data_27880 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27880 _Entry.Title ; 1H, 13C, 15N Backbone chemical Shift Assignment of the RYMV-encoded viral supressor of RNA silencing P1 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-04-17 _Entry.Accession_date 2019-04-17 _Entry.Last_release_date 2019-04-17 _Entry.Original_release_date 2019-04-17 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Backbone assignment of the P1 protein of Rice Yellow Mottle VIRUS (RYMV).' _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.ORCID _Entry_author.Entry_ID 1 Yinshan Yang . . . . 27880 2 Francois-Xavier Gillet . . . . 27880 3 Francois Hoh . . . . 27880 4 Christophe Brugidou . . . . 27880 5 Florence Vignols . . . . 27880 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Centre de Biochimie Structurale' . 27880 2 . CNRS . 27880 3 . INSERM . 27880 4 . 'Univ Montpellier' . 27880 5 . IRD . 27880 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27880 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 422 27880 '15N chemical shifts' 152 27880 '1H chemical shifts' 317 27880 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2019-12-23 2019-04-17 update BMRB 'update entry citation' 27880 1 . . 2019-08-14 2019-04-17 original author 'original release' 27880 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27880 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 31346897 _Citation.Full_citation . _Citation.Title ; NMR chemical shift backbone assignment of the viral protein P1 encoded by the African Rice Yellow Mottle Virus ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 13 _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 345 _Citation.Page_last 348 _Citation.Year 2019 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yinshan Yang . . . . 27880 1 2 Vianney Poignavent . . . . 27880 1 3 Francois-Xavier Gillet . . . . 27880 1 4 Francois Hoh . . . . 27880 1 5 Christophe Brugidou . . . . 27880 1 6 Florence Vignols . . . . 27880 1 7 Helene Demene . . . . 27880 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'RNA silencing' 27880 1 RYMV 27880 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27880 _Assembly.ID 1 _Assembly.Name 'RYMV P1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'RYMV P1' 1 $RYMV_P1 A . yes native no no . . . 27880 1 2 'ZINC ION, 1' 2 $entity_ZN B . no native no no . . . 27880 1 3 'ZINC ION, 2' 2 $entity_ZN C . no native no no . . . 27880 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 coordination single . 1 . 1 CYS 64 64 SG . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 2 coordination single . 1 . 1 CYS 67 67 SG . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 3 coordination single . 1 . 1 CYS 92 92 SG . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 4 coordination single . 1 . 1 CYS 95 95 SG . 2 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 5 coordination single . 1 . 1 HIS 109 109 HE1 . 3 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 6 coordination single . 1 . 1 CYS 140 140 SG . 3 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 7 coordination single . 1 . 1 HIS 145 145 HE1 . 3 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 8 coordination single . 1 . 1 CYS 149 149 SG . 3 . 2 ZN 1 1 ZN . . . . . . . . . . . . 27880 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RYMV_P1 _Entity.Sf_category entity _Entity.Sf_framecode RYMV_P1 _Entity.Entry_ID 27880 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RYMV_P1 _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 ; MTRLEVLIRPTEQTAAKANA VGYTHALTWVWHSQTWDVDS VRDPSLRADFNPEKVGWVSV SFACTQCTAHYYTSEQVKYF TNIPPVHFDVVCADCERSVQ LDDEIDREHQERNAEISACN ARALSEGRPASLVYLSRDAC DIPEHSGRCRFVKYLNF ; _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 157 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and other bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 27880 1 2 . THR . 27880 1 3 . ARG . 27880 1 4 . LEU . 27880 1 5 . GLU . 27880 1 6 . VAL . 27880 1 7 . LEU . 27880 1 8 . ILE . 27880 1 9 . ARG . 27880 1 10 . PRO . 27880 1 11 . THR . 27880 1 12 . GLU . 27880 1 13 . GLN . 27880 1 14 . THR . 27880 1 15 . ALA . 27880 1 16 . ALA . 27880 1 17 . LYS . 27880 1 18 . ALA . 27880 1 19 . ASN . 27880 1 20 . ALA . 27880 1 21 . VAL . 27880 1 22 . GLY . 27880 1 23 . TYR . 27880 1 24 . THR . 27880 1 25 . HIS . 27880 1 26 . ALA . 27880 1 27 . LEU . 27880 1 28 . THR . 27880 1 29 . TRP . 27880 1 30 . VAL . 27880 1 31 . TRP . 27880 1 32 . HIS . 27880 1 33 . SER . 27880 1 34 . GLN . 27880 1 35 . THR . 27880 1 36 . TRP . 27880 1 37 . ASP . 27880 1 38 . VAL . 27880 1 39 . ASP . 27880 1 40 . SER . 27880 1 41 . VAL . 27880 1 42 . ARG . 27880 1 43 . ASP . 27880 1 44 . PRO . 27880 1 45 . SER . 27880 1 46 . LEU . 27880 1 47 . ARG . 27880 1 48 . ALA . 27880 1 49 . ASP . 27880 1 50 . PHE . 27880 1 51 . ASN . 27880 1 52 . PRO . 27880 1 53 . GLU . 27880 1 54 . LYS . 27880 1 55 . VAL . 27880 1 56 . GLY . 27880 1 57 . TRP . 27880 1 58 . VAL . 27880 1 59 . SER . 27880 1 60 . VAL . 27880 1 61 . SER . 27880 1 62 . PHE . 27880 1 63 . ALA . 27880 1 64 . CYS . 27880 1 65 . THR . 27880 1 66 . GLN . 27880 1 67 . CYS . 27880 1 68 . THR . 27880 1 69 . ALA . 27880 1 70 . HIS . 27880 1 71 . TYR . 27880 1 72 . TYR . 27880 1 73 . THR . 27880 1 74 . SER . 27880 1 75 . GLU . 27880 1 76 . GLN . 27880 1 77 . VAL . 27880 1 78 . LYS . 27880 1 79 . TYR . 27880 1 80 . PHE . 27880 1 81 . THR . 27880 1 82 . ASN . 27880 1 83 . ILE . 27880 1 84 . PRO . 27880 1 85 . PRO . 27880 1 86 . VAL . 27880 1 87 . HIS . 27880 1 88 . PHE . 27880 1 89 . ASP . 27880 1 90 . VAL . 27880 1 91 . VAL . 27880 1 92 . CYS . 27880 1 93 . ALA . 27880 1 94 . ASP . 27880 1 95 . CYS . 27880 1 96 . GLU . 27880 1 97 . ARG . 27880 1 98 . SER . 27880 1 99 . VAL . 27880 1 100 . GLN . 27880 1 101 . LEU . 27880 1 102 . ASP . 27880 1 103 . ASP . 27880 1 104 . GLU . 27880 1 105 . ILE . 27880 1 106 . ASP . 27880 1 107 . ARG . 27880 1 108 . GLU . 27880 1 109 . HIS . 27880 1 110 . GLN . 27880 1 111 . GLU . 27880 1 112 . ARG . 27880 1 113 . ASN . 27880 1 114 . ALA . 27880 1 115 . GLU . 27880 1 116 . ILE . 27880 1 117 . SER . 27880 1 118 . ALA . 27880 1 119 . CYS . 27880 1 120 . ASN . 27880 1 121 . ALA . 27880 1 122 . ARG . 27880 1 123 . ALA . 27880 1 124 . LEU . 27880 1 125 . SER . 27880 1 126 . GLU . 27880 1 127 . GLY . 27880 1 128 . ARG . 27880 1 129 . PRO . 27880 1 130 . ALA . 27880 1 131 . SER . 27880 1 132 . LEU . 27880 1 133 . VAL . 27880 1 134 . TYR . 27880 1 135 . LEU . 27880 1 136 . SER . 27880 1 137 . ARG . 27880 1 138 . ASP . 27880 1 139 . ALA . 27880 1 140 . CYS . 27880 1 141 . ASP . 27880 1 142 . ILE . 27880 1 143 . PRO . 27880 1 144 . GLU . 27880 1 145 . HIS . 27880 1 146 . SER . 27880 1 147 . GLY . 27880 1 148 . ARG . 27880 1 149 . CYS . 27880 1 150 . ARG . 27880 1 151 . PHE . 27880 1 152 . VAL . 27880 1 153 . LYS . 27880 1 154 . TYR . 27880 1 155 . LEU . 27880 1 156 . ASN . 27880 1 157 . PHE . 27880 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 27880 1 . THR 2 2 27880 1 . ARG 3 3 27880 1 . LEU 4 4 27880 1 . GLU 5 5 27880 1 . VAL 6 6 27880 1 . LEU 7 7 27880 1 . ILE 8 8 27880 1 . ARG 9 9 27880 1 . PRO 10 10 27880 1 . THR 11 11 27880 1 . GLU 12 12 27880 1 . GLN 13 13 27880 1 . THR 14 14 27880 1 . ALA 15 15 27880 1 . ALA 16 16 27880 1 . LYS 17 17 27880 1 . ALA 18 18 27880 1 . ASN 19 19 27880 1 . ALA 20 20 27880 1 . VAL 21 21 27880 1 . GLY 22 22 27880 1 . TYR 23 23 27880 1 . THR 24 24 27880 1 . HIS 25 25 27880 1 . ALA 26 26 27880 1 . LEU 27 27 27880 1 . THR 28 28 27880 1 . TRP 29 29 27880 1 . VAL 30 30 27880 1 . TRP 31 31 27880 1 . HIS 32 32 27880 1 . SER 33 33 27880 1 . GLN 34 34 27880 1 . THR 35 35 27880 1 . TRP 36 36 27880 1 . ASP 37 37 27880 1 . VAL 38 38 27880 1 . ASP 39 39 27880 1 . SER 40 40 27880 1 . VAL 41 41 27880 1 . ARG 42 42 27880 1 . ASP 43 43 27880 1 . PRO 44 44 27880 1 . SER 45 45 27880 1 . LEU 46 46 27880 1 . ARG 47 47 27880 1 . ALA 48 48 27880 1 . ASP 49 49 27880 1 . PHE 50 50 27880 1 . ASN 51 51 27880 1 . PRO 52 52 27880 1 . GLU 53 53 27880 1 . LYS 54 54 27880 1 . VAL 55 55 27880 1 . GLY 56 56 27880 1 . TRP 57 57 27880 1 . VAL 58 58 27880 1 . SER 59 59 27880 1 . VAL 60 60 27880 1 . SER 61 61 27880 1 . PHE 62 62 27880 1 . ALA 63 63 27880 1 . CYS 64 64 27880 1 . THR 65 65 27880 1 . GLN 66 66 27880 1 . CYS 67 67 27880 1 . THR 68 68 27880 1 . ALA 69 69 27880 1 . HIS 70 70 27880 1 . TYR 71 71 27880 1 . TYR 72 72 27880 1 . THR 73 73 27880 1 . SER 74 74 27880 1 . GLU 75 75 27880 1 . GLN 76 76 27880 1 . VAL 77 77 27880 1 . LYS 78 78 27880 1 . TYR 79 79 27880 1 . PHE 80 80 27880 1 . THR 81 81 27880 1 . ASN 82 82 27880 1 . ILE 83 83 27880 1 . PRO 84 84 27880 1 . PRO 85 85 27880 1 . VAL 86 86 27880 1 . HIS 87 87 27880 1 . PHE 88 88 27880 1 . ASP 89 89 27880 1 . VAL 90 90 27880 1 . VAL 91 91 27880 1 . CYS 92 92 27880 1 . ALA 93 93 27880 1 . ASP 94 94 27880 1 . CYS 95 95 27880 1 . GLU 96 96 27880 1 . ARG 97 97 27880 1 . SER 98 98 27880 1 . VAL 99 99 27880 1 . GLN 100 100 27880 1 . LEU 101 101 27880 1 . ASP 102 102 27880 1 . ASP 103 103 27880 1 . GLU 104 104 27880 1 . ILE 105 105 27880 1 . ASP 106 106 27880 1 . ARG 107 107 27880 1 . GLU 108 108 27880 1 . HIS 109 109 27880 1 . GLN 110 110 27880 1 . GLU 111 111 27880 1 . ARG 112 112 27880 1 . ASN 113 113 27880 1 . ALA 114 114 27880 1 . GLU 115 115 27880 1 . ILE 116 116 27880 1 . SER 117 117 27880 1 . ALA 118 118 27880 1 . CYS 119 119 27880 1 . ASN 120 120 27880 1 . ALA 121 121 27880 1 . ARG 122 122 27880 1 . ALA 123 123 27880 1 . LEU 124 124 27880 1 . SER 125 125 27880 1 . GLU 126 126 27880 1 . GLY 127 127 27880 1 . ARG 128 128 27880 1 . PRO 129 129 27880 1 . ALA 130 130 27880 1 . SER 131 131 27880 1 . LEU 132 132 27880 1 . VAL 133 133 27880 1 . TYR 134 134 27880 1 . LEU 135 135 27880 1 . SER 136 136 27880 1 . ARG 137 137 27880 1 . ASP 138 138 27880 1 . ALA 139 139 27880 1 . CYS 140 140 27880 1 . ASP 141 141 27880 1 . ILE 142 142 27880 1 . PRO 143 143 27880 1 . GLU 144 144 27880 1 . HIS 145 145 27880 1 . SER 146 146 27880 1 . GLY 147 147 27880 1 . ARG 148 148 27880 1 . CYS 149 149 27880 1 . ARG 150 150 27880 1 . PHE 151 151 27880 1 . VAL 152 152 27880 1 . LYS 153 153 27880 1 . TYR 154 154 27880 1 . LEU 155 155 27880 1 . ASN 156 156 27880 1 . PHE 157 157 27880 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 27880 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_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 . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _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 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 27880 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 27880 2 ZN 'Three letter code' 27880 2 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 1 ZN $chem_comp_ZN 27880 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 27880 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $RYMV_P1 . 12137 virus . Sobemovirus Sobemovirus . . Viruses . Sobemovirus . . . . . . . . . . . . . . 27880 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 27880 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $RYMV_P1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET3b . . . 27880 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 27880 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _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 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _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 . _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 27880 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 27880 ZN [Zn++] SMILES CACTVS 3.341 27880 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 27880 ZN [Zn+2] SMILES ACDLabs 10.04 27880 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 27880 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 27880 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 27880 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 27880 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 ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 27880 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27880 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'RYMV P1' '[U-99% 13C; U-99% 15N]' . . 1 $RYMV_P1 . . 350 300 400 uM 50 . . . 27880 1 2 ZnSO4 'natural abundance' . . 2 $entity_ZN . . 350 . . uM . . . . 27880 1 3 DSS 'natural abundance' . . . . . . 50 . . uM . . . . 27880 1 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 27880 1 5 Na2SO4 'natural abundance' . . . . . . 60 . . mM . . . . 27880 1 6 TRIS 'natural abundance' . . . . . . 15 . . mM . . . . 27880 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27880 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.2 0.015 M 27880 1 pH 8 0.1 pH 27880 1 pressure 1 . atm 27880 1 temperature 300 0.5 K 27880 1 stop_ save_ ############################ # Computer software used # ############################ save_GIFA _Software.Sf_category software _Software.Sf_framecode GIFA _Software.Entry_ID 27880 _Software.ID 1 _Software.Type . _Software.Name GIFA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Marc Andre Delsuc' . . 27880 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 27880 1 stop_ save_ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 27880 _Software.ID 2 _Software.Type . _Software.Name NMRview _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson Bruce A' . . 27880 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27880 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27880 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 27880 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27880 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 27880 1 2 spectrometer_2 Bruker Avance . 700 . . . 27880 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27880 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 7 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 9 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27880 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27880 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27880 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27880 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27880 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27880 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D HNCA' . . . 27880 1 3 '3D CBCA(CO)NH' . . . 27880 1 4 '3D HNCO' . . . 27880 1 9 '3D HNCACB' . . . 27880 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 3.812 0.01 . 1 . . . . . 1 MET HA . 27880 1 2 . 1 1 1 1 MET CA C 13 55.75 0.01 . 1 . . . . . 1 MET CA . 27880 1 3 . 1 1 2 2 THR HA H 1 4.330 0.01 . 1 . . . . . 2 THR HA . 27880 1 4 . 1 1 2 2 THR C C 13 171.36 0.01 . 1 . . . . . 2 THR C . 27880 1 5 . 1 1 2 2 THR CA C 13 61.30 0.01 . 1 . . . . . 2 THR CA . 27880 1 6 . 1 1 2 2 THR CB C 13 70.40 0.01 . 1 . . . . . 2 THR CB . 27880 1 7 . 1 1 3 3 ARG H H 1 7.920 0.01 . 1 . . . . . 3 ARG H . 27880 1 8 . 1 1 3 3 ARG HA H 1 4.159 0.01 . 1 . . . . . 3 ARG HA . 27880 1 9 . 1 1 3 3 ARG C C 13 174.62 0.01 . 1 . . . . . 3 ARG C . 27880 1 10 . 1 1 3 3 ARG CA C 13 55.00 0.01 . 1 . . . . . 3 ARG CA . 27880 1 11 . 1 1 3 3 ARG CB C 13 31.79 0.01 . 1 . . . . . 3 ARG CB . 27880 1 12 . 1 1 3 3 ARG N N 15 123.85 0.01 . 1 . . . . . 3 ARG N . 27880 1 13 . 1 1 4 4 LEU H H 1 9.103 0.01 . 1 . . . . . 4 LEU H . 27880 1 14 . 1 1 4 4 LEU HA H 1 4.567 0.01 . 1 . . . . . 4 LEU HA . 27880 1 15 . 1 1 4 4 LEU C C 13 174.70 0.01 . 1 . . . . . 4 LEU C . 27880 1 16 . 1 1 4 4 LEU CA C 13 54.63 0.01 . 1 . . . . . 4 LEU CA . 27880 1 17 . 1 1 4 4 LEU CB C 13 45.01 0.01 . 1 . . . . . 4 LEU CB . 27880 1 18 . 1 1 4 4 LEU N N 15 129.45 0.01 . 1 . . . . . 4 LEU N . 27880 1 19 . 1 1 5 5 GLU H H 1 8.584 0.01 . 1 . . . . . 5 GLU H . 27880 1 20 . 1 1 5 5 GLU HA H 1 4.615 0.01 . 1 . . . . . 5 GLU HA . 27880 1 21 . 1 1 5 5 GLU C C 13 174.10 0.01 . 1 . . . . . 5 GLU C . 27880 1 22 . 1 1 5 5 GLU CA C 13 55.58 0.01 . 1 . . . . . 5 GLU CA . 27880 1 23 . 1 1 5 5 GLU CB C 13 31.93 0.01 . 1 . . . . . 5 GLU CB . 27880 1 24 . 1 1 5 5 GLU N N 15 128.05 0.01 . 1 . . . . . 5 GLU N . 27880 1 25 . 1 1 6 6 VAL H H 1 8.717 0.01 . 1 . . . . . 6 VAL H . 27880 1 26 . 1 1 6 6 VAL HA H 1 4.225 0.01 . 1 . . . . . 6 VAL HA . 27880 1 27 . 1 1 6 6 VAL C C 13 173.65 0.01 . 1 . . . . . 6 VAL C . 27880 1 28 . 1 1 6 6 VAL CA C 13 61.18 0.01 . 1 . . . . . 6 VAL CA . 27880 1 29 . 1 1 6 6 VAL CB C 13 34.28 0.01 . 1 . . . . . 6 VAL CB . 27880 1 30 . 1 1 6 6 VAL N N 15 124.12 0.01 . 1 . . . . . 6 VAL N . 27880 1 31 . 1 1 7 7 LEU H H 1 7.921 0.01 . 1 . . . . . 7 LEU H . 27880 1 32 . 1 1 7 7 LEU HA H 1 5.027 0.01 . 1 . . . . . 7 LEU HA . 27880 1 33 . 1 1 7 7 LEU C C 13 175.32 0.01 . 1 . . . . . 7 LEU C . 27880 1 34 . 1 1 7 7 LEU CA C 13 54.11 0.01 . 1 . . . . . 7 LEU CA . 27880 1 35 . 1 1 7 7 LEU CB C 13 43.99 0.01 . 1 . . . . . 7 LEU CB . 27880 1 36 . 1 1 7 7 LEU N N 15 130.18 0.01 . 1 . . . . . 7 LEU N . 27880 1 37 . 1 1 8 8 ILE H H 1 8.907 0.01 . 1 . . . . . 8 ILE H . 27880 1 38 . 1 1 8 8 ILE HA H 1 4.408 0.01 . 1 . . . . . 8 ILE HA . 27880 1 39 . 1 1 8 8 ILE C C 13 174.12 0.01 . 1 . . . . . 8 ILE C . 27880 1 40 . 1 1 8 8 ILE CA C 13 60.22 0.01 . 1 . . . . . 8 ILE CA . 27880 1 41 . 1 1 8 8 ILE CB C 13 40.50 0.01 . 1 . . . . . 8 ILE CB . 27880 1 42 . 1 1 8 8 ILE N N 15 125.63 0.01 . 1 . . . . . 8 ILE N . 27880 1 43 . 1 1 9 9 ARG H H 1 8.364 0.01 . 1 . . . . . 9 ARG H . 27880 1 44 . 1 1 9 9 ARG HA H 1 5.077 0.01 . 1 . . . . . 9 ARG HA . 27880 1 45 . 1 1 9 9 ARG CA C 13 53.27 0.01 . 1 . . . . . 9 ARG CA . 27880 1 46 . 1 1 9 9 ARG N N 15 124.17 0.01 . 1 . . . . . 9 ARG N . 27880 1 47 . 1 1 10 10 PRO HA H 1 5.536 0.01 . 1 . . . . . 10 PRO HA . 27880 1 48 . 1 1 10 10 PRO C C 13 178.65 0.01 . 1 . . . . . 10 PRO C . 27880 1 49 . 1 1 10 10 PRO CA C 13 62.93 0.01 . 1 . . . . . 10 PRO CA . 27880 1 50 . 1 1 10 10 PRO CB C 13 32.07 0.01 . 1 . . . . . 10 PRO CB . 27880 1 51 . 1 1 11 11 THR H H 1 8.136 0.01 . 1 . . . . . 11 THR H . 27880 1 52 . 1 1 11 11 THR HA H 1 4.775 0.01 . 1 . . . . . 11 THR HA . 27880 1 53 . 1 1 11 11 THR CA C 13 60.88 0.01 . 1 . . . . . 11 THR CA . 27880 1 54 . 1 1 11 11 THR CB C 13 71.10 0.01 . 1 . . . . . 11 THR CB . 27880 1 55 . 1 1 11 11 THR N N 15 114.27 0.01 . 1 . . . . . 11 THR N . 27880 1 56 . 1 1 13 13 GLN HE21 H 1 7.817 . . . . . . . . 13 GLN HE21 . 27880 1 57 . 1 1 13 13 GLN HE22 H 1 6.922 . . . . . . . . 13 GLN HE22 . 27880 1 58 . 1 1 13 13 GLN C C 13 177.10 0.01 . 1 . . . . . 13 GLN C . 27880 1 59 . 1 1 13 13 GLN CA C 13 58.37 0.01 . 1 . . . . . 13 GLN CA . 27880 1 60 . 1 1 13 13 GLN CB C 13 28.07 0.01 . 1 . . . . . 13 GLN CB . 27880 1 61 . 1 1 13 13 GLN NE2 N 15 112.61 . . . . . . . . 13 GLN NE2 . 27880 1 62 . 1 1 14 14 THR H H 1 7.806 0.01 . 1 . . . . . 14 THR H . 27880 1 63 . 1 1 14 14 THR HA H 1 4.958 0.01 . 1 . . . . . 14 THR HA . 27880 1 64 . 1 1 14 14 THR C C 13 174.50 0.01 . 1 . . . . . 14 THR C . 27880 1 65 . 1 1 14 14 THR CA C 13 61.80 0.01 . 1 . . . . . 14 THR CA . 27880 1 66 . 1 1 14 14 THR CB C 13 70.84 0.01 . 1 . . . . . 14 THR CB . 27880 1 67 . 1 1 14 14 THR N N 15 107.13 0.01 . 1 . . . . . 14 THR N . 27880 1 68 . 1 1 15 15 ALA H H 1 7.614 0.01 . 1 . . . . . 15 ALA H . 27880 1 69 . 1 1 15 15 ALA HA H 1 3.905 0.01 . 1 . . . . . 15 ALA HA . 27880 1 70 . 1 1 15 15 ALA CA C 13 55.68 0.01 . 1 . . . . . 15 ALA CA . 27880 1 71 . 1 1 15 15 ALA CB C 13 18.42 0.01 . 1 . . . . . 15 ALA CB . 27880 1 72 . 1 1 15 15 ALA N N 15 125.96 0.01 . 1 . . . . . 15 ALA N . 27880 1 73 . 1 1 16 16 ALA HA H 1 4.170 0.01 . 1 . . . . . 16 ALA HA . 27880 1 74 . 1 1 16 16 ALA C C 13 181.28 0.01 . 1 . . . . . 16 ALA C . 27880 1 75 . 1 1 16 16 ALA CA C 13 55.70 0.01 . 1 . . . . . 16 ALA CA . 27880 1 76 . 1 1 16 16 ALA CB C 13 17.48 0.01 . 1 . . . . . 16 ALA CB . 27880 1 77 . 1 1 17 17 LYS H H 1 7.811 0.01 . 1 . . . . . 17 LYS H . 27880 1 78 . 1 1 17 17 LYS HA H 1 4.100 0.01 . 1 . . . . . 17 LYS HA . 27880 1 79 . 1 1 17 17 LYS C C 13 178.13 0.01 . 1 . . . . . 17 LYS C . 27880 1 80 . 1 1 17 17 LYS CA C 13 58.88 0.01 . 1 . . . . . 17 LYS CA . 27880 1 81 . 1 1 17 17 LYS CB C 13 32.06 0.01 . 1 . . . . . 17 LYS CB . 27880 1 82 . 1 1 17 17 LYS N N 15 120.01 0.01 . 1 . . . . . 17 LYS N . 27880 1 83 . 1 1 18 18 ALA H H 1 7.391 0.01 . 1 . . . . . 18 ALA H . 27880 1 84 . 1 1 18 18 ALA HA H 1 3.004 0.01 . 1 . . . . . 18 ALA HA . 27880 1 85 . 1 1 18 18 ALA C C 13 179.82 0.01 . 1 . . . . . 18 ALA C . 27880 1 86 . 1 1 18 18 ALA CA C 13 54.92 0.01 . 1 . . . . . 18 ALA CA . 27880 1 87 . 1 1 18 18 ALA CB C 13 17.55 0.01 . 1 . . . . . 18 ALA CB . 27880 1 88 . 1 1 18 18 ALA N N 15 121.67 0.01 . 1 . . . . . 18 ALA N . 27880 1 89 . 1 1 19 19 ASN H H 1 8.657 0.01 . 1 . . . . . 19 ASN H . 27880 1 90 . 1 1 19 19 ASN HA H 1 4.313 0.01 . 1 . . . . . 19 ASN HA . 27880 1 91 . 1 1 19 19 ASN HD21 H 1 7.567 . . . . . . . . 19 ASN HD21 . 27880 1 92 . 1 1 19 19 ASN HD22 H 1 6.961 . . . . . . . . 19 ASN HD22 . 27880 1 93 . 1 1 19 19 ASN C C 13 178.47 0.01 . 1 . . . . . 19 ASN C . 27880 1 94 . 1 1 19 19 ASN CA C 13 55.47 0.01 . 1 . . . . . 19 ASN CA . 27880 1 95 . 1 1 19 19 ASN CB C 13 38.32 0.01 . 1 . . . . . 19 ASN CB . 27880 1 96 . 1 1 19 19 ASN N N 15 116.50 0.01 . 1 . . . . . 19 ASN N . 27880 1 97 . 1 1 19 19 ASN ND2 N 15 111.93 . . . . . . . . 19 ASN ND2 . 27880 1 98 . 1 1 20 20 ALA H H 1 7.801 0.01 . 1 . . . . . 20 ALA H . 27880 1 99 . 1 1 20 20 ALA HA H 1 4.157 0.01 . 1 . . . . . 20 ALA HA . 27880 1 100 . 1 1 20 20 ALA C C 13 179.42 0.01 . 1 . . . . . 20 ALA C . 27880 1 101 . 1 1 20 20 ALA CA C 13 54.91 0.01 . 1 . . . . . 20 ALA CA . 27880 1 102 . 1 1 20 20 ALA CB C 13 18.22 0.01 . 1 . . . . . 20 ALA CB . 27880 1 103 . 1 1 20 20 ALA N N 15 121.61 0.01 . 1 . . . . . 20 ALA N . 27880 1 104 . 1 1 21 21 VAL H H 1 7.247 0.01 . 1 . . . . . 21 VAL H . 27880 1 105 . 1 1 21 21 VAL HA H 1 4.466 0.01 . 1 . . . . . 21 VAL HA . 27880 1 106 . 1 1 21 21 VAL C C 13 176.40 0.01 . 1 . . . . . 21 VAL C . 27880 1 107 . 1 1 21 21 VAL CA C 13 60.93 0.01 . 1 . . . . . 21 VAL CA . 27880 1 108 . 1 1 21 21 VAL CB C 13 31.90 0.01 . 1 . . . . . 21 VAL CB . 27880 1 109 . 1 1 21 21 VAL N N 15 108.91 0.01 . 1 . . . . . 21 VAL N . 27880 1 110 . 1 1 22 22 GLY H H 1 7.741 0.01 . 1 . . . . . 22 GLY H . 27880 1 111 . 1 1 22 22 GLY HA2 H 1 3.771 0.01 . 2 . . . . . 22 GLY HA2 . 27880 1 112 . 1 1 22 22 GLY HA3 H 1 4.065 0.01 . 2 . . . . . 22 GLY HA3 . 27880 1 113 . 1 1 22 22 GLY C C 13 173.65 0.01 . 1 . . . . . 22 GLY C . 27880 1 114 . 1 1 22 22 GLY CA C 13 46.27 0.01 . 1 . . . . . 22 GLY CA . 27880 1 115 . 1 1 22 22 GLY N N 15 110.02 0.01 . 1 . . . . . 22 GLY N . 27880 1 116 . 1 1 23 23 TYR H H 1 8.018 0.01 . 1 . . . . . 23 TYR H . 27880 1 117 . 1 1 23 23 TYR HA H 1 4.462 0.01 . 1 . . . . . 23 TYR HA . 27880 1 118 . 1 1 23 23 TYR C C 13 174.69 0.01 . 1 . . . . . 23 TYR C . 27880 1 119 . 1 1 23 23 TYR CA C 13 57.92 0.01 . 1 . . . . . 23 TYR CA . 27880 1 120 . 1 1 23 23 TYR CB C 13 41.28 0.01 . 1 . . . . . 23 TYR CB . 27880 1 121 . 1 1 23 23 TYR N N 15 123.90 0.01 . 1 . . . . . 23 TYR N . 27880 1 122 . 1 1 24 24 THR H H 1 7.933 0.01 . 1 . . . . . 24 THR H . 27880 1 123 . 1 1 24 24 THR HA H 1 4.779 0.01 . 1 . . . . . 24 THR HA . 27880 1 124 . 1 1 24 24 THR C C 13 174.27 0.01 . 1 . . . . . 24 THR C . 27880 1 125 . 1 1 24 24 THR CA C 13 62.50 0.01 . 1 . . . . . 24 THR CA . 27880 1 126 . 1 1 24 24 THR CB C 13 69.56 0.01 . 1 . . . . . 24 THR CB . 27880 1 127 . 1 1 24 24 THR N N 15 113.00 0.01 . 1 . . . . . 24 THR N . 27880 1 128 . 1 1 25 25 HIS H H 1 7.297 0.01 . 1 . . . . . 25 HIS H . 27880 1 129 . 1 1 25 25 HIS HA H 1 5.192 0.01 . 1 . . . . . 25 HIS HA . 27880 1 130 . 1 1 25 25 HIS C C 13 172.11 0.01 . 1 . . . . . 25 HIS C . 27880 1 131 . 1 1 25 25 HIS CA C 13 56.08 0.01 . 1 . . . . . 25 HIS CA . 27880 1 132 . 1 1 25 25 HIS CB C 13 31.56 0.01 . 1 . . . . . 25 HIS CB . 27880 1 133 . 1 1 25 25 HIS N N 15 115.08 0.01 . 1 . . . . . 25 HIS N . 27880 1 134 . 1 1 26 26 ALA H H 1 9.183 0.01 . 1 . . . . . 26 ALA H . 27880 1 135 . 1 1 26 26 ALA HA H 1 4.681 0.01 . 1 . . . . . 26 ALA HA . 27880 1 136 . 1 1 26 26 ALA C C 13 175.50 0.01 . 1 . . . . . 26 ALA C . 27880 1 137 . 1 1 26 26 ALA CA C 13 51.06 0.01 . 1 . . . . . 26 ALA CA . 27880 1 138 . 1 1 26 26 ALA CB C 13 22.87 0.01 . 1 . . . . . 26 ALA CB . 27880 1 139 . 1 1 26 26 ALA N N 15 121.20 0.01 . 1 . . . . . 26 ALA N . 27880 1 140 . 1 1 27 27 LEU H H 1 8.197 0.01 . 1 . . . . . 27 LEU H . 27880 1 141 . 1 1 27 27 LEU HA H 1 5.163 0.01 . 1 . . . . . 27 LEU HA . 27880 1 142 . 1 1 27 27 LEU C C 13 176.17 0.01 . 1 . . . . . 27 LEU C . 27880 1 143 . 1 1 27 27 LEU CA C 13 53.63 0.01 . 1 . . . . . 27 LEU CA . 27880 1 144 . 1 1 27 27 LEU CB C 13 45.00 0.01 . 1 . . . . . 27 LEU CB . 27880 1 145 . 1 1 27 27 LEU N N 15 121.99 0.01 . 1 . . . . . 27 LEU N . 27880 1 146 . 1 1 28 28 THR H H 1 8.648 0.01 . 1 . . . . . 28 THR H . 27880 1 147 . 1 1 28 28 THR HA H 1 4.204 0.01 . 1 . . . . . 28 THR HA . 27880 1 148 . 1 1 28 28 THR C C 13 171.55 0.01 . 1 . . . . . 28 THR C . 27880 1 149 . 1 1 28 28 THR CA C 13 60.70 0.01 . 1 . . . . . 28 THR CA . 27880 1 150 . 1 1 28 28 THR CB C 13 70.22 0.01 . 1 . . . . . 28 THR CB . 27880 1 151 . 1 1 28 28 THR N N 15 121.15 0.01 . 1 . . . . . 28 THR N . 27880 1 152 . 1 1 29 29 TRP H H 1 8.163 0.01 . 1 . . . . . 29 TRP H . 27880 1 153 . 1 1 29 29 TRP HA H 1 5.550 0.01 . 1 . . . . . 29 TRP HA . 27880 1 154 . 1 1 29 29 TRP C C 13 175.12 0.01 . 1 . . . . . 29 TRP C . 27880 1 155 . 1 1 29 29 TRP CA C 13 56.19 0.01 . 1 . . . . . 29 TRP CA . 27880 1 156 . 1 1 29 29 TRP CB C 13 28.64 0.01 . 1 . . . . . 29 TRP CB . 27880 1 157 . 1 1 29 29 TRP N N 15 122.13 0.01 . 1 . . . . . 29 TRP N . 27880 1 158 . 1 1 30 30 VAL H H 1 8.657 0.01 . 1 . . . . . 30 VAL H . 27880 1 159 . 1 1 30 30 VAL HA H 1 4.676 0.01 . 1 . . . . . 30 VAL HA . 27880 1 160 . 1 1 30 30 VAL C C 13 174.06 0.01 . 1 . . . . . 30 VAL C . 27880 1 161 . 1 1 30 30 VAL CA C 13 59.41 0.01 . 1 . . . . . 30 VAL CA . 27880 1 162 . 1 1 30 30 VAL CB C 13 34.54 0.01 . 1 . . . . . 30 VAL CB . 27880 1 163 . 1 1 30 30 VAL N N 15 115.76 0.01 . 1 . . . . . 30 VAL N . 27880 1 164 . 1 1 31 31 TRP H H 1 9.056 0.01 . 1 . . . . . 31 TRP H . 27880 1 165 . 1 1 31 31 TRP HA H 1 5.282 0.01 . 1 . . . . . 31 TRP HA . 27880 1 166 . 1 1 31 31 TRP C C 13 176.37 0.01 . 1 . . . . . 31 TRP C . 27880 1 167 . 1 1 31 31 TRP CA C 13 56.54 0.01 . 1 . . . . . 31 TRP CA . 27880 1 168 . 1 1 31 31 TRP CB C 13 31.44 0.01 . 1 . . . . . 31 TRP CB . 27880 1 169 . 1 1 31 31 TRP N N 15 123.70 0.01 . 1 . . . . . 31 TRP N . 27880 1 170 . 1 1 32 32 HIS H H 1 8.857 0.01 . 1 . . . . . 32 HIS H . 27880 1 171 . 1 1 32 32 HIS HA H 1 4.785 0.01 . 1 . . . . . 32 HIS HA . 27880 1 172 . 1 1 32 32 HIS N N 15 117.08 0.01 . 1 . . . . . 32 HIS N . 27880 1 173 . 1 1 34 34 GLN HE21 H 1 7.577 . . . . . . . . 34 GLN HE21 . 27880 1 174 . 1 1 34 34 GLN HE22 H 1 6.922 . . . . . . . . 34 GLN HE22 . 27880 1 175 . 1 1 34 34 GLN C C 13 177.63 0.01 . 1 . . . . . 34 GLN C . 27880 1 176 . 1 1 34 34 GLN NE2 N 15 112.51 . . . . . . . . 34 GLN NE2 . 27880 1 177 . 1 1 35 35 THR H H 1 7.649 0.01 . 1 . . . . . 35 THR H . 27880 1 178 . 1 1 35 35 THR HA H 1 3.371 0.01 . 1 . . . . . 35 THR HA . 27880 1 179 . 1 1 35 35 THR C C 13 172.06 0.01 . 1 . . . . . 35 THR C . 27880 1 180 . 1 1 35 35 THR CA C 13 65.73 0.01 . 1 . . . . . 35 THR CA . 27880 1 181 . 1 1 35 35 THR CB C 13 69.61 0.01 . 1 . . . . . 35 THR CB . 27880 1 182 . 1 1 35 35 THR N N 15 118.20 0.01 . 1 . . . . . 35 THR N . 27880 1 183 . 1 1 36 36 TRP H H 1 6.568 0.01 . 1 . . . . . 36 TRP H . 27880 1 184 . 1 1 36 36 TRP HA H 1 4.585 0.01 . 1 . . . . . 36 TRP HA . 27880 1 185 . 1 1 36 36 TRP C C 13 174.20 0.01 . 1 . . . . . 36 TRP C . 27880 1 186 . 1 1 36 36 TRP CA C 13 52.93 0.01 . 1 . . . . . 36 TRP CA . 27880 1 187 . 1 1 36 36 TRP CB C 13 28.54 0.01 . 1 . . . . . 36 TRP CB . 27880 1 188 . 1 1 36 36 TRP N N 15 116.70 0.01 . 1 . . . . . 36 TRP N . 27880 1 189 . 1 1 37 37 ASP H H 1 7.224 0.01 . 1 . . . . . 37 ASP H . 27880 1 190 . 1 1 37 37 ASP HA H 1 4.962 0.01 . 1 . . . . . 37 ASP HA . 27880 1 191 . 1 1 37 37 ASP C C 13 174.83 0.01 . 1 . . . . . 37 ASP C . 27880 1 192 . 1 1 37 37 ASP CA C 13 52.40 0.01 . 1 . . . . . 37 ASP CA . 27880 1 193 . 1 1 37 37 ASP CB C 13 39.36 0.01 . 1 . . . . . 37 ASP CB . 27880 1 194 . 1 1 37 37 ASP N N 15 119.83 0.01 . 1 . . . . . 37 ASP N . 27880 1 195 . 1 1 38 38 VAL H H 1 7.562 0.01 . 1 . . . . . 38 VAL H . 27880 1 196 . 1 1 38 38 VAL HA H 1 4.793 0.01 . 1 . . . . . 38 VAL HA . 27880 1 197 . 1 1 38 38 VAL C C 13 178.26 0.01 . 1 . . . . . 38 VAL C . 27880 1 198 . 1 1 38 38 VAL CA C 13 58.64 0.01 . 1 . . . . . 38 VAL CA . 27880 1 199 . 1 1 38 38 VAL CB C 13 35.24 0.01 . 1 . . . . . 38 VAL CB . 27880 1 200 . 1 1 38 38 VAL N N 15 113.72 0.01 . 1 . . . . . 38 VAL N . 27880 1 201 . 1 1 39 39 ASP H H 1 9.029 0.01 . 1 . . . . . 39 ASP H . 27880 1 202 . 1 1 39 39 ASP HA H 1 4.286 0.01 . 1 . . . . . 39 ASP HA . 27880 1 203 . 1 1 39 39 ASP C C 13 177.53 0.01 . 1 . . . . . 39 ASP C . 27880 1 204 . 1 1 39 39 ASP CA C 13 59.78 0.01 . 1 . . . . . 39 ASP CA . 27880 1 205 . 1 1 39 39 ASP CB C 13 41.19 0.01 . 1 . . . . . 39 ASP CB . 27880 1 206 . 1 1 39 39 ASP N N 15 122.74 0.01 . 1 . . . . . 39 ASP N . 27880 1 207 . 1 1 40 40 SER H H 1 8.094 0.01 . 1 . . . . . 40 SER H . 27880 1 208 . 1 1 40 40 SER HA H 1 4.289 0.01 . 1 . . . . . 40 SER HA . 27880 1 209 . 1 1 40 40 SER C C 13 174.26 0.01 . 1 . . . . . 40 SER C . 27880 1 210 . 1 1 40 40 SER CA C 13 59.95 0.01 . 1 . . . . . 40 SER CA . 27880 1 211 . 1 1 40 40 SER CB C 13 63.39 0.01 . 1 . . . . . 40 SER CB . 27880 1 212 . 1 1 40 40 SER N N 15 110.38 0.01 . 1 . . . . . 40 SER N . 27880 1 213 . 1 1 41 41 VAL H H 1 7.458 0.01 . 1 . . . . . 41 VAL H . 27880 1 214 . 1 1 41 41 VAL HA H 1 3.330 0.01 . 1 . . . . . 41 VAL HA . 27880 1 215 . 1 1 41 41 VAL C C 13 173.81 0.01 . 1 . . . . . 41 VAL C . 27880 1 216 . 1 1 41 41 VAL CA C 13 63.33 0.01 . 1 . . . . . 41 VAL CA . 27880 1 217 . 1 1 41 41 VAL CB C 13 31.26 0.01 . 1 . . . . . 41 VAL CB . 27880 1 218 . 1 1 41 41 VAL N N 15 124.12 0.01 . 1 . . . . . 41 VAL N . 27880 1 219 . 1 1 42 42 ARG H H 1 6.572 0.01 . 1 . . . . . 42 ARG H . 27880 1 220 . 1 1 42 42 ARG HA H 1 4.689 0.01 . 1 . . . . . 42 ARG HA . 27880 1 221 . 1 1 42 42 ARG C C 13 175.47 0.01 . 1 . . . . . 42 ARG C . 27880 1 222 . 1 1 42 42 ARG CA C 13 53.58 0.01 . 1 . . . . . 42 ARG CA . 27880 1 223 . 1 1 42 42 ARG CB C 13 33.62 0.01 . 1 . . . . . 42 ARG CB . 27880 1 224 . 1 1 42 42 ARG N N 15 124.33 0.01 . 1 . . . . . 42 ARG N . 27880 1 225 . 1 1 43 43 ASP H H 1 8.266 0.01 . 1 . . . . . 43 ASP H . 27880 1 226 . 1 1 43 43 ASP HA H 1 4.773 0.01 . 1 . . . . . 43 ASP HA . 27880 1 227 . 1 1 43 43 ASP CA C 13 53.46 0.01 . 1 . . . . . 43 ASP CA . 27880 1 228 . 1 1 43 43 ASP CB C 13 41.08 0.01 . 1 . . . . . 43 ASP CB . 27880 1 229 . 1 1 43 43 ASP N N 15 123.39 0.01 . 1 . . . . . 43 ASP N . 27880 1 230 . 1 1 44 44 PRO C C 13 175.44 0.01 . 1 . . . . . 44 PRO C . 27880 1 231 . 1 1 44 44 PRO CA C 13 62.59 0.01 . 1 . . . . . 44 PRO CA . 27880 1 232 . 1 1 44 44 PRO CB C 13 32.99 0.01 . 1 . . . . . 44 PRO CB . 27880 1 233 . 1 1 45 45 SER H H 1 8.258 0.01 . 1 . . . . . 45 SER H . 27880 1 234 . 1 1 45 45 SER HA H 1 5.353 0.01 . 1 . . . . . 45 SER HA . 27880 1 235 . 1 1 45 45 SER C C 13 173.93 0.01 . 1 . . . . . 45 SER C . 27880 1 236 . 1 1 45 45 SER CA C 13 56.58 0.01 . 1 . . . . . 45 SER CA . 27880 1 237 . 1 1 45 45 SER CB C 13 64.25 0.01 . 1 . . . . . 45 SER CB . 27880 1 238 . 1 1 45 45 SER N N 15 115.58 0.01 . 1 . . . . . 45 SER N . 27880 1 239 . 1 1 46 46 LEU H H 1 9.259 0.01 . 1 . . . . . 46 LEU H . 27880 1 240 . 1 1 46 46 LEU HA H 1 4.847 0.01 . 1 . . . . . 46 LEU HA . 27880 1 241 . 1 1 46 46 LEU C C 13 176.76 0.01 . 1 . . . . . 46 LEU C . 27880 1 242 . 1 1 46 46 LEU CA C 13 53.32 0.01 . 1 . . . . . 46 LEU CA . 27880 1 243 . 1 1 46 46 LEU CB C 13 46.60 0.01 . 1 . . . . . 46 LEU CB . 27880 1 244 . 1 1 46 46 LEU N N 15 124.69 0.01 . 1 . . . . . 46 LEU N . 27880 1 245 . 1 1 47 47 ARG H H 1 8.300 0.01 . 1 . . . . . 47 ARG H . 27880 1 246 . 1 1 47 47 ARG HA H 1 5.665 0.01 . 1 . . . . . 47 ARG HA . 27880 1 247 . 1 1 47 47 ARG C C 13 175.18 0.01 . 1 . . . . . 47 ARG C . 27880 1 248 . 1 1 47 47 ARG CA C 13 53.48 0.01 . 1 . . . . . 47 ARG CA . 27880 1 249 . 1 1 47 47 ARG CB C 13 32.89 0.01 . 1 . . . . . 47 ARG CB . 27880 1 250 . 1 1 47 47 ARG N N 15 120.61 0.01 . 1 . . . . . 47 ARG N . 27880 1 251 . 1 1 48 48 ALA H H 1 8.655 0.01 . 1 . . . . . 48 ALA H . 27880 1 252 . 1 1 48 48 ALA HA H 1 4.851 0.01 . 1 . . . . . 48 ALA HA . 27880 1 253 . 1 1 48 48 ALA C C 13 175.64 0.01 . 1 . . . . . 48 ALA C . 27880 1 254 . 1 1 48 48 ALA CA C 13 50.52 0.01 . 1 . . . . . 48 ALA CA . 27880 1 255 . 1 1 48 48 ALA CB C 13 24.03 0.01 . 1 . . . . . 48 ALA CB . 27880 1 256 . 1 1 48 48 ALA N N 15 121.66 0.01 . 1 . . . . . 48 ALA N . 27880 1 257 . 1 1 49 49 ASP H H 1 8.088 0.01 . 1 . . . . . 49 ASP H . 27880 1 258 . 1 1 49 49 ASP HA H 1 4.751 0.01 . 1 . . . . . 49 ASP HA . 27880 1 259 . 1 1 49 49 ASP C C 13 174.19 0.01 . 1 . . . . . 49 ASP C . 27880 1 260 . 1 1 49 49 ASP CA C 13 54.94 0.01 . 1 . . . . . 49 ASP CA . 27880 1 261 . 1 1 49 49 ASP CB C 13 40.51 0.01 . 1 . . . . . 49 ASP CB . 27880 1 262 . 1 1 49 49 ASP N N 15 121.04 0.01 . 1 . . . . . 49 ASP N . 27880 1 263 . 1 1 50 50 PHE H H 1 8.800 0.01 . 1 . . . . . 50 PHE H . 27880 1 264 . 1 1 50 50 PHE HA H 1 4.413 0.01 . 1 . . . . . 50 PHE HA . 27880 1 265 . 1 1 50 50 PHE C C 13 175.01 0.01 . 1 . . . . . 50 PHE C . 27880 1 266 . 1 1 50 50 PHE CA C 13 57.40 0.01 . 1 . . . . . 50 PHE CA . 27880 1 267 . 1 1 50 50 PHE CB C 13 38.53 0.01 . 1 . . . . . 50 PHE CB . 27880 1 268 . 1 1 50 50 PHE N N 15 127.61 0.01 . 1 . . . . . 50 PHE N . 27880 1 269 . 1 1 51 51 ASN H H 1 7.989 0.01 . 1 . . . . . 51 ASN H . 27880 1 270 . 1 1 51 51 ASN HA H 1 4.163 0.01 . 1 . . . . . 51 ASN HA . 27880 1 271 . 1 1 51 51 ASN HD21 H 1 7.210 . . . . . . . . 51 ASN HD21 . 27880 1 272 . 1 1 51 51 ASN HD22 H 1 7.187 . . . . . . . . 51 ASN HD22 . 27880 1 273 . 1 1 51 51 ASN CA C 13 50.52 0.01 . 1 . . . . . 51 ASN CA . 27880 1 274 . 1 1 51 51 ASN CB C 13 40.35 0.01 . 1 . . . . . 51 ASN CB . 27880 1 275 . 1 1 51 51 ASN N N 15 125.44 0.01 . 1 . . . . . 51 ASN N . 27880 1 276 . 1 1 51 51 ASN ND2 N 15 113.68 . . . . . . . . 51 ASN ND2 . 27880 1 277 . 1 1 52 52 PRO HA H 1 4.687 0.01 . 1 . . . . . 52 PRO HA . 27880 1 278 . 1 1 52 52 PRO C C 13 176.03 0.01 . 1 . . . . . 52 PRO C . 27880 1 279 . 1 1 52 52 PRO CA C 13 63.11 0.01 . 1 . . . . . 52 PRO CA . 27880 1 280 . 1 1 52 52 PRO CB C 13 31.99 0.01 . 1 . . . . . 52 PRO CB . 27880 1 281 . 1 1 53 53 GLU H H 1 7.836 0.01 . 1 . . . . . 53 GLU H . 27880 1 282 . 1 1 53 53 GLU HA H 1 4.337 0.01 . 1 . . . . . 53 GLU HA . 27880 1 283 . 1 1 53 53 GLU C C 13 176.29 0.01 . 1 . . . . . 53 GLU C . 27880 1 284 . 1 1 53 53 GLU CA C 13 55.67 0.01 . 1 . . . . . 53 GLU CA . 27880 1 285 . 1 1 53 53 GLU CB C 13 30.38 0.01 . 1 . . . . . 53 GLU CB . 27880 1 286 . 1 1 53 53 GLU N N 15 115.62 0.01 . 1 . . . . . 53 GLU N . 27880 1 287 . 1 1 54 54 LYS H H 1 7.316 0.01 . 1 . . . . . 54 LYS H . 27880 1 288 . 1 1 54 54 LYS HA H 1 4.775 0.01 . 1 . . . . . 54 LYS HA . 27880 1 289 . 1 1 54 54 LYS C C 13 175.29 0.01 . 1 . . . . . 54 LYS C . 27880 1 290 . 1 1 54 54 LYS CA C 13 54.16 0.01 . 1 . . . . . 54 LYS CA . 27880 1 291 . 1 1 54 54 LYS N N 15 117.38 0.01 . 1 . . . . . 54 LYS N . 27880 1 292 . 1 1 55 55 VAL H H 1 7.947 0.01 . 1 . . . . . 55 VAL H . 27880 1 293 . 1 1 55 55 VAL HA H 1 4.198 0.01 . 1 . . . . . 55 VAL HA . 27880 1 294 . 1 1 55 55 VAL C C 13 174.42 0.01 . 1 . . . . . 55 VAL C . 27880 1 295 . 1 1 55 55 VAL CA C 13 61.84 0.01 . 1 . . . . . 55 VAL CA . 27880 1 296 . 1 1 55 55 VAL CB C 13 34.28 0.01 . 1 . . . . . 55 VAL CB . 27880 1 297 . 1 1 55 55 VAL N N 15 118.31 0.01 . 1 . . . . . 55 VAL N . 27880 1 298 . 1 1 56 56 GLY H H 1 8.533 0.01 . 1 . . . . . 56 GLY H . 27880 1 299 . 1 1 56 56 GLY HA2 H 1 4.102 0.01 . 2 . . . . . 56 GLY HA2 . 27880 1 300 . 1 1 56 56 GLY HA3 H 1 4.669 0.01 . 2 . . . . . 56 GLY HA3 . 27880 1 301 . 1 1 56 56 GLY C C 13 172.02 0.01 . 1 . . . . . 56 GLY C . 27880 1 302 . 1 1 56 56 GLY CA C 13 44.42 0.01 . 1 . . . . . 56 GLY CA . 27880 1 303 . 1 1 56 56 GLY N N 15 117.91 0.01 . 1 . . . . . 56 GLY N . 27880 1 304 . 1 1 57 57 TRP H H 1 8.189 0.01 . 1 . . . . . 57 TRP H . 27880 1 305 . 1 1 57 57 TRP HA H 1 5.180 0.01 . 1 . . . . . 57 TRP HA . 27880 1 306 . 1 1 57 57 TRP C C 13 175.72 0.01 . 1 . . . . . 57 TRP C . 27880 1 307 . 1 1 57 57 TRP CA C 13 56.54 0.01 . 1 . . . . . 57 TRP CA . 27880 1 308 . 1 1 57 57 TRP CB C 13 28.45 0.01 . 1 . . . . . 57 TRP CB . 27880 1 309 . 1 1 57 57 TRP N N 15 117.68 0.01 . 1 . . . . . 57 TRP N . 27880 1 310 . 1 1 58 58 VAL H H 1 9.344 0.01 . 1 . . . . . 58 VAL H . 27880 1 311 . 1 1 58 58 VAL HA H 1 4.628 0.01 . 1 . . . . . 58 VAL HA . 27880 1 312 . 1 1 58 58 VAL C C 13 173.70 0.01 . 1 . . . . . 58 VAL C . 27880 1 313 . 1 1 58 58 VAL CA C 13 58.99 0.01 . 1 . . . . . 58 VAL CA . 27880 1 314 . 1 1 58 58 VAL CB C 13 33.91 0.01 . 1 . . . . . 58 VAL CB . 27880 1 315 . 1 1 58 58 VAL N N 15 123.91 0.01 . 1 . . . . . 58 VAL N . 27880 1 316 . 1 1 59 59 SER H H 1 8.756 0.01 . 1 . . . . . 59 SER H . 27880 1 317 . 1 1 59 59 SER HA H 1 4.912 0.01 . 1 . . . . . 59 SER HA . 27880 1 318 . 1 1 59 59 SER C C 13 172.92 0.01 . 1 . . . . . 59 SER C . 27880 1 319 . 1 1 59 59 SER CA C 13 57.45 0.01 . 1 . . . . . 59 SER CA . 27880 1 320 . 1 1 59 59 SER CB C 13 64.54 0.01 . 1 . . . . . 59 SER CB . 27880 1 321 . 1 1 59 59 SER N N 15 124.43 0.01 . 1 . . . . . 59 SER N . 27880 1 322 . 1 1 60 60 VAL H H 1 8.600 0.01 . 1 . . . . . 60 VAL H . 27880 1 323 . 1 1 60 60 VAL HA H 1 4.926 0.01 . 1 . . . . . 60 VAL HA . 27880 1 324 . 1 1 60 60 VAL C C 13 173.11 0.01 . 1 . . . . . 60 VAL C . 27880 1 325 . 1 1 60 60 VAL CA C 13 60.61 0.01 . 1 . . . . . 60 VAL CA . 27880 1 326 . 1 1 60 60 VAL CB C 13 33.97 0.01 . 1 . . . . . 60 VAL CB . 27880 1 327 . 1 1 60 60 VAL N N 15 126.16 0.01 . 1 . . . . . 60 VAL N . 27880 1 328 . 1 1 61 61 SER H H 1 8.686 0.01 . 1 . . . . . 61 SER H . 27880 1 329 . 1 1 61 61 SER HA H 1 5.345 0.01 . 1 . . . . . 61 SER HA . 27880 1 330 . 1 1 61 61 SER C C 13 172.32 0.01 . 1 . . . . . 61 SER C . 27880 1 331 . 1 1 61 61 SER CA C 13 56.33 0.01 . 1 . . . . . 61 SER CA . 27880 1 332 . 1 1 61 61 SER N N 15 119.20 0.01 . 1 . . . . . 61 SER N . 27880 1 333 . 1 1 62 62 PHE H H 1 8.772 0.01 . 1 . . . . . 62 PHE H . 27880 1 334 . 1 1 62 62 PHE HA H 1 4.816 0.01 . 1 . . . . . 62 PHE HA . 27880 1 335 . 1 1 62 62 PHE C C 13 175.29 0.01 . 1 . . . . . 62 PHE C . 27880 1 336 . 1 1 62 62 PHE CA C 13 55.34 0.01 . 1 . . . . . 62 PHE CA . 27880 1 337 . 1 1 62 62 PHE N N 15 117.50 0.01 . 1 . . . . . 62 PHE N . 27880 1 338 . 1 1 63 63 ALA H H 1 8.867 0.01 . 1 . . . . . 63 ALA H . 27880 1 339 . 1 1 63 63 ALA HA H 1 5.142 0.01 . 1 . . . . . 63 ALA HA . 27880 1 340 . 1 1 63 63 ALA CA C 13 52.10 0.01 . 1 . . . . . 63 ALA CA . 27880 1 341 . 1 1 63 63 ALA CB C 13 22.16 0.01 . 1 . . . . . 63 ALA CB . 27880 1 342 . 1 1 63 63 ALA N N 15 124.09 0.01 . 1 . . . . . 63 ALA N . 27880 1 343 . 1 1 64 64 CYS H H 1 8.527 0.01 . 1 . . . . . 64 CYS H . 27880 1 344 . 1 1 64 64 CYS HA H 1 6.215 0.01 . 1 . . . . . 64 CYS HA . 27880 1 345 . 1 1 64 64 CYS CA C 13 57.31 0.01 . 1 . . . . . 64 CYS CA . 27880 1 346 . 1 1 64 64 CYS CB C 13 31.54 0.01 . 1 . . . . . 64 CYS CB . 27880 1 347 . 1 1 64 64 CYS N N 15 123.31 0.01 . 1 . . . . . 64 CYS N . 27880 1 348 . 1 1 65 65 THR H H 1 8.953 0.01 . 1 . . . . . 65 THR H . 27880 1 349 . 1 1 65 65 THR HA H 1 4.773 0.01 . 1 . . . . . 65 THR HA . 27880 1 350 . 1 1 65 65 THR CB C 13 68.69 0.01 . 1 . . . . . 65 THR CB . 27880 1 351 . 1 1 65 65 THR N N 15 119.46 0.01 . 1 . . . . . 65 THR N . 27880 1 352 . 1 1 66 66 GLN H H 1 10.108 0.01 . 1 . . . . . 66 GLN H . 27880 1 353 . 1 1 66 66 GLN HA H 1 4.613 0.01 . 1 . . . . . 66 GLN HA . 27880 1 354 . 1 1 66 66 GLN HE21 H 1 7.482 . . . . . . . . 66 GLN HE21 . 27880 1 355 . 1 1 66 66 GLN HE22 H 1 6.864 . . . . . . . . 66 GLN HE22 . 27880 1 356 . 1 1 66 66 GLN N N 15 125.83 0.01 . 1 . . . . . 66 GLN N . 27880 1 357 . 1 1 66 66 GLN NE2 N 15 111.75 . . . . . . . . 66 GLN NE2 . 27880 1 358 . 1 1 67 67 CYS H H 1 8.785 0.01 . 1 . . . . . 67 CYS H . 27880 1 359 . 1 1 67 67 CYS HA H 1 5.160 0.01 . 1 . . . . . 67 CYS HA . 27880 1 360 . 1 1 67 67 CYS CB C 13 31.45 0.01 . 1 . . . . . 67 CYS CB . 27880 1 361 . 1 1 67 67 CYS N N 15 123.92 0.01 . 1 . . . . . 67 CYS N . 27880 1 362 . 1 1 68 68 THR H H 1 7.454 0.01 . 1 . . . . . 68 THR H . 27880 1 363 . 1 1 68 68 THR HA H 1 4.607 0.01 . 1 . . . . . 68 THR HA . 27880 1 364 . 1 1 68 68 THR CB C 13 70.69 0.01 . 1 . . . . . 68 THR CB . 27880 1 365 . 1 1 68 68 THR N N 15 107.44 0.01 . 1 . . . . . 68 THR N . 27880 1 366 . 1 1 69 69 ALA H H 1 9.581 0.01 . 1 . . . . . 69 ALA H . 27880 1 367 . 1 1 69 69 ALA HA H 1 4.560 0.01 . 1 . . . . . 69 ALA HA . 27880 1 368 . 1 1 69 69 ALA C C 13 177.54 0.01 . 1 . . . . . 69 ALA C . 27880 1 369 . 1 1 69 69 ALA CA C 13 54.50 0.01 . 1 . . . . . 69 ALA CA . 27880 1 370 . 1 1 69 69 ALA CB C 13 19.76 0.01 . 1 . . . . . 69 ALA CB . 27880 1 371 . 1 1 69 69 ALA N N 15 130.02 0.01 . 1 . . . . . 69 ALA N . 27880 1 372 . 1 1 70 70 HIS H H 1 8.561 0.01 . 1 . . . . . 70 HIS H . 27880 1 373 . 1 1 70 70 HIS HA H 1 5.553 0.01 . 1 . . . . . 70 HIS HA . 27880 1 374 . 1 1 70 70 HIS C C 13 173.86 0.01 . 1 . . . . . 70 HIS C . 27880 1 375 . 1 1 70 70 HIS CA C 13 56.11 0.01 . 1 . . . . . 70 HIS CA . 27880 1 376 . 1 1 70 70 HIS CB C 13 32.70 0.01 . 1 . . . . . 70 HIS CB . 27880 1 377 . 1 1 70 70 HIS N N 15 117.85 0.01 . 1 . . . . . 70 HIS N . 27880 1 378 . 1 1 71 71 TYR H H 1 8.760 0.01 . 1 . . . . . 71 TYR H . 27880 1 379 . 1 1 71 71 TYR HA H 1 4.885 0.01 . 1 . . . . . 71 TYR HA . 27880 1 380 . 1 1 71 71 TYR C C 13 171.82 0.01 . 1 . . . . . 71 TYR C . 27880 1 381 . 1 1 71 71 TYR CA C 13 57.81 0.01 . 1 . . . . . 71 TYR CA . 27880 1 382 . 1 1 71 71 TYR CB C 13 42.39 0.01 . 1 . . . . . 71 TYR CB . 27880 1 383 . 1 1 71 71 TYR N N 15 122.35 0.01 . 1 . . . . . 71 TYR N . 27880 1 384 . 1 1 72 72 TYR H H 1 7.489 0.01 . 1 . . . . . 72 TYR H . 27880 1 385 . 1 1 72 72 TYR HA H 1 5.027 0.01 . 1 . . . . . 72 TYR HA . 27880 1 386 . 1 1 72 72 TYR C C 13 172.90 0.01 . 1 . . . . . 72 TYR C . 27880 1 387 . 1 1 72 72 TYR CA C 13 56.54 0.01 . 1 . . . . . 72 TYR CA . 27880 1 388 . 1 1 72 72 TYR CB C 13 38.58 0.01 . 1 . . . . . 72 TYR CB . 27880 1 389 . 1 1 72 72 TYR N N 15 127.17 0.01 . 1 . . . . . 72 TYR N . 27880 1 390 . 1 1 73 73 THR H H 1 8.529 0.01 . 1 . . . . . 73 THR H . 27880 1 391 . 1 1 73 73 THR HA H 1 4.083 0.01 . 1 . . . . . 73 THR HA . 27880 1 392 . 1 1 73 73 THR C C 13 170.50 0.01 . 1 . . . . . 73 THR C . 27880 1 393 . 1 1 73 73 THR CA C 13 60.04 0.01 . 1 . . . . . 73 THR CA . 27880 1 394 . 1 1 73 73 THR CB C 13 69.31 0.01 . 1 . . . . . 73 THR CB . 27880 1 395 . 1 1 73 73 THR N N 15 119.03 0.01 . 1 . . . . . 73 THR N . 27880 1 396 . 1 1 74 74 SER H H 1 7.933 0.01 . 1 . . . . . 74 SER H . 27880 1 397 . 1 1 74 74 SER HA H 1 5.753 0.01 . 1 . . . . . 74 SER HA . 27880 1 398 . 1 1 74 74 SER C C 13 173.36 0.01 . 1 . . . . . 74 SER C . 27880 1 399 . 1 1 74 74 SER CA C 13 56.78 0.01 . 1 . . . . . 74 SER CA . 27880 1 400 . 1 1 74 74 SER CB C 13 66.22 0.01 . 1 . . . . . 74 SER CB . 27880 1 401 . 1 1 74 74 SER N N 15 116.66 0.01 . 1 . . . . . 74 SER N . 27880 1 402 . 1 1 75 75 GLU H H 1 8.599 0.01 . 1 . . . . . 75 GLU H . 27880 1 403 . 1 1 75 75 GLU HA H 1 4.935 0.01 . 1 . . . . . 75 GLU HA . 27880 1 404 . 1 1 75 75 GLU C C 13 174.33 0.01 . 1 . . . . . 75 GLU C . 27880 1 405 . 1 1 75 75 GLU CA C 13 54.63 0.01 . 1 . . . . . 75 GLU CA . 27880 1 406 . 1 1 75 75 GLU N N 15 120.77 0.01 . 1 . . . . . 75 GLU N . 27880 1 407 . 1 1 76 76 GLN H H 1 8.945 0.01 . 1 . . . . . 76 GLN H . 27880 1 408 . 1 1 76 76 GLN HA H 1 4.066 0.01 . 1 . . . . . 76 GLN HA . 27880 1 409 . 1 1 76 76 GLN HE21 H 1 6.775 . . . . . . . . 76 GLN HE21 . 27880 1 410 . 1 1 76 76 GLN HE22 H 1 6.769 . . . . . . . . 76 GLN HE22 . 27880 1 411 . 1 1 76 76 GLN C C 13 175.76 0.01 . 1 . . . . . 76 GLN C . 27880 1 412 . 1 1 76 76 GLN CA C 13 55.75 0.01 . 1 . . . . . 76 GLN CA . 27880 1 413 . 1 1 76 76 GLN CB C 13 30.38 0.01 . 1 . . . . . 76 GLN CB . 27880 1 414 . 1 1 76 76 GLN N N 15 124.53 0.01 . 1 . . . . . 76 GLN N . 27880 1 415 . 1 1 76 76 GLN NE2 N 15 111.51 . . . . . . . . 76 GLN NE2 . 27880 1 416 . 1 1 77 77 VAL H H 1 8.711 0.01 . 1 . . . . . 77 VAL H . 27880 1 417 . 1 1 77 77 VAL HA H 1 4.024 0.01 . 1 . . . . . 77 VAL HA . 27880 1 418 . 1 1 77 77 VAL C C 13 174.72 0.01 . 1 . . . . . 77 VAL C . 27880 1 419 . 1 1 77 77 VAL CA C 13 60.94 0.01 . 1 . . . . . 77 VAL CA . 27880 1 420 . 1 1 77 77 VAL CB C 13 33.82 0.01 . 1 . . . . . 77 VAL CB . 27880 1 421 . 1 1 77 77 VAL N N 15 124.20 0.01 . 1 . . . . . 77 VAL N . 27880 1 422 . 1 1 78 78 LYS H H 1 8.398 0.01 . 1 . . . . . 78 LYS H . 27880 1 423 . 1 1 78 78 LYS HA H 1 3.712 0.01 . 1 . . . . . 78 LYS HA . 27880 1 424 . 1 1 78 78 LYS C C 13 176.01 0.01 . 1 . . . . . 78 LYS C . 27880 1 425 . 1 1 78 78 LYS CA C 13 58.82 0.01 . 1 . . . . . 78 LYS CA . 27880 1 426 . 1 1 78 78 LYS CB C 13 31.48 0.01 . 1 . . . . . 78 LYS CB . 27880 1 427 . 1 1 78 78 LYS N N 15 127.44 0.01 . 1 . . . . . 78 LYS N . 27880 1 428 . 1 1 79 79 TYR H H 1 7.820 0.01 . 1 . . . . . 79 TYR H . 27880 1 429 . 1 1 79 79 TYR HA H 1 4.292 0.01 . 1 . . . . . 79 TYR HA . 27880 1 430 . 1 1 79 79 TYR C C 13 173.39 0.01 . 1 . . . . . 79 TYR C . 27880 1 431 . 1 1 79 79 TYR CA C 13 56.99 0.01 . 1 . . . . . 79 TYR CA . 27880 1 432 . 1 1 79 79 TYR CB C 13 35.50 0.01 . 1 . . . . . 79 TYR CB . 27880 1 433 . 1 1 79 79 TYR N N 15 112.59 0.01 . 1 . . . . . 79 TYR N . 27880 1 434 . 1 1 80 80 PHE H H 1 6.893 0.01 . 1 . . . . . 80 PHE H . 27880 1 435 . 1 1 80 80 PHE HA H 1 5.374 0.01 . 1 . . . . . 80 PHE HA . 27880 1 436 . 1 1 80 80 PHE C C 13 173.33 0.01 . 1 . . . . . 80 PHE C . 27880 1 437 . 1 1 80 80 PHE CA C 13 56.44 0.01 . 1 . . . . . 80 PHE CA . 27880 1 438 . 1 1 80 80 PHE CB C 13 43.48 0.01 . 1 . . . . . 80 PHE CB . 27880 1 439 . 1 1 80 80 PHE N N 15 114.34 0.01 . 1 . . . . . 80 PHE N . 27880 1 440 . 1 1 81 81 THR H H 1 8.559 0.01 . 1 . . . . . 81 THR H . 27880 1 441 . 1 1 81 81 THR HA H 1 4.609 0.01 . 1 . . . . . 81 THR HA . 27880 1 442 . 1 1 81 81 THR C C 13 172.96 0.01 . 1 . . . . . 81 THR C . 27880 1 443 . 1 1 81 81 THR CA C 13 59.05 0.01 . 1 . . . . . 81 THR CA . 27880 1 444 . 1 1 81 81 THR CB C 13 71.19 0.01 . 1 . . . . . 81 THR CB . 27880 1 445 . 1 1 81 81 THR N N 15 107.80 0.01 . 1 . . . . . 81 THR N . 27880 1 446 . 1 1 82 82 ASN H H 1 8.605 0.01 . 1 . . . . . 82 ASN H . 27880 1 447 . 1 1 82 82 ASN HA H 1 4.373 0.01 . 1 . . . . . 82 ASN HA . 27880 1 448 . 1 1 82 82 ASN HD21 H 1 8.190 . . . . . . . . 82 ASN HD21 . 27880 1 449 . 1 1 82 82 ASN HD22 H 1 6.844 . . . . . . . . 82 ASN HD22 . 27880 1 450 . 1 1 82 82 ASN C C 13 175.21 0.01 . 1 . . . . . 82 ASN C . 27880 1 451 . 1 1 82 82 ASN CA C 13 54.13 0.01 . 1 . . . . . 82 ASN CA . 27880 1 452 . 1 1 82 82 ASN CB C 13 37.04 0.01 . 1 . . . . . 82 ASN CB . 27880 1 453 . 1 1 82 82 ASN N N 15 118.42 0.01 . 1 . . . . . 82 ASN N . 27880 1 454 . 1 1 82 82 ASN ND2 N 15 115.14 . . . . . . . . 82 ASN ND2 . 27880 1 455 . 1 1 83 83 ILE H H 1 8.294 0.01 . 1 . . . . . 83 ILE H . 27880 1 456 . 1 1 83 83 ILE HA H 1 4.157 0.01 . 1 . . . . . 83 ILE HA . 27880 1 457 . 1 1 83 83 ILE CA C 13 59.8 0.01 . 1 . . . . . 83 ILE CA . 27880 1 458 . 1 1 83 83 ILE CB C 13 36.97 0.01 . 1 . . . . . 83 ILE CB . 27880 1 459 . 1 1 83 83 ILE N N 15 120.55 0.01 . 1 . . . . . 83 ILE N . 27880 1 460 . 1 1 85 85 PRO HA H 1 4.725 0.01 . 1 . . . . . 85 PRO HA . 27880 1 461 . 1 1 85 85 PRO C C 13 177.01 0.01 . 1 . . . . . 85 PRO C . 27880 1 462 . 1 1 85 85 PRO CA C 13 62.29 0.01 . 1 . . . . . 85 PRO CA . 27880 1 463 . 1 1 85 85 PRO CB C 13 32.66 0.01 . 1 . . . . . 85 PRO CB . 27880 1 464 . 1 1 86 86 VAL H H 1 8.303 0.01 . 1 . . . . . 86 VAL H . 27880 1 465 . 1 1 86 86 VAL HA H 1 3.960 0.01 . 1 . . . . . 86 VAL HA . 27880 1 466 . 1 1 86 86 VAL C C 13 173.88 0.01 . 1 . . . . . 86 VAL C . 27880 1 467 . 1 1 86 86 VAL CA C 13 61.10 0.01 . 1 . . . . . 86 VAL CA . 27880 1 468 . 1 1 86 86 VAL CB C 13 33.71 0.01 . 1 . . . . . 86 VAL CB . 27880 1 469 . 1 1 86 86 VAL N N 15 121.61 0.01 . 1 . . . . . 86 VAL N . 27880 1 470 . 1 1 87 87 HIS H H 1 8.182 0.01 . 1 . . . . . 87 HIS H . 27880 1 471 . 1 1 87 87 HIS HA H 1 5.157 0.01 . 1 . . . . . 87 HIS HA . 27880 1 472 . 1 1 87 87 HIS C C 13 174.07 0.01 . 1 . . . . . 87 HIS C . 27880 1 473 . 1 1 87 87 HIS CA C 13 54.91 0.01 . 1 . . . . . 87 HIS CA . 27880 1 474 . 1 1 87 87 HIS CB C 13 33.91 0.01 . 1 . . . . . 87 HIS CB . 27880 1 475 . 1 1 87 87 HIS N N 15 126.66 0.01 . 1 . . . . . 87 HIS N . 27880 1 476 . 1 1 88 88 PHE H H 1 7.915 0.01 . 1 . . . . . 88 PHE H . 27880 1 477 . 1 1 88 88 PHE HA H 1 4.497 0.01 . 1 . . . . . 88 PHE HA . 27880 1 478 . 1 1 88 88 PHE C C 13 173.11 0.01 . 1 . . . . . 88 PHE C . 27880 1 479 . 1 1 88 88 PHE CA C 13 56.68 0.01 . 1 . . . . . 88 PHE CA . 27880 1 480 . 1 1 88 88 PHE CB C 13 41.31 0.01 . 1 . . . . . 88 PHE CB . 27880 1 481 . 1 1 88 88 PHE N N 15 126.07 0.01 . 1 . . . . . 88 PHE N . 27880 1 482 . 1 1 89 89 ASP H H 1 8.364 0.01 . 1 . . . . . 89 ASP H . 27880 1 483 . 1 1 89 89 ASP HA H 1 5.727 0.01 . 1 . . . . . 89 ASP HA . 27880 1 484 . 1 1 89 89 ASP C C 13 176.07 0.01 . 1 . . . . . 89 ASP C . 27880 1 485 . 1 1 89 89 ASP CA C 13 54.31 0.01 . 1 . . . . . 89 ASP CA . 27880 1 486 . 1 1 89 89 ASP CB C 13 41.66 0.01 . 1 . . . . . 89 ASP CB . 27880 1 487 . 1 1 89 89 ASP N N 15 125.68 0.01 . 1 . . . . . 89 ASP N . 27880 1 488 . 1 1 90 90 VAL H H 1 8.728 0.01 . 1 . . . . . 90 VAL H . 27880 1 489 . 1 1 90 90 VAL HA H 1 4.956 0.01 . 1 . . . . . 90 VAL HA . 27880 1 490 . 1 1 90 90 VAL C C 13 173.77 0.01 . 1 . . . . . 90 VAL C . 27880 1 491 . 1 1 90 90 VAL CA C 13 58.19 0.01 . 1 . . . . . 90 VAL CA . 27880 1 492 . 1 1 90 90 VAL CB C 13 36.37 0.01 . 1 . . . . . 90 VAL CB . 27880 1 493 . 1 1 90 90 VAL N N 15 116.48 0.01 . 1 . . . . . 90 VAL N . 27880 1 494 . 1 1 91 91 VAL H H 1 7.982 0.01 . 1 . . . . . 91 VAL H . 27880 1 495 . 1 1 91 91 VAL HA H 1 4.605 0.01 . 1 . . . . . 91 VAL HA . 27880 1 496 . 1 1 91 91 VAL C C 13 176.62 0.01 . 1 . . . . . 91 VAL C . 27880 1 497 . 1 1 91 91 VAL CA C 13 62.94 0.01 . 1 . . . . . 91 VAL CA . 27880 1 498 . 1 1 91 91 VAL CB C 13 31.41 0.01 . 1 . . . . . 91 VAL CB . 27880 1 499 . 1 1 91 91 VAL N N 15 121.12 0.01 . 1 . . . . . 91 VAL N . 27880 1 500 . 1 1 92 92 CYS H H 1 9.921 0.01 . 1 . . . . . 92 CYS H . 27880 1 501 . 1 1 92 92 CYS HA H 1 4.156 0.01 . 1 . . . . . 92 CYS HA . 27880 1 502 . 1 1 92 92 CYS C C 13 174.47 0.01 . 1 . . . . . 92 CYS C . 27880 1 503 . 1 1 92 92 CYS CA C 13 58.88 0.01 . 1 . . . . . 92 CYS CA . 27880 1 504 . 1 1 92 92 CYS CB C 13 30.54 0.01 . 1 . . . . . 92 CYS CB . 27880 1 505 . 1 1 92 92 CYS N N 15 131.44 0.01 . 1 . . . . . 92 CYS N . 27880 1 506 . 1 1 93 93 ALA H H 1 8.698 0.01 . 1 . . . . . 93 ALA H . 27880 1 507 . 1 1 93 93 ALA HA H 1 3.758 0.01 . 1 . . . . . 93 ALA HA . 27880 1 508 . 1 1 93 93 ALA C C 13 180.43 0.01 . 1 . . . . . 93 ALA C . 27880 1 509 . 1 1 93 93 ALA CA C 13 54.94 0.01 . 1 . . . . . 93 ALA CA . 27880 1 510 . 1 1 93 93 ALA CB C 13 19.22 0.01 . 1 . . . . . 93 ALA CB . 27880 1 511 . 1 1 93 93 ALA N N 15 118.66 0.01 . 1 . . . . . 93 ALA N . 27880 1 512 . 1 1 94 94 ASP H H 1 7.738 0.01 . 1 . . . . . 94 ASP H . 27880 1 513 . 1 1 94 94 ASP HA H 1 4.402 0.01 . 1 . . . . . 94 ASP HA . 27880 1 514 . 1 1 94 94 ASP C C 13 178.86 0.01 . 1 . . . . . 94 ASP C . 27880 1 515 . 1 1 94 94 ASP CA C 13 57.49 0.01 . 1 . . . . . 94 ASP CA . 27880 1 516 . 1 1 94 94 ASP CB C 13 41.03 0.01 . 1 . . . . . 94 ASP CB . 27880 1 517 . 1 1 94 94 ASP N N 15 117.48 0.01 . 1 . . . . . 94 ASP N . 27880 1 518 . 1 1 95 95 CYS H H 1 8.570 0.01 . 1 . . . . . 95 CYS H . 27880 1 519 . 1 1 95 95 CYS HA H 1 3.990 0.01 . 1 . . . . . 95 CYS HA . 27880 1 520 . 1 1 95 95 CYS C C 13 178.44 0.01 . 1 . . . . . 95 CYS C . 27880 1 521 . 1 1 95 95 CYS CA C 13 60.72 0.01 . 1 . . . . . 95 CYS CA . 27880 1 522 . 1 1 95 95 CYS CB C 13 31.52 0.01 . 1 . . . . . 95 CYS CB . 27880 1 523 . 1 1 95 95 CYS N N 15 126.70 0.01 . 1 . . . . . 95 CYS N . 27880 1 524 . 1 1 96 96 GLU H H 1 8.591 0.01 . 1 . . . . . 96 GLU H . 27880 1 525 . 1 1 96 96 GLU HA H 1 3.895 0.01 . 1 . . . . . 96 GLU HA . 27880 1 526 . 1 1 96 96 GLU C C 13 178.34 0.01 . 1 . . . . . 96 GLU C . 27880 1 527 . 1 1 96 96 GLU CA C 13 59.14 0.01 . 1 . . . . . 96 GLU CA . 27880 1 528 . 1 1 96 96 GLU CB C 13 29.84 0.01 . 1 . . . . . 96 GLU CB . 27880 1 529 . 1 1 96 96 GLU N N 15 120.86 0.01 . 1 . . . . . 96 GLU N . 27880 1 530 . 1 1 97 97 ARG H H 1 7.528 0.01 . 1 . . . . . 97 ARG H . 27880 1 531 . 1 1 97 97 ARG HA H 1 4.200 0.01 . 1 . . . . . 97 ARG HA . 27880 1 532 . 1 1 97 97 ARG C C 13 177.55 0.01 . 1 . . . . . 97 ARG C . 27880 1 533 . 1 1 97 97 ARG CA C 13 57.75 0.01 . 1 . . . . . 97 ARG CA . 27880 1 534 . 1 1 97 97 ARG CB C 13 30.39 0.01 . 1 . . . . . 97 ARG CB . 27880 1 535 . 1 1 97 97 ARG N N 15 117.39 0.01 . 1 . . . . . 97 ARG N . 27880 1 536 . 1 1 98 98 SER H H 1 7.771 0.01 . 1 . . . . . 98 SER H . 27880 1 537 . 1 1 98 98 SER HA H 1 4.267 0.01 . 1 . . . . . 98 SER HA . 27880 1 538 . 1 1 98 98 SER C C 13 175.40 0.01 . 1 . . . . . 98 SER C . 27880 1 539 . 1 1 98 98 SER CA C 13 60.22 0.01 . 1 . . . . . 98 SER CA . 27880 1 540 . 1 1 98 98 SER CB C 13 63.44 0.01 . 1 . . . . . 98 SER CB . 27880 1 541 . 1 1 98 98 SER N N 15 115.04 0.01 . 1 . . . . . 98 SER N . 27880 1 542 . 1 1 99 99 VAL H H 1 7.795 0.01 . 1 . . . . . 99 VAL H . 27880 1 543 . 1 1 99 99 VAL HA H 1 3.987 0.01 . 1 . . . . . 99 VAL HA . 27880 1 544 . 1 1 99 99 VAL C C 13 176.94 0.01 . 1 . . . . . 99 VAL C . 27880 1 545 . 1 1 99 99 VAL CA C 13 63.80 0.01 . 1 . . . . . 99 VAL CA . 27880 1 546 . 1 1 99 99 VAL CB C 13 32.29 0.01 . 1 . . . . . 99 VAL CB . 27880 1 547 . 1 1 99 99 VAL N N 15 120.63 0.01 . 1 . . . . . 99 VAL N . 27880 1 548 . 1 1 100 100 GLN H H 1 8.060 0.01 . 1 . . . . . 100 GLN H . 27880 1 549 . 1 1 100 100 GLN HA H 1 4.255 0.01 . 1 . . . . . 100 GLN HA . 27880 1 550 . 1 1 100 100 GLN HE21 H 1 7.544 . . . . . . . . 100 GLN HE21 . 27880 1 551 . 1 1 100 100 GLN HE22 H 1 6.806 . . . . . . . . 100 GLN HE22 . 27880 1 552 . 1 1 100 100 GLN C C 13 177.09 0.01 . 1 . . . . . 100 GLN C . 27880 1 553 . 1 1 100 100 GLN CA C 13 57.06 0.01 . 1 . . . . . 100 GLN CA . 27880 1 554 . 1 1 100 100 GLN CB C 13 28.88 0.01 . 1 . . . . . 100 GLN CB . 27880 1 555 . 1 1 100 100 GLN N N 15 121.98 0.01 . 1 . . . . . 100 GLN N . 27880 1 556 . 1 1 100 100 GLN NE2 N 15 112.19 . . . . . . . . 100 GLN NE2 . 27880 1 557 . 1 1 101 101 LEU H H 1 8.176 0.01 . 1 . . . . . 101 LEU H . 27880 1 558 . 1 1 101 101 LEU HA H 1 4.234 0.01 . 1 . . . . . 101 LEU HA . 27880 1 559 . 1 1 101 101 LEU C C 13 177.95 0.01 . 1 . . . . . 101 LEU C . 27880 1 560 . 1 1 101 101 LEU CA C 13 56.42 0.01 . 1 . . . . . 101 LEU CA . 27880 1 561 . 1 1 101 101 LEU CB C 13 41.30 0.01 . 1 . . . . . 101 LEU CB . 27880 1 562 . 1 1 101 101 LEU N N 15 122.63 0.01 . 1 . . . . . 101 LEU N . 27880 1 563 . 1 1 102 102 ASP H H 1 8.209 0.01 . 1 . . . . . 102 ASP H . 27880 1 564 . 1 1 102 102 ASP HA H 1 4.448 0.01 . 1 . . . . . 102 ASP HA . 27880 1 565 . 1 1 102 102 ASP C C 13 177.23 0.01 . 1 . . . . . 102 ASP C . 27880 1 566 . 1 1 102 102 ASP CA C 13 56.33 0.01 . 1 . . . . . 102 ASP CA . 27880 1 567 . 1 1 102 102 ASP CB C 13 41.20 0.01 . 1 . . . . . 102 ASP CB . 27880 1 568 . 1 1 102 102 ASP N N 15 120.65 0.01 . 1 . . . . . 102 ASP N . 27880 1 569 . 1 1 103 103 ASP H H 1 8.241 0.01 . 1 . . . . . 103 ASP H . 27880 1 570 . 1 1 103 103 ASP HA H 1 4.469 0.01 . 1 . . . . . 103 ASP HA . 27880 1 571 . 1 1 103 103 ASP C C 13 177.91 0.01 . 1 . . . . . 103 ASP C . 27880 1 572 . 1 1 103 103 ASP CA C 13 56.06 0.01 . 1 . . . . . 103 ASP CA . 27880 1 573 . 1 1 103 103 ASP CB C 13 41.10 0.01 . 1 . . . . . 103 ASP CB . 27880 1 574 . 1 1 103 103 ASP N N 15 120.64 0.01 . 1 . . . . . 103 ASP N . 27880 1 575 . 1 1 104 104 GLU H H 1 8.236 0.01 . 1 . . . . . 104 GLU H . 27880 1 576 . 1 1 104 104 GLU HA H 1 4.024 0.01 . 1 . . . . . 104 GLU HA . 27880 1 577 . 1 1 104 104 GLU C C 13 178.11 0.01 . 1 . . . . . 104 GLU C . 27880 1 578 . 1 1 104 104 GLU CA C 13 59.17 0.01 . 1 . . . . . 104 GLU CA . 27880 1 579 . 1 1 104 104 GLU CB C 13 29.60 0.01 . 1 . . . . . 104 GLU CB . 27880 1 580 . 1 1 104 104 GLU N N 15 121.66 0.01 . 1 . . . . . 104 GLU N . 27880 1 581 . 1 1 105 105 ILE H H 1 7.729 0.01 . 1 . . . . . 105 ILE H . 27880 1 582 . 1 1 105 105 ILE HA H 1 3.129 0.01 . 1 . . . . . 105 ILE HA . 27880 1 583 . 1 1 105 105 ILE C C 13 177.64 0.01 . 1 . . . . . 105 ILE C . 27880 1 584 . 1 1 105 105 ILE CA C 13 63.96 0.01 . 1 . . . . . 105 ILE CA . 27880 1 585 . 1 1 105 105 ILE CB C 13 36.40 0.01 . 1 . . . . . 105 ILE CB . 27880 1 586 . 1 1 105 105 ILE N N 15 119.92 0.01 . 1 . . . . . 105 ILE N . 27880 1 587 . 1 1 106 106 ASP H H 1 7.655 0.01 . 1 . . . . . 106 ASP H . 27880 1 588 . 1 1 106 106 ASP HA H 1 4.254 0.01 . 1 . . . . . 106 ASP HA . 27880 1 589 . 1 1 106 106 ASP C C 13 179.21 0.01 . 1 . . . . . 106 ASP C . 27880 1 590 . 1 1 106 106 ASP CA C 13 57.81 0.01 . 1 . . . . . 106 ASP CA . 27880 1 591 . 1 1 106 106 ASP CB C 13 40.55 0.01 . 1 . . . . . 106 ASP CB . 27880 1 592 . 1 1 106 106 ASP N N 15 118.16 0.01 . 1 . . . . . 106 ASP N . 27880 1 593 . 1 1 107 107 ARG H H 1 8.141 0.01 . 1 . . . . . 107 ARG H . 27880 1 594 . 1 1 107 107 ARG HA H 1 4.047 0.01 . 1 . . . . . 107 ARG HA . 27880 1 595 . 1 1 107 107 ARG C C 13 179.06 0.01 . 1 . . . . . 107 ARG C . 27880 1 596 . 1 1 107 107 ARG CA C 13 59.81 0.01 . 1 . . . . . 107 ARG CA . 27880 1 597 . 1 1 107 107 ARG CB C 13 29.60 0.01 . 1 . . . . . 107 ARG CB . 27880 1 598 . 1 1 107 107 ARG N N 15 121.31 0.01 . 1 . . . . . 107 ARG N . 27880 1 599 . 1 1 108 108 GLU H H 1 8.269 0.01 . 1 . . . . . 108 GLU H . 27880 1 600 . 1 1 108 108 GLU HA H 1 4.135 0.01 . 1 . . . . . 108 GLU HA . 27880 1 601 . 1 1 108 108 GLU C C 13 180.81 0.01 . 1 . . . . . 108 GLU C . 27880 1 602 . 1 1 108 108 GLU CA C 13 59.83 0.01 . 1 . . . . . 108 GLU CA . 27880 1 603 . 1 1 108 108 GLU CB C 13 29.25 0.01 . 1 . . . . . 108 GLU CB . 27880 1 604 . 1 1 108 108 GLU N N 15 119.87 0.01 . 1 . . . . . 108 GLU N . 27880 1 605 . 1 1 109 109 HIS H H 1 8.516 0.01 . 1 . . . . . 109 HIS H . 27880 1 606 . 1 1 109 109 HIS HA H 1 4.470 0.01 . 1 . . . . . 109 HIS HA . 27880 1 607 . 1 1 109 109 HIS C C 13 176.69 0.01 . 1 . . . . . 109 HIS C . 27880 1 608 . 1 1 109 109 HIS CA C 13 57.78 0.01 . 1 . . . . . 109 HIS CA . 27880 1 609 . 1 1 109 109 HIS CB C 13 28.31 0.01 . 1 . . . . . 109 HIS CB . 27880 1 610 . 1 1 109 109 HIS N N 15 118.06 0.01 . 1 . . . . . 109 HIS N . 27880 1 611 . 1 1 110 110 GLN H H 1 8.502 0.01 . 1 . . . . . 110 GLN H . 27880 1 612 . 1 1 110 110 GLN HA H 1 4.155 0.01 . 1 . . . . . 110 GLN HA . 27880 1 613 . 1 1 110 110 GLN C C 13 179.30 0.01 . 1 . . . . . 110 GLN C . 27880 1 614 . 1 1 110 110 GLN CA C 13 59.72 0.01 . 1 . . . . . 110 GLN CA . 27880 1 615 . 1 1 110 110 GLN CB C 13 28.05 0.01 . 1 . . . . . 110 GLN CB . 27880 1 616 . 1 1 110 110 GLN N N 15 119.07 0.01 . 1 . . . . . 110 GLN N . 27880 1 617 . 1 1 111 111 GLU H H 1 8.316 0.01 . 1 . . . . . 111 GLU H . 27880 1 618 . 1 1 111 111 GLU HA H 1 4.148 0.01 . 1 . . . . . 111 GLU HA . 27880 1 619 . 1 1 111 111 GLU C C 13 179.92 0.01 . 1 . . . . . 111 GLU C . 27880 1 620 . 1 1 111 111 GLU CA C 13 59.63 0.01 . 1 . . . . . 111 GLU CA . 27880 1 621 . 1 1 111 111 GLU CB C 13 29.78 0.01 . 1 . . . . . 111 GLU CB . 27880 1 622 . 1 1 111 111 GLU N N 15 120.22 0.01 . 1 . . . . . 111 GLU N . 27880 1 623 . 1 1 112 112 ARG H H 1 7.877 0.01 . 1 . . . . . 112 ARG H . 27880 1 624 . 1 1 112 112 ARG HA H 1 4.334 0.01 . 1 . . . . . 112 ARG HA . 27880 1 625 . 1 1 112 112 ARG C C 13 179.48 0.01 . 1 . . . . . 112 ARG C . 27880 1 626 . 1 1 112 112 ARG CA C 13 57.78 0.01 . 1 . . . . . 112 ARG CA . 27880 1 627 . 1 1 112 112 ARG CB C 13 29.09 0.01 . 1 . . . . . 112 ARG CB . 27880 1 628 . 1 1 112 112 ARG N N 15 119.78 0.01 . 1 . . . . . 112 ARG N . 27880 1 629 . 1 1 113 113 ASN H H 1 9.371 0.01 . 1 . . . . . 113 ASN H . 27880 1 630 . 1 1 113 113 ASN HA H 1 4.917 0.01 . 1 . . . . . 113 ASN HA . 27880 1 631 . 1 1 113 113 ASN HD21 H 1 7.438 . . . . . . . . 113 ASN HD21 . 27880 1 632 . 1 1 113 113 ASN HD22 H 1 7.260 . . . . . . . . 113 ASN HD22 . 27880 1 633 . 1 1 113 113 ASN C C 13 178.17 0.01 . 1 . . . . . 113 ASN C . 27880 1 634 . 1 1 113 113 ASN CA C 13 55.40 0.01 . 1 . . . . . 113 ASN CA . 27880 1 635 . 1 1 113 113 ASN CB C 13 37.06 0.01 . 1 . . . . . 113 ASN CB . 27880 1 636 . 1 1 113 113 ASN N N 15 119.70 0.01 . 1 . . . . . 113 ASN N . 27880 1 637 . 1 1 113 113 ASN ND2 N 15 106.50 . . . . . . . . 113 ASN ND2 . 27880 1 638 . 1 1 114 114 ALA H H 1 8.163 0.01 . 1 . . . . . 114 ALA H . 27880 1 639 . 1 1 114 114 ALA HA H 1 4.328 0.01 . 1 . . . . . 114 ALA HA . 27880 1 640 . 1 1 114 114 ALA C C 13 181.07 0.01 . 1 . . . . . 114 ALA C . 27880 1 641 . 1 1 114 114 ALA CA C 13 55.48 0.01 . 1 . . . . . 114 ALA CA . 27880 1 642 . 1 1 114 114 ALA CB C 13 17.85 0.01 . 1 . . . . . 114 ALA CB . 27880 1 643 . 1 1 114 114 ALA N N 15 125.24 0.01 . 1 . . . . . 114 ALA N . 27880 1 644 . 1 1 115 115 GLU H H 1 7.355 0.01 . 1 . . . . . 115 GLU H . 27880 1 645 . 1 1 115 115 GLU HA H 1 4.329 0.01 . 1 . . . . . 115 GLU HA . 27880 1 646 . 1 1 115 115 GLU C C 13 179.48 0.01 . 1 . . . . . 115 GLU C . 27880 1 647 . 1 1 115 115 GLU CA C 13 58.96 0.01 . 1 . . . . . 115 GLU CA . 27880 1 648 . 1 1 115 115 GLU CB C 13 29.47 0.01 . 1 . . . . . 115 GLU CB . 27880 1 649 . 1 1 115 115 GLU N N 15 120.34 0.01 . 1 . . . . . 115 GLU N . 27880 1 650 . 1 1 116 116 ILE H H 1 8.448 0.01 . 1 . . . . . 116 ILE H . 27880 1 651 . 1 1 116 116 ILE HA H 1 3.529 0.01 . 1 . . . . . 116 ILE HA . 27880 1 652 . 1 1 116 116 ILE C C 13 178.33 0.01 . 1 . . . . . 116 ILE C . 27880 1 653 . 1 1 116 116 ILE CA C 13 66.04 0.01 . 1 . . . . . 116 ILE CA . 27880 1 654 . 1 1 116 116 ILE CB C 13 42.91 0.01 . 1 . . . . . 116 ILE CB . 27880 1 655 . 1 1 116 116 ILE N N 15 123.12 0.01 . 1 . . . . . 116 ILE N . 27880 1 656 . 1 1 117 117 SER H H 1 8.956 0.01 . 1 . . . . . 117 SER H . 27880 1 657 . 1 1 117 117 SER HA H 1 4.503 0.01 . 1 . . . . . 117 SER HA . 27880 1 658 . 1 1 117 117 SER C C 13 177.55 0.01 . 1 . . . . . 117 SER C . 27880 1 659 . 1 1 117 117 SER CA C 13 61.81 0.01 . 1 . . . . . 117 SER CA . 27880 1 660 . 1 1 117 117 SER CB C 13 62.91 0.01 . 1 . . . . . 117 SER CB . 27880 1 661 . 1 1 117 117 SER N N 15 115.32 0.01 . 1 . . . . . 117 SER N . 27880 1 662 . 1 1 118 118 ALA H H 1 7.667 0.01 . 1 . . . . . 118 ALA H . 27880 1 663 . 1 1 118 118 ALA HA H 1 4.310 0.01 . 1 . . . . . 118 ALA HA . 27880 1 664 . 1 1 118 118 ALA C C 13 180.87 0.01 . 1 . . . . . 118 ALA C . 27880 1 665 . 1 1 118 118 ALA CA C 13 55.32 0.01 . 1 . . . . . 118 ALA CA . 27880 1 666 . 1 1 118 118 ALA CB C 13 18.08 0.01 . 1 . . . . . 118 ALA CB . 27880 1 667 . 1 1 118 118 ALA N N 15 124.10 0.01 . 1 . . . . . 118 ALA N . 27880 1 668 . 1 1 119 119 CYS H H 1 8.419 0.01 . 1 . . . . . 119 CYS H . 27880 1 669 . 1 1 119 119 CYS HA H 1 4.157 0.01 . 1 . . . . . 119 CYS HA . 27880 1 670 . 1 1 119 119 CYS C C 13 178.25 0.01 . 1 . . . . . 119 CYS C . 27880 1 671 . 1 1 119 119 CYS CA C 13 63.52 0.01 . 1 . . . . . 119 CYS CA . 27880 1 672 . 1 1 119 119 CYS CB C 13 27.06 0.01 . 1 . . . . . 119 CYS CB . 27880 1 673 . 1 1 119 119 CYS N N 15 119.38 0.01 . 1 . . . . . 119 CYS N . 27880 1 674 . 1 1 120 120 ASN H H 1 8.862 0.01 . 1 . . . . . 120 ASN H . 27880 1 675 . 1 1 120 120 ASN HA H 1 4.618 0.01 . 1 . . . . . 120 ASN HA . 27880 1 676 . 1 1 120 120 ASN HD21 H 1 7.056 . . . . . . . . 120 ASN HD21 . 27880 1 677 . 1 1 120 120 ASN HD22 H 1 7.042 . . . . . . . . 120 ASN HD22 . 27880 1 678 . 1 1 120 120 ASN C C 13 177.04 0.01 . 1 . . . . . 120 ASN C . 27880 1 679 . 1 1 120 120 ASN CA C 13 55.36 0.01 . 1 . . . . . 120 ASN CA . 27880 1 680 . 1 1 120 120 ASN CB C 13 37.72 0.01 . 1 . . . . . 120 ASN CB . 27880 1 681 . 1 1 120 120 ASN N N 15 121.44 0.01 . 1 . . . . . 120 ASN N . 27880 1 682 . 1 1 120 120 ASN ND2 N 15 108.95 . . . . . . . . 120 ASN ND2 . 27880 1 683 . 1 1 121 121 ALA H H 1 8.336 0.01 . 1 . . . . . 121 ALA H . 27880 1 684 . 1 1 121 121 ALA HA H 1 4.170 0.01 . 1 . . . . . 121 ALA HA . 27880 1 685 . 1 1 121 121 ALA C C 13 181.06 0.01 . 1 . . . . . 121 ALA C . 27880 1 686 . 1 1 121 121 ALA CA C 13 55.28 0.01 . 1 . . . . . 121 ALA CA . 27880 1 687 . 1 1 121 121 ALA CB C 13 17.98 0.01 . 1 . . . . . 121 ALA CB . 27880 1 688 . 1 1 121 121 ALA N N 15 122.52 0.01 . 1 . . . . . 121 ALA N . 27880 1 689 . 1 1 122 122 ARG H H 1 7.928 0.01 . 1 . . . . . 122 ARG H . 27880 1 690 . 1 1 122 122 ARG HA H 1 4.113 0.01 . 1 . . . . . 122 ARG HA . 27880 1 691 . 1 1 122 122 ARG C C 13 178.78 0.01 . 1 . . . . . 122 ARG C . 27880 1 692 . 1 1 122 122 ARG CA C 13 59.41 0.01 . 1 . . . . . 122 ARG CA . 27880 1 693 . 1 1 122 122 ARG CB C 13 29.72 0.01 . 1 . . . . . 122 ARG CB . 27880 1 694 . 1 1 122 122 ARG N N 15 119.85 0.01 . 1 . . . . . 122 ARG N . 27880 1 695 . 1 1 123 123 ALA H H 1 7.988 0.01 . 1 . . . . . 123 ALA H . 27880 1 696 . 1 1 123 123 ALA HA H 1 3.941 0.01 . 1 . . . . . 123 ALA HA . 27880 1 697 . 1 1 123 123 ALA C C 13 179.97 0.01 . 1 . . . . . 123 ALA C . 27880 1 698 . 1 1 123 123 ALA CA C 13 55.91 0.01 . 1 . . . . . 123 ALA CA . 27880 1 699 . 1 1 123 123 ALA CB C 13 17.80 0.01 . 1 . . . . . 123 ALA CB . 27880 1 700 . 1 1 123 123 ALA N N 15 123.19 0.01 . 1 . . . . . 123 ALA N . 27880 1 701 . 1 1 124 124 LEU H H 1 8.159 0.01 . 1 . . . . . 124 LEU H . 27880 1 702 . 1 1 124 124 LEU HA H 1 4.330 0.01 . 1 . . . . . 124 LEU HA . 27880 1 703 . 1 1 124 124 LEU C C 13 182.07 0.01 . 1 . . . . . 124 LEU C . 27880 1 704 . 1 1 124 124 LEU CA C 13 57.94 0.01 . 1 . . . . . 124 LEU CA . 27880 1 705 . 1 1 124 124 LEU CB C 13 41.77 0.01 . 1 . . . . . 124 LEU CB . 27880 1 706 . 1 1 124 124 LEU N N 15 118.03 0.01 . 1 . . . . . 124 LEU N . 27880 1 707 . 1 1 125 125 SER H H 1 8.014 0.01 . 1 . . . . . 125 SER H . 27880 1 708 . 1 1 125 125 SER HA H 1 4.697 0.01 . 1 . . . . . 125 SER HA . 27880 1 709 . 1 1 125 125 SER C C 13 175.41 0.01 . 1 . . . . . 125 SER C . 27880 1 710 . 1 1 125 125 SER CA C 13 61.37 0.01 . 1 . . . . . 125 SER CA . 27880 1 711 . 1 1 125 125 SER CB C 13 62.93 0.01 . 1 . . . . . 125 SER CB . 27880 1 712 . 1 1 125 125 SER N N 15 116.17 0.01 . 1 . . . . . 125 SER N . 27880 1 713 . 1 1 126 126 GLU H H 1 7.742 0.01 . 1 . . . . . 126 GLU H . 27880 1 714 . 1 1 126 126 GLU HA H 1 4.445 0.01 . 1 . . . . . 126 GLU HA . 27880 1 715 . 1 1 126 126 GLU C C 13 176.64 0.01 . 1 . . . . . 126 GLU C . 27880 1 716 . 1 1 126 126 GLU CA C 13 55.96 0.01 . 1 . . . . . 126 GLU CA . 27880 1 717 . 1 1 126 126 GLU CB C 13 30.49 0.01 . 1 . . . . . 126 GLU CB . 27880 1 718 . 1 1 126 126 GLU N N 15 120.01 0.01 . 1 . . . . . 126 GLU N . 27880 1 719 . 1 1 127 127 GLY H H 1 7.967 0.01 . 1 . . . . . 127 GLY H . 27880 1 720 . 1 1 127 127 GLY HA2 H 1 3.834 0.01 . 2 . . . . . 127 GLY HA2 . 27880 1 721 . 1 1 127 127 GLY HA3 H 1 4.112 0.01 . 2 . . . . . 127 GLY HA3 . 27880 1 722 . 1 1 127 127 GLY C C 13 174.24 0.01 . 1 . . . . . 127 GLY C . 27880 1 723 . 1 1 127 127 GLY CA C 13 46.07 0.01 . 1 . . . . . 127 GLY CA . 27880 1 724 . 1 1 127 127 GLY N N 15 108.37 0.01 . 1 . . . . . 127 GLY N . 27880 1 725 . 1 1 128 128 ARG H H 1 8.283 0.01 . 1 . . . . . 128 ARG H . 27880 1 726 . 1 1 128 128 ARG HA H 1 4.716 0.01 . 1 . . . . . 128 ARG HA . 27880 1 727 . 1 1 128 128 ARG CA C 13 53.55 0.01 . 1 . . . . . 128 ARG CA . 27880 1 728 . 1 1 128 128 ARG N N 15 121.06 0.01 . 1 . . . . . 128 ARG N . 27880 1 729 . 1 1 129 129 PRO HA H 1 4.285 0.01 . 1 . . . . . 129 PRO HA . 27880 1 730 . 1 1 129 129 PRO C C 13 176.54 0.01 . 1 . . . . . 129 PRO C . 27880 1 731 . 1 1 129 129 PRO CA C 13 62.82 0.01 . 1 . . . . . 129 PRO CA . 27880 1 732 . 1 1 129 129 PRO CB C 13 31.91 0.01 . 1 . . . . . 129 PRO CB . 27880 1 733 . 1 1 130 130 ALA H H 1 8.384 0.01 . 1 . . . . . 130 ALA H . 27880 1 734 . 1 1 130 130 ALA HA H 1 4.413 0.01 . 1 . . . . . 130 ALA HA . 27880 1 735 . 1 1 130 130 ALA CA C 13 51.11 0.01 . 1 . . . . . 130 ALA CA . 27880 1 736 . 1 1 130 130 ALA CB C 13 17.83 0.01 . 1 . . . . . 130 ALA CB . 27880 1 737 . 1 1 130 130 ALA N N 15 126.12 0.01 . 1 . . . . . 130 ALA N . 27880 1 738 . 1 1 131 131 SER HA H 1 4.710 0.01 . 1 . . . . . 131 SER HA . 27880 1 739 . 1 1 131 131 SER C C 13 174.59 0.01 . 1 . . . . . 131 SER C . 27880 1 740 . 1 1 131 131 SER CA C 13 58.47 0.01 . 1 . . . . . 131 SER CA . 27880 1 741 . 1 1 131 131 SER CB C 13 64.42 0.01 . 1 . . . . . 131 SER CB . 27880 1 742 . 1 1 132 132 LEU H H 1 8.022 0.01 . 1 . . . . . 132 LEU H . 27880 1 743 . 1 1 132 132 LEU HA H 1 4.355 0.01 . 1 . . . . . 132 LEU HA . 27880 1 744 . 1 1 132 132 LEU C C 13 177.06 0.01 . 1 . . . . . 132 LEU C . 27880 1 745 . 1 1 132 132 LEU CA C 13 55.34 0.01 . 1 . . . . . 132 LEU CA . 27880 1 746 . 1 1 132 132 LEU CB C 13 43.15 0.01 . 1 . . . . . 132 LEU CB . 27880 1 747 . 1 1 132 132 LEU N N 15 123.30 0.01 . 1 . . . . . 132 LEU N . 27880 1 748 . 1 1 133 133 VAL H H 1 9.095 0.01 . 1 . . . . . 133 VAL H . 27880 1 749 . 1 1 133 133 VAL HA H 1 3.989 0.01 . 1 . . . . . 133 VAL HA . 27880 1 750 . 1 1 133 133 VAL C C 13 174.81 0.01 . 1 . . . . . 133 VAL C . 27880 1 751 . 1 1 133 133 VAL CA C 13 60.83 0.01 . 1 . . . . . 133 VAL CA . 27880 1 752 . 1 1 133 133 VAL CB C 13 33.60 0.01 . 1 . . . . . 133 VAL CB . 27880 1 753 . 1 1 133 133 VAL N N 15 122.38 0.01 . 1 . . . . . 133 VAL N . 27880 1 754 . 1 1 134 134 TYR H H 1 7.577 0.01 . 1 . . . . . 134 TYR H . 27880 1 755 . 1 1 134 134 TYR HA H 1 4.457 0.01 . 1 . . . . . 134 TYR HA . 27880 1 756 . 1 1 134 134 TYR C C 13 176.31 0.01 . 1 . . . . . 134 TYR C . 27880 1 757 . 1 1 134 134 TYR CA C 13 57.72 0.01 . 1 . . . . . 134 TYR CA . 27880 1 758 . 1 1 134 134 TYR CB C 13 37.61 0.01 . 1 . . . . . 134 TYR CB . 27880 1 759 . 1 1 134 134 TYR N N 15 119.87 0.01 . 1 . . . . . 134 TYR N . 27880 1 760 . 1 1 135 135 LEU H H 1 9.978 0.01 . 1 . . . . . 135 LEU H . 27880 1 761 . 1 1 135 135 LEU HA H 1 4.471 0.01 . 1 . . . . . 135 LEU HA . 27880 1 762 . 1 1 135 135 LEU C C 13 177.71 0.01 . 1 . . . . . 135 LEU C . 27880 1 763 . 1 1 135 135 LEU CA C 13 56.05 0.01 . 1 . . . . . 135 LEU CA . 27880 1 764 . 1 1 135 135 LEU CB C 13 43.48 0.01 . 1 . . . . . 135 LEU CB . 27880 1 765 . 1 1 135 135 LEU N N 15 123.38 0.01 . 1 . . . . . 135 LEU N . 27880 1 766 . 1 1 136 136 SER H H 1 8.154 0.01 . 1 . . . . . 136 SER H . 27880 1 767 . 1 1 136 136 SER HA H 1 4.178 0.01 . 1 . . . . . 136 SER HA . 27880 1 768 . 1 1 136 136 SER C C 13 173.57 0.01 . 1 . . . . . 136 SER C . 27880 1 769 . 1 1 136 136 SER CA C 13 57.52 0.01 . 1 . . . . . 136 SER CA . 27880 1 770 . 1 1 136 136 SER CB C 13 66.54 0.01 . 1 . . . . . 136 SER CB . 27880 1 771 . 1 1 136 136 SER N N 15 114.27 0.01 . 1 . . . . . 136 SER N . 27880 1 772 . 1 1 137 137 ARG H H 1 9.025 0.01 . 1 . . . . . 137 ARG H . 27880 1 773 . 1 1 137 137 ARG HA H 1 4.690 0.01 . 1 . . . . . 137 ARG HA . 27880 1 774 . 1 1 137 137 ARG C C 13 177.81 0.01 . 1 . . . . . 137 ARG C . 27880 1 775 . 1 1 137 137 ARG CA C 13 58.87 0.01 . 1 . . . . . 137 ARG CA . 27880 1 776 . 1 1 137 137 ARG CB C 13 30.00 0.01 . 1 . . . . . 137 ARG CB . 27880 1 777 . 1 1 137 137 ARG N N 15 117.94 0.01 . 1 . . . . . 137 ARG N . 27880 1 778 . 1 1 138 138 ASP H H 1 7.808 0.01 . 1 . . . . . 138 ASP H . 27880 1 779 . 1 1 138 138 ASP HA H 1 4.615 0.01 . 1 . . . . . 138 ASP HA . 27880 1 780 . 1 1 138 138 ASP C C 13 175.87 0.01 . 1 . . . . . 138 ASP C . 27880 1 781 . 1 1 138 138 ASP CA C 13 55.52 0.01 . 1 . . . . . 138 ASP CA . 27880 1 782 . 1 1 138 138 ASP CB C 13 41.98 0.01 . 1 . . . . . 138 ASP CB . 27880 1 783 . 1 1 138 138 ASP N N 15 116.61 0.01 . 1 . . . . . 138 ASP N . 27880 1 784 . 1 1 139 139 ALA H H 1 7.290 0.01 . 1 . . . . . 139 ALA H . 27880 1 785 . 1 1 139 139 ALA HA H 1 4.297 0.01 . 1 . . . . . 139 ALA HA . 27880 1 786 . 1 1 139 139 ALA C C 13 173.11 0.01 . 1 . . . . . 139 ALA C . 27880 1 787 . 1 1 139 139 ALA CA C 13 54.33 0.01 . 1 . . . . . 139 ALA CA . 27880 1 788 . 1 1 139 139 ALA CB C 13 18.74 0.01 . 1 . . . . . 139 ALA CB . 27880 1 789 . 1 1 139 139 ALA N N 15 121.60 0.01 . 1 . . . . . 139 ALA N . 27880 1 790 . 1 1 140 140 CYS H H 1 8.527 0.01 . 1 . . . . . 140 CYS H . 27880 1 791 . 1 1 140 140 CYS HA H 1 4.444 0.01 . 1 . . . . . 140 CYS HA . 27880 1 792 . 1 1 140 140 CYS C C 13 173.31 0.01 . 1 . . . . . 140 CYS C . 27880 1 793 . 1 1 140 140 CYS CA C 13 59.34 0.01 . 1 . . . . . 140 CYS CA . 27880 1 794 . 1 1 140 140 CYS CB C 13 31.78 0.01 . 1 . . . . . 140 CYS CB . 27880 1 795 . 1 1 140 140 CYS N N 15 129.73 0.01 . 1 . . . . . 140 CYS N . 27880 1 796 . 1 1 141 141 ASP H H 1 7.222 0.01 . 1 . . . . . 141 ASP H . 27880 1 797 . 1 1 141 141 ASP HA H 1 4.894 0.01 . 1 . . . . . 141 ASP HA . 27880 1 798 . 1 1 141 141 ASP C C 13 176.92 0.01 . 1 . . . . . 141 ASP C . 27880 1 799 . 1 1 141 141 ASP CA C 13 52.93 0.01 . 1 . . . . . 141 ASP CA . 27880 1 800 . 1 1 141 141 ASP CB C 13 41.50 0.01 . 1 . . . . . 141 ASP CB . 27880 1 801 . 1 1 141 141 ASP N N 15 126.23 0.01 . 1 . . . . . 141 ASP N . 27880 1 802 . 1 1 142 142 ILE H H 1 8.997 0.01 . 1 . . . . . 142 ILE H . 27880 1 803 . 1 1 142 142 ILE HA H 1 4.350 0.01 . 1 . . . . . 142 ILE HA . 27880 1 804 . 1 1 142 142 ILE CA C 13 60.11 0.01 . 1 . . . . . 142 ILE CA . 27880 1 805 . 1 1 142 142 ILE CB C 13 38.36 0.01 . 1 . . . . . 142 ILE CB . 27880 1 806 . 1 1 142 142 ILE N N 15 126.93 0.01 . 1 . . . . . 142 ILE N . 27880 1 807 . 1 1 143 143 PRO C C 13 179.75 0.01 . 1 . . . . . 143 PRO C . 27880 1 808 . 1 1 143 143 PRO CA C 13 65.85 0.01 . 1 . . . . . 143 PRO CA . 27880 1 809 . 1 1 143 143 PRO CB C 13 31.54 0.01 . 1 . . . . . 143 PRO CB . 27880 1 810 . 1 1 144 144 GLU H H 1 9.069 0.01 . 1 . . . . . 144 GLU H . 27880 1 811 . 1 1 144 144 GLU HA H 1 4.092 0.01 . 1 . . . . . 144 GLU HA . 27880 1 812 . 1 1 144 144 GLU C C 13 177.65 0.01 . 1 . . . . . 144 GLU C . 27880 1 813 . 1 1 144 144 GLU CA C 13 59.84 0.01 . 1 . . . . . 144 GLU CA . 27880 1 814 . 1 1 144 144 GLU CB C 13 28.46 0.01 . 1 . . . . . 144 GLU CB . 27880 1 815 . 1 1 144 144 GLU N N 15 116.57 0.01 . 1 . . . . . 144 GLU N . 27880 1 816 . 1 1 145 145 HIS H H 1 8.124 0.01 . 1 . . . . . 145 HIS H . 27880 1 817 . 1 1 145 145 HIS HA H 1 4.607 0.01 . 1 . . . . . 145 HIS HA . 27880 1 818 . 1 1 145 145 HIS C C 13 176.33 0.01 . 1 . . . . . 145 HIS C . 27880 1 819 . 1 1 145 145 HIS CA C 13 55.35 0.01 . 1 . . . . . 145 HIS CA . 27880 1 820 . 1 1 145 145 HIS CB C 13 31.52 0.01 . 1 . . . . . 145 HIS CB . 27880 1 821 . 1 1 145 145 HIS N N 15 117.40 0.01 . 1 . . . . . 145 HIS N . 27880 1 822 . 1 1 146 146 SER H H 1 7.629 0.01 . 1 . . . . . 146 SER H . 27880 1 823 . 1 1 146 146 SER HA H 1 4.250 0.01 . 1 . . . . . 146 SER HA . 27880 1 824 . 1 1 146 146 SER CA C 13 61.19 0.01 . 1 . . . . . 146 SER CA . 27880 1 825 . 1 1 146 146 SER N N 15 115.67 0.01 . 1 . . . . . 146 SER N . 27880 1 826 . 1 1 147 147 GLY HA2 H 1 3.792 0.01 . 2 . . . . . 147 GLY HA2 . 27880 1 827 . 1 1 147 147 GLY HA3 H 1 4.423 0.01 . 2 . . . . . 147 GLY HA3 . 27880 1 828 . 1 1 147 147 GLY C C 13 174.48 0.01 . 1 . . . . . 147 GLY C . 27880 1 829 . 1 1 147 147 GLY CA C 13 45.67 0.01 . 1 . . . . . 147 GLY CA . 27880 1 830 . 1 1 148 148 ARG H H 1 8.141 0.01 . 1 . . . . . 148 ARG H . 27880 1 831 . 1 1 148 148 ARG HA H 1 4.457 0.01 . 1 . . . . . 148 ARG HA . 27880 1 832 . 1 1 148 148 ARG C C 13 176.64 0.01 . 1 . . . . . 148 ARG C . 27880 1 833 . 1 1 148 148 ARG CA C 13 58.04 0.01 . 1 . . . . . 148 ARG CA . 27880 1 834 . 1 1 148 148 ARG CB C 13 31.24 0.01 . 1 . . . . . 148 ARG CB . 27880 1 835 . 1 1 148 148 ARG N N 15 121.38 0.01 . 1 . . . . . 148 ARG N . 27880 1 836 . 1 1 149 149 CYS H H 1 8.006 0.01 . 1 . . . . . 149 CYS H . 27880 1 837 . 1 1 149 149 CYS HA H 1 4.728 0.01 . 1 . . . . . 149 CYS HA . 27880 1 838 . 1 1 149 149 CYS C C 13 175.32 0.01 . 1 . . . . . 149 CYS C . 27880 1 839 . 1 1 149 149 CYS CA C 13 58.62 0.01 . 1 . . . . . 149 CYS CA . 27880 1 840 . 1 1 149 149 CYS CB C 13 32.54 0.01 . 1 . . . . . 149 CYS CB . 27880 1 841 . 1 1 149 149 CYS N N 15 120.34 0.01 . 1 . . . . . 149 CYS N . 27880 1 842 . 1 1 150 150 ARG H H 1 8.003 0.01 . 1 . . . . . 150 ARG H . 27880 1 843 . 1 1 150 150 ARG HA H 1 4.302 0.01 . 1 . . . . . 150 ARG HA . 27880 1 844 . 1 1 150 150 ARG C C 13 173.80 0.01 . 1 . . . . . 150 ARG C . 27880 1 845 . 1 1 150 150 ARG CA C 13 56.02 0.01 . 1 . . . . . 150 ARG CA . 27880 1 846 . 1 1 150 150 ARG CB C 13 29.14 0.01 . 1 . . . . . 150 ARG CB . 27880 1 847 . 1 1 150 150 ARG N N 15 122.55 0.01 . 1 . . . . . 150 ARG N . 27880 1 848 . 1 1 151 151 PHE H H 1 8.230 0.01 . 1 . . . . . 151 PHE H . 27880 1 849 . 1 1 151 151 PHE HA H 1 5.244 0.01 . 1 . . . . . 151 PHE HA . 27880 1 850 . 1 1 151 151 PHE C C 13 176.03 0.01 . 1 . . . . . 151 PHE C . 27880 1 851 . 1 1 151 151 PHE CA C 13 56.80 0.01 . 1 . . . . . 151 PHE CA . 27880 1 852 . 1 1 151 151 PHE CB C 13 39.67 0.01 . 1 . . . . . 151 PHE CB . 27880 1 853 . 1 1 151 151 PHE N N 15 128.88 0.01 . 1 . . . . . 151 PHE N . 27880 1 854 . 1 1 152 152 VAL H H 1 8.512 0.01 . 1 . . . . . 152 VAL H . 27880 1 855 . 1 1 152 152 VAL HA H 1 3.696 0.01 . 1 . . . . . 152 VAL HA . 27880 1 856 . 1 1 152 152 VAL C C 13 173.67 0.01 . 1 . . . . . 152 VAL C . 27880 1 857 . 1 1 152 152 VAL CA C 13 60.57 0.01 . 1 . . . . . 152 VAL CA . 27880 1 858 . 1 1 152 152 VAL CB C 13 33.33 0.01 . 1 . . . . . 152 VAL CB . 27880 1 859 . 1 1 152 152 VAL N N 15 131.23 0.01 . 1 . . . . . 152 VAL N . 27880 1 860 . 1 1 153 153 LYS H H 1 7.583 0.01 . 1 . . . . . 153 LYS H . 27880 1 861 . 1 1 153 153 LYS HA H 1 3.323 0.01 . 1 . . . . . 153 LYS HA . 27880 1 862 . 1 1 153 153 LYS C C 13 177.27 0.01 . 1 . . . . . 153 LYS C . 27880 1 863 . 1 1 153 153 LYS CA C 13 58.72 0.01 . 1 . . . . . 153 LYS CA . 27880 1 864 . 1 1 153 153 LYS CB C 13 32.77 0.01 . 1 . . . . . 153 LYS CB . 27880 1 865 . 1 1 153 153 LYS N N 15 123.66 0.01 . 1 . . . . . 153 LYS N . 27880 1 866 . 1 1 154 154 TYR H H 1 7.859 0.01 . 1 . . . . . 154 TYR H . 27880 1 867 . 1 1 154 154 TYR HA H 1 4.832 0.01 . 1 . . . . . 154 TYR HA . 27880 1 868 . 1 1 154 154 TYR C C 13 175.00 0.01 . 1 . . . . . 154 TYR C . 27880 1 869 . 1 1 154 154 TYR CA C 13 55.41 0.01 . 1 . . . . . 154 TYR CA . 27880 1 870 . 1 1 154 154 TYR CB C 13 37.05 0.01 . 1 . . . . . 154 TYR CB . 27880 1 871 . 1 1 154 154 TYR N N 15 115.64 0.01 . 1 . . . . . 154 TYR N . 27880 1 872 . 1 1 155 155 LEU H H 1 7.564 0.01 . 1 . . . . . 155 LEU H . 27880 1 873 . 1 1 155 155 LEU HA H 1 3.914 0.01 . 1 . . . . . 155 LEU HA . 27880 1 874 . 1 1 155 155 LEU C C 13 176.03 0.01 . 1 . . . . . 155 LEU C . 27880 1 875 . 1 1 155 155 LEU CA C 13 57.04 0.01 . 1 . . . . . 155 LEU CA . 27880 1 876 . 1 1 155 155 LEU CB C 13 43.60 0.01 . 1 . . . . . 155 LEU CB . 27880 1 877 . 1 1 155 155 LEU N N 15 123.33 0.01 . 1 . . . . . 155 LEU N . 27880 1 878 . 1 1 156 156 ASN H H 1 8.509 0.01 . 1 . . . . . 156 ASN H . 27880 1 879 . 1 1 156 156 ASN HA H 1 4.951 0.01 . 1 . . . . . 156 ASN HA . 27880 1 880 . 1 1 156 156 ASN HD21 H 1 7.748 . . . . . . . . 156 ASN HD21 . 27880 1 881 . 1 1 156 156 ASN HD22 H 1 7.694 . . . . . . . . 156 ASN HD22 . 27880 1 882 . 1 1 156 156 ASN C C 13 173.84 0.01 . 1 . . . . . 156 ASN C . 27880 1 883 . 1 1 156 156 ASN CA C 13 52.62 0.01 . 1 . . . . . 156 ASN CA . 27880 1 884 . 1 1 156 156 ASN CB C 13 40.18 0.01 . 1 . . . . . 156 ASN CB . 27880 1 885 . 1 1 156 156 ASN N N 15 115.39 0.01 . 1 . . . . . 156 ASN N . 27880 1 886 . 1 1 156 156 ASN ND2 N 15 113.72 . . . . . . . . 156 ASN ND2 . 27880 1 887 . 1 1 157 157 PHE H H 1 7.584 0.01 . 1 . . . . . 157 PHE H . 27880 1 888 . 1 1 157 157 PHE HA H 1 4.370 0.01 . 1 . . . . . 157 PHE HA . 27880 1 889 . 1 1 157 157 PHE CA C 13 59.58 0.01 . 1 . . . . . 157 PHE CA . 27880 1 890 . 1 1 157 157 PHE CB C 13 40.48 0.01 . 1 . . . . . 157 PHE CB . 27880 1 891 . 1 1 157 157 PHE N N 15 125.25 0.01 . 1 . . . . . 157 PHE N . 27880 1 stop_ save_