data_50125 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50125 _Entry.Title ; VDAC E73V assignment in DHPC7 micelles ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-12-12 _Entry.Accession_date 2019-12-12 _Entry.Last_release_date 2019-12-12 _Entry.Original_release_date 2019-12-12 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'VDAC E73V assignment in DHPC7 micelles' _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 Bibow Stefan . . . . 50125 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University Basel' . 50125 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50125 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 249 50125 '1H chemical shifts' 249 50125 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2020-07-26 2019-12-13 update BMRB 'update entry citation' 50125 1 . . 2020-01-24 2019-12-13 original author 'original release' 50125 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 28053 'VDAC E73V mutant in MSP1D1 nanodiscs' 50125 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50125 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32378880 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Detergent Titration as an Efficient Method for NMR Resonance Assignments of Membrane Proteins in Lipid-Bilayer Nanodiscs ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Anal. Chem.' _Citation.Journal_name_full 'Analytical chemistry' _Citation.Journal_volume 92 _Citation.Journal_issue 11 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-6882 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 7786 _Citation.Page_last 7793 _Citation.Year 2020 _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 Bibow Stefan . . . . 50125 1 2 Boehm Raphael . . . . 50125 1 3 Modaresi 'Seyed Majed' . . . . 50125 1 4 Hiller Sebastian . . . . 50125 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50125 _Assembly.ID 1 _Assembly.Name VDAC-E73V _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 VDAC-E73V 1 $entity_1 . . yes native no no . . . 50125 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50125 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAVPPTYADLGKSARDVFTK GYGFGLIKLDLKTKSENGLE FTSSGSANTETTKVTGSLET KYRWTEYGLTFTVKWNTDNT LGTEITVEDQLARGLKLTFD SSFSPNTGKKNAKIKTGYKR EHINLGCDMDFDIAGPSIRG ALVLGYEGWLAGYQMNFETA KSRVTQSNFAVGYKTDEFQL HTNVNDGTEFGGSIYQKVNK KLETAVNLAWTAGNSNTRFG IAAKYQIDPDACFSAKVNNS SLIGLGYTQTLKPGIKLTLS ALLDGKNVNAGGHKLGLGLE FQALEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 291 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state reduced _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation E73V _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 50125 1 2 . ALA . 50125 1 3 . VAL . 50125 1 4 . PRO . 50125 1 5 . PRO . 50125 1 6 . THR . 50125 1 7 . TYR . 50125 1 8 . ALA . 50125 1 9 . ASP . 50125 1 10 . LEU . 50125 1 11 . GLY . 50125 1 12 . LYS . 50125 1 13 . SER . 50125 1 14 . ALA . 50125 1 15 . ARG . 50125 1 16 . ASP . 50125 1 17 . VAL . 50125 1 18 . PHE . 50125 1 19 . THR . 50125 1 20 . LYS . 50125 1 21 . GLY . 50125 1 22 . TYR . 50125 1 23 . GLY . 50125 1 24 . PHE . 50125 1 25 . GLY . 50125 1 26 . LEU . 50125 1 27 . ILE . 50125 1 28 . LYS . 50125 1 29 . LEU . 50125 1 30 . ASP . 50125 1 31 . LEU . 50125 1 32 . LYS . 50125 1 33 . THR . 50125 1 34 . LYS . 50125 1 35 . SER . 50125 1 36 . GLU . 50125 1 37 . ASN . 50125 1 38 . GLY . 50125 1 39 . LEU . 50125 1 40 . GLU . 50125 1 41 . PHE . 50125 1 42 . THR . 50125 1 43 . SER . 50125 1 44 . SER . 50125 1 45 . GLY . 50125 1 46 . SER . 50125 1 47 . ALA . 50125 1 48 . ASN . 50125 1 49 . THR . 50125 1 50 . GLU . 50125 1 51 . THR . 50125 1 52 . THR . 50125 1 53 . LYS . 50125 1 54 . VAL . 50125 1 55 . THR . 50125 1 56 . GLY . 50125 1 57 . SER . 50125 1 58 . LEU . 50125 1 59 . GLU . 50125 1 60 . THR . 50125 1 61 . LYS . 50125 1 62 . TYR . 50125 1 63 . ARG . 50125 1 64 . TRP . 50125 1 65 . THR . 50125 1 66 . GLU . 50125 1 67 . TYR . 50125 1 68 . GLY . 50125 1 69 . LEU . 50125 1 70 . THR . 50125 1 71 . PHE . 50125 1 72 . THR . 50125 1 73 . VAL . 50125 1 74 . LYS . 50125 1 75 . TRP . 50125 1 76 . ASN . 50125 1 77 . THR . 50125 1 78 . ASP . 50125 1 79 . ASN . 50125 1 80 . THR . 50125 1 81 . LEU . 50125 1 82 . GLY . 50125 1 83 . THR . 50125 1 84 . GLU . 50125 1 85 . ILE . 50125 1 86 . THR . 50125 1 87 . VAL . 50125 1 88 . GLU . 50125 1 89 . ASP . 50125 1 90 . GLN . 50125 1 91 . LEU . 50125 1 92 . ALA . 50125 1 93 . ARG . 50125 1 94 . GLY . 50125 1 95 . LEU . 50125 1 96 . LYS . 50125 1 97 . LEU . 50125 1 98 . THR . 50125 1 99 . PHE . 50125 1 100 . ASP . 50125 1 101 . SER . 50125 1 102 . SER . 50125 1 103 . PHE . 50125 1 104 . SER . 50125 1 105 . PRO . 50125 1 106 . ASN . 50125 1 107 . THR . 50125 1 108 . GLY . 50125 1 109 . LYS . 50125 1 110 . LYS . 50125 1 111 . ASN . 50125 1 112 . ALA . 50125 1 113 . LYS . 50125 1 114 . ILE . 50125 1 115 . LYS . 50125 1 116 . THR . 50125 1 117 . GLY . 50125 1 118 . TYR . 50125 1 119 . LYS . 50125 1 120 . ARG . 50125 1 121 . GLU . 50125 1 122 . HIS . 50125 1 123 . ILE . 50125 1 124 . ASN . 50125 1 125 . LEU . 50125 1 126 . GLY . 50125 1 127 . CYS . 50125 1 128 . ASP . 50125 1 129 . MET . 50125 1 130 . ASP . 50125 1 131 . PHE . 50125 1 132 . ASP . 50125 1 133 . ILE . 50125 1 134 . ALA . 50125 1 135 . GLY . 50125 1 136 . PRO . 50125 1 137 . SER . 50125 1 138 . ILE . 50125 1 139 . ARG . 50125 1 140 . GLY . 50125 1 141 . ALA . 50125 1 142 . LEU . 50125 1 143 . VAL . 50125 1 144 . LEU . 50125 1 145 . GLY . 50125 1 146 . TYR . 50125 1 147 . GLU . 50125 1 148 . GLY . 50125 1 149 . TRP . 50125 1 150 . LEU . 50125 1 151 . ALA . 50125 1 152 . GLY . 50125 1 153 . TYR . 50125 1 154 . GLN . 50125 1 155 . MET . 50125 1 156 . ASN . 50125 1 157 . PHE . 50125 1 158 . GLU . 50125 1 159 . THR . 50125 1 160 . ALA . 50125 1 161 . LYS . 50125 1 162 . SER . 50125 1 163 . ARG . 50125 1 164 . VAL . 50125 1 165 . THR . 50125 1 166 . GLN . 50125 1 167 . SER . 50125 1 168 . ASN . 50125 1 169 . PHE . 50125 1 170 . ALA . 50125 1 171 . VAL . 50125 1 172 . GLY . 50125 1 173 . TYR . 50125 1 174 . LYS . 50125 1 175 . THR . 50125 1 176 . ASP . 50125 1 177 . GLU . 50125 1 178 . PHE . 50125 1 179 . GLN . 50125 1 180 . LEU . 50125 1 181 . HIS . 50125 1 182 . THR . 50125 1 183 . ASN . 50125 1 184 . VAL . 50125 1 185 . ASN . 50125 1 186 . ASP . 50125 1 187 . GLY . 50125 1 188 . THR . 50125 1 189 . GLU . 50125 1 190 . PHE . 50125 1 191 . GLY . 50125 1 192 . GLY . 50125 1 193 . SER . 50125 1 194 . ILE . 50125 1 195 . TYR . 50125 1 196 . GLN . 50125 1 197 . LYS . 50125 1 198 . VAL . 50125 1 199 . ASN . 50125 1 200 . LYS . 50125 1 201 . LYS . 50125 1 202 . LEU . 50125 1 203 . GLU . 50125 1 204 . THR . 50125 1 205 . ALA . 50125 1 206 . VAL . 50125 1 207 . ASN . 50125 1 208 . LEU . 50125 1 209 . ALA . 50125 1 210 . TRP . 50125 1 211 . THR . 50125 1 212 . ALA . 50125 1 213 . GLY . 50125 1 214 . ASN . 50125 1 215 . SER . 50125 1 216 . ASN . 50125 1 217 . THR . 50125 1 218 . ARG . 50125 1 219 . PHE . 50125 1 220 . GLY . 50125 1 221 . ILE . 50125 1 222 . ALA . 50125 1 223 . ALA . 50125 1 224 . LYS . 50125 1 225 . TYR . 50125 1 226 . GLN . 50125 1 227 . ILE . 50125 1 228 . ASP . 50125 1 229 . PRO . 50125 1 230 . ASP . 50125 1 231 . ALA . 50125 1 232 . CYS . 50125 1 233 . PHE . 50125 1 234 . SER . 50125 1 235 . ALA . 50125 1 236 . LYS . 50125 1 237 . VAL . 50125 1 238 . ASN . 50125 1 239 . ASN . 50125 1 240 . SER . 50125 1 241 . SER . 50125 1 242 . LEU . 50125 1 243 . ILE . 50125 1 244 . GLY . 50125 1 245 . LEU . 50125 1 246 . GLY . 50125 1 247 . TYR . 50125 1 248 . THR . 50125 1 249 . GLN . 50125 1 250 . THR . 50125 1 251 . LEU . 50125 1 252 . LYS . 50125 1 253 . PRO . 50125 1 254 . GLY . 50125 1 255 . ILE . 50125 1 256 . LYS . 50125 1 257 . LEU . 50125 1 258 . THR . 50125 1 259 . LEU . 50125 1 260 . SER . 50125 1 261 . ALA . 50125 1 262 . LEU . 50125 1 263 . LEU . 50125 1 264 . ASP . 50125 1 265 . GLY . 50125 1 266 . LYS . 50125 1 267 . ASN . 50125 1 268 . VAL . 50125 1 269 . ASN . 50125 1 270 . ALA . 50125 1 271 . GLY . 50125 1 272 . GLY . 50125 1 273 . HIS . 50125 1 274 . LYS . 50125 1 275 . LEU . 50125 1 276 . GLY . 50125 1 277 . LEU . 50125 1 278 . GLY . 50125 1 279 . LEU . 50125 1 280 . GLU . 50125 1 281 . PHE . 50125 1 282 . GLN . 50125 1 283 . ALA . 50125 1 284 . LEU . 50125 1 285 . GLU . 50125 1 286 . HIS . 50125 1 287 . HIS . 50125 1 288 . HIS . 50125 1 289 . HIS . 50125 1 290 . HIS . 50125 1 291 . HIS . 50125 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 50125 1 . ALA 2 2 50125 1 . VAL 3 3 50125 1 . PRO 4 4 50125 1 . PRO 5 5 50125 1 . THR 6 6 50125 1 . TYR 7 7 50125 1 . ALA 8 8 50125 1 . ASP 9 9 50125 1 . LEU 10 10 50125 1 . GLY 11 11 50125 1 . LYS 12 12 50125 1 . SER 13 13 50125 1 . ALA 14 14 50125 1 . ARG 15 15 50125 1 . ASP 16 16 50125 1 . VAL 17 17 50125 1 . PHE 18 18 50125 1 . THR 19 19 50125 1 . LYS 20 20 50125 1 . GLY 21 21 50125 1 . TYR 22 22 50125 1 . GLY 23 23 50125 1 . PHE 24 24 50125 1 . GLY 25 25 50125 1 . LEU 26 26 50125 1 . ILE 27 27 50125 1 . LYS 28 28 50125 1 . LEU 29 29 50125 1 . ASP 30 30 50125 1 . LEU 31 31 50125 1 . LYS 32 32 50125 1 . THR 33 33 50125 1 . LYS 34 34 50125 1 . SER 35 35 50125 1 . GLU 36 36 50125 1 . ASN 37 37 50125 1 . GLY 38 38 50125 1 . LEU 39 39 50125 1 . GLU 40 40 50125 1 . PHE 41 41 50125 1 . THR 42 42 50125 1 . SER 43 43 50125 1 . SER 44 44 50125 1 . GLY 45 45 50125 1 . SER 46 46 50125 1 . ALA 47 47 50125 1 . ASN 48 48 50125 1 . THR 49 49 50125 1 . GLU 50 50 50125 1 . THR 51 51 50125 1 . THR 52 52 50125 1 . LYS 53 53 50125 1 . VAL 54 54 50125 1 . THR 55 55 50125 1 . GLY 56 56 50125 1 . SER 57 57 50125 1 . LEU 58 58 50125 1 . GLU 59 59 50125 1 . THR 60 60 50125 1 . LYS 61 61 50125 1 . TYR 62 62 50125 1 . ARG 63 63 50125 1 . TRP 64 64 50125 1 . THR 65 65 50125 1 . GLU 66 66 50125 1 . TYR 67 67 50125 1 . GLY 68 68 50125 1 . LEU 69 69 50125 1 . THR 70 70 50125 1 . PHE 71 71 50125 1 . THR 72 72 50125 1 . VAL 73 73 50125 1 . LYS 74 74 50125 1 . TRP 75 75 50125 1 . ASN 76 76 50125 1 . THR 77 77 50125 1 . ASP 78 78 50125 1 . ASN 79 79 50125 1 . THR 80 80 50125 1 . LEU 81 81 50125 1 . GLY 82 82 50125 1 . THR 83 83 50125 1 . GLU 84 84 50125 1 . ILE 85 85 50125 1 . THR 86 86 50125 1 . VAL 87 87 50125 1 . GLU 88 88 50125 1 . ASP 89 89 50125 1 . GLN 90 90 50125 1 . LEU 91 91 50125 1 . ALA 92 92 50125 1 . ARG 93 93 50125 1 . GLY 94 94 50125 1 . LEU 95 95 50125 1 . LYS 96 96 50125 1 . LEU 97 97 50125 1 . THR 98 98 50125 1 . PHE 99 99 50125 1 . ASP 100 100 50125 1 . SER 101 101 50125 1 . SER 102 102 50125 1 . PHE 103 103 50125 1 . SER 104 104 50125 1 . PRO 105 105 50125 1 . ASN 106 106 50125 1 . THR 107 107 50125 1 . GLY 108 108 50125 1 . LYS 109 109 50125 1 . LYS 110 110 50125 1 . ASN 111 111 50125 1 . ALA 112 112 50125 1 . LYS 113 113 50125 1 . ILE 114 114 50125 1 . LYS 115 115 50125 1 . THR 116 116 50125 1 . GLY 117 117 50125 1 . TYR 118 118 50125 1 . LYS 119 119 50125 1 . ARG 120 120 50125 1 . GLU 121 121 50125 1 . HIS 122 122 50125 1 . ILE 123 123 50125 1 . ASN 124 124 50125 1 . LEU 125 125 50125 1 . GLY 126 126 50125 1 . CYS 127 127 50125 1 . ASP 128 128 50125 1 . MET 129 129 50125 1 . ASP 130 130 50125 1 . PHE 131 131 50125 1 . ASP 132 132 50125 1 . ILE 133 133 50125 1 . ALA 134 134 50125 1 . GLY 135 135 50125 1 . PRO 136 136 50125 1 . SER 137 137 50125 1 . ILE 138 138 50125 1 . ARG 139 139 50125 1 . GLY 140 140 50125 1 . ALA 141 141 50125 1 . LEU 142 142 50125 1 . VAL 143 143 50125 1 . LEU 144 144 50125 1 . GLY 145 145 50125 1 . TYR 146 146 50125 1 . GLU 147 147 50125 1 . GLY 148 148 50125 1 . TRP 149 149 50125 1 . LEU 150 150 50125 1 . ALA 151 151 50125 1 . GLY 152 152 50125 1 . TYR 153 153 50125 1 . GLN 154 154 50125 1 . MET 155 155 50125 1 . ASN 156 156 50125 1 . PHE 157 157 50125 1 . GLU 158 158 50125 1 . THR 159 159 50125 1 . ALA 160 160 50125 1 . LYS 161 161 50125 1 . SER 162 162 50125 1 . ARG 163 163 50125 1 . VAL 164 164 50125 1 . THR 165 165 50125 1 . GLN 166 166 50125 1 . SER 167 167 50125 1 . ASN 168 168 50125 1 . PHE 169 169 50125 1 . ALA 170 170 50125 1 . VAL 171 171 50125 1 . GLY 172 172 50125 1 . TYR 173 173 50125 1 . LYS 174 174 50125 1 . THR 175 175 50125 1 . ASP 176 176 50125 1 . GLU 177 177 50125 1 . PHE 178 178 50125 1 . GLN 179 179 50125 1 . LEU 180 180 50125 1 . HIS 181 181 50125 1 . THR 182 182 50125 1 . ASN 183 183 50125 1 . VAL 184 184 50125 1 . ASN 185 185 50125 1 . ASP 186 186 50125 1 . GLY 187 187 50125 1 . THR 188 188 50125 1 . GLU 189 189 50125 1 . PHE 190 190 50125 1 . GLY 191 191 50125 1 . GLY 192 192 50125 1 . SER 193 193 50125 1 . ILE 194 194 50125 1 . TYR 195 195 50125 1 . GLN 196 196 50125 1 . LYS 197 197 50125 1 . VAL 198 198 50125 1 . ASN 199 199 50125 1 . LYS 200 200 50125 1 . LYS 201 201 50125 1 . LEU 202 202 50125 1 . GLU 203 203 50125 1 . THR 204 204 50125 1 . ALA 205 205 50125 1 . VAL 206 206 50125 1 . ASN 207 207 50125 1 . LEU 208 208 50125 1 . ALA 209 209 50125 1 . TRP 210 210 50125 1 . THR 211 211 50125 1 . ALA 212 212 50125 1 . GLY 213 213 50125 1 . ASN 214 214 50125 1 . SER 215 215 50125 1 . ASN 216 216 50125 1 . THR 217 217 50125 1 . ARG 218 218 50125 1 . PHE 219 219 50125 1 . GLY 220 220 50125 1 . ILE 221 221 50125 1 . ALA 222 222 50125 1 . ALA 223 223 50125 1 . LYS 224 224 50125 1 . TYR 225 225 50125 1 . GLN 226 226 50125 1 . ILE 227 227 50125 1 . ASP 228 228 50125 1 . PRO 229 229 50125 1 . ASP 230 230 50125 1 . ALA 231 231 50125 1 . CYS 232 232 50125 1 . PHE 233 233 50125 1 . SER 234 234 50125 1 . ALA 235 235 50125 1 . LYS 236 236 50125 1 . VAL 237 237 50125 1 . ASN 238 238 50125 1 . ASN 239 239 50125 1 . SER 240 240 50125 1 . SER 241 241 50125 1 . LEU 242 242 50125 1 . ILE 243 243 50125 1 . GLY 244 244 50125 1 . LEU 245 245 50125 1 . GLY 246 246 50125 1 . TYR 247 247 50125 1 . THR 248 248 50125 1 . GLN 249 249 50125 1 . THR 250 250 50125 1 . LEU 251 251 50125 1 . LYS 252 252 50125 1 . PRO 253 253 50125 1 . GLY 254 254 50125 1 . ILE 255 255 50125 1 . LYS 256 256 50125 1 . LEU 257 257 50125 1 . THR 258 258 50125 1 . LEU 259 259 50125 1 . SER 260 260 50125 1 . ALA 261 261 50125 1 . LEU 262 262 50125 1 . LEU 263 263 50125 1 . ASP 264 264 50125 1 . GLY 265 265 50125 1 . LYS 266 266 50125 1 . ASN 267 267 50125 1 . VAL 268 268 50125 1 . ASN 269 269 50125 1 . ALA 270 270 50125 1 . GLY 271 271 50125 1 . GLY 272 272 50125 1 . HIS 273 273 50125 1 . LYS 274 274 50125 1 . LEU 275 275 50125 1 . GLY 276 276 50125 1 . LEU 277 277 50125 1 . GLY 278 278 50125 1 . LEU 279 279 50125 1 . GLU 280 280 50125 1 . PHE 281 281 50125 1 . GLN 282 282 50125 1 . ALA 283 283 50125 1 . LEU 284 284 50125 1 . GLU 285 285 50125 1 . HIS 286 286 50125 1 . HIS 287 287 50125 1 . HIS 288 288 50125 1 . HIS 289 289 50125 1 . HIS 290 290 50125 1 . HIS 291 291 50125 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50125 _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 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 50125 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50125 _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' . . . Escherichia coli . . . plasmid . . pET21a . . . 50125 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50125 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 VDAC '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 0.3 . . mM . . . . 50125 1 2 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 50125 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 50125 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 50125 1 pH 7.0 . pH 50125 1 pressure 1 . atm 50125 1 temperature 310 . K 50125 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50125 _Software.ID 1 _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' . . 50125 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'recording of spectrum' 50125 1 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 50125 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 50125 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50125 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50125 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 50125 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 50125 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 50125 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 50125 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 50125 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 6 6 THR H H 1 7.477 0.00 . . . . . . . 6 THR H . 50125 1 2 . 1 . 1 6 6 THR N N 15 106.318 0.00 . . . . . . . 6 THR N . 50125 1 3 . 1 . 1 7 7 TYR H H 1 7.745 0.00 . . . . . . . 7 TYR H . 50125 1 4 . 1 . 1 7 7 TYR N N 15 122.723 0.00 . . . . . . . 7 TYR N . 50125 1 5 . 1 . 1 8 8 ALA H H 1 8.467 0.00 . . . . . . . 8 ALA H . 50125 1 6 . 1 . 1 8 8 ALA N N 15 119.349 0.00 . . . . . . . 8 ALA N . 50125 1 7 . 1 . 1 9 9 ASP H H 1 7.295 0.00 . . . . . . . 9 ASP H . 50125 1 8 . 1 . 1 9 9 ASP N N 15 115.402 0.00 . . . . . . . 9 ASP N . 50125 1 9 . 1 . 1 10 10 LEU H H 1 7.417 0.00 . . . . . . . 10 LEU H . 50125 1 10 . 1 . 1 10 10 LEU N N 15 125.466 0.00 . . . . . . . 10 LEU N . 50125 1 11 . 1 . 1 12 12 LYS H H 1 7.330 0.00 . . . . . . . 12 LYS H . 50125 1 12 . 1 . 1 12 12 LYS N N 15 122.584 0.00 . . . . . . . 12 LYS N . 50125 1 13 . 1 . 1 13 13 SER H H 1 8.178 0.00 . . . . . . . 13 SER H . 50125 1 14 . 1 . 1 13 13 SER N N 15 115.535 0.00 . . . . . . . 13 SER N . 50125 1 15 . 1 . 1 14 14 ALA H H 1 8.302 0.00 . . . . . . . 14 ALA H . 50125 1 16 . 1 . 1 14 14 ALA N N 15 122.054 0.00 . . . . . . . 14 ALA N . 50125 1 17 . 1 . 1 15 15 ARG H H 1 7.355 0.00 . . . . . . . 15 ARG H . 50125 1 18 . 1 . 1 15 15 ARG N N 15 117.471 0.00 . . . . . . . 15 ARG N . 50125 1 19 . 1 . 1 16 16 ASP H H 1 9.102 0.00 . . . . . . . 16 ASP H . 50125 1 20 . 1 . 1 16 16 ASP N N 15 122.254 0.00 . . . . . . . 16 ASP N . 50125 1 21 . 1 . 1 17 17 VAL H H 1 7.542 0.00 . . . . . . . 17 VAL H . 50125 1 22 . 1 . 1 17 17 VAL N N 15 120.411 0.00 . . . . . . . 17 VAL N . 50125 1 23 . 1 . 1 18 18 PHE H H 1 7.622 0.00 . . . . . . . 18 PHE H . 50125 1 24 . 1 . 1 18 18 PHE N N 15 116.420 0.00 . . . . . . . 18 PHE N . 50125 1 25 . 1 . 1 21 21 GLY H H 1 8.371 0.00 . . . . . . . 21 GLY H . 50125 1 26 . 1 . 1 21 21 GLY N N 15 109.883 0.00 . . . . . . . 21 GLY N . 50125 1 27 . 1 . 1 22 22 TYR H H 1 6.657 0.00 . . . . . . . 22 TYR H . 50125 1 28 . 1 . 1 22 22 TYR N N 15 113.816 0.00 . . . . . . . 22 TYR N . 50125 1 29 . 1 . 1 24 24 PHE H H 1 7.112 0.00 . . . . . . . 24 PHE H . 50125 1 30 . 1 . 1 24 24 PHE N N 15 120.726 0.00 . . . . . . . 24 PHE N . 50125 1 31 . 1 . 1 25 25 GLY H H 1 8.194 0.00 . . . . . . . 25 GLY H . 50125 1 32 . 1 . 1 25 25 GLY N N 15 110.664 0.00 . . . . . . . 25 GLY N . 50125 1 33 . 1 . 1 26 26 LEU H H 1 7.533 0.00 . . . . . . . 26 LEU H . 50125 1 34 . 1 . 1 26 26 LEU N N 15 118.369 0.00 . . . . . . . 26 LEU N . 50125 1 35 . 1 . 1 27 27 ILE H H 1 8.713 0.00 . . . . . . . 27 ILE H . 50125 1 36 . 1 . 1 27 27 ILE N N 15 120.981 0.00 . . . . . . . 27 ILE N . 50125 1 37 . 1 . 1 28 28 LYS H H 1 8.819 0.00 . . . . . . . 28 LYS H . 50125 1 38 . 1 . 1 28 28 LYS N N 15 127.096 0.00 . . . . . . . 28 LYS N . 50125 1 39 . 1 . 1 29 29 LEU H H 1 8.773 0.00 . . . . . . . 29 LEU H . 50125 1 40 . 1 . 1 29 29 LEU N N 15 124.299 0.00 . . . . . . . 29 LEU N . 50125 1 41 . 1 . 1 30 30 ASP H H 1 8.556 0.00 . . . . . . . 30 ASP H . 50125 1 42 . 1 . 1 30 30 ASP N N 15 123.749 0.00 . . . . . . . 30 ASP N . 50125 1 43 . 1 . 1 31 31 LEU H H 1 9.168 0.00 . . . . . . . 31 LEU H . 50125 1 44 . 1 . 1 31 31 LEU N N 15 123.653 0.00 . . . . . . . 31 LEU N . 50125 1 45 . 1 . 1 32 32 LYS H H 1 8.596 0.00 . . . . . . . 32 LYS H . 50125 1 46 . 1 . 1 32 32 LYS N N 15 125.077 0.00 . . . . . . . 32 LYS N . 50125 1 47 . 1 . 1 33 33 THR H H 1 9.073 0.00 . . . . . . . 33 THR H . 50125 1 48 . 1 . 1 33 33 THR N N 15 116.413 0.00 . . . . . . . 33 THR N . 50125 1 49 . 1 . 1 34 34 LYS H H 1 8.210 0.00 . . . . . . . 34 LYS H . 50125 1 50 . 1 . 1 34 34 LYS N N 15 123.705 0.00 . . . . . . . 34 LYS N . 50125 1 51 . 1 . 1 35 35 SER H H 1 8.966 0.00 . . . . . . . 35 SER H . 50125 1 52 . 1 . 1 35 35 SER N N 15 120.113 0.00 . . . . . . . 35 SER N . 50125 1 53 . 1 . 1 37 37 ASN H H 1 8.434 0.00 . . . . . . . 37 ASN H . 50125 1 54 . 1 . 1 37 37 ASN N N 15 116.238 0.00 . . . . . . . 37 ASN N . 50125 1 55 . 1 . 1 38 38 GLY H H 1 7.869 0.00 . . . . . . . 38 GLY H . 50125 1 56 . 1 . 1 38 38 GLY N N 15 106.686 0.00 . . . . . . . 38 GLY N . 50125 1 57 . 1 . 1 39 39 LEU H H 1 7.836 0.00 . . . . . . . 39 LEU H . 50125 1 58 . 1 . 1 39 39 LEU N N 15 122.675 0.00 . . . . . . . 39 LEU N . 50125 1 59 . 1 . 1 40 40 GLU H H 1 8.935 0.00 . . . . . . . 40 GLU H . 50125 1 60 . 1 . 1 40 40 GLU N N 15 124.532 0.00 . . . . . . . 40 GLU N . 50125 1 61 . 1 . 1 41 41 PHE H H 1 8.902 0.00 . . . . . . . 41 PHE H . 50125 1 62 . 1 . 1 41 41 PHE N N 15 125.126 0.00 . . . . . . . 41 PHE N . 50125 1 63 . 1 . 1 43 43 SER H H 1 9.246 0.00 . . . . . . . 43 SER H . 50125 1 64 . 1 . 1 43 43 SER N N 15 120.874 0.00 . . . . . . . 43 SER N . 50125 1 65 . 1 . 1 44 44 SER H H 1 8.650 0.00 . . . . . . . 44 SER H . 50125 1 66 . 1 . 1 44 44 SER N N 15 120.677 0.00 . . . . . . . 44 SER N . 50125 1 67 . 1 . 1 45 45 GLY H H 1 9.130 0.00 . . . . . . . 45 GLY H . 50125 1 68 . 1 . 1 45 45 GLY N N 15 111.008 0.00 . . . . . . . 45 GLY N . 50125 1 69 . 1 . 1 46 46 SER H H 1 9.136 0.00 . . . . . . . 46 SER H . 50125 1 70 . 1 . 1 46 46 SER N N 15 116.314 0.00 . . . . . . . 46 SER N . 50125 1 71 . 1 . 1 47 47 ALA H H 1 9.265 0.00 . . . . . . . 47 ALA H . 50125 1 72 . 1 . 1 47 47 ALA N N 15 124.715 0.00 . . . . . . . 47 ALA N . 50125 1 73 . 1 . 1 48 48 ASN H H 1 8.348 0.00 . . . . . . . 48 ASN H . 50125 1 74 . 1 . 1 48 48 ASN N N 15 121.422 0.00 . . . . . . . 48 ASN N . 50125 1 75 . 1 . 1 53 53 LYS H H 1 7.599 0.00 . . . . . . . 53 LYS H . 50125 1 76 . 1 . 1 53 53 LYS N N 15 120.742 0.00 . . . . . . . 53 LYS N . 50125 1 77 . 1 . 1 54 54 VAL H H 1 8.711 0.00 . . . . . . . 54 VAL H . 50125 1 78 . 1 . 1 54 54 VAL N N 15 127.063 0.00 . . . . . . . 54 VAL N . 50125 1 79 . 1 . 1 55 55 THR H H 1 8.846 0.00 . . . . . . . 55 THR H . 50125 1 80 . 1 . 1 55 55 THR N N 15 119.641 0.00 . . . . . . . 55 THR N . 50125 1 81 . 1 . 1 56 56 GLY H H 1 8.371 0.00 . . . . . . . 56 GLY H . 50125 1 82 . 1 . 1 56 56 GLY N N 15 109.883 0.00 . . . . . . . 56 GLY N . 50125 1 83 . 1 . 1 57 57 SER H H 1 9.151 0.00 . . . . . . . 57 SER H . 50125 1 84 . 1 . 1 57 57 SER N N 15 113.385 0.00 . . . . . . . 57 SER N . 50125 1 85 . 1 . 1 58 58 LEU H H 1 9.212 0.00 . . . . . . . 58 LEU H . 50125 1 86 . 1 . 1 58 58 LEU N N 15 122.511 0.00 . . . . . . . 58 LEU N . 50125 1 87 . 1 . 1 59 59 GLU H H 1 9.082 0.00 . . . . . . . 59 GLU H . 50125 1 88 . 1 . 1 59 59 GLU N N 15 123.753 0.00 . . . . . . . 59 GLU N . 50125 1 89 . 1 . 1 60 60 THR H H 1 9.116 0.00 . . . . . . . 60 THR H . 50125 1 90 . 1 . 1 60 60 THR N N 15 119.700 0.00 . . . . . . . 60 THR N . 50125 1 91 . 1 . 1 61 61 LYS H H 1 8.917 0.00 . . . . . . . 61 LYS H . 50125 1 92 . 1 . 1 61 61 LYS N N 15 126.857 0.00 . . . . . . . 61 LYS N . 50125 1 93 . 1 . 1 62 62 TYR H H 1 9.187 0.00 . . . . . . . 62 TYR H . 50125 1 94 . 1 . 1 62 62 TYR N N 15 124.810 0.00 . . . . . . . 62 TYR N . 50125 1 95 . 1 . 1 63 63 ARG H H 1 7.537 0.00 . . . . . . . 63 ARG H . 50125 1 96 . 1 . 1 63 63 ARG N N 15 126.959 0.00 . . . . . . . 63 ARG N . 50125 1 97 . 1 . 1 64 64 TRP H H 1 9.271 0.00 . . . . . . . 64 TRP H . 50125 1 98 . 1 . 1 64 64 TRP N N 15 127.808 0.00 . . . . . . . 64 TRP N . 50125 1 99 . 1 . 1 65 65 THR H H 1 8.473 0.00 . . . . . . . 65 THR H . 50125 1 100 . 1 . 1 65 65 THR N N 15 120.965 0.00 . . . . . . . 65 THR N . 50125 1 101 . 1 . 1 67 67 TYR H H 1 6.743 0.00 . . . . . . . 67 TYR H . 50125 1 102 . 1 . 1 67 67 TYR N N 15 114.215 0.00 . . . . . . . 67 TYR N . 50125 1 103 . 1 . 1 68 68 GLY H H 1 7.661 0.00 . . . . . . . 68 GLY H . 50125 1 104 . 1 . 1 68 68 GLY N N 15 106.144 0.00 . . . . . . . 68 GLY N . 50125 1 105 . 1 . 1 69 69 LEU H H 1 7.372 0.00 . . . . . . . 69 LEU H . 50125 1 106 . 1 . 1 69 69 LEU N N 15 120.740 0.00 . . . . . . . 69 LEU N . 50125 1 107 . 1 . 1 70 70 THR H H 1 9.327 0.00 . . . . . . . 70 THR H . 50125 1 108 . 1 . 1 70 70 THR N N 15 121.665 0.00 . . . . . . . 70 THR N . 50125 1 109 . 1 . 1 71 71 PHE H H 1 9.350 0.00 . . . . . . . 71 PHE H . 50125 1 110 . 1 . 1 71 71 PHE N N 15 128.069 0.00 . . . . . . . 71 PHE N . 50125 1 111 . 1 . 1 72 72 THR H H 1 8.992 0.00 . . . . . . . 72 THR H . 50125 1 112 . 1 . 1 72 72 THR N N 15 122.220 0.00 . . . . . . . 72 THR N . 50125 1 113 . 1 . 1 73 73 VAL H H 1 8.975 0.00 . . . . . . . 73 VAL H . 50125 1 114 . 1 . 1 73 73 VAL N N 15 125.663 0.00 . . . . . . . 73 VAL N . 50125 1 115 . 1 . 1 74 74 LYS H H 1 9.188 0.00 . . . . . . . 74 LYS H . 50125 1 116 . 1 . 1 74 74 LYS N N 15 126.124 0.00 . . . . . . . 74 LYS N . 50125 1 117 . 1 . 1 75 75 TRP H H 1 9.108 0.00 . . . . . . . 75 TRP H . 50125 1 118 . 1 . 1 75 75 TRP N N 15 123.759 0.00 . . . . . . . 75 TRP N . 50125 1 119 . 1 . 1 76 76 ASN H H 1 7.831 0.00 . . . . . . . 76 ASN H . 50125 1 120 . 1 . 1 76 76 ASN N N 15 122.722 0.00 . . . . . . . 76 ASN N . 50125 1 121 . 1 . 1 77 77 THR H H 1 8.230 0.00 . . . . . . . 77 THR H . 50125 1 122 . 1 . 1 77 77 THR N N 15 109.494 0.00 . . . . . . . 77 THR N . 50125 1 123 . 1 . 1 78 78 ASP H H 1 7.752 0.00 . . . . . . . 78 ASP H . 50125 1 124 . 1 . 1 78 78 ASP N N 15 121.710 0.00 . . . . . . . 78 ASP N . 50125 1 125 . 1 . 1 79 79 ASN H H 1 8.574 0.00 . . . . . . . 79 ASN H . 50125 1 126 . 1 . 1 79 79 ASN N N 15 115.730 0.00 . . . . . . . 79 ASN N . 50125 1 127 . 1 . 1 81 81 LEU H H 1 8.773 0.00 . . . . . . . 81 LEU H . 50125 1 128 . 1 . 1 81 81 LEU N N 15 128.612 0.00 . . . . . . . 81 LEU N . 50125 1 129 . 1 . 1 82 82 GLY H H 1 9.414 0.00 . . . . . . . 82 GLY H . 50125 1 130 . 1 . 1 82 82 GLY N N 15 112.665 0.00 . . . . . . . 82 GLY N . 50125 1 131 . 1 . 1 83 83 THR H H 1 8.858 0.00 . . . . . . . 83 THR H . 50125 1 132 . 1 . 1 83 83 THR N N 15 114.394 0.00 . . . . . . . 83 THR N . 50125 1 133 . 1 . 1 84 84 GLU H H 1 8.882 0.00 . . . . . . . 84 GLU H . 50125 1 134 . 1 . 1 84 84 GLU N N 15 124.493 0.00 . . . . . . . 84 GLU N . 50125 1 135 . 1 . 1 85 85 ILE H H 1 9.038 0.00 . . . . . . . 85 ILE H . 50125 1 136 . 1 . 1 85 85 ILE N N 15 125.889 0.00 . . . . . . . 85 ILE N . 50125 1 137 . 1 . 1 86 86 THR H H 1 9.124 0.00 . . . . . . . 86 THR H . 50125 1 138 . 1 . 1 86 86 THR N N 15 124.096 0.00 . . . . . . . 86 THR N . 50125 1 139 . 1 . 1 87 87 VAL H H 1 9.441 0.00 . . . . . . . 87 VAL H . 50125 1 140 . 1 . 1 87 87 VAL N N 15 124.907 0.00 . . . . . . . 87 VAL N . 50125 1 141 . 1 . 1 88 88 GLU H H 1 9.165 0.00 . . . . . . . 88 GLU H . 50125 1 142 . 1 . 1 88 88 GLU N N 15 128.335 0.00 . . . . . . . 88 GLU N . 50125 1 143 . 1 . 1 89 89 ASP H H 1 8.731 0.00 . . . . . . . 89 ASP H . 50125 1 144 . 1 . 1 89 89 ASP N N 15 118.074 0.00 . . . . . . . 89 ASP N . 50125 1 145 . 1 . 1 90 90 GLN H H 1 7.996 0.00 . . . . . . . 90 GLN H . 50125 1 146 . 1 . 1 90 90 GLN N N 15 117.936 0.00 . . . . . . . 90 GLN N . 50125 1 147 . 1 . 1 91 91 LEU H H 1 8.308 0.00 . . . . . . . 91 LEU H . 50125 1 148 . 1 . 1 91 91 LEU N N 15 118.248 0.00 . . . . . . . 91 LEU N . 50125 1 149 . 1 . 1 92 92 ALA H H 1 7.634 0.00 . . . . . . . 92 ALA H . 50125 1 150 . 1 . 1 92 92 ALA N N 15 117.416 0.00 . . . . . . . 92 ALA N . 50125 1 151 . 1 . 1 93 93 ARG H H 1 8.836 0.00 . . . . . . . 93 ARG H . 50125 1 152 . 1 . 1 93 93 ARG N N 15 123.739 0.00 . . . . . . . 93 ARG N . 50125 1 153 . 1 . 1 94 94 GLY H H 1 9.439 0.00 . . . . . . . 94 GLY H . 50125 1 154 . 1 . 1 94 94 GLY N N 15 115.305 0.00 . . . . . . . 94 GLY N . 50125 1 155 . 1 . 1 95 95 LEU H H 1 7.934 0.00 . . . . . . . 95 LEU H . 50125 1 156 . 1 . 1 95 95 LEU N N 15 122.845 0.00 . . . . . . . 95 LEU N . 50125 1 157 . 1 . 1 96 96 LYS H H 1 9.677 0.00 . . . . . . . 96 LYS H . 50125 1 158 . 1 . 1 96 96 LYS N N 15 132.053 0.00 . . . . . . . 96 LYS N . 50125 1 159 . 1 . 1 97 97 LEU H H 1 8.819 0.00 . . . . . . . 97 LEU H . 50125 1 160 . 1 . 1 97 97 LEU N N 15 127.362 0.00 . . . . . . . 97 LEU N . 50125 1 161 . 1 . 1 98 98 THR H H 1 9.205 0.00 . . . . . . . 98 THR H . 50125 1 162 . 1 . 1 98 98 THR N N 15 120.512 0.00 . . . . . . . 98 THR N . 50125 1 163 . 1 . 1 99 99 PHE H H 1 9.520 0.00 . . . . . . . 99 PHE H . 50125 1 164 . 1 . 1 99 99 PHE N N 15 127.163 0.00 . . . . . . . 99 PHE N . 50125 1 165 . 1 . 1 100 100 ASP H H 1 8.786 0.00 . . . . . . . 100 ASP H . 50125 1 166 . 1 . 1 100 100 ASP N N 15 129.283 0.00 . . . . . . . 100 ASP N . 50125 1 167 . 1 . 1 101 101 SER H H 1 8.678 0.00 . . . . . . . 101 SER H . 50125 1 168 . 1 . 1 101 101 SER N N 15 118.420 0.00 . . . . . . . 101 SER N . 50125 1 169 . 1 . 1 102 102 SER H H 1 8.696 0.00 . . . . . . . 102 SER H . 50125 1 170 . 1 . 1 102 102 SER N N 15 118.402 0.00 . . . . . . . 102 SER N . 50125 1 171 . 1 . 1 103 103 PHE H H 1 9.186 0.00 . . . . . . . 103 PHE H . 50125 1 172 . 1 . 1 103 103 PHE N N 15 121.877 0.00 . . . . . . . 103 PHE N . 50125 1 173 . 1 . 1 104 104 SER H H 1 7.933 0.00 . . . . . . . 104 SER H . 50125 1 174 . 1 . 1 104 104 SER N N 15 120.737 0.00 . . . . . . . 104 SER N . 50125 1 175 . 1 . 1 108 108 GLY H H 1 8.306 0.00 . . . . . . . 108 GLY H . 50125 1 176 . 1 . 1 108 108 GLY N N 15 112.147 0.00 . . . . . . . 108 GLY N . 50125 1 177 . 1 . 1 109 109 LYS H H 1 7.561 0.00 . . . . . . . 109 LYS H . 50125 1 178 . 1 . 1 109 109 LYS N N 15 121.067 0.00 . . . . . . . 109 LYS N . 50125 1 179 . 1 . 1 110 110 LYS H H 1 8.473 0.00 . . . . . . . 110 LYS H . 50125 1 180 . 1 . 1 110 110 LYS N N 15 124.489 0.00 . . . . . . . 110 LYS N . 50125 1 181 . 1 . 1 111 111 ASN H H 1 8.658 0.00 . . . . . . . 111 ASN H . 50125 1 182 . 1 . 1 111 111 ASN N N 15 119.888 0.00 . . . . . . . 111 ASN N . 50125 1 183 . 1 . 1 112 112 ALA H H 1 8.517 0.00 . . . . . . . 112 ALA H . 50125 1 184 . 1 . 1 112 112 ALA N N 15 124.342 0.00 . . . . . . . 112 ALA N . 50125 1 185 . 1 . 1 113 113 LYS H H 1 9.112 0.00 . . . . . . . 113 LYS H . 50125 1 186 . 1 . 1 113 113 LYS N N 15 119.700 0.00 . . . . . . . 113 LYS N . 50125 1 187 . 1 . 1 114 114 ILE H H 1 8.866 0.00 . . . . . . . 114 ILE H . 50125 1 188 . 1 . 1 114 114 ILE N N 15 120.720 0.00 . . . . . . . 114 ILE N . 50125 1 189 . 1 . 1 115 115 LYS H H 1 9.346 0.00 . . . . . . . 115 LYS H . 50125 1 190 . 1 . 1 115 115 LYS N N 15 127.050 0.00 . . . . . . . 115 LYS N . 50125 1 191 . 1 . 1 116 116 THR H H 1 8.708 0.00 . . . . . . . 116 THR H . 50125 1 192 . 1 . 1 116 116 THR N N 15 117.222 0.00 . . . . . . . 116 THR N . 50125 1 193 . 1 . 1 117 117 GLY H H 1 9.252 0.00 . . . . . . . 117 GLY H . 50125 1 194 . 1 . 1 117 117 GLY N N 15 114.081 0.00 . . . . . . . 117 GLY N . 50125 1 195 . 1 . 1 118 118 TYR H H 1 9.181 0.00 . . . . . . . 118 TYR H . 50125 1 196 . 1 . 1 118 118 TYR N N 15 123.657 0.00 . . . . . . . 118 TYR N . 50125 1 197 . 1 . 1 119 119 LYS H H 1 7.629 0.00 . . . . . . . 119 LYS H . 50125 1 198 . 1 . 1 119 119 LYS N N 15 125.264 0.00 . . . . . . . 119 LYS N . 50125 1 199 . 1 . 1 120 120 ARG H H 1 8.810 0.00 . . . . . . . 120 ARG H . 50125 1 200 . 1 . 1 120 120 ARG N N 15 118.703 0.00 . . . . . . . 120 ARG N . 50125 1 201 . 1 . 1 122 122 HIS H H 1 7.991 0.00 . . . . . . . 122 HIS H . 50125 1 202 . 1 . 1 122 122 HIS N N 15 112.540 0.00 . . . . . . . 122 HIS N . 50125 1 203 . 1 . 1 123 123 ILE H H 1 8.001 0.00 . . . . . . . 123 ILE H . 50125 1 204 . 1 . 1 123 123 ILE N N 15 118.259 0.00 . . . . . . . 123 ILE N . 50125 1 205 . 1 . 1 124 124 ASN H H 1 9.004 0.00 . . . . . . . 124 ASN H . 50125 1 206 . 1 . 1 124 124 ASN N N 15 125.500 0.00 . . . . . . . 124 ASN N . 50125 1 207 . 1 . 1 125 125 LEU H H 1 9.543 0.00 . . . . . . . 125 LEU H . 50125 1 208 . 1 . 1 125 125 LEU N N 15 129.046 0.00 . . . . . . . 125 LEU N . 50125 1 209 . 1 . 1 126 126 GLY H H 1 9.538 0.00 . . . . . . . 126 GLY H . 50125 1 210 . 1 . 1 126 126 GLY N N 15 113.577 0.00 . . . . . . . 126 GLY N . 50125 1 211 . 1 . 1 127 127 CYS H H 1 8.586 0.00 . . . . . . . 127 CYS H . 50125 1 212 . 1 . 1 127 127 CYS N N 15 121.425 0.00 . . . . . . . 127 CYS N . 50125 1 213 . 1 . 1 128 128 ASP H H 1 9.435 0.00 . . . . . . . 128 ASP H . 50125 1 214 . 1 . 1 128 128 ASP N N 15 130.245 0.00 . . . . . . . 128 ASP N . 50125 1 215 . 1 . 1 129 129 MET H H 1 9.491 0.00 . . . . . . . 129 MET H . 50125 1 216 . 1 . 1 129 129 MET N N 15 123.424 0.00 . . . . . . . 129 MET N . 50125 1 217 . 1 . 1 130 130 ASP H H 1 8.688 0.00 . . . . . . . 130 ASP H . 50125 1 218 . 1 . 1 130 130 ASP N N 15 125.249 0.00 . . . . . . . 130 ASP N . 50125 1 219 . 1 . 1 131 131 PHE H H 1 8.604 0.00 . . . . . . . 131 PHE H . 50125 1 220 . 1 . 1 131 131 PHE N N 15 123.432 0.00 . . . . . . . 131 PHE N . 50125 1 221 . 1 . 1 132 132 ASP H H 1 7.387 0.00 . . . . . . . 132 ASP H . 50125 1 222 . 1 . 1 132 132 ASP N N 15 122.823 0.00 . . . . . . . 132 ASP N . 50125 1 223 . 1 . 1 133 133 ILE H H 1 8.503 0.00 . . . . . . . 133 ILE H . 50125 1 224 . 1 . 1 133 133 ILE N N 15 124.657 0.00 . . . . . . . 133 ILE N . 50125 1 225 . 1 . 1 134 134 ALA H H 1 8.552 0.00 . . . . . . . 134 ALA H . 50125 1 226 . 1 . 1 134 134 ALA N N 15 123.691 0.00 . . . . . . . 134 ALA N . 50125 1 227 . 1 . 1 135 135 GLY H H 1 7.767 0.00 . . . . . . . 135 GLY H . 50125 1 228 . 1 . 1 135 135 GLY N N 15 106.721 0.00 . . . . . . . 135 GLY N . 50125 1 229 . 1 . 1 137 137 SER H H 1 8.886 0.00 . . . . . . . 137 SER H . 50125 1 230 . 1 . 1 137 137 SER N N 15 117.941 0.00 . . . . . . . 137 SER N . 50125 1 231 . 1 . 1 138 138 ILE H H 1 9.168 0.00 . . . . . . . 138 ILE H . 50125 1 232 . 1 . 1 138 138 ILE N N 15 122.271 0.00 . . . . . . . 138 ILE N . 50125 1 233 . 1 . 1 139 139 ARG H H 1 9.113 0.00 . . . . . . . 139 ARG H . 50125 1 234 . 1 . 1 139 139 ARG N N 15 128.596 0.00 . . . . . . . 139 ARG N . 50125 1 235 . 1 . 1 140 140 GLY H H 1 8.774 0.00 . . . . . . . 140 GLY H . 50125 1 236 . 1 . 1 140 140 GLY N N 15 113.676 0.00 . . . . . . . 140 GLY N . 50125 1 237 . 1 . 1 141 141 ALA H H 1 9.027 0.00 . . . . . . . 141 ALA H . 50125 1 238 . 1 . 1 141 141 ALA N N 15 124.284 0.00 . . . . . . . 141 ALA N . 50125 1 239 . 1 . 1 142 142 LEU H H 1 9.295 0.00 . . . . . . . 142 LEU H . 50125 1 240 . 1 . 1 142 142 LEU N N 15 123.736 0.00 . . . . . . . 142 LEU N . 50125 1 241 . 1 . 1 143 143 VAL H H 1 9.105 0.00 . . . . . . . 143 VAL H . 50125 1 242 . 1 . 1 143 143 VAL N N 15 125.484 0.00 . . . . . . . 143 VAL N . 50125 1 243 . 1 . 1 144 144 LEU H H 1 9.437 0.00 . . . . . . . 144 LEU H . 50125 1 244 . 1 . 1 144 144 LEU N N 15 126.381 0.00 . . . . . . . 144 LEU N . 50125 1 245 . 1 . 1 145 145 GLY H H 1 8.270 0.00 . . . . . . . 145 GLY H . 50125 1 246 . 1 . 1 145 145 GLY N N 15 106.103 0.00 . . . . . . . 145 GLY N . 50125 1 247 . 1 . 1 146 146 TYR H H 1 8.502 0.00 . . . . . . . 146 TYR H . 50125 1 248 . 1 . 1 146 146 TYR N N 15 123.153 0.00 . . . . . . . 146 TYR N . 50125 1 249 . 1 . 1 147 147 GLU H H 1 9.037 0.00 . . . . . . . 147 GLU H . 50125 1 250 . 1 . 1 147 147 GLU N N 15 125.826 0.00 . . . . . . . 147 GLU N . 50125 1 251 . 1 . 1 148 148 GLY H H 1 7.985 0.00 . . . . . . . 148 GLY H . 50125 1 252 . 1 . 1 148 148 GLY N N 15 107.771 0.00 . . . . . . . 148 GLY N . 50125 1 253 . 1 . 1 149 149 TRP H H 1 8.256 0.00 . . . . . . . 149 TRP H . 50125 1 254 . 1 . 1 149 149 TRP N N 15 121.056 0.00 . . . . . . . 149 TRP N . 50125 1 255 . 1 . 1 150 150 LEU H H 1 9.041 0.00 . . . . . . . 150 LEU H . 50125 1 256 . 1 . 1 150 150 LEU N N 15 123.600 0.00 . . . . . . . 150 LEU N . 50125 1 257 . 1 . 1 151 151 ALA H H 1 8.974 0.00 . . . . . . . 151 ALA H . 50125 1 258 . 1 . 1 151 151 ALA N N 15 122.152 0.00 . . . . . . . 151 ALA N . 50125 1 259 . 1 . 1 152 152 GLY H H 1 9.717 0.00 . . . . . . . 152 GLY H . 50125 1 260 . 1 . 1 152 152 GLY N N 15 108.183 0.00 . . . . . . . 152 GLY N . 50125 1 261 . 1 . 1 153 153 TYR H H 1 9.291 0.00 . . . . . . . 153 TYR H . 50125 1 262 . 1 . 1 153 153 TYR N N 15 122.629 0.00 . . . . . . . 153 TYR N . 50125 1 263 . 1 . 1 154 154 GLN H H 1 8.322 0.00 . . . . . . . 154 GLN H . 50125 1 264 . 1 . 1 154 154 GLN N N 15 128.188 0.00 . . . . . . . 154 GLN N . 50125 1 265 . 1 . 1 155 155 MET H H 1 8.860 0.00 . . . . . . . 155 MET H . 50125 1 266 . 1 . 1 155 155 MET N N 15 121.515 0.00 . . . . . . . 155 MET N . 50125 1 267 . 1 . 1 156 156 ASN H H 1 8.064 0.00 . . . . . . . 156 ASN H . 50125 1 268 . 1 . 1 156 156 ASN N N 15 119.431 0.00 . . . . . . . 156 ASN N . 50125 1 269 . 1 . 1 157 157 PHE H H 1 9.617 0.00 . . . . . . . 157 PHE H . 50125 1 270 . 1 . 1 157 157 PHE N N 15 127.913 0.00 . . . . . . . 157 PHE N . 50125 1 271 . 1 . 1 158 158 GLU H H 1 7.958 0.00 . . . . . . . 158 GLU H . 50125 1 272 . 1 . 1 158 158 GLU N N 15 127.403 0.00 . . . . . . . 158 GLU N . 50125 1 273 . 1 . 1 159 159 THR H H 1 7.737 0.00 . . . . . . . 159 THR H . 50125 1 274 . 1 . 1 159 159 THR N N 15 117.813 0.00 . . . . . . . 159 THR N . 50125 1 275 . 1 . 1 160 160 ALA H H 1 9.154 0.00 . . . . . . . 160 ALA H . 50125 1 276 . 1 . 1 160 160 ALA N N 15 125.592 0.00 . . . . . . . 160 ALA N . 50125 1 277 . 1 . 1 162 162 SER H H 1 7.598 0.00 . . . . . . . 162 SER H . 50125 1 278 . 1 . 1 162 162 SER N N 15 114.855 0.00 . . . . . . . 162 SER N . 50125 1 279 . 1 . 1 163 163 ARG H H 1 6.774 0.00 . . . . . . . 163 ARG H . 50125 1 280 . 1 . 1 163 163 ARG N N 15 114.632 0.00 . . . . . . . 163 ARG N . 50125 1 281 . 1 . 1 164 164 VAL H H 1 8.794 0.00 . . . . . . . 164 VAL H . 50125 1 282 . 1 . 1 164 164 VAL N N 15 123.834 0.00 . . . . . . . 164 VAL N . 50125 1 283 . 1 . 1 165 165 THR H H 1 8.768 0.00 . . . . . . . 165 THR H . 50125 1 284 . 1 . 1 165 165 THR N N 15 119.120 0.00 . . . . . . . 165 THR N . 50125 1 285 . 1 . 1 166 166 GLN H H 1 7.501 0.00 . . . . . . . 166 GLN H . 50125 1 286 . 1 . 1 166 166 GLN N N 15 121.439 0.00 . . . . . . . 166 GLN N . 50125 1 287 . 1 . 1 167 167 SER H H 1 8.447 0.00 . . . . . . . 167 SER H . 50125 1 288 . 1 . 1 167 167 SER N N 15 119.208 0.00 . . . . . . . 167 SER N . 50125 1 289 . 1 . 1 168 168 ASN H H 1 9.155 0.00 . . . . . . . 168 ASN H . 50125 1 290 . 1 . 1 168 168 ASN N N 15 126.272 0.00 . . . . . . . 168 ASN N . 50125 1 291 . 1 . 1 169 169 PHE H H 1 8.678 0.00 . . . . . . . 169 PHE H . 50125 1 292 . 1 . 1 169 169 PHE N N 15 118.259 0.00 . . . . . . . 169 PHE N . 50125 1 293 . 1 . 1 170 170 ALA H H 1 8.907 0.00 . . . . . . . 170 ALA H . 50125 1 294 . 1 . 1 170 170 ALA N N 15 122.689 0.00 . . . . . . . 170 ALA N . 50125 1 295 . 1 . 1 171 171 VAL H H 1 8.344 0.00 . . . . . . . 171 VAL H . 50125 1 296 . 1 . 1 171 171 VAL N N 15 117.383 0.00 . . . . . . . 171 VAL N . 50125 1 297 . 1 . 1 172 172 GLY H H 1 9.554 0.00 . . . . . . . 172 GLY H . 50125 1 298 . 1 . 1 172 172 GLY N N 15 113.616 0.00 . . . . . . . 172 GLY N . 50125 1 299 . 1 . 1 173 173 TYR H H 1 8.658 0.00 . . . . . . . 173 TYR H . 50125 1 300 . 1 . 1 173 173 TYR N N 15 119.888 0.00 . . . . . . . 173 TYR N . 50125 1 301 . 1 . 1 174 174 LYS H H 1 8.762 0.00 . . . . . . . 174 LYS H . 50125 1 302 . 1 . 1 174 174 LYS N N 15 129.337 0.00 . . . . . . . 174 LYS N . 50125 1 303 . 1 . 1 175 175 THR H H 1 8.710 0.00 . . . . . . . 175 THR H . 50125 1 304 . 1 . 1 175 175 THR N N 15 118.179 0.00 . . . . . . . 175 THR N . 50125 1 305 . 1 . 1 177 177 GLU H H 1 8.167 0.00 . . . . . . . 177 GLU H . 50125 1 306 . 1 . 1 177 177 GLU N N 15 114.868 0.00 . . . . . . . 177 GLU N . 50125 1 307 . 1 . 1 178 178 PHE H H 1 7.608 0.00 . . . . . . . 178 PHE H . 50125 1 308 . 1 . 1 178 178 PHE N N 15 120.049 0.00 . . . . . . . 178 PHE N . 50125 1 309 . 1 . 1 179 179 GLN H H 1 8.886 0.00 . . . . . . . 179 GLN H . 50125 1 310 . 1 . 1 179 179 GLN N N 15 121.568 0.00 . . . . . . . 179 GLN N . 50125 1 311 . 1 . 1 180 180 LEU H H 1 9.465 0.00 . . . . . . . 180 LEU H . 50125 1 312 . 1 . 1 180 180 LEU N N 15 127.756 0.00 . . . . . . . 180 LEU N . 50125 1 313 . 1 . 1 181 181 HIS H H 1 9.217 0.00 . . . . . . . 181 HIS H . 50125 1 314 . 1 . 1 181 181 HIS N N 15 128.539 0.00 . . . . . . . 181 HIS N . 50125 1 315 . 1 . 1 183 183 ASN H H 1 8.906 0.00 . . . . . . . 183 ASN H . 50125 1 316 . 1 . 1 183 183 ASN N N 15 117.157 0.00 . . . . . . . 183 ASN N . 50125 1 317 . 1 . 1 184 184 VAL H H 1 9.000 0.00 . . . . . . . 184 VAL H . 50125 1 318 . 1 . 1 184 184 VAL N N 15 118.719 0.00 . . . . . . . 184 VAL N . 50125 1 319 . 1 . 1 185 185 ASN H H 1 9.346 0.00 . . . . . . . 185 ASN H . 50125 1 320 . 1 . 1 185 185 ASN N N 15 129.061 0.00 . . . . . . . 185 ASN N . 50125 1 321 . 1 . 1 186 186 ASP H H 1 9.114 0.00 . . . . . . . 186 ASP H . 50125 1 322 . 1 . 1 186 186 ASP N N 15 125.812 0.00 . . . . . . . 186 ASP N . 50125 1 323 . 1 . 1 187 187 GLY H H 1 8.697 0.00 . . . . . . . 187 GLY H . 50125 1 324 . 1 . 1 187 187 GLY N N 15 105.664 0.00 . . . . . . . 187 GLY N . 50125 1 325 . 1 . 1 188 188 THR H H 1 7.721 0.00 . . . . . . . 188 THR H . 50125 1 326 . 1 . 1 188 188 THR N N 15 109.565 0.00 . . . . . . . 188 THR N . 50125 1 327 . 1 . 1 189 189 GLU H H 1 7.382 0.00 . . . . . . . 189 GLU H . 50125 1 328 . 1 . 1 189 189 GLU N N 15 123.288 0.00 . . . . . . . 189 GLU N . 50125 1 329 . 1 . 1 190 190 PHE H H 1 8.919 0.00 . . . . . . . 190 PHE H . 50125 1 330 . 1 . 1 190 190 PHE N N 15 125.955 0.00 . . . . . . . 190 PHE N . 50125 1 331 . 1 . 1 191 191 GLY H H 1 8.504 0.00 . . . . . . . 191 GLY H . 50125 1 332 . 1 . 1 191 191 GLY N N 15 110.995 0.00 . . . . . . . 191 GLY N . 50125 1 333 . 1 . 1 192 192 GLY H H 1 8.689 0.00 . . . . . . . 192 GLY H . 50125 1 334 . 1 . 1 192 192 GLY N N 15 105.946 0.00 . . . . . . . 192 GLY N . 50125 1 335 . 1 . 1 193 193 SER H H 1 9.823 0.00 . . . . . . . 193 SER H . 50125 1 336 . 1 . 1 193 193 SER N N 15 114.955 0.00 . . . . . . . 193 SER N . 50125 1 337 . 1 . 1 194 194 ILE H H 1 8.831 0.00 . . . . . . . 194 ILE H . 50125 1 338 . 1 . 1 194 194 ILE N N 15 119.187 0.00 . . . . . . . 194 ILE N . 50125 1 339 . 1 . 1 195 195 TYR H H 1 8.868 0.00 . . . . . . . 195 TYR H . 50125 1 340 . 1 . 1 195 195 TYR N N 15 127.756 0.00 . . . . . . . 195 TYR N . 50125 1 341 . 1 . 1 196 196 GLN H H 1 8.399 0.00 . . . . . . . 196 GLN H . 50125 1 342 . 1 . 1 196 196 GLN N N 15 125.917 0.00 . . . . . . . 196 GLN N . 50125 1 343 . 1 . 1 197 197 LYS H H 1 8.645 0.00 . . . . . . . 197 LYS H . 50125 1 344 . 1 . 1 197 197 LYS N N 15 129.337 0.00 . . . . . . . 197 LYS N . 50125 1 345 . 1 . 1 198 198 VAL H H 1 8.409 0.00 . . . . . . . 198 VAL H . 50125 1 346 . 1 . 1 198 198 VAL N N 15 130.478 0.00 . . . . . . . 198 VAL N . 50125 1 347 . 1 . 1 202 202 LEU H H 1 7.612 0.00 . . . . . . . 202 LEU H . 50125 1 348 . 1 . 1 202 202 LEU N N 15 122.668 0.00 . . . . . . . 202 LEU N . 50125 1 349 . 1 . 1 203 203 GLU H H 1 8.856 0.00 . . . . . . . 203 GLU H . 50125 1 350 . 1 . 1 203 203 GLU N N 15 125.608 0.00 . . . . . . . 203 GLU N . 50125 1 351 . 1 . 1 204 204 THR H H 1 8.703 0.00 . . . . . . . 204 THR H . 50125 1 352 . 1 . 1 204 204 THR N N 15 112.696 0.00 . . . . . . . 204 THR N . 50125 1 353 . 1 . 1 205 205 ALA H H 1 9.075 0.00 . . . . . . . 205 ALA H . 50125 1 354 . 1 . 1 205 205 ALA N N 15 122.245 0.00 . . . . . . . 205 ALA N . 50125 1 355 . 1 . 1 206 206 VAL H H 1 9.035 0.00 . . . . . . . 206 VAL H . 50125 1 356 . 1 . 1 206 206 VAL N N 15 117.221 0.00 . . . . . . . 206 VAL N . 50125 1 357 . 1 . 1 207 207 ASN H H 1 8.930 0.00 . . . . . . . 207 ASN H . 50125 1 358 . 1 . 1 207 207 ASN N N 15 123.181 0.00 . . . . . . . 207 ASN N . 50125 1 359 . 1 . 1 208 208 LEU H H 1 8.844 0.00 . . . . . . . 208 LEU H . 50125 1 360 . 1 . 1 208 208 LEU N N 15 122.219 0.00 . . . . . . . 208 LEU N . 50125 1 361 . 1 . 1 209 209 ALA H H 1 9.237 0.00 . . . . . . . 209 ALA H . 50125 1 362 . 1 . 1 209 209 ALA N N 15 126.585 0.00 . . . . . . . 209 ALA N . 50125 1 363 . 1 . 1 210 210 TRP H H 1 8.973 0.00 . . . . . . . 210 TRP H . 50125 1 364 . 1 . 1 210 210 TRP N N 15 121.575 0.00 . . . . . . . 210 TRP N . 50125 1 365 . 1 . 1 211 211 THR H H 1 8.502 0.00 . . . . . . . 211 THR H . 50125 1 366 . 1 . 1 211 211 THR N N 15 120.899 0.00 . . . . . . . 211 THR N . 50125 1 367 . 1 . 1 212 212 ALA H H 1 8.689 0.00 . . . . . . . 212 ALA H . 50125 1 368 . 1 . 1 212 212 ALA N N 15 127.246 0.00 . . . . . . . 212 ALA N . 50125 1 369 . 1 . 1 213 213 GLY H H 1 8.559 0.00 . . . . . . . 213 GLY H . 50125 1 370 . 1 . 1 213 213 GLY N N 15 110.370 0.00 . . . . . . . 213 GLY N . 50125 1 371 . 1 . 1 214 214 ASN H H 1 8.039 0.00 . . . . . . . 214 ASN H . 50125 1 372 . 1 . 1 214 214 ASN N N 15 119.259 0.00 . . . . . . . 214 ASN N . 50125 1 373 . 1 . 1 216 216 ASN H H 1 8.401 0.00 . . . . . . . 216 ASN H . 50125 1 374 . 1 . 1 216 216 ASN N N 15 120.621 0.00 . . . . . . . 216 ASN N . 50125 1 375 . 1 . 1 217 217 THR H H 1 8.456 0.00 . . . . . . . 217 THR H . 50125 1 376 . 1 . 1 217 217 THR N N 15 119.579 0.00 . . . . . . . 217 THR N . 50125 1 377 . 1 . 1 218 218 ARG H H 1 9.033 0.00 . . . . . . . 218 ARG H . 50125 1 378 . 1 . 1 218 218 ARG N N 15 125.897 0.00 . . . . . . . 218 ARG N . 50125 1 379 . 1 . 1 219 219 PHE H H 1 8.080 0.00 . . . . . . . 219 PHE H . 50125 1 380 . 1 . 1 219 219 PHE N N 15 119.979 0.00 . . . . . . . 219 PHE N . 50125 1 381 . 1 . 1 220 220 GLY H H 1 8.635 0.00 . . . . . . . 220 GLY H . 50125 1 382 . 1 . 1 220 220 GLY N N 15 108.536 0.00 . . . . . . . 220 GLY N . 50125 1 383 . 1 . 1 221 221 ILE H H 1 8.875 0.00 . . . . . . . 221 ILE H . 50125 1 384 . 1 . 1 221 221 ILE N N 15 118.767 0.00 . . . . . . . 221 ILE N . 50125 1 385 . 1 . 1 222 222 ALA H H 1 8.968 0.00 . . . . . . . 222 ALA H . 50125 1 386 . 1 . 1 222 222 ALA N N 15 126.568 0.00 . . . . . . . 222 ALA N . 50125 1 387 . 1 . 1 223 223 ALA H H 1 9.245 0.00 . . . . . . . 223 ALA H . 50125 1 388 . 1 . 1 223 223 ALA N N 15 119.378 0.00 . . . . . . . 223 ALA N . 50125 1 389 . 1 . 1 224 224 LYS H H 1 8.908 0.00 . . . . . . . 224 LYS H . 50125 1 390 . 1 . 1 224 224 LYS N N 15 123.137 0.00 . . . . . . . 224 LYS N . 50125 1 391 . 1 . 1 225 225 TYR H H 1 9.909 0.00 . . . . . . . 225 TYR H . 50125 1 392 . 1 . 1 225 225 TYR N N 15 129.449 0.00 . . . . . . . 225 TYR N . 50125 1 393 . 1 . 1 226 226 GLN H H 1 9.101 0.00 . . . . . . . 226 GLN H . 50125 1 394 . 1 . 1 226 226 GLN N N 15 131.781 0.00 . . . . . . . 226 GLN N . 50125 1 395 . 1 . 1 227 227 ILE H H 1 7.888 0.00 . . . . . . . 227 ILE H . 50125 1 396 . 1 . 1 227 227 ILE N N 15 130.536 0.00 . . . . . . . 227 ILE N . 50125 1 397 . 1 . 1 228 228 ASP H H 1 8.483 0.00 . . . . . . . 228 ASP H . 50125 1 398 . 1 . 1 228 228 ASP N N 15 118.338 0.00 . . . . . . . 228 ASP N . 50125 1 399 . 1 . 1 230 230 ASP H H 1 8.581 0.00 . . . . . . . 230 ASP H . 50125 1 400 . 1 . 1 230 230 ASP N N 15 114.519 0.00 . . . . . . . 230 ASP N . 50125 1 401 . 1 . 1 231 231 ALA H H 1 7.758 0.00 . . . . . . . 231 ALA H . 50125 1 402 . 1 . 1 231 231 ALA N N 15 124.376 0.00 . . . . . . . 231 ALA N . 50125 1 403 . 1 . 1 232 232 CYS H H 1 8.549 0.00 . . . . . . . 232 CYS H . 50125 1 404 . 1 . 1 232 232 CYS N N 15 119.216 0.00 . . . . . . . 232 CYS N . 50125 1 405 . 1 . 1 233 233 PHE H H 1 9.376 0.00 . . . . . . . 233 PHE H . 50125 1 406 . 1 . 1 233 233 PHE N N 15 128.185 0.00 . . . . . . . 233 PHE N . 50125 1 407 . 1 . 1 234 234 SER H H 1 9.358 0.00 . . . . . . . 234 SER H . 50125 1 408 . 1 . 1 234 234 SER N N 15 125.174 0.00 . . . . . . . 234 SER N . 50125 1 409 . 1 . 1 235 235 ALA H H 1 8.074 0.00 . . . . . . . 235 ALA H . 50125 1 410 . 1 . 1 235 235 ALA N N 15 122.921 0.00 . . . . . . . 235 ALA N . 50125 1 411 . 1 . 1 236 236 LYS H H 1 9.107 0.00 . . . . . . . 236 LYS H . 50125 1 412 . 1 . 1 236 236 LYS N N 15 115.026 0.00 . . . . . . . 236 LYS N . 50125 1 413 . 1 . 1 237 237 VAL H H 1 9.023 0.00 . . . . . . . 237 VAL H . 50125 1 414 . 1 . 1 237 237 VAL N N 15 117.756 0.00 . . . . . . . 237 VAL N . 50125 1 415 . 1 . 1 238 238 ASN H H 1 7.706 0.00 . . . . . . . 238 ASN H . 50125 1 416 . 1 . 1 238 238 ASN N N 15 122.367 0.00 . . . . . . . 238 ASN N . 50125 1 417 . 1 . 1 239 239 ASN H H 1 8.620 0.00 . . . . . . . 239 ASN H . 50125 1 418 . 1 . 1 239 239 ASN N N 15 114.072 0.00 . . . . . . . 239 ASN N . 50125 1 419 . 1 . 1 240 240 SER H H 1 7.953 0.00 . . . . . . . 240 SER H . 50125 1 420 . 1 . 1 240 240 SER N N 15 117.114 0.00 . . . . . . . 240 SER N . 50125 1 421 . 1 . 1 241 241 SER H H 1 8.244 0.00 . . . . . . . 241 SER H . 50125 1 422 . 1 . 1 241 241 SER N N 15 109.658 0.00 . . . . . . . 241 SER N . 50125 1 423 . 1 . 1 242 242 LEU H H 1 7.345 0.00 . . . . . . . 242 LEU H . 50125 1 424 . 1 . 1 242 242 LEU N N 15 118.898 0.00 . . . . . . . 242 LEU N . 50125 1 425 . 1 . 1 243 243 ILE H H 1 9.034 0.00 . . . . . . . 243 ILE H . 50125 1 426 . 1 . 1 243 243 ILE N N 15 125.882 0.00 . . . . . . . 243 ILE N . 50125 1 427 . 1 . 1 244 244 GLY H H 1 9.349 0.00 . . . . . . . 244 GLY H . 50125 1 428 . 1 . 1 244 244 GLY N N 15 114.501 0.00 . . . . . . . 244 GLY N . 50125 1 429 . 1 . 1 245 245 LEU H H 1 9.413 0.00 . . . . . . . 245 LEU H . 50125 1 430 . 1 . 1 245 245 LEU N N 15 122.339 0.00 . . . . . . . 245 LEU N . 50125 1 431 . 1 . 1 246 246 GLY H H 1 9.231 0.00 . . . . . . . 246 GLY H . 50125 1 432 . 1 . 1 246 246 GLY N N 15 110.810 0.00 . . . . . . . 246 GLY N . 50125 1 433 . 1 . 1 247 247 TYR H H 1 9.178 0.00 . . . . . . . 247 TYR H . 50125 1 434 . 1 . 1 247 247 TYR N N 15 125.674 0.00 . . . . . . . 247 TYR N . 50125 1 435 . 1 . 1 248 248 THR H H 1 8.403 0.00 . . . . . . . 248 THR H . 50125 1 436 . 1 . 1 248 248 THR N N 15 124.805 0.00 . . . . . . . 248 THR N . 50125 1 437 . 1 . 1 249 249 GLN H H 1 9.243 0.00 . . . . . . . 249 GLN H . 50125 1 438 . 1 . 1 249 249 GLN N N 15 127.124 0.00 . . . . . . . 249 GLN N . 50125 1 439 . 1 . 1 254 254 GLY H H 1 8.493 0.00 . . . . . . . 254 GLY H . 50125 1 440 . 1 . 1 254 254 GLY N N 15 111.002 0.00 . . . . . . . 254 GLY N . 50125 1 441 . 1 . 1 255 255 ILE H H 1 8.225 0.00 . . . . . . . 255 ILE H . 50125 1 442 . 1 . 1 255 255 ILE N N 15 121.013 0.00 . . . . . . . 255 ILE N . 50125 1 443 . 1 . 1 256 256 LYS H H 1 8.820 0.00 . . . . . . . 256 LYS H . 50125 1 444 . 1 . 1 256 256 LYS N N 15 126.537 0.00 . . . . . . . 256 LYS N . 50125 1 445 . 1 . 1 257 257 LEU H H 1 8.868 0.00 . . . . . . . 257 LEU H . 50125 1 446 . 1 . 1 257 257 LEU N N 15 127.756 0.00 . . . . . . . 257 LEU N . 50125 1 447 . 1 . 1 258 258 THR H H 1 9.655 0.00 . . . . . . . 258 THR H . 50125 1 448 . 1 . 1 258 258 THR N N 15 123.213 0.00 . . . . . . . 258 THR N . 50125 1 449 . 1 . 1 259 259 LEU H H 1 9.313 0.00 . . . . . . . 259 LEU H . 50125 1 450 . 1 . 1 259 259 LEU N N 15 129.411 0.00 . . . . . . . 259 LEU N . 50125 1 451 . 1 . 1 260 260 SER H H 1 8.854 0.00 . . . . . . . 260 SER H . 50125 1 452 . 1 . 1 260 260 SER N N 15 115.390 0.00 . . . . . . . 260 SER N . 50125 1 453 . 1 . 1 261 261 ALA H H 1 9.580 0.00 . . . . . . . 261 ALA H . 50125 1 454 . 1 . 1 261 261 ALA N N 15 120.611 0.00 . . . . . . . 261 ALA N . 50125 1 455 . 1 . 1 262 262 LEU H H 1 8.737 0.00 . . . . . . . 262 LEU H . 50125 1 456 . 1 . 1 262 262 LEU N N 15 124.919 0.00 . . . . . . . 262 LEU N . 50125 1 457 . 1 . 1 263 263 LEU H H 1 9.505 0.00 . . . . . . . 263 LEU H . 50125 1 458 . 1 . 1 263 263 LEU N N 15 126.140 0.00 . . . . . . . 263 LEU N . 50125 1 459 . 1 . 1 264 264 ASP H H 1 9.535 0.00 . . . . . . . 264 ASP H . 50125 1 460 . 1 . 1 264 264 ASP N N 15 123.919 0.00 . . . . . . . 264 ASP N . 50125 1 461 . 1 . 1 265 265 GLY H H 1 8.613 0.00 . . . . . . . 265 GLY H . 50125 1 462 . 1 . 1 265 265 GLY N N 15 112.766 0.00 . . . . . . . 265 GLY N . 50125 1 463 . 1 . 1 266 266 LYS H H 1 8.247 0.00 . . . . . . . 266 LYS H . 50125 1 464 . 1 . 1 266 266 LYS N N 15 117.886 0.00 . . . . . . . 266 LYS N . 50125 1 465 . 1 . 1 267 267 ASN H H 1 7.602 0.00 . . . . . . . 267 ASN H . 50125 1 466 . 1 . 1 267 267 ASN N N 15 118.111 0.00 . . . . . . . 267 ASN N . 50125 1 467 . 1 . 1 268 268 VAL H H 1 8.459 0.00 . . . . . . . 268 VAL H . 50125 1 468 . 1 . 1 268 268 VAL N N 15 122.113 0.00 . . . . . . . 268 VAL N . 50125 1 469 . 1 . 1 269 269 ASN H H 1 8.376 0.00 . . . . . . . 269 ASN H . 50125 1 470 . 1 . 1 269 269 ASN N N 15 117.451 0.00 . . . . . . . 269 ASN N . 50125 1 471 . 1 . 1 270 270 ALA H H 1 7.609 0.00 . . . . . . . 270 ALA H . 50125 1 472 . 1 . 1 270 270 ALA N N 15 121.348 0.00 . . . . . . . 270 ALA N . 50125 1 473 . 1 . 1 271 271 GLY H H 1 7.948 0.00 . . . . . . . 271 GLY H . 50125 1 474 . 1 . 1 271 271 GLY N N 15 106.805 0.00 . . . . . . . 271 GLY N . 50125 1 475 . 1 . 1 272 272 GLY H H 1 8.429 0.00 . . . . . . . 272 GLY H . 50125 1 476 . 1 . 1 272 272 GLY N N 15 108.938 0.00 . . . . . . . 272 GLY N . 50125 1 477 . 1 . 1 273 273 HIS H H 1 7.484 0.00 . . . . . . . 273 HIS H . 50125 1 478 . 1 . 1 273 273 HIS N N 15 120.105 0.00 . . . . . . . 273 HIS N . 50125 1 479 . 1 . 1 274 274 LYS H H 1 8.739 0.00 . . . . . . . 274 LYS H . 50125 1 480 . 1 . 1 274 274 LYS N N 15 119.501 0.00 . . . . . . . 274 LYS N . 50125 1 481 . 1 . 1 275 275 LEU H H 1 8.551 0.00 . . . . . . . 275 LEU H . 50125 1 482 . 1 . 1 275 275 LEU N N 15 122.100 0.00 . . . . . . . 275 LEU N . 50125 1 483 . 1 . 1 276 276 GLY H H 1 9.125 0.00 . . . . . . . 276 GLY H . 50125 1 484 . 1 . 1 276 276 GLY N N 15 111.373 0.00 . . . . . . . 276 GLY N . 50125 1 485 . 1 . 1 277 277 LEU H H 1 8.286 0.00 . . . . . . . 277 LEU H . 50125 1 486 . 1 . 1 277 277 LEU N N 15 121.145 0.00 . . . . . . . 277 LEU N . 50125 1 487 . 1 . 1 278 278 GLY H H 1 9.627 0.00 . . . . . . . 278 GLY H . 50125 1 488 . 1 . 1 278 278 GLY N N 15 115.835 0.00 . . . . . . . 278 GLY N . 50125 1 489 . 1 . 1 279 279 LEU H H 1 8.749 0.00 . . . . . . . 279 LEU H . 50125 1 490 . 1 . 1 279 279 LEU N N 15 124.938 0.00 . . . . . . . 279 LEU N . 50125 1 491 . 1 . 1 280 280 GLU H H 1 8.724 0.00 . . . . . . . 280 GLU H . 50125 1 492 . 1 . 1 280 280 GLU N N 15 124.872 0.00 . . . . . . . 280 GLU N . 50125 1 493 . 1 . 1 282 282 GLN H H 1 9.333 0.00 . . . . . . . 282 GLN H . 50125 1 494 . 1 . 1 282 282 GLN N N 15 125.139 0.00 . . . . . . . 282 GLN N . 50125 1 495 . 1 . 1 283 283 ALA H H 1 8.243 0.00 . . . . . . . 283 ALA H . 50125 1 496 . 1 . 1 283 283 ALA N N 15 126.993 0.00 . . . . . . . 283 ALA N . 50125 1 497 . 1 . 1 284 284 LEU H H 1 8.429 0.00 . . . . . . . 284 LEU H . 50125 1 498 . 1 . 1 284 284 LEU N N 15 123.393 0.00 . . . . . . . 284 LEU N . 50125 1 stop_ save_