data_27482 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27482 _Entry.Title ; Amide backbone chemical shift assignments for SET nuclear proto-oncogene. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-05-15 _Entry.Accession_date 2018-05-15 _Entry.Last_release_date 2018-05-15 _Entry.Original_release_date 2018-05-15 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 'Chemical shift backbone assignments for NdCd-SET' _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 Stuart Parnham . R. . . 27482 2 Ryan 'De Palma' . M . . 27482 3 Besim Ogretmen . . . . 27482 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'NMR Facility, Medical University of South Carolina' . 27482 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27482 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 106 27482 '15N chemical shifts' 92 27482 '1H chemical shifts' 91 27482 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 . . 2019-06-07 2018-05-15 update BMRB 'update entry citation' 27482 1 . . 2019-04-12 2018-05-15 original author 'original release' 27482 stop_ save_ ############### # Citations # ############### save_SET-FTY720 _Citation.Sf_category citations _Citation.Sf_framecode SET-FTY720 _Citation.Entry_ID 27482 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30917007 _Citation.Full_citation . _Citation.Title ; The NMR-based characterization of the FTY720-SET complex reveals an alternative mechanism for the attenuation of the inhibitory SET-PP2A interaction ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FASEB J.' _Citation.Journal_name_full 'FASEB journal' _Citation.Journal_volume 33 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1530-6860 _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 7647 _Citation.Page_last 7666 _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 Ryan 'De Palma' R. M. . . 27482 1 2 Stuart Parnham S. R. . . 27482 1 3 Yitong Li Y. . . . 27482 1 4 Joshua Oaks J. J. . . 27482 1 5 Yuri Peterson Y. K. . . 27482 1 6 Zdzislaw Szulc Z. M. . . 27482 1 7 Braden Roth B. M. . . 27482 1 8 Yongna Xing Y. . . . 27482 1 9 Besim Ogretmen B. . . . 27482 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID PP2A 27482 1 'SET-FTY720 complex' 27482 1 'mechanism activation of PP2A' 27482 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27482 _Assembly.ID 1 _Assembly.Name 'NdCd-SET homodimer' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic 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 'NdCd-SET, subunit 1' 1 $NdCd-SET_nuclear_proto-oncogene A . yes native no no . . . 27482 1 2 'NdCd-SET, subunit 2' 1 $NdCd-SET_nuclear_proto-oncogene B . no native no no . . . 27482 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NdCd-SET_nuclear_proto-oncogene _Entity.Sf_category entity _Entity.Sf_framecode NdCd-SET_nuclear_proto-oncogene _Entity.Entry_ID 27482 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NdCd-SET_nuclear_proto-oncogene _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 ; GSMTSEKEQQEAIEHIDEVQ NEIDRLNEQASEEILKVEQK YNKLRQPFFQKRSELIAKIP NFWVTTFVNHPQVSALLGEE DEEALHYLTRVEVTEFEDIK SGYRIDFYFDENPYFENKVL SKEFHLNESGDPSSKSTEIK WKSGKDLTKRSSQTQNKASR KRQHEEPESFFTWFTDHSDA GADELGEVIKDDIWPNPLQY YLVPD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'Native sequence starts at 23 T (gsmTSEK)' _Entity.Polymer_author_seq_details 'Residues GSM (-3, -2, -1)' _Entity.Ambiguous_conformational_states yes _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 205 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'SET Nuclear Proto-oncogene' _Entity.Mutation '22 N-terminal residues and 52 C-terminal residues were removed.' _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_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Inhibitor of protein phosphatase 2A' 27482 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -3 GLY . 27482 1 2 -2 SER . 27482 1 3 -1 MET . 27482 1 4 23 THR . 27482 1 5 24 SER . 27482 1 6 25 GLU . 27482 1 7 26 LYS . 27482 1 8 27 GLU . 27482 1 9 28 GLN . 27482 1 10 29 GLN . 27482 1 11 30 GLU . 27482 1 12 31 ALA . 27482 1 13 32 ILE . 27482 1 14 33 GLU . 27482 1 15 34 HIS . 27482 1 16 35 ILE . 27482 1 17 36 ASP . 27482 1 18 37 GLU . 27482 1 19 38 VAL . 27482 1 20 39 GLN . 27482 1 21 40 ASN . 27482 1 22 41 GLU . 27482 1 23 42 ILE . 27482 1 24 43 ASP . 27482 1 25 44 ARG . 27482 1 26 45 LEU . 27482 1 27 46 ASN . 27482 1 28 47 GLU . 27482 1 29 48 GLN . 27482 1 30 49 ALA . 27482 1 31 50 SER . 27482 1 32 51 GLU . 27482 1 33 52 GLU . 27482 1 34 53 ILE . 27482 1 35 54 LEU . 27482 1 36 55 LYS . 27482 1 37 56 VAL . 27482 1 38 57 GLU . 27482 1 39 58 GLN . 27482 1 40 59 LYS . 27482 1 41 60 TYR . 27482 1 42 61 ASN . 27482 1 43 62 LYS . 27482 1 44 63 LEU . 27482 1 45 64 ARG . 27482 1 46 65 GLN . 27482 1 47 66 PRO . 27482 1 48 67 PHE . 27482 1 49 68 PHE . 27482 1 50 69 GLN . 27482 1 51 70 LYS . 27482 1 52 71 ARG . 27482 1 53 72 SER . 27482 1 54 73 GLU . 27482 1 55 74 LEU . 27482 1 56 75 ILE . 27482 1 57 76 ALA . 27482 1 58 77 LYS . 27482 1 59 78 ILE . 27482 1 60 79 PRO . 27482 1 61 80 ASN . 27482 1 62 81 PHE . 27482 1 63 82 TRP . 27482 1 64 83 VAL . 27482 1 65 84 THR . 27482 1 66 85 THR . 27482 1 67 86 PHE . 27482 1 68 87 VAL . 27482 1 69 88 ASN . 27482 1 70 89 HIS . 27482 1 71 90 PRO . 27482 1 72 91 GLN . 27482 1 73 92 VAL . 27482 1 74 93 SER . 27482 1 75 94 ALA . 27482 1 76 95 LEU . 27482 1 77 96 LEU . 27482 1 78 97 GLY . 27482 1 79 98 GLU . 27482 1 80 99 GLU . 27482 1 81 100 ASP . 27482 1 82 101 GLU . 27482 1 83 102 GLU . 27482 1 84 103 ALA . 27482 1 85 104 LEU . 27482 1 86 105 HIS . 27482 1 87 106 TYR . 27482 1 88 107 LEU . 27482 1 89 108 THR . 27482 1 90 109 ARG . 27482 1 91 110 VAL . 27482 1 92 111 GLU . 27482 1 93 112 VAL . 27482 1 94 113 THR . 27482 1 95 114 GLU . 27482 1 96 115 PHE . 27482 1 97 116 GLU . 27482 1 98 117 ASP . 27482 1 99 118 ILE . 27482 1 100 119 LYS . 27482 1 101 120 SER . 27482 1 102 121 GLY . 27482 1 103 122 TYR . 27482 1 104 123 ARG . 27482 1 105 124 ILE . 27482 1 106 125 ASP . 27482 1 107 126 PHE . 27482 1 108 127 TYR . 27482 1 109 128 PHE . 27482 1 110 129 ASP . 27482 1 111 130 GLU . 27482 1 112 131 ASN . 27482 1 113 132 PRO . 27482 1 114 133 TYR . 27482 1 115 134 PHE . 27482 1 116 135 GLU . 27482 1 117 136 ASN . 27482 1 118 137 LYS . 27482 1 119 138 VAL . 27482 1 120 139 LEU . 27482 1 121 140 SER . 27482 1 122 141 LYS . 27482 1 123 142 GLU . 27482 1 124 143 PHE . 27482 1 125 144 HIS . 27482 1 126 145 LEU . 27482 1 127 146 ASN . 27482 1 128 147 GLU . 27482 1 129 148 SER . 27482 1 130 149 GLY . 27482 1 131 150 ASP . 27482 1 132 151 PRO . 27482 1 133 152 SER . 27482 1 134 153 SER . 27482 1 135 154 LYS . 27482 1 136 155 SER . 27482 1 137 156 THR . 27482 1 138 157 GLU . 27482 1 139 158 ILE . 27482 1 140 159 LYS . 27482 1 141 160 TRP . 27482 1 142 161 LYS . 27482 1 143 162 SER . 27482 1 144 163 GLY . 27482 1 145 164 LYS . 27482 1 146 165 ASP . 27482 1 147 166 LEU . 27482 1 148 167 THR . 27482 1 149 168 LYS . 27482 1 150 169 ARG . 27482 1 151 170 SER . 27482 1 152 171 SER . 27482 1 153 172 GLN . 27482 1 154 173 THR . 27482 1 155 174 GLN . 27482 1 156 175 ASN . 27482 1 157 176 LYS . 27482 1 158 177 ALA . 27482 1 159 178 SER . 27482 1 160 179 ARG . 27482 1 161 180 LYS . 27482 1 162 181 ARG . 27482 1 163 182 GLN . 27482 1 164 183 HIS . 27482 1 165 184 GLU . 27482 1 166 185 GLU . 27482 1 167 186 PRO . 27482 1 168 187 GLU . 27482 1 169 188 SER . 27482 1 170 189 PHE . 27482 1 171 190 PHE . 27482 1 172 191 THR . 27482 1 173 192 TRP . 27482 1 174 193 PHE . 27482 1 175 194 THR . 27482 1 176 195 ASP . 27482 1 177 196 HIS . 27482 1 178 197 SER . 27482 1 179 198 ASP . 27482 1 180 199 ALA . 27482 1 181 200 GLY . 27482 1 182 201 ALA . 27482 1 183 202 ASP . 27482 1 184 203 GLU . 27482 1 185 204 LEU . 27482 1 186 205 GLY . 27482 1 187 206 GLU . 27482 1 188 207 VAL . 27482 1 189 208 ILE . 27482 1 190 209 LYS . 27482 1 191 210 ASP . 27482 1 192 211 ASP . 27482 1 193 212 ILE . 27482 1 194 213 TRP . 27482 1 195 214 PRO . 27482 1 196 215 ASN . 27482 1 197 216 PRO . 27482 1 198 217 LEU . 27482 1 199 218 GLN . 27482 1 200 219 TYR . 27482 1 201 220 TYR . 27482 1 202 221 LEU . 27482 1 203 222 VAL . 27482 1 204 223 PRO . 27482 1 205 224 ASP . 27482 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 27482 1 . SER 2 2 27482 1 . MET 3 3 27482 1 . THR 4 4 27482 1 . SER 5 5 27482 1 . GLU 6 6 27482 1 . LYS 7 7 27482 1 . GLU 8 8 27482 1 . GLN 9 9 27482 1 . GLN 10 10 27482 1 . GLU 11 11 27482 1 . ALA 12 12 27482 1 . ILE 13 13 27482 1 . GLU 14 14 27482 1 . HIS 15 15 27482 1 . ILE 16 16 27482 1 . ASP 17 17 27482 1 . GLU 18 18 27482 1 . VAL 19 19 27482 1 . GLN 20 20 27482 1 . ASN 21 21 27482 1 . GLU 22 22 27482 1 . ILE 23 23 27482 1 . ASP 24 24 27482 1 . ARG 25 25 27482 1 . LEU 26 26 27482 1 . ASN 27 27 27482 1 . GLU 28 28 27482 1 . GLN 29 29 27482 1 . ALA 30 30 27482 1 . SER 31 31 27482 1 . GLU 32 32 27482 1 . GLU 33 33 27482 1 . ILE 34 34 27482 1 . LEU 35 35 27482 1 . LYS 36 36 27482 1 . VAL 37 37 27482 1 . GLU 38 38 27482 1 . GLN 39 39 27482 1 . LYS 40 40 27482 1 . TYR 41 41 27482 1 . ASN 42 42 27482 1 . LYS 43 43 27482 1 . LEU 44 44 27482 1 . ARG 45 45 27482 1 . GLN 46 46 27482 1 . PRO 47 47 27482 1 . PHE 48 48 27482 1 . PHE 49 49 27482 1 . GLN 50 50 27482 1 . LYS 51 51 27482 1 . ARG 52 52 27482 1 . SER 53 53 27482 1 . GLU 54 54 27482 1 . LEU 55 55 27482 1 . ILE 56 56 27482 1 . ALA 57 57 27482 1 . LYS 58 58 27482 1 . ILE 59 59 27482 1 . PRO 60 60 27482 1 . ASN 61 61 27482 1 . PHE 62 62 27482 1 . TRP 63 63 27482 1 . VAL 64 64 27482 1 . THR 65 65 27482 1 . THR 66 66 27482 1 . PHE 67 67 27482 1 . VAL 68 68 27482 1 . ASN 69 69 27482 1 . HIS 70 70 27482 1 . PRO 71 71 27482 1 . GLN 72 72 27482 1 . VAL 73 73 27482 1 . SER 74 74 27482 1 . ALA 75 75 27482 1 . LEU 76 76 27482 1 . LEU 77 77 27482 1 . GLY 78 78 27482 1 . GLU 79 79 27482 1 . GLU 80 80 27482 1 . ASP 81 81 27482 1 . GLU 82 82 27482 1 . GLU 83 83 27482 1 . ALA 84 84 27482 1 . LEU 85 85 27482 1 . HIS 86 86 27482 1 . TYR 87 87 27482 1 . LEU 88 88 27482 1 . THR 89 89 27482 1 . ARG 90 90 27482 1 . VAL 91 91 27482 1 . GLU 92 92 27482 1 . VAL 93 93 27482 1 . THR 94 94 27482 1 . GLU 95 95 27482 1 . PHE 96 96 27482 1 . GLU 97 97 27482 1 . ASP 98 98 27482 1 . ILE 99 99 27482 1 . LYS 100 100 27482 1 . SER 101 101 27482 1 . GLY 102 102 27482 1 . TYR 103 103 27482 1 . ARG 104 104 27482 1 . ILE 105 105 27482 1 . ASP 106 106 27482 1 . PHE 107 107 27482 1 . TYR 108 108 27482 1 . PHE 109 109 27482 1 . ASP 110 110 27482 1 . GLU 111 111 27482 1 . ASN 112 112 27482 1 . PRO 113 113 27482 1 . TYR 114 114 27482 1 . PHE 115 115 27482 1 . GLU 116 116 27482 1 . ASN 117 117 27482 1 . LYS 118 118 27482 1 . VAL 119 119 27482 1 . LEU 120 120 27482 1 . SER 121 121 27482 1 . LYS 122 122 27482 1 . GLU 123 123 27482 1 . PHE 124 124 27482 1 . HIS 125 125 27482 1 . LEU 126 126 27482 1 . ASN 127 127 27482 1 . GLU 128 128 27482 1 . SER 129 129 27482 1 . GLY 130 130 27482 1 . ASP 131 131 27482 1 . PRO 132 132 27482 1 . SER 133 133 27482 1 . SER 134 134 27482 1 . LYS 135 135 27482 1 . SER 136 136 27482 1 . THR 137 137 27482 1 . GLU 138 138 27482 1 . ILE 139 139 27482 1 . LYS 140 140 27482 1 . TRP 141 141 27482 1 . LYS 142 142 27482 1 . SER 143 143 27482 1 . GLY 144 144 27482 1 . LYS 145 145 27482 1 . ASP 146 146 27482 1 . LEU 147 147 27482 1 . THR 148 148 27482 1 . LYS 149 149 27482 1 . ARG 150 150 27482 1 . SER 151 151 27482 1 . SER 152 152 27482 1 . GLN 153 153 27482 1 . THR 154 154 27482 1 . GLN 155 155 27482 1 . ASN 156 156 27482 1 . LYS 157 157 27482 1 . ALA 158 158 27482 1 . SER 159 159 27482 1 . ARG 160 160 27482 1 . LYS 161 161 27482 1 . ARG 162 162 27482 1 . GLN 163 163 27482 1 . HIS 164 164 27482 1 . GLU 165 165 27482 1 . GLU 166 166 27482 1 . PRO 167 167 27482 1 . GLU 168 168 27482 1 . SER 169 169 27482 1 . PHE 170 170 27482 1 . PHE 171 171 27482 1 . THR 172 172 27482 1 . TRP 173 173 27482 1 . PHE 174 174 27482 1 . THR 175 175 27482 1 . ASP 176 176 27482 1 . HIS 177 177 27482 1 . SER 178 178 27482 1 . ASP 179 179 27482 1 . ALA 180 180 27482 1 . GLY 181 181 27482 1 . ALA 182 182 27482 1 . ASP 183 183 27482 1 . GLU 184 184 27482 1 . LEU 185 185 27482 1 . GLY 186 186 27482 1 . GLU 187 187 27482 1 . VAL 188 188 27482 1 . ILE 189 189 27482 1 . LYS 190 190 27482 1 . ASP 191 191 27482 1 . ASP 192 192 27482 1 . ILE 193 193 27482 1 . TRP 194 194 27482 1 . PRO 195 195 27482 1 . ASN 196 196 27482 1 . PRO 197 197 27482 1 . LEU 198 198 27482 1 . GLN 199 199 27482 1 . TYR 200 200 27482 1 . TYR 201 201 27482 1 . LEU 202 202 27482 1 . VAL 203 203 27482 1 . PRO 204 204 27482 1 . ASP 205 205 27482 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 27482 _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 $NdCd-SET_nuclear_proto-oncogene . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27482 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 27482 _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 $NdCd-SET_nuclear_proto-oncogene . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET-28b(+) . . . 27482 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27482 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '99% H2O 1%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 'NdCd-SET nuclear proto-oncogene' '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $NdCd-SET_nuclear_proto-oncogene . . 0.4 . . mM 0.2 . . . 27482 1 2 'NdCd-SET nuclear proto-oncogene' '[U-100% 13C; U-100% 15N]' . . 1 $NdCd-SET_nuclear_proto-oncogene . . 0.5 . . mM 0.2 . . . 27482 1 3 'NdCd-SET nuclear proto-oncogene' '[U-100% 15N]' . . 1 $NdCd-SET_nuclear_proto-oncogene . . 1.0 . . mM 0.2 . . . 27482 1 4 phosphate 'natural abundance' . . . . . . 20 . . mM . . . . 27482 1 5 naCl 'natural abundance' . . . . . . 50 . . mM . . . . 27482 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 27482 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 70 . mM 27482 1 pH 8.0 . pH 27482 1 pressure 1 . atm 27482 1 temperature 310 . K 27482 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27482 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27482 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 27482 1 processing 27482 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27482 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27482 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27482 2 stop_ save_ save_CcpNmr _Software.Sf_category software _Software.Sf_framecode CcpNmr _Software.Entry_ID 27482 _Software.ID 3 _Software.Type . _Software.Name CcpNmr _Software.Version 2.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 27482 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 27482 3 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 27482 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 27482 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 850 . . . 27482 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 27482 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27482 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27482 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27482 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27482 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27482 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27482 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 27482 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 . . . . . 27482 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27482 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27482 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 27482 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.004 _Assigned_chem_shift_list.Chem_shift_13C_err 0.007 _Assigned_chem_shift_list.Chem_shift_15N_err 0.01 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27482 1 2 '3D HNCA' . . . 27482 1 3 '3D CBCA(CO)NH' . . . 27482 1 4 '3D HNCACB' . . . 27482 1 5 '3D HN(CO)CA' . . . 27482 1 6 '3D 1H-15N NOESY' . . . 27482 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $CcpNmr . . 27482 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 4 4 THR CA C 13 63.553 0.003 . 1 . . . . . 23 THR CA . 27482 1 2 . 1 1 4 4 THR N N 15 120.044 0.068 . 1 . . . . . 23 THR N . 27482 1 3 . 1 1 5 5 SER H H 1 8.431 0.005 . 1 . . . . . 24 SER H . 27482 1 4 . 1 1 5 5 SER CA C 13 57.648 0.000 . 1 . . . . . 24 SER CA . 27482 1 5 . 1 1 5 5 SER N N 15 118.343 0.046 . 1 . . . . . 24 SER N . 27482 1 6 . 1 1 9 9 GLN H H 1 7.901 0.003 . 1 . . . . . 28 GLN H . 27482 1 7 . 1 1 9 9 GLN N N 15 115.480 0.039 . 1 . . . . . 28 GLN N . 27482 1 8 . 1 1 10 10 GLN H H 1 8.612 0.005 . 1 . . . . . 29 GLN H . 27482 1 9 . 1 1 10 10 GLN N N 15 118.799 0.015 . 1 . . . . . 29 GLN N . 27482 1 10 . 1 1 11 11 GLU H H 1 9.029 0.008 . 1 . . . . . 30 GLU H . 27482 1 11 . 1 1 11 11 GLU N N 15 119.102 0.020 . 1 . . . . . 30 GLU N . 27482 1 12 . 1 1 15 15 HIS CA C 13 56.601 0.000 . 1 . . . . . 34 HIS CA . 27482 1 13 . 1 1 16 16 ILE H H 1 7.756 0.008 . 1 . . . . . 35 ILE H . 27482 1 14 . 1 1 16 16 ILE CA C 13 55.210 0.000 . 1 . . . . . 35 ILE CA . 27482 1 15 . 1 1 16 16 ILE N N 15 121.672 0.056 . 1 . . . . . 35 ILE N . 27482 1 16 . 1 1 17 17 ASP H H 1 8.612 0.005 . 1 . . . . . 36 ASP H . 27482 1 17 . 1 1 17 17 ASP CA C 13 52.765 0.000 . 1 . . . . . 36 ASP CA . 27482 1 18 . 1 1 17 17 ASP N N 15 119.056 0.051 . 1 . . . . . 36 ASP N . 27482 1 19 . 1 1 18 18 GLU H H 1 8.097 0.004 . 1 . . . . . 37 GLU H . 27482 1 20 . 1 1 18 18 GLU CA C 13 56.506 0.000 . 1 . . . . . 37 GLU CA . 27482 1 21 . 1 1 18 18 GLU N N 15 122.837 0.034 . 1 . . . . . 37 GLU N . 27482 1 22 . 1 1 19 19 VAL H H 1 7.878 0.004 . 1 . . . . . 38 VAL H . 27482 1 23 . 1 1 19 19 VAL CA C 13 63.036 0.000 . 1 . . . . . 38 VAL CA . 27482 1 24 . 1 1 19 19 VAL N N 15 120.145 0.064 . 1 . . . . . 38 VAL N . 27482 1 25 . 1 1 20 20 GLN H H 1 8.861 0.004 . 1 . . . . . 39 GLN H . 27482 1 26 . 1 1 20 20 GLN CA C 13 55.599 0.000 . 1 . . . . . 39 GLN CA . 27482 1 27 . 1 1 20 20 GLN N N 15 120.822 0.041 . 1 . . . . . 39 GLN N . 27482 1 28 . 1 1 21 21 ASN H H 1 8.200 0.002 . 1 . . . . . 40 ASN H . 27482 1 29 . 1 1 21 21 ASN CA C 13 53.637 0.000 . 1 . . . . . 40 ASN CA . 27482 1 30 . 1 1 21 21 ASN N N 15 118.930 0.021 . 1 . . . . . 40 ASN N . 27482 1 31 . 1 1 22 22 GLU H H 1 8.342 0.002 . 1 . . . . . 41 GLU H . 27482 1 32 . 1 1 22 22 GLU CA C 13 51.254 0.000 . 1 . . . . . 41 GLU CA . 27482 1 33 . 1 1 22 22 GLU N N 15 123.235 0.015 . 1 . . . . . 41 GLU N . 27482 1 34 . 1 1 23 23 ILE H H 1 8.462 0.005 . 1 . . . . . 42 ILE H . 27482 1 35 . 1 1 23 23 ILE CA C 13 55.961 0.000 . 1 . . . . . 42 ILE CA . 27482 1 36 . 1 1 23 23 ILE N N 15 125.885 0.013 . 1 . . . . . 42 ILE N . 27482 1 37 . 1 1 29 29 GLN CA C 13 53.649 0.000 . 1 . . . . . 48 GLN CA . 27482 1 38 . 1 1 29 29 GLN CB C 13 30.517 0.000 . 1 . . . . . 48 GLN CB . 27482 1 39 . 1 1 30 30 ALA H H 1 7.874 0.005 . 1 . . . . . 49 ALA H . 27482 1 40 . 1 1 30 30 ALA CA C 13 51.303 0.000 . 1 . . . . . 49 ALA CA . 27482 1 41 . 1 1 30 30 ALA CB C 13 17.712 0.000 . 1 . . . . . 49 ALA CB . 27482 1 42 . 1 1 30 30 ALA N N 15 131.560 0.042 . 1 . . . . . 49 ALA N . 27482 1 43 . 1 1 37 37 VAL H H 1 8.499 0.006 . 1 . . . . . 56 VAL H . 27482 1 44 . 1 1 37 37 VAL CA C 13 57.893 0.000 . 1 . . . . . 56 VAL CA . 27482 1 45 . 1 1 37 37 VAL N N 15 117.335 0.018 . 1 . . . . . 56 VAL N . 27482 1 46 . 1 1 38 38 GLU H H 1 8.694 0.011 . 1 . . . . . 57 GLU H . 27482 1 47 . 1 1 38 38 GLU CA C 13 62.789 0.000 . 1 . . . . . 57 GLU CA . 27482 1 48 . 1 1 38 38 GLU N N 15 119.243 0.071 . 1 . . . . . 57 GLU N . 27482 1 49 . 1 1 39 39 GLN H H 1 7.216 0.005 . 1 . . . . . 58 GLN H . 27482 1 50 . 1 1 39 39 GLN CA C 13 58.559 0.000 . 1 . . . . . 58 GLN CA . 27482 1 51 . 1 1 39 39 GLN N N 15 116.404 0.038 . 1 . . . . . 58 GLN N . 27482 1 52 . 1 1 40 40 LYS H H 1 8.846 0.005 . 1 . . . . . 59 LYS H . 27482 1 53 . 1 1 40 40 LYS CA C 13 53.023 0.000 . 1 . . . . . 59 LYS CA . 27482 1 54 . 1 1 40 40 LYS N N 15 126.778 0.064 . 1 . . . . . 59 LYS N . 27482 1 55 . 1 1 41 41 TYR H H 1 8.547 0.004 . 1 . . . . . 60 TYR H . 27482 1 56 . 1 1 41 41 TYR CA C 13 59.737 0.000 . 1 . . . . . 60 TYR CA . 27482 1 57 . 1 1 41 41 TYR N N 15 129.719 0.063 . 1 . . . . . 60 TYR N . 27482 1 58 . 1 1 42 42 ASN H H 1 9.192 0.002 . 1 . . . . . 61 ASN H . 27482 1 59 . 1 1 42 42 ASN CA C 13 50.205 0.000 . 1 . . . . . 61 ASN CA . 27482 1 60 . 1 1 42 42 ASN N N 15 131.529 0.062 . 1 . . . . . 61 ASN N . 27482 1 61 . 1 1 43 43 LYS H H 1 7.448 0.006 . 1 . . . . . 62 LYS H . 27482 1 62 . 1 1 43 43 LYS CA C 13 54.741 0.000 . 1 . . . . . 62 LYS CA . 27482 1 63 . 1 1 43 43 LYS N N 15 124.476 0.050 . 1 . . . . . 62 LYS N . 27482 1 64 . 1 1 44 44 LEU H H 1 8.969 0.005 . 1 . . . . . 63 LEU H . 27482 1 65 . 1 1 44 44 LEU CA C 13 53.884 0.000 . 1 . . . . . 63 LEU CA . 27482 1 66 . 1 1 44 44 LEU N N 15 124.966 0.043 . 1 . . . . . 63 LEU N . 27482 1 67 . 1 1 49 49 PHE H H 1 6.864 0.007 . 1 . . . . . 68 PHE H . 27482 1 68 . 1 1 49 49 PHE CA C 13 52.619 0.000 . 1 . . . . . 68 PHE CA . 27482 1 69 . 1 1 49 49 PHE N N 15 122.861 0.035 . 1 . . . . . 68 PHE N . 27482 1 70 . 1 1 50 50 GLN H H 1 7.631 0.008 . 1 . . . . . 69 GLN H . 27482 1 71 . 1 1 50 50 GLN CA C 13 54.313 0.000 . 1 . . . . . 69 GLN CA . 27482 1 72 . 1 1 50 50 GLN N N 15 127.988 0.075 . 1 . . . . . 69 GLN N . 27482 1 73 . 1 1 51 51 LYS H H 1 8.784 0.005 . 1 . . . . . 70 LYS H . 27482 1 74 . 1 1 51 51 LYS CA C 13 52.827 0.000 . 1 . . . . . 70 LYS CA . 27482 1 75 . 1 1 51 51 LYS N N 15 125.532 0.063 . 1 . . . . . 70 LYS N . 27482 1 76 . 1 1 52 52 ARG H H 1 8.488 0.001 . 1 . . . . . 71 ARG H . 27482 1 77 . 1 1 52 52 ARG CA C 13 51.163 0.000 . 1 . . . . . 71 ARG CA . 27482 1 78 . 1 1 52 52 ARG N N 15 124.392 0.029 . 1 . . . . . 71 ARG N . 27482 1 79 . 1 1 53 53 SER H H 1 8.932 0.005 . 1 . . . . . 72 SER H . 27482 1 80 . 1 1 53 53 SER CA C 13 57.445 0.000 . 1 . . . . . 72 SER CA . 27482 1 81 . 1 1 53 53 SER N N 15 125.267 0.056 . 1 . . . . . 72 SER N . 27482 1 82 . 1 1 54 54 GLU H H 1 8.748 0.006 . 1 . . . . . 73 GLU H . 27482 1 83 . 1 1 54 54 GLU CA C 13 50.623 0.000 . 1 . . . . . 73 GLU CA . 27482 1 84 . 1 1 54 54 GLU N N 15 124.969 0.114 . 1 . . . . . 73 GLU N . 27482 1 85 . 1 1 55 55 LEU H H 1 9.508 0.004 . 1 . . . . . 74 LEU H . 27482 1 86 . 1 1 55 55 LEU CA C 13 52.725 0.000 . 1 . . . . . 74 LEU CA . 27482 1 87 . 1 1 55 55 LEU N N 15 121.020 0.024 . 1 . . . . . 74 LEU N . 27482 1 88 . 1 1 56 56 ILE H H 1 9.029 0.005 . 1 . . . . . 75 ILE H . 27482 1 89 . 1 1 56 56 ILE CA C 13 54.957 0.000 . 1 . . . . . 75 ILE CA . 27482 1 90 . 1 1 56 56 ILE N N 15 123.279 0.037 . 1 . . . . . 75 ILE N . 27482 1 91 . 1 1 57 57 ALA H H 1 8.805 0.003 . 1 . . . . . 76 ALA H . 27482 1 92 . 1 1 57 57 ALA CA C 13 53.962 0.000 . 1 . . . . . 76 ALA CA . 27482 1 93 . 1 1 57 57 ALA N N 15 120.709 0.031 . 1 . . . . . 76 ALA N . 27482 1 94 . 1 1 58 58 LYS H H 1 8.905 0.006 . 1 . . . . . 77 LYS H . 27482 1 95 . 1 1 58 58 LYS CA C 13 50.639 0.000 . 1 . . . . . 77 LYS CA . 27482 1 96 . 1 1 58 58 LYS N N 15 123.473 0.046 . 1 . . . . . 77 LYS N . 27482 1 97 . 1 1 59 59 ILE H H 1 8.437 0.012 . 1 . . . . . 78 ILE H . 27482 1 98 . 1 1 59 59 ILE CA C 13 55.001 0.000 . 1 . . . . . 78 ILE CA . 27482 1 99 . 1 1 59 59 ILE N N 15 121.049 0.067 . 1 . . . . . 78 ILE N . 27482 1 100 . 1 1 60 60 PRO CA C 13 61.239 0.000 . 1 . . . . . 79 PRO CA . 27482 1 101 . 1 1 61 61 ASN H H 1 7.782 0.009 . 1 . . . . . 80 ASN H . 27482 1 102 . 1 1 61 61 ASN CA C 13 54.878 0.000 . 1 . . . . . 80 ASN CA . 27482 1 103 . 1 1 61 61 ASN N N 15 120.834 0.178 . 1 . . . . . 80 ASN N . 27482 1 104 . 1 1 62 62 PHE H H 1 7.854 0.011 . 1 . . . . . 81 PHE H . 27482 1 105 . 1 1 62 62 PHE CA C 13 56.569 0.000 . 1 . . . . . 81 PHE CA . 27482 1 106 . 1 1 62 62 PHE N N 15 118.027 0.017 . 1 . . . . . 81 PHE N . 27482 1 107 . 1 1 63 63 TRP H H 1 7.849 0.012 . 1 . . . . . 82 TRP H . 27482 1 108 . 1 1 63 63 TRP CA C 13 56.194 0.000 . 1 . . . . . 82 TRP CA . 27482 1 109 . 1 1 63 63 TRP N N 15 120.405 0.052 . 1 . . . . . 82 TRP N . 27482 1 110 . 1 1 64 64 VAL H H 1 6.963 0.003 . 1 . . . . . 83 VAL H . 27482 1 111 . 1 1 64 64 VAL CA C 13 55.882 0.000 . 1 . . . . . 83 VAL CA . 27482 1 112 . 1 1 64 64 VAL N N 15 116.053 0.039 . 1 . . . . . 83 VAL N . 27482 1 113 . 1 1 65 65 THR H H 1 8.471 0.006 . 1 . . . . . 84 THR H . 27482 1 114 . 1 1 65 65 THR CA C 13 62.380 0.000 . 1 . . . . . 84 THR CA . 27482 1 115 . 1 1 65 65 THR N N 15 115.930 0.027 . 1 . . . . . 84 THR N . 27482 1 116 . 1 1 66 66 THR H H 1 8.282 0.002 . 1 . . . . . 85 THR H . 27482 1 117 . 1 1 66 66 THR CA C 13 62.359 0.000 . 1 . . . . . 85 THR CA . 27482 1 118 . 1 1 66 66 THR N N 15 116.045 0.015 . 1 . . . . . 85 THR N . 27482 1 119 . 1 1 67 67 PHE H H 1 9.133 0.009 . 1 . . . . . 86 PHE H . 27482 1 120 . 1 1 67 67 PHE CA C 13 54.799 0.000 . 1 . . . . . 86 PHE CA . 27482 1 121 . 1 1 67 67 PHE N N 15 117.071 0.058 . 1 . . . . . 86 PHE N . 27482 1 122 . 1 1 72 72 GLN CA C 13 50.587 0.000 . 1 . . . . . 91 GLN CA . 27482 1 123 . 1 1 73 73 VAL H H 1 8.127 0.001 . 1 . . . . . 92 VAL H . 27482 1 124 . 1 1 73 73 VAL CA C 13 61.420 0.000 . 1 . . . . . 92 VAL CA . 27482 1 125 . 1 1 73 73 VAL N N 15 120.956 0.085 . 1 . . . . . 92 VAL N . 27482 1 126 . 1 1 74 74 SER H H 1 8.503 0.001 . 1 . . . . . 93 SER H . 27482 1 127 . 1 1 74 74 SER CA C 13 54.511 0.000 . 1 . . . . . 93 SER CA . 27482 1 128 . 1 1 74 74 SER N N 15 121.068 0.002 . 1 . . . . . 93 SER N . 27482 1 129 . 1 1 75 75 ALA H H 1 7.907 0.015 . 1 . . . . . 94 ALA H . 27482 1 130 . 1 1 75 75 ALA CA C 13 53.511 0.000 . 1 . . . . . 94 ALA CA . 27482 1 131 . 1 1 75 75 ALA N N 15 127.950 0.134 . 1 . . . . . 94 ALA N . 27482 1 132 . 1 1 76 76 LEU H H 1 8.311 0.015 . 1 . . . . . 95 LEU H . 27482 1 133 . 1 1 76 76 LEU CA C 13 51.380 0.000 . 1 . . . . . 95 LEU CA . 27482 1 134 . 1 1 76 76 LEU N N 15 122.884 0.025 . 1 . . . . . 95 LEU N . 27482 1 135 . 1 1 77 77 LEU H H 1 7.089 0.005 . 1 . . . . . 96 LEU H . 27482 1 136 . 1 1 77 77 LEU CA C 13 51.413 0.000 . 1 . . . . . 96 LEU CA . 27482 1 137 . 1 1 77 77 LEU N N 15 117.437 0.008 . 1 . . . . . 96 LEU N . 27482 1 138 . 1 1 78 78 GLY H H 1 9.738 0.013 . 1 . . . . . 97 GLY H . 27482 1 139 . 1 1 78 78 GLY CA C 13 40.827 0.000 . 1 . . . . . 97 GLY CA . 27482 1 140 . 1 1 78 78 GLY N N 15 114.045 0.034 . 1 . . . . . 97 GLY N . 27482 1 141 . 1 1 79 79 GLU H H 1 8.889 0.010 . 1 . . . . . 98 GLU H . 27482 1 142 . 1 1 79 79 GLU CA C 13 57.247 0.000 . 1 . . . . . 98 GLU CA . 27482 1 143 . 1 1 79 79 GLU N N 15 121.837 0.055 . 1 . . . . . 98 GLU N . 27482 1 144 . 1 1 80 80 GLU H H 1 7.273 0.006 . 1 . . . . . 99 GLU H . 27482 1 145 . 1 1 80 80 GLU CA C 13 57.244 0.000 . 1 . . . . . 99 GLU CA . 27482 1 146 . 1 1 80 80 GLU N N 15 121.721 0.043 . 1 . . . . . 99 GLU N . 27482 1 147 . 1 1 81 81 ASP H H 1 7.309 0.007 . 1 . . . . . 100 ASP H . 27482 1 148 . 1 1 81 81 ASP CA C 13 50.964 0.000 . 1 . . . . . 100 ASP CA . 27482 1 149 . 1 1 81 81 ASP N N 15 121.748 0.032 . 1 . . . . . 100 ASP N . 27482 1 150 . 1 1 88 88 LEU H H 1 7.420 0.005 . 1 . . . . . 107 LEU H . 27482 1 151 . 1 1 88 88 LEU CA C 13 51.640 0.000 . 1 . . . . . 107 LEU CA . 27482 1 152 . 1 1 88 88 LEU N N 15 122.382 0.039 . 1 . . . . . 107 LEU N . 27482 1 153 . 1 1 89 89 THR H H 1 9.214 0.011 . 1 . . . . . 108 THR H . 27482 1 154 . 1 1 89 89 THR CA C 13 59.404 0.000 . 1 . . . . . 108 THR CA . 27482 1 155 . 1 1 89 89 THR N N 15 121.611 0.023 . 1 . . . . . 108 THR N . 27482 1 156 . 1 1 90 90 ARG H H 1 7.223 0.005 . 1 . . . . . 109 ARG H . 27482 1 157 . 1 1 90 90 ARG CA C 13 53.411 0.000 . 1 . . . . . 109 ARG CA . 27482 1 158 . 1 1 90 90 ARG N N 15 121.216 0.045 . 1 . . . . . 109 ARG N . 27482 1 159 . 1 1 91 91 VAL H H 1 8.058 0.000 . 1 . . . . . 110 VAL H . 27482 1 160 . 1 1 91 91 VAL CA C 13 59.213 0.000 . 1 . . . . . 110 VAL CA . 27482 1 161 . 1 1 91 91 VAL N N 15 122.277 0.000 . 1 . . . . . 110 VAL N . 27482 1 162 . 1 1 92 92 GLU H H 1 8.334 0.005 . 1 . . . . . 111 GLU H . 27482 1 163 . 1 1 92 92 GLU CA C 13 53.109 0.000 . 1 . . . . . 111 GLU CA . 27482 1 164 . 1 1 92 92 GLU N N 15 125.969 0.075 . 1 . . . . . 111 GLU N . 27482 1 165 . 1 1 93 93 VAL H H 1 8.063 0.004 . 1 . . . . . 112 VAL H . 27482 1 166 . 1 1 93 93 VAL CA C 13 59.228 0.000 . 1 . . . . . 112 VAL CA . 27482 1 167 . 1 1 93 93 VAL N N 15 122.249 0.027 . 1 . . . . . 112 VAL N . 27482 1 168 . 1 1 94 94 THR H H 1 8.228 0.008 . 1 . . . . . 113 THR H . 27482 1 169 . 1 1 94 94 THR CA C 13 59.332 0.000 . 1 . . . . . 113 THR CA . 27482 1 170 . 1 1 94 94 THR N N 15 118.145 0.031 . 1 . . . . . 113 THR N . 27482 1 171 . 1 1 98 98 ASP H H 1 8.578 0.010 . 1 . . . . . 117 ASP H . 27482 1 172 . 1 1 98 98 ASP CA C 13 52.565 0.000 . 1 . . . . . 117 ASP CA . 27482 1 173 . 1 1 98 98 ASP N N 15 113.438 0.040 . 1 . . . . . 117 ASP N . 27482 1 174 . 1 1 99 99 ILE H H 1 7.929 0.010 . 1 . . . . . 118 ILE H . 27482 1 175 . 1 1 99 99 ILE CA C 13 61.581 0.009 . 1 . . . . . 118 ILE CA . 27482 1 176 . 1 1 99 99 ILE N N 15 118.431 0.066 . 1 . . . . . 118 ILE N . 27482 1 177 . 1 1 100 100 LYS H H 1 7.742 0.011 . 1 . . . . . 119 LYS H . 27482 1 178 . 1 1 100 100 LYS CA C 13 56.151 0.000 . 1 . . . . . 119 LYS CA . 27482 1 179 . 1 1 100 100 LYS N N 15 120.503 0.214 . 1 . . . . . 119 LYS N . 27482 1 180 . 1 1 101 101 SER H H 1 8.061 0.017 . 1 . . . . . 120 SER H . 27482 1 181 . 1 1 101 101 SER CA C 13 54.437 0.000 . 1 . . . . . 120 SER CA . 27482 1 182 . 1 1 101 101 SER N N 15 120.706 0.045 . 1 . . . . . 120 SER N . 27482 1 183 . 1 1 102 102 GLY H H 1 8.771 0.008 . 1 . . . . . 121 GLY H . 27482 1 184 . 1 1 102 102 GLY CA C 13 45.044 0.000 . 1 . . . . . 121 GLY CA . 27482 1 185 . 1 1 102 102 GLY N N 15 107.545 0.028 . 1 . . . . . 121 GLY N . 27482 1 186 . 1 1 103 103 TYR H H 1 7.491 0.008 . 1 . . . . . 122 TYR H . 27482 1 187 . 1 1 103 103 TYR CA C 13 56.155 0.000 . 1 . . . . . 122 TYR CA . 27482 1 188 . 1 1 103 103 TYR N N 15 118.891 0.010 . 1 . . . . . 122 TYR N . 27482 1 189 . 1 1 114 114 TYR CA C 13 59.968 0.000 . 1 . . . . . 133 TYR CA . 27482 1 190 . 1 1 115 115 PHE H H 1 8.647 0.001 . 1 . . . . . 134 PHE H . 27482 1 191 . 1 1 115 115 PHE CA C 13 54.860 0.000 . 1 . . . . . 134 PHE CA . 27482 1 192 . 1 1 115 115 PHE N N 15 116.491 0.015 . 1 . . . . . 134 PHE N . 27482 1 193 . 1 1 116 116 GLU H H 1 8.366 0.006 . 1 . . . . . 135 GLU H . 27482 1 194 . 1 1 116 116 GLU CA C 13 53.759 0.000 . 1 . . . . . 135 GLU CA . 27482 1 195 . 1 1 116 116 GLU N N 15 115.832 0.082 . 1 . . . . . 135 GLU N . 27482 1 196 . 1 1 117 117 ASN H H 1 8.144 0.003 . 1 . . . . . 136 ASN H . 27482 1 197 . 1 1 117 117 ASN CA C 13 52.286 0.000 . 1 . . . . . 136 ASN CA . 27482 1 198 . 1 1 117 117 ASN N N 15 120.311 0.025 . 1 . . . . . 136 ASN N . 27482 1 199 . 1 1 118 118 LYS H H 1 8.722 0.000 . 1 . . . . . 137 LYS H . 27482 1 200 . 1 1 118 118 LYS CA C 13 54.022 0.000 . 1 . . . . . 137 LYS CA . 27482 1 201 . 1 1 118 118 LYS N N 15 119.438 0.004 . 1 . . . . . 137 LYS N . 27482 1 202 . 1 1 127 127 ASN CA C 13 51.743 0.000 . 1 . . . . . 146 ASN CA . 27482 1 203 . 1 1 128 128 GLU H H 1 7.640 0.005 . 1 . . . . . 147 GLU H . 27482 1 204 . 1 1 128 128 GLU CA C 13 54.114 0.000 . 1 . . . . . 147 GLU CA . 27482 1 205 . 1 1 128 128 GLU N N 15 124.964 0.117 . 1 . . . . . 147 GLU N . 27482 1 206 . 1 1 129 129 SER H H 1 8.192 0.006 . 1 . . . . . 148 SER H . 27482 1 207 . 1 1 129 129 SER CA C 13 56.911 0.000 . 1 . . . . . 148 SER CA . 27482 1 208 . 1 1 129 129 SER N N 15 113.560 0.046 . 1 . . . . . 148 SER N . 27482 1 209 . 1 1 130 130 GLY H H 1 7.671 0.006 . 1 . . . . . 149 GLY H . 27482 1 210 . 1 1 130 130 GLY CA C 13 42.252 0.000 . 1 . . . . . 149 GLY CA . 27482 1 211 . 1 1 130 130 GLY N N 15 109.252 0.061 . 1 . . . . . 149 GLY N . 27482 1 212 . 1 1 139 139 ILE CA C 13 54.349 0.000 . 1 . . . . . 158 ILE CA . 27482 1 213 . 1 1 140 140 LYS H H 1 8.689 0.002 . 1 . . . . . 159 LYS H . 27482 1 214 . 1 1 140 140 LYS CA C 13 59.474 0.000 . 1 . . . . . 159 LYS CA . 27482 1 215 . 1 1 140 140 LYS N N 15 121.250 0.014 . 1 . . . . . 159 LYS N . 27482 1 216 . 1 1 141 141 TRP H H 1 8.640 0.010 . 1 . . . . . 160 TRP H . 27482 1 217 . 1 1 141 141 TRP CA C 13 54.181 0.000 . 1 . . . . . 160 TRP CA . 27482 1 218 . 1 1 141 141 TRP N N 15 121.029 0.094 . 1 . . . . . 160 TRP N . 27482 1 219 . 1 1 142 142 LYS H H 1 7.292 0.004 . 1 . . . . . 161 LYS H . 27482 1 220 . 1 1 142 142 LYS CA C 13 56.330 0.000 . 1 . . . . . 161 LYS CA . 27482 1 221 . 1 1 142 142 LYS N N 15 117.158 0.026 . 1 . . . . . 161 LYS N . 27482 1 222 . 1 1 143 143 SER H H 1 8.104 0.002 . 1 . . . . . 162 SER H . 27482 1 223 . 1 1 143 143 SER CA C 13 55.508 0.000 . 1 . . . . . 162 SER CA . 27482 1 224 . 1 1 143 143 SER N N 15 119.817 0.072 . 1 . . . . . 162 SER N . 27482 1 225 . 1 1 144 144 GLY H H 1 8.053 0.006 . 1 . . . . . 163 GLY H . 27482 1 226 . 1 1 144 144 GLY CA C 13 42.237 0.000 . 1 . . . . . 163 GLY CA . 27482 1 227 . 1 1 144 144 GLY N N 15 109.782 0.025 . 1 . . . . . 163 GLY N . 27482 1 228 . 1 1 145 145 LYS H H 1 7.978 0.015 . 1 . . . . . 164 LYS H . 27482 1 229 . 1 1 145 145 LYS CA C 13 52.845 0.000 . 1 . . . . . 164 LYS CA . 27482 1 230 . 1 1 145 145 LYS N N 15 116.368 0.046 . 1 . . . . . 164 LYS N . 27482 1 231 . 1 1 146 146 ASP H H 1 8.841 0.004 . 1 . . . . . 165 ASP H . 27482 1 232 . 1 1 146 146 ASP CA C 13 51.155 0.000 . 1 . . . . . 165 ASP CA . 27482 1 233 . 1 1 146 146 ASP N N 15 119.289 0.010 . 1 . . . . . 165 ASP N . 27482 1 234 . 1 1 147 147 LEU H H 1 8.670 0.004 . 1 . . . . . 166 LEU H . 27482 1 235 . 1 1 147 147 LEU CA C 13 54.232 0.000 . 1 . . . . . 166 LEU CA . 27482 1 236 . 1 1 147 147 LEU N N 15 123.130 0.025 . 1 . . . . . 166 LEU N . 27482 1 237 . 1 1 159 159 SER H H 1 7.640 0.020 . 1 . . . . . 178 SER H . 27482 1 238 . 1 1 159 159 SER CA C 13 59.138 0.000 . 1 . . . . . 178 SER CA . 27482 1 239 . 1 1 159 159 SER N N 15 121.838 0.054 . 1 . . . . . 178 SER N . 27482 1 240 . 1 1 167 167 PRO CA C 13 60.507 0.000 . 1 . . . . . 186 PRO CA . 27482 1 241 . 1 1 168 168 GLU H H 1 9.178 0.006 . 1 . . . . . 187 GLU H . 27482 1 242 . 1 1 168 168 GLU CA C 13 51.072 0.000 . 1 . . . . . 187 GLU CA . 27482 1 243 . 1 1 168 168 GLU N N 15 115.489 0.030 . 1 . . . . . 187 GLU N . 27482 1 244 . 1 1 177 177 HIS CA C 13 53.339 0.000 . 1 . . . . . 196 HIS CA . 27482 1 245 . 1 1 177 177 HIS CB C 13 28.309 0.000 . 1 . . . . . 196 HIS CB . 27482 1 246 . 1 1 178 178 SER H H 1 7.826 0.033 . 1 . . . . . 197 SER H . 27482 1 247 . 1 1 178 178 SER CA C 13 57.389 0.000 . 1 . . . . . 197 SER CA . 27482 1 248 . 1 1 178 178 SER CB C 13 62.377 0.000 . 1 . . . . . 197 SER CB . 27482 1 249 . 1 1 178 178 SER N N 15 122.551 0.121 . 1 . . . . . 197 SER N . 27482 1 250 . 1 1 180 180 ALA H H 1 8.237 0.008 . 1 . . . . . 199 ALA H . 27482 1 251 . 1 1 180 180 ALA CA C 13 50.063 0.003 . 1 . . . . . 199 ALA CA . 27482 1 252 . 1 1 180 180 ALA N N 15 124.458 0.029 . 1 . . . . . 199 ALA N . 27482 1 253 . 1 1 181 181 GLY H H 1 8.331 0.011 . 1 . . . . . 200 GLY H . 27482 1 254 . 1 1 181 181 GLY CA C 13 42.342 0.001 . 1 . . . . . 200 GLY CA . 27482 1 255 . 1 1 181 181 GLY N N 15 107.491 0.060 . 1 . . . . . 200 GLY N . 27482 1 256 . 1 1 182 182 ALA H H 1 7.886 0.009 . 1 . . . . . 201 ALA H . 27482 1 257 . 1 1 182 182 ALA CA C 13 48.981 0.000 . 1 . . . . . 201 ALA CA . 27482 1 258 . 1 1 182 182 ALA N N 15 123.869 0.039 . 1 . . . . . 201 ALA N . 27482 1 259 . 1 1 183 183 ASP H H 1 7.935 0.016 . 1 . . . . . 202 ASP H . 27482 1 260 . 1 1 183 183 ASP CA C 13 51.285 0.000 . 1 . . . . . 202 ASP CA . 27482 1 261 . 1 1 183 183 ASP N N 15 122.173 0.162 . 1 . . . . . 202 ASP N . 27482 1 262 . 1 1 184 184 GLU H H 1 8.202 0.005 . 1 . . . . . 203 GLU H . 27482 1 263 . 1 1 184 184 GLU CA C 13 51.859 0.000 . 1 . . . . . 203 GLU CA . 27482 1 264 . 1 1 184 184 GLU N N 15 122.856 0.041 . 1 . . . . . 203 GLU N . 27482 1 265 . 1 1 185 185 LEU H H 1 8.483 0.004 . 1 . . . . . 204 LEU H . 27482 1 266 . 1 1 185 185 LEU CA C 13 54.225 0.000 . 1 . . . . . 204 LEU CA . 27482 1 267 . 1 1 185 185 LEU N N 15 120.393 0.022 . 1 . . . . . 204 LEU N . 27482 1 268 . 1 1 186 186 GLY H H 1 8.332 0.000 . 1 . . . . . 205 GLY H . 27482 1 269 . 1 1 186 186 GLY CA C 13 42.225 0.000 . 1 . . . . . 205 GLY CA . 27482 1 270 . 1 1 186 186 GLY N N 15 109.398 0.006 . 1 . . . . . 205 GLY N . 27482 1 271 . 1 1 187 187 GLU H H 1 8.011 0.007 . 1 . . . . . 206 GLU H . 27482 1 272 . 1 1 187 187 GLU CA C 13 49.197 0.000 . 1 . . . . . 206 GLU CA . 27482 1 273 . 1 1 187 187 GLU N N 15 121.701 0.029 . 1 . . . . . 206 GLU N . 27482 1 274 . 1 1 188 188 VAL H H 1 8.761 0.004 . 1 . . . . . 207 VAL H . 27482 1 275 . 1 1 188 188 VAL CA C 13 55.005 0.000 . 1 . . . . . 207 VAL CA . 27482 1 276 . 1 1 188 188 VAL N N 15 122.438 0.019 . 1 . . . . . 207 VAL N . 27482 1 277 . 1 1 189 189 ILE H H 1 8.726 0.003 . 1 . . . . . 208 ILE H . 27482 1 278 . 1 1 189 189 ILE CA C 13 63.182 0.000 . 1 . . . . . 208 ILE CA . 27482 1 279 . 1 1 189 189 ILE N N 15 123.419 0.047 . 1 . . . . . 208 ILE N . 27482 1 280 . 1 1 195 195 PRO CA C 13 60.589 0.000 . 1 . . . . . 214 PRO CA . 27482 1 281 . 1 1 195 195 PRO CB C 13 29.680 0.000 . 1 . . . . . 214 PRO CB . 27482 1 282 . 1 1 196 196 ASN H H 1 8.160 0.009 . 1 . . . . . 215 ASN H . 27482 1 283 . 1 1 196 196 ASN CA C 13 51.977 0.000 . 1 . . . . . 215 ASN CA . 27482 1 284 . 1 1 196 196 ASN CB C 13 38.488 0.000 . 1 . . . . . 215 ASN CB . 27482 1 285 . 1 1 196 196 ASN N N 15 120.659 0.055 . 1 . . . . . 215 ASN N . 27482 1 286 . 1 1 204 204 PRO CA C 13 63.803 0.000 . 1 . . . . . 223 PRO CA . 27482 1 287 . 1 1 205 205 ASP H H 1 6.849 0.005 . 1 . . . . . 224 ASP H . 27482 1 288 . 1 1 205 205 ASP CA C 13 48.742 0.000 . 1 . . . . . 224 ASP CA . 27482 1 289 . 1 1 205 205 ASP N N 15 105.513 0.051 . 1 . . . . . 224 ASP N . 27482 1 stop_ save_