298 1 1002 . 1 1 90 90 LEU HD12 H 1 1.103 0.020 . 2 . . . . 90 LEU HD1 . 7298 1 1003 . 1 1 90 90 LEU HD13 H 1 1.103 0.020 . 2 . . . . 90 LEU HD1 . 7298 1 1004 . 1 1 90 90 LEU HD21 H 1 1.183 0.020 . 2 . . . . 90 LEU HD2 . 7298 1 1005 . 1 1 90 90 LEU HD22 H 1 1.183 0.020 . 2 . . . . 90 LEU HD2 . 7298 1 1006 . 1 1 90 90 LEU HD23 H 1 1.183 0.020 . 2 . . . . 90 LEU HD2 . 7298 1 1007 . 1 1 90 90 LEU CA C 13 52.113 0.400 . 1 . . . . 90 LEU CA . 7298 1 1008 . 1 1 90 90 LEU CB C 13 48.300 0.400 . 1 . . . . 90 LEU CB . 7298 1 1009 . 1 1 90 90 LEU CG C 13 27.260 0.400 . 1 . . . . 90 LEU CG . 7298 1 1010 . 1 1 90 90 LEU CD1 C 13 25.963 0.400 . 1 . . . . 90 LEU CD1 . 7298 1 1011 . 1 1 90 90 LEU CD2 C 13 27.486 0.400 . 1 . . . . 90 LEU CD2 . 7298 1 1012 . 1 1 90 90 LEU N N 15 123.434 0.400 . 1 . . . . 90 LEU N . 7298 1 1013 . 1 1 91 91 SER H H 1 9.277 0.020 . 1 . . . . 91 SER H . 7298 1 1014 . 1 1 91 91 SER HA H 1 3.355 0.020 . 1 . . . . 91 SER HA . 7298 1 1015 . 1 1 91 91 SER HB2 H 1 2.201 0.020 . 2 . . . . 91 SER HB2 . 7298 1 1016 . 1 1 91 91 SER HB3 H 1 3.317 0.020 . 2 . . . . 91 SER HB3 . 7298 1 1017 . 1 1 91 91 SER CA C 13 57.180 0.400 . 1 . . . . 91 SER CA . 7298 1 1018 . 1 1 91 91 SER CB C 13 62.515 0.400 . 1 . . . . 91 SER CB . 7298 1 1019 . 1 1 91 91 SER N N 15 123.822 0.400 . 1 . . . . 91 SER N . 7298 1 1020 . 1 1 92 92 LEU H H 1 7.540 0.020 . 1 . . . . 92 LEU H . 7298 1 1021 . 1 1 92 92 LEU HA H 1 3.217 0.020 . 1 . . . . 92 LEU HA . 7298 1 1022 . 1 1 92 92 LEU HB2 H 1 1.197 0.020 . 2 . . . . 92 LEU HB2 . 7298 1 1023 . 1 1 92 92 LEU HB3 H 1 1.448 0.020 . 2 . . . . 92 LEU HB3 . 7298 1 1024 . 1 1 92 92 LEU HG H 1 1.468 0.020 . 1 . . . . 92 LEU HG . 7298 1 1025 . 1 1 92 92 LEU HD11 H 1 0.723 0.020 . 2 . . . . 92 LEU HD1 . 7298 1 1026 . 1 1 92 92 LEU HD12 H 1 0.723 0.020 . 2 . . . . 92 LEU HD1 . 7298 1 1027 . 1 1 92 92 LEU HD13 H 1 0.723 0.020 . 2 . . . . 92 LEU HD1 . 7298 1 1028 . 1 1 92 92 LEU HD21 H 1 0.722 0.020 . 2 . . . . 92 LEU HD2 . 7298 1 1029 . 1 1 92 92 LEU HD22 H 1 0.722 0.020 . 2 . . . . 92 LEU HD2 . 7298 1 1030 . 1 1 92 92 LEU HD23 H 1 0.722 0.020 . 2 . . . . 92 LEU HD2 . 7298 1 1031 . 1 1 92 92 LEU CA C 13 54.387 0.400 . 1 . . . . 92 LEU CA . 7298 1 1032 . 1 1 92 92 LEU CB C 13 39.192 0.400 . 1 . . . . 92 LEU CB . 7298 1 1033 . 1 1 92 92 LEU CG C 13 26.978 0.400 . 1 . . . . 92 LEU CG . 7298 1 1034 . 1 1 92 92 LEU CD1 C 13 23.034 0.400 . 1 . . . . 92 LEU CD1 . 7298 1 1035 . 1 1 92 92 LEU CD2 C 13 25.963 0.400 . 1 . . . . 92 LEU CD2 . 7298 1 1036 . 1 1 92 92 LEU N N 15 126.558 0.400 . 1 . . . . 92 LEU N . 7298 1 1037 . 1 1 93 93 ASP H H 1 7.342 0.020 . 1 . . . . 93 ASP H . 7298 1 1038 . 1 1 93 93 ASP HA H 1 4.420 0.020 . 1 . . . . 93 ASP HA . 7298 1 1039 . 1 1 93 93 ASP HB2 H 1 2.195 0.020 . 2 . . . . 93 ASP HB2 . 7298 1 1040 . 1 1 93 93 ASP HB3 H 1 2.352 0.020 . 2 . . . . 93 ASP HB3 . 7298 1 1041 . 1 1 93 93 ASP CA C 13 54.632 0.400 . 1 . . . . 93 ASP CA . 7298 1 1042 . 1 1 93 93 ASP CB C 13 41.954 0.400 . 1 . . . . 93 ASP CB . 7298 1 1043 . 1 1 93 93 ASP N N 15 114.595 0.400 . 1 . . . . 93 ASP N . 7298 1 1044 . 1 1 94 94 ASN H H 1 7.155 0.020 . 1 . . . . 94 ASN H . 7298 1 1045 . 1 1 94 94 ASN HA H 1 4.652 0.020 . 1 . . . . 94 ASN HA . 7298 1 1046 . 1 1 94 94 ASN HB2 H 1 2.535 0.020 . 2 . . . . 94 ASN HB2 . 7298 1 1047 . 1 1 94 94 ASN HB3 H 1 3.141 0.020 . 2 . . . . 94 ASN HB3 . 7298 1 1048 . 1 1 94 94 ASN HD21 H 1 6.854 0.020 . 2 . . . . 94 ASN HD21 . 7298 1 1049 . 1 1 94 94 ASN HD22 H 1 7.579 0.020 . 2 . . . . 94 ASN HD22 . 7298 1 1050 . 1 1 94 94 ASN CA C 13 51.142 0.400 . 1 . . . . 94 ASN CA . 7298 1 1051 . 1 1 94 94 ASN CB C 13 38.908 0.400 . 1 . . . . 94 ASN CB . 7298 1 1052 . 1 1 94 94 ASN N N 15 112.686 0.400 . 1 . . . . 94 ASN N . 7298 1 1053 . 1 1 94 94 ASN ND2 N 15 111.778 0.400 . 1 . . . . 94 ASN ND2 . 7298 1 1054 . 1 1 95 95 TRP H H 1 7.177 0.020 . 1 . . . . 95 TRP H . 7298 1 1055 . 1 1 95 95 TRP HA H 1 4.672 0.020 . 1 . . . . 95 TRP HA . 7298 1 1056 . 1 1 95 95 TRP HB2 H 1 3.429 0.020 . 1 . . . . 95 TRP HB2 . 7298 1 1057 . 1 1 95 95 TRP HB3 H 1 3.429 0.020 . 1 . . . . 95 TRP HB3 . 7298 1 1058 . 1 1 95 95 TRP HD1 H 1 6.927 0.020 . 1 . . . . 95 TRP HD1 . 7298 1 1059 . 1 1 95 95 TRP HE1 H 1 9.792 0.020 . 1 . . . . 95 TRP HE1 . 7298 1 1060 . 1 1 95 95 TRP HE3 H 1 7.359 0.020 . 1 . . . . 95 TRP HE3 . 7298 1 1061 . 1 1 95 95 TRP HZ2 H 1 7.395 0.020 . 1 . . . . 95 TRP HZ2 . 7298 1 1062 . 1 1 95 95 TRP HZ3 H 1 6.783 0.020 . 1 . . . . 95 TRP HZ3 . 7298 1 1063 . 1 1 95 95 TRP HH2 H 1 6.918 0.020 . 1 . . . . 95 TRP HH2 . 7298 1 1064 . 1 1 95 95 TRP CA C 13 57.667 0.400 . 1 . . . . 95 TRP CA . 7298 1 1065 . 1 1 95 95 TRP CB C 13 25.455 0.400 . 1 . . . . 95 TRP CB . 7298 1 1066 . 1 1 95 95 TRP CD1 C 13 127.015 0.400 . 1 . . . . 95 TRP CD1 . 7298 1 1067 . 1 1 95 95 TRP CE3 C 13 120.257 0.400 . 1 . . . . 95 TRP CE3 . 7298 1 1068 . 1 1 95 95 TRP CZ2 C 13 114.649 0.400 . 1 . . . . 95 TRP CZ2 . 7298 1 1069 . 1 1 95 95 TRP CZ3 C 13 120.257 0.400 . 1 . . . . 95 TRP CZ3 . 7298 1 1070 . 1 1 95 95 TRP CH2 C 13 123.520 0.400 . 1 . . . . 95 TRP CH2 . 7298 1 1071 . 1 1 95 95 TRP N N 15 114.911 0.400 . 1 . . . . 95 TRP N . 7298 1 1072 . 1 1 95 95 TRP NE1 N 15 128.017 0.400 . 1 . . . . 95 TRP NE1 . 7298 1 1073 . 1 1 96 96 SER H H 1 7.950 0.020 . 1 . . . . 96 SER H . 7298 1 1074 . 1 1 96 96 SER HA H 1 4.904 0.020 . 1 . . . . 96 SER HA . 7298 1 1075 . 1 1 96 96 SER HB2 H 1 3.968 0.020 . 2 . . . . 96 SER HB2 . 7298 1 1076 . 1 1 96 96 SER HB3 H 1 4.052 0.020 . 2 . . . . 96 SER HB3 . 7298 1 1077 . 1 1 96 96 SER CA C 13 58.199 0.400 . 1 . . . . 96 SER CA . 7298 1 1078 . 1 1 96 96 SER CB C 13 64.799 0.400 . 1 . . . . 96 SER CB . 7298 1 1079 . 1 1 96 96 SER N N 15 115.318 0.400 . 1 . . . . 96 SER N . 7298 1 1080 . 1 1 97 97 VAL H H 1 9.289 0.020 . 1 . . . . 97 VAL H . 7298 1 1081 . 1 1 97 97 VAL HA H 1 5.451 0.020 . 1 . . . . 97 VAL HA . 7298 1 1082 . 1 1 97 97 VAL HB H 1 2.393 0.020 . 1 . . . . 97 VAL HB . 7298 1 1083 . 1 1 97 97 VAL HG11 H 1 0.958 0.020 . 2 . . . . 97 VAL HG1 . 7298 1 1084 . 1 1 97 97 VAL HG12 H 1 0.958 0.020 . 2 . . . . 97 VAL HG1 . 7298 1 1085 . 1 1 97 97 VAL HG13 H 1 0.958 0.020 . 2 . . . . 97 VAL HG1 . 7298 1 1086 . 1 1 97 97 VAL HG21 H 1 0.997 0.020 . 2 . . . . 97 VAL HG2 . 7298 1 1087 . 1 1 97 97 VAL HG22 H 1 0.997 0.020 . 2 . . . . 97 VAL HG2 . 7298 1 1088 . 1 1 97 97 VAL HG23 H 1 0.997 0.020 . 2 . . . . 97 VAL HG2 . 7298 1 1089 . 1 1 97 97 VAL CA C 13 60.603 0.400 . 1 . . . . 97 VAL CA . 7298 1 1090 . 1 1 97 97 VAL CB C 13 33.226 0.400 . 1 . . . . 97 VAL CB . 7298 1 1091 . 1 1 97 97 VAL CG1 C 13 21.902 0.400 . 1 . . . . 97 VAL CG1 . 7298 1 1092 . 1 1 97 97 VAL CG2 C 13 23.932 0.400 . 1 . . . . 97 VAL CG2 . 7298 1 1093 . 1 1 97 97 VAL N N 15 123.228 0.400 . 1 . . . . 97 VAL N . 7298 1 1094 . 1 1 98 98 TRP H H 1 9.529 0.020 . 1 . . . . 98 TRP H . 7298 1 1095 . 1 1 98 98 TRP HA H 1 4.759 0.020 . 1 . . . . 98 TRP HA . 7298 1 1096 . 1 1 98 98 TRP HB2 H 1 2.589 0.020 . 2 . . . . 98 TRP HB2 . 7298 1 1097 . 1 1 98 98 TRP HB3 H 1 2.811 0.020 . 2 . . . . 98 TRP HB3 . 7298 1 1098 . 1 1 98 98 TRP HD1 H 1 5.390 0.020 . 1 . . . . 98 TRP HD1 . 7298 1 1099 . 1 1 98 98 TRP HE1 H 1 9.759 0.020 . 1 . . . . 98 TRP HE1 . 7298 1 1100 . 1 1 98 98 TRP HE3 H 1 7.434 0.020 . 1 . . . . 98 TRP HE3 . 7298 1 1101 . 1 1 98 98 TRP HZ2 H 1 7.382 0.020 . 1 . . . . 98 TRP HZ2 . 7298 1 1102 . 1 1 98 98 TRP HZ3 H 1 7.153 0.020 . 1 . . . . 98 TRP HZ3 . 7298 1 1103 . 1 1 98 98 TRP HH2 H 1 7.138 0.020 . 1 . . . . 98 TRP HH2 . 7298 1 1104 . 1 1 98 98 TRP CA C 13 55.661 0.400 . 1 . . . . 98 TRP CA . 7298 1 1105 . 1 1 98 98 TRP CB C 13 32.729 0.400 . 1 . . . . 98 TRP CB . 7298 1 1106 . 1 1 98 98 TRP CD1 C 13 124.918 0.400 . 1 . . . . 98 TRP CD1 . 7298 1 1107 . 1 1 98 98 TRP CE3 C 13 119.558 0.400 . 1 . . . . 98 TRP CE3 . 7298 1 1108 . 1 1 98 98 TRP CZ2 C 13 114.431 0.400 . 1 . . . . 98 TRP CZ2 . 7298 1 1109 . 1 1 98 98 TRP CZ3 C 13 122.354 0.400 . 1 . . . . 98 TRP CZ3 . 7298 1 1110 . 1 1 98 98 TRP CH2 C 13 124.452 0.400 . 1 . . . . 98 TRP CH2 . 7298 1 1111 . 1 1 98 98 TRP N N 15 129.682 0.400 . 1 . . . . 98 TRP N . 7298 1 1112 . 1 1 98 98 TRP NE1 N 15 128.225 0.400 . 1 . . . . 98 TRP NE1 . 7298 1 1113 . 1 1 99 99 CYS H H 1 7.193 0.020 . 1 . . . . 99 CYS H . 7298 1 1114 . 1 1 99 99 CYS HA H 1 5.363 0.020 . 1 . . . . 99 CYS HA . 7298 1 1115 . 1 1 99 99 CYS HB2 H 1 2.442 0.020 . 2 . . . . 99 CYS HB2 . 7298 1 1116 . 1 1 99 99 CYS HB3 H 1 2.730 0.020 . 2 . . . . 99 CYS HB3 . 7298 1 1117 . 1 1 99 99 CYS CA C 13 55.736 0.400 . 1 . . . . 99 CYS CA . 7298 1 1118 . 1 1 99 99 CYS CB C 13 31.039 0.400 . 1 . . . . 99 CYS CB . 7298 1 1119 . 1 1 99 99 CYS N N 15 125.939 0.400 . 1 . . . . 99 CYS N . 7298 1 1120 . 1 1 100 100 TYR H H 1 9.268 0.020 . 1 . . . . 100 TYR H . 7298 1 1121 . 1 1 100 100 TYR HA H 1 4.246 0.020 . 1 . . . . 100 TYR HA . 7298 1 1122 . 1 1 100 100 TYR HB2 H 1 1.403 0.020 . 2 . . . . 100 TYR HB2 . 7298 1 1123 . 1 1 100 100 TYR HB3 H 1 2.262 0.020 . 2 . . . . 100 TYR HB3 . 7298 1 1124 . 1 1 100 100 TYR HD1 H 1 6.897 0.020 . 1 . . . . 100 TYR HD1 . 7298 1 1125 . 1 1 100 100 TYR HD2 H 1 6.897 0.020 . 1 . . . . 100 TYR HD2 . 7298 1 1126 . 1 1 100 100 TYR HE1 H 1 6.526 0.020 . 1 . . . . 100 TYR HE1 . 7298 1 1127 . 1 1 100 100 TYR HE2 H 1 6.526 0.020 . 1 . . . . 100 TYR HE2 . 7298 1 1128 . 1 1 100 100 TYR CA C 13 60.995 0.400 . 1 . . . . 100 TYR CA . 7298 1 1129 . 1 1 100 100 TYR CB C 13 38.401 0.400 . 1 . . . . 100 TYR CB . 7298 1 1130 . 1 1 100 100 TYR CD1 C 13 132.142 0.400 . 1 . . . . 100 TYR CD1 . 7298 1 1131 . 1 1 100 100 TYR CE1 C 13 117.227 0.400 . 1 . . . . 100 TYR CE1 . 7298 1 1132 . 1 1 100 100 TYR N N 15 125.518 0.400 . 1 . . . . 100 TYR N . 7298 1 1133 . 1 1 101 101 VAL H H 1 8.538 0.020 . 1 . . . . 101 VAL H . 7298 1 1134 . 1 1 101 101 VAL HA H 1 3.685 0.020 . 1 . . . . 101 VAL HA . 7298 1 1135 . 1 1 101 101 VAL HB H 1 0.907 0.020 . 1 . . . . 101 VAL HB . 7298 1 1136 . 1 1 101 101 VAL HG11 H 1 0.847 0.020 . 2 . . . . 101 VAL HG1 . 7298 1 1137 . 1 1 101 101 VAL HG12 H 1 0.847 0.020 . 2 . . . . 101 VAL HG1 . 7298 1 1138 . 1 1 101 101 VAL HG13 H 1 0.847 0.020 . 2 . . . . 101 VAL HG1 . 7298 1 1139 . 1 1 101 101 VAL HG21 H 1 0.715 0.020 . 2 . . . . 101 VAL HG2 . 7298 1 1140 . 1 1 101 101 VAL HG22 H 1 0.715 0.020 . 2 . . . . 101 VAL HG2 . 7298 1 1141 . 1 1 101 101 VAL HG23 H 1 0.715 0.020 . 2 . . . . 101 VAL HG2 . 7298 1 1142 . 1 1 101 101 VAL CA C 13 65.814 0.400 . 1 . . . . 101 VAL CA . 7298 1 1143 . 1 1 101 101 VAL CB C 13 31.983 0.400 . 1 . . . . 101 VAL CB . 7298 1 1144 . 1 1 101 101 VAL CG1 C 13 22.040 0.400 . 1 . . . . 101 VAL CG1 . 7298 1 1145 . 1 1 101 101 VAL CG2 C 13 22.040 0.400 . 1 . . . . 101 VAL CG2 . 7298 1 1146 . 1 1 101 101 VAL N N 15 122.187 0.400 . 1 . . . . 101 VAL N . 7298 1 1147 . 1 1 102 102 CYS H H 1 9.653 0.020 . 1 . . . . 102 CYS H . 7298 1 1148 . 1 1 102 102 CYS HA H 1 3.842 0.020 . 1 . . . . 102 CYS HA . 7298 1 1149 . 1 1 102 102 CYS HB2 H 1 2.425 0.020 . 2 . . . . 102 CYS HB2 . 7298 1 1150 . 1 1 102 102 CYS HB3 H 1 2.773 0.020 . 2 . . . . 102 CYS HB3 . 7298 1 1151 . 1 1 102 102 CYS CA C 13 63.779 0.400 . 1 . . . . 102 CYS CA . 7298 1 1152 . 1 1 102 102 CYS CB C 13 29.746 0.400 . 1 . . . . 102 CYS CB . 7298 1 1153 . 1 1 102 102 CYS N N 15 125.309 0.400 . 1 . . . . 102 CYS N . 7298 1 1154 . 1 1 103 103 ASP H H 1 8.081 0.020 . 1 . . . . 103 ASP H . 7298 1 1155 . 1 1 103 103 ASP HA H 1 4.211 0.020 . 1 . . . . 103 ASP HA . 7298 1 1156 . 1 1 103 103 ASP HB2 H 1 2.192 0.020 . 2 . . . . 103 ASP HB2 . 7298 1 1157 . 1 1 103 103 ASP HB3 H 1 3.262 0.020 . 2 . . . . 103 ASP HB3 . 7298 1 1158 . 1 1 103 103 ASP CA C 13 53.925 0.400 . 1 . . . . 103 ASP CA . 7298 1 1159 . 1 1 103 103 ASP CB C 13 39.162 0.400 . 1 . . . . 103 ASP CB . 7298 1 1160 . 1 1 103 103 ASP N N 15 118.853 0.400 . 1 . . . . 103 ASP N . 7298 1 1161 . 1 1 104 104 ASN H H 1 6.529 0.020 . 1 . . . . 104 ASN H . 7298 1 1162 . 1 1 104 104 ASN HA H 1 3.801 0.020 . 1 . . . . 104 ASN HA . 7298 1 1163 . 1 1 104 104 ASN HB2 H 1 2.294 0.020 . 2 . . . . 104 ASN HB2 . 7298 1 1164 . 1 1 104 104 ASN HB3 H 1 2.387 0.020 . 2 . . . . 104 ASN HB3 . 7298 1 1165 . 1 1 104 104 ASN HD21 H 1 6.973 0.020 . 2 . . . . 104 ASN HD21 . 7298 1 1166 . 1 1 104 104 ASN HD22 H 1 7.401 0.020 . 2 . . . . 104 ASN HD22 . 7298 1 1167 . 1 1 104 104 ASN CA C 13 50.876 0.400 . 1 . . . . 104 ASN CA . 7298 1 1168 . 1 1 104 104 ASN CB C 13 42.462 0.400 . 1 . . . . 104 ASN CB . 7298 1 1169 . 1 1 104 104 ASN N N 15 112.402 0.400 . 1 . . . . 104 ASN N . 7298 1 1170 . 1 1 104 104 ASN ND2 N 15 112.194 0.400 . 1 . . . . 104 ASN ND2 . 7298 1 1171 . 1 1 105 105 GLU H H 1 7.730 0.020 . 1 . . . . 105 GLU H . 7298 1 1172 . 1 1 105 105 GLU HA H 1 4.646 0.020 . 1 . . . . 105 GLU HA . 7298 1 1173 . 1 1 105 105 GLU HB2 H 1 1.928 0.020 . 2 . . . . 105 GLU HB2 . 7298 1 1174 . 1 1 105 105 GLU HB3 H 1 2.118 0.020 . 2 . . . . 105 GLU HB3 . 7298 1 1175 . 1 1 105 105 GLU HG2 H 1 2.323 0.020 . 2 . . . . 105 GLU HG2 . 7298 1 1176 . 1 1 105 105 GLU HG3 H 1 2.764 0.020 . 2 . . . . 105 GLU HG3 . 7298 1 1177 . 1 1 105 105 GLU CA C 13 55.386 0.400 . 1 . . . . 105 GLU CA . 7298 1 1178 . 1 1 105 105 GLU CB C 13 30.532 0.400 . 1 . . . . 105 GLU CB . 7298 1 1179 . 1 1 105 105 GLU CG C 13 36.706 0.400 . 1 . . . . 105 GLU CG . 7298 1 1180 . 1 1 105 105 GLU N N 15 119.885 0.400 . 1 . . . . 105 GLU N . 7298 1 1181 . 1 1 106 106 VAL H H 1 8.682 0.020 . 1 . . . . 106 VAL H . 7298 1 1182 . 1 1 106 106 VAL HA H 1 4.108 0.020 . 1 . . . . 106 VAL HA . 7298 1 1183 . 1 1 106 106 VAL HB H 1 1.825 0.020 . 1 . . . . 106 VAL HB . 7298 1 1184 . 1 1 106 106 VAL HG11 H 1 0.994 0.020 . 2 . . . . 106 VAL HG1 . 7298 1 1185 . 1 1 106 106 VAL HG12 H 1 0.994 0.020 . 2 . . . . 106 VAL HG1 . 7298 1 1186 . 1 1 106 106 VAL HG13 H 1 0.994 0.020 . 2 . . . . 106 VAL HG1 . 7298 1 1187 . 1 1 106 106 VAL HG21 H 1 0.906 0.020 . 2 . . . . 106 VAL HG2 . 7298 1 1188 . 1 1 106 106 VAL HG22 H 1 0.906 0.020 . 2 . . . . 106 VAL HG2 . 7298 1 1189 . 1 1 106 106 VAL HG23 H 1 0.906 0.020 . 2 . . . . 106 VAL HG2 . 7298 1 1190 . 1 1 106 106 VAL CA C 13 61.506 0.400 . 1 . . . . 106 VAL CA . 7298 1 1191 . 1 1 106 106 VAL CB C 13 33.475 0.400 . 1 . . . . 106 VAL CB . 7298 1 1192 . 1 1 106 106 VAL CG1 C 13 21.791 0.400 . 1 . . . . 106 VAL CG1 . 7298 1 1193 . 1 1 106 106 VAL CG2 C 13 22.155 0.400 . 1 . . . . 106 VAL CG2 . 7298 1 1194 . 1 1 106 106 VAL N N 15 126.060 0.400 . 1 . . . . 106 VAL N . 7298 1 1195 . 1 1 107 107 GLN H H 1 8.455 0.020 . 1 . . . . 107 GLN H . 7298 1 1196 . 1 1 107 107 GLN HA H 1 4.445 0.020 . 1 . . . . 107 GLN HA . 7298 1 1197 . 1 1 107 107 GLN HB2 H 1 1.935 0.020 . 2 . . . . 107 GLN HB2 . 7298 1 1198 . 1 1 107 107 GLN HB3 H 1 2.070 0.020 . 2 . . . . 107 GLN HB3 . 7298 1 1199 . 1 1 107 107 GLN HG2 H 1 2.381 0.020 . 1 . . . . 107 GLN HG2 . 7298 1 1200 . 1 1 107 107 GLN HG3 H 1 2.381 0.020 . 1 . . . . 107 GLN HG3 . 7298 1 1201 . 1 1 107 107 GLN HE21 H 1 6.829 0.020 . 2 . . . . 107 GLN HE21 . 7298 1 1202 . 1 1 107 107 GLN HE22 H 1 7.578 0.020 . 2 . . . . 107 GLN HE22 . 7298 1 1203 . 1 1 107 107 GLN CA C 13 55.668 0.400 . 1 . . . . 107 GLN CA . 7298 1 1204 . 1 1 107 107 GLN CB C 13 29.009 0.400 . 1 . . . . 107 GLN CB . 7298 1 1205 . 1 1 107 107 GLN CG C 13 33.832 0.400 . 1 . . . . 107 GLN CG . 7298 1 1206 . 1 1 107 107 GLN N N 15 126.156 0.400 . 1 . . . . 107 GLN N . 7298 1 1207 . 1 1 107 107 GLN NE2 N 15 112.611 0.400 . 1 . . . . 107 GLN NE2 . 7298 1 1208 . 1 1 108 108 TYR H H 1 8.174 0.020 . 1 . . . . 108 TYR H . 7298 1 1209 . 1 1 108 108 TYR HA H 1 5.010 0.020 . 1 . . . . 108 TYR HA . 7298 1 1210 . 1 1 108 108 TYR HB2 H 1 2.967 0.020 . 2 . . . . 108 TYR HB2 . 7298 1 1211 . 1 1 108 108 TYR HB3 H 1 3.123 0.020 . 2 . . . . 108 TYR HB3 . 7298 1 1212 . 1 1 108 108 TYR HD1 H 1 6.945 0.020 . 1 . . . . 108 TYR HD1 . 7298 1 1213 . 1 1 108 108 TYR HD2 H 1 6.945 0.020 . 1 . . . . 108 TYR HD2 . 7298 1 1214 . 1 1 108 108 TYR HE1 H 1 7.065 0.020 . 1 . . . . 108 TYR HE1 . 7298 1 1215 . 1 1 108 108 TYR HE2 H 1 7.065 0.020 . 1 . . . . 108 TYR HE2 . 7298 1 1216 . 1 1 108 108 TYR CA C 13 56.439 0.400 . 1 . . . . 108 TYR CA . 7298 1 1217 . 1 1 108 108 TYR CB C 13 40.187 0.400 . 1 . . . . 108 TYR CB . 7298 1 1218 . 1 1 108 108 TYR CD1 C 13 133.541 0.400 . 1 . . . . 108 TYR CD1 . 7298 1 1219 . 1 1 108 108 TYR CE1 C 13 118.393 0.400 . 1 . . . . 108 TYR CE1 . 7298 1 1220 . 1 1 108 108 TYR N N 15 117.565 0.400 . 1 . . . . 108 TYR N . 7298 1 1221 . 1 1 109 109 CYS H H 1 7.825 0.020 . 1 . . . . 109 CYS H . 7298 1 1222 . 1 1 109 109 CYS HA H 1 4.968 0.020 . 1 . . . . 109 CYS HA . 7298 1 1223 . 1 1 109 109 CYS HB2 H 1 3.066 0.020 . 2 . . . . 109 CYS HB2 . 7298 1 1224 . 1 1 109 109 CYS HB3 H 1 3.149 0.020 . 2 . . . . 109 CYS HB3 . 7298 1 1225 . 1 1 109 109 CYS CA C 13 56.131 0.400 . 1 . . . . 109 CYS CA . 7298 1 1226 . 1 1 109 109 CYS CB C 13 29.995 0.400 . 1 . . . . 109 CYS CB . 7298 1 1227 . 1 1 109 109 CYS N N 15 114.898 0.400 . 1 . . . . 109 CYS N . 7298 1 1228 . 1 1 111 111 SER H H 1 7.810 0.020 . 1 . . . . 111 SER H . 7298 1 1229 . 1 1 111 111 SER HA H 1 4.522 0.020 . 1 . . . . 111 SER HA . 7298 1 1230 . 1 1 111 111 SER HB2 H 1 3.846 0.020 . 2 . . . . 111 SER HB2 . 7298 1 1231 . 1 1 111 111 SER HB3 H 1 4.063 0.020 . 2 . . . . 111 SER HB3 . 7298 1 1232 . 1 1 111 111 SER CA C 13 58.080 0.400 . 1 . . . . 111 SER CA . 7298 1 1233 . 1 1 111 111 SER CB C 13 63.796 0.400 . 1 . . . . 111 SER CB . 7298 1 1234 . 1 1 111 111 SER N N 15 112.049 0.400 . 1 . . . . 111 SER N . 7298 1 1235 . 1 1 112 112 ASN HA H 1 4.985 0.020 . 1 . . . . 112 ASN HA . 7298 1 1236 . 1 1 112 112 ASN HB2 H 1 3.043 0.020 . 2 . . . . 112 ASN HB2 . 7298 1 1237 . 1 1 112 112 ASN HB3 H 1 3.394 0.020 . 2 . . . . 112 ASN HB3 . 7298 1 1238 . 1 1 112 112 ASN HD21 H 1 6.985 0.020 . 2 . . . . 112 ASN HD21 . 7298 1 1239 . 1 1 112 112 ASN HD22 H 1 7.705 0.020 . 2 . . . . 112 ASN HD22 . 7298 1 1240 . 1 1 112 112 ASN CA C 13 51.373 0.400 . 1 . . . . 112 ASN CA . 7298 1 1241 . 1 1 112 112 ASN CB C 13 39.689 0.400 . 1 . . . . 112 ASN CB . 7298 1 1242 . 1 1 112 112 ASN ND2 N 15 110.737 0.400 . 1 . . . . 112 ASN ND2 . 7298 1 1243 . 1 1 113 113 GLN HA H 1 3.967 0.020 . 1 . . . . 113 GLN HA . 7298 1 1244 . 1 1 113 113 GLN HB2 H 1 1.967 0.020 . 2 . . . . 113 GLN HB2 . 7298 1 1245 . 1 1 113 113 GLN HB3 H 1 2.078 0.020 . 2 . . . . 113 GLN HB3 . 7298 1 1246 . 1 1 113 113 GLN HG2 H 1 2.273 0.020 . 2 . . . . 113 GLN HG2 . 7298 1 1247 . 1 1 113 113 GLN HG3 H 1 2.459 0.020 . 2 . . . . 113 GLN HG3 . 7298 1 1248 . 1 1 113 113 GLN HE21 H 1 6.906 0.020 . 2 . . . . 113 GLN HE21 . 7298 1 1249 . 1 1 113 113 GLN HE22 H 1 7.493 0.020 . 2 . . . . 113 GLN HE22 . 7298 1 1250 . 1 1 113 113 GLN CA C 13 59.471 0.400 . 1 . . . . 113 GLN CA . 7298 1 1251 . 1 1 113 113 GLN CB C 13 28.247 0.400 . 1 . . . . 113 GLN CB . 7298 1 1252 . 1 1 113 113 GLN CG C 13 33.832 0.400 . 1 . . . . 113 GLN CG . 7298 1 1253 . 1 1 113 113 GLN NE2 N 15 111.362 0.400 . 1 . . . . 113 GLN NE2 . 7298 1 1254 . 1 1 114 114 LEU H H 1 8.368 0.020 . 1 . . . . 114 LEU H . 7298 1 1255 . 1 1 114 114 LEU HA H 1 4.065 0.020 . 1 . . . . 114 LEU HA . 7298 1 1256 . 1 1 114 114 LEU HB2 H 1 1.485 0.020 . 2 . . . . 114 LEU HB2 . 7298 1 1257 . 1 1 114 114 LEU HB3 H 1 1.838 0.020 . 2 . . . . 114 LEU HB3 . 7298 1 1258 . 1 1 114 114 LEU HG H 1 1.246 0.020 . 1 . . . . 114 LEU HG . 7298 1 1259 . 1 1 114 114 LEU HD11 H 1 0.915 0.020 . 2 . . . . 114 LEU HD1 . 7298 1 1260 . 1 1 114 114 LEU HD12 H 1 0.915 0.020 . 2 . . . . 114 LEU HD1 . 7298 1 1261 . 1 1 114 114 LEU HD13 H 1 0.915 0.020 . 2 . . . . 114 LEU HD1 . 7298 1 1262 . 1 1 114 114 LEU HD21 H 1 0.937 0.020 . 2 . . . . 114 LEU HD2 . 7298 1 1263 . 1 1 114 114 LEU HD22 H 1 0.937 0.020 . 2 . . . . 114 LEU HD2 . 7298 1 1264 . 1 1 114 114 LEU HD23 H 1 0.937 0.020 . 2 . . . . 114 LEU HD2 . 7298 1 1265 . 1 1 114 114 LEU CA C 13 57.682 0.400 . 1 . . . . 114 LEU CA . 7298 1 1266 . 1 1 114 114 LEU CB C 13 41.447 0.400 . 1 . . . . 114 LEU CB . 7298 1 1267 . 1 1 114 114 LEU CG C 13 26.763 0.400 . 1 . . . . 114 LEU CG . 7298 1 1268 . 1 1 114 114 LEU CD1 C 13 23.781 0.400 . 1 . . . . 114 LEU CD1 . 7298 1 1269 . 1 1 114 114 LEU CD2 C 13 26.470 0.400 . 1 . . . . 114 LEU CD2 . 7298 1 1270 . 1 1 114 114 LEU N N 15 118.619 0.400 . 1 . . . . 114 LEU N . 7298 1 1271 . 1 1 115 115 GLY H H 1 8.376 0.020 . 1 . . . . 115 GLY H . 7298 1 1272 . 1 1 115 115 GLY HA2 H 1 3.523 0.020 . 2 . . . . 115 GLY HA2 . 7298 1 1273 . 1 1 115 115 GLY HA3 H 1 4.529 0.020 . 2 . . . . 115 GLY HA3 . 7298 1 1274 . 1 1 115 115 GLY CA C 13 47.396 0.400 . 1 . . . . 115 GLY CA . 7298 1 1275 . 1 1 115 115 GLY N N 15 106.110 0.400 . 1 . . . . 115 GLY N . 7298 1 1276 . 1 1 116 116 GLN H H 1 8.321 0.020 . 1 . . . . 116 GLN H . 7298 1 1277 . 1 1 116 116 GLN HA H 1 4.233 0.020 . 1 . . . . 116 GLN HA . 7298 1 1278 . 1 1 116 116 GLN HB2 H 1 2.132 0.020 . 2 . . . . 116 GLN HB2 . 7298 1 1279 . 1 1 116 116 GLN HB3 H 1 2.218 0.020 . 2 . . . . 116 GLN HB3 . 7298 1 1280 . 1 1 116 116 GLN HG2 H 1 2.469 0.020 . 2 . . . . 116 GLN HG2 . 7298 1 1281 . 1 1 116 116 GLN HG3 H 1 2.571 0.020 . 2 . . . . 116 GLN HG3 . 7298 1 1282 . 1 1 116 116 GLN HE21 H 1 6.803 0.020 . 2 . . . . 116 GLN HE21 . 7298 1 1283 . 1 1 116 116 GLN HE22 H 1 7.219 0.020 . 2 . . . . 116 GLN HE22 . 7298 1 1284 . 1 1 116 116 GLN CA C 13 58.582 0.400 . 1 . . . . 116 GLN CA . 7298 1 1285 . 1 1 116 116 GLN CB C 13 28.247 0.400 . 1 . . . . 116 GLN CB . 7298 1 1286 . 1 1 116 116 GLN CG C 13 34.200 0.400 . 1 . . . . 116 GLN CG . 7298 1 1287 . 1 1 116 116 GLN N N 15 120.314 0.400 . 1 . . . . 116 GLN N . 7298 1 1288 . 1 1 116 116 GLN NE2 N 15 111.570 0.400 . 1 . . . . 116 GLN NE2 . 7298 1 1289 . 1 1 117 117 VAL H H 1 7.905 0.020 . 1 . . . . 117 VAL H . 7298 1 1290 . 1 1 117 117 VAL HA H 1 3.836 0.020 . 1 . . . . 117 VAL HA . 7298 1 1291 . 1 1 117 117 VAL HB H 1 2.300 0.020 . 1 . . . . 117 VAL HB . 7298 1 1292 . 1 1 117 117 VAL HG11 H 1 0.995 0.020 . 2 . . . . 117 VAL HG1 . 7298 1 1293 . 1 1 117 117 VAL HG12 H 1 0.995 0.020 . 2 . . . . 117 VAL HG1 . 7298 1 1294 . 1 1 117 117 VAL HG13 H 1 0.995 0.020 . 2 . . . . 117 VAL HG1 . 7298 1 1295 . 1 1 117 117 VAL HG21 H 1 1.148 0.020 . 2 . . . . 117 VAL HG2 . 7298 1 1296 . 1 1 117 117 VAL HG22 H 1 1.148 0.020 . 2 . . . . 117 VAL HG2 . 7298 1 1297 . 1 1 117 117 VAL HG23 H 1 1.148 0.020 . 2 . . . . 117 VAL HG2 . 7298 1 1298 . 1 1 117 117 VAL CA C 13 66.589 0.400 . 1 . . . . 117 VAL CA . 7298 1 1299 . 1 1 117 117 VAL CB C 13 31.237 0.400 . 1 . . . . 117 VAL CB . 7298 1 1300 . 1 1 117 117 VAL CG1 C 13 22.040 0.400 . 1 . . . . 117 VAL CG1 . 7298 1 1301 . 1 1 117 117 VAL CG2 C 13 23.780 0.400 . 1 . . . . 117 VAL CG2 . 7298 1 1302 . 1 1 117 117 VAL N N 15 122.355 0.400 . 1 . . . . 117 VAL N . 7298 1 1303 . 1 1 118 118 VAL H H 1 8.384 0.020 . 1 . . . . 118 VAL H . 7298 1 1304 . 1 1 118 118 VAL HA H 1 3.326 0.020 . 1 . . . . 118 VAL HA . 7298 1 1305 . 1 1 118 118 VAL HB H 1 1.865 0.020 . 1 . . . . 118 VAL HB . 7298 1 1306 . 1 1 118 118 VAL HG11 H 1 1.059 0.020 . 2 . . . . 118 VAL HG1 . 7298 1 1307 . 1 1 118 118 VAL HG12 H 1 1.059 0.020 . 2 . . . . 118 VAL HG1 . 7298 1 1308 . 1 1 118 118 VAL HG13 H 1 1.059 0.020 . 2 . . . . 118 VAL HG1 . 7298 1 1309 . 1 1 118 118 VAL HG21 H 1 0.605 0.020 . 2 . . . . 118 VAL HG2 . 7298 1 1310 . 1 1 118 118 VAL HG22 H 1 0.605 0.020 . 2 . . . . 118 VAL HG2 . 7298 1 1311 . 1 1 118 118 VAL HG23 H 1 0.605 0.020 . 2 . . . . 118 VAL HG2 . 7298 1 1312 . 1 1 118 118 VAL CA C 13 68.081 0.400 . 1 . . . . 118 VAL CA . 7298 1 1313 . 1 1 118 118 VAL CB C 13 31.237 0.400 . 1 . . . . 118 VAL CB . 7298 1 1314 . 1 1 118 118 VAL CG1 C 13 21.294 0.400 . 1 . . . . 118 VAL CG1 . 7298 1 1315 . 1 1 118 118 VAL CG2 C 13 22.040 0.400 . 1 . . . . 118 VAL CG2 . 7298 1 1316 . 1 1 118 118 VAL N N 15 121.147 0.400 . 1 . . . . 118 VAL N . 7298 1 1317 . 1 1 119 119 ASP H H 1 8.069 0.020 . 1 . . . . 119 ASP H . 7298 1 1318 . 1 1 119 119 ASP HA H 1 4.159 0.020 . 1 . . . . 119 ASP HA . 7298 1 1319 . 1 1 119 119 ASP HB2 H 1 2.594 0.020 . 2 . . . . 119 ASP HB2 . 7298 1 1320 . 1 1 119 119 ASP HB3 H 1 2.752 0.020 . 2 . . . . 119 ASP HB3 . 7298 1 1321 . 1 1 119 119 ASP CA C 13 57.588 0.400 . 1 . . . . 119 ASP CA . 7298 1 1322 . 1 1 119 119 ASP CB C 13 41.193 0.400 . 1 . . . . 119 ASP CB . 7298 1 1323 . 1 1 119 119 ASP N N 15 117.397 0.400 . 1 . . . . 119 ASP N . 7298 1 1324 . 1 1 120 120 TYR H H 1 7.669 0.020 . 1 . . . . 120 TYR H . 7298 1 1325 . 1 1 120 120 TYR HA H 1 4.068 0.020 . 1 . . . . 120 TYR HA . 7298 1 1326 . 1 1 120 120 TYR HB2 H 1 3.240 0.020 . 2 . . . . 120 TYR HB2 . 7298 1 1327 . 1 1 120 120 TYR HB3 H 1 3.386 0.020 . 2 . . . . 120 TYR HB3 . 7298 1 1328 . 1 1 120 120 TYR HD1 H 1 7.061 0.020 . 1 . . . . 120 TYR HD1 . 7298 1 1329 . 1 1 120 120 TYR HD2 H 1 7.061 0.020 . 1 . . . . 120 TYR HD2 . 7298 1 1330 . 1 1 120 120 TYR HE1 H 1 6.754 0.020 . 1 . . . . 120 TYR HE1 . 7298 1 1331 . 1 1 120 120 TYR HE2 H 1 6.754 0.020 . 1 . . . . 120 TYR HE2 . 7298 1 1332 . 1 1 120 120 TYR CA C 13 61.565 0.400 . 1 . . . . 120 TYR CA . 7298 1 1333 . 1 1 120 120 TYR CB C 13 37.701 0.400 . 1 . . . . 120 TYR CB . 7298 1 1334 . 1 1 120 120 TYR CD1 C 13 133.075 0.400 . 1 . . . . 120 TYR CD1 . 7298 1 1335 . 1 1 120 120 TYR CE1 C 13 117.927 0.400 . 1 . . . . 120 TYR CE1 . 7298 1 1336 . 1 1 120 120 TYR N N 15 119.273 0.400 . 1 . . . . 120 TYR N . 7298 1 1337 . 1 1 121 121 VAL H H 1 8.432 0.020 . 1 . . . . 121 VAL H . 7298 1 1338 . 1 1 121 121 VAL HA H 1 3.177 0.020 . 1 . . . . 121 VAL HA . 7298 1 1339 . 1 1 121 121 VAL HB H 1 2.235 0.020 . 1 . . . . 121 VAL HB . 7298 1 1340 . 1 1 121 121 VAL HG11 H 1 1.157 0.020 . 2 . . . . 121 VAL HG1 . 7298 1 1341 . 1 1 121 121 VAL HG12 H 1 1.157 0.020 . 2 . . . . 121 VAL HG1 . 7298 1 1342 . 1 1 121 121 VAL HG13 H 1 1.157 0.020 . 2 . . . . 121 VAL HG1 . 7298 1 1343 . 1 1 121 121 VAL HG21 H 1 1.157 0.020 . 2 . . . . 121 VAL HG2 . 7298 1 1344 . 1 1 121 121 VAL HG22 H 1 1.157 0.020 . 2 . . . . 121 VAL HG2 . 7298 1 1345 . 1 1 121 121 VAL HG23 H 1 1.157 0.020 . 2 . . . . 121 VAL HG2 . 7298 1 1346 . 1 1 121 121 VAL CA C 13 67.309 0.400 . 1 . . . . 121 VAL CA . 7298 1 1347 . 1 1 121 121 VAL CB C 13 31.237 0.400 . 1 . . . . 121 VAL CB . 7298 1 1348 . 1 1 121 121 VAL CG1 C 13 22.786 0.400 . 1 . . . . 121 VAL CG1 . 7298 1 1349 . 1 1 121 121 VAL N N 15 120.314 0.400 . 1 . . . . 121 VAL N . 7298 1 1350 . 1 1 122 122 ARG H H 1 8.587 0.020 . 1 . . . . 122 ARG H . 7298 1 1351 . 1 1 122 122 ARG HA H 1 3.304 0.020 . 1 . . . . 122 ARG HA . 7298 1 1352 . 1 1 122 122 ARG HB2 H 1 0.945 0.020 . 2 . . . . 122 ARG HB2 . 7298 1 1353 . 1 1 122 122 ARG HB3 H 1 1.329 0.020 . 2 . . . . 122 ARG HB3 . 7298 1 1354 . 1 1 122 122 ARG HG2 H 1 0.170 0.020 . 2 . . . . 122 ARG HG2 . 7298 1 1355 . 1 1 122 122 ARG HG3 H 1 0.624 0.020 . 2 . . . . 122 ARG HG3 . 7298 1 1356 . 1 1 122 122 ARG HD2 H 1 2.162 0.020 . 1 . . . . 122 ARG HD2 . 7298 1 1357 . 1 1 122 122 ARG HD3 H 1 2.162 0.020 . 1 . . . . 122 ARG HD3 . 7298 1 1358 . 1 1 122 122 ARG CA C 13 59.328 0.400 . 1 . . . . 122 ARG CA . 7298 1 1359 . 1 1 122 122 ARG CB C 13 29.770 0.400 . 1 . . . . 122 ARG CB . 7298 1 1360 . 1 1 122 122 ARG CG C 13 25.963 0.400 . 1 . . . . 122 ARG CG . 7298 1 1361 . 1 1 122 122 ARG CD C 13 43.223 0.400 . 1 . . . . 122 ARG CD . 7298 1 1362 . 1 1 122 122 ARG N N 15 118.647 0.400 . 1 . . . . 122 ARG N . 7298 1 1363 . 1 1 123 123 LYS H H 1 7.601 0.020 . 1 . . . . 123 LYS H . 7298 1 1364 . 1 1 123 123 LYS HA H 1 3.864 0.020 . 1 . . . . 123 LYS HA . 7298 1 1365 . 1 1 123 123 LYS HB2 H 1 1.740 0.020 . 1 . . . . 123 LYS HB2 . 7298 1 1366 . 1 1 123 123 LYS HB3 H 1 1.740 0.020 . 1 . . . . 123 LYS HB3 . 7298 1 1367 . 1 1 123 123 LYS HG2 H 1 1.315 0.020 . 2 . . . . 123 LYS HG2 . 7298 1 1368 . 1 1 123 123 LYS HG3 H 1 1.443 0.020 . 2 . . . . 123 LYS HG3 . 7298 1 1369 . 1 1 123 123 LYS HD2 H 1 1.558 0.020 . 1 . . . . 123 LYS HD2 . 7298 1 1370 . 1 1 123 123 LYS HD3 H 1 1.558 0.020 . 1 . . . . 123 LYS HD3 . 7298 1 1371 . 1 1 123 123 LYS HE2 H 1 2.907 0.020 . 1 . . . . 123 LYS HE2 . 7298 1 1372 . 1 1 123 123 LYS HE3 H 1 2.907 0.020 . 1 . . . . 123 LYS HE3 . 7298 1 1373 . 1 1 123 123 LYS CA C 13 58.333 0.400 . 1 . . . . 123 LYS CA . 7298 1 1374 . 1 1 123 123 LYS CB C 13 32.055 0.400 . 1 . . . . 123 LYS CB . 7298 1 1375 . 1 1 123 123 LYS CG C 13 25.520 0.400 . 1 . . . . 123 LYS CG . 7298 1 1376 . 1 1 123 123 LYS CD C 13 28.755 0.400 . 1 . . . . 123 LYS CD . 7298 1 1377 . 1 1 123 123 LYS CE C 13 41.700 0.400 . 1 . . . . 123 LYS CE . 7298 1 1378 . 1 1 123 123 LYS N N 15 117.601 0.400 . 1 . . . . 123 LYS N . 7298 1 1379 . 1 1 124 124 GLN H H 1 7.578 0.020 . 1 . . . . 124 GLN H . 7298 1 1380 . 1 1 124 124 GLN HA H 1 4.005 0.020 . 1 . . . . 124 GLN HA . 7298 1 1381 . 1 1 124 124 GLN HB2 H 1 1.916 0.020 . 2 . . . . 124 GLN HB2 . 7298 1 1382 . 1 1 124 124 GLN HB3 H 1 2.209 0.020 . 2 . . . . 124 GLN HB3 . 7298 1 1383 . 1 1 124 124 GLN HG2 H 1 2.074 0.020 . 2 . . . . 124 GLN HG2 . 7298 1 1384 . 1 1 124 124 GLN HG3 H 1 2.173 0.020 . 2 . . . . 124 GLN HG3 . 7298 1 1385 . 1 1 124 124 GLN HE21 H 1 6.565 0.020 . 2 . . . . 124 GLN HE21 . 7298 1 1386 . 1 1 124 124 GLN HE22 H 1 6.698 0.020 . 2 . . . . 124 GLN HE22 . 7298 1 1387 . 1 1 124 124 GLN CA C 13 55.910 0.400 . 1 . . . . 124 GLN CA . 7298 1 1388 . 1 1 124 124 GLN CB C 13 28.247 0.400 . 1 . . . . 124 GLN CB . 7298 1 1389 . 1 1 124 124 GLN CG C 13 32.978 0.400 . 1 . . . . 124 GLN CG . 7298 1 1390 . 1 1 124 124 GLN N N 15 116.981 0.400 . 1 . . . . 124 GLN N . 7298 1 1391 . 1 1 124 124 GLN NE2 N 15 113.444 0.400 . 1 . . . . 124 GLN NE2 . 7298 1 1392 . 1 1 125 125 ALA H H 1 7.261 0.020 . 1 . . . . 125 ALA H . 7298 1 1393 . 1 1 125 125 ALA HA H 1 2.767 0.020 . 1 . . . . 125 ALA HA . 7298 1 1394 . 1 1 125 125 ALA HB1 H 1 0.722 0.020 . 1 . . . . 125 ALA HB . 7298 1 1395 . 1 1 125 125 ALA HB2 H 1 0.722 0.020 . 1 . . . . 125 ALA HB . 7298 1 1396 . 1 1 125 125 ALA HB3 H 1 0.722 0.020 . 1 . . . . 125 ALA HB . 7298 1 1397 . 1 1 125 125 ALA CA C 13 52.216 0.400 . 1 . . . . 125 ALA CA . 7298 1 1398 . 1 1 125 125 ALA CB C 13 18.602 0.400 . 1 . . . . 125 ALA CB . 7298 1 1399 . 1 1 125 125 ALA N N 15 120.523 0.400 . 1 . . . . 125 ALA N . 7298 1 1400 . 1 1 126 126 SER H H 1 6.802 0.020 . 1 . . . . 126 SER H . 7298 1 1401 . 1 1 126 126 SER HA H 1 4.195 0.020 . 1 . . . . 126 SER HA . 7298 1 1402 . 1 1 126 126 SER HB2 H 1 3.816 0.020 . 1 . . . . 126 SER HB2 . 7298 1 1403 . 1 1 126 126 SER HB3 H 1 3.816 0.020 . 1 . . . . 126 SER HB3 . 7298 1 1404 . 1 1 126 126 SER CA C 13 59.825 0.400 . 1 . . . . 126 SER CA . 7298 1 1405 . 1 1 126 126 SER CB C 13 64.799 0.400 . 1 . . . . 126 SER CB . 7298 1 1406 . 1 1 126 126 SER N N 15 119.257 0.400 . 1 . . . . 126 SER N . 7298 1 stop_ save_