data_36514 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36514 _Entry.Title ; Solid-state NMR Structure of Aquaporin Z in its Native Cellular Membranes ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-10-02 _Entry.Accession_date 2023-02-19 _Entry.Last_release_date 2023-02-19 _Entry.Original_release_date 2023-02-19 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLID-STATE NMR' _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 . _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 H. Xie H. . . . 36514 2 Y. Zhao Y. . . . 36514 3 W. Zhao W. . . . 36514 4 Y. Chen Y. . . . 36514 5 M. Liu M. . . . 36514 6 J. Yang J. . . . 36514 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'MEMBRANE PROTEIN' . 36514 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36514 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 847 36514 '15N chemical shifts' 227 36514 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2025-10-27 . original BMRB . 36514 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 8H1D 'BMRB Entry Tracking System' 36514 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36514 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37910616 _Citation.DOI 10.1126/sciadv.adh4168 _Citation.Full_citation . _Citation.Title ; Solid-state NMR structure determination of a membrane protein in E. coli cellular inner membrane. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Adv.' _Citation.Journal_name_full 'Science advances' _Citation.Journal_volume 9 _Citation.Journal_issue 44 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 eadh4168 _Citation.Page_last eadh4168 _Citation.Year 2023 _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 Huayong Xie H. . . . 36514 1 2 Yongxiang Zhao Y. . . . 36514 1 3 Weijing Zhao W. . . . 36514 1 4 Yanke Chen Y. . . . 36514 1 5 Maili Liu M. . . . 36514 1 6 Jun Yang J. . . . 36514 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36514 _Assembly.ID 1 _Assembly.Name 'Aquaporin Z' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 25185.242 _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 entity_1 1 $entity_1 A A yes . . . . . . 36514 1 stop_ loop_ _Chem_comp_assembly.Assembly_chem_comp_ID _Chem_comp_assembly.Entity_assembly_ID _Chem_comp_assembly.Entity_ID _Chem_comp_assembly.Comp_index_ID _Chem_comp_assembly.Comp_ID _Chem_comp_assembly.Seq_ID _Chem_comp_assembly.Auth_entity_assembly_ID _Chem_comp_assembly.Auth_asym_ID _Chem_comp_assembly.Auth_seq_ID _Chem_comp_assembly.Auth_comp_ID _Chem_comp_assembly.Auth_variant_ID _Chem_comp_assembly.Sequence_linking _Chem_comp_assembly.Cis_residue _Chem_comp_assembly.NEF_index _Chem_comp_assembly.Entry_ID _Chem_comp_assembly.Assembly_ID . 1 1 1 MET 1 . A -11 MET . start . . 36514 1 . 1 1 10 HIS 10 . A -2 HIS . middle . . 36514 1 . 1 1 100 GLN 100 . A 88 GLN . middle . . 36514 1 . 1 1 101 VAL 101 . A 89 VAL . middle . . 36514 1 . 1 1 102 VAL 102 . A 90 VAL . middle . . 36514 1 . 1 1 103 GLY 103 . A 91 GLY . middle no . 36514 1 . 1 1 104 GLY 104 . A 92 GLY . middle no . 36514 1 . 1 1 105 ILE 105 . A 93 ILE . middle . . 36514 1 . 1 1 106 VAL 106 . A 94 VAL . middle . . 36514 1 . 1 1 107 ALA 107 . A 95 ALA . middle . . 36514 1 . 1 1 108 ALA 108 . A 96 ALA . middle . . 36514 1 . 1 1 109 ALA 109 . A 97 ALA . middle . . 36514 1 . 1 1 11 GLU 11 . A -1 GLU . middle . . 36514 1 . 1 1 110 LEU 110 . A 98 LEU . middle . . 36514 1 . 1 1 111 LEU 111 . A 99 LEU . middle . . 36514 1 . 1 1 112 TYR 112 . A 100 TYR . middle . . 36514 1 . 1 1 113 LEU 113 . A 101 LEU . middle . . 36514 1 . 1 1 114 ILE 114 . A 102 ILE . middle . . 36514 1 . 1 1 115 ALA 115 . A 103 ALA . middle . . 36514 1 . 1 1 116 SER 116 . A 104 SER . middle . . 36514 1 . 1 1 117 GLY 117 . A 105 GLY . middle no . 36514 1 . 1 1 118 LYS 118 . A 106 LYS . middle . . 36514 1 . 1 1 119 THR 119 . A 107 THR . middle . . 36514 1 . 1 1 12 PHE 12 . A 0 PHE . middle . . 36514 1 . 1 1 120 GLY 120 . A 108 GLY . middle no . 36514 1 . 1 1 121 PHE 121 . A 109 PHE . middle . . 36514 1 . 1 1 122 ASP 122 . A 110 ASP . middle . . 36514 1 . 1 1 123 ALA 123 . A 111 ALA . middle . . 36514 1 . 1 1 124 ALA 124 . A 112 ALA . middle . . 36514 1 . 1 1 125 ALA 125 . A 113 ALA . middle . . 36514 1 . 1 1 126 SER 126 . A 114 SER . middle . . 36514 1 . 1 1 127 GLY 127 . A 115 GLY . middle no . 36514 1 . 1 1 128 PHE 128 . A 116 PHE . middle . . 36514 1 . 1 1 129 ALA 129 . A 117 ALA . middle . . 36514 1 . 1 1 13 MET 13 . A 1 MET . middle . . 36514 1 . 1 1 130 SER 130 . A 118 SER . middle . . 36514 1 . 1 1 131 ASN 131 . A 119 ASN . middle . . 36514 1 . 1 1 132 GLY 132 . A 120 GLY . middle no . 36514 1 . 1 1 133 TYR 133 . A 121 TYR . middle . . 36514 1 . 1 1 134 GLY 134 . A 122 GLY . middle no . 36514 1 . 1 1 135 GLU 135 . A 123 GLU . middle . . 36514 1 . 1 1 136 HIS 136 . A 124 HIS . middle . . 36514 1 . 1 1 137 SER 137 . A 125 SER . middle . . 36514 1 . 1 1 138 PRO 138 . A 126 PRO . middle no . 36514 1 . 1 1 139 GLY 139 . A 127 GLY . middle no . 36514 1 . 1 1 14 PHE 14 . A 2 PHE . middle . . 36514 1 . 1 1 140 GLY 140 . A 128 GLY . middle no . 36514 1 . 1 1 141 TYR 141 . A 129 TYR . middle . . 36514 1 . 1 1 142 SER 142 . A 130 SER . middle . . 36514 1 . 1 1 143 MET 143 . A 131 MET . middle . . 36514 1 . 1 1 144 LEU 144 . A 132 LEU . middle . . 36514 1 . 1 1 145 SER 145 . A 133 SER . middle . . 36514 1 . 1 1 146 ALA 146 . A 134 ALA . middle . . 36514 1 . 1 1 147 LEU 147 . A 135 LEU . middle . . 36514 1 . 1 1 148 VAL 148 . A 136 VAL . middle . . 36514 1 . 1 1 149 VAL 149 . A 137 VAL . middle . . 36514 1 . 1 1 15 ARG 15 . A 3 ARG . middle . . 36514 1 . 1 1 150 GLU 150 . A 138 GLU . middle . . 36514 1 . 1 1 151 LEU 151 . A 139 LEU . middle . . 36514 1 . 1 1 152 VAL 152 . A 140 VAL . middle . . 36514 1 . 1 1 153 LEU 153 . A 141 LEU . middle . . 36514 1 . 1 1 154 SER 154 . A 142 SER . middle . . 36514 1 . 1 1 155 ALA 155 . A 143 ALA . middle . . 36514 1 . 1 1 156 GLY 156 . A 144 GLY . middle no . 36514 1 . 1 1 157 PHE 157 . A 145 PHE . middle . . 36514 1 . 1 1 158 LEU 158 . A 146 LEU . middle . . 36514 1 . 1 1 159 LEU 159 . A 147 LEU . middle . . 36514 1 . 1 1 16 LYS 16 . A 4 LYS . middle . . 36514 1 . 1 1 160 VAL 160 . A 148 VAL . middle . . 36514 1 . 1 1 161 ILE 161 . A 149 ILE . middle . . 36514 1 . 1 1 162 HIS 162 . A 150 HIS . middle . . 36514 1 . 1 1 163 GLY 163 . A 151 GLY . middle no . 36514 1 . 1 1 164 ALA 164 . A 152 ALA . middle . . 36514 1 . 1 1 165 THR 165 . A 153 THR . middle . . 36514 1 . 1 1 166 ASP 166 . A 154 ASP . middle . . 36514 1 . 1 1 167 LYS 167 . A 155 LYS . middle . . 36514 1 . 1 1 168 PHE 168 . A 156 PHE . middle . . 36514 1 . 1 1 169 ALA 169 . A 157 ALA . middle . . 36514 1 . 1 1 17 LEU 17 . A 5 LEU . middle . . 36514 1 . 1 1 170 PRO 170 . A 158 PRO . middle no . 36514 1 . 1 1 171 ALA 171 . A 159 ALA . middle . . 36514 1 . 1 1 172 GLY 172 . A 160 GLY . middle no . 36514 1 . 1 1 173 PHE 173 . A 161 PHE . middle . . 36514 1 . 1 1 174 ALA 174 . A 162 ALA . middle . . 36514 1 . 1 1 175 PRO 175 . A 163 PRO . middle no . 36514 1 . 1 1 176 ILE 176 . A 164 ILE . middle . . 36514 1 . 1 1 177 ALA 177 . A 165 ALA . middle . . 36514 1 . 1 1 178 ILE 178 . A 166 ILE . middle . . 36514 1 . 1 1 179 GLY 179 . A 167 GLY . middle no . 36514 1 . 1 1 18 ALA 18 . A 6 ALA . middle . . 36514 1 . 1 1 180 LEU 180 . A 168 LEU . middle . . 36514 1 . 1 1 181 ALA 181 . A 169 ALA . middle . . 36514 1 . 1 1 182 LEU 182 . A 170 LEU . middle . . 36514 1 . 1 1 183 THR 183 . A 171 THR . middle . . 36514 1 . 1 1 184 LEU 184 . A 172 LEU . middle . . 36514 1 . 1 1 185 ILE 185 . A 173 ILE . middle . . 36514 1 . 1 1 186 HIS 186 . A 174 HIS . middle . . 36514 1 . 1 1 187 LEU 187 . A 175 LEU . middle . . 36514 1 . 1 1 188 ILE 188 . A 176 ILE . middle . . 36514 1 . 1 1 189 SER 189 . A 177 SER . middle . . 36514 1 . 1 1 19 ALA 19 . A 7 ALA . middle . . 36514 1 . 1 1 190 ILE 190 . A 178 ILE . middle . . 36514 1 . 1 1 191 PRO 191 . A 179 PRO . middle no . 36514 1 . 1 1 192 VAL 192 . A 180 VAL . middle . . 36514 1 . 1 1 193 THR 193 . A 181 THR . middle . . 36514 1 . 1 1 194 ASN 194 . A 182 ASN . middle . . 36514 1 . 1 1 195 THR 195 . A 183 THR . middle . . 36514 1 . 1 1 196 SER 196 . A 184 SER . middle . . 36514 1 . 1 1 197 VAL 197 . A 185 VAL . middle . . 36514 1 . 1 1 198 ASN 198 . A 186 ASN . middle . . 36514 1 . 1 1 199 PRO 199 . A 187 PRO . middle no . 36514 1 . 1 1 2 GLY 2 . A -10 GLY . middle no . 36514 1 . 1 1 20 GLU 20 . A 8 GLU . middle . . 36514 1 . 1 1 200 ALA 200 . A 188 ALA . middle . . 36514 1 . 1 1 201 ARG 201 . A 189 ARG . middle . . 36514 1 . 1 1 202 SER 202 . A 190 SER . middle . . 36514 1 . 1 1 203 THR 203 . A 191 THR . middle . . 36514 1 . 1 1 204 ALA 204 . A 192 ALA . middle . . 36514 1 . 1 1 205 VAL 205 . A 193 VAL . middle . . 36514 1 . 1 1 206 ALA 206 . A 194 ALA . middle . . 36514 1 . 1 1 207 ILE 207 . A 195 ILE . middle . . 36514 1 . 1 1 208 PHE 208 . A 196 PHE . middle . . 36514 1 . 1 1 209 GLN 209 . A 197 GLN . middle . . 36514 1 . 1 1 21 CYS 21 . A 9 CYS . middle . . 36514 1 . 1 1 210 GLY 210 . A 198 GLY . middle no . 36514 1 . 1 1 211 GLY 211 . A 199 GLY . middle no . 36514 1 . 1 1 212 TRP 212 . A 200 TRP . middle . . 36514 1 . 1 1 213 ALA 213 . A 201 ALA . middle . . 36514 1 . 1 1 214 LEU 214 . A 202 LEU . middle . . 36514 1 . 1 1 215 GLU 215 . A 203 GLU . middle . . 36514 1 . 1 1 216 GLN 216 . A 204 GLN . middle . . 36514 1 . 1 1 217 LEU 217 . A 205 LEU . middle . . 36514 1 . 1 1 218 TRP 218 . A 206 TRP . middle . . 36514 1 . 1 1 219 PHE 219 . A 207 PHE . middle . . 36514 1 . 1 1 22 PHE 22 . A 10 PHE . middle . . 36514 1 . 1 1 220 PHE 220 . A 208 PHE . middle . . 36514 1 . 1 1 221 TRP 221 . A 209 TRP . middle . . 36514 1 . 1 1 222 VAL 222 . A 210 VAL . middle . . 36514 1 . 1 1 223 VAL 223 . A 211 VAL . middle . . 36514 1 . 1 1 224 PRO 224 . A 212 PRO . middle no . 36514 1 . 1 1 225 ILE 225 . A 213 ILE . middle . . 36514 1 . 1 1 226 VAL 226 . A 214 VAL . middle . . 36514 1 . 1 1 227 GLY 227 . A 215 GLY . middle no . 36514 1 . 1 1 228 GLY 228 . A 216 GLY . middle no . 36514 1 . 1 1 229 ILE 229 . A 217 ILE . middle . . 36514 1 . 1 1 23 GLY 23 . A 11 GLY . middle no . 36514 1 . 1 1 230 ILE 230 . A 218 ILE . middle . . 36514 1 . 1 1 231 GLY 231 . A 219 GLY . middle no . 36514 1 . 1 1 232 GLY 232 . A 220 GLY . middle no . 36514 1 . 1 1 233 LEU 233 . A 221 LEU . middle . . 36514 1 . 1 1 234 ILE 234 . A 222 ILE . middle . . 36514 1 . 1 1 235 TYR 235 . A 223 TYR . middle . . 36514 1 . 1 1 236 ARG 236 . A 224 ARG . middle . . 36514 1 . 1 1 237 THR 237 . A 225 THR . middle . . 36514 1 . 1 1 238 LEU 238 . A 226 LEU . middle . . 36514 1 . 1 1 239 LEU 239 . A 227 LEU . middle . . 36514 1 . 1 1 24 THR 24 . A 12 THR . middle . . 36514 1 . 1 1 240 GLU 240 . A 228 GLU . middle . . 36514 1 . 1 1 241 LYS 241 . A 229 LYS . middle . . 36514 1 . 1 1 242 ARG 242 . A 230 ARG . middle . . 36514 1 . 1 1 243 ASP 243 . A 231 ASP . end . . 36514 1 . 1 1 25 PHE 25 . A 13 PHE . middle . . 36514 1 . 1 1 26 TRP 26 . A 14 TRP . middle . . 36514 1 . 1 1 27 LEU 27 . A 15 LEU . middle . . 36514 1 . 1 1 28 VAL 28 . A 16 VAL . middle . . 36514 1 . 1 1 29 PHE 29 . A 17 PHE . middle . . 36514 1 . 1 1 3 SER 3 . A -9 SER . middle . . 36514 1 . 1 1 30 GLY 30 . A 18 GLY . middle no . 36514 1 . 1 1 31 GLY 31 . A 19 GLY . middle no . 36514 1 . 1 1 32 CYS 32 . A 20 CYS . middle . . 36514 1 . 1 1 33 GLY 33 . A 21 GLY . middle no . 36514 1 . 1 1 34 SER 34 . A 22 SER . middle . . 36514 1 . 1 1 35 ALA 35 . A 23 ALA . middle . . 36514 1 . 1 1 36 VAL 36 . A 24 VAL . middle . . 36514 1 . 1 1 37 LEU 37 . A 25 LEU . middle . . 36514 1 . 1 1 38 ALA 38 . A 26 ALA . middle . . 36514 1 . 1 1 39 ALA 39 . A 27 ALA . middle . . 36514 1 . 1 1 4 SER 4 . A -8 SER . middle . . 36514 1 . 1 1 40 GLY 40 . A 28 GLY . middle no . 36514 1 . 1 1 41 PHE 41 . A 29 PHE . middle . . 36514 1 . 1 1 42 PRO 42 . A 30 PRO . middle no . 36514 1 . 1 1 43 GLU 43 . A 31 GLU . middle . . 36514 1 . 1 1 44 LEU 44 . A 32 LEU . middle . . 36514 1 . 1 1 45 GLY 45 . A 33 GLY . middle no . 36514 1 . 1 1 46 ILE 46 . A 34 ILE . middle . . 36514 1 . 1 1 47 GLY 47 . A 35 GLY . middle no . 36514 1 . 1 1 48 PHE 48 . A 36 PHE . middle . . 36514 1 . 1 1 49 ALA 49 . A 37 ALA . middle . . 36514 1 . 1 1 5 HIS 5 . A -7 HIS . middle . . 36514 1 . 1 1 50 GLY 50 . A 38 GLY . middle no . 36514 1 . 1 1 51 VAL 51 . A 39 VAL . middle . . 36514 1 . 1 1 52 ALA 52 . A 40 ALA . middle . . 36514 1 . 1 1 53 LEU 53 . A 41 LEU . middle . . 36514 1 . 1 1 54 ALA 54 . A 42 ALA . middle . . 36514 1 . 1 1 55 PHE 55 . A 43 PHE . middle . . 36514 1 . 1 1 56 GLY 56 . A 44 GLY . middle no . 36514 1 . 1 1 57 LEU 57 . A 45 LEU . middle . . 36514 1 . 1 1 58 THR 58 . A 46 THR . middle . . 36514 1 . 1 1 59 VAL 59 . A 47 VAL . middle . . 36514 1 . 1 1 6 HIS 6 . A -6 HIS . middle . . 36514 1 . 1 1 60 LEU 60 . A 48 LEU . middle . . 36514 1 . 1 1 61 THR 61 . A 49 THR . middle . . 36514 1 . 1 1 62 MET 62 . A 50 MET . middle . . 36514 1 . 1 1 63 ALA 63 . A 51 ALA . middle . . 36514 1 . 1 1 64 PHE 64 . A 52 PHE . middle . . 36514 1 . 1 1 65 ALA 65 . A 53 ALA . middle . . 36514 1 . 1 1 66 VAL 66 . A 54 VAL . middle . . 36514 1 . 1 1 67 GLY 67 . A 55 GLY . middle no . 36514 1 . 1 1 68 HIS 68 . A 56 HIS . middle . . 36514 1 . 1 1 69 ILE 69 . A 57 ILE . middle . . 36514 1 . 1 1 7 HIS 7 . A -5 HIS . middle . . 36514 1 . 1 1 70 SER 70 . A 58 SER . middle . . 36514 1 . 1 1 71 GLY 71 . A 59 GLY . middle no . 36514 1 . 1 1 72 GLY 72 . A 60 GLY . middle no . 36514 1 . 1 1 73 HIS 73 . A 61 HIS . middle . . 36514 1 . 1 1 74 PHE 74 . A 62 PHE . middle . . 36514 1 . 1 1 75 ASN 75 . A 63 ASN . middle . . 36514 1 . 1 1 76 PRO 76 . A 64 PRO . middle no . 36514 1 . 1 1 77 ALA 77 . A 65 ALA . middle . . 36514 1 . 1 1 78 VAL 78 . A 66 VAL . middle . . 36514 1 . 1 1 79 THR 79 . A 67 THR . middle . . 36514 1 . 1 1 8 HIS 8 . A -4 HIS . middle . . 36514 1 . 1 1 80 ILE 80 . A 68 ILE . middle . . 36514 1 . 1 1 81 GLY 81 . A 69 GLY . middle no . 36514 1 . 1 1 82 LEU 82 . A 70 LEU . middle . . 36514 1 . 1 1 83 TRP 83 . A 71 TRP . middle . . 36514 1 . 1 1 84 ALA 84 . A 72 ALA . middle . . 36514 1 . 1 1 85 GLY 85 . A 73 GLY . middle no . 36514 1 . 1 1 86 GLY 86 . A 74 GLY . middle no . 36514 1 . 1 1 87 ARG 87 . A 75 ARG . middle . . 36514 1 . 1 1 88 PHE 88 . A 76 PHE . middle . . 36514 1 . 1 1 89 PRO 89 . A 77 PRO . middle no . 36514 1 . 1 1 9 HIS 9 . A -3 HIS . middle . . 36514 1 . 1 1 90 ALA 90 . A 78 ALA . middle . . 36514 1 . 1 1 91 LYS 91 . A 79 LYS . middle . . 36514 1 . 1 1 92 GLU 92 . A 80 GLU . middle . . 36514 1 . 1 1 93 VAL 93 . A 81 VAL . middle . . 36514 1 . 1 1 94 VAL 94 . A 82 VAL . middle . . 36514 1 . 1 1 95 GLY 95 . A 83 GLY . middle no . 36514 1 . 1 1 96 TYR 96 . A 84 TYR . middle . . 36514 1 . 1 1 97 VAL 97 . A 85 VAL . middle . . 36514 1 . 1 1 98 ILE 98 . A 86 ILE . middle . . 36514 1 . 1 1 99 ALA 99 . A 87 ALA . middle . . 36514 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36514 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Aquaporin Z' _Entity.Type polymer _Entity.Polymer_common_type protein _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSSHHHHHHEFMFRKLAAE CFGTFWLVFGGCGSAVLAAG FPELGIGFAGVALAFGLTVL TMAFAVGHISGGHFNPAVTI GLWAGGRFPAKEVVGYVIAQ VVGGIVAAALLYLIASGKTG FDAAASGFASNGYGEHSPGG YSMLSALVVELVLSAGFLLV IHGATDKFAPAGFAPIAIGL ALTLIHLISIPVTNTSVNPA RSTAVAIFQGGWALEQLWFF WVVPIVGGIIGGLIYRTLLE KRD ; _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 no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 243 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 25185.242 _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 -11 MET . 36514 1 2 -10 GLY . 36514 1 3 -9 SER . 36514 1 4 -8 SER . 36514 1 5 -7 HIS . 36514 1 6 -6 HIS . 36514 1 7 -5 HIS . 36514 1 8 -4 HIS . 36514 1 9 -3 HIS . 36514 1 10 -2 HIS . 36514 1 11 -1 GLU . 36514 1 12 0 PHE . 36514 1 13 1 MET . 36514 1 14 2 PHE . 36514 1 15 3 ARG . 36514 1 16 4 LYS . 36514 1 17 5 LEU . 36514 1 18 6 ALA . 36514 1 19 7 ALA . 36514 1 20 8 GLU . 36514 1 21 9 CYS . 36514 1 22 10 PHE . 36514 1 23 11 GLY . 36514 1 24 12 THR . 36514 1 25 13 PHE . 36514 1 26 14 TRP . 36514 1 27 15 LEU . 36514 1 28 16 VAL . 36514 1 29 17 PHE . 36514 1 30 18 GLY . 36514 1 31 19 GLY . 36514 1 32 20 CYS . 36514 1 33 21 GLY . 36514 1 34 22 SER . 36514 1 35 23 ALA . 36514 1 36 24 VAL . 36514 1 37 25 LEU . 36514 1 38 26 ALA . 36514 1 39 27 ALA . 36514 1 40 28 GLY . 36514 1 41 29 PHE . 36514 1 42 30 PRO . 36514 1 43 31 GLU . 36514 1 44 32 LEU . 36514 1 45 33 GLY . 36514 1 46 34 ILE . 36514 1 47 35 GLY . 36514 1 48 36 PHE . 36514 1 49 37 ALA . 36514 1 50 38 GLY . 36514 1 51 39 VAL . 36514 1 52 40 ALA . 36514 1 53 41 LEU . 36514 1 54 42 ALA . 36514 1 55 43 PHE . 36514 1 56 44 GLY . 36514 1 57 45 LEU . 36514 1 58 46 THR . 36514 1 59 47 VAL . 36514 1 60 48 LEU . 36514 1 61 49 THR . 36514 1 62 50 MET . 36514 1 63 51 ALA . 36514 1 64 52 PHE . 36514 1 65 53 ALA . 36514 1 66 54 VAL . 36514 1 67 55 GLY . 36514 1 68 56 HIS . 36514 1 69 57 ILE . 36514 1 70 58 SER . 36514 1 71 59 GLY . 36514 1 72 60 GLY . 36514 1 73 61 HIS . 36514 1 74 62 PHE . 36514 1 75 63 ASN . 36514 1 76 64 PRO . 36514 1 77 65 ALA . 36514 1 78 66 VAL . 36514 1 79 67 THR . 36514 1 80 68 ILE . 36514 1 81 69 GLY . 36514 1 82 70 LEU . 36514 1 83 71 TRP . 36514 1 84 72 ALA . 36514 1 85 73 GLY . 36514 1 86 74 GLY . 36514 1 87 75 ARG . 36514 1 88 76 PHE . 36514 1 89 77 PRO . 36514 1 90 78 ALA . 36514 1 91 79 LYS . 36514 1 92 80 GLU . 36514 1 93 81 VAL . 36514 1 94 82 VAL . 36514 1 95 83 GLY . 36514 1 96 84 TYR . 36514 1 97 85 VAL . 36514 1 98 86 ILE . 36514 1 99 87 ALA . 36514 1 100 88 GLN . 36514 1 101 89 VAL . 36514 1 102 90 VAL . 36514 1 103 91 GLY . 36514 1 104 92 GLY . 36514 1 105 93 ILE . 36514 1 106 94 VAL . 36514 1 107 95 ALA . 36514 1 108 96 ALA . 36514 1 109 97 ALA . 36514 1 110 98 LEU . 36514 1 111 99 LEU . 36514 1 112 100 TYR . 36514 1 113 101 LEU . 36514 1 114 102 ILE . 36514 1 115 103 ALA . 36514 1 116 104 SER . 36514 1 117 105 GLY . 36514 1 118 106 LYS . 36514 1 119 107 THR . 36514 1 120 108 GLY . 36514 1 121 109 PHE . 36514 1 122 110 ASP . 36514 1 123 111 ALA . 36514 1 124 112 ALA . 36514 1 125 113 ALA . 36514 1 126 114 SER . 36514 1 127 115 GLY . 36514 1 128 116 PHE . 36514 1 129 117 ALA . 36514 1 130 118 SER . 36514 1 131 119 ASN . 36514 1 132 120 GLY . 36514 1 133 121 TYR . 36514 1 134 122 GLY . 36514 1 135 123 GLU . 36514 1 136 124 HIS . 36514 1 137 125 SER . 36514 1 138 126 PRO . 36514 1 139 127 GLY . 36514 1 140 128 GLY . 36514 1 141 129 TYR . 36514 1 142 130 SER . 36514 1 143 131 MET . 36514 1 144 132 LEU . 36514 1 145 133 SER . 36514 1 146 134 ALA . 36514 1 147 135 LEU . 36514 1 148 136 VAL . 36514 1 149 137 VAL . 36514 1 150 138 GLU . 36514 1 151 139 LEU . 36514 1 152 140 VAL . 36514 1 153 141 LEU . 36514 1 154 142 SER . 36514 1 155 143 ALA . 36514 1 156 144 GLY . 36514 1 157 145 PHE . 36514 1 158 146 LEU . 36514 1 159 147 LEU . 36514 1 160 148 VAL . 36514 1 161 149 ILE . 36514 1 162 150 HIS . 36514 1 163 151 GLY . 36514 1 164 152 ALA . 36514 1 165 153 THR . 36514 1 166 154 ASP . 36514 1 167 155 LYS . 36514 1 168 156 PHE . 36514 1 169 157 ALA . 36514 1 170 158 PRO . 36514 1 171 159 ALA . 36514 1 172 160 GLY . 36514 1 173 161 PHE . 36514 1 174 162 ALA . 36514 1 175 163 PRO . 36514 1 176 164 ILE . 36514 1 177 165 ALA . 36514 1 178 166 ILE . 36514 1 179 167 GLY . 36514 1 180 168 LEU . 36514 1 181 169 ALA . 36514 1 182 170 LEU . 36514 1 183 171 THR . 36514 1 184 172 LEU . 36514 1 185 173 ILE . 36514 1 186 174 HIS . 36514 1 187 175 LEU . 36514 1 188 176 ILE . 36514 1 189 177 SER . 36514 1 190 178 ILE . 36514 1 191 179 PRO . 36514 1 192 180 VAL . 36514 1 193 181 THR . 36514 1 194 182 ASN . 36514 1 195 183 THR . 36514 1 196 184 SER . 36514 1 197 185 VAL . 36514 1 198 186 ASN . 36514 1 199 187 PRO . 36514 1 200 188 ALA . 36514 1 201 189 ARG . 36514 1 202 190 SER . 36514 1 203 191 THR . 36514 1 204 192 ALA . 36514 1 205 193 VAL . 36514 1 206 194 ALA . 36514 1 207 195 ILE . 36514 1 208 196 PHE . 36514 1 209 197 GLN . 36514 1 210 198 GLY . 36514 1 211 199 GLY . 36514 1 212 200 TRP . 36514 1 213 201 ALA . 36514 1 214 202 LEU . 36514 1 215 203 GLU . 36514 1 216 204 GLN . 36514 1 217 205 LEU . 36514 1 218 206 TRP . 36514 1 219 207 PHE . 36514 1 220 208 PHE . 36514 1 221 209 TRP . 36514 1 222 210 VAL . 36514 1 223 211 VAL . 36514 1 224 212 PRO . 36514 1 225 213 ILE . 36514 1 226 214 VAL . 36514 1 227 215 GLY . 36514 1 228 216 GLY . 36514 1 229 217 ILE . 36514 1 230 218 ILE . 36514 1 231 219 GLY . 36514 1 232 220 GLY . 36514 1 233 221 LEU . 36514 1 234 222 ILE . 36514 1 235 223 TYR . 36514 1 236 224 ARG . 36514 1 237 225 THR . 36514 1 238 226 LEU . 36514 1 239 227 LEU . 36514 1 240 228 GLU . 36514 1 241 229 LYS . 36514 1 242 230 ARG . 36514 1 243 231 ASP . 36514 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 36514 1 . GLY 2 2 36514 1 . SER 3 3 36514 1 . SER 4 4 36514 1 . HIS 5 5 36514 1 . HIS 6 6 36514 1 . HIS 7 7 36514 1 . HIS 8 8 36514 1 . HIS 9 9 36514 1 . HIS 10 10 36514 1 . GLU 11 11 36514 1 . PHE 12 12 36514 1 . MET 13 13 36514 1 . PHE 14 14 36514 1 . ARG 15 15 36514 1 . LYS 16 16 36514 1 . LEU 17 17 36514 1 . ALA 18 18 36514 1 . ALA 19 19 36514 1 . GLU 20 20 36514 1 . CYS 21 21 36514 1 . PHE 22 22 36514 1 . GLY 23 23 36514 1 . THR 24 24 36514 1 . PHE 25 25 36514 1 . TRP 26 26 36514 1 . LEU 27 27 36514 1 . VAL 28 28 36514 1 . PHE 29 29 36514 1 . GLY 30 30 36514 1 . GLY 31 31 36514 1 . CYS 32 32 36514 1 . GLY 33 33 36514 1 . SER 34 34 36514 1 . ALA 35 35 36514 1 . VAL 36 36 36514 1 . LEU 37 37 36514 1 . ALA 38 38 36514 1 . ALA 39 39 36514 1 . GLY 40 40 36514 1 . PHE 41 41 36514 1 . PRO 42 42 36514 1 . GLU 43 43 36514 1 . LEU 44 44 36514 1 . GLY 45 45 36514 1 . ILE 46 46 36514 1 . GLY 47 47 36514 1 . PHE 48 48 36514 1 . ALA 49 49 36514 1 . GLY 50 50 36514 1 . VAL 51 51 36514 1 . ALA 52 52 36514 1 . LEU 53 53 36514 1 . ALA 54 54 36514 1 . PHE 55 55 36514 1 . GLY 56 56 36514 1 . LEU 57 57 36514 1 . THR 58 58 36514 1 . VAL 59 59 36514 1 . LEU 60 60 36514 1 . THR 61 61 36514 1 . MET 62 62 36514 1 . ALA 63 63 36514 1 . PHE 64 64 36514 1 . ALA 65 65 36514 1 . VAL 66 66 36514 1 . GLY 67 67 36514 1 . HIS 68 68 36514 1 . ILE 69 69 36514 1 . SER 70 70 36514 1 . GLY 71 71 36514 1 . GLY 72 72 36514 1 . HIS 73 73 36514 1 . PHE 74 74 36514 1 . ASN 75 75 36514 1 . PRO 76 76 36514 1 . ALA 77 77 36514 1 . VAL 78 78 36514 1 . THR 79 79 36514 1 . ILE 80 80 36514 1 . GLY 81 81 36514 1 . LEU 82 82 36514 1 . TRP 83 83 36514 1 . ALA 84 84 36514 1 . GLY 85 85 36514 1 . GLY 86 86 36514 1 . ARG 87 87 36514 1 . PHE 88 88 36514 1 . PRO 89 89 36514 1 . ALA 90 90 36514 1 . LYS 91 91 36514 1 . GLU 92 92 36514 1 . VAL 93 93 36514 1 . VAL 94 94 36514 1 . GLY 95 95 36514 1 . TYR 96 96 36514 1 . VAL 97 97 36514 1 . ILE 98 98 36514 1 . ALA 99 99 36514 1 . GLN 100 100 36514 1 . VAL 101 101 36514 1 . VAL 102 102 36514 1 . GLY 103 103 36514 1 . GLY 104 104 36514 1 . ILE 105 105 36514 1 . VAL 106 106 36514 1 . ALA 107 107 36514 1 . ALA 108 108 36514 1 . ALA 109 109 36514 1 . LEU 110 110 36514 1 . LEU 111 111 36514 1 . TYR 112 112 36514 1 . LEU 113 113 36514 1 . ILE 114 114 36514 1 . ALA 115 115 36514 1 . SER 116 116 36514 1 . GLY 117 117 36514 1 . LYS 118 118 36514 1 . THR 119 119 36514 1 . GLY 120 120 36514 1 . PHE 121 121 36514 1 . ASP 122 122 36514 1 . ALA 123 123 36514 1 . ALA 124 124 36514 1 . ALA 125 125 36514 1 . SER 126 126 36514 1 . GLY 127 127 36514 1 . PHE 128 128 36514 1 . ALA 129 129 36514 1 . SER 130 130 36514 1 . ASN 131 131 36514 1 . GLY 132 132 36514 1 . TYR 133 133 36514 1 . GLY 134 134 36514 1 . GLU 135 135 36514 1 . HIS 136 136 36514 1 . SER 137 137 36514 1 . PRO 138 138 36514 1 . GLY 139 139 36514 1 . GLY 140 140 36514 1 . TYR 141 141 36514 1 . SER 142 142 36514 1 . MET 143 143 36514 1 . LEU 144 144 36514 1 . SER 145 145 36514 1 . ALA 146 146 36514 1 . LEU 147 147 36514 1 . VAL 148 148 36514 1 . VAL 149 149 36514 1 . GLU 150 150 36514 1 . LEU 151 151 36514 1 . VAL 152 152 36514 1 . LEU 153 153 36514 1 . SER 154 154 36514 1 . ALA 155 155 36514 1 . GLY 156 156 36514 1 . PHE 157 157 36514 1 . LEU 158 158 36514 1 . LEU 159 159 36514 1 . VAL 160 160 36514 1 . ILE 161 161 36514 1 . HIS 162 162 36514 1 . GLY 163 163 36514 1 . ALA 164 164 36514 1 . THR 165 165 36514 1 . ASP 166 166 36514 1 . LYS 167 167 36514 1 . PHE 168 168 36514 1 . ALA 169 169 36514 1 . PRO 170 170 36514 1 . ALA 171 171 36514 1 . GLY 172 172 36514 1 . PHE 173 173 36514 1 . ALA 174 174 36514 1 . PRO 175 175 36514 1 . ILE 176 176 36514 1 . ALA 177 177 36514 1 . ILE 178 178 36514 1 . GLY 179 179 36514 1 . LEU 180 180 36514 1 . ALA 181 181 36514 1 . LEU 182 182 36514 1 . THR 183 183 36514 1 . LEU 184 184 36514 1 . ILE 185 185 36514 1 . HIS 186 186 36514 1 . LEU 187 187 36514 1 . ILE 188 188 36514 1 . SER 189 189 36514 1 . ILE 190 190 36514 1 . PRO 191 191 36514 1 . VAL 192 192 36514 1 . THR 193 193 36514 1 . ASN 194 194 36514 1 . THR 195 195 36514 1 . SER 196 196 36514 1 . VAL 197 197 36514 1 . ASN 198 198 36514 1 . PRO 199 199 36514 1 . ALA 200 200 36514 1 . ARG 201 201 36514 1 . SER 202 202 36514 1 . THR 203 203 36514 1 . ALA 204 204 36514 1 . VAL 205 205 36514 1 . ALA 206 206 36514 1 . ILE 207 207 36514 1 . PHE 208 208 36514 1 . GLN 209 209 36514 1 . GLY 210 210 36514 1 . GLY 211 211 36514 1 . TRP 212 212 36514 1 . ALA 213 213 36514 1 . LEU 214 214 36514 1 . GLU 215 215 36514 1 . GLN 216 216 36514 1 . LEU 217 217 36514 1 . TRP 218 218 36514 1 . PHE 219 219 36514 1 . PHE 220 220 36514 1 . TRP 221 221 36514 1 . VAL 222 222 36514 1 . VAL 223 223 36514 1 . PRO 224 224 36514 1 . ILE 225 225 36514 1 . VAL 226 226 36514 1 . GLY 227 227 36514 1 . GLY 228 228 36514 1 . ILE 229 229 36514 1 . ILE 230 230 36514 1 . GLY 231 231 36514 1 . GLY 232 232 36514 1 . LEU 233 233 36514 1 . ILE 234 234 36514 1 . TYR 235 235 36514 1 . ARG 236 236 36514 1 . THR 237 237 36514 1 . LEU 238 238 36514 1 . LEU 239 239 36514 1 . GLU 240 240 36514 1 . LYS 241 241 36514 1 . ARG 242 242 36514 1 . ASP 243 243 36514 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 36514 _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 $entity_1 . 469008 organism . 'Escherichia coli BL21(DE3)' . . . Bacteria Pseudomonadati Escherichia coli . . . . . . . . . . . 'aqpZ, ECBD_2719' . 36514 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 36514 _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 $entity_1 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 Escherichia coli . . . . . . . . . . 36514 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_13C_15N_sample _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_sample _Sample.Entry_ID 36514 _Sample.ID 1 _Sample.Name . _Sample.Type membrane _Sample.Sub_type . _Sample.Details '29.4 % w/w [U-13C; U-15N] aquaporin Z, 5 mM Tris-Cl pH 8.0' _Sample.Aggregate_sample_number . _Sample.Solvent_system '5 mM Tris-Cl pH 8.0' _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 'aquaporin Z' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein 29.4 . . '% w/w' 2.4 . . . 36514 1 2 '5 mM Tris-Cl pH 8.0' 'natural abundance' . . . . . solvent 100 . . % . . . . 36514 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 36514 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details IM1 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' 1 0.1 M 36514 1 pH 8.0 0.1 pH 36514 1 pressure 1 0.1 atm 36514 1 temperature 298 1 K 36514 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 36514 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _Sample_condition_list.Details IM2 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' 1 0.1 M 36514 2 pH 8.0 0.1 pH 36514 2 pressure 1 0.1 atm 36514 2 temperature 298 1 K 36514 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36514 _Software.ID 1 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version 2.6 _Software.DOI . _Software.Details 'Sparky is a graphical NMR assignment and integration program for proteins, nucleic acids, and other polymers.' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'T. D. Goddard and D. G. Kneller' . . 36514 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36514 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36514 _Software.ID 2 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version 2.47 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 36514 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36514 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36514 _Software.ID 3 _Software.Type . _Software.Name TopSpin _Software.Version 3.6 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 36514 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 36514 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36514 _Software.ID 4 _Software.Type . _Software.Name NMRPipe _Software.Version 3.0 _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' . . 36514 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36514 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36514 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'A standard Bruker Advance 800 MHz spectrometer with a 3.2 mm E-free HCN MAS probe.' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list_1 _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list_1 _NMR_spectrometer_list.Entry_ID 36514 _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 NMR_spectrometer_1 Bruker 'AVANCE III' . 800 . . . 36514 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 36514 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D NCA' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 1 2 '2D DARR' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 1 3 '3D NCACX' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 1 4 '3D NCOCX' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 1 5 '3D CONCA' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 1 6 '2D 100ms CORD' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 1 7 '2D 500ms CORD' . . . . . . . . . . . . . 1 $13C_15N_sample isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36514 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 36514 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; 13C chemical shifts were referenced to adamantine, which was used as an external reference standard (40.48 ppm for methylene carbon) and 15N chemical shifts were indirectly referenced to liquid NH3 based on gyromagnetic ratios. ; 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 adamantane 'methylene carbons' . . . . ppm 40.48 external indirect 0.251449530 . . . . . 36514 1 N 15 'liquid anhydrous ammonia' nitrogen . . . . ppm 0.000 external indirect 0.101329118 . . . . . 36514 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36514 _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 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.5 _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 NCA' 1 $13C_15N_sample isotropic 36514 1 2 '2D DARR' 1 $13C_15N_sample isotropic 36514 1 3 '3D NCACX' 1 $13C_15N_sample isotropic 36514 1 4 '3D NCOCX' 1 $13C_15N_sample isotropic 36514 1 5 '3D CONCA' 1 $13C_15N_sample isotropic 36514 1 6 '2D 100ms CORD' 1 $13C_15N_sample isotropic 36514 1 7 '2D 500ms CORD' 1 $13C_15N_sample isotropic 36514 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 17 17 LEU C C 13 179.43 0.3 . 1 . . . . A 5 LEU C . 36514 1 2 . 1 . 1 17 17 LEU CA C 13 57.36 0.3 . 1 . . . . A 5 LEU CA . 36514 1 3 . 1 . 1 17 17 LEU CB C 13 41.86 0.3 . 1 . . . . A 5 LEU CB . 36514 1 4 . 1 . 1 17 17 LEU N N 15 116.49 0.5 . 1 . . . . A 5 LEU N . 36514 1 5 . 1 . 1 18 18 ALA C C 13 178.19 0.3 . 1 . . . . A 6 ALA C . 36514 1 6 . 1 . 1 18 18 ALA CA C 13 55.26 0.3 . 1 . . . . A 6 ALA CA . 36514 1 7 . 1 . 1 18 18 ALA CB C 13 17.29 0.3 . 1 . . . . A 6 ALA CB . 36514 1 8 . 1 . 1 18 18 ALA N N 15 120.81 0.5 . 1 . . . . A 6 ALA N . 36514 1 9 . 1 . 1 19 19 ALA C C 13 179.81 0.3 . 1 . . . . A 7 ALA C . 36514 1 10 . 1 . 1 19 19 ALA CA C 13 56.29 0.3 . 1 . . . . A 7 ALA CA . 36514 1 11 . 1 . 1 19 19 ALA CB C 13 17.55 0.3 . 1 . . . . A 7 ALA CB . 36514 1 12 . 1 . 1 19 19 ALA N N 15 120.36 0.5 . 1 . . . . A 7 ALA N . 36514 1 13 . 1 . 1 20 20 GLU C C 13 179.58 0.3 . 1 . . . . A 8 GLU C . 36514 1 14 . 1 . 1 20 20 GLU CA C 13 59.29 0.3 . 1 . . . . A 8 GLU CA . 36514 1 15 . 1 . 1 20 20 GLU CB C 13 30.66 0.3 . 1 . . . . A 8 GLU CB . 36514 1 16 . 1 . 1 20 20 GLU CG C 13 36.86 0.3 . 1 . . . . A 8 GLU CG . 36514 1 17 . 1 . 1 20 20 GLU CD C 13 181.96 0.3 . 1 . . . . A 8 GLU CD . 36514 1 18 . 1 . 1 20 20 GLU N N 15 116.27 0.5 . 1 . . . . A 8 GLU N . 36514 1 19 . 1 . 1 21 21 CYS C C 13 177.10 0.3 . 1 . . . . A 9 CYS C . 36514 1 20 . 1 . 1 21 21 CYS CA C 13 62.53 0.3 . 1 . . . . A 9 CYS CA . 36514 1 21 . 1 . 1 21 21 CYS CB C 13 27.36 0.3 . 1 . . . . A 9 CYS CB . 36514 1 22 . 1 . 1 21 21 CYS N N 15 123.76 0.5 . 1 . . . . A 9 CYS N . 36514 1 23 . 1 . 1 22 22 PHE C C 13 179.15 0.3 . 1 . . . . A 10 PHE C . 36514 1 24 . 1 . 1 22 22 PHE CA C 13 60.30 0.3 . 1 . . . . A 10 PHE CA . 36514 1 25 . 1 . 1 22 22 PHE CB C 13 38.18 0.3 . 1 . . . . A 10 PHE CB . 36514 1 26 . 1 . 1 22 22 PHE N N 15 116.63 0.5 . 1 . . . . A 10 PHE N . 36514 1 27 . 1 . 1 23 23 GLY C C 13 175.12 0.3 . 1 . . . . A 11 GLY C . 36514 1 28 . 1 . 1 23 23 GLY CA C 13 47.41 0.3 . 1 . . . . A 11 GLY CA . 36514 1 29 . 1 . 1 23 23 GLY N N 15 107.38 0.5 . 1 . . . . A 11 GLY N . 36514 1 30 . 1 . 1 26 26 TRP C C 13 174.80 0.3 . 1 . . . . A 14 TRP C . 36514 1 31 . 1 . 1 26 26 TRP CA C 13 59.48 0.3 . 1 . . . . A 14 TRP CA . 36514 1 32 . 1 . 1 26 26 TRP CB C 13 31.98 0.3 . 1 . . . . A 14 TRP CB . 36514 1 33 . 1 . 1 26 26 TRP N N 15 122.15 0.5 . 1 . . . . A 14 TRP N . 36514 1 34 . 1 . 1 27 27 LEU C C 13 179.23 0.3 . 1 . . . . A 15 LEU C . 36514 1 35 . 1 . 1 27 27 LEU CA C 13 58.27 0.3 . 1 . . . . A 15 LEU CA . 36514 1 36 . 1 . 1 27 27 LEU CB C 13 43.21 0.3 . 1 . . . . A 15 LEU CB . 36514 1 37 . 1 . 1 27 27 LEU CG C 13 28.25 0.3 . 1 . . . . A 15 LEU CG . 36514 1 38 . 1 . 1 27 27 LEU CD1 C 13 25.49 0.3 . . . . . . A 15 LEU CD1 . 36514 1 39 . 1 . 1 27 27 LEU CD2 C 13 24.34 0.3 . . . . . . A 15 LEU CD2 . 36514 1 40 . 1 . 1 27 27 LEU N N 15 120.69 0.5 . 1 . . . . A 15 LEU N . 36514 1 41 . 1 . 1 28 28 VAL C C 13 177.47 0.3 . 1 . . . . A 16 VAL C . 36514 1 42 . 1 . 1 28 28 VAL CA C 13 66.78 0.3 . 1 . . . . A 16 VAL CA . 36514 1 43 . 1 . 1 28 28 VAL CB C 13 31.56 0.3 . 1 . . . . A 16 VAL CB . 36514 1 44 . 1 . 1 28 28 VAL CG1 C 13 23.91 0.3 . . . . . . A 16 VAL CG1 . 36514 1 45 . 1 . 1 28 28 VAL CG2 C 13 19.87 0.3 . . . . . . A 16 VAL CG2 . 36514 1 46 . 1 . 1 28 28 VAL N N 15 118.68 0.5 . 1 . . . . A 16 VAL N . 36514 1 47 . 1 . 1 29 29 PHE C C 13 176.94 0.3 . 1 . . . . A 17 PHE C . 36514 1 48 . 1 . 1 29 29 PHE CA C 13 62.36 0.3 . 1 . . . . A 17 PHE CA . 36514 1 49 . 1 . 1 29 29 PHE CB C 13 40.02 0.3 . 1 . . . . A 17 PHE CB . 36514 1 50 . 1 . 1 29 29 PHE CD1 C 13 131.87 0.3 . . . . . . A 17 PHE CD1 . 36514 1 51 . 1 . 1 29 29 PHE N N 15 119.34 0.5 . 1 . . . . A 17 PHE N . 36514 1 52 . 1 . 1 30 30 GLY C C 13 175.35 0.3 . 1 . . . . A 18 GLY C . 36514 1 53 . 1 . 1 30 30 GLY CA C 13 45.91 0.3 . 1 . . . . A 18 GLY CA . 36514 1 54 . 1 . 1 30 30 GLY N N 15 101.27 0.5 . 1 . . . . A 18 GLY N . 36514 1 55 . 1 . 1 31 31 GLY C C 13 175.62 0.3 . 1 . . . . A 19 GLY C . 36514 1 56 . 1 . 1 31 31 GLY CA C 13 44.89 0.3 . 1 . . . . A 19 GLY CA . 36514 1 57 . 1 . 1 31 31 GLY N N 15 111.25 0.5 . 1 . . . . A 19 GLY N . 36514 1 58 . 1 . 1 32 32 CYS C C 13 176.78 0.3 . 1 . . . . A 20 CYS C . 36514 1 59 . 1 . 1 32 32 CYS CA C 13 62.23 0.3 . 1 . . . . A 20 CYS CA . 36514 1 60 . 1 . 1 32 32 CYS CB C 13 24.99 0.3 . 1 . . . . A 20 CYS CB . 36514 1 61 . 1 . 1 32 32 CYS N N 15 119.00 0.5 . 1 . . . . A 20 CYS N . 36514 1 62 . 1 . 1 33 33 GLY C C 13 175.26 0.3 . 1 . . . . A 21 GLY C . 36514 1 63 . 1 . 1 33 33 GLY CA C 13 47.81 0.3 . 1 . . . . A 21 GLY CA . 36514 1 64 . 1 . 1 33 33 GLY N N 15 107.59 0.5 . 1 . . . . A 21 GLY N . 36514 1 65 . 1 . 1 34 34 SER C C 13 176.56 0.3 . 1 . . . . A 22 SER C . 36514 1 66 . 1 . 1 34 34 SER CA C 13 62.66 0.3 . 1 . . . . A 22 SER CA . 36514 1 67 . 1 . 1 34 34 SER CB C 13 60.95 0.3 . 1 . . . . A 22 SER CB . 36514 1 68 . 1 . 1 34 34 SER N N 15 118.22 0.5 . 1 . . . . A 22 SER N . 36514 1 69 . 1 . 1 35 35 ALA C C 13 179.22 0.3 . 1 . . . . A 23 ALA C . 36514 1 70 . 1 . 1 35 35 ALA CA C 13 54.71 0.3 . 1 . . . . A 23 ALA CA . 36514 1 71 . 1 . 1 35 35 ALA CB C 13 18.48 0.3 . 1 . . . . A 23 ALA CB . 36514 1 72 . 1 . 1 35 35 ALA N N 15 125.73 0.5 . 1 . . . . A 23 ALA N . 36514 1 73 . 1 . 1 36 36 VAL C C 13 177.86 0.3 . 1 . . . . A 24 VAL C . 36514 1 74 . 1 . 1 36 36 VAL CA C 13 65.38 0.3 . 1 . . . . A 24 VAL CA . 36514 1 75 . 1 . 1 36 36 VAL CB C 13 33.60 0.3 . 1 . . . . A 24 VAL CB . 36514 1 76 . 1 . 1 36 36 VAL CG1 C 13 22.49 0.3 . . . . . . A 24 VAL CG1 . 36514 1 77 . 1 . 1 36 36 VAL CG2 C 13 20.98 0.3 . . . . . . A 24 VAL CG2 . 36514 1 78 . 1 . 1 36 36 VAL N N 15 117.61 0.5 . 1 . . . . A 24 VAL N . 36514 1 79 . 1 . 1 37 37 LEU C C 13 179.00 0.3 . 1 . . . . A 25 LEU C . 36514 1 80 . 1 . 1 37 37 LEU CA C 13 56.01 0.3 . 1 . . . . A 25 LEU CA . 36514 1 81 . 1 . 1 37 37 LEU CB C 13 41.42 0.3 . 1 . . . . A 25 LEU CB . 36514 1 82 . 1 . 1 37 37 LEU CG C 13 27.07 0.3 . 1 . . . . A 25 LEU CG . 36514 1 83 . 1 . 1 37 37 LEU CD1 C 13 24.42 0.3 . . . . . . A 25 LEU CD1 . 36514 1 84 . 1 . 1 37 37 LEU CD2 C 13 22.28 0.3 . . . . . . A 25 LEU CD2 . 36514 1 85 . 1 . 1 37 37 LEU N N 15 114.14 0.5 . 1 . . . . A 25 LEU N . 36514 1 86 . 1 . 1 38 38 ALA C C 13 180.46 0.3 . 1 . . . . A 26 ALA C . 36514 1 87 . 1 . 1 38 38 ALA CA C 13 53.21 0.3 . 1 . . . . A 26 ALA CA . 36514 1 88 . 1 . 1 38 38 ALA CB C 13 24.16 0.3 . 1 . . . . A 26 ALA CB . 36514 1 89 . 1 . 1 38 38 ALA N N 15 117.45 0.5 . 1 . . . . A 26 ALA N . 36514 1 90 . 1 . 1 39 39 ALA C C 13 178.60 0.3 . 1 . . . . A 27 ALA C . 36514 1 91 . 1 . 1 39 39 ALA CA C 13 55.93 0.3 . 1 . . . . A 27 ALA CA . 36514 1 92 . 1 . 1 39 39 ALA CB C 13 19.50 0.3 . 1 . . . . A 27 ALA CB . 36514 1 93 . 1 . 1 39 39 ALA N N 15 124.98 0.5 . 1 . . . . A 27 ALA N . 36514 1 94 . 1 . 1 40 40 GLY C C 13 173.80 0.3 . 1 . . . . A 28 GLY C . 36514 1 95 . 1 . 1 40 40 GLY CA C 13 44.20 0.3 . 1 . . . . A 28 GLY CA . 36514 1 96 . 1 . 1 40 40 GLY N N 15 102.65 0.5 . 1 . . . . A 28 GLY N . 36514 1 97 . 1 . 1 41 41 PHE C C 13 174.36 0.3 . 1 . . . . A 29 PHE C . 36514 1 98 . 1 . 1 41 41 PHE CA C 13 57.27 0.3 . 1 . . . . A 29 PHE CA . 36514 1 99 . 1 . 1 41 41 PHE CB C 13 40.14 0.3 . 1 . . . . A 29 PHE CB . 36514 1 100 . 1 . 1 41 41 PHE CG C 13 137.55 0.3 . 1 . . . . A 29 PHE CG . 36514 1 101 . 1 . 1 41 41 PHE CD1 C 13 131.25 0.3 . . . . . . A 29 PHE CD1 . 36514 1 102 . 1 . 1 41 41 PHE CD2 C 13 130.16 0.3 . . . . . . A 29 PHE CD2 . 36514 1 103 . 1 . 1 42 42 PRO C C 13 179.23 0.3 . 1 . . . . A 30 PRO C . 36514 1 104 . 1 . 1 42 42 PRO CA C 13 64.41 0.3 . 1 . . . . A 30 PRO CA . 36514 1 105 . 1 . 1 42 42 PRO CB C 13 31.62 0.3 . 1 . . . . A 30 PRO CB . 36514 1 106 . 1 . 1 42 42 PRO CG C 13 27.69 0.3 . 1 . . . . A 30 PRO CG . 36514 1 107 . 1 . 1 42 42 PRO CD C 13 50.43 0.3 . 1 . . . . A 30 PRO CD . 36514 1 108 . 1 . 1 42 42 PRO N N 15 145.09 0.5 . 1 . . . . A 30 PRO N . 36514 1 109 . 1 . 1 43 43 GLU C C 13 178.46 0.3 . 1 . . . . A 31 GLU C . 36514 1 110 . 1 . 1 43 43 GLU CA C 13 61.82 0.3 . 1 . . . . A 31 GLU CA . 36514 1 111 . 1 . 1 43 43 GLU CB C 13 29.00 0.3 . 1 . . . . A 31 GLU CB . 36514 1 112 . 1 . 1 43 43 GLU CG C 13 36.54 0.3 . 1 . . . . A 31 GLU CG . 36514 1 113 . 1 . 1 43 43 GLU N N 15 121.39 0.5 . 1 . . . . A 31 GLU N . 36514 1 114 . 1 . 1 44 44 LEU C C 13 177.07 0.3 . 1 . . . . A 32 LEU C . 36514 1 115 . 1 . 1 44 44 LEU CA C 13 54.12 0.3 . 1 . . . . A 32 LEU CA . 36514 1 116 . 1 . 1 44 44 LEU CB C 13 42.49 0.3 . 1 . . . . A 32 LEU CB . 36514 1 117 . 1 . 1 44 44 LEU CG C 13 27.25 0.3 . 1 . . . . A 32 LEU CG . 36514 1 118 . 1 . 1 44 44 LEU CD1 C 13 24.20 0.3 . . . . . . A 32 LEU CD1 . 36514 1 119 . 1 . 1 44 44 LEU CD2 C 13 22.24 0.3 . . . . . . A 32 LEU CD2 . 36514 1 120 . 1 . 1 44 44 LEU N N 15 121.38 0.5 . 1 . . . . A 32 LEU N . 36514 1 121 . 1 . 1 45 45 GLY C C 13 174.40 0.3 . 1 . . . . A 33 GLY C . 36514 1 122 . 1 . 1 45 45 GLY CA C 13 46.84 0.3 . 1 . . . . A 33 GLY CA . 36514 1 123 . 1 . 1 45 45 GLY N N 15 103.92 0.5 . 1 . . . . A 33 GLY N . 36514 1 124 . 1 . 1 46 46 ILE C C 13 177.50 0.3 . 1 . . . . A 34 ILE C . 36514 1 125 . 1 . 1 46 46 ILE CA C 13 63.07 0.3 . 1 . . . . A 34 ILE CA . 36514 1 126 . 1 . 1 46 46 ILE CB C 13 39.08 0.3 . 1 . . . . A 34 ILE CB . 36514 1 127 . 1 . 1 46 46 ILE CG1 C 13 25.54 0.3 . 1 . . . . A 34 ILE CG1 . 36514 1 128 . 1 . 1 46 46 ILE CG2 C 13 18.09 0.3 . 1 . . . . A 34 ILE CG2 . 36514 1 129 . 1 . 1 46 46 ILE CD1 C 13 15.01 0.3 . 1 . . . . A 34 ILE CD1 . 36514 1 130 . 1 . 1 46 46 ILE N N 15 109.51 0.5 . 1 . . . . A 34 ILE N . 36514 1 131 . 1 . 1 47 47 GLY C C 13 172.54 0.3 . 1 . . . . A 35 GLY C . 36514 1 132 . 1 . 1 47 47 GLY CA C 13 45.06 0.3 . 1 . . . . A 35 GLY CA . 36514 1 133 . 1 . 1 47 47 GLY N N 15 109.94 0.5 . 1 . . . . A 35 GLY N . 36514 1 134 . 1 . 1 48 48 PHE C C 13 179.61 0.3 . 1 . . . . A 36 PHE C . 36514 1 135 . 1 . 1 48 48 PHE CA C 13 56.34 0.3 . 1 . . . . A 36 PHE CA . 36514 1 136 . 1 . 1 48 48 PHE CB C 13 37.13 0.3 . 1 . . . . A 36 PHE CB . 36514 1 137 . 1 . 1 48 48 PHE N N 15 117.58 0.5 . 1 . . . . A 36 PHE N . 36514 1 138 . 1 . 1 49 49 ALA C C 13 178.75 0.3 . 1 . . . . A 37 ALA C . 36514 1 139 . 1 . 1 49 49 ALA CA C 13 55.78 0.3 . 1 . . . . A 37 ALA CA . 36514 1 140 . 1 . 1 49 49 ALA CB C 13 17.44 0.3 . 1 . . . . A 37 ALA CB . 36514 1 141 . 1 . 1 49 49 ALA N N 15 123.45 0.5 . 1 . . . . A 37 ALA N . 36514 1 142 . 1 . 1 52 52 ALA C C 13 176.39 0.3 . 1 . . . . A 40 ALA C . 36514 1 143 . 1 . 1 52 52 ALA CA C 13 55.08 0.3 . 1 . . . . A 40 ALA CA . 36514 1 144 . 1 . 1 52 52 ALA CB C 13 18.16 0.3 . 1 . . . . A 40 ALA CB . 36514 1 145 . 1 . 1 52 52 ALA N N 15 117.16 0.5 . 1 . . . . A 40 ALA N . 36514 1 146 . 1 . 1 53 53 LEU C C 13 176.89 0.3 . 1 . . . . A 41 LEU C . 36514 1 147 . 1 . 1 53 53 LEU CA C 13 57.69 0.3 . 1 . . . . A 41 LEU CA . 36514 1 148 . 1 . 1 53 53 LEU CB C 13 41.47 0.3 . 1 . . . . A 41 LEU CB . 36514 1 149 . 1 . 1 53 53 LEU CG C 13 26.61 0.3 . 1 . . . . A 41 LEU CG . 36514 1 150 . 1 . 1 53 53 LEU CD1 C 13 25.28 0.3 . . . . . . A 41 LEU CD1 . 36514 1 151 . 1 . 1 53 53 LEU CD2 C 13 22.68 0.3 . . . . . . A 41 LEU CD2 . 36514 1 152 . 1 . 1 53 53 LEU N N 15 120.84 0.5 . 1 . . . . A 41 LEU N . 36514 1 153 . 1 . 1 54 54 ALA C C 13 179.61 0.3 . 1 . . . . A 42 ALA C . 36514 1 154 . 1 . 1 54 54 ALA CA C 13 56.00 0.3 . 1 . . . . A 42 ALA CA . 36514 1 155 . 1 . 1 54 54 ALA CB C 13 18.27 0.3 . 1 . . . . A 42 ALA CB . 36514 1 156 . 1 . 1 54 54 ALA N N 15 121.51 0.5 . 1 . . . . A 42 ALA N . 36514 1 157 . 1 . 1 55 55 PHE C C 13 180.60 0.3 . 1 . . . . A 43 PHE C . 36514 1 158 . 1 . 1 55 55 PHE CA C 13 64.09 0.3 . 1 . . . . A 43 PHE CA . 36514 1 159 . 1 . 1 55 55 PHE CB C 13 39.03 0.3 . 1 . . . . A 43 PHE CB . 36514 1 160 . 1 . 1 55 55 PHE N N 15 112.74 0.5 . 1 . . . . A 43 PHE N . 36514 1 161 . 1 . 1 56 56 GLY C C 13 176.83 0.3 . 1 . . . . A 44 GLY C . 36514 1 162 . 1 . 1 56 56 GLY CA C 13 48.29 0.3 . 1 . . . . A 44 GLY CA . 36514 1 163 . 1 . 1 56 56 GLY N N 15 104.80 0.5 . 1 . . . . A 44 GLY N . 36514 1 164 . 1 . 1 57 57 LEU C C 13 181.75 0.3 . 1 . . . . A 45 LEU C . 36514 1 165 . 1 . 1 57 57 LEU CA C 13 57.44 0.3 . 1 . . . . A 45 LEU CA . 36514 1 166 . 1 . 1 57 57 LEU CB C 13 41.22 0.3 . 1 . . . . A 45 LEU CB . 36514 1 167 . 1 . 1 57 57 LEU CG C 13 25.93 0.3 . 1 . . . . A 45 LEU CG . 36514 1 168 . 1 . 1 57 57 LEU CD1 C 13 25.14 0.3 . . . . . . A 45 LEU CD1 . 36514 1 169 . 1 . 1 57 57 LEU CD2 C 13 23.14 0.3 . . . . . . A 45 LEU CD2 . 36514 1 170 . 1 . 1 57 57 LEU N N 15 117.40 0.5 . 1 . . . . A 45 LEU N . 36514 1 171 . 1 . 1 58 58 THR C C 13 175.81 0.3 . 1 . . . . A 46 THR C . 36514 1 172 . 1 . 1 58 58 THR CA C 13 65.92 0.3 . 1 . . . . A 46 THR CA . 36514 1 173 . 1 . 1 58 58 THR CB C 13 67.91 0.3 . 1 . . . . A 46 THR CB . 36514 1 174 . 1 . 1 58 58 THR CG2 C 13 23.95 0.3 . 1 . . . . A 46 THR CG2 . 36514 1 175 . 1 . 1 58 58 THR N N 15 117.02 0.5 . 1 . . . . A 46 THR N . 36514 1 176 . 1 . 1 59 59 VAL C C 13 176.50 0.3 . 1 . . . . A 47 VAL C . 36514 1 177 . 1 . 1 59 59 VAL CA C 13 66.01 0.3 . 1 . . . . A 47 VAL CA . 36514 1 178 . 1 . 1 59 59 VAL CB C 13 32.90 0.3 . 1 . . . . A 47 VAL CB . 36514 1 179 . 1 . 1 59 59 VAL CG1 C 13 25.76 0.3 . . . . . . A 47 VAL CG1 . 36514 1 180 . 1 . 1 59 59 VAL CG2 C 13 21.99 0.3 . . . . . . A 47 VAL CG2 . 36514 1 181 . 1 . 1 59 59 VAL N N 15 123.26 0.5 . 1 . . . . A 47 VAL N . 36514 1 182 . 1 . 1 60 60 LEU C C 13 178.90 0.3 . 1 . . . . A 48 LEU C . 36514 1 183 . 1 . 1 60 60 LEU CA C 13 59.78 0.3 . 1 . . . . A 48 LEU CA . 36514 1 184 . 1 . 1 60 60 LEU CB C 13 45.32 0.3 . 1 . . . . A 48 LEU CB . 36514 1 185 . 1 . 1 60 60 LEU CG C 13 28.58 0.3 . 1 . . . . A 48 LEU CG . 36514 1 186 . 1 . 1 60 60 LEU CD1 C 13 27.48 0.3 . . . . . . A 48 LEU CD1 . 36514 1 187 . 1 . 1 60 60 LEU CD2 C 13 25.63 0.3 . . . . . . A 48 LEU CD2 . 36514 1 188 . 1 . 1 60 60 LEU N N 15 120.59 0.5 . 1 . . . . A 48 LEU N . 36514 1 189 . 1 . 1 61 61 THR C C 13 177.38 0.3 . 1 . . . . A 49 THR C . 36514 1 190 . 1 . 1 61 61 THR CA C 13 65.72 0.3 . 1 . . . . A 49 THR CA . 36514 1 191 . 1 . 1 61 61 THR CB C 13 69.75 0.3 . 1 . . . . A 49 THR CB . 36514 1 192 . 1 . 1 61 61 THR CG2 C 13 23.86 0.3 . 1 . . . . A 49 THR CG2 . 36514 1 193 . 1 . 1 61 61 THR N N 15 105.68 0.5 . 1 . . . . A 49 THR N . 36514 1 194 . 1 . 1 62 62 MET C C 13 178.61 0.3 . 1 . . . . A 50 MET C . 36514 1 195 . 1 . 1 62 62 MET CA C 13 56.62 0.3 . 1 . . . . A 50 MET CA . 36514 1 196 . 1 . 1 62 62 MET CB C 13 31.38 0.3 . 1 . . . . A 50 MET CB . 36514 1 197 . 1 . 1 62 62 MET CE C 13 19.68 0.3 . 1 . . . . A 50 MET CE . 36514 1 198 . 1 . 1 62 62 MET N N 15 119.78 0.5 . 1 . . . . A 50 MET N . 36514 1 199 . 1 . 1 63 63 ALA C C 13 181.41 0.3 . 1 . . . . A 51 ALA C . 36514 1 200 . 1 . 1 63 63 ALA CA C 13 55.90 0.3 . 1 . . . . A 51 ALA CA . 36514 1 201 . 1 . 1 63 63 ALA CB C 13 16.45 0.3 . 1 . . . . A 51 ALA CB . 36514 1 202 . 1 . 1 63 63 ALA N N 15 124.61 0.5 . 1 . . . . A 51 ALA N . 36514 1 203 . 1 . 1 64 64 PHE C C 13 177.34 0.3 . 1 . . . . A 52 PHE C . 36514 1 204 . 1 . 1 64 64 PHE CA C 13 63.20 0.3 . 1 . . . . A 52 PHE CA . 36514 1 205 . 1 . 1 64 64 PHE CB C 13 39.75 0.3 . 1 . . . . A 52 PHE CB . 36514 1 206 . 1 . 1 64 64 PHE N N 15 116.41 0.5 . 1 . . . . A 52 PHE N . 36514 1 207 . 1 . 1 65 65 ALA C C 13 177.35 0.3 . 1 . . . . A 53 ALA C . 36514 1 208 . 1 . 1 65 65 ALA CA C 13 54.88 0.3 . 1 . . . . A 53 ALA CA . 36514 1 209 . 1 . 1 65 65 ALA CB C 13 22.47 0.3 . 1 . . . . A 53 ALA CB . 36514 1 210 . 1 . 1 65 65 ALA N N 15 118.34 0.5 . 1 . . . . A 53 ALA N . 36514 1 211 . 1 . 1 66 66 VAL C C 13 178.74 0.3 . 1 . . . . A 54 VAL C . 36514 1 212 . 1 . 1 66 66 VAL CA C 13 59.04 0.3 . 1 . . . . A 54 VAL CA . 36514 1 213 . 1 . 1 66 66 VAL CB C 13 33.89 0.3 . 1 . . . . A 54 VAL CB . 36514 1 214 . 1 . 1 66 66 VAL CG1 C 13 20.76 0.3 . . . . . . A 54 VAL CG1 . 36514 1 215 . 1 . 1 66 66 VAL CG2 C 13 18.60 0.3 . . . . . . A 54 VAL CG2 . 36514 1 216 . 1 . 1 66 66 VAL N N 15 100.60 0.5 . 1 . . . . A 54 VAL N . 36514 1 217 . 1 . 1 67 67 GLY C C 13 176.65 0.3 . 1 . . . . A 55 GLY C . 36514 1 218 . 1 . 1 67 67 GLY CA C 13 47.46 0.3 . 1 . . . . A 55 GLY CA . 36514 1 219 . 1 . 1 67 67 GLY N N 15 116.32 0.5 . 1 . . . . A 55 GLY N . 36514 1 220 . 1 . 1 68 68 HIS C C 13 176.55 0.3 . 1 . . . . A 56 HIS C . 36514 1 221 . 1 . 1 68 68 HIS CA C 13 56.90 0.3 . 1 . . . . A 56 HIS CA . 36514 1 222 . 1 . 1 68 68 HIS CB C 13 31.23 0.3 . 1 . . . . A 56 HIS CB . 36514 1 223 . 1 . 1 68 68 HIS N N 15 116.79 0.5 . 1 . . . . A 56 HIS N . 36514 1 224 . 1 . 1 68 68 HIS ND1 N 15 164.11 0.5 . 1 . . . . A 56 HIS ND1 . 36514 1 225 . 1 . 1 69 69 ILE C C 13 176.55 0.3 . 1 . . . . A 57 ILE C . 36514 1 226 . 1 . 1 69 69 ILE CA C 13 63.21 0.3 . 1 . . . . A 57 ILE CA . 36514 1 227 . 1 . 1 69 69 ILE CB C 13 38.27 0.3 . 1 . . . . A 57 ILE CB . 36514 1 228 . 1 . 1 69 69 ILE CG1 C 13 27.27 0.3 . 1 . . . . A 57 ILE CG1 . 36514 1 229 . 1 . 1 69 69 ILE CG2 C 13 17.38 0.3 . 1 . . . . A 57 ILE CG2 . 36514 1 230 . 1 . 1 69 69 ILE CD1 C 13 14.74 0.3 . 1 . . . . A 57 ILE CD1 . 36514 1 231 . 1 . 1 69 69 ILE N N 15 119.74 0.5 . 1 . . . . A 57 ILE N . 36514 1 232 . 1 . 1 70 70 SER C C 13 176.31 0.3 . 1 . . . . A 58 SER C . 36514 1 233 . 1 . 1 70 70 SER CA C 13 58.42 0.3 . 1 . . . . A 58 SER CA . 36514 1 234 . 1 . 1 70 70 SER CB C 13 67.14 0.3 . 1 . . . . A 58 SER CB . 36514 1 235 . 1 . 1 70 70 SER N N 15 107.15 0.5 . 1 . . . . A 58 SER N . 36514 1 236 . 1 . 1 71 71 GLY C C 13 174.80 0.3 . 1 . . . . A 59 GLY C . 36514 1 237 . 1 . 1 71 71 GLY CA C 13 45.03 0.3 . 1 . . . . A 59 GLY CA . 36514 1 238 . 1 . 1 71 71 GLY N N 15 114.93 0.5 . 1 . . . . A 59 GLY N . 36514 1 239 . 1 . 1 72 72 GLY C C 13 170.83 0.3 . 1 . . . . A 60 GLY C . 36514 1 240 . 1 . 1 72 72 GLY CA C 13 47.97 0.3 . 1 . . . . A 60 GLY CA . 36514 1 241 . 1 . 1 72 72 GLY N N 15 110.67 0.5 . 1 . . . . A 60 GLY N . 36514 1 242 . 1 . 1 73 73 HIS C C 13 175.89 0.3 . 1 . . . . A 61 HIS C . 36514 1 243 . 1 . 1 73 73 HIS CA C 13 56.96 0.3 . 1 . . . . A 61 HIS CA . 36514 1 244 . 1 . 1 73 73 HIS CB C 13 31.55 0.3 . 1 . . . . A 61 HIS CB . 36514 1 245 . 1 . 1 73 73 HIS CD2 C 13 112.77 0.3 . 1 . . . . A 61 HIS CD2 . 36514 1 246 . 1 . 1 73 73 HIS CE1 C 13 136.20 0.3 . 1 . . . . A 61 HIS CE1 . 36514 1 247 . 1 . 1 73 73 HIS N N 15 123.84 0.5 . 1 . . . . A 61 HIS N . 36514 1 248 . 1 . 1 74 74 PHE C C 13 176.47 0.3 . 1 . . . . A 62 PHE C . 36514 1 249 . 1 . 1 74 74 PHE CA C 13 54.84 0.3 . 1 . . . . A 62 PHE CA . 36514 1 250 . 1 . 1 74 74 PHE CB C 13 37.35 0.3 . 1 . . . . A 62 PHE CB . 36514 1 251 . 1 . 1 74 74 PHE N N 15 117.20 0.5 . 1 . . . . A 62 PHE N . 36514 1 252 . 1 . 1 75 75 ASN C C 13 174.91 0.3 . 1 . . . . A 63 ASN C . 36514 1 253 . 1 . 1 75 75 ASN CA C 13 51.36 0.3 . 1 . . . . A 63 ASN CA . 36514 1 254 . 1 . 1 75 75 ASN CB C 13 40.60 0.3 . 1 . . . . A 63 ASN CB . 36514 1 255 . 1 . 1 75 75 ASN CG C 13 178.11 0.3 . 1 . . . . A 63 ASN CG . 36514 1 256 . 1 . 1 75 75 ASN N N 15 106.91 0.5 . 1 . . . . A 63 ASN N . 36514 1 257 . 1 . 1 75 75 ASN ND2 N 15 113.54 0.5 . 1 . . . . A 63 ASN ND2 . 36514 1 258 . 1 . 1 76 76 PRO C C 13 177.83 0.3 . 1 . . . . A 64 PRO C . 36514 1 259 . 1 . 1 76 76 PRO CA C 13 64.98 0.3 . 1 . . . . A 64 PRO CA . 36514 1 260 . 1 . 1 76 76 PRO CB C 13 33.91 0.3 . 1 . . . . A 64 PRO CB . 36514 1 261 . 1 . 1 76 76 PRO CG C 13 26.41 0.3 . 1 . . . . A 64 PRO CG . 36514 1 262 . 1 . 1 76 76 PRO CD C 13 51.85 0.3 . 1 . . . . A 64 PRO CD . 36514 1 263 . 1 . 1 76 76 PRO N N 15 138.20 0.5 . 1 . . . . A 64 PRO N . 36514 1 264 . 1 . 1 77 77 ALA C C 13 180.41 0.3 . 1 . . . . A 65 ALA C . 36514 1 265 . 1 . 1 77 77 ALA CA C 13 54.25 0.3 . 1 . . . . A 65 ALA CA . 36514 1 266 . 1 . 1 77 77 ALA CB C 13 17.63 0.3 . 1 . . . . A 65 ALA CB . 36514 1 267 . 1 . 1 77 77 ALA N N 15 113.81 0.5 . 1 . . . . A 65 ALA N . 36514 1 268 . 1 . 1 78 78 VAL C C 13 176.57 0.3 . 1 . . . . A 66 VAL C . 36514 1 269 . 1 . 1 78 78 VAL CA C 13 64.41 0.3 . 1 . . . . A 66 VAL CA . 36514 1 270 . 1 . 1 78 78 VAL CB C 13 32.19 0.3 . 1 . . . . A 66 VAL CB . 36514 1 271 . 1 . 1 78 78 VAL CG1 C 13 23.10 0.3 . . . . . . A 66 VAL CG1 . 36514 1 272 . 1 . 1 78 78 VAL CG2 C 13 21.30 0.3 . . . . . . A 66 VAL CG2 . 36514 1 273 . 1 . 1 78 78 VAL N N 15 118.54 0.5 . 1 . . . . A 66 VAL N . 36514 1 274 . 1 . 1 79 79 THR C C 13 176.33 0.3 . 1 . . . . A 67 THR C . 36514 1 275 . 1 . 1 79 79 THR CA C 13 66.64 0.3 . 1 . . . . A 67 THR CA . 36514 1 276 . 1 . 1 79 79 THR CB C 13 69.25 0.3 . 1 . . . . A 67 THR CB . 36514 1 277 . 1 . 1 79 79 THR CG2 C 13 24.76 0.3 . 1 . . . . A 67 THR CG2 . 36514 1 278 . 1 . 1 79 79 THR N N 15 117.64 0.5 . 1 . . . . A 67 THR N . 36514 1 279 . 1 . 1 80 80 ILE C C 13 177.87 0.3 . 1 . . . . A 68 ILE C . 36514 1 280 . 1 . 1 80 80 ILE CA C 13 65.42 0.3 . 1 . . . . A 68 ILE CA . 36514 1 281 . 1 . 1 80 80 ILE CB C 13 38.04 0.3 . 1 . . . . A 68 ILE CB . 36514 1 282 . 1 . 1 80 80 ILE CG1 C 13 31.32 0.3 . 1 . . . . A 68 ILE CG1 . 36514 1 283 . 1 . 1 80 80 ILE CG2 C 13 18.34 0.3 . 1 . . . . A 68 ILE CG2 . 36514 1 284 . 1 . 1 80 80 ILE CD1 C 13 14.26 0.3 . 1 . . . . A 68 ILE CD1 . 36514 1 285 . 1 . 1 80 80 ILE N N 15 117.33 0.5 . 1 . . . . A 68 ILE N . 36514 1 286 . 1 . 1 81 81 GLY C C 13 175.69 0.3 . 1 . . . . A 69 GLY C . 36514 1 287 . 1 . 1 81 81 GLY CA C 13 47.83 0.3 . 1 . . . . A 69 GLY CA . 36514 1 288 . 1 . 1 81 81 GLY N N 15 110.56 0.5 . 1 . . . . A 69 GLY N . 36514 1 289 . 1 . 1 82 82 LEU C C 13 180.00 0.3 . 1 . . . . A 70 LEU C . 36514 1 290 . 1 . 1 82 82 LEU CA C 13 56.85 0.3 . 1 . . . . A 70 LEU CA . 36514 1 291 . 1 . 1 82 82 LEU CB C 13 42.23 0.3 . 1 . . . . A 70 LEU CB . 36514 1 292 . 1 . 1 82 82 LEU CG C 13 27.21 0.3 . 1 . . . . A 70 LEU CG . 36514 1 293 . 1 . 1 82 82 LEU CD1 C 13 25.73 0.3 . . . . . . A 70 LEU CD1 . 36514 1 294 . 1 . 1 82 82 LEU CD2 C 13 20.81 0.3 . . . . . . A 70 LEU CD2 . 36514 1 295 . 1 . 1 82 82 LEU N N 15 121.59 0.5 . 1 . . . . A 70 LEU N . 36514 1 296 . 1 . 1 83 83 TRP C C 13 179.84 0.3 . 1 . . . . A 71 TRP C . 36514 1 297 . 1 . 1 83 83 TRP CA C 13 60.51 0.3 . 1 . . . . A 71 TRP CA . 36514 1 298 . 1 . 1 83 83 TRP CB C 13 26.39 0.3 . 1 . . . . A 71 TRP CB . 36514 1 299 . 1 . 1 83 83 TRP N N 15 123.18 0.5 . 1 . . . . A 71 TRP N . 36514 1 300 . 1 . 1 84 84 ALA C C 13 178.03 0.3 . 1 . . . . A 72 ALA C . 36514 1 301 . 1 . 1 84 84 ALA CA C 13 54.64 0.3 . 1 . . . . A 72 ALA CA . 36514 1 302 . 1 . 1 84 84 ALA CB C 13 19.04 0.3 . 1 . . . . A 72 ALA CB . 36514 1 303 . 1 . 1 84 84 ALA N N 15 125.92 0.5 . 1 . . . . A 72 ALA N . 36514 1 304 . 1 . 1 85 85 GLY C C 13 175.71 0.3 . 1 . . . . A 73 GLY C . 36514 1 305 . 1 . 1 85 85 GLY CA C 13 45.21 0.3 . 1 . . . . A 73 GLY CA . 36514 1 306 . 1 . 1 85 85 GLY N N 15 102.60 0.5 . 1 . . . . A 73 GLY N . 36514 1 307 . 1 . 1 86 86 GLY C C 13 175.32 0.3 . 1 . . . . A 74 GLY C . 36514 1 308 . 1 . 1 86 86 GLY CA C 13 45.44 0.3 . 1 . . . . A 74 GLY CA . 36514 1 309 . 1 . 1 86 86 GLY N N 15 108.79 0.5 . 1 . . . . A 74 GLY N . 36514 1 310 . 1 . 1 87 87 ARG C C 13 175.72 0.3 . 1 . . . . A 75 ARG C . 36514 1 311 . 1 . 1 87 87 ARG CA C 13 54.01 0.3 . 1 . . . . A 75 ARG CA . 36514 1 312 . 1 . 1 87 87 ARG CB C 13 32.87 0.3 . 1 . . . . A 75 ARG CB . 36514 1 313 . 1 . 1 87 87 ARG CG C 13 25.76 0.3 . 1 . . . . A 75 ARG CG . 36514 1 314 . 1 . 1 87 87 ARG CD C 13 42.41 0.3 . 1 . . . . A 75 ARG CD . 36514 1 315 . 1 . 1 87 87 ARG N N 15 115.55 0.5 . 1 . . . . A 75 ARG N . 36514 1 316 . 1 . 1 87 87 ARG NE N 15 85.40 0.5 . 1 . . . . A 75 ARG NE . 36514 1 317 . 1 . 1 88 88 PHE C C 13 172.51 0.3 . 1 . . . . A 76 PHE C . 36514 1 318 . 1 . 1 88 88 PHE CA C 13 55.19 0.3 . 1 . . . . A 76 PHE CA . 36514 1 319 . 1 . 1 88 88 PHE CB C 13 38.22 0.3 . 1 . . . . A 76 PHE CB . 36514 1 320 . 1 . 1 88 88 PHE N N 15 122.97 0.5 . 1 . . . . A 76 PHE N . 36514 1 321 . 1 . 1 89 89 PRO C C 13 177.29 0.3 . 1 . . . . A 77 PRO C . 36514 1 322 . 1 . 1 89 89 PRO CA C 13 62.39 0.3 . 1 . . . . A 77 PRO CA . 36514 1 323 . 1 . 1 89 89 PRO CB C 13 32.29 0.3 . 1 . . . . A 77 PRO CB . 36514 1 324 . 1 . 1 89 89 PRO CG C 13 27.08 0.3 . 1 . . . . A 77 PRO CG . 36514 1 325 . 1 . 1 89 89 PRO CD C 13 50.76 0.3 . 1 . . . . A 77 PRO CD . 36514 1 326 . 1 . 1 89 89 PRO N N 15 142.36 0.5 . 1 . . . . A 77 PRO N . 36514 1 327 . 1 . 1 90 90 ALA C C 13 180.67 0.3 . 1 . . . . A 78 ALA C . 36514 1 328 . 1 . 1 90 90 ALA CA C 13 54.74 0.3 . 1 . . . . A 78 ALA CA . 36514 1 329 . 1 . 1 90 90 ALA CB C 13 18.83 0.3 . 1 . . . . A 78 ALA CB . 36514 1 330 . 1 . 1 90 90 ALA N N 15 126.66 0.5 . 1 . . . . A 78 ALA N . 36514 1 331 . 1 . 1 91 91 LYS C C 13 176.94 0.3 . 1 . . . . A 79 LYS C . 36514 1 332 . 1 . 1 91 91 LYS CA C 13 58.30 0.3 . 1 . . . . A 79 LYS CA . 36514 1 333 . 1 . 1 91 91 LYS CB C 13 31.84 0.3 . 1 . . . . A 79 LYS CB . 36514 1 334 . 1 . 1 91 91 LYS N N 15 112.07 0.5 . 1 . . . . A 79 LYS N . 36514 1 335 . 1 . 1 92 92 GLU C C 13 176.77 0.3 . 1 . . . . A 80 GLU C . 36514 1 336 . 1 . 1 92 92 GLU CA C 13 56.44 0.3 . 1 . . . . A 80 GLU CA . 36514 1 337 . 1 . 1 92 92 GLU CB C 13 31.26 0.3 . 1 . . . . A 80 GLU CB . 36514 1 338 . 1 . 1 92 92 GLU CG C 13 37.09 0.3 . 1 . . . . A 80 GLU CG . 36514 1 339 . 1 . 1 92 92 GLU CD C 13 179.66 0.3 . 1 . . . . A 80 GLU CD . 36514 1 340 . 1 . 1 92 92 GLU N N 15 116.88 0.5 . 1 . . . . A 80 GLU N . 36514 1 341 . 1 . 1 93 93 VAL C C 13 177.36 0.3 . 1 . . . . A 81 VAL C . 36514 1 342 . 1 . 1 93 93 VAL CA C 13 66.55 0.3 . 1 . . . . A 81 VAL CA . 36514 1 343 . 1 . 1 93 93 VAL CB C 13 32.16 0.3 . 1 . . . . A 81 VAL CB . 36514 1 344 . 1 . 1 93 93 VAL CG1 C 13 22.91 0.3 . . . . . . A 81 VAL CG1 . 36514 1 345 . 1 . 1 93 93 VAL CG2 C 13 21.05 0.3 . . . . . . A 81 VAL CG2 . 36514 1 346 . 1 . 1 93 93 VAL N N 15 119.65 0.5 . 1 . . . . A 81 VAL N . 36514 1 347 . 1 . 1 94 94 VAL C C 13 176.51 0.3 . 1 . . . . A 82 VAL C . 36514 1 348 . 1 . 1 94 94 VAL CA C 13 67.24 0.3 . 1 . . . . A 82 VAL CA . 36514 1 349 . 1 . 1 94 94 VAL CB C 13 31.74 0.3 . 1 . . . . A 82 VAL CB . 36514 1 350 . 1 . 1 94 94 VAL CG1 C 13 23.87 0.3 . . . . . . A 82 VAL CG1 . 36514 1 351 . 1 . 1 94 94 VAL CG2 C 13 21.53 0.3 . . . . . . A 82 VAL CG2 . 36514 1 352 . 1 . 1 94 94 VAL N N 15 118.59 0.5 . 1 . . . . A 82 VAL N . 36514 1 353 . 1 . 1 95 95 GLY C C 13 175.06 0.3 . 1 . . . . A 83 GLY C . 36514 1 354 . 1 . 1 95 95 GLY CA C 13 47.89 0.3 . 1 . . . . A 83 GLY CA . 36514 1 355 . 1 . 1 95 95 GLY N N 15 105.42 0.5 . 1 . . . . A 83 GLY N . 36514 1 356 . 1 . 1 96 96 TYR C C 13 179.17 0.3 . 1 . . . . A 84 TYR C . 36514 1 357 . 1 . 1 96 96 TYR CA C 13 62.94 0.3 . 1 . . . . A 84 TYR CA . 36514 1 358 . 1 . 1 96 96 TYR CB C 13 38.36 0.3 . 1 . . . . A 84 TYR CB . 36514 1 359 . 1 . 1 96 96 TYR N N 15 122.80 0.5 . 1 . . . . A 84 TYR N . 36514 1 360 . 1 . 1 97 97 VAL C C 13 179.19 0.3 . 1 . . . . A 85 VAL C . 36514 1 361 . 1 . 1 97 97 VAL CA C 13 65.73 0.3 . 1 . . . . A 85 VAL CA . 36514 1 362 . 1 . 1 97 97 VAL CB C 13 31.50 0.3 . 1 . . . . A 85 VAL CB . 36514 1 363 . 1 . 1 97 97 VAL CG1 C 13 22.49 0.3 . . . . . . A 85 VAL CG1 . 36514 1 364 . 1 . 1 97 97 VAL CG2 C 13 21.17 0.3 . . . . . . A 85 VAL CG2 . 36514 1 365 . 1 . 1 97 97 VAL N N 15 117.83 0.5 . 1 . . . . A 85 VAL N . 36514 1 366 . 1 . 1 98 98 ILE C C 13 180.35 0.3 . 1 . . . . A 86 ILE C . 36514 1 367 . 1 . 1 98 98 ILE CA C 13 64.71 0.3 . 1 . . . . A 86 ILE CA . 36514 1 368 . 1 . 1 98 98 ILE CB C 13 38.94 0.3 . 1 . . . . A 86 ILE CB . 36514 1 369 . 1 . 1 98 98 ILE CG1 C 13 29.09 0.3 . 1 . . . . A 86 ILE CG1 . 36514 1 370 . 1 . 1 98 98 ILE CG2 C 13 17.90 0.3 . 1 . . . . A 86 ILE CG2 . 36514 1 371 . 1 . 1 98 98 ILE CD1 C 13 16.25 0.3 . 1 . . . . A 86 ILE CD1 . 36514 1 372 . 1 . 1 98 98 ILE N N 15 119.33 0.5 . 1 . . . . A 86 ILE N . 36514 1 373 . 1 . 1 99 99 ALA C C 13 180.26 0.3 . 1 . . . . A 87 ALA C . 36514 1 374 . 1 . 1 99 99 ALA CA C 13 56.08 0.3 . 1 . . . . A 87 ALA CA . 36514 1 375 . 1 . 1 99 99 ALA CB C 13 19.46 0.3 . 1 . . . . A 87 ALA CB . 36514 1 376 . 1 . 1 99 99 ALA N N 15 124.64 0.5 . 1 . . . . A 87 ALA N . 36514 1 377 . 1 . 1 100 100 GLN C C 13 179.05 0.3 . 1 . . . . A 88 GLN C . 36514 1 378 . 1 . 1 100 100 GLN CA C 13 58.46 0.3 . 1 . . . . A 88 GLN CA . 36514 1 379 . 1 . 1 100 100 GLN CB C 13 27.47 0.3 . 1 . . . . A 88 GLN CB . 36514 1 380 . 1 . 1 100 100 GLN CG C 13 32.72 0.3 . 1 . . . . A 88 GLN CG . 36514 1 381 . 1 . 1 100 100 GLN CD C 13 177.13 0.3 . 1 . . . . A 88 GLN CD . 36514 1 382 . 1 . 1 100 100 GLN N N 15 116.86 0.5 . 1 . . . . A 88 GLN N . 36514 1 383 . 1 . 1 101 101 VAL C C 13 179.11 0.3 . 1 . . . . A 89 VAL C . 36514 1 384 . 1 . 1 101 101 VAL CA C 13 67.03 0.3 . 1 . . . . A 89 VAL CA . 36514 1 385 . 1 . 1 101 101 VAL CB C 13 31.92 0.3 . 1 . . . . A 89 VAL CB . 36514 1 386 . 1 . 1 101 101 VAL CG1 C 13 23.85 0.3 . . . . . . A 89 VAL CG1 . 36514 1 387 . 1 . 1 101 101 VAL CG2 C 13 21.77 0.3 . . . . . . A 89 VAL CG2 . 36514 1 388 . 1 . 1 101 101 VAL N N 15 118.97 0.5 . 1 . . . . A 89 VAL N . 36514 1 389 . 1 . 1 102 102 VAL C C 13 177.69 0.3 . 1 . . . . A 90 VAL C . 36514 1 390 . 1 . 1 102 102 VAL CA C 13 67.25 0.3 . 1 . . . . A 90 VAL CA . 36514 1 391 . 1 . 1 102 102 VAL CB C 13 31.76 0.3 . 1 . . . . A 90 VAL CB . 36514 1 392 . 1 . 1 102 102 VAL CG1 C 13 23.97 0.3 . . . . . . A 90 VAL CG1 . 36514 1 393 . 1 . 1 102 102 VAL CG2 C 13 21.47 0.3 . . . . . . A 90 VAL CG2 . 36514 1 394 . 1 . 1 102 102 VAL N N 15 118.90 0.5 . 1 . . . . A 90 VAL N . 36514 1 395 . 1 . 1 103 103 GLY C C 13 176.42 0.3 . 1 . . . . A 91 GLY C . 36514 1 396 . 1 . 1 103 103 GLY CA C 13 49.07 0.3 . 1 . . . . A 91 GLY CA . 36514 1 397 . 1 . 1 103 103 GLY N N 15 106.52 0.5 . 1 . . . . A 91 GLY N . 36514 1 398 . 1 . 1 107 107 ALA C C 13 181.47 0.3 . 1 . . . . A 95 ALA C . 36514 1 399 . 1 . 1 107 107 ALA CA C 13 54.82 0.3 . 1 . . . . A 95 ALA CA . 36514 1 400 . 1 . 1 107 107 ALA CB C 13 19.37 0.3 . 1 . . . . A 95 ALA CB . 36514 1 401 . 1 . 1 107 107 ALA N N 15 121.44 0.5 . 1 . . . . A 95 ALA N . 36514 1 402 . 1 . 1 108 108 ALA C C 13 178.11 0.3 . 1 . . . . A 96 ALA C . 36514 1 403 . 1 . 1 108 108 ALA CA C 13 55.03 0.3 . 1 . . . . A 96 ALA CA . 36514 1 404 . 1 . 1 108 108 ALA CB C 13 19.85 0.3 . 1 . . . . A 96 ALA CB . 36514 1 405 . 1 . 1 108 108 ALA N N 15 120.84 0.5 . 1 . . . . A 96 ALA N . 36514 1 406 . 1 . 1 109 109 ALA C C 13 179.50 0.3 . 1 . . . . A 97 ALA C . 36514 1 407 . 1 . 1 109 109 ALA CA C 13 55.33 0.3 . 1 . . . . A 97 ALA CA . 36514 1 408 . 1 . 1 109 109 ALA CB C 13 20.03 0.3 . 1 . . . . A 97 ALA CB . 36514 1 409 . 1 . 1 109 109 ALA N N 15 120.76 0.5 . 1 . . . . A 97 ALA N . 36514 1 410 . 1 . 1 110 110 LEU C C 13 176.16 0.3 . 1 . . . . A 98 LEU C . 36514 1 411 . 1 . 1 110 110 LEU CA C 13 57.33 0.3 . 1 . . . . A 98 LEU CA . 36514 1 412 . 1 . 1 110 110 LEU CB C 13 40.80 0.3 . 1 . . . . A 98 LEU CB . 36514 1 413 . 1 . 1 110 110 LEU CG C 13 26.55 0.3 . 1 . . . . A 98 LEU CG . 36514 1 414 . 1 . 1 110 110 LEU N N 15 120.69 0.5 . 1 . . . . A 98 LEU N . 36514 1 415 . 1 . 1 111 111 LEU C C 13 176.35 0.3 . 1 . . . . A 99 LEU C . 36514 1 416 . 1 . 1 111 111 LEU CA C 13 57.72 0.3 . 1 . . . . A 99 LEU CA . 36514 1 417 . 1 . 1 111 111 LEU CB C 13 38.52 0.3 . 1 . . . . A 99 LEU CB . 36514 1 418 . 1 . 1 111 111 LEU CG C 13 27.47 0.3 . 1 . . . . A 99 LEU CG . 36514 1 419 . 1 . 1 111 111 LEU N N 15 115.28 0.5 . 1 . . . . A 99 LEU N . 36514 1 420 . 1 . 1 112 112 TYR C C 13 178.47 0.3 . 1 . . . . A 100 TYR C . 36514 1 421 . 1 . 1 112 112 TYR CA C 13 57.63 0.3 . 1 . . . . A 100 TYR CA . 36514 1 422 . 1 . 1 112 112 TYR CB C 13 37.43 0.3 . 1 . . . . A 100 TYR CB . 36514 1 423 . 1 . 1 112 112 TYR N N 15 120.91 0.5 . 1 . . . . A 100 TYR N . 36514 1 424 . 1 . 1 113 113 LEU C C 13 179.24 0.3 . 1 . . . . A 101 LEU C . 36514 1 425 . 1 . 1 113 113 LEU CA C 13 58.40 0.3 . 1 . . . . A 101 LEU CA . 36514 1 426 . 1 . 1 113 113 LEU CB C 13 43.09 0.3 . 1 . . . . A 101 LEU CB . 36514 1 427 . 1 . 1 113 113 LEU CG C 13 28.24 0.3 . 1 . . . . A 101 LEU CG . 36514 1 428 . 1 . 1 113 113 LEU CD1 C 13 25.43 0.3 . . . . . . A 101 LEU CD1 . 36514 1 429 . 1 . 1 113 113 LEU CD2 C 13 24.57 0.3 . . . . . . A 101 LEU CD2 . 36514 1 430 . 1 . 1 113 113 LEU N N 15 120.69 0.5 . 1 . . . . A 101 LEU N . 36514 1 431 . 1 . 1 114 114 ILE C C 13 179.56 0.3 . 1 . . . . A 102 ILE C . 36514 1 432 . 1 . 1 114 114 ILE CA C 13 64.70 0.3 . 1 . . . . A 102 ILE CA . 36514 1 433 . 1 . 1 114 114 ILE CB C 13 39.06 0.3 . 1 . . . . A 102 ILE CB . 36514 1 434 . 1 . 1 114 114 ILE CG2 C 13 17.78 0.3 . 1 . . . . A 102 ILE CG2 . 36514 1 435 . 1 . 1 114 114 ILE CD1 C 13 16.15 0.3 . 1 . . . . A 102 ILE CD1 . 36514 1 436 . 1 . 1 114 114 ILE N N 15 119.49 0.5 . 1 . . . . A 102 ILE N . 36514 1 437 . 1 . 1 115 115 ALA C C 13 178.30 0.3 . 1 . . . . A 103 ALA C . 36514 1 438 . 1 . 1 115 115 ALA CA C 13 54.65 0.3 . 1 . . . . A 103 ALA CA . 36514 1 439 . 1 . 1 115 115 ALA CB C 13 16.54 0.3 . 1 . . . . A 103 ALA CB . 36514 1 440 . 1 . 1 115 115 ALA N N 15 124.37 0.5 . 1 . . . . A 103 ALA N . 36514 1 441 . 1 . 1 116 116 SER C C 13 173.88 0.3 . 1 . . . . A 104 SER C . 36514 1 442 . 1 . 1 116 116 SER CA C 13 60.21 0.3 . 1 . . . . A 104 SER CA . 36514 1 443 . 1 . 1 116 116 SER CB C 13 63.17 0.3 . 1 . . . . A 104 SER CB . 36514 1 444 . 1 . 1 116 116 SER N N 15 109.35 0.5 . 1 . . . . A 104 SER N . 36514 1 445 . 1 . 1 117 117 GLY C C 13 172.50 0.3 . 1 . . . . A 105 GLY C . 36514 1 446 . 1 . 1 117 117 GLY CA C 13 45.57 0.3 . 1 . . . . A 105 GLY CA . 36514 1 447 . 1 . 1 117 117 GLY N N 15 109.49 0.5 . 1 . . . . A 105 GLY N . 36514 1 448 . 1 . 1 118 118 LYS C C 13 175.48 0.3 . 1 . . . . A 106 LYS C . 36514 1 449 . 1 . 1 118 118 LYS CA C 13 54.08 0.3 . 1 . . . . A 106 LYS CA . 36514 1 450 . 1 . 1 118 118 LYS CB C 13 34.88 0.3 . 1 . . . . A 106 LYS CB . 36514 1 451 . 1 . 1 118 118 LYS CG C 13 24.14 0.3 . 1 . . . . A 106 LYS CG . 36514 1 452 . 1 . 1 118 118 LYS CD C 13 28.93 0.3 . 1 . . . . A 106 LYS CD . 36514 1 453 . 1 . 1 118 118 LYS CE C 13 42.43 0.3 . 1 . . . . A 106 LYS CE . 36514 1 454 . 1 . 1 118 118 LYS N N 15 122.04 0.5 . 1 . . . . A 106 LYS N . 36514 1 455 . 1 . 1 119 119 THR C C 13 175.86 0.3 . 1 . . . . A 107 THR C . 36514 1 456 . 1 . 1 119 119 THR CA C 13 64.58 0.3 . 1 . . . . A 107 THR CA . 36514 1 457 . 1 . 1 119 119 THR CB C 13 68.86 0.3 . 1 . . . . A 107 THR CB . 36514 1 458 . 1 . 1 119 119 THR CG2 C 13 21.91 0.3 . 1 . . . . A 107 THR CG2 . 36514 1 459 . 1 . 1 119 119 THR N N 15 123.07 0.5 . 1 . . . . A 107 THR N . 36514 1 460 . 1 . 1 120 120 GLY C C 13 174.44 0.3 . 1 . . . . A 108 GLY C . 36514 1 461 . 1 . 1 120 120 GLY CA C 13 45.09 0.3 . 1 . . . . A 108 GLY CA . 36514 1 462 . 1 . 1 120 120 GLY N N 15 116.98 0.5 . 1 . . . . A 108 GLY N . 36514 1 463 . 1 . 1 121 121 PHE C C 13 175.06 0.3 . 1 . . . . A 109 PHE C . 36514 1 464 . 1 . 1 121 121 PHE CA C 13 59.12 0.3 . 1 . . . . A 109 PHE CA . 36514 1 465 . 1 . 1 121 121 PHE CB C 13 39.79 0.3 . 1 . . . . A 109 PHE CB . 36514 1 466 . 1 . 1 121 121 PHE N N 15 121.73 0.5 . 1 . . . . A 109 PHE N . 36514 1 467 . 1 . 1 122 122 ASP C C 13 176.13 0.3 . 1 . . . . A 110 ASP C . 36514 1 468 . 1 . 1 122 122 ASP CA C 13 52.52 0.3 . 1 . . . . A 110 ASP CA . 36514 1 469 . 1 . 1 122 122 ASP CB C 13 42.47 0.3 . 1 . . . . A 110 ASP CB . 36514 1 470 . 1 . 1 122 122 ASP CG C 13 180.99 0.3 . 1 . . . . A 110 ASP CG . 36514 1 471 . 1 . 1 122 122 ASP N N 15 129.91 0.5 . 1 . . . . A 110 ASP N . 36514 1 472 . 1 . 1 123 123 ALA C C 13 178.09 0.3 . 1 . . . . A 111 ALA C . 36514 1 473 . 1 . 1 123 123 ALA CA C 13 55.24 0.3 . 1 . . . . A 111 ALA CA . 36514 1 474 . 1 . 1 123 123 ALA CB C 13 19.25 0.3 . 1 . . . . A 111 ALA CB . 36514 1 475 . 1 . 1 123 123 ALA N N 15 131.10 0.5 . 1 . . . . A 111 ALA N . 36514 1 476 . 1 . 1 124 124 ALA C C 13 181.44 0.3 . 1 . . . . A 112 ALA C . 36514 1 477 . 1 . 1 124 124 ALA CA C 13 54.59 0.3 . 1 . . . . A 112 ALA CA . 36514 1 478 . 1 . 1 124 124 ALA CB C 13 19.19 0.3 . 1 . . . . A 112 ALA CB . 36514 1 479 . 1 . 1 124 124 ALA N N 15 118.15 0.5 . 1 . . . . A 112 ALA N . 36514 1 480 . 1 . 1 125 125 ALA C C 13 179.73 0.3 . 1 . . . . A 113 ALA C . 36514 1 481 . 1 . 1 125 125 ALA CA C 13 54.20 0.3 . 1 . . . . A 113 ALA CA . 36514 1 482 . 1 . 1 125 125 ALA CB C 13 19.07 0.3 . 1 . . . . A 113 ALA CB . 36514 1 483 . 1 . 1 125 125 ALA N N 15 121.36 0.5 . 1 . . . . A 113 ALA N . 36514 1 484 . 1 . 1 126 126 SER C C 13 176.59 0.3 . 1 . . . . A 114 SER C . 36514 1 485 . 1 . 1 126 126 SER CA C 13 59.83 0.3 . 1 . . . . A 114 SER CA . 36514 1 486 . 1 . 1 126 126 SER CB C 13 64.52 0.3 . 1 . . . . A 114 SER CB . 36514 1 487 . 1 . 1 126 126 SER N N 15 109.36 0.5 . 1 . . . . A 114 SER N . 36514 1 488 . 1 . 1 127 127 GLY C C 13 173.68 0.3 . 1 . . . . A 115 GLY C . 36514 1 489 . 1 . 1 127 127 GLY CA C 13 45.96 0.3 . 1 . . . . A 115 GLY CA . 36514 1 490 . 1 . 1 127 127 GLY N N 15 112.16 0.5 . 1 . . . . A 115 GLY N . 36514 1 491 . 1 . 1 128 128 PHE C C 13 172.60 0.3 . 1 . . . . A 116 PHE C . 36514 1 492 . 1 . 1 128 128 PHE CA C 13 57.60 0.3 . 1 . . . . A 116 PHE CA . 36514 1 493 . 1 . 1 128 128 PHE CB C 13 38.82 0.3 . 1 . . . . A 116 PHE CB . 36514 1 494 . 1 . 1 128 128 PHE N N 15 124.26 0.5 . 1 . . . . A 116 PHE N . 36514 1 495 . 1 . 1 129 129 ALA C C 13 178.04 0.3 . 1 . . . . A 117 ALA C . 36514 1 496 . 1 . 1 129 129 ALA CA C 13 52.14 0.3 . 1 . . . . A 117 ALA CA . 36514 1 497 . 1 . 1 129 129 ALA CB C 13 16.99 0.3 . 1 . . . . A 117 ALA CB . 36514 1 498 . 1 . 1 129 129 ALA N N 15 108.42 0.5 . 1 . . . . A 117 ALA N . 36514 1 499 . 1 . 1 130 130 SER C C 13 175.38 0.3 . 1 . . . . A 118 SER C . 36514 1 500 . 1 . 1 130 130 SER CA C 13 61.16 0.3 . 1 . . . . A 118 SER CA . 36514 1 501 . 1 . 1 130 130 SER CB C 13 64.76 0.3 . 1 . . . . A 118 SER CB . 36514 1 502 . 1 . 1 130 130 SER N N 15 116.76 0.5 . 1 . . . . A 118 SER N . 36514 1 503 . 1 . 1 131 131 ASN C C 13 172.05 0.3 . 1 . . . . A 119 ASN C . 36514 1 504 . 1 . 1 131 131 ASN CA C 13 54.68 0.3 . 1 . . . . A 119 ASN CA . 36514 1 505 . 1 . 1 131 131 ASN CB C 13 38.26 0.3 . 1 . . . . A 119 ASN CB . 36514 1 506 . 1 . 1 131 131 ASN CG C 13 177.37 0.3 . 1 . . . . A 119 ASN CG . 36514 1 507 . 1 . 1 131 131 ASN N N 15 123.05 0.5 . 1 . . . . A 119 ASN N . 36514 1 508 . 1 . 1 132 132 GLY C C 13 170.08 0.3 . 1 . . . . A 120 GLY C . 36514 1 509 . 1 . 1 132 132 GLY CA C 13 45.43 0.3 . 1 . . . . A 120 GLY CA . 36514 1 510 . 1 . 1 132 132 GLY N N 15 107.61 0.5 . 1 . . . . A 120 GLY N . 36514 1 511 . 1 . 1 133 133 TYR C C 13 177.36 0.3 . 1 . . . . A 121 TYR C . 36514 1 512 . 1 . 1 133 133 TYR CA C 13 54.68 0.3 . 1 . . . . A 121 TYR CA . 36514 1 513 . 1 . 1 133 133 TYR CB C 13 43.40 0.3 . 1 . . . . A 121 TYR CB . 36514 1 514 . 1 . 1 133 133 TYR N N 15 111.72 0.5 . 1 . . . . A 121 TYR N . 36514 1 515 . 1 . 1 134 134 GLY C C 13 176.71 0.3 . 1 . . . . A 122 GLY C . 36514 1 516 . 1 . 1 134 134 GLY CA C 13 46.82 0.3 . 1 . . . . A 122 GLY CA . 36514 1 517 . 1 . 1 134 134 GLY N N 15 113.17 0.5 . 1 . . . . A 122 GLY N . 36514 1 518 . 1 . 1 135 135 GLU C C 13 176.60 0.3 . 1 . . . . A 123 GLU C . 36514 1 519 . 1 . 1 135 135 GLU CA C 13 57.72 0.3 . 1 . . . . A 123 GLU CA . 36514 1 520 . 1 . 1 135 135 GLU CB C 13 29.68 0.3 . 1 . . . . A 123 GLU CB . 36514 1 521 . 1 . 1 135 135 GLU CG C 13 35.57 0.3 . 1 . . . . A 123 GLU CG . 36514 1 522 . 1 . 1 135 135 GLU N N 15 126.29 0.5 . 1 . . . . A 123 GLU N . 36514 1 523 . 1 . 1 136 136 HIS C C 13 173.34 0.3 . 1 . . . . A 124 HIS C . 36514 1 524 . 1 . 1 136 136 HIS CA C 13 52.93 0.3 . 1 . . . . A 124 HIS CA . 36514 1 525 . 1 . 1 136 136 HIS CB C 13 26.81 0.3 . 1 . . . . A 124 HIS CB . 36514 1 526 . 1 . 1 136 136 HIS CG C 13 131.14 0.3 . 1 . . . . A 124 HIS CG . 36514 1 527 . 1 . 1 136 136 HIS CD2 C 13 118.98 0.3 . 1 . . . . A 124 HIS CD2 . 36514 1 528 . 1 . 1 136 136 HIS CE1 C 13 132.97 0.3 . 1 . . . . A 124 HIS CE1 . 36514 1 529 . 1 . 1 136 136 HIS N N 15 112.73 0.5 . 1 . . . . A 124 HIS N . 36514 1 530 . 1 . 1 136 136 HIS ND1 N 15 171.34 0.5 . 1 . . . . A 124 HIS ND1 . 36514 1 531 . 1 . 1 137 137 SER C C 13 176.17 0.3 . 1 . . . . A 125 SER C . 36514 1 532 . 1 . 1 137 137 SER CA C 13 54.14 0.3 . 1 . . . . A 125 SER CA . 36514 1 533 . 1 . 1 137 137 SER CB C 13 64.29 0.3 . 1 . . . . A 125 SER CB . 36514 1 534 . 1 . 1 137 137 SER N N 15 114.10 0.5 . 1 . . . . A 125 SER N . 36514 1 535 . 1 . 1 138 138 PRO C C 13 177.77 0.3 . 1 . . . . A 126 PRO C . 36514 1 536 . 1 . 1 138 138 PRO CA C 13 65.57 0.3 . 1 . . . . A 126 PRO CA . 36514 1 537 . 1 . 1 138 138 PRO CB C 13 31.93 0.3 . 1 . . . . A 126 PRO CB . 36514 1 538 . 1 . 1 138 138 PRO CG C 13 27.35 0.3 . 1 . . . . A 126 PRO CG . 36514 1 539 . 1 . 1 138 138 PRO CD C 13 50.67 0.3 . 1 . . . . A 126 PRO CD . 36514 1 540 . 1 . 1 138 138 PRO N N 15 144.19 0.5 . 1 . . . . A 126 PRO N . 36514 1 541 . 1 . 1 139 139 GLY C C 13 173.66 0.3 . 1 . . . . A 127 GLY C . 36514 1 542 . 1 . 1 139 139 GLY CA C 13 44.95 0.3 . 1 . . . . A 127 GLY CA . 36514 1 543 . 1 . 1 139 139 GLY N N 15 102.33 0.5 . 1 . . . . A 127 GLY N . 36514 1 544 . 1 . 1 140 140 GLY C C 13 175.20 0.3 . 1 . . . . A 128 GLY C . 36514 1 545 . 1 . 1 140 140 GLY CA C 13 46.26 0.3 . 1 . . . . A 128 GLY CA . 36514 1 546 . 1 . 1 140 140 GLY N N 15 108.56 0.5 . 1 . . . . A 128 GLY N . 36514 1 547 . 1 . 1 141 141 TYR C C 13 176.11 0.3 . 1 . . . . A 129 TYR C . 36514 1 548 . 1 . 1 141 141 TYR CA C 13 59.46 0.3 . 1 . . . . A 129 TYR CA . 36514 1 549 . 1 . 1 141 141 TYR CB C 13 40.26 0.3 . 1 . . . . A 129 TYR CB . 36514 1 550 . 1 . 1 141 141 TYR CG C 13 123.20 0.3 . 1 . . . . A 129 TYR CG . 36514 1 551 . 1 . 1 141 141 TYR CD1 C 13 128.87 0.3 . . . . . . A 129 TYR CD1 . 36514 1 552 . 1 . 1 141 141 TYR CD2 C 13 128.87 0.3 . . . . . . A 129 TYR CD2 . 36514 1 553 . 1 . 1 141 141 TYR CE1 C 13 117.06 0.3 . . . . . . A 129 TYR CE1 . 36514 1 554 . 1 . 1 141 141 TYR CE2 C 13 117.06 0.3 . . . . . . A 129 TYR CE2 . 36514 1 555 . 1 . 1 141 141 TYR N N 15 117.51 0.5 . 1 . . . . A 129 TYR N . 36514 1 556 . 1 . 1 142 142 SER C C 13 174.43 0.3 . 1 . . . . A 130 SER C . 36514 1 557 . 1 . 1 142 142 SER CA C 13 57.07 0.3 . 1 . . . . A 130 SER CA . 36514 1 558 . 1 . 1 142 142 SER CB C 13 65.88 0.3 . 1 . . . . A 130 SER CB . 36514 1 559 . 1 . 1 142 142 SER N N 15 114.70 0.5 . 1 . . . . A 130 SER N . 36514 1 560 . 1 . 1 143 143 MET C C 13 177.77 0.3 . 1 . . . . A 131 MET C . 36514 1 561 . 1 . 1 143 143 MET CA C 13 59.62 0.3 . 1 . . . . A 131 MET CA . 36514 1 562 . 1 . 1 143 143 MET CB C 13 32.53 0.3 . 1 . . . . A 131 MET CB . 36514 1 563 . 1 . 1 143 143 MET N N 15 120.59 0.5 . 1 . . . . A 131 MET N . 36514 1 564 . 1 . 1 144 144 LEU C C 13 178.40 0.3 . 1 . . . . A 132 LEU C . 36514 1 565 . 1 . 1 144 144 LEU CA C 13 58.30 0.3 . 1 . . . . A 132 LEU CA . 36514 1 566 . 1 . 1 144 144 LEU CB C 13 41.07 0.3 . 1 . . . . A 132 LEU CB . 36514 1 567 . 1 . 1 144 144 LEU CG C 13 27.19 0.3 . 1 . . . . A 132 LEU CG . 36514 1 568 . 1 . 1 144 144 LEU CD1 C 13 23.62 0.3 . . . . . . A 132 LEU CD1 . 36514 1 569 . 1 . 1 144 144 LEU CD2 C 13 22.24 0.3 . . . . . . A 132 LEU CD2 . 36514 1 570 . 1 . 1 144 144 LEU N N 15 119.25 0.5 . 1 . . . . A 132 LEU N . 36514 1 571 . 1 . 1 145 145 SER C C 13 175.36 0.3 . 1 . . . . A 133 SER C . 36514 1 572 . 1 . 1 145 145 SER CA C 13 64.54 0.3 . 1 . . . . A 133 SER CA . 36514 1 573 . 1 . 1 145 145 SER CB C 13 62.47 0.3 . 1 . . . . A 133 SER CB . 36514 1 574 . 1 . 1 145 145 SER N N 15 116.24 0.5 . 1 . . . . A 133 SER N . 36514 1 575 . 1 . 1 146 146 ALA C C 13 177.88 0.3 . 1 . . . . A 134 ALA C . 36514 1 576 . 1 . 1 146 146 ALA CA C 13 54.55 0.3 . 1 . . . . A 134 ALA CA . 36514 1 577 . 1 . 1 146 146 ALA CB C 13 20.21 0.3 . 1 . . . . A 134 ALA CB . 36514 1 578 . 1 . 1 146 146 ALA N N 15 123.31 0.5 . 1 . . . . A 134 ALA N . 36514 1 579 . 1 . 1 147 147 LEU C C 13 177.70 0.3 . 1 . . . . A 135 LEU C . 36514 1 580 . 1 . 1 147 147 LEU CA C 13 58.44 0.3 . 1 . . . . A 135 LEU CA . 36514 1 581 . 1 . 1 147 147 LEU CB C 13 42.05 0.3 . 1 . . . . A 135 LEU CB . 36514 1 582 . 1 . 1 147 147 LEU CG C 13 27.41 0.3 . 1 . . . . A 135 LEU CG . 36514 1 583 . 1 . 1 147 147 LEU CD1 C 13 26.15 0.3 . . . . . . A 135 LEU CD1 . 36514 1 584 . 1 . 1 147 147 LEU CD2 C 13 23.08 0.3 . . . . . . A 135 LEU CD2 . 36514 1 585 . 1 . 1 147 147 LEU N N 15 119.06 0.5 . 1 . . . . A 135 LEU N . 36514 1 586 . 1 . 1 148 148 VAL C C 13 177.73 0.3 . 1 . . . . A 136 VAL C . 36514 1 587 . 1 . 1 148 148 VAL CA C 13 67.39 0.3 . 1 . . . . A 136 VAL CA . 36514 1 588 . 1 . 1 148 148 VAL CB C 13 31.31 0.3 . 1 . . . . A 136 VAL CB . 36514 1 589 . 1 . 1 148 148 VAL CG1 C 13 22.90 0.3 . . . . . . A 136 VAL CG1 . 36514 1 590 . 1 . 1 148 148 VAL CG2 C 13 21.06 0.3 . . . . . . A 136 VAL CG2 . 36514 1 591 . 1 . 1 148 148 VAL N N 15 115.73 0.5 . 1 . . . . A 136 VAL N . 36514 1 592 . 1 . 1 149 149 VAL C C 13 176.52 0.3 . 1 . . . . A 137 VAL C . 36514 1 593 . 1 . 1 149 149 VAL CA C 13 66.41 0.3 . 1 . . . . A 137 VAL CA . 36514 1 594 . 1 . 1 149 149 VAL CB C 13 31.26 0.3 . 1 . . . . A 137 VAL CB . 36514 1 595 . 1 . 1 149 149 VAL CG1 C 13 23.78 0.3 . . . . . . A 137 VAL CG1 . 36514 1 596 . 1 . 1 149 149 VAL CG2 C 13 21.51 0.3 . . . . . . A 137 VAL CG2 . 36514 1 597 . 1 . 1 149 149 VAL N N 15 118.58 0.5 . 1 . . . . A 137 VAL N . 36514 1 598 . 1 . 1 150 150 GLU C C 13 180.31 0.3 . 1 . . . . A 138 GLU C . 36514 1 599 . 1 . 1 150 150 GLU CA C 13 59.96 0.3 . 1 . . . . A 138 GLU CA . 36514 1 600 . 1 . 1 150 150 GLU CB C 13 29.20 0.3 . 1 . . . . A 138 GLU CB . 36514 1 601 . 1 . 1 150 150 GLU CG C 13 38.28 0.3 . 1 . . . . A 138 GLU CG . 36514 1 602 . 1 . 1 150 150 GLU N N 15 120.85 0.5 . 1 . . . . A 138 GLU N . 36514 1 603 . 1 . 1 151 151 LEU C C 13 178.26 0.3 . 1 . . . . A 139 LEU C . 36514 1 604 . 1 . 1 151 151 LEU CA C 13 58.84 0.3 . 1 . . . . A 139 LEU CA . 36514 1 605 . 1 . 1 151 151 LEU CB C 13 43.45 0.3 . 1 . . . . A 139 LEU CB . 36514 1 606 . 1 . 1 151 151 LEU CG C 13 27.59 0.3 . 1 . . . . A 139 LEU CG . 36514 1 607 . 1 . 1 151 151 LEU CD1 C 13 25.85 0.3 . . . . . . A 139 LEU CD1 . 36514 1 608 . 1 . 1 151 151 LEU CD2 C 13 22.37 0.3 . . . . . . A 139 LEU CD2 . 36514 1 609 . 1 . 1 151 151 LEU N N 15 122.81 0.5 . 1 . . . . A 139 LEU N . 36514 1 610 . 1 . 1 152 152 VAL C C 13 178.47 0.3 . 1 . . . . A 140 VAL C . 36514 1 611 . 1 . 1 152 152 VAL CA C 13 66.26 0.3 . 1 . . . . A 140 VAL CA . 36514 1 612 . 1 . 1 152 152 VAL CB C 13 31.72 0.3 . 1 . . . . A 140 VAL CB . 36514 1 613 . 1 . 1 152 152 VAL N N 15 115.89 0.5 . 1 . . . . A 140 VAL N . 36514 1 614 . 1 . 1 153 153 LEU C C 13 179.01 0.3 . 1 . . . . A 141 LEU C . 36514 1 615 . 1 . 1 153 153 LEU CA C 13 57.57 0.3 . 1 . . . . A 141 LEU CA . 36514 1 616 . 1 . 1 153 153 LEU CB C 13 39.56 0.3 . 1 . . . . A 141 LEU CB . 36514 1 617 . 1 . 1 153 153 LEU CG C 13 28.08 0.3 . 1 . . . . A 141 LEU CG . 36514 1 618 . 1 . 1 153 153 LEU CD1 C 13 26.18 0.3 . . . . . . A 141 LEU CD1 . 36514 1 619 . 1 . 1 153 153 LEU CD2 C 13 22.48 0.3 . . . . . . A 141 LEU CD2 . 36514 1 620 . 1 . 1 153 153 LEU N N 15 114.80 0.5 . 1 . . . . A 141 LEU N . 36514 1 621 . 1 . 1 154 154 SER C C 13 175.85 0.3 . 1 . . . . A 142 SER C . 36514 1 622 . 1 . 1 154 154 SER CA C 13 63.29 0.3 . 1 . . . . A 142 SER CA . 36514 1 623 . 1 . 1 154 154 SER CB C 13 62.30 0.3 . 1 . . . . A 142 SER CB . 36514 1 624 . 1 . 1 154 154 SER N N 15 117.13 0.5 . 1 . . . . A 142 SER N . 36514 1 625 . 1 . 1 155 155 ALA C C 13 180.62 0.3 . 1 . . . . A 143 ALA C . 36514 1 626 . 1 . 1 155 155 ALA CA C 13 55.29 0.3 . 1 . . . . A 143 ALA CA . 36514 1 627 . 1 . 1 155 155 ALA CB C 13 18.16 0.3 . 1 . . . . A 143 ALA CB . 36514 1 628 . 1 . 1 155 155 ALA N N 15 123.70 0.5 . 1 . . . . A 143 ALA N . 36514 1 629 . 1 . 1 156 156 GLY C C 13 174.73 0.3 . 1 . . . . A 144 GLY C . 36514 1 630 . 1 . 1 156 156 GLY CA C 13 47.06 0.3 . 1 . . . . A 144 GLY CA . 36514 1 631 . 1 . 1 156 156 GLY N N 15 105.26 0.5 . 1 . . . . A 144 GLY N . 36514 1 632 . 1 . 1 157 157 PHE C C 13 177.46 0.3 . 1 . . . . A 145 PHE C . 36514 1 633 . 1 . 1 157 157 PHE CA C 13 58.28 0.3 . 1 . . . . A 145 PHE CA . 36514 1 634 . 1 . 1 157 157 PHE CB C 13 38.60 0.3 . 1 . . . . A 145 PHE CB . 36514 1 635 . 1 . 1 157 157 PHE N N 15 121.29 0.5 . 1 . . . . A 145 PHE N . 36514 1 636 . 1 . 1 158 158 LEU C C 13 181.04 0.3 . 1 . . . . A 146 LEU C . 36514 1 637 . 1 . 1 158 158 LEU CA C 13 53.75 0.3 . 1 . . . . A 146 LEU CA . 36514 1 638 . 1 . 1 158 158 LEU CB C 13 40.24 0.3 . 1 . . . . A 146 LEU CB . 36514 1 639 . 1 . 1 158 158 LEU CG C 13 28.03 0.3 . 1 . . . . A 146 LEU CG . 36514 1 640 . 1 . 1 158 158 LEU CD1 C 13 23.57 0.3 . . . . . . A 146 LEU CD1 . 36514 1 641 . 1 . 1 158 158 LEU CD2 C 13 20.43 0.3 . . . . . . A 146 LEU CD2 . 36514 1 642 . 1 . 1 158 158 LEU N N 15 119.18 0.5 . 1 . . . . A 146 LEU N . 36514 1 643 . 1 . 1 159 159 LEU C C 13 178.49 0.3 . 1 . . . . A 147 LEU C . 36514 1 644 . 1 . 1 159 159 LEU CA C 13 60.20 0.3 . 1 . . . . A 147 LEU CA . 36514 1 645 . 1 . 1 159 159 LEU CB C 13 42.05 0.3 . 1 . . . . A 147 LEU CB . 36514 1 646 . 1 . 1 159 159 LEU CG C 13 28.61 0.3 . 1 . . . . A 147 LEU CG . 36514 1 647 . 1 . 1 159 159 LEU CD1 C 13 26.15 0.3 . . . . . . A 147 LEU CD1 . 36514 1 648 . 1 . 1 159 159 LEU CD2 C 13 22.50 0.3 . . . . . . A 147 LEU CD2 . 36514 1 649 . 1 . 1 159 159 LEU N N 15 127.32 0.5 . 1 . . . . A 147 LEU N . 36514 1 650 . 1 . 1 160 160 VAL C C 13 177.45 0.3 . 1 . . . . A 148 VAL C . 36514 1 651 . 1 . 1 160 160 VAL CA C 13 65.58 0.3 . 1 . . . . A 148 VAL CA . 36514 1 652 . 1 . 1 160 160 VAL CB C 13 31.06 0.3 . 1 . . . . A 148 VAL CB . 36514 1 653 . 1 . 1 160 160 VAL CG1 C 13 22.31 0.3 . . . . . . A 148 VAL CG1 . 36514 1 654 . 1 . 1 160 160 VAL CG2 C 13 21.17 0.3 . . . . . . A 148 VAL CG2 . 36514 1 655 . 1 . 1 160 160 VAL N N 15 119.66 0.5 . 1 . . . . A 148 VAL N . 36514 1 656 . 1 . 1 161 161 ILE C C 13 178.99 0.3 . 1 . . . . A 149 ILE C . 36514 1 657 . 1 . 1 161 161 ILE CA C 13 65.80 0.3 . 1 . . . . A 149 ILE CA . 36514 1 658 . 1 . 1 161 161 ILE CB C 13 38.41 0.3 . 1 . . . . A 149 ILE CB . 36514 1 659 . 1 . 1 161 161 ILE CD1 C 13 14.04 0.3 . 1 . . . . A 149 ILE CD1 . 36514 1 660 . 1 . 1 161 161 ILE N N 15 118.68 0.5 . 1 . . . . A 149 ILE N . 36514 1 661 . 1 . 1 162 162 HIS C C 13 178.39 0.3 . 1 . . . . A 150 HIS C . 36514 1 662 . 1 . 1 162 162 HIS CA C 13 61.66 0.3 . 1 . . . . A 150 HIS CA . 36514 1 663 . 1 . 1 162 162 HIS CB C 13 28.50 0.3 . 1 . . . . A 150 HIS CB . 36514 1 664 . 1 . 1 162 162 HIS CG C 13 129.58 0.3 . 1 . . . . A 150 HIS CG . 36514 1 665 . 1 . 1 162 162 HIS CE1 C 13 137.71 0.3 . 1 . . . . A 150 HIS CE1 . 36514 1 666 . 1 . 1 162 162 HIS N N 15 118.37 0.5 . 1 . . . . A 150 HIS N . 36514 1 667 . 1 . 1 162 162 HIS ND1 N 15 161.40 0.5 . 1 . . . . A 150 HIS ND1 . 36514 1 668 . 1 . 1 163 163 GLY C C 13 175.95 0.3 . 1 . . . . A 151 GLY C . 36514 1 669 . 1 . 1 163 163 GLY CA C 13 48.87 0.3 . 1 . . . . A 151 GLY CA . 36514 1 670 . 1 . 1 163 163 GLY N N 15 108.41 0.5 . 1 . . . . A 151 GLY N . 36514 1 671 . 1 . 1 164 164 ALA C C 13 178.04 0.3 . 1 . . . . A 152 ALA C . 36514 1 672 . 1 . 1 164 164 ALA CA C 13 53.41 0.3 . 1 . . . . A 152 ALA CA . 36514 1 673 . 1 . 1 164 164 ALA CB C 13 17.95 0.3 . 1 . . . . A 152 ALA CB . 36514 1 674 . 1 . 1 164 164 ALA N N 15 119.32 0.5 . 1 . . . . A 152 ALA N . 36514 1 675 . 1 . 1 165 165 THR C C 13 173.95 0.3 . 1 . . . . A 153 THR C . 36514 1 676 . 1 . 1 165 165 THR CA C 13 60.36 0.3 . 1 . . . . A 153 THR CA . 36514 1 677 . 1 . 1 165 165 THR CB C 13 69.20 0.3 . 1 . . . . A 153 THR CB . 36514 1 678 . 1 . 1 165 165 THR CG2 C 13 21.35 0.3 . 1 . . . . A 153 THR CG2 . 36514 1 679 . 1 . 1 165 165 THR N N 15 102.27 0.5 . 1 . . . . A 153 THR N . 36514 1 680 . 1 . 1 166 166 ASP C C 13 177.14 0.3 . 1 . . . . A 154 ASP C . 36514 1 681 . 1 . 1 166 166 ASP CA C 13 54.28 0.3 . 1 . . . . A 154 ASP CA . 36514 1 682 . 1 . 1 166 166 ASP CB C 13 42.74 0.3 . 1 . . . . A 154 ASP CB . 36514 1 683 . 1 . 1 166 166 ASP CG C 13 180.01 0.3 . 1 . . . . A 154 ASP CG . 36514 1 684 . 1 . 1 166 166 ASP N N 15 126.92 0.5 . 1 . . . . A 154 ASP N . 36514 1 685 . 1 . 1 167 167 LYS C C 13 175.99 0.3 . 1 . . . . A 155 LYS C . 36514 1 686 . 1 . 1 167 167 LYS CA C 13 57.77 0.3 . 1 . . . . A 155 LYS CA . 36514 1 687 . 1 . 1 167 167 LYS CB C 13 29.10 0.3 . 1 . . . . A 155 LYS CB . 36514 1 688 . 1 . 1 167 167 LYS CD C 13 29.10 0.3 . 1 . . . . A 155 LYS CD . 36514 1 689 . 1 . 1 167 167 LYS CE C 13 41.31 0.3 . 1 . . . . A 155 LYS CE . 36514 1 690 . 1 . 1 167 167 LYS N N 15 128.80 0.5 . 1 . . . . A 155 LYS N . 36514 1 691 . 1 . 1 168 168 PHE C C 13 175.50 0.3 . 1 . . . . A 156 PHE C . 36514 1 692 . 1 . 1 168 168 PHE CA C 13 63.84 0.3 . 1 . . . . A 156 PHE CA . 36514 1 693 . 1 . 1 168 168 PHE CB C 13 40.50 0.3 . 1 . . . . A 156 PHE CB . 36514 1 694 . 1 . 1 168 168 PHE N N 15 110.34 0.5 . 1 . . . . A 156 PHE N . 36514 1 695 . 1 . 1 169 169 ALA C C 13 176.10 0.3 . 1 . . . . A 157 ALA C . 36514 1 696 . 1 . 1 169 169 ALA CA C 13 51.01 0.3 . 1 . . . . A 157 ALA CA . 36514 1 697 . 1 . 1 169 169 ALA CB C 13 18.03 0.3 . 1 . . . . A 157 ALA CB . 36514 1 698 . 1 . 1 169 169 ALA N N 15 124.36 0.5 . 1 . . . . A 157 ALA N . 36514 1 699 . 1 . 1 170 170 PRO C C 13 177.52 0.3 . 1 . . . . A 158 PRO C . 36514 1 700 . 1 . 1 170 170 PRO CA C 13 65.85 0.3 . 1 . . . . A 158 PRO CA . 36514 1 701 . 1 . 1 170 170 PRO CB C 13 31.91 0.3 . 1 . . . . A 158 PRO CB . 36514 1 702 . 1 . 1 170 170 PRO CD C 13 50.49 0.3 . 1 . . . . A 158 PRO CD . 36514 1 703 . 1 . 1 170 170 PRO N N 15 145.74 0.5 . 1 . . . . A 158 PRO N . 36514 1 704 . 1 . 1 171 171 ALA C C 13 178.01 0.3 . 1 . . . . A 159 ALA C . 36514 1 705 . 1 . 1 171 171 ALA CA C 13 53.41 0.3 . 1 . . . . A 159 ALA CA . 36514 1 706 . 1 . 1 171 171 ALA CB C 13 17.98 0.3 . 1 . . . . A 159 ALA CB . 36514 1 707 . 1 . 1 171 171 ALA N N 15 119.34 0.5 . 1 . . . . A 159 ALA N . 36514 1 708 . 1 . 1 172 172 GLY C C 13 175.68 0.3 . 1 . . . . A 160 GLY C . 36514 1 709 . 1 . 1 172 172 GLY CA C 13 47.69 0.3 . 1 . . . . A 160 GLY CA . 36514 1 710 . 1 . 1 172 172 GLY N N 15 105.82 0.5 . 1 . . . . A 160 GLY N . 36514 1 711 . 1 . 1 173 173 PHE C C 13 178.05 0.3 . 1 . . . . A 161 PHE C . 36514 1 712 . 1 . 1 173 173 PHE CA C 13 58.45 0.3 . 1 . . . . A 161 PHE CA . 36514 1 713 . 1 . 1 173 173 PHE CB C 13 40.86 0.3 . 1 . . . . A 161 PHE CB . 36514 1 714 . 1 . 1 173 173 PHE N N 15 119.23 0.5 . 1 . . . . A 161 PHE N . 36514 1 715 . 1 . 1 174 174 ALA C C 13 175.01 0.3 . 1 . . . . A 162 ALA C . 36514 1 716 . 1 . 1 174 174 ALA CA C 13 56.93 0.3 . 1 . . . . A 162 ALA CA . 36514 1 717 . 1 . 1 174 174 ALA CB C 13 15.90 0.3 . 1 . . . . A 162 ALA CB . 36514 1 718 . 1 . 1 174 174 ALA N N 15 123.62 0.5 . 1 . . . . A 162 ALA N . 36514 1 719 . 1 . 1 175 175 PRO C C 13 179.56 0.3 . 1 . . . . A 163 PRO C . 36514 1 720 . 1 . 1 175 175 PRO CA C 13 66.19 0.3 . 1 . . . . A 163 PRO CA . 36514 1 721 . 1 . 1 175 175 PRO CB C 13 31.43 0.3 . 1 . . . . A 163 PRO CB . 36514 1 722 . 1 . 1 175 175 PRO CG C 13 28.98 0.3 . 1 . . . . A 163 PRO CG . 36514 1 723 . 1 . 1 175 175 PRO CD C 13 49.70 0.3 . 1 . . . . A 163 PRO CD . 36514 1 724 . 1 . 1 175 175 PRO N N 15 130.72 0.5 . 1 . . . . A 163 PRO N . 36514 1 725 . 1 . 1 176 176 ILE C C 13 176.66 0.3 . 1 . . . . A 164 ILE C . 36514 1 726 . 1 . 1 176 176 ILE CA C 13 64.16 0.3 . 1 . . . . A 164 ILE CA . 36514 1 727 . 1 . 1 176 176 ILE CB C 13 38.28 0.3 . 1 . . . . A 164 ILE CB . 36514 1 728 . 1 . 1 176 176 ILE CG1 C 13 29.72 0.3 . 1 . . . . A 164 ILE CG1 . 36514 1 729 . 1 . 1 176 176 ILE CG2 C 13 18.40 0.3 . 1 . . . . A 164 ILE CG2 . 36514 1 730 . 1 . 1 176 176 ILE CD1 C 13 14.90 0.3 . 1 . . . . A 164 ILE CD1 . 36514 1 731 . 1 . 1 176 176 ILE N N 15 112.14 0.5 . 1 . . . . A 164 ILE N . 36514 1 732 . 1 . 1 177 177 ALA C C 13 178.38 0.3 . 1 . . . . A 165 ALA C . 36514 1 733 . 1 . 1 177 177 ALA CA C 13 55.38 0.3 . 1 . . . . A 165 ALA CA . 36514 1 734 . 1 . 1 177 177 ALA CB C 13 18.51 0.3 . 1 . . . . A 165 ALA CB . 36514 1 735 . 1 . 1 177 177 ALA N N 15 120.83 0.5 . 1 . . . . A 165 ALA N . 36514 1 736 . 1 . 1 178 178 ILE C C 13 178.80 0.3 . 1 . . . . A 166 ILE C . 36514 1 737 . 1 . 1 178 178 ILE CA C 13 65.89 0.3 . 1 . . . . A 166 ILE CA . 36514 1 738 . 1 . 1 178 178 ILE CB C 13 39.22 0.3 . 1 . . . . A 166 ILE CB . 36514 1 739 . 1 . 1 178 178 ILE CG1 C 13 28.93 0.3 . 1 . . . . A 166 ILE CG1 . 36514 1 740 . 1 . 1 178 178 ILE CG2 C 13 17.26 0.3 . 1 . . . . A 166 ILE CG2 . 36514 1 741 . 1 . 1 178 178 ILE CD1 C 13 14.44 0.3 . 1 . . . . A 166 ILE CD1 . 36514 1 742 . 1 . 1 178 178 ILE N N 15 115.37 0.5 . 1 . . . . A 166 ILE N . 36514 1 743 . 1 . 1 179 179 GLY C C 13 176.11 0.3 . 1 . . . . A 167 GLY C . 36514 1 744 . 1 . 1 179 179 GLY CA C 13 48.55 0.3 . 1 . . . . A 167 GLY CA . 36514 1 745 . 1 . 1 179 179 GLY N N 15 105.74 0.5 . 1 . . . . A 167 GLY N . 36514 1 746 . 1 . 1 180 180 LEU C C 13 179.97 0.3 . 1 . . . . A 168 LEU C . 36514 1 747 . 1 . 1 180 180 LEU CA C 13 57.27 0.3 . 1 . . . . A 168 LEU CA . 36514 1 748 . 1 . 1 180 180 LEU CB C 13 38.31 0.3 . 1 . . . . A 168 LEU CB . 36514 1 749 . 1 . 1 180 180 LEU CG C 13 27.39 0.3 . 1 . . . . A 168 LEU CG . 36514 1 750 . 1 . 1 180 180 LEU N N 15 116.03 0.5 . 1 . . . . A 168 LEU N . 36514 1 751 . 1 . 1 181 181 ALA C C 13 178.90 0.3 . 1 . . . . A 169 ALA C . 36514 1 752 . 1 . 1 181 181 ALA CA C 13 55.80 0.3 . 1 . . . . A 169 ALA CA . 36514 1 753 . 1 . 1 181 181 ALA CB C 13 17.42 0.3 . 1 . . . . A 169 ALA CB . 36514 1 754 . 1 . 1 181 181 ALA N N 15 123.40 0.5 . 1 . . . . A 169 ALA N . 36514 1 755 . 1 . 1 182 182 LEU C C 13 181.50 0.3 . 1 . . . . A 170 LEU C . 36514 1 756 . 1 . 1 182 182 LEU CA C 13 57.42 0.3 . 1 . . . . A 170 LEU CA . 36514 1 757 . 1 . 1 182 182 LEU CB C 13 41.10 0.3 . 1 . . . . A 170 LEU CB . 36514 1 758 . 1 . 1 182 182 LEU CG C 13 26.99 0.3 . 1 . . . . A 170 LEU CG . 36514 1 759 . 1 . 1 182 182 LEU CD1 C 13 22.37 0.3 . . . . . . A 170 LEU CD1 . 36514 1 760 . 1 . 1 182 182 LEU N N 15 119.72 0.5 . 1 . . . . A 170 LEU N . 36514 1 761 . 1 . 1 183 183 THR C C 13 175.98 0.3 . 1 . . . . A 171 THR C . 36514 1 762 . 1 . 1 183 183 THR CA C 13 67.65 0.3 . 1 . . . . A 171 THR CA . 36514 1 763 . 1 . 1 183 183 THR CB C 13 68.85 0.3 . 1 . . . . A 171 THR CB . 36514 1 764 . 1 . 1 183 183 THR CG2 C 13 22.25 0.3 . 1 . . . . A 171 THR CG2 . 36514 1 765 . 1 . 1 183 183 THR N N 15 122.66 0.5 . 1 . . . . A 171 THR N . 36514 1 766 . 1 . 1 184 184 LEU C C 13 176.29 0.3 . 1 . . . . A 172 LEU C . 36514 1 767 . 1 . 1 184 184 LEU CA C 13 58.26 0.3 . 1 . . . . A 172 LEU CA . 36514 1 768 . 1 . 1 184 184 LEU CB C 13 41.12 0.3 . 1 . . . . A 172 LEU CB . 36514 1 769 . 1 . 1 184 184 LEU N N 15 123.47 0.5 . 1 . . . . A 172 LEU N . 36514 1 770 . 1 . 1 185 185 ILE C C 13 178.97 0.3 . 1 . . . . A 173 ILE C . 36514 1 771 . 1 . 1 185 185 ILE CA C 13 65.39 0.3 . 1 . . . . A 173 ILE CA . 36514 1 772 . 1 . 1 185 185 ILE CB C 13 38.82 0.3 . 1 . . . . A 173 ILE CB . 36514 1 773 . 1 . 1 185 185 ILE N N 15 117.47 0.5 . 1 . . . . A 173 ILE N . 36514 1 774 . 1 . 1 186 186 HIS C C 13 176.28 0.3 . 1 . . . . A 174 HIS C . 36514 1 775 . 1 . 1 186 186 HIS CA C 13 60.40 0.3 . 1 . . . . A 174 HIS CA . 36514 1 776 . 1 . 1 186 186 HIS CB C 13 30.02 0.3 . 1 . . . . A 174 HIS CB . 36514 1 777 . 1 . 1 186 186 HIS N N 15 120.22 0.5 . 1 . . . . A 174 HIS N . 36514 1 778 . 1 . 1 186 186 HIS ND1 N 15 162.74 0.5 . 1 . . . . A 174 HIS ND1 . 36514 1 779 . 1 . 1 187 187 LEU C C 13 175.92 0.3 . 1 . . . . A 175 LEU C . 36514 1 780 . 1 . 1 187 187 LEU CA C 13 57.64 0.3 . 1 . . . . A 175 LEU CA . 36514 1 781 . 1 . 1 187 187 LEU CB C 13 40.67 0.3 . 1 . . . . A 175 LEU CB . 36514 1 782 . 1 . 1 187 187 LEU CG C 13 26.01 0.3 . 1 . . . . A 175 LEU CG . 36514 1 783 . 1 . 1 187 187 LEU CD1 C 13 22.50 0.3 . . . . . . A 175 LEU CD1 . 36514 1 784 . 1 . 1 187 187 LEU N N 15 121.09 0.5 . 1 . . . . A 175 LEU N . 36514 1 785 . 1 . 1 188 188 ILE C C 13 175.38 0.3 . 1 . . . . A 176 ILE C . 36514 1 786 . 1 . 1 188 188 ILE CA C 13 63.51 0.3 . 1 . . . . A 176 ILE CA . 36514 1 787 . 1 . 1 188 188 ILE CB C 13 40.38 0.3 . 1 . . . . A 176 ILE CB . 36514 1 788 . 1 . 1 188 188 ILE CG1 C 13 26.54 0.3 . 1 . . . . A 176 ILE CG1 . 36514 1 789 . 1 . 1 188 188 ILE CG2 C 13 18.04 0.3 . 1 . . . . A 176 ILE CG2 . 36514 1 790 . 1 . 1 188 188 ILE CD1 C 13 14.98 0.3 . 1 . . . . A 176 ILE CD1 . 36514 1 791 . 1 . 1 188 188 ILE N N 15 110.19 0.5 . 1 . . . . A 176 ILE N . 36514 1 792 . 1 . 1 189 189 SER C C 13 176.52 0.3 . 1 . . . . A 177 SER C . 36514 1 793 . 1 . 1 189 189 SER CA C 13 59.66 0.3 . 1 . . . . A 177 SER CA . 36514 1 794 . 1 . 1 189 189 SER CB C 13 67.59 0.3 . 1 . . . . A 177 SER CB . 36514 1 795 . 1 . 1 189 189 SER N N 15 99.62 0.5 . 1 . . . . A 177 SER N . 36514 1 796 . 1 . 1 190 190 ILE C C 13 175.63 0.3 . 1 . . . . A 178 ILE C . 36514 1 797 . 1 . 1 190 190 ILE CA C 13 66.59 0.3 . 1 . . . . A 178 ILE CA . 36514 1 798 . 1 . 1 190 190 ILE CB C 13 35.12 0.3 . 1 . . . . A 178 ILE CB . 36514 1 799 . 1 . 1 190 190 ILE CG1 C 13 29.92 0.3 . 1 . . . . A 178 ILE CG1 . 36514 1 800 . 1 . 1 190 190 ILE CG2 C 13 17.26 0.3 . 1 . . . . A 178 ILE CG2 . 36514 1 801 . 1 . 1 190 190 ILE CD1 C 13 14.61 0.3 . 1 . . . . A 178 ILE CD1 . 36514 1 802 . 1 . 1 190 190 ILE N N 15 129.00 0.5 . 1 . . . . A 178 ILE N . 36514 1 803 . 1 . 1 191 191 PRO C C 13 175.81 0.3 . 1 . . . . A 179 PRO C . 36514 1 804 . 1 . 1 191 191 PRO CA C 13 65.19 0.3 . 1 . . . . A 179 PRO CA . 36514 1 805 . 1 . 1 191 191 PRO CB C 13 33.28 0.3 . 1 . . . . A 179 PRO CB . 36514 1 806 . 1 . 1 191 191 PRO CG C 13 28.30 0.3 . 1 . . . . A 179 PRO CG . 36514 1 807 . 1 . 1 191 191 PRO CD C 13 49.66 0.3 . 1 . . . . A 179 PRO CD . 36514 1 808 . 1 . 1 191 191 PRO N N 15 129.26 0.5 . 1 . . . . A 179 PRO N . 36514 1 809 . 1 . 1 192 192 VAL C C 13 179.34 0.3 . 1 . . . . A 180 VAL C . 36514 1 810 . 1 . 1 192 192 VAL CA C 13 63.80 0.3 . 1 . . . . A 180 VAL CA . 36514 1 811 . 1 . 1 192 192 VAL CB C 13 31.86 0.3 . 1 . . . . A 180 VAL CB . 36514 1 812 . 1 . 1 192 192 VAL CG1 C 13 21.65 0.3 . . . . . . A 180 VAL CG1 . 36514 1 813 . 1 . 1 192 192 VAL CG2 C 13 20.15 0.3 . . . . . . A 180 VAL CG2 . 36514 1 814 . 1 . 1 192 192 VAL N N 15 111.04 0.5 . 1 . . . . A 180 VAL N . 36514 1 815 . 1 . 1 193 193 THR C C 13 177.77 0.3 . 1 . . . . A 181 THR C . 36514 1 816 . 1 . 1 193 193 THR CA C 13 60.41 0.3 . 1 . . . . A 181 THR CA . 36514 1 817 . 1 . 1 193 193 THR CB C 13 71.17 0.3 . 1 . . . . A 181 THR CB . 36514 1 818 . 1 . 1 193 193 THR CG2 C 13 24.54 0.3 . 1 . . . . A 181 THR CG2 . 36514 1 819 . 1 . 1 193 193 THR N N 15 104.80 0.5 . 1 . . . . A 181 THR N . 36514 1 820 . 1 . 1 194 194 ASN C C 13 172.04 0.3 . 1 . . . . A 182 ASN C . 36514 1 821 . 1 . 1 194 194 ASN CA C 13 54.04 0.3 . 1 . . . . A 182 ASN CA . 36514 1 822 . 1 . 1 194 194 ASN CB C 13 40.15 0.3 . 1 . . . . A 182 ASN CB . 36514 1 823 . 1 . 1 194 194 ASN CG C 13 177.55 0.3 . 1 . . . . A 182 ASN CG . 36514 1 824 . 1 . 1 194 194 ASN N N 15 124.45 0.5 . 1 . . . . A 182 ASN N . 36514 1 825 . 1 . 1 196 196 SER C C 13 174.23 0.3 . 1 . . . . A 184 SER C . 36514 1 826 . 1 . 1 196 196 SER CA C 13 58.47 0.3 . 1 . . . . A 184 SER CA . 36514 1 827 . 1 . 1 196 196 SER CB C 13 64.11 0.3 . 1 . . . . A 184 SER CB . 36514 1 828 . 1 . 1 196 196 SER N N 15 129.24 0.5 . 1 . . . . A 184 SER N . 36514 1 829 . 1 . 1 197 197 VAL C C 13 174.97 0.3 . 1 . . . . A 185 VAL C . 36514 1 830 . 1 . 1 197 197 VAL CA C 13 62.32 0.3 . 1 . . . . A 185 VAL CA . 36514 1 831 . 1 . 1 197 197 VAL CB C 13 33.55 0.3 . 1 . . . . A 185 VAL CB . 36514 1 832 . 1 . 1 197 197 VAL CG1 C 13 22.35 0.3 . . . . . . A 185 VAL CG1 . 36514 1 833 . 1 . 1 197 197 VAL CG2 C 13 21.21 0.3 . . . . . . A 185 VAL CG2 . 36514 1 834 . 1 . 1 197 197 VAL N N 15 111.76 0.5 . 1 . . . . A 185 VAL N . 36514 1 835 . 1 . 1 198 198 ASN C C 13 173.76 0.3 . 1 . . . . A 186 ASN C . 36514 1 836 . 1 . 1 198 198 ASN CA C 13 52.00 0.3 . 1 . . . . A 186 ASN CA . 36514 1 837 . 1 . 1 198 198 ASN CB C 13 39.45 0.3 . 1 . . . . A 186 ASN CB . 36514 1 838 . 1 . 1 198 198 ASN CG C 13 178.72 0.3 . 1 . . . . A 186 ASN CG . 36514 1 839 . 1 . 1 198 198 ASN N N 15 110.94 0.5 . 1 . . . . A 186 ASN N . 36514 1 840 . 1 . 1 198 198 ASN ND2 N 15 115.39 0.5 . 1 . . . . A 186 ASN ND2 . 36514 1 841 . 1 . 1 199 199 PRO C C 13 180.74 0.3 . 1 . . . . A 187 PRO C . 36514 1 842 . 1 . 1 199 199 PRO CA C 13 63.53 0.3 . 1 . . . . A 187 PRO CA . 36514 1 843 . 1 . 1 199 199 PRO CB C 13 31.28 0.3 . 1 . . . . A 187 PRO CB . 36514 1 844 . 1 . 1 199 199 PRO CG C 13 26.47 0.3 . 1 . . . . A 187 PRO CG . 36514 1 845 . 1 . 1 199 199 PRO CD C 13 50.58 0.3 . 1 . . . . A 187 PRO CD . 36514 1 846 . 1 . 1 199 199 PRO N N 15 133.89 0.5 . 1 . . . . A 187 PRO N . 36514 1 847 . 1 . 1 200 200 ALA C C 13 178.48 0.3 . 1 . . . . A 188 ALA C . 36514 1 848 . 1 . 1 200 200 ALA CA C 13 54.93 0.3 . 1 . . . . A 188 ALA CA . 36514 1 849 . 1 . 1 200 200 ALA CB C 13 18.10 0.3 . 1 . . . . A 188 ALA CB . 36514 1 850 . 1 . 1 200 200 ALA N N 15 116.89 0.5 . 1 . . . . A 188 ALA N . 36514 1 851 . 1 . 1 201 201 ARG C C 13 179.02 0.3 . 1 . . . . A 189 ARG C . 36514 1 852 . 1 . 1 201 201 ARG CA C 13 57.64 0.3 . 1 . . . . A 189 ARG CA . 36514 1 853 . 1 . 1 201 201 ARG CB C 13 28.30 0.3 . 1 . . . . A 189 ARG CB . 36514 1 854 . 1 . 1 201 201 ARG CG C 13 25.73 0.3 . 1 . . . . A 189 ARG CG . 36514 1 855 . 1 . 1 201 201 ARG CD C 13 43.63 0.3 . 1 . . . . A 189 ARG CD . 36514 1 856 . 1 . 1 201 201 ARG CZ C 13 159.31 0.3 . 1 . . . . A 189 ARG CZ . 36514 1 857 . 1 . 1 201 201 ARG N N 15 120.72 0.5 . 1 . . . . A 189 ARG N . 36514 1 858 . 1 . 1 201 201 ARG NE N 15 87.49 0.5 . 1 . . . . A 189 ARG NE . 36514 1 859 . 1 . 1 202 202 SER C C 13 175.86 0.3 . 1 . . . . A 190 SER C . 36514 1 860 . 1 . 1 202 202 SER CA C 13 62.33 0.3 . 1 . . . . A 190 SER CA . 36514 1 861 . 1 . 1 202 202 SER CB C 13 63.14 0.3 . 1 . . . . A 190 SER CB . 36514 1 862 . 1 . 1 202 202 SER N N 15 115.32 0.5 . 1 . . . . A 190 SER N . 36514 1 863 . 1 . 1 203 203 THR C C 13 174.20 0.3 . 1 . . . . A 191 THR C . 36514 1 864 . 1 . 1 203 203 THR CA C 13 66.66 0.3 . 1 . . . . A 191 THR CA . 36514 1 865 . 1 . 1 203 203 THR CB C 13 69.48 0.3 . 1 . . . . A 191 THR CB . 36514 1 866 . 1 . 1 203 203 THR CG2 C 13 22.07 0.3 . 1 . . . . A 191 THR CG2 . 36514 1 867 . 1 . 1 203 203 THR N N 15 118.42 0.5 . 1 . . . . A 191 THR N . 36514 1 868 . 1 . 1 204 204 ALA C C 13 176.15 0.3 . 1 . . . . A 192 ALA C . 36514 1 869 . 1 . 1 204 204 ALA CA C 13 55.91 0.3 . 1 . . . . A 192 ALA CA . 36514 1 870 . 1 . 1 204 204 ALA CB C 13 19.71 0.3 . 1 . . . . A 192 ALA CB . 36514 1 871 . 1 . 1 204 204 ALA N N 15 118.73 0.5 . 1 . . . . A 192 ALA N . 36514 1 872 . 1 . 1 205 205 VAL C C 13 178.67 0.3 . 1 . . . . A 193 VAL C . 36514 1 873 . 1 . 1 205 205 VAL CA C 13 62.28 0.3 . 1 . . . . A 193 VAL CA . 36514 1 874 . 1 . 1 205 205 VAL CB C 13 30.40 0.3 . 1 . . . . A 193 VAL CB . 36514 1 875 . 1 . 1 205 205 VAL CG1 C 13 23.09 0.3 . . . . . . A 193 VAL CG1 . 36514 1 876 . 1 . 1 205 205 VAL CG2 C 13 18.73 0.3 . . . . . . A 193 VAL CG2 . 36514 1 877 . 1 . 1 205 205 VAL N N 15 97.73 0.5 . 1 . . . . A 193 VAL N . 36514 1 878 . 1 . 1 206 206 ALA C C 13 179.56 0.3 . 1 . . . . A 194 ALA C . 36514 1 879 . 1 . 1 206 206 ALA CA C 13 54.65 0.3 . 1 . . . . A 194 ALA CA . 36514 1 880 . 1 . 1 206 206 ALA CB C 13 19.56 0.3 . 1 . . . . A 194 ALA CB . 36514 1 881 . 1 . 1 206 206 ALA N N 15 125.55 0.5 . 1 . . . . A 194 ALA N . 36514 1 882 . 1 . 1 207 207 ILE C C 13 176.68 0.3 . 1 . . . . A 195 ILE C . 36514 1 883 . 1 . 1 207 207 ILE CA C 13 64.53 0.3 . 1 . . . . A 195 ILE CA . 36514 1 884 . 1 . 1 207 207 ILE CB C 13 38.55 0.3 . 1 . . . . A 195 ILE CB . 36514 1 885 . 1 . 1 207 207 ILE CG1 C 13 28.29 0.3 . 1 . . . . A 195 ILE CG1 . 36514 1 886 . 1 . 1 207 207 ILE CG2 C 13 20.07 0.3 . 1 . . . . A 195 ILE CG2 . 36514 1 887 . 1 . 1 207 207 ILE CD1 C 13 16.66 0.3 . 1 . . . . A 195 ILE CD1 . 36514 1 888 . 1 . 1 207 207 ILE N N 15 111.40 0.5 . 1 . . . . A 195 ILE N . 36514 1 889 . 1 . 1 208 208 PHE C C 13 177.35 0.3 . 1 . . . . A 196 PHE C . 36514 1 890 . 1 . 1 208 208 PHE CA C 13 57.56 0.3 . 1 . . . . A 196 PHE CA . 36514 1 891 . 1 . 1 208 208 PHE CB C 13 41.22 0.3 . 1 . . . . A 196 PHE CB . 36514 1 892 . 1 . 1 208 208 PHE N N 15 121.14 0.5 . 1 . . . . A 196 PHE N . 36514 1 893 . 1 . 1 209 209 GLN C C 13 179.55 0.3 . 1 . . . . A 197 GLN C . 36514 1 894 . 1 . 1 209 209 GLN CA C 13 60.53 0.3 . 1 . . . . A 197 GLN CA . 36514 1 895 . 1 . 1 209 209 GLN CB C 13 28.42 0.3 . 1 . . . . A 197 GLN CB . 36514 1 896 . 1 . 1 209 209 GLN CG C 13 34.89 0.3 . 1 . . . . A 197 GLN CG . 36514 1 897 . 1 . 1 209 209 GLN N N 15 122.45 0.5 . 1 . . . . A 197 GLN N . 36514 1 898 . 1 . 1 210 210 GLY C C 13 174.12 0.3 . 1 . . . . A 198 GLY C . 36514 1 899 . 1 . 1 210 210 GLY CA C 13 46.89 0.3 . 1 . . . . A 198 GLY CA . 36514 1 900 . 1 . 1 210 210 GLY N N 15 98.97 0.5 . 1 . . . . A 198 GLY N . 36514 1 901 . 1 . 1 211 211 GLY C C 13 175.80 0.3 . 1 . . . . A 199 GLY C . 36514 1 902 . 1 . 1 211 211 GLY CA C 13 45.61 0.3 . 1 . . . . A 199 GLY CA . 36514 1 903 . 1 . 1 211 211 GLY N N 15 109.88 0.5 . 1 . . . . A 199 GLY N . 36514 1 904 . 1 . 1 212 212 TRP C C 13 177.74 0.3 . 1 . . . . A 200 TRP C . 36514 1 905 . 1 . 1 212 212 TRP CA C 13 58.71 0.3 . 1 . . . . A 200 TRP CA . 36514 1 906 . 1 . 1 212 212 TRP CB C 13 28.06 0.3 . 1 . . . . A 200 TRP CB . 36514 1 907 . 1 . 1 212 212 TRP N N 15 132.82 0.5 . 1 . . . . A 200 TRP N . 36514 1 908 . 1 . 1 213 213 ALA C C 13 181.38 0.3 . 1 . . . . A 201 ALA C . 36514 1 909 . 1 . 1 213 213 ALA CA C 13 55.80 0.3 . 1 . . . . A 201 ALA CA . 36514 1 910 . 1 . 1 213 213 ALA CB C 13 19.73 0.3 . 1 . . . . A 201 ALA CB . 36514 1 911 . 1 . 1 213 213 ALA N N 15 124.52 0.5 . 1 . . . . A 201 ALA N . 36514 1 912 . 1 . 1 214 214 LEU C C 13 178.08 0.3 . 1 . . . . A 202 LEU C . 36514 1 913 . 1 . 1 214 214 LEU CA C 13 56.62 0.3 . 1 . . . . A 202 LEU CA . 36514 1 914 . 1 . 1 214 214 LEU CB C 13 41.71 0.3 . 1 . . . . A 202 LEU CB . 36514 1 915 . 1 . 1 214 214 LEU CG C 13 26.21 0.3 . 1 . . . . A 202 LEU CG . 36514 1 916 . 1 . 1 214 214 LEU CD1 C 13 23.24 0.3 . . . . . . A 202 LEU CD1 . 36514 1 917 . 1 . 1 214 214 LEU N N 15 114.91 0.5 . 1 . . . . A 202 LEU N . 36514 1 918 . 1 . 1 215 215 GLU C C 13 178.68 0.3 . 1 . . . . A 203 GLU C . 36514 1 919 . 1 . 1 215 215 GLU CA C 13 59.43 0.3 . 1 . . . . A 203 GLU CA . 36514 1 920 . 1 . 1 215 215 GLU CB C 13 29.51 0.3 . 1 . . . . A 203 GLU CB . 36514 1 921 . 1 . 1 215 215 GLU CG C 13 36.30 0.3 . 1 . . . . A 203 GLU CG . 36514 1 922 . 1 . 1 215 215 GLU CD C 13 182.62 0.3 . 1 . . . . A 203 GLU CD . 36514 1 923 . 1 . 1 215 215 GLU N N 15 120.49 0.5 . 1 . . . . A 203 GLU N . 36514 1 924 . 1 . 1 216 216 GLN C C 13 176.41 0.3 . 1 . . . . A 204 GLN C . 36514 1 925 . 1 . 1 216 216 GLN CA C 13 56.63 0.3 . 1 . . . . A 204 GLN CA . 36514 1 926 . 1 . 1 216 216 GLN CB C 13 29.52 0.3 . 1 . . . . A 204 GLN CB . 36514 1 927 . 1 . 1 216 216 GLN CG C 13 33.82 0.3 . 1 . . . . A 204 GLN CG . 36514 1 928 . 1 . 1 216 216 GLN CD C 13 178.63 0.3 . 1 . . . . A 204 GLN CD . 36514 1 929 . 1 . 1 216 216 GLN N N 15 112.73 0.5 . 1 . . . . A 204 GLN N . 36514 1 930 . 1 . 1 217 217 LEU C C 13 178.52 0.3 . 1 . . . . A 205 LEU C . 36514 1 931 . 1 . 1 217 217 LEU CA C 13 58.26 0.3 . 1 . . . . A 205 LEU CA . 36514 1 932 . 1 . 1 217 217 LEU CB C 13 41.04 0.3 . 1 . . . . A 205 LEU CB . 36514 1 933 . 1 . 1 217 217 LEU CG C 13 27.52 0.3 . 1 . . . . A 205 LEU CG . 36514 1 934 . 1 . 1 217 217 LEU CD1 C 13 25.89 0.3 . . . . . . A 205 LEU CD1 . 36514 1 935 . 1 . 1 217 217 LEU CD2 C 13 23.65 0.3 . . . . . . A 205 LEU CD2 . 36514 1 936 . 1 . 1 217 217 LEU N N 15 119.41 0.5 . 1 . . . . A 205 LEU N . 36514 1 937 . 1 . 1 218 218 TRP C C 13 176.83 0.3 . 1 . . . . A 206 TRP C . 36514 1 938 . 1 . 1 218 218 TRP CA C 13 59.36 0.3 . 1 . . . . A 206 TRP CA . 36514 1 939 . 1 . 1 218 218 TRP CB C 13 27.17 0.3 . 1 . . . . A 206 TRP CB . 36514 1 940 . 1 . 1 218 218 TRP N N 15 117.16 0.5 . 1 . . . . A 206 TRP N . 36514 1 941 . 1 . 1 219 219 PHE C C 13 175.48 0.3 . 1 . . . . A 207 PHE C . 36514 1 942 . 1 . 1 219 219 PHE CA C 13 61.09 0.3 . 1 . . . . A 207 PHE CA . 36514 1 943 . 1 . 1 219 219 PHE CB C 13 39.90 0.3 . 1 . . . . A 207 PHE CB . 36514 1 944 . 1 . 1 219 219 PHE N N 15 126.56 0.5 . 1 . . . . A 207 PHE N . 36514 1 945 . 1 . 1 220 220 PHE C C 13 173.69 0.3 . 1 . . . . A 208 PHE C . 36514 1 946 . 1 . 1 220 220 PHE CA C 13 59.87 0.3 . 1 . . . . A 208 PHE CA . 36514 1 947 . 1 . 1 220 220 PHE CB C 13 37.84 0.3 . 1 . . . . A 208 PHE CB . 36514 1 948 . 1 . 1 220 220 PHE N N 15 115.92 0.5 . 1 . . . . A 208 PHE N . 36514 1 949 . 1 . 1 221 221 TRP C C 13 176.94 0.3 . 1 . . . . A 209 TRP C . 36514 1 950 . 1 . 1 221 221 TRP CA C 13 60.34 0.3 . 1 . . . . A 209 TRP CA . 36514 1 951 . 1 . 1 221 221 TRP CB C 13 29.63 0.3 . 1 . . . . A 209 TRP CB . 36514 1 952 . 1 . 1 221 221 TRP CD1 C 13 126.15 0.3 . 1 . . . . A 209 TRP CD1 . 36514 1 953 . 1 . 1 221 221 TRP CE2 C 13 139.34 0.3 . 1 . . . . A 209 TRP CE2 . 36514 1 954 . 1 . 1 221 221 TRP CZ2 C 13 114.37 0.3 . 1 . . . . A 209 TRP CZ2 . 36514 1 955 . 1 . 1 221 221 TRP N N 15 114.08 0.5 . 1 . . . . A 209 TRP N . 36514 1 956 . 1 . 1 222 222 VAL C C 13 176.16 0.3 . 1 . . . . A 210 VAL C . 36514 1 957 . 1 . 1 222 222 VAL CA C 13 66.75 0.3 . 1 . . . . A 210 VAL CA . 36514 1 958 . 1 . 1 222 222 VAL CB C 13 33.18 0.3 . 1 . . . . A 210 VAL CB . 36514 1 959 . 1 . 1 222 222 VAL CG1 C 13 23.15 0.3 . . . . . . A 210 VAL CG1 . 36514 1 960 . 1 . 1 222 222 VAL CG2 C 13 21.71 0.3 . . . . . . A 210 VAL CG2 . 36514 1 961 . 1 . 1 222 222 VAL N N 15 113.61 0.5 . 1 . . . . A 210 VAL N . 36514 1 962 . 1 . 1 223 223 VAL C C 13 174.42 0.3 . 1 . . . . A 211 VAL C . 36514 1 963 . 1 . 1 223 223 VAL CA C 13 69.23 0.3 . 1 . . . . A 211 VAL CA . 36514 1 964 . 1 . 1 223 223 VAL CB C 13 28.61 0.3 . 1 . . . . A 211 VAL CB . 36514 1 965 . 1 . 1 223 223 VAL CG1 C 13 23.82 0.3 . . . . . . A 211 VAL CG1 . 36514 1 966 . 1 . 1 223 223 VAL CG2 C 13 22.61 0.3 . . . . . . A 211 VAL CG2 . 36514 1 967 . 1 . 1 223 223 VAL N N 15 115.42 0.5 . 1 . . . . A 211 VAL N . 36514 1 968 . 1 . 1 224 224 PRO C C 13 179.08 0.3 . 1 . . . . A 212 PRO C . 36514 1 969 . 1 . 1 224 224 PRO CA C 13 64.83 0.3 . 1 . . . . A 212 PRO CA . 36514 1 970 . 1 . 1 224 224 PRO CB C 13 32.67 0.3 . 1 . . . . A 212 PRO CB . 36514 1 971 . 1 . 1 224 224 PRO CG C 13 34.89 0.3 . 1 . . . . A 212 PRO CG . 36514 1 972 . 1 . 1 224 224 PRO CD C 13 50.01 0.3 . 1 . . . . A 212 PRO CD . 36514 1 973 . 1 . 1 224 224 PRO N N 15 132.62 0.5 . 1 . . . . A 212 PRO N . 36514 1 974 . 1 . 1 225 225 ILE C C 13 177.68 0.3 . 1 . . . . A 213 ILE C . 36514 1 975 . 1 . 1 225 225 ILE CA C 13 65.61 0.3 . 1 . . . . A 213 ILE CA . 36514 1 976 . 1 . 1 225 225 ILE CB C 13 37.13 0.3 . 1 . . . . A 213 ILE CB . 36514 1 977 . 1 . 1 225 225 ILE CG1 C 13 27.53 0.3 . 1 . . . . A 213 ILE CG1 . 36514 1 978 . 1 . 1 225 225 ILE CG2 C 13 17.62 0.3 . 1 . . . . A 213 ILE CG2 . 36514 1 979 . 1 . 1 225 225 ILE CD1 C 13 14.44 0.3 . 1 . . . . A 213 ILE CD1 . 36514 1 980 . 1 . 1 225 225 ILE N N 15 112.15 0.5 . 1 . . . . A 213 ILE N . 36514 1 981 . 1 . 1 226 226 VAL C C 13 178.07 0.3 . 1 . . . . A 214 VAL C . 36514 1 982 . 1 . 1 226 226 VAL CA C 13 67.42 0.3 . 1 . . . . A 214 VAL CA . 36514 1 983 . 1 . 1 226 226 VAL CB C 13 31.14 0.3 . 1 . . . . A 214 VAL CB . 36514 1 984 . 1 . 1 226 226 VAL CG1 C 13 24.23 0.3 . . . . . . A 214 VAL CG1 . 36514 1 985 . 1 . 1 226 226 VAL CG2 C 13 21.65 0.3 . . . . . . A 214 VAL CG2 . 36514 1 986 . 1 . 1 226 226 VAL N N 15 120.11 0.5 . 1 . . . . A 214 VAL N . 36514 1 987 . 1 . 1 227 227 GLY C C 13 174.87 0.3 . 1 . . . . A 215 GLY C . 36514 1 988 . 1 . 1 227 227 GLY CA C 13 48.08 0.3 . 1 . . . . A 215 GLY CA . 36514 1 989 . 1 . 1 227 227 GLY N N 15 105.72 0.5 . 1 . . . . A 215 GLY N . 36514 1 990 . 1 . 1 228 228 GLY C C 13 175.44 0.3 . 1 . . . . A 216 GLY C . 36514 1 991 . 1 . 1 228 228 GLY CA C 13 46.92 0.3 . 1 . . . . A 216 GLY CA . 36514 1 992 . 1 . 1 228 228 GLY N N 15 107.32 0.5 . 1 . . . . A 216 GLY N . 36514 1 993 . 1 . 1 229 229 ILE C C 13 177.25 0.3 . 1 . . . . A 217 ILE C . 36514 1 994 . 1 . 1 229 229 ILE CA C 13 65.81 0.3 . 1 . . . . A 217 ILE CA . 36514 1 995 . 1 . 1 229 229 ILE CB C 13 37.92 0.3 . 1 . . . . A 217 ILE CB . 36514 1 996 . 1 . 1 229 229 ILE CG1 C 13 30.05 0.3 . 1 . . . . A 217 ILE CG1 . 36514 1 997 . 1 . 1 229 229 ILE CG2 C 13 17.01 0.3 . 1 . . . . A 217 ILE CG2 . 36514 1 998 . 1 . 1 229 229 ILE CD1 C 13 14.87 0.3 . 1 . . . . A 217 ILE CD1 . 36514 1 999 . 1 . 1 229 229 ILE N N 15 121.51 0.5 . 1 . . . . A 217 ILE N . 36514 1 1000 . 1 . 1 230 230 ILE C C 13 177.94 0.3 . 1 . . . . A 218 ILE C . 36514 1 1001 . 1 . 1 230 230 ILE CA C 13 66.08 0.3 . 1 . . . . A 218 ILE CA . 36514 1 1002 . 1 . 1 230 230 ILE CB C 13 37.43 0.3 . 1 . . . . A 218 ILE CB . 36514 1 1003 . 1 . 1 230 230 ILE CG1 C 13 30.32 0.3 . 1 . . . . A 218 ILE CG1 . 36514 1 1004 . 1 . 1 230 230 ILE CG2 C 13 16.83 0.3 . 1 . . . . A 218 ILE CG2 . 36514 1 1005 . 1 . 1 230 230 ILE CD1 C 13 14.06 0.3 . 1 . . . . A 218 ILE CD1 . 36514 1 1006 . 1 . 1 230 230 ILE N N 15 118.96 0.5 . 1 . . . . A 218 ILE N . 36514 1 1007 . 1 . 1 231 231 GLY C C 13 176.50 0.3 . 1 . . . . A 219 GLY C . 36514 1 1008 . 1 . 1 231 231 GLY CA C 13 47.98 0.3 . 1 . . . . A 219 GLY CA . 36514 1 1009 . 1 . 1 231 231 GLY N N 15 105.90 0.5 . 1 . . . . A 219 GLY N . 36514 1 1010 . 1 . 1 232 232 GLY C C 13 175.06 0.3 . 1 . . . . A 220 GLY C . 36514 1 1011 . 1 . 1 232 232 GLY CA C 13 47.93 0.3 . 1 . . . . A 220 GLY CA . 36514 1 1012 . 1 . 1 232 232 GLY N N 15 105.45 0.5 . 1 . . . . A 220 GLY N . 36514 1 1013 . 1 . 1 233 233 LEU C C 13 177.52 0.3 . 1 . . . . A 221 LEU C . 36514 1 1014 . 1 . 1 233 233 LEU CA C 13 57.45 0.3 . 1 . . . . A 221 LEU CA . 36514 1 1015 . 1 . 1 233 233 LEU CB C 13 41.86 0.3 . 1 . . . . A 221 LEU CB . 36514 1 1016 . 1 . 1 233 233 LEU CG C 13 26.34 0.3 . 1 . . . . A 221 LEU CG . 36514 1 1017 . 1 . 1 233 233 LEU CD1 C 13 23.02 0.3 . . . . . . A 221 LEU CD1 . 36514 1 1018 . 1 . 1 233 233 LEU CD2 C 13 21.72 0.3 . . . . . . A 221 LEU CD2 . 36514 1 1019 . 1 . 1 233 233 LEU N N 15 119.04 0.5 . 1 . . . . A 221 LEU N . 36514 1 1020 . 1 . 1 234 234 ILE C C 13 178.48 0.3 . 1 . . . . A 222 ILE C . 36514 1 1021 . 1 . 1 234 234 ILE CA C 13 61.79 0.3 . 1 . . . . A 222 ILE CA . 36514 1 1022 . 1 . 1 234 234 ILE CB C 13 37.62 0.3 . 1 . . . . A 222 ILE CB . 36514 1 1023 . 1 . 1 234 234 ILE CG1 C 13 26.39 0.3 . 1 . . . . A 222 ILE CG1 . 36514 1 1024 . 1 . 1 234 234 ILE CG2 C 13 18.11 0.3 . 1 . . . . A 222 ILE CG2 . 36514 1 1025 . 1 . 1 234 234 ILE N N 15 122.49 0.5 . 1 . . . . A 222 ILE N . 36514 1 1026 . 1 . 1 235 235 TYR C C 13 178.41 0.3 . 1 . . . . A 223 TYR C . 36514 1 1027 . 1 . 1 235 235 TYR CA C 13 57.44 0.3 . 1 . . . . A 223 TYR CA . 36514 1 1028 . 1 . 1 235 235 TYR CB C 13 37.57 0.3 . 1 . . . . A 223 TYR CB . 36514 1 1029 . 1 . 1 235 235 TYR CD1 C 13 132.52 0.3 . . . . . . A 223 TYR CD1 . 36514 1 1030 . 1 . 1 235 235 TYR CD2 C 13 129.91 0.3 . . . . . . A 223 TYR CD2 . 36514 1 1031 . 1 . 1 235 235 TYR N N 15 120.80 0.5 . 1 . . . . A 223 TYR N . 36514 1 1032 . 1 . 1 236 236 ARG C C 13 178.97 0.3 . 1 . . . . A 224 ARG C . 36514 1 1033 . 1 . 1 236 236 ARG CA C 13 57.54 0.3 . 1 . . . . A 224 ARG CA . 36514 1 1034 . 1 . 1 236 236 ARG CB C 13 28.25 0.3 . 1 . . . . A 224 ARG CB . 36514 1 1035 . 1 . 1 236 236 ARG CG C 13 26.23 0.3 . 1 . . . . A 224 ARG CG . 36514 1 1036 . 1 . 1 236 236 ARG CD C 13 43.61 0.3 . 1 . . . . A 224 ARG CD . 36514 1 1037 . 1 . 1 236 236 ARG N N 15 120.91 0.5 . 1 . . . . A 224 ARG N . 36514 1 1038 . 1 . 1 236 236 ARG NH1 N 15 70.23 0.5 . . . . . . A 224 ARG NH1 . 36514 1 1039 . 1 . 1 237 237 THR C C 13 175.99 0.3 . 1 . . . . A 225 THR C . 36514 1 1040 . 1 . 1 237 237 THR CA C 13 62.25 0.3 . 1 . . . . A 225 THR CA . 36514 1 1041 . 1 . 1 237 237 THR CB C 13 63.14 0.3 . 1 . . . . A 225 THR CB . 36514 1 1042 . 1 . 1 237 237 THR CG2 C 13 19.51 0.3 . 1 . . . . A 225 THR CG2 . 36514 1 1043 . 1 . 1 237 237 THR N N 15 115.36 0.5 . 1 . . . . A 225 THR N . 36514 1 1044 . 1 . 1 238 238 LEU C C 13 176.49 0.3 . 1 . . . . A 226 LEU C . 36514 1 1045 . 1 . 1 238 238 LEU CA C 13 58.25 0.3 . 1 . . . . A 226 LEU CA . 36514 1 1046 . 1 . 1 238 238 LEU CB C 13 41.04 0.3 . 1 . . . . A 226 LEU CB . 36514 1 1047 . 1 . 1 238 238 LEU CG C 13 27.55 0.3 . 1 . . . . A 226 LEU CG . 36514 1 1048 . 1 . 1 238 238 LEU CD1 C 13 22.42 0.3 . . . . . . A 226 LEU CD1 . 36514 1 1049 . 1 . 1 238 238 LEU N N 15 123.47 0.5 . 1 . . . . A 226 LEU N . 36514 1 1050 . 1 . 1 239 239 LEU C C 13 176.68 0.3 . 1 . . . . A 227 LEU C . 36514 1 1051 . 1 . 1 239 239 LEU CA C 13 57.33 0.3 . 1 . . . . A 227 LEU CA . 36514 1 1052 . 1 . 1 239 239 LEU CB C 13 41.16 0.3 . 1 . . . . A 227 LEU CB . 36514 1 1053 . 1 . 1 239 239 LEU N N 15 117.39 0.5 . 1 . . . . A 227 LEU N . 36514 1 1054 . 1 . 1 240 240 GLU C C 13 180.14 0.3 . 1 . . . . A 228 GLU C . 36514 1 1055 . 1 . 1 240 240 GLU CA C 13 60.06 0.3 . 1 . . . . A 228 GLU CA . 36514 1 1056 . 1 . 1 240 240 GLU CB C 13 32.37 0.3 . 1 . . . . A 228 GLU CB . 36514 1 1057 . 1 . 1 240 240 GLU CG C 13 29.07 0.3 . 1 . . . . A 228 GLU CG . 36514 1 1058 . 1 . 1 240 240 GLU N N 15 120.46 0.5 . 1 . . . . A 228 GLU N . 36514 1 1059 . 1 . 1 241 241 LYS C C 13 178.21 0.3 . 1 . . . . A 229 LYS C . 36514 1 1060 . 1 . 1 241 241 LYS CA C 13 59.12 0.3 . 1 . . . . A 229 LYS CA . 36514 1 1061 . 1 . 1 241 241 LYS CB C 13 31.86 0.3 . 1 . . . . A 229 LYS CB . 36514 1 1062 . 1 . 1 241 241 LYS CD C 13 26.36 0.3 . 1 . . . . A 229 LYS CD . 36514 1 1063 . 1 . 1 241 241 LYS CE C 13 43.45 0.3 . 1 . . . . A 229 LYS CE . 36514 1 1064 . 1 . 1 241 241 LYS N N 15 122.82 0.5 . 1 . . . . A 229 LYS N . 36514 1 1065 . 1 . 1 242 242 ARG C C 13 177.95 0.3 . 1 . . . . A 230 ARG C . 36514 1 1066 . 1 . 1 242 242 ARG CA C 13 56.88 0.3 . 1 . . . . A 230 ARG CA . 36514 1 1067 . 1 . 1 242 242 ARG CB C 13 30.75 0.3 . 1 . . . . A 230 ARG CB . 36514 1 1068 . 1 . 1 242 242 ARG CG C 13 26.21 0.3 . 1 . . . . A 230 ARG CG . 36514 1 1069 . 1 . 1 242 242 ARG CD C 13 41.99 0.3 . 1 . . . . A 230 ARG CD . 36514 1 1070 . 1 . 1 242 242 ARG N N 15 115.51 0.5 . 1 . . . . A 230 ARG N . 36514 1 1071 . 1 . 1 243 243 ASP C C 13 178.64 0.3 . 1 . . . . A 231 ASP C . 36514 1 1072 . 1 . 1 243 243 ASP CA C 13 58.69 0.3 . 1 . . . . A 231 ASP CA . 36514 1 1073 . 1 . 1 243 243 ASP CB C 13 40.80 0.3 . 1 . . . . A 231 ASP CB . 36514 1 1074 . 1 . 1 243 243 ASP N N 15 119.19 0.5 . 1 . . . . A 231 ASP N . 36514 1 stop_ save_