data_27128 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27128 _Entry.Title ; Voltage-dependent anion channel - VDAC E73V mutant ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-06-07 _Entry.Accession_date 2017-06-07 _Entry.Last_release_date 2017-06-07 _Entry.Original_release_date 2017-06-07 _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 . _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 Raphael Boehm . . . . 27128 2 Sebastian Hiller . . . . 27128 3 Gerhard Wagner . . . . 27128 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27128 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 470 27128 '15N chemical shifts' 259 27128 '1H chemical shifts' 259 27128 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 . . 2020-08-15 2017-06-07 update BMRB 'update entry citation' 27128 1 . . 2019-11-22 2017-06-07 original author 'original release' 27128 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27128 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 31862297 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; The Structural Basis for Low Conductance in the Membrane Protein VDAC upon beta-NADH Binding and Voltage Gating ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full 'Structure (London, England : 1993)' _Citation.Journal_volume 28 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1878-4186 _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 206 _Citation.Page_last 214 _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 R. Boehm R. . . . 27128 1 2 S. Hiller S. . . . 27128 1 3 G. Amodeo G. F. . . 27128 1 4 S. Murlidaran S. . . . 27128 1 5 S. Chavali S. . . . 27128 1 6 G. Wagner G. . . . 27128 1 7 G. Brannigan G. . . . 27128 1 8 M. Winterhalter M. . . . 27128 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Gating-mechanism 27128 1 VDAC 27128 1 dynamics 27128 1 'membrane protein' 27128 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27128 _Assembly.ID 1 _Assembly.Name VDAC-1 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 VDAC-1 1 $VDAC-1 A . yes native no no . . . 27128 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_VDAC-1 _Entity.Sf_category entity _Entity.Sf_framecode VDAC-1 _Entity.Entry_ID 27128 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name VDAC-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; 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 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation E73V _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 31800 _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 . 27128 1 2 . ALA . 27128 1 3 . VAL . 27128 1 4 . PRO . 27128 1 5 . PRO . 27128 1 6 . THR . 27128 1 7 . TYR . 27128 1 8 . ALA . 27128 1 9 . ASP . 27128 1 10 . LEU . 27128 1 11 . GLY . 27128 1 12 . LYS . 27128 1 13 . SER . 27128 1 14 . ALA . 27128 1 15 . ARG . 27128 1 16 . ASP . 27128 1 17 . VAL . 27128 1 18 . PHE . 27128 1 19 . THR . 27128 1 20 . LYS . 27128 1 21 . GLY . 27128 1 22 . TYR . 27128 1 23 . GLY . 27128 1 24 . PHE . 27128 1 25 . GLY . 27128 1 26 . LEU . 27128 1 27 . ILE . 27128 1 28 . LYS . 27128 1 29 . LEU . 27128 1 30 . ASP . 27128 1 31 . LEU . 27128 1 32 . LYS . 27128 1 33 . THR . 27128 1 34 . LYS . 27128 1 35 . SER . 27128 1 36 . GLU . 27128 1 37 . ASN . 27128 1 38 . GLY . 27128 1 39 . LEU . 27128 1 40 . GLU . 27128 1 41 . PHE . 27128 1 42 . THR . 27128 1 43 . SER . 27128 1 44 . SER . 27128 1 45 . GLY . 27128 1 46 . SER . 27128 1 47 . ALA . 27128 1 48 . ASN . 27128 1 49 . THR . 27128 1 50 . GLU . 27128 1 51 . THR . 27128 1 52 . THR . 27128 1 53 . LYS . 27128 1 54 . VAL . 27128 1 55 . THR . 27128 1 56 . GLY . 27128 1 57 . SER . 27128 1 58 . LEU . 27128 1 59 . GLU . 27128 1 60 . THR . 27128 1 61 . LYS . 27128 1 62 . TYR . 27128 1 63 . ARG . 27128 1 64 . TRP . 27128 1 65 . THR . 27128 1 66 . GLU . 27128 1 67 . TYR . 27128 1 68 . GLY . 27128 1 69 . LEU . 27128 1 70 . THR . 27128 1 71 . PHE . 27128 1 72 . THR . 27128 1 73 . VAL . 27128 1 74 . LYS . 27128 1 75 . TRP . 27128 1 76 . ASN . 27128 1 77 . THR . 27128 1 78 . ASP . 27128 1 79 . ASN . 27128 1 80 . THR . 27128 1 81 . LEU . 27128 1 82 . GLY . 27128 1 83 . THR . 27128 1 84 . GLU . 27128 1 85 . ILE . 27128 1 86 . THR . 27128 1 87 . VAL . 27128 1 88 . GLU . 27128 1 89 . ASP . 27128 1 90 . GLN . 27128 1 91 . LEU . 27128 1 92 . ALA . 27128 1 93 . ARG . 27128 1 94 . GLY . 27128 1 95 . LEU . 27128 1 96 . LYS . 27128 1 97 . LEU . 27128 1 98 . THR . 27128 1 99 . PHE . 27128 1 100 . ASP . 27128 1 101 . SER . 27128 1 102 . SER . 27128 1 103 . PHE . 27128 1 104 . SER . 27128 1 105 . PRO . 27128 1 106 . ASN . 27128 1 107 . THR . 27128 1 108 . GLY . 27128 1 109 . LYS . 27128 1 110 . LYS . 27128 1 111 . ASN . 27128 1 112 . ALA . 27128 1 113 . LYS . 27128 1 114 . ILE . 27128 1 115 . LYS . 27128 1 116 . THR . 27128 1 117 . GLY . 27128 1 118 . TYR . 27128 1 119 . LYS . 27128 1 120 . ARG . 27128 1 121 . GLU . 27128 1 122 . HIS . 27128 1 123 . ILE . 27128 1 124 . ASN . 27128 1 125 . LEU . 27128 1 126 . GLY . 27128 1 127 . CYS . 27128 1 128 . ASP . 27128 1 129 . MET . 27128 1 130 . ASP . 27128 1 131 . PHE . 27128 1 132 . ASP . 27128 1 133 . ILE . 27128 1 134 . ALA . 27128 1 135 . GLY . 27128 1 136 . PRO . 27128 1 137 . SER . 27128 1 138 . ILE . 27128 1 139 . ARG . 27128 1 140 . GLY . 27128 1 141 . ALA . 27128 1 142 . LEU . 27128 1 143 . VAL . 27128 1 144 . LEU . 27128 1 145 . GLY . 27128 1 146 . TYR . 27128 1 147 . GLU . 27128 1 148 . GLY . 27128 1 149 . TRP . 27128 1 150 . LEU . 27128 1 151 . ALA . 27128 1 152 . GLY . 27128 1 153 . TYR . 27128 1 154 . GLN . 27128 1 155 . MET . 27128 1 156 . ASN . 27128 1 157 . PHE . 27128 1 158 . GLU . 27128 1 159 . THR . 27128 1 160 . ALA . 27128 1 161 . LYS . 27128 1 162 . SER . 27128 1 163 . ARG . 27128 1 164 . VAL . 27128 1 165 . THR . 27128 1 166 . GLN . 27128 1 167 . SER . 27128 1 168 . ASN . 27128 1 169 . PHE . 27128 1 170 . ALA . 27128 1 171 . VAL . 27128 1 172 . GLY . 27128 1 173 . TYR . 27128 1 174 . LYS . 27128 1 175 . THR . 27128 1 176 . ASP . 27128 1 177 . GLU . 27128 1 178 . PHE . 27128 1 179 . GLN . 27128 1 180 . LEU . 27128 1 181 . HIS . 27128 1 182 . THR . 27128 1 183 . ASN . 27128 1 184 . VAL . 27128 1 185 . ASN . 27128 1 186 . ASP . 27128 1 187 . GLY . 27128 1 188 . THR . 27128 1 189 . GLU . 27128 1 190 . PHE . 27128 1 191 . GLY . 27128 1 192 . GLY . 27128 1 193 . SER . 27128 1 194 . ILE . 27128 1 195 . TYR . 27128 1 196 . GLN . 27128 1 197 . LYS . 27128 1 198 . VAL . 27128 1 199 . ASN . 27128 1 200 . LYS . 27128 1 201 . LYS . 27128 1 202 . LEU . 27128 1 203 . GLU . 27128 1 204 . THR . 27128 1 205 . ALA . 27128 1 206 . VAL . 27128 1 207 . ASN . 27128 1 208 . LEU . 27128 1 209 . ALA . 27128 1 210 . TRP . 27128 1 211 . THR . 27128 1 212 . ALA . 27128 1 213 . GLY . 27128 1 214 . ASN . 27128 1 215 . SER . 27128 1 216 . ASN . 27128 1 217 . THR . 27128 1 218 . ARG . 27128 1 219 . PHE . 27128 1 220 . GLY . 27128 1 221 . ILE . 27128 1 222 . ALA . 27128 1 223 . ALA . 27128 1 224 . LYS . 27128 1 225 . TYR . 27128 1 226 . GLN . 27128 1 227 . ILE . 27128 1 228 . ASP . 27128 1 229 . PRO . 27128 1 230 . ASP . 27128 1 231 . ALA . 27128 1 232 . CYS . 27128 1 233 . PHE . 27128 1 234 . SER . 27128 1 235 . ALA . 27128 1 236 . LYS . 27128 1 237 . VAL . 27128 1 238 . ASN . 27128 1 239 . ASN . 27128 1 240 . SER . 27128 1 241 . SER . 27128 1 242 . LEU . 27128 1 243 . ILE . 27128 1 244 . GLY . 27128 1 245 . LEU . 27128 1 246 . GLY . 27128 1 247 . TYR . 27128 1 248 . THR . 27128 1 249 . GLN . 27128 1 250 . THR . 27128 1 251 . LEU . 27128 1 252 . LYS . 27128 1 253 . PRO . 27128 1 254 . GLY . 27128 1 255 . ILE . 27128 1 256 . LYS . 27128 1 257 . LEU . 27128 1 258 . THR . 27128 1 259 . LEU . 27128 1 260 . SER . 27128 1 261 . ALA . 27128 1 262 . LEU . 27128 1 263 . LEU . 27128 1 264 . ASP . 27128 1 265 . GLY . 27128 1 266 . LYS . 27128 1 267 . ASN . 27128 1 268 . VAL . 27128 1 269 . ASN . 27128 1 270 . ALA . 27128 1 271 . GLY . 27128 1 272 . GLY . 27128 1 273 . HIS . 27128 1 274 . LYS . 27128 1 275 . LEU . 27128 1 276 . GLY . 27128 1 277 . LEU . 27128 1 278 . GLY . 27128 1 279 . LEU . 27128 1 280 . GLU . 27128 1 281 . PHE . 27128 1 282 . GLN . 27128 1 283 . ALA . 27128 1 284 . LEU . 27128 1 285 . GLU . 27128 1 286 . HIS . 27128 1 287 . HIS . 27128 1 288 . HIS . 27128 1 289 . HIS . 27128 1 290 . HIS . 27128 1 291 . HIS . 27128 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 27128 1 . ALA 2 2 27128 1 . VAL 3 3 27128 1 . PRO 4 4 27128 1 . PRO 5 5 27128 1 . THR 6 6 27128 1 . TYR 7 7 27128 1 . ALA 8 8 27128 1 . ASP 9 9 27128 1 . LEU 10 10 27128 1 . GLY 11 11 27128 1 . LYS 12 12 27128 1 . SER 13 13 27128 1 . ALA 14 14 27128 1 . ARG 15 15 27128 1 . ASP 16 16 27128 1 . VAL 17 17 27128 1 . PHE 18 18 27128 1 . THR 19 19 27128 1 . LYS 20 20 27128 1 . GLY 21 21 27128 1 . TYR 22 22 27128 1 . GLY 23 23 27128 1 . PHE 24 24 27128 1 . GLY 25 25 27128 1 . LEU 26 26 27128 1 . ILE 27 27 27128 1 . LYS 28 28 27128 1 . LEU 29 29 27128 1 . ASP 30 30 27128 1 . LEU 31 31 27128 1 . LYS 32 32 27128 1 . THR 33 33 27128 1 . LYS 34 34 27128 1 . SER 35 35 27128 1 . GLU 36 36 27128 1 . ASN 37 37 27128 1 . GLY 38 38 27128 1 . LEU 39 39 27128 1 . GLU 40 40 27128 1 . PHE 41 41 27128 1 . THR 42 42 27128 1 . SER 43 43 27128 1 . SER 44 44 27128 1 . GLY 45 45 27128 1 . SER 46 46 27128 1 . ALA 47 47 27128 1 . ASN 48 48 27128 1 . THR 49 49 27128 1 . GLU 50 50 27128 1 . THR 51 51 27128 1 . THR 52 52 27128 1 . LYS 53 53 27128 1 . VAL 54 54 27128 1 . THR 55 55 27128 1 . GLY 56 56 27128 1 . SER 57 57 27128 1 . LEU 58 58 27128 1 . GLU 59 59 27128 1 . THR 60 60 27128 1 . LYS 61 61 27128 1 . TYR 62 62 27128 1 . ARG 63 63 27128 1 . TRP 64 64 27128 1 . THR 65 65 27128 1 . GLU 66 66 27128 1 . TYR 67 67 27128 1 . GLY 68 68 27128 1 . LEU 69 69 27128 1 . THR 70 70 27128 1 . PHE 71 71 27128 1 . THR 72 72 27128 1 . VAL 73 73 27128 1 . LYS 74 74 27128 1 . TRP 75 75 27128 1 . ASN 76 76 27128 1 . THR 77 77 27128 1 . ASP 78 78 27128 1 . ASN 79 79 27128 1 . THR 80 80 27128 1 . LEU 81 81 27128 1 . GLY 82 82 27128 1 . THR 83 83 27128 1 . GLU 84 84 27128 1 . ILE 85 85 27128 1 . THR 86 86 27128 1 . VAL 87 87 27128 1 . GLU 88 88 27128 1 . ASP 89 89 27128 1 . GLN 90 90 27128 1 . LEU 91 91 27128 1 . ALA 92 92 27128 1 . ARG 93 93 27128 1 . GLY 94 94 27128 1 . LEU 95 95 27128 1 . LYS 96 96 27128 1 . LEU 97 97 27128 1 . THR 98 98 27128 1 . PHE 99 99 27128 1 . ASP 100 100 27128 1 . SER 101 101 27128 1 . SER 102 102 27128 1 . PHE 103 103 27128 1 . SER 104 104 27128 1 . PRO 105 105 27128 1 . ASN 106 106 27128 1 . THR 107 107 27128 1 . GLY 108 108 27128 1 . LYS 109 109 27128 1 . LYS 110 110 27128 1 . ASN 111 111 27128 1 . ALA 112 112 27128 1 . LYS 113 113 27128 1 . ILE 114 114 27128 1 . LYS 115 115 27128 1 . THR 116 116 27128 1 . GLY 117 117 27128 1 . TYR 118 118 27128 1 . LYS 119 119 27128 1 . ARG 120 120 27128 1 . GLU 121 121 27128 1 . HIS 122 122 27128 1 . ILE 123 123 27128 1 . ASN 124 124 27128 1 . LEU 125 125 27128 1 . GLY 126 126 27128 1 . CYS 127 127 27128 1 . ASP 128 128 27128 1 . MET 129 129 27128 1 . ASP 130 130 27128 1 . PHE 131 131 27128 1 . ASP 132 132 27128 1 . ILE 133 133 27128 1 . ALA 134 134 27128 1 . GLY 135 135 27128 1 . PRO 136 136 27128 1 . SER 137 137 27128 1 . ILE 138 138 27128 1 . ARG 139 139 27128 1 . GLY 140 140 27128 1 . ALA 141 141 27128 1 . LEU 142 142 27128 1 . VAL 143 143 27128 1 . LEU 144 144 27128 1 . GLY 145 145 27128 1 . TYR 146 146 27128 1 . GLU 147 147 27128 1 . GLY 148 148 27128 1 . TRP 149 149 27128 1 . LEU 150 150 27128 1 . ALA 151 151 27128 1 . GLY 152 152 27128 1 . TYR 153 153 27128 1 . GLN 154 154 27128 1 . MET 155 155 27128 1 . ASN 156 156 27128 1 . PHE 157 157 27128 1 . GLU 158 158 27128 1 . THR 159 159 27128 1 . ALA 160 160 27128 1 . LYS 161 161 27128 1 . SER 162 162 27128 1 . ARG 163 163 27128 1 . VAL 164 164 27128 1 . THR 165 165 27128 1 . GLN 166 166 27128 1 . SER 167 167 27128 1 . ASN 168 168 27128 1 . PHE 169 169 27128 1 . ALA 170 170 27128 1 . VAL 171 171 27128 1 . GLY 172 172 27128 1 . TYR 173 173 27128 1 . LYS 174 174 27128 1 . THR 175 175 27128 1 . ASP 176 176 27128 1 . GLU 177 177 27128 1 . PHE 178 178 27128 1 . GLN 179 179 27128 1 . LEU 180 180 27128 1 . HIS 181 181 27128 1 . THR 182 182 27128 1 . ASN 183 183 27128 1 . VAL 184 184 27128 1 . ASN 185 185 27128 1 . ASP 186 186 27128 1 . GLY 187 187 27128 1 . THR 188 188 27128 1 . GLU 189 189 27128 1 . PHE 190 190 27128 1 . GLY 191 191 27128 1 . GLY 192 192 27128 1 . SER 193 193 27128 1 . ILE 194 194 27128 1 . TYR 195 195 27128 1 . GLN 196 196 27128 1 . LYS 197 197 27128 1 . VAL 198 198 27128 1 . ASN 199 199 27128 1 . LYS 200 200 27128 1 . LYS 201 201 27128 1 . LEU 202 202 27128 1 . GLU 203 203 27128 1 . THR 204 204 27128 1 . ALA 205 205 27128 1 . VAL 206 206 27128 1 . ASN 207 207 27128 1 . LEU 208 208 27128 1 . ALA 209 209 27128 1 . TRP 210 210 27128 1 . THR 211 211 27128 1 . ALA 212 212 27128 1 . GLY 213 213 27128 1 . ASN 214 214 27128 1 . SER 215 215 27128 1 . ASN 216 216 27128 1 . THR 217 217 27128 1 . ARG 218 218 27128 1 . PHE 219 219 27128 1 . GLY 220 220 27128 1 . ILE 221 221 27128 1 . ALA 222 222 27128 1 . ALA 223 223 27128 1 . LYS 224 224 27128 1 . TYR 225 225 27128 1 . GLN 226 226 27128 1 . ILE 227 227 27128 1 . ASP 228 228 27128 1 . PRO 229 229 27128 1 . ASP 230 230 27128 1 . ALA 231 231 27128 1 . CYS 232 232 27128 1 . PHE 233 233 27128 1 . SER 234 234 27128 1 . ALA 235 235 27128 1 . LYS 236 236 27128 1 . VAL 237 237 27128 1 . ASN 238 238 27128 1 . ASN 239 239 27128 1 . SER 240 240 27128 1 . SER 241 241 27128 1 . LEU 242 242 27128 1 . ILE 243 243 27128 1 . GLY 244 244 27128 1 . LEU 245 245 27128 1 . GLY 246 246 27128 1 . TYR 247 247 27128 1 . THR 248 248 27128 1 . GLN 249 249 27128 1 . THR 250 250 27128 1 . LEU 251 251 27128 1 . LYS 252 252 27128 1 . PRO 253 253 27128 1 . GLY 254 254 27128 1 . ILE 255 255 27128 1 . LYS 256 256 27128 1 . LEU 257 257 27128 1 . THR 258 258 27128 1 . LEU 259 259 27128 1 . SER 260 260 27128 1 . ALA 261 261 27128 1 . LEU 262 262 27128 1 . LEU 263 263 27128 1 . ASP 264 264 27128 1 . GLY 265 265 27128 1 . LYS 266 266 27128 1 . ASN 267 267 27128 1 . VAL 268 268 27128 1 . ASN 269 269 27128 1 . ALA 270 270 27128 1 . GLY 271 271 27128 1 . GLY 272 272 27128 1 . HIS 273 273 27128 1 . LYS 274 274 27128 1 . LEU 275 275 27128 1 . GLY 276 276 27128 1 . LEU 277 277 27128 1 . GLY 278 278 27128 1 . LEU 279 279 27128 1 . GLU 280 280 27128 1 . PHE 281 281 27128 1 . GLN 282 282 27128 1 . ALA 283 283 27128 1 . LEU 284 284 27128 1 . GLU 285 285 27128 1 . HIS 286 286 27128 1 . HIS 287 287 27128 1 . HIS 288 288 27128 1 . HIS 289 289 27128 1 . HIS 290 290 27128 1 . HIS 291 291 27128 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 27128 _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 $VDAC-1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27128 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 27128 _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 $VDAC-1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET21a . . . 27128 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27128 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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-1 '[U-13C; U-15N; U-2H]' . . 1 $VDAC-1 . . 0.6 . . mM . . . . 27128 1 2 LDAO 'natural abundance' . . . . . . 3 . . % . . . . 27128 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 27128 _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' 225 . mM 27128 1 pH 6.8 . pH 27128 1 pressure 1 . atm 27128 1 temperature 303 . K 27128 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 27128 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Rochus Keller' . . 27128 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27128 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27128 _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_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27128 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 27128 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27128 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27128 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27128 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27128 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27128 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 27128 _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 . . . . . 27128 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27128 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27128 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.404808636 . . . . . 27128 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27128 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27128 1 2 '3D HNCO' . . . 27128 1 3 '3D HNCA' . . . 27128 1 4 '3D HNCACB' . . . 27128 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 7.429 0.020 . . . . . . . 6 THR H . 27128 1 2 . 1 . 1 6 6 THR CA C 13 60.091 0.300 . . . . . . . 6 THR CA . 27128 1 3 . 1 . 1 6 6 THR CB C 13 69.622 0.300 . . . . . . . 6 THR CB . 27128 1 4 . 1 . 1 6 6 THR N N 15 106.437 0.300 . . . . . . . 6 THR N . 27128 1 5 . 1 . 1 7 7 TYR H H 1 7.662 0.020 . . . . . . . 7 TYR H . 27128 1 6 . 1 . 1 7 7 TYR CA C 13 61.888 0.300 . . . . . . . 7 TYR CA . 27128 1 7 . 1 . 1 7 7 TYR CB C 13 38.995 0.300 . . . . . . . 7 TYR CB . 27128 1 8 . 1 . 1 7 7 TYR N N 15 122.692 0.300 . . . . . . . 7 TYR N . 27128 1 9 . 1 . 1 8 8 ALA H H 1 8.439 0.020 . . . . . . . 8 ALA H . 27128 1 10 . 1 . 1 8 8 ALA CA C 13 53.501 0.300 . . . . . . . 8 ALA CA . 27128 1 11 . 1 . 1 8 8 ALA CB C 13 17.932 0.300 . . . . . . . 8 ALA CB . 27128 1 12 . 1 . 1 8 8 ALA N N 15 119.331 0.300 . . . . . . . 8 ALA N . 27128 1 13 . 1 . 1 9 9 ASP H H 1 7.218 0.020 . . . . . . . 9 ASP H . 27128 1 14 . 1 . 1 9 9 ASP CA C 13 53.467 0.300 . . . . . . . 9 ASP CA . 27128 1 15 . 1 . 1 9 9 ASP CB C 13 39.916 0.300 . . . . . . . 9 ASP CB . 27128 1 16 . 1 . 1 9 9 ASP N N 15 115.310 0.300 . . . . . . . 9 ASP N . 27128 1 17 . 1 . 1 10 10 LEU H H 1 7.351 0.020 . . . . . . . 10 LEU H . 27128 1 18 . 1 . 1 10 10 LEU CA C 13 55.831 0.300 . . . . . . . 10 LEU CA . 27128 1 19 . 1 . 1 10 10 LEU CB C 13 38.350 0.300 . . . . . . . 10 LEU CB . 27128 1 20 . 1 . 1 10 10 LEU N N 15 125.633 0.300 . . . . . . . 10 LEU N . 27128 1 21 . 1 . 1 12 12 LYS H H 1 7.272 0.020 . . . . . . . 12 LYS H . 27128 1 22 . 1 . 1 12 12 LYS CA C 13 59.425 0.300 . . . . . . . 12 LYS CA . 27128 1 23 . 1 . 1 12 12 LYS CB C 13 32.212 0.300 . . . . . . . 12 LYS CB . 27128 1 24 . 1 . 1 12 12 LYS N N 15 122.682 0.300 . . . . . . . 12 LYS N . 27128 1 25 . 1 . 1 13 13 SER H H 1 8.132 0.020 . . . . . . . 13 SER H . 27128 1 26 . 1 . 1 13 13 SER CA C 13 62.621 0.300 . . . . . . . 13 SER CA . 27128 1 27 . 1 . 1 13 13 SER N N 15 115.479 0.300 . . . . . . . 13 SER N . 27128 1 28 . 1 . 1 14 14 ALA H H 1 8.302 0.020 . . . . . . . 14 ALA H . 27128 1 29 . 1 . 1 14 14 ALA CA C 13 54.798 0.300 . . . . . . . 14 ALA CA . 27128 1 30 . 1 . 1 14 14 ALA N N 15 122.053 0.300 . . . . . . . 14 ALA N . 27128 1 31 . 1 . 1 15 15 ARG H H 1 7.287 0.020 . . . . . . . 15 ARG H . 27128 1 32 . 1 . 1 15 15 ARG CA C 13 59.625 0.300 . . . . . . . 15 ARG CA . 27128 1 33 . 1 . 1 15 15 ARG CB C 13 29.456 0.300 . . . . . . . 15 ARG CB . 27128 1 34 . 1 . 1 15 15 ARG N N 15 117.436 0.300 . . . . . . . 15 ARG N . 27128 1 35 . 1 . 1 16 16 ASP H H 1 9.028 0.020 . . . . . . . 16 ASP H . 27128 1 36 . 1 . 1 16 16 ASP CA C 13 56.862 0.300 . . . . . . . 16 ASP CA . 27128 1 37 . 1 . 1 16 16 ASP CB C 13 38.976 0.300 . . . . . . . 16 ASP CB . 27128 1 38 . 1 . 1 16 16 ASP N N 15 122.203 0.300 . . . . . . . 16 ASP N . 27128 1 39 . 1 . 1 17 17 VAL H H 1 7.474 0.020 . . . . . . . 17 VAL H . 27128 1 40 . 1 . 1 17 17 VAL CA C 13 66.229 0.300 . . . . . . . 17 VAL CA . 27128 1 41 . 1 . 1 17 17 VAL N N 15 120.336 0.300 . . . . . . . 17 VAL N . 27128 1 42 . 1 . 1 18 18 PHE H H 1 7.549 0.020 . . . . . . . 18 PHE H . 27128 1 43 . 1 . 1 18 18 PHE CA C 13 62.221 0.300 . . . . . . . 18 PHE CA . 27128 1 44 . 1 . 1 18 18 PHE N N 15 116.441 0.300 . . . . . . . 18 PHE N . 27128 1 45 . 1 . 1 21 21 GLY H H 1 8.280 0.020 . . . . . . . 21 GLY H . 27128 1 46 . 1 . 1 21 21 GLY CA C 13 44.148 0.300 . . . . . . . 21 GLY CA . 27128 1 47 . 1 . 1 21 21 GLY N N 15 109.011 0.300 . . . . . . . 21 GLY N . 27128 1 48 . 1 . 1 22 22 TYR H H 1 6.614 0.020 . . . . . . . 22 TYR H . 27128 1 49 . 1 . 1 22 22 TYR CA C 13 55.731 0.300 . . . . . . . 22 TYR CA . 27128 1 50 . 1 . 1 22 22 TYR CB C 13 38.976 0.300 . . . . . . . 22 TYR CB . 27128 1 51 . 1 . 1 22 22 TYR N N 15 113.844 0.300 . . . . . . . 22 TYR N . 27128 1 52 . 1 . 1 23 23 GLY H H 1 7.580 0.020 . . . . . . . 23 GLY H . 27128 1 53 . 1 . 1 23 23 GLY CA C 13 45.192 0.300 . . . . . . . 23 GLY CA . 27128 1 54 . 1 . 1 23 23 GLY N N 15 111.587 0.300 . . . . . . . 23 GLY N . 27128 1 55 . 1 . 1 24 24 PHE H H 1 7.099 0.020 . . . . . . . 24 PHE H . 27128 1 56 . 1 . 1 24 24 PHE CA C 13 56.097 0.300 . . . . . . . 24 PHE CA . 27128 1 57 . 1 . 1 24 24 PHE CB C 13 37.786 0.300 . . . . . . . 24 PHE CB . 27128 1 58 . 1 . 1 24 24 PHE N N 15 120.304 0.300 . . . . . . . 24 PHE N . 27128 1 59 . 1 . 1 25 25 GLY H H 1 8.112 0.020 . . . . . . . 25 GLY H . 27128 1 60 . 1 . 1 25 25 GLY CA C 13 45.180 0.300 . . . . . . . 25 GLY CA . 27128 1 61 . 1 . 1 25 25 GLY N N 15 110.293 0.300 . . . . . . . 25 GLY N . 27128 1 62 . 1 . 1 26 26 LEU H H 1 7.471 0.020 . . . . . . . 26 LEU H . 27128 1 63 . 1 . 1 26 26 LEU CA C 13 52.968 0.300 . . . . . . . 26 LEU CA . 27128 1 64 . 1 . 1 26 26 LEU CB C 13 45.615 0.300 . . . . . . . 26 LEU CB . 27128 1 65 . 1 . 1 26 26 LEU N N 15 118.742 0.300 . . . . . . . 26 LEU N . 27128 1 66 . 1 . 1 27 27 ILE H H 1 8.709 0.020 . . . . . . . 27 ILE H . 27128 1 67 . 1 . 1 27 27 ILE CA C 13 59.658 0.300 . . . . . . . 27 ILE CA . 27128 1 68 . 1 . 1 27 27 ILE N N 15 121.053 0.300 . . . . . . . 27 ILE N . 27128 1 69 . 1 . 1 28 28 LYS H H 1 8.746 0.020 . . . . . . . 28 LYS H . 27128 1 70 . 1 . 1 28 28 LYS CA C 13 54.732 0.300 . . . . . . . 28 LYS CA . 27128 1 71 . 1 . 1 28 28 LYS CB C 13 35.845 0.300 . . . . . . . 28 LYS CB . 27128 1 72 . 1 . 1 28 28 LYS N N 15 126.951 0.300 . . . . . . . 28 LYS N . 27128 1 73 . 1 . 1 29 29 LEU H H 1 8.703 0.020 . . . . . . . 29 LEU H . 27128 1 74 . 1 . 1 29 29 LEU CA C 13 53.127 0.300 . . . . . . . 29 LEU CA . 27128 1 75 . 1 . 1 29 29 LEU CB C 13 45.239 0.300 . . . . . . . 29 LEU CB . 27128 1 76 . 1 . 1 29 29 LEU N N 15 124.188 0.300 . . . . . . . 29 LEU N . 27128 1 77 . 1 . 1 30 30 ASP H H 1 8.463 0.020 . . . . . . . 30 ASP H . 27128 1 78 . 1 . 1 30 30 ASP CA C 13 53.379 0.300 . . . . . . . 30 ASP CA . 27128 1 79 . 1 . 1 30 30 ASP CB C 13 44.926 0.300 . . . . . . . 30 ASP CB . 27128 1 80 . 1 . 1 30 30 ASP N N 15 123.258 0.300 . . . . . . . 30 ASP N . 27128 1 81 . 1 . 1 31 31 LEU H H 1 9.061 0.020 . . . . . . . 31 LEU H . 27128 1 82 . 1 . 1 31 31 LEU CA C 13 53.628 0.300 . . . . . . . 31 LEU CA . 27128 1 83 . 1 . 1 31 31 LEU CB C 13 44.175 0.300 . . . . . . . 31 LEU CB . 27128 1 84 . 1 . 1 31 31 LEU N N 15 123.809 0.300 . . . . . . . 31 LEU N . 27128 1 85 . 1 . 1 32 32 LYS H H 1 8.586 0.020 . . . . . . . 32 LYS H . 27128 1 86 . 1 . 1 32 32 LYS CA C 13 54.898 0.300 . . . . . . . 32 LYS CA . 27128 1 87 . 1 . 1 32 32 LYS CB C 13 35.344 0.300 . . . . . . . 32 LYS CB . 27128 1 88 . 1 . 1 32 32 LYS N N 15 125.065 0.300 . . . . . . . 32 LYS N . 27128 1 89 . 1 . 1 33 33 THR H H 1 9.076 0.020 . . . . . . . 33 THR H . 27128 1 90 . 1 . 1 33 33 THR CA C 13 59.879 0.300 . . . . . . . 33 THR CA . 27128 1 91 . 1 . 1 33 33 THR CB C 13 69.916 0.300 . . . . . . . 33 THR CB . 27128 1 92 . 1 . 1 33 33 THR N N 15 116.194 0.300 . . . . . . . 33 THR N . 27128 1 93 . 1 . 1 34 34 LYS H H 1 8.130 0.020 . . . . . . . 34 LYS H . 27128 1 94 . 1 . 1 34 34 LYS CA C 13 55.333 0.300 . . . . . . . 34 LYS CA . 27128 1 95 . 1 . 1 34 34 LYS CB C 13 34.905 0.300 . . . . . . . 34 LYS CB . 27128 1 96 . 1 . 1 34 34 LYS N N 15 123.935 0.300 . . . . . . . 34 LYS N . 27128 1 97 . 1 . 1 35 35 SER H H 1 8.677 0.020 . . . . . . . 35 SER H . 27128 1 98 . 1 . 1 35 35 SER CA C 13 56.703 0.300 . . . . . . . 35 SER CA . 27128 1 99 . 1 . 1 35 35 SER CB C 13 64.468 0.300 . . . . . . . 35 SER CB . 27128 1 100 . 1 . 1 35 35 SER N N 15 119.814 0.300 . . . . . . . 35 SER N . 27128 1 101 . 1 . 1 36 36 GLU H H 1 9.188 0.020 . . . . . . . 36 GLU H . 27128 1 102 . 1 . 1 36 36 GLU CA C 13 57.828 0.300 . . . . . . . 36 GLU CA . 27128 1 103 . 1 . 1 36 36 GLU N N 15 125.450 0.300 . . . . . . . 36 GLU N . 27128 1 104 . 1 . 1 37 37 ASN H H 1 8.164 0.020 . . . . . . . 37 ASN H . 27128 1 105 . 1 . 1 37 37 ASN CA C 13 52.735 0.300 . . . . . . . 37 ASN CA . 27128 1 106 . 1 . 1 37 37 ASN CB C 13 37.536 0.300 . . . . . . . 37 ASN CB . 27128 1 107 . 1 . 1 37 37 ASN N N 15 116.242 0.300 . . . . . . . 37 ASN N . 27128 1 108 . 1 . 1 38 38 GLY H H 1 7.811 0.020 . . . . . . . 38 GLY H . 27128 1 109 . 1 . 1 38 38 GLY CA C 13 44.938 0.300 . . . . . . . 38 GLY CA . 27128 1 110 . 1 . 1 38 38 GLY N N 15 106.512 0.300 . . . . . . . 38 GLY N . 27128 1 111 . 1 . 1 39 39 LEU H H 1 7.869 0.020 . . . . . . . 39 LEU H . 27128 1 112 . 1 . 1 39 39 LEU CA C 13 54.865 0.300 . . . . . . . 39 LEU CA . 27128 1 113 . 1 . 1 39 39 LEU CB C 13 42.672 0.300 . . . . . . . 39 LEU CB . 27128 1 114 . 1 . 1 39 39 LEU N N 15 122.909 0.300 . . . . . . . 39 LEU N . 27128 1 115 . 1 . 1 40 40 GLU H H 1 9.039 0.020 . . . . . . . 40 GLU H . 27128 1 116 . 1 . 1 40 40 GLU CA C 13 54.632 0.300 . . . . . . . 40 GLU CA . 27128 1 117 . 1 . 1 40 40 GLU CB C 13 32.024 0.300 . . . . . . . 40 GLU CB . 27128 1 118 . 1 . 1 40 40 GLU N N 15 125.107 0.300 . . . . . . . 40 GLU N . 27128 1 119 . 1 . 1 41 41 PHE H H 1 8.735 0.020 . . . . . . . 41 PHE H . 27128 1 120 . 1 . 1 41 41 PHE CA C 13 56.363 0.300 . . . . . . . 41 PHE CA . 27128 1 121 . 1 . 1 41 41 PHE CB C 13 41.857 0.300 . . . . . . . 41 PHE CB . 27128 1 122 . 1 . 1 41 41 PHE N N 15 124.345 0.300 . . . . . . . 41 PHE N . 27128 1 123 . 1 . 1 42 42 THR H H 1 8.809 0.020 . . . . . . . 42 THR H . 27128 1 124 . 1 . 1 42 42 THR CA C 13 60.624 0.300 . . . . . . . 42 THR CA . 27128 1 125 . 1 . 1 42 42 THR CB C 13 71.106 0.300 . . . . . . . 42 THR CB . 27128 1 126 . 1 . 1 42 42 THR N N 15 120.583 0.300 . . . . . . . 42 THR N . 27128 1 127 . 1 . 1 43 43 SER H H 1 9.170 0.020 . . . . . . . 43 SER H . 27128 1 128 . 1 . 1 43 43 SER CA C 13 56.363 0.300 . . . . . . . 43 SER CA . 27128 1 129 . 1 . 1 43 43 SER CB C 13 65.971 0.300 . . . . . . . 43 SER CB . 27128 1 130 . 1 . 1 43 43 SER N N 15 120.473 0.300 . . . . . . . 43 SER N . 27128 1 131 . 1 . 1 44 44 SER H H 1 8.524 0.020 . . . . . . . 44 SER H . 27128 1 132 . 1 . 1 44 44 SER CA C 13 56.363 0.300 . . . . . . . 44 SER CA . 27128 1 133 . 1 . 1 44 44 SER CB C 13 65.658 0.300 . . . . . . . 44 SER CB . 27128 1 134 . 1 . 1 44 44 SER N N 15 120.527 0.300 . . . . . . . 44 SER N . 27128 1 135 . 1 . 1 45 45 GLY H H 1 9.063 0.020 . . . . . . . 45 GLY H . 27128 1 136 . 1 . 1 45 45 GLY CA C 13 44.837 0.300 . . . . . . . 45 GLY CA . 27128 1 137 . 1 . 1 45 45 GLY N N 15 111.192 0.300 . . . . . . . 45 GLY N . 27128 1 138 . 1 . 1 46 46 SER H H 1 9.046 0.020 . . . . . . . 46 SER H . 27128 1 139 . 1 . 1 46 46 SER CA C 13 56.503 0.300 . . . . . . . 46 SER CA . 27128 1 140 . 1 . 1 46 46 SER CB C 13 66.033 0.300 . . . . . . . 46 SER CB . 27128 1 141 . 1 . 1 46 46 SER N N 15 116.106 0.300 . . . . . . . 46 SER N . 27128 1 142 . 1 . 1 47 47 ALA H H 1 9.169 0.020 . . . . . . . 47 ALA H . 27128 1 143 . 1 . 1 47 47 ALA CA C 13 49.249 0.300 . . . . . . . 47 ALA CA . 27128 1 144 . 1 . 1 47 47 ALA CB C 13 21.126 0.300 . . . . . . . 47 ALA CB . 27128 1 145 . 1 . 1 47 47 ALA N N 15 123.836 0.300 . . . . . . . 47 ALA N . 27128 1 146 . 1 . 1 48 48 ASN H H 1 8.298 0.020 . . . . . . . 48 ASN H . 27128 1 147 . 1 . 1 48 48 ASN CA C 13 52.559 0.300 . . . . . . . 48 ASN CA . 27128 1 148 . 1 . 1 48 48 ASN N N 15 122.388 0.300 . . . . . . . 48 ASN N . 27128 1 149 . 1 . 1 53 53 LYS H H 1 7.536 0.020 . . . . . . . 53 LYS H . 27128 1 150 . 1 . 1 53 53 LYS CA C 13 56.336 0.300 . . . . . . . 53 LYS CA . 27128 1 151 . 1 . 1 53 53 LYS CB C 13 32.212 0.300 . . . . . . . 53 LYS CB . 27128 1 152 . 1 . 1 53 53 LYS N N 15 120.633 0.300 . . . . . . . 53 LYS N . 27128 1 153 . 1 . 1 54 54 VAL H H 1 8.575 0.020 . . . . . . . 54 VAL H . 27128 1 154 . 1 . 1 54 54 VAL CA C 13 59.645 0.300 . . . . . . . 54 VAL CA . 27128 1 155 . 1 . 1 54 54 VAL CB C 13 33.339 0.300 . . . . . . . 54 VAL CB . 27128 1 156 . 1 . 1 54 54 VAL N N 15 125.759 0.300 . . . . . . . 54 VAL N . 27128 1 157 . 1 . 1 55 55 THR H H 1 8.779 0.020 . . . . . . . 55 THR H . 27128 1 158 . 1 . 1 55 55 THR CA C 13 59.511 0.300 . . . . . . . 55 THR CA . 27128 1 159 . 1 . 1 55 55 THR CB C 13 71.420 0.300 . . . . . . . 55 THR CB . 27128 1 160 . 1 . 1 55 55 THR N N 15 118.798 0.300 . . . . . . . 55 THR N . 27128 1 161 . 1 . 1 56 56 GLY H H 1 8.265 0.020 . . . . . . . 56 GLY H . 27128 1 162 . 1 . 1 56 56 GLY CA C 13 45.439 0.300 . . . . . . . 56 GLY CA . 27128 1 163 . 1 . 1 56 56 GLY N N 15 108.913 0.300 . . . . . . . 56 GLY N . 27128 1 164 . 1 . 1 57 57 SER H H 1 9.036 0.020 . . . . . . . 57 SER H . 27128 1 165 . 1 . 1 57 57 SER CA C 13 57.071 0.300 . . . . . . . 57 SER CA . 27128 1 166 . 1 . 1 57 57 SER CB C 13 65.971 0.300 . . . . . . . 57 SER CB . 27128 1 167 . 1 . 1 57 57 SER N N 15 112.810 0.300 . . . . . . . 57 SER N . 27128 1 168 . 1 . 1 58 58 LEU H H 1 8.959 0.020 . . . . . . . 58 LEU H . 27128 1 169 . 1 . 1 58 58 LEU CA C 13 53.860 0.300 . . . . . . . 58 LEU CA . 27128 1 170 . 1 . 1 58 58 LEU CB C 13 45.573 0.300 . . . . . . . 58 LEU CB . 27128 1 171 . 1 . 1 58 58 LEU N N 15 121.719 0.300 . . . . . . . 58 LEU N . 27128 1 172 . 1 . 1 59 59 GLU H H 1 9.043 0.020 . . . . . . . 59 GLU H . 27128 1 173 . 1 . 1 59 59 GLU CA C 13 54.632 0.300 . . . . . . . 59 GLU CA . 27128 1 174 . 1 . 1 59 59 GLU CB C 13 33.290 0.300 . . . . . . . 59 GLU CB . 27128 1 175 . 1 . 1 59 59 GLU N N 15 123.977 0.300 . . . . . . . 59 GLU N . 27128 1 176 . 1 . 1 60 60 THR H H 1 9.056 0.020 . . . . . . . 60 THR H . 27128 1 177 . 1 . 1 60 60 THR CA C 13 60.514 0.300 . . . . . . . 60 THR CA . 27128 1 178 . 1 . 1 60 60 THR CB C 13 70.668 0.300 . . . . . . . 60 THR CB . 27128 1 179 . 1 . 1 60 60 THR N N 15 120.208 0.300 . . . . . . . 60 THR N . 27128 1 180 . 1 . 1 61 61 LYS H H 1 8.864 0.020 . . . . . . . 61 LYS H . 27128 1 181 . 1 . 1 61 61 LYS CA C 13 53.962 0.300 . . . . . . . 61 LYS CA . 27128 1 182 . 1 . 1 61 61 LYS CB C 13 36.408 0.300 . . . . . . . 61 LYS CB . 27128 1 183 . 1 . 1 61 61 LYS N N 15 127.021 0.300 . . . . . . . 61 LYS N . 27128 1 184 . 1 . 1 62 62 TYR H H 1 9.261 0.020 . . . . . . . 62 TYR H . 27128 1 185 . 1 . 1 62 62 TYR CA C 13 56.870 0.300 . . . . . . . 62 TYR CA . 27128 1 186 . 1 . 1 62 62 TYR CB C 13 42.358 0.300 . . . . . . . 62 TYR CB . 27128 1 187 . 1 . 1 62 62 TYR N N 15 124.031 0.300 . . . . . . . 62 TYR N . 27128 1 188 . 1 . 1 63 63 ARG H H 1 7.766 0.020 . . . . . . . 63 ARG H . 27128 1 189 . 1 . 1 63 63 ARG CA C 13 54.230 0.300 . . . . . . . 63 ARG CA . 27128 1 190 . 1 . 1 63 63 ARG CB C 13 30.646 0.300 . . . . . . . 63 ARG CB . 27128 1 191 . 1 . 1 63 63 ARG N N 15 127.947 0.300 . . . . . . . 63 ARG N . 27128 1 192 . 1 . 1 64 64 TRP H H 1 9.110 0.020 . . . . . . . 64 TRP H . 27128 1 193 . 1 . 1 64 64 TRP CA C 13 52.968 0.300 . . . . . . . 64 TRP CA . 27128 1 194 . 1 . 1 64 64 TRP CB C 13 28.767 0.300 . . . . . . . 64 TRP CB . 27128 1 195 . 1 . 1 64 64 TRP N N 15 128.128 0.300 . . . . . . . 64 TRP N . 27128 1 196 . 1 . 1 65 65 THR H H 1 8.378 0.020 . . . . . . . 65 THR H . 27128 1 197 . 1 . 1 65 65 THR CA C 13 66.129 0.300 . . . . . . . 65 THR CA . 27128 1 198 . 1 . 1 65 65 THR CB C 13 67.934 0.300 . . . . . . . 65 THR CB . 27128 1 199 . 1 . 1 65 65 THR N N 15 120.852 0.300 . . . . . . . 65 THR N . 27128 1 200 . 1 . 1 66 66 GLU H H 1 9.394 0.020 . . . . . . . 66 GLU H . 27128 1 201 . 1 . 1 66 66 GLU CA C 13 58.926 0.300 . . . . . . . 66 GLU CA . 27128 1 202 . 1 . 1 66 66 GLU CB C 13 28.247 0.300 . . . . . . . 66 GLU CB . 27128 1 203 . 1 . 1 66 66 GLU N N 15 122.597 0.300 . . . . . . . 66 GLU N . 27128 1 204 . 1 . 1 67 67 TYR H H 1 6.452 0.020 . . . . . . . 67 TYR H . 27128 1 205 . 1 . 1 67 67 TYR CA C 13 55.634 0.300 . . . . . . . 67 TYR CA . 27128 1 206 . 1 . 1 67 67 TYR CB C 13 38.876 0.300 . . . . . . . 67 TYR CB . 27128 1 207 . 1 . 1 67 67 TYR N N 15 114.175 0.300 . . . . . . . 67 TYR N . 27128 1 208 . 1 . 1 68 68 GLY H H 1 7.551 0.020 . . . . . . . 68 GLY H . 27128 1 209 . 1 . 1 68 68 GLY CA C 13 46.576 0.300 . . . . . . . 68 GLY CA . 27128 1 210 . 1 . 1 68 68 GLY N N 15 105.689 0.300 . . . . . . . 68 GLY N . 27128 1 211 . 1 . 1 69 69 LEU H H 1 7.216 0.020 . . . . . . . 69 LEU H . 27128 1 212 . 1 . 1 69 69 LEU CA C 13 53.361 0.300 . . . . . . . 69 LEU CA . 27128 1 213 . 1 . 1 69 69 LEU CB C 13 45.553 0.300 . . . . . . . 69 LEU CB . 27128 1 214 . 1 . 1 69 69 LEU N N 15 120.164 0.300 . . . . . . . 69 LEU N . 27128 1 215 . 1 . 1 70 70 THR H H 1 9.001 0.020 . . . . . . . 70 THR H . 27128 1 216 . 1 . 1 70 70 THR CA C 13 61.984 0.300 . . . . . . . 70 THR CA . 27128 1 217 . 1 . 1 70 70 THR CB C 13 70.605 0.300 . . . . . . . 70 THR CB . 27128 1 218 . 1 . 1 70 70 THR N N 15 120.237 0.300 . . . . . . . 70 THR N . 27128 1 219 . 1 . 1 71 71 PHE H H 1 9.214 0.020 . . . . . . . 71 PHE H . 27128 1 220 . 1 . 1 71 71 PHE CA C 13 55.366 0.300 . . . . . . . 71 PHE CA . 27128 1 221 . 1 . 1 71 71 PHE CB C 13 42.045 0.300 . . . . . . . 71 PHE CB . 27128 1 222 . 1 . 1 71 71 PHE N N 15 127.025 0.300 . . . . . . . 71 PHE N . 27128 1 223 . 1 . 1 72 72 THR H H 1 9.024 0.020 . . . . . . . 72 THR H . 27128 1 224 . 1 . 1 72 72 THR CA C 13 61.149 0.300 . . . . . . . 72 THR CA . 27128 1 225 . 1 . 1 72 72 THR CB C 13 70.856 0.300 . . . . . . . 72 THR CB . 27128 1 226 . 1 . 1 72 72 THR N N 15 120.585 0.300 . . . . . . . 72 THR N . 27128 1 227 . 1 . 1 73 73 VAL H H 1 8.980 0.020 . . . . . . . 73 VAL H . 27128 1 228 . 1 . 1 73 73 VAL CA C 13 60.357 0.300 . . . . . . . 73 VAL CA . 27128 1 229 . 1 . 1 73 73 VAL CB C 13 33.590 0.300 . . . . . . . 73 VAL CB . 27128 1 230 . 1 . 1 73 73 VAL N N 15 125.699 0.300 . . . . . . . 73 VAL N . 27128 1 231 . 1 . 1 74 74 LYS H H 1 9.122 0.020 . . . . . . . 74 LYS H . 27128 1 232 . 1 . 1 74 74 LYS CA C 13 54.366 0.300 . . . . . . . 74 LYS CA . 27128 1 233 . 1 . 1 74 74 LYS CB C 13 35.907 0.300 . . . . . . . 74 LYS CB . 27128 1 234 . 1 . 1 74 74 LYS N N 15 126.103 0.300 . . . . . . . 74 LYS N . 27128 1 235 . 1 . 1 75 75 TRP H H 1 9.114 0.020 . . . . . . . 75 TRP H . 27128 1 236 . 1 . 1 75 75 TRP CA C 13 54.631 0.300 . . . . . . . 75 TRP CA . 27128 1 237 . 1 . 1 75 75 TRP CB C 13 31.832 0.300 . . . . . . . 75 TRP CB . 27128 1 238 . 1 . 1 75 75 TRP N N 15 124.615 0.300 . . . . . . . 75 TRP N . 27128 1 239 . 1 . 1 76 76 ASN H H 1 7.841 0.020 . . . . . . . 76 ASN H . 27128 1 240 . 1 . 1 76 76 ASN CA C 13 51.537 0.300 . . . . . . . 76 ASN CA . 27128 1 241 . 1 . 1 76 76 ASN CB C 13 40.855 0.300 . . . . . . . 76 ASN CB . 27128 1 242 . 1 . 1 76 76 ASN N N 15 123.271 0.300 . . . . . . . 76 ASN N . 27128 1 243 . 1 . 1 77 77 THR H H 1 8.162 0.020 . . . . . . . 77 THR H . 27128 1 244 . 1 . 1 77 77 THR CA C 13 63.622 0.300 . . . . . . . 77 THR CA . 27128 1 245 . 1 . 1 77 77 THR CB C 13 68.100 0.300 . . . . . . . 77 THR CB . 27128 1 246 . 1 . 1 77 77 THR N N 15 108.942 0.300 . . . . . . . 77 THR N . 27128 1 247 . 1 . 1 78 78 ASP H H 1 7.640 0.020 . . . . . . . 78 ASP H . 27128 1 248 . 1 . 1 78 78 ASP CA C 13 53.628 0.300 . . . . . . . 78 ASP CA . 27128 1 249 . 1 . 1 78 78 ASP CB C 13 39.039 0.300 . . . . . . . 78 ASP CB . 27128 1 250 . 1 . 1 78 78 ASP N N 15 120.972 0.300 . . . . . . . 78 ASP N . 27128 1 251 . 1 . 1 79 79 ASN H H 1 8.464 0.020 . . . . . . . 79 ASN H . 27128 1 252 . 1 . 1 79 79 ASN CA C 13 53.862 0.300 . . . . . . . 79 ASN CA . 27128 1 253 . 1 . 1 79 79 ASN CB C 13 37.223 0.300 . . . . . . . 79 ASN CB . 27128 1 254 . 1 . 1 79 79 ASN N N 15 114.938 0.300 . . . . . . . 79 ASN N . 27128 1 255 . 1 . 1 80 80 THR H H 1 7.398 0.020 . . . . . . . 80 THR H . 27128 1 256 . 1 . 1 80 80 THR CA C 13 62.486 0.300 . . . . . . . 80 THR CA . 27128 1 257 . 1 . 1 80 80 THR CB C 13 69.603 0.300 . . . . . . . 80 THR CB . 27128 1 258 . 1 . 1 80 80 THR N N 15 112.715 0.300 . . . . . . . 80 THR N . 27128 1 259 . 1 . 1 81 81 LEU H H 1 8.606 0.020 . . . . . . . 81 LEU H . 27128 1 260 . 1 . 1 81 81 LEU CA C 13 52.793 0.300 . . . . . . . 81 LEU CA . 27128 1 261 . 1 . 1 81 81 LEU CB C 13 44.425 0.300 . . . . . . . 81 LEU CB . 27128 1 262 . 1 . 1 81 81 LEU N N 15 127.945 0.300 . . . . . . . 81 LEU N . 27128 1 263 . 1 . 1 82 82 GLY H H 1 9.397 0.020 . . . . . . . 82 GLY H . 27128 1 264 . 1 . 1 82 82 GLY CA C 13 44.110 0.300 . . . . . . . 82 GLY CA . 27128 1 265 . 1 . 1 82 82 GLY N N 15 112.870 0.300 . . . . . . . 82 GLY N . 27128 1 266 . 1 . 1 83 83 THR H H 1 8.808 0.020 . . . . . . . 83 THR H . 27128 1 267 . 1 . 1 83 83 THR CA C 13 59.377 0.300 . . . . . . . 83 THR CA . 27128 1 268 . 1 . 1 83 83 THR CB C 13 71.670 0.300 . . . . . . . 83 THR CB . 27128 1 269 . 1 . 1 83 83 THR N N 15 114.231 0.300 . . . . . . . 83 THR N . 27128 1 270 . 1 . 1 84 84 GLU H H 1 8.896 0.020 . . . . . . . 84 GLU H . 27128 1 271 . 1 . 1 84 84 GLU CA C 13 54.300 0.300 . . . . . . . 84 GLU CA . 27128 1 272 . 1 . 1 84 84 GLU CB C 13 33.214 0.300 . . . . . . . 84 GLU CB . 27128 1 273 . 1 . 1 84 84 GLU N N 15 124.531 0.300 . . . . . . . 84 GLU N . 27128 1 274 . 1 . 1 85 85 ILE H H 1 9.040 0.020 . . . . . . . 85 ILE H . 27128 1 275 . 1 . 1 85 85 ILE CA C 13 59.879 0.300 . . . . . . . 85 ILE CA . 27128 1 276 . 1 . 1 85 85 ILE CB C 13 40.855 0.300 . . . . . . . 85 ILE CB . 27128 1 277 . 1 . 1 85 85 ILE N N 15 126.159 0.300 . . . . . . . 85 ILE N . 27128 1 278 . 1 . 1 86 86 THR H H 1 8.967 0.020 . . . . . . . 86 THR H . 27128 1 279 . 1 . 1 86 86 THR CA C 13 60.480 0.300 . . . . . . . 86 THR CA . 27128 1 280 . 1 . 1 86 86 THR CB C 13 71.608 0.300 . . . . . . . 86 THR CB . 27128 1 281 . 1 . 1 86 86 THR N N 15 123.822 0.300 . . . . . . . 86 THR N . 27128 1 282 . 1 . 1 87 87 VAL H H 1 9.353 0.020 . . . . . . . 87 VAL H . 27128 1 283 . 1 . 1 87 87 VAL CA C 13 59.411 0.300 . . . . . . . 87 VAL CA . 27128 1 284 . 1 . 1 87 87 VAL CB C 13 33.778 0.300 . . . . . . . 87 VAL CB . 27128 1 285 . 1 . 1 87 87 VAL N N 15 124.688 0.300 . . . . . . . 87 VAL N . 27128 1 286 . 1 . 1 88 88 GLU H H 1 9.123 0.020 . . . . . . . 88 GLU H . 27128 1 287 . 1 . 1 88 88 GLU CA C 13 54.999 0.300 . . . . . . . 88 GLU CA . 27128 1 288 . 1 . 1 88 88 GLU CB C 13 32.588 0.300 . . . . . . . 88 GLU CB . 27128 1 289 . 1 . 1 88 88 GLU N N 15 128.701 0.300 . . . . . . . 88 GLU N . 27128 1 290 . 1 . 1 89 89 ASP H H 1 8.719 0.020 . . . . . . . 89 ASP H . 27128 1 291 . 1 . 1 89 89 ASP CA C 13 56.870 0.300 . . . . . . . 89 ASP CA . 27128 1 292 . 1 . 1 89 89 ASP N N 15 118.297 0.300 . . . . . . . 89 ASP N . 27128 1 293 . 1 . 1 90 90 GLN H H 1 7.884 0.020 . . . . . . . 90 GLN H . 27128 1 294 . 1 . 1 90 90 GLN CA C 13 55.099 0.300 . . . . . . . 90 GLN CA . 27128 1 295 . 1 . 1 90 90 GLN N N 15 117.160 0.300 . . . . . . . 90 GLN N . 27128 1 296 . 1 . 1 91 91 LEU H H 1 8.258 0.020 . . . . . . . 91 LEU H . 27128 1 297 . 1 . 1 91 91 LEU CA C 13 57.994 0.300 . . . . . . . 91 LEU CA . 27128 1 298 . 1 . 1 91 91 LEU CB C 13 40.354 0.300 . . . . . . . 91 LEU CB . 27128 1 299 . 1 . 1 91 91 LEU N N 15 117.862 0.300 . . . . . . . 91 LEU N . 27128 1 300 . 1 . 1 92 92 ALA H H 1 7.453 0.020 . . . . . . . 92 ALA H . 27128 1 301 . 1 . 1 92 92 ALA CA C 13 50.971 0.300 . . . . . . . 92 ALA CA . 27128 1 302 . 1 . 1 92 92 ALA CB C 13 20.312 0.300 . . . . . . . 92 ALA CB . 27128 1 303 . 1 . 1 92 92 ALA N N 15 116.498 0.300 . . . . . . . 92 ALA N . 27128 1 304 . 1 . 1 93 93 ARG H H 1 8.803 0.020 . . . . . . . 93 ARG H . 27128 1 305 . 1 . 1 93 93 ARG CA C 13 57.495 0.300 . . . . . . . 93 ARG CA . 27128 1 306 . 1 . 1 93 93 ARG CB C 13 28.329 0.300 . . . . . . . 93 ARG CB . 27128 1 307 . 1 . 1 93 93 ARG N N 15 124.087 0.300 . . . . . . . 93 ARG N . 27128 1 308 . 1 . 1 94 94 GLY H H 1 9.427 0.020 . . . . . . . 94 GLY H . 27128 1 309 . 1 . 1 94 94 GLY CA C 13 44.971 0.300 . . . . . . . 94 GLY CA . 27128 1 310 . 1 . 1 94 94 GLY N N 15 115.566 0.300 . . . . . . . 94 GLY N . 27128 1 311 . 1 . 1 95 95 LEU H H 1 7.865 0.020 . . . . . . . 95 LEU H . 27128 1 312 . 1 . 1 95 95 LEU CA C 13 53.667 0.300 . . . . . . . 95 LEU CA . 27128 1 313 . 1 . 1 95 95 LEU CB C 13 44.363 0.300 . . . . . . . 95 LEU CB . 27128 1 314 . 1 . 1 95 95 LEU N N 15 122.929 0.300 . . . . . . . 95 LEU N . 27128 1 315 . 1 . 1 96 96 LYS H H 1 9.631 0.020 . . . . . . . 96 LYS H . 27128 1 316 . 1 . 1 96 96 LYS CA C 13 54.898 0.300 . . . . . . . 96 LYS CA . 27128 1 317 . 1 . 1 96 96 LYS CB C 13 35.406 0.300 . . . . . . . 96 LYS CB . 27128 1 318 . 1 . 1 96 96 LYS N N 15 132.433 0.300 . . . . . . . 96 LYS N . 27128 1 319 . 1 . 1 97 97 LEU H H 1 8.710 0.020 . . . . . . . 97 LEU H . 27128 1 320 . 1 . 1 97 97 LEU CA C 13 53.361 0.300 . . . . . . . 97 LEU CA . 27128 1 321 . 1 . 1 97 97 LEU CB C 13 44.989 0.300 . . . . . . . 97 LEU CB . 27128 1 322 . 1 . 1 97 97 LEU N N 15 127.187 0.300 . . . . . . . 97 LEU N . 27128 1 323 . 1 . 1 98 98 THR H H 1 9.152 0.020 . . . . . . . 98 THR H . 27128 1 324 . 1 . 1 98 98 THR CA C 13 60.982 0.300 . . . . . . . 98 THR CA . 27128 1 325 . 1 . 1 98 98 THR CB C 13 71.733 0.300 . . . . . . . 98 THR CB . 27128 1 326 . 1 . 1 98 98 THR N N 15 120.453 0.300 . . . . . . . 98 THR N . 27128 1 327 . 1 . 1 99 99 PHE H H 1 9.412 0.020 . . . . . . . 99 PHE H . 27128 1 328 . 1 . 1 99 99 PHE CA C 13 55.734 0.300 . . . . . . . 99 PHE CA . 27128 1 329 . 1 . 1 99 99 PHE CB C 13 40.667 0.300 . . . . . . . 99 PHE CB . 27128 1 330 . 1 . 1 99 99 PHE N N 15 126.816 0.300 . . . . . . . 99 PHE N . 27128 1 331 . 1 . 1 100 100 ASP H H 1 8.702 0.020 . . . . . . . 100 ASP H . 27128 1 332 . 1 . 1 100 100 ASP CA C 13 52.124 0.300 . . . . . . . 100 ASP CA . 27128 1 333 . 1 . 1 100 100 ASP CB C 13 44.049 0.300 . . . . . . . 100 ASP CB . 27128 1 334 . 1 . 1 100 100 ASP N N 15 128.771 0.300 . . . . . . . 100 ASP N . 27128 1 335 . 1 . 1 101 101 SER H H 1 8.602 0.020 . . . . . . . 101 SER H . 27128 1 336 . 1 . 1 101 101 SER CA C 13 56.837 0.300 . . . . . . . 101 SER CA . 27128 1 337 . 1 . 1 101 101 SER CB C 13 65.783 0.300 . . . . . . . 101 SER CB . 27128 1 338 . 1 . 1 101 101 SER N N 15 118.362 0.300 . . . . . . . 101 SER N . 27128 1 339 . 1 . 1 102 102 SER H H 1 8.621 0.020 . . . . . . . 102 SER H . 27128 1 340 . 1 . 1 102 102 SER CA C 13 56.837 0.300 . . . . . . . 102 SER CA . 27128 1 341 . 1 . 1 102 102 SER CB C 13 65.783 0.300 . . . . . . . 102 SER CB . 27128 1 342 . 1 . 1 102 102 SER N N 15 118.401 0.300 . . . . . . . 102 SER N . 27128 1 343 . 1 . 1 103 103 PHE H H 1 9.011 0.020 . . . . . . . 103 PHE H . 27128 1 344 . 1 . 1 103 103 PHE CA C 13 55.767 0.300 . . . . . . . 103 PHE CA . 27128 1 345 . 1 . 1 103 103 PHE CB C 13 42.045 0.300 . . . . . . . 103 PHE CB . 27128 1 346 . 1 . 1 103 103 PHE N N 15 121.245 0.300 . . . . . . . 103 PHE N . 27128 1 347 . 1 . 1 104 104 SER H H 1 7.997 0.020 . . . . . . . 104 SER H . 27128 1 348 . 1 . 1 104 104 SER CA C 13 53.194 0.300 . . . . . . . 104 SER CA . 27128 1 349 . 1 . 1 104 104 SER CB C 13 63.528 0.300 . . . . . . . 104 SER CB . 27128 1 350 . 1 . 1 104 104 SER N N 15 120.094 0.300 . . . . . . . 104 SER N . 27128 1 351 . 1 . 1 108 108 GLY H H 1 8.199 0.020 . . . . . . . 108 GLY H . 27128 1 352 . 1 . 1 108 108 GLY CA C 13 45.105 0.300 . . . . . . . 108 GLY CA . 27128 1 353 . 1 . 1 108 108 GLY N N 15 111.804 0.300 . . . . . . . 108 GLY N . 27128 1 354 . 1 . 1 109 109 LYS H H 1 7.533 0.020 . . . . . . . 109 LYS H . 27128 1 355 . 1 . 1 109 109 LYS CA C 13 56.436 0.300 . . . . . . . 109 LYS CA . 27128 1 356 . 1 . 1 109 109 LYS CB C 13 32.087 0.300 . . . . . . . 109 LYS CB . 27128 1 357 . 1 . 1 109 109 LYS N N 15 120.892 0.300 . . . . . . . 109 LYS N . 27128 1 358 . 1 . 1 110 110 LYS H H 1 8.419 0.020 . . . . . . . 110 LYS H . 27128 1 359 . 1 . 1 110 110 LYS CA C 13 54.631 0.300 . . . . . . . 110 LYS CA . 27128 1 360 . 1 . 1 110 110 LYS CB C 13 33.966 0.300 . . . . . . . 110 LYS CB . 27128 1 361 . 1 . 1 110 110 LYS N N 15 123.941 0.300 . . . . . . . 110 LYS N . 27128 1 362 . 1 . 1 111 111 ASN H H 1 8.527 0.020 . . . . . . . 111 ASN H . 27128 1 363 . 1 . 1 111 111 ASN CA C 13 52.502 0.300 . . . . . . . 111 ASN CA . 27128 1 364 . 1 . 1 111 111 ASN CB C 13 41.857 0.300 . . . . . . . 111 ASN CB . 27128 1 365 . 1 . 1 111 111 ASN N N 15 119.775 0.300 . . . . . . . 111 ASN N . 27128 1 366 . 1 . 1 112 112 ALA H H 1 8.559 0.020 . . . . . . . 112 ALA H . 27128 1 367 . 1 . 1 112 112 ALA CA C 13 51.389 0.300 . . . . . . . 112 ALA CA . 27128 1 368 . 1 . 1 112 112 ALA CB C 13 21.439 0.300 . . . . . . . 112 ALA CB . 27128 1 369 . 1 . 1 112 112 ALA N N 15 124.481 0.300 . . . . . . . 112 ALA N . 27128 1 370 . 1 . 1 113 113 LYS H H 1 9.013 0.020 . . . . . . . 113 LYS H . 27128 1 371 . 1 . 1 113 113 LYS CA C 13 54.497 0.300 . . . . . . . 113 LYS CA . 27128 1 372 . 1 . 1 113 113 LYS CB C 13 36.471 0.300 . . . . . . . 113 LYS CB . 27128 1 373 . 1 . 1 113 113 LYS N N 15 119.795 0.300 . . . . . . . 113 LYS N . 27128 1 374 . 1 . 1 114 114 ILE H H 1 8.797 0.020 . . . . . . . 114 ILE H . 27128 1 375 . 1 . 1 114 114 ILE CA C 13 59.143 0.300 . . . . . . . 114 ILE CA . 27128 1 376 . 1 . 1 114 114 ILE CB C 13 40.166 0.300 . . . . . . . 114 ILE CB . 27128 1 377 . 1 . 1 114 114 ILE N N 15 120.701 0.300 . . . . . . . 114 ILE N . 27128 1 378 . 1 . 1 115 115 LYS H H 1 9.259 0.020 . . . . . . . 115 LYS H . 27128 1 379 . 1 . 1 115 115 LYS CA C 13 54.531 0.300 . . . . . . . 115 LYS CA . 27128 1 380 . 1 . 1 115 115 LYS CB C 13 33.715 0.300 . . . . . . . 115 LYS CB . 27128 1 381 . 1 . 1 115 115 LYS N N 15 126.807 0.300 . . . . . . . 115 LYS N . 27128 1 382 . 1 . 1 116 116 THR H H 1 8.646 0.020 . . . . . . . 116 THR H . 27128 1 383 . 1 . 1 116 116 THR CA C 13 59.912 0.300 . . . . . . . 116 THR CA . 27128 1 384 . 1 . 1 116 116 THR CB C 13 71.044 0.300 . . . . . . . 116 THR CB . 27128 1 385 . 1 . 1 116 116 THR N N 15 117.194 0.300 . . . . . . . 116 THR N . 27128 1 386 . 1 . 1 117 117 GLY H H 1 9.170 0.020 . . . . . . . 117 GLY H . 27128 1 387 . 1 . 1 117 117 GLY CA C 13 44.369 0.300 . . . . . . . 117 GLY CA . 27128 1 388 . 1 . 1 117 117 GLY N N 15 113.943 0.300 . . . . . . . 117 GLY N . 27128 1 389 . 1 . 1 118 118 TYR H H 1 9.114 0.020 . . . . . . . 118 TYR H . 27128 1 390 . 1 . 1 118 118 TYR CA C 13 56.402 0.300 . . . . . . . 118 TYR CA . 27128 1 391 . 1 . 1 118 118 TYR CB C 13 41.732 0.300 . . . . . . . 118 TYR CB . 27128 1 392 . 1 . 1 118 118 TYR N N 15 123.375 0.300 . . . . . . . 118 TYR N . 27128 1 393 . 1 . 1 119 119 LYS H H 1 7.576 0.020 . . . . . . . 119 LYS H . 27128 1 394 . 1 . 1 119 119 LYS CA C 13 52.826 0.300 . . . . . . . 119 LYS CA . 27128 1 395 . 1 . 1 119 119 LYS CB C 13 34.091 0.300 . . . . . . . 119 LYS CB . 27128 1 396 . 1 . 1 119 119 LYS N N 15 125.190 0.300 . . . . . . . 119 LYS N . 27128 1 397 . 1 . 1 120 120 ARG H H 1 8.738 0.020 . . . . . . . 120 ARG H . 27128 1 398 . 1 . 1 120 120 ARG CA C 13 53.628 0.300 . . . . . . . 120 ARG CA . 27128 1 399 . 1 . 1 120 120 ARG CB C 13 30.646 0.300 . . . . . . . 120 ARG CB . 27128 1 400 . 1 . 1 120 120 ARG N N 15 118.486 0.300 . . . . . . . 120 ARG N . 27128 1 401 . 1 . 1 121 121 GLU H H 1 8.540 0.020 . . . . . . . 121 GLU H . 27128 1 402 . 1 . 1 121 121 GLU CA C 13 59.210 0.300 . . . . . . . 121 GLU CA . 27128 1 403 . 1 . 1 121 121 GLU CB C 13 28.204 0.300 . . . . . . . 121 GLU CB . 27128 1 404 . 1 . 1 121 121 GLU N N 15 120.957 0.300 . . . . . . . 121 GLU N . 27128 1 405 . 1 . 1 122 122 HIS H H 1 7.877 0.020 . . . . . . . 122 HIS H . 27128 1 406 . 1 . 1 122 122 HIS CA C 13 59.110 0.300 . . . . . . . 122 HIS CA . 27128 1 407 . 1 . 1 122 122 HIS N N 15 112.192 0.300 . . . . . . . 122 HIS N . 27128 1 408 . 1 . 1 123 123 ILE H H 1 7.988 0.020 . . . . . . . 123 ILE H . 27128 1 409 . 1 . 1 123 123 ILE CA C 13 59.812 0.300 . . . . . . . 123 ILE CA . 27128 1 410 . 1 . 1 123 123 ILE CB C 13 41.795 0.300 . . . . . . . 123 ILE CB . 27128 1 411 . 1 . 1 123 123 ILE N N 15 118.460 0.300 . . . . . . . 123 ILE N . 27128 1 412 . 1 . 1 124 124 ASN H H 1 8.966 0.020 . . . . . . . 124 ASN H . 27128 1 413 . 1 . 1 124 124 ASN CA C 13 52.692 0.300 . . . . . . . 124 ASN CA . 27128 1 414 . 1 . 1 124 124 ASN CB C 13 40.605 0.300 . . . . . . . 124 ASN CB . 27128 1 415 . 1 . 1 124 124 ASN N N 15 125.404 0.300 . . . . . . . 124 ASN N . 27128 1 416 . 1 . 1 125 125 LEU H H 1 9.445 0.020 . . . . . . . 125 LEU H . 27128 1 417 . 1 . 1 125 125 LEU CA C 13 53.160 0.300 . . . . . . . 125 LEU CA . 27128 1 418 . 1 . 1 125 125 LEU CB C 13 45.427 0.300 . . . . . . . 125 LEU CB . 27128 1 419 . 1 . 1 125 125 LEU N N 15 129.076 0.300 . . . . . . . 125 LEU N . 27128 1 420 . 1 . 1 126 126 GLY H H 1 9.484 0.020 . . . . . . . 126 GLY H . 27128 1 421 . 1 . 1 126 126 GLY CA C 13 44.603 0.300 . . . . . . . 126 GLY CA . 27128 1 422 . 1 . 1 126 126 GLY N N 15 113.848 0.300 . . . . . . . 126 GLY N . 27128 1 423 . 1 . 1 127 127 CYS H H 1 8.520 0.020 . . . . . . . 127 CYS H . 27128 1 424 . 1 . 1 127 127 CYS CA C 13 57.961 0.300 . . . . . . . 127 CYS CA . 27128 1 425 . 1 . 1 127 127 CYS CB C 13 28.078 0.300 . . . . . . . 127 CYS CB . 27128 1 426 . 1 . 1 127 127 CYS N N 15 121.332 0.300 . . . . . . . 127 CYS N . 27128 1 427 . 1 . 1 128 128 ASP H H 1 9.373 0.020 . . . . . . . 128 ASP H . 27128 1 428 . 1 . 1 128 128 ASP CA C 13 52.258 0.300 . . . . . . . 128 ASP CA . 27128 1 429 . 1 . 1 128 128 ASP CB C 13 42.421 0.300 . . . . . . . 128 ASP CB . 27128 1 430 . 1 . 1 128 128 ASP N N 15 130.055 0.300 . . . . . . . 128 ASP N . 27128 1 431 . 1 . 1 129 129 MET H H 1 9.397 0.020 . . . . . . . 129 MET H . 27128 1 432 . 1 . 1 129 129 MET CA C 13 54.233 0.300 . . . . . . . 129 MET CA . 27128 1 433 . 1 . 1 129 129 MET CB C 13 35.406 0.300 . . . . . . . 129 MET CB . 27128 1 434 . 1 . 1 129 129 MET N N 15 123.006 0.300 . . . . . . . 129 MET N . 27128 1 435 . 1 . 1 130 130 ASP H H 1 8.517 0.020 . . . . . . . 130 ASP H . 27128 1 436 . 1 . 1 130 130 ASP CA C 13 52.625 0.300 . . . . . . . 130 ASP CA . 27128 1 437 . 1 . 1 130 130 ASP CB C 13 42.233 0.300 . . . . . . . 130 ASP CB . 27128 1 438 . 1 . 1 130 130 ASP N N 15 125.055 0.300 . . . . . . . 130 ASP N . 27128 1 439 . 1 . 1 131 131 PHE H H 1 8.520 0.020 . . . . . . . 131 PHE H . 27128 1 440 . 1 . 1 131 131 PHE CA C 13 57.639 0.300 . . . . . . . 131 PHE CA . 27128 1 441 . 1 . 1 131 131 PHE CB C 13 37.410 0.300 . . . . . . . 131 PHE CB . 27128 1 442 . 1 . 1 131 131 PHE N N 15 122.985 0.300 . . . . . . . 131 PHE N . 27128 1 443 . 1 . 1 132 132 ASP H H 1 7.380 0.020 . . . . . . . 132 ASP H . 27128 1 444 . 1 . 1 132 132 ASP CA C 13 53.862 0.300 . . . . . . . 132 ASP CA . 27128 1 445 . 1 . 1 132 132 ASP CB C 13 42.484 0.300 . . . . . . . 132 ASP CB . 27128 1 446 . 1 . 1 132 132 ASP N N 15 123.143 0.300 . . . . . . . 132 ASP N . 27128 1 447 . 1 . 1 133 133 ILE H H 1 8.428 0.020 . . . . . . . 133 ILE H . 27128 1 448 . 1 . 1 133 133 ILE CA C 13 62.887 0.300 . . . . . . . 133 ILE CA . 27128 1 449 . 1 . 1 133 133 ILE CB C 13 41.732 0.300 . . . . . . . 133 ILE CB . 27128 1 450 . 1 . 1 133 133 ILE N N 15 124.202 0.300 . . . . . . . 133 ILE N . 27128 1 451 . 1 . 1 134 134 ALA H H 1 8.470 0.020 . . . . . . . 134 ALA H . 27128 1 452 . 1 . 1 134 134 ALA CA C 13 52.358 0.300 . . . . . . . 134 ALA CA . 27128 1 453 . 1 . 1 134 134 ALA CB C 13 17.995 0.300 . . . . . . . 134 ALA CB . 27128 1 454 . 1 . 1 134 134 ALA N N 15 123.733 0.300 . . . . . . . 134 ALA N . 27128 1 455 . 1 . 1 135 135 GLY H H 1 7.657 0.020 . . . . . . . 135 GLY H . 27128 1 456 . 1 . 1 135 135 GLY CA C 13 44.269 0.300 . . . . . . . 135 GLY CA . 27128 1 457 . 1 . 1 135 135 GLY N N 15 106.560 0.300 . . . . . . . 135 GLY N . 27128 1 458 . 1 . 1 137 137 SER H H 1 8.862 0.020 . . . . . . . 137 SER H . 27128 1 459 . 1 . 1 137 137 SER CA C 13 57.171 0.300 . . . . . . . 137 SER CA . 27128 1 460 . 1 . 1 137 137 SER CB C 13 65.031 0.300 . . . . . . . 137 SER CB . 27128 1 461 . 1 . 1 137 137 SER N N 15 118.710 0.300 . . . . . . . 137 SER N . 27128 1 462 . 1 . 1 138 138 ILE H H 1 9.103 0.020 . . . . . . . 138 ILE H . 27128 1 463 . 1 . 1 138 138 ILE CA C 13 59.411 0.300 . . . . . . . 138 ILE CA . 27128 1 464 . 1 . 1 138 138 ILE CB C 13 40.605 0.300 . . . . . . . 138 ILE CB . 27128 1 465 . 1 . 1 138 138 ILE N N 15 122.811 0.300 . . . . . . . 138 ILE N . 27128 1 466 . 1 . 1 139 139 ARG H H 1 9.036 0.020 . . . . . . . 139 ARG H . 27128 1 467 . 1 . 1 139 139 ARG CA C 13 53.728 0.300 . . . . . . . 139 ARG CA . 27128 1 468 . 1 . 1 139 139 ARG CB C 13 31.711 0.300 . . . . . . . 139 ARG CB . 27128 1 469 . 1 . 1 139 139 ARG N N 15 128.694 0.300 . . . . . . . 139 ARG N . 27128 1 470 . 1 . 1 140 140 GLY H H 1 8.743 0.020 . . . . . . . 140 GLY H . 27128 1 471 . 1 . 1 140 140 GLY CA C 13 43.734 0.300 . . . . . . . 140 GLY CA . 27128 1 472 . 1 . 1 140 140 GLY N N 15 113.531 0.300 . . . . . . . 140 GLY N . 27128 1 473 . 1 . 1 141 141 ALA H H 1 8.945 0.020 . . . . . . . 141 ALA H . 27128 1 474 . 1 . 1 141 141 ALA CA C 13 50.754 0.300 . . . . . . . 141 ALA CA . 27128 1 475 . 1 . 1 141 141 ALA CB C 13 22.316 0.300 . . . . . . . 141 ALA CB . 27128 1 476 . 1 . 1 141 141 ALA N N 15 124.132 0.300 . . . . . . . 141 ALA N . 27128 1 477 . 1 . 1 142 142 LEU H H 1 9.208 0.020 . . . . . . . 142 LEU H . 27128 1 478 . 1 . 1 142 142 LEU CA C 13 53.501 0.300 . . . . . . . 142 LEU CA . 27128 1 479 . 1 . 1 142 142 LEU CB C 13 45.803 0.300 . . . . . . . 142 LEU CB . 27128 1 480 . 1 . 1 142 142 LEU N N 15 123.765 0.300 . . . . . . . 142 LEU N . 27128 1 481 . 1 . 1 143 143 VAL H H 1 8.995 0.020 . . . . . . . 143 VAL H . 27128 1 482 . 1 . 1 143 143 VAL CA C 13 60.614 0.300 . . . . . . . 143 VAL CA . 27128 1 483 . 1 . 1 143 143 VAL CB C 13 34.592 0.300 . . . . . . . 143 VAL CB . 27128 1 484 . 1 . 1 143 143 VAL N N 15 125.404 0.300 . . . . . . . 143 VAL N . 27128 1 485 . 1 . 1 144 144 LEU H H 1 9.337 0.020 . . . . . . . 144 LEU H . 27128 1 486 . 1 . 1 144 144 LEU CA C 13 51.890 0.300 . . . . . . . 144 LEU CA . 27128 1 487 . 1 . 1 144 144 LEU CB C 13 44.989 0.300 . . . . . . . 144 LEU CB . 27128 1 488 . 1 . 1 144 144 LEU N N 15 126.186 0.300 . . . . . . . 144 LEU N . 27128 1 489 . 1 . 1 145 145 GLY H H 1 8.151 0.020 . . . . . . . 145 GLY H . 27128 1 490 . 1 . 1 145 145 GLY CA C 13 44.603 0.300 . . . . . . . 145 GLY CA . 27128 1 491 . 1 . 1 145 145 GLY N N 15 105.514 0.300 . . . . . . . 145 GLY N . 27128 1 492 . 1 . 1 146 146 TYR H H 1 8.519 0.020 . . . . . . . 146 TYR H . 27128 1 493 . 1 . 1 146 146 TYR CA C 13 58.776 0.300 . . . . . . . 146 TYR CA . 27128 1 494 . 1 . 1 146 146 TYR CB C 13 41.043 0.300 . . . . . . . 146 TYR CB . 27128 1 495 . 1 . 1 146 146 TYR N N 15 123.206 0.300 . . . . . . . 146 TYR N . 27128 1 496 . 1 . 1 147 147 GLU H H 1 9.079 0.020 . . . . . . . 147 GLU H . 27128 1 497 . 1 . 1 147 147 GLU CA C 13 56.870 0.300 . . . . . . . 147 GLU CA . 27128 1 498 . 1 . 1 147 147 GLU CB C 13 26.700 0.300 . . . . . . . 147 GLU CB . 27128 1 499 . 1 . 1 147 147 GLU N N 15 126.075 0.300 . . . . . . . 147 GLU N . 27128 1 500 . 1 . 1 148 148 GLY H H 1 8.103 0.020 . . . . . . . 148 GLY H . 27128 1 501 . 1 . 1 148 148 GLY CA C 13 45.038 0.300 . . . . . . . 148 GLY CA . 27128 1 502 . 1 . 1 148 148 GLY N N 15 108.615 0.300 . . . . . . . 148 GLY N . 27128 1 503 . 1 . 1 149 149 TRP H H 1 8.138 0.020 . . . . . . . 149 TRP H . 27128 1 504 . 1 . 1 149 149 TRP CA C 13 57.071 0.300 . . . . . . . 149 TRP CA . 27128 1 505 . 1 . 1 149 149 TRP CB C 13 29.832 0.300 . . . . . . . 149 TRP CB . 27128 1 506 . 1 . 1 149 149 TRP N N 15 121.640 0.300 . . . . . . . 149 TRP N . 27128 1 507 . 1 . 1 150 150 LEU H H 1 8.962 0.020 . . . . . . . 150 LEU H . 27128 1 508 . 1 . 1 150 150 LEU CA C 13 53.327 0.300 . . . . . . . 150 LEU CA . 27128 1 509 . 1 . 1 150 150 LEU CB C 13 46.680 0.300 . . . . . . . 150 LEU CB . 27128 1 510 . 1 . 1 150 150 LEU N N 15 123.824 0.300 . . . . . . . 150 LEU N . 27128 1 511 . 1 . 1 151 151 ALA H H 1 8.858 0.020 . . . . . . . 151 ALA H . 27128 1 512 . 1 . 1 151 151 ALA CA C 13 50.520 0.300 . . . . . . . 151 ALA CA . 27128 1 513 . 1 . 1 151 151 ALA CB C 13 21.502 0.300 . . . . . . . 151 ALA CB . 27128 1 514 . 1 . 1 151 151 ALA N N 15 121.836 0.300 . . . . . . . 151 ALA N . 27128 1 515 . 1 . 1 152 152 GLY H H 1 9.622 0.020 . . . . . . . 152 GLY H . 27128 1 516 . 1 . 1 152 152 GLY CA C 13 45.105 0.300 . . . . . . . 152 GLY CA . 27128 1 517 . 1 . 1 152 152 GLY N N 15 107.941 0.300 . . . . . . . 152 GLY N . 27128 1 518 . 1 . 1 153 153 TYR H H 1 9.197 0.020 . . . . . . . 153 TYR H . 27128 1 519 . 1 . 1 153 153 TYR CA C 13 55.868 0.300 . . . . . . . 153 TYR CA . 27128 1 520 . 1 . 1 153 153 TYR CB C 13 43.298 0.300 . . . . . . . 153 TYR CB . 27128 1 521 . 1 . 1 153 153 TYR N N 15 122.221 0.300 . . . . . . . 153 TYR N . 27128 1 522 . 1 . 1 154 154 GLN H H 1 8.188 0.020 . . . . . . . 154 GLN H . 27128 1 523 . 1 . 1 154 154 GLN CA C 13 52.993 0.300 . . . . . . . 154 GLN CA . 27128 1 524 . 1 . 1 154 154 GLN CB C 13 30.897 0.300 . . . . . . . 154 GLN CB . 27128 1 525 . 1 . 1 154 154 GLN N N 15 128.115 0.300 . . . . . . . 154 GLN N . 27128 1 526 . 1 . 1 155 155 MET H H 1 8.750 0.020 . . . . . . . 155 MET H . 27128 1 527 . 1 . 1 155 155 MET CA C 13 52.726 0.300 . . . . . . . 155 MET CA . 27128 1 528 . 1 . 1 155 155 MET CB C 13 34.780 0.300 . . . . . . . 155 MET CB . 27128 1 529 . 1 . 1 155 155 MET N N 15 121.499 0.300 . . . . . . . 155 MET N . 27128 1 530 . 1 . 1 156 156 ASN H H 1 7.970 0.020 . . . . . . . 156 ASN H . 27128 1 531 . 1 . 1 156 156 ASN CA C 13 52.124 0.300 . . . . . . . 156 ASN CA . 27128 1 532 . 1 . 1 156 156 ASN CB C 13 42.233 0.300 . . . . . . . 156 ASN CB . 27128 1 533 . 1 . 1 156 156 ASN N N 15 119.686 0.300 . . . . . . . 156 ASN N . 27128 1 534 . 1 . 1 157 157 PHE H H 1 9.547 0.020 . . . . . . . 157 PHE H . 27128 1 535 . 1 . 1 157 157 PHE CA C 13 56.001 0.300 . . . . . . . 157 PHE CA . 27128 1 536 . 1 . 1 157 157 PHE CB C 13 41.795 0.300 . . . . . . . 157 PHE CB . 27128 1 537 . 1 . 1 157 157 PHE N N 15 127.679 0.300 . . . . . . . 157 PHE N . 27128 1 538 . 1 . 1 158 158 GLU H H 1 8.113 0.020 . . . . . . . 158 GLU H . 27128 1 539 . 1 . 1 158 158 GLU CA C 13 54.698 0.300 . . . . . . . 158 GLU CA . 27128 1 540 . 1 . 1 158 158 GLU CB C 13 29.707 0.300 . . . . . . . 158 GLU CB . 27128 1 541 . 1 . 1 158 158 GLU N N 15 127.943 0.300 . . . . . . . 158 GLU N . 27128 1 542 . 1 . 1 159 159 THR H H 1 7.647 0.020 . . . . . . . 159 THR H . 27128 1 543 . 1 . 1 159 159 THR CA C 13 64.725 0.300 . . . . . . . 159 THR CA . 27128 1 544 . 1 . 1 159 159 THR CB C 13 67.975 0.300 . . . . . . . 159 THR CB . 27128 1 545 . 1 . 1 159 159 THR N N 15 117.059 0.300 . . . . . . . 159 THR N . 27128 1 546 . 1 . 1 160 160 ALA H H 1 9.130 0.020 . . . . . . . 160 ALA H . 27128 1 547 . 1 . 1 160 160 ALA CA C 13 54.366 0.300 . . . . . . . 160 ALA CA . 27128 1 548 . 1 . 1 160 160 ALA CB C 13 17.995 0.300 . . . . . . . 160 ALA CB . 27128 1 549 . 1 . 1 160 160 ALA N N 15 125.284 0.300 . . . . . . . 160 ALA N . 27128 1 550 . 1 . 1 162 162 SER H H 1 7.466 0.020 . . . . . . . 162 SER H . 27128 1 551 . 1 . 1 162 162 SER CA C 13 58.140 0.300 . . . . . . . 162 SER CA . 27128 1 552 . 1 . 1 162 162 SER CB C 13 61.211 0.300 . . . . . . . 162 SER CB . 27128 1 553 . 1 . 1 162 162 SER N N 15 114.769 0.300 . . . . . . . 162 SER N . 27128 1 554 . 1 . 1 163 163 ARG H H 1 6.855 0.020 . . . . . . . 163 ARG H . 27128 1 555 . 1 . 1 163 163 ARG CA C 13 53.628 0.300 . . . . . . . 163 ARG CA . 27128 1 556 . 1 . 1 163 163 ARG CB C 13 32.964 0.300 . . . . . . . 163 ARG CB . 27128 1 557 . 1 . 1 163 163 ARG N N 15 115.442 0.300 . . . . . . . 163 ARG N . 27128 1 558 . 1 . 1 164 164 VAL H H 1 8.818 0.020 . . . . . . . 164 VAL H . 27128 1 559 . 1 . 1 164 164 VAL CA C 13 61.851 0.300 . . . . . . . 164 VAL CA . 27128 1 560 . 1 . 1 164 164 VAL CB C 13 31.085 0.300 . . . . . . . 164 VAL CB . 27128 1 561 . 1 . 1 164 164 VAL N N 15 124.566 0.300 . . . . . . . 164 VAL N . 27128 1 562 . 1 . 1 165 165 THR H H 1 8.617 0.020 . . . . . . . 165 THR H . 27128 1 563 . 1 . 1 165 165 THR CA C 13 61.216 0.300 . . . . . . . 165 THR CA . 27128 1 564 . 1 . 1 165 165 THR CB C 13 68.664 0.300 . . . . . . . 165 THR CB . 27128 1 565 . 1 . 1 165 165 THR N N 15 119.187 0.300 . . . . . . . 165 THR N . 27128 1 566 . 1 . 1 166 166 GLN H H 1 7.438 0.020 . . . . . . . 166 GLN H . 27128 1 567 . 1 . 1 166 166 GLN CA C 13 55.166 0.300 . . . . . . . 166 GLN CA . 27128 1 568 . 1 . 1 166 166 GLN CB C 13 31.962 0.300 . . . . . . . 166 GLN CB . 27128 1 569 . 1 . 1 166 166 GLN N N 15 121.189 0.300 . . . . . . . 166 GLN N . 27128 1 570 . 1 . 1 167 167 SER H H 1 8.291 0.020 . . . . . . . 167 SER H . 27128 1 571 . 1 . 1 167 167 SER CA C 13 56.837 0.300 . . . . . . . 167 SER CA . 27128 1 572 . 1 . 1 167 167 SER CB C 13 63.152 0.300 . . . . . . . 167 SER CB . 27128 1 573 . 1 . 1 167 167 SER N N 15 118.999 0.300 . . . . . . . 167 SER N . 27128 1 574 . 1 . 1 168 168 ASN H H 1 9.127 0.020 . . . . . . . 168 ASN H . 27128 1 575 . 1 . 1 168 168 ASN CA C 13 51.389 0.300 . . . . . . . 168 ASN CA . 27128 1 576 . 1 . 1 168 168 ASN CB C 13 41.231 0.300 . . . . . . . 168 ASN CB . 27128 1 577 . 1 . 1 168 168 ASN N N 15 127.614 0.300 . . . . . . . 168 ASN N . 27128 1 578 . 1 . 1 169 169 PHE H H 1 8.601 0.020 . . . . . . . 169 PHE H . 27128 1 579 . 1 . 1 169 169 PHE CA C 13 55.901 0.300 . . . . . . . 169 PHE CA . 27128 1 580 . 1 . 1 169 169 PHE CB C 13 43.799 0.300 . . . . . . . 169 PHE CB . 27128 1 581 . 1 . 1 169 169 PHE N N 15 118.209 0.300 . . . . . . . 169 PHE N . 27128 1 582 . 1 . 1 170 170 ALA H H 1 8.813 0.020 . . . . . . . 170 ALA H . 27128 1 583 . 1 . 1 170 170 ALA CA C 13 50.887 0.300 . . . . . . . 170 ALA CA . 27128 1 584 . 1 . 1 170 170 ALA CB C 13 23.068 0.300 . . . . . . . 170 ALA CB . 27128 1 585 . 1 . 1 170 170 ALA N N 15 122.648 0.300 . . . . . . . 170 ALA N . 27128 1 586 . 1 . 1 171 171 VAL H H 1 8.220 0.020 . . . . . . . 171 VAL H . 27128 1 587 . 1 . 1 171 171 VAL CA C 13 60.012 0.300 . . . . . . . 171 VAL CA . 27128 1 588 . 1 . 1 171 171 VAL CB C 13 34.968 0.300 . . . . . . . 171 VAL CB . 27128 1 589 . 1 . 1 171 171 VAL N N 15 117.034 0.300 . . . . . . . 171 VAL N . 27128 1 590 . 1 . 1 172 172 GLY H H 1 9.447 0.020 . . . . . . . 172 GLY H . 27128 1 591 . 1 . 1 172 172 GLY CA C 13 45.539 0.300 . . . . . . . 172 GLY CA . 27128 1 592 . 1 . 1 172 172 GLY N N 15 113.298 0.300 . . . . . . . 172 GLY N . 27128 1 593 . 1 . 1 173 173 TYR H H 1 8.582 0.020 . . . . . . . 173 TYR H . 27128 1 594 . 1 . 1 173 173 TYR CA C 13 56.503 0.300 . . . . . . . 173 TYR CA . 27128 1 595 . 1 . 1 173 173 TYR CB C 13 42.108 0.300 . . . . . . . 173 TYR CB . 27128 1 596 . 1 . 1 173 173 TYR N N 15 119.664 0.300 . . . . . . . 173 TYR N . 27128 1 597 . 1 . 1 174 174 LYS H H 1 8.733 0.020 . . . . . . . 174 LYS H . 27128 1 598 . 1 . 1 174 174 LYS CA C 13 55.299 0.300 . . . . . . . 174 LYS CA . 27128 1 599 . 1 . 1 174 174 LYS CB C 13 35.469 0.300 . . . . . . . 174 LYS CB . 27128 1 600 . 1 . 1 174 174 LYS N N 15 129.560 0.300 . . . . . . . 174 LYS N . 27128 1 601 . 1 . 1 175 175 THR H H 1 8.628 0.020 . . . . . . . 175 THR H . 27128 1 602 . 1 . 1 175 175 THR CA C 13 59.326 0.300 . . . . . . . 175 THR CA . 27128 1 603 . 1 . 1 175 175 THR CB C 13 71.169 0.300 . . . . . . . 175 THR CB . 27128 1 604 . 1 . 1 175 175 THR N N 15 118.231 0.300 . . . . . . . 175 THR N . 27128 1 605 . 1 . 1 176 176 ASP H H 1 8.545 0.020 . . . . . . . 176 ASP H . 27128 1 606 . 1 . 1 176 176 ASP CA C 13 57.095 0.300 . . . . . . . 176 ASP CA . 27128 1 607 . 1 . 1 176 176 ASP CB C 13 39.791 0.300 . . . . . . . 176 ASP CB . 27128 1 608 . 1 . 1 176 176 ASP N N 15 118.728 0.300 . . . . . . . 176 ASP N . 27128 1 609 . 1 . 1 177 177 GLU H H 1 8.081 0.020 . . . . . . . 177 GLU H . 27128 1 610 . 1 . 1 177 177 GLU CA C 13 56.302 0.300 . . . . . . . 177 GLU CA . 27128 1 611 . 1 . 1 177 177 GLU CB C 13 30.584 0.300 . . . . . . . 177 GLU CB . 27128 1 612 . 1 . 1 177 177 GLU N N 15 114.189 0.300 . . . . . . . 177 GLU N . 27128 1 613 . 1 . 1 178 178 PHE H H 1 7.498 0.020 . . . . . . . 178 PHE H . 27128 1 614 . 1 . 1 178 178 PHE CA C 13 56.035 0.300 . . . . . . . 178 PHE CA . 27128 1 615 . 1 . 1 178 178 PHE CB C 13 41.669 0.300 . . . . . . . 178 PHE CB . 27128 1 616 . 1 . 1 178 178 PHE N N 15 119.964 0.300 . . . . . . . 178 PHE N . 27128 1 617 . 1 . 1 179 179 GLN H H 1 8.686 0.020 . . . . . . . 179 GLN H . 27128 1 618 . 1 . 1 179 179 GLN CA C 13 53.628 0.300 . . . . . . . 179 GLN CA . 27128 1 619 . 1 . 1 179 179 GLN CB C 13 31.648 0.300 . . . . . . . 179 GLN CB . 27128 1 620 . 1 . 1 179 179 GLN N N 15 122.731 0.300 . . . . . . . 179 GLN N . 27128 1 621 . 1 . 1 180 180 LEU H H 1 9.324 0.020 . . . . . . . 180 LEU H . 27128 1 622 . 1 . 1 180 180 LEU CA C 13 53.294 0.300 . . . . . . . 180 LEU CA . 27128 1 623 . 1 . 1 180 180 LEU CB C 13 44.864 0.300 . . . . . . . 180 LEU CB . 27128 1 624 . 1 . 1 180 180 LEU N N 15 127.814 0.300 . . . . . . . 180 LEU N . 27128 1 625 . 1 . 1 181 181 HIS H H 1 9.156 0.020 . . . . . . . 181 HIS H . 27128 1 626 . 1 . 1 181 181 HIS CA C 13 55.868 0.300 . . . . . . . 181 HIS CA . 27128 1 627 . 1 . 1 181 181 HIS CB C 13 30.709 0.300 . . . . . . . 181 HIS CB . 27128 1 628 . 1 . 1 181 181 HIS N N 15 128.873 0.300 . . . . . . . 181 HIS N . 27128 1 629 . 1 . 1 182 182 THR H H 1 7.759 0.020 . . . . . . . 182 THR H . 27128 1 630 . 1 . 1 182 182 THR CA C 13 59.611 0.300 . . . . . . . 182 THR CA . 27128 1 631 . 1 . 1 182 182 THR N N 15 118.255 0.300 . . . . . . . 182 THR N . 27128 1 632 . 1 . 1 183 183 ASN H H 1 8.851 0.020 . . . . . . . 183 ASN H . 27128 1 633 . 1 . 1 183 183 ASN CA C 13 52.926 0.300 . . . . . . . 183 ASN CA . 27128 1 634 . 1 . 1 183 183 ASN CB C 13 42.609 0.300 . . . . . . . 183 ASN CB . 27128 1 635 . 1 . 1 183 183 ASN N N 15 116.688 0.300 . . . . . . . 183 ASN N . 27128 1 636 . 1 . 1 184 184 VAL H H 1 8.910 0.020 . . . . . . . 184 VAL H . 27128 1 637 . 1 . 1 184 184 VAL CA C 13 59.879 0.300 . . . . . . . 184 VAL CA . 27128 1 638 . 1 . 1 184 184 VAL CB C 13 32.650 0.300 . . . . . . . 184 VAL CB . 27128 1 639 . 1 . 1 184 184 VAL N N 15 118.387 0.300 . . . . . . . 184 VAL N . 27128 1 640 . 1 . 1 185 185 ASN H H 1 9.340 0.020 . . . . . . . 185 ASN H . 27128 1 641 . 1 . 1 185 185 ASN CA C 13 51.121 0.300 . . . . . . . 185 ASN CA . 27128 1 642 . 1 . 1 185 185 ASN CB C 13 37.661 0.300 . . . . . . . 185 ASN CB . 27128 1 643 . 1 . 1 185 185 ASN N N 15 129.686 0.300 . . . . . . . 185 ASN N . 27128 1 644 . 1 . 1 186 186 ASP H H 1 8.978 0.020 . . . . . . . 186 ASP H . 27128 1 645 . 1 . 1 186 186 ASP CA C 13 55.667 0.300 . . . . . . . 186 ASP CA . 27128 1 646 . 1 . 1 186 186 ASP CB C 13 40.166 0.300 . . . . . . . 186 ASP CB . 27128 1 647 . 1 . 1 186 186 ASP N N 15 125.238 0.300 . . . . . . . 186 ASP N . 27128 1 648 . 1 . 1 187 187 GLY H H 1 8.640 0.020 . . . . . . . 187 GLY H . 27128 1 649 . 1 . 1 187 187 GLY CA C 13 45.874 0.300 . . . . . . . 187 GLY CA . 27128 1 650 . 1 . 1 187 187 GLY N N 15 105.313 0.300 . . . . . . . 187 GLY N . 27128 1 651 . 1 . 1 188 188 THR H H 1 7.629 0.020 . . . . . . . 188 THR H . 27128 1 652 . 1 . 1 188 188 THR CA C 13 62.319 0.300 . . . . . . . 188 THR CA . 27128 1 653 . 1 . 1 188 188 THR N N 15 109.309 0.300 . . . . . . . 188 THR N . 27128 1 654 . 1 . 1 189 189 GLU H H 1 7.632 0.020 . . . . . . . 189 GLU H . 27128 1 655 . 1 . 1 189 189 GLU CA C 13 54.497 0.300 . . . . . . . 189 GLU CA . 27128 1 656 . 1 . 1 189 189 GLU CB C 13 30.270 0.300 . . . . . . . 189 GLU CB . 27128 1 657 . 1 . 1 189 189 GLU N N 15 122.986 0.300 . . . . . . . 189 GLU N . 27128 1 658 . 1 . 1 190 190 PHE H H 1 8.864 0.020 . . . . . . . 190 PHE H . 27128 1 659 . 1 . 1 190 190 PHE CA C 13 55.634 0.300 . . . . . . . 190 PHE CA . 27128 1 660 . 1 . 1 190 190 PHE CB C 13 40.542 0.300 . . . . . . . 190 PHE CB . 27128 1 661 . 1 . 1 190 190 PHE N N 15 125.702 0.300 . . . . . . . 190 PHE N . 27128 1 662 . 1 . 1 191 191 GLY H H 1 8.539 0.020 . . . . . . . 191 GLY H . 27128 1 663 . 1 . 1 191 191 GLY CA C 13 44.369 0.300 . . . . . . . 191 GLY CA . 27128 1 664 . 1 . 1 191 191 GLY N N 15 110.673 0.300 . . . . . . . 191 GLY N . 27128 1 665 . 1 . 1 192 192 GLY H H 1 8.604 0.020 . . . . . . . 192 GLY H . 27128 1 666 . 1 . 1 192 192 GLY CA C 13 45.372 0.300 . . . . . . . 192 GLY CA . 27128 1 667 . 1 . 1 192 192 GLY N N 15 105.694 0.300 . . . . . . . 192 GLY N . 27128 1 668 . 1 . 1 193 193 SER H H 1 9.763 0.020 . . . . . . . 193 SER H . 27128 1 669 . 1 . 1 193 193 SER CA C 13 55.968 0.300 . . . . . . . 193 SER CA . 27128 1 670 . 1 . 1 193 193 SER CB C 13 66.472 0.300 . . . . . . . 193 SER CB . 27128 1 671 . 1 . 1 193 193 SER N N 15 114.693 0.300 . . . . . . . 193 SER N . 27128 1 672 . 1 . 1 194 194 ILE H H 1 8.796 0.020 . . . . . . . 194 ILE H . 27128 1 673 . 1 . 1 194 194 ILE CA C 13 59.411 0.300 . . . . . . . 194 ILE CA . 27128 1 674 . 1 . 1 194 194 ILE CB C 13 41.356 0.300 . . . . . . . 194 ILE CB . 27128 1 675 . 1 . 1 194 194 ILE N N 15 119.044 0.300 . . . . . . . 194 ILE N . 27128 1 676 . 1 . 1 195 195 TYR H H 1 8.770 0.020 . . . . . . . 195 TYR H . 27128 1 677 . 1 . 1 195 195 TYR CA C 13 55.466 0.300 . . . . . . . 195 TYR CA . 27128 1 678 . 1 . 1 195 195 TYR CB C 13 42.108 0.300 . . . . . . . 195 TYR CB . 27128 1 679 . 1 . 1 195 195 TYR N N 15 127.565 0.300 . . . . . . . 195 TYR N . 27128 1 680 . 1 . 1 196 196 GLN H H 1 8.254 0.020 . . . . . . . 196 GLN H . 27128 1 681 . 1 . 1 196 196 GLN CA C 13 53.494 0.300 . . . . . . . 196 GLN CA . 27128 1 682 . 1 . 1 196 196 GLN CB C 13 31.523 0.300 . . . . . . . 196 GLN CB . 27128 1 683 . 1 . 1 196 196 GLN N N 15 125.686 0.300 . . . . . . . 196 GLN N . 27128 1 684 . 1 . 1 197 197 LYS H H 1 8.931 0.020 . . . . . . . 197 LYS H . 27128 1 685 . 1 . 1 197 197 LYS CA C 13 55.634 0.300 . . . . . . . 197 LYS CA . 27128 1 686 . 1 . 1 197 197 LYS CB C 13 30.959 0.300 . . . . . . . 197 LYS CB . 27128 1 687 . 1 . 1 197 197 LYS N N 15 130.688 0.300 . . . . . . . 197 LYS N . 27128 1 688 . 1 . 1 198 198 VAL H H 1 8.606 0.020 . . . . . . . 198 VAL H . 27128 1 689 . 1 . 1 198 198 VAL CA C 13 64.859 0.300 . . . . . . . 198 VAL CA . 27128 1 690 . 1 . 1 198 198 VAL N N 15 131.304 0.300 . . . . . . . 198 VAL N . 27128 1 691 . 1 . 1 199 199 ASN H H 1 8.152 0.020 . . . . . . . 199 ASN H . 27128 1 692 . 1 . 1 199 199 ASN CA C 13 51.888 0.300 . . . . . . . 199 ASN CA . 27128 1 693 . 1 . 1 199 199 ASN N N 15 113.698 0.300 . . . . . . . 199 ASN N . 27128 1 694 . 1 . 1 202 202 LEU H H 1 7.531 0.020 . . . . . . . 202 LEU H . 27128 1 695 . 1 . 1 202 202 LEU CA C 13 53.929 0.300 . . . . . . . 202 LEU CA . 27128 1 696 . 1 . 1 202 202 LEU CB C 13 44.237 0.300 . . . . . . . 202 LEU CB . 27128 1 697 . 1 . 1 202 202 LEU N N 15 122.216 0.300 . . . . . . . 202 LEU N . 27128 1 698 . 1 . 1 203 203 GLU H H 1 8.833 0.020 . . . . . . . 203 GLU H . 27128 1 699 . 1 . 1 203 203 GLU CA C 13 53.996 0.300 . . . . . . . 203 GLU CA . 27128 1 700 . 1 . 1 203 203 GLU CB C 13 33.653 0.300 . . . . . . . 203 GLU CB . 27128 1 701 . 1 . 1 203 203 GLU N N 15 125.702 0.300 . . . . . . . 203 GLU N . 27128 1 702 . 1 . 1 204 204 THR H H 1 8.365 0.020 . . . . . . . 204 THR H . 27128 1 703 . 1 . 1 204 204 THR CA C 13 59.210 0.300 . . . . . . . 204 THR CA . 27128 1 704 . 1 . 1 204 204 THR CB C 13 72.422 0.300 . . . . . . . 204 THR CB . 27128 1 705 . 1 . 1 204 204 THR N N 15 112.280 0.300 . . . . . . . 204 THR N . 27128 1 706 . 1 . 1 205 205 ALA H H 1 9.022 0.020 . . . . . . . 205 ALA H . 27128 1 707 . 1 . 1 205 205 ALA CA C 13 50.653 0.300 . . . . . . . 205 ALA CA . 27128 1 708 . 1 . 1 205 205 ALA CB C 13 23.318 0.300 . . . . . . . 205 ALA CB . 27128 1 709 . 1 . 1 205 205 ALA N N 15 122.694 0.300 . . . . . . . 205 ALA N . 27128 1 710 . 1 . 1 206 206 VAL H H 1 8.952 0.020 . . . . . . . 206 VAL H . 27128 1 711 . 1 . 1 206 206 VAL CA C 13 59.277 0.300 . . . . . . . 206 VAL CA . 27128 1 712 . 1 . 1 206 206 VAL CB C 13 35.406 0.300 . . . . . . . 206 VAL CB . 27128 1 713 . 1 . 1 206 206 VAL N N 15 116.936 0.300 . . . . . . . 206 VAL N . 27128 1 714 . 1 . 1 207 207 ASN H H 1 8.876 0.020 . . . . . . . 207 ASN H . 27128 1 715 . 1 . 1 207 207 ASN CA C 13 51.823 0.300 . . . . . . . 207 ASN CA . 27128 1 716 . 1 . 1 207 207 ASN CB C 13 41.920 0.300 . . . . . . . 207 ASN CB . 27128 1 717 . 1 . 1 207 207 ASN N N 15 122.683 0.300 . . . . . . . 207 ASN N . 27128 1 718 . 1 . 1 208 208 LEU H H 1 8.661 0.020 . . . . . . . 208 LEU H . 27128 1 719 . 1 . 1 208 208 LEU CA C 13 54.029 0.300 . . . . . . . 208 LEU CA . 27128 1 720 . 1 . 1 208 208 LEU CB C 13 45.615 0.300 . . . . . . . 208 LEU CB . 27128 1 721 . 1 . 1 208 208 LEU N N 15 121.195 0.300 . . . . . . . 208 LEU N . 27128 1 722 . 1 . 1 209 209 ALA H H 1 9.181 0.020 . . . . . . . 209 ALA H . 27128 1 723 . 1 . 1 209 209 ALA CA C 13 51.756 0.300 . . . . . . . 209 ALA CA . 27128 1 724 . 1 . 1 209 209 ALA CB C 13 22.003 0.300 . . . . . . . 209 ALA CB . 27128 1 725 . 1 . 1 209 209 ALA N N 15 126.445 0.300 . . . . . . . 209 ALA N . 27128 1 726 . 1 . 1 210 210 TRP H H 1 8.992 0.020 . . . . . . . 210 TRP H . 27128 1 727 . 1 . 1 210 210 TRP CA C 13 57.405 0.300 . . . . . . . 210 TRP CA . 27128 1 728 . 1 . 1 210 210 TRP CB C 13 31.586 0.300 . . . . . . . 210 TRP CB . 27128 1 729 . 1 . 1 210 210 TRP N N 15 121.484 0.300 . . . . . . . 210 TRP N . 27128 1 730 . 1 . 1 211 211 THR H H 1 8.522 0.020 . . . . . . . 211 THR H . 27128 1 731 . 1 . 1 211 211 THR CA C 13 60.258 0.300 . . . . . . . 211 THR CA . 27128 1 732 . 1 . 1 211 211 THR CB C 13 70.605 0.300 . . . . . . . 211 THR CB . 27128 1 733 . 1 . 1 211 211 THR N N 15 120.924 0.300 . . . . . . . 211 THR N . 27128 1 734 . 1 . 1 212 212 ALA H H 1 8.661 0.020 . . . . . . . 212 ALA H . 27128 1 735 . 1 . 1 212 212 ALA CA C 13 53.093 0.300 . . . . . . . 212 ALA CA . 27128 1 736 . 1 . 1 212 212 ALA CB C 13 17.932 0.300 . . . . . . . 212 ALA CB . 27128 1 737 . 1 . 1 212 212 ALA N N 15 127.189 0.300 . . . . . . . 212 ALA N . 27128 1 738 . 1 . 1 213 213 GLY H H 1 8.372 0.020 . . . . . . . 213 GLY H . 27128 1 739 . 1 . 1 213 213 GLY CA C 13 44.871 0.300 . . . . . . . 213 GLY CA . 27128 1 740 . 1 . 1 213 213 GLY N N 15 110.188 0.300 . . . . . . . 213 GLY N . 27128 1 741 . 1 . 1 214 214 ASN H H 1 7.955 0.020 . . . . . . . 214 ASN H . 27128 1 742 . 1 . 1 214 214 ASN CA C 13 52.124 0.300 . . . . . . . 214 ASN CA . 27128 1 743 . 1 . 1 214 214 ASN CB C 13 39.289 0.300 . . . . . . . 214 ASN CB . 27128 1 744 . 1 . 1 214 214 ASN N N 15 119.352 0.300 . . . . . . . 214 ASN N . 27128 1 745 . 1 . 1 216 216 ASN H H 1 8.390 0.020 . . . . . . . 216 ASN H . 27128 1 746 . 1 . 1 216 216 ASN CA C 13 52.902 0.300 . . . . . . . 216 ASN CA . 27128 1 747 . 1 . 1 216 216 ASN CB C 13 38.663 0.300 . . . . . . . 216 ASN CB . 27128 1 748 . 1 . 1 216 216 ASN N N 15 120.536 0.300 . . . . . . . 216 ASN N . 27128 1 749 . 1 . 1 217 217 THR H H 1 8.377 0.020 . . . . . . . 217 THR H . 27128 1 750 . 1 . 1 217 217 THR CA C 13 62.486 0.300 . . . . . . . 217 THR CA . 27128 1 751 . 1 . 1 217 217 THR CB C 13 69.603 0.300 . . . . . . . 217 THR CB . 27128 1 752 . 1 . 1 217 217 THR N N 15 119.565 0.300 . . . . . . . 217 THR N . 27128 1 753 . 1 . 1 218 218 ARG H H 1 9.020 0.020 . . . . . . . 218 ARG H . 27128 1 754 . 1 . 1 218 218 ARG CA C 13 54.831 0.300 . . . . . . . 218 ARG CA . 27128 1 755 . 1 . 1 218 218 ARG CB C 13 30.709 0.300 . . . . . . . 218 ARG CB . 27128 1 756 . 1 . 1 218 218 ARG N N 15 125.879 0.300 . . . . . . . 218 ARG N . 27128 1 757 . 1 . 1 219 219 PHE H H 1 8.032 0.020 . . . . . . . 219 PHE H . 27128 1 758 . 1 . 1 219 219 PHE CA C 13 55.767 0.300 . . . . . . . 219 PHE CA . 27128 1 759 . 1 . 1 219 219 PHE CB C 13 41.669 0.300 . . . . . . . 219 PHE CB . 27128 1 760 . 1 . 1 219 219 PHE N N 15 119.000 0.300 . . . . . . . 219 PHE N . 27128 1 761 . 1 . 1 220 220 GLY H H 1 8.554 0.020 . . . . . . . 220 GLY H . 27128 1 762 . 1 . 1 220 220 GLY CA C 13 44.971 0.300 . . . . . . . 220 GLY CA . 27128 1 763 . 1 . 1 220 220 GLY N N 15 107.622 0.300 . . . . . . . 220 GLY N . 27128 1 764 . 1 . 1 221 221 ILE H H 1 8.798 0.020 . . . . . . . 221 ILE H . 27128 1 765 . 1 . 1 221 221 ILE CA C 13 59.411 0.300 . . . . . . . 221 ILE CA . 27128 1 766 . 1 . 1 221 221 ILE CB C 13 41.294 0.300 . . . . . . . 221 ILE CB . 27128 1 767 . 1 . 1 221 221 ILE N N 15 118.717 0.300 . . . . . . . 221 ILE N . 27128 1 768 . 1 . 1 222 222 ALA H H 1 8.851 0.020 . . . . . . . 222 ALA H . 27128 1 769 . 1 . 1 222 222 ALA CA C 13 50.052 0.300 . . . . . . . 222 ALA CA . 27128 1 770 . 1 . 1 222 222 ALA CB C 13 21.753 0.300 . . . . . . . 222 ALA CB . 27128 1 771 . 1 . 1 222 222 ALA N N 15 126.408 0.300 . . . . . . . 222 ALA N . 27128 1 772 . 1 . 1 223 223 ALA H H 1 9.192 0.020 . . . . . . . 223 ALA H . 27128 1 773 . 1 . 1 223 223 ALA CA C 13 50.152 0.300 . . . . . . . 223 ALA CA . 27128 1 774 . 1 . 1 223 223 ALA CB C 13 22.943 0.300 . . . . . . . 223 ALA CB . 27128 1 775 . 1 . 1 223 223 ALA N N 15 119.433 0.300 . . . . . . . 223 ALA N . 27128 1 776 . 1 . 1 224 224 LYS H H 1 8.737 0.020 . . . . . . . 224 LYS H . 27128 1 777 . 1 . 1 224 224 LYS CA C 13 55.968 0.300 . . . . . . . 224 LYS CA . 27128 1 778 . 1 . 1 224 224 LYS CB C 13 35.845 0.300 . . . . . . . 224 LYS CB . 27128 1 779 . 1 . 1 224 224 LYS N N 15 122.644 0.300 . . . . . . . 224 LYS N . 27128 1 780 . 1 . 1 225 225 TYR H H 1 9.860 0.020 . . . . . . . 225 TYR H . 27128 1 781 . 1 . 1 225 225 TYR CA C 13 54.999 0.300 . . . . . . . 225 TYR CA . 27128 1 782 . 1 . 1 225 225 TYR CB C 13 41.795 0.300 . . . . . . . 225 TYR CB . 27128 1 783 . 1 . 1 225 225 TYR N N 15 129.119 0.300 . . . . . . . 225 TYR N . 27128 1 784 . 1 . 1 226 226 GLN H H 1 9.016 0.020 . . . . . . . 226 GLN H . 27128 1 785 . 1 . 1 226 226 GLN CA C 13 54.263 0.300 . . . . . . . 226 GLN CA . 27128 1 786 . 1 . 1 226 226 GLN CB C 13 26.638 0.300 . . . . . . . 226 GLN CB . 27128 1 787 . 1 . 1 226 226 GLN N N 15 131.812 0.300 . . . . . . . 226 GLN N . 27128 1 788 . 1 . 1 227 227 ILE H H 1 7.795 0.020 . . . . . . . 227 ILE H . 27128 1 789 . 1 . 1 227 227 ILE CA C 13 64.391 0.300 . . . . . . . 227 ILE CA . 27128 1 790 . 1 . 1 227 227 ILE N N 15 130.062 0.300 . . . . . . . 227 ILE N . 27128 1 791 . 1 . 1 228 228 ASP H H 1 8.418 0.020 . . . . . . . 228 ASP H . 27128 1 792 . 1 . 1 228 228 ASP CA C 13 52.559 0.300 . . . . . . . 228 ASP CA . 27128 1 793 . 1 . 1 228 228 ASP CB C 13 40.417 0.300 . . . . . . . 228 ASP CB . 27128 1 794 . 1 . 1 228 228 ASP N N 15 118.381 0.300 . . . . . . . 228 ASP N . 27128 1 795 . 1 . 1 230 230 ASP H H 1 8.469 0.020 . . . . . . . 230 ASP H . 27128 1 796 . 1 . 1 230 230 ASP CA C 13 53.494 0.300 . . . . . . . 230 ASP CA . 27128 1 797 . 1 . 1 230 230 ASP CB C 13 42.484 0.300 . . . . . . . 230 ASP CB . 27128 1 798 . 1 . 1 230 230 ASP N N 15 114.187 0.300 . . . . . . . 230 ASP N . 27128 1 799 . 1 . 1 231 231 ALA H H 1 7.637 0.020 . . . . . . . 231 ALA H . 27128 1 800 . 1 . 1 231 231 ALA CA C 13 51.522 0.300 . . . . . . . 231 ALA CA . 27128 1 801 . 1 . 1 231 231 ALA CB C 13 22.128 0.300 . . . . . . . 231 ALA CB . 27128 1 802 . 1 . 1 231 231 ALA N N 15 124.271 0.300 . . . . . . . 231 ALA N . 27128 1 803 . 1 . 1 232 232 CYS H H 1 8.443 0.020 . . . . . . . 232 CYS H . 27128 1 804 . 1 . 1 232 232 CYS CA C 13 55.864 0.300 . . . . . . . 232 CYS CA . 27128 1 805 . 1 . 1 232 232 CYS CB C 13 30.020 0.300 . . . . . . . 232 CYS CB . 27128 1 806 . 1 . 1 232 232 CYS N N 15 119.221 0.300 . . . . . . . 232 CYS N . 27128 1 807 . 1 . 1 233 233 PHE H H 1 9.224 0.020 . . . . . . . 233 PHE H . 27128 1 808 . 1 . 1 233 233 PHE CA C 13 55.400 0.300 . . . . . . . 233 PHE CA . 27128 1 809 . 1 . 1 233 233 PHE CB C 13 43.110 0.300 . . . . . . . 233 PHE CB . 27128 1 810 . 1 . 1 233 233 PHE N N 15 127.928 0.300 . . . . . . . 233 PHE N . 27128 1 811 . 1 . 1 234 234 SER H H 1 9.323 0.020 . . . . . . . 234 SER H . 27128 1 812 . 1 . 1 234 234 SER CA C 13 57.129 0.300 . . . . . . . 234 SER CA . 27128 1 813 . 1 . 1 234 234 SER CB C 13 64.655 0.300 . . . . . . . 234 SER CB . 27128 1 814 . 1 . 1 234 234 SER N N 15 124.756 0.300 . . . . . . . 234 SER N . 27128 1 815 . 1 . 1 235 235 ALA H H 1 8.014 0.020 . . . . . . . 235 ALA H . 27128 1 816 . 1 . 1 235 235 ALA CA C 13 50.620 0.300 . . . . . . . 235 ALA CA . 27128 1 817 . 1 . 1 235 235 ALA CB C 13 22.567 0.300 . . . . . . . 235 ALA CB . 27128 1 818 . 1 . 1 235 235 ALA N N 15 122.816 0.300 . . . . . . . 235 ALA N . 27128 1 819 . 1 . 1 236 236 LYS H H 1 9.027 0.020 . . . . . . . 236 LYS H . 27128 1 820 . 1 . 1 236 236 LYS CA C 13 54.531 0.300 . . . . . . . 236 LYS CA . 27128 1 821 . 1 . 1 236 236 LYS CB C 13 35.594 0.300 . . . . . . . 236 LYS CB . 27128 1 822 . 1 . 1 236 236 LYS N N 15 114.932 0.300 . . . . . . . 236 LYS N . 27128 1 823 . 1 . 1 237 237 VAL H H 1 8.945 0.020 . . . . . . . 237 VAL H . 27128 1 824 . 1 . 1 237 237 VAL CA C 13 59.344 0.300 . . . . . . . 237 VAL CA . 27128 1 825 . 1 . 1 237 237 VAL CB C 13 34.028 0.300 . . . . . . . 237 VAL CB . 27128 1 826 . 1 . 1 237 237 VAL N N 15 117.018 0.300 . . . . . . . 237 VAL N . 27128 1 827 . 1 . 1 238 238 ASN H H 1 7.532 0.020 . . . . . . . 238 ASN H . 27128 1 828 . 1 . 1 238 238 ASN CA C 13 50.620 0.300 . . . . . . . 238 ASN CA . 27128 1 829 . 1 . 1 238 238 ASN CB C 13 40.855 0.300 . . . . . . . 238 ASN CB . 27128 1 830 . 1 . 1 238 238 ASN N N 15 122.654 0.300 . . . . . . . 238 ASN N . 27128 1 831 . 1 . 1 239 239 ASN H H 1 8.433 0.020 . . . . . . . 239 ASN H . 27128 1 832 . 1 . 1 239 239 ASN CA C 13 54.765 0.300 . . . . . . . 239 ASN CA . 27128 1 833 . 1 . 1 239 239 ASN CB C 13 36.659 0.300 . . . . . . . 239 ASN CB . 27128 1 834 . 1 . 1 239 239 ASN N N 15 113.571 0.300 . . . . . . . 239 ASN N . 27128 1 835 . 1 . 1 240 240 SER H H 1 7.795 0.020 . . . . . . . 240 SER H . 27128 1 836 . 1 . 1 240 240 SER CA C 13 58.107 0.300 . . . . . . . 240 SER CA . 27128 1 837 . 1 . 1 240 240 SER CB C 13 62.526 0.300 . . . . . . . 240 SER CB . 27128 1 838 . 1 . 1 240 240 SER N N 15 117.242 0.300 . . . . . . . 240 SER N . 27128 1 839 . 1 . 1 241 241 SER H H 1 8.144 0.020 . . . . . . . 241 SER H . 27128 1 840 . 1 . 1 241 241 SER CA C 13 59.511 0.300 . . . . . . . 241 SER CA . 27128 1 841 . 1 . 1 241 241 SER N N 15 109.569 0.300 . . . . . . . 241 SER N . 27128 1 842 . 1 . 1 242 242 LEU H H 1 7.305 0.020 . . . . . . . 242 LEU H . 27128 1 843 . 1 . 1 242 242 LEU CA C 13 53.595 0.300 . . . . . . . 242 LEU CA . 27128 1 844 . 1 . 1 242 242 LEU CB C 13 40.166 0.300 . . . . . . . 242 LEU CB . 27128 1 845 . 1 . 1 242 242 LEU N N 15 118.664 0.300 . . . . . . . 242 LEU N . 27128 1 846 . 1 . 1 243 243 ILE H H 1 9.062 0.020 . . . . . . . 243 ILE H . 27128 1 847 . 1 . 1 243 243 ILE CA C 13 59.344 0.300 . . . . . . . 243 ILE CA . 27128 1 848 . 1 . 1 243 243 ILE CB C 13 40.166 0.300 . . . . . . . 243 ILE CB . 27128 1 849 . 1 . 1 243 243 ILE N N 15 126.943 0.300 . . . . . . . 243 ILE N . 27128 1 850 . 1 . 1 244 244 GLY H H 1 9.282 0.020 . . . . . . . 244 GLY H . 27128 1 851 . 1 . 1 244 244 GLY CA C 13 43.935 0.300 . . . . . . . 244 GLY CA . 27128 1 852 . 1 . 1 244 244 GLY N N 15 114.807 0.300 . . . . . . . 244 GLY N . 27128 1 853 . 1 . 1 245 245 LEU H H 1 9.378 0.020 . . . . . . . 245 LEU H . 27128 1 854 . 1 . 1 245 245 LEU CA C 13 53.101 0.300 . . . . . . . 245 LEU CA . 27128 1 855 . 1 . 1 245 245 LEU CB C 13 46.179 0.300 . . . . . . . 245 LEU CB . 27128 1 856 . 1 . 1 245 245 LEU N N 15 122.361 0.300 . . . . . . . 245 LEU N . 27128 1 857 . 1 . 1 246 246 GLY H H 1 9.188 0.020 . . . . . . . 246 GLY H . 27128 1 858 . 1 . 1 246 246 GLY CA C 13 44.470 0.300 . . . . . . . 246 GLY CA . 27128 1 859 . 1 . 1 246 246 GLY N N 15 110.809 0.300 . . . . . . . 246 GLY N . 27128 1 860 . 1 . 1 247 247 TYR H H 1 9.093 0.020 . . . . . . . 247 TYR H . 27128 1 861 . 1 . 1 247 247 TYR CA C 13 55.968 0.300 . . . . . . . 247 TYR CA . 27128 1 862 . 1 . 1 247 247 TYR CB C 13 42.546 0.300 . . . . . . . 247 TYR CB . 27128 1 863 . 1 . 1 247 247 TYR N N 15 125.708 0.300 . . . . . . . 247 TYR N . 27128 1 864 . 1 . 1 248 248 THR H H 1 8.377 0.020 . . . . . . . 248 THR H . 27128 1 865 . 1 . 1 248 248 THR CA C 13 60.647 0.300 . . . . . . . 248 THR CA . 27128 1 866 . 1 . 1 248 248 THR CB C 13 71.169 0.300 . . . . . . . 248 THR CB . 27128 1 867 . 1 . 1 248 248 THR N N 15 124.518 0.300 . . . . . . . 248 THR N . 27128 1 868 . 1 . 1 249 249 GLN H H 1 9.089 0.020 . . . . . . . 249 GLN H . 27128 1 869 . 1 . 1 249 249 GLN CA C 13 52.224 0.300 . . . . . . . 249 GLN CA . 27128 1 870 . 1 . 1 249 249 GLN CB C 13 32.588 0.300 . . . . . . . 249 GLN CB . 27128 1 871 . 1 . 1 249 249 GLN N N 15 126.623 0.300 . . . . . . . 249 GLN N . 27128 1 872 . 1 . 1 251 251 LEU H H 1 9.374 0.020 . . . . . . . 251 LEU H . 27128 1 873 . 1 . 1 251 251 LEU CA C 13 53.093 0.300 . . . . . . . 251 LEU CA . 27128 1 874 . 1 . 1 251 251 LEU CB C 13 42.985 0.300 . . . . . . . 251 LEU CB . 27128 1 875 . 1 . 1 251 251 LEU N N 15 128.684 0.300 . . . . . . . 251 LEU N . 27128 1 876 . 1 . 1 254 254 GLY H H 1 8.523 0.020 . . . . . . . 254 GLY H . 27128 1 877 . 1 . 1 254 254 GLY CA C 13 47.010 0.300 . . . . . . . 254 GLY CA . 27128 1 878 . 1 . 1 254 254 GLY N N 15 110.575 0.300 . . . . . . . 254 GLY N . 27128 1 879 . 1 . 1 255 255 ILE H H 1 8.141 0.020 . . . . . . . 255 ILE H . 27128 1 880 . 1 . 1 255 255 ILE CA C 13 59.745 0.300 . . . . . . . 255 ILE CA . 27128 1 881 . 1 . 1 255 255 ILE CB C 13 39.039 0.300 . . . . . . . 255 ILE CB . 27128 1 882 . 1 . 1 255 255 ILE N N 15 121.254 0.300 . . . . . . . 255 ILE N . 27128 1 883 . 1 . 1 256 256 LYS H H 1 8.750 0.020 . . . . . . . 256 LYS H . 27128 1 884 . 1 . 1 256 256 LYS CA C 13 54.597 0.300 . . . . . . . 256 LYS CA . 27128 1 885 . 1 . 1 256 256 LYS N N 15 126.814 0.300 . . . . . . . 256 LYS N . 27128 1 886 . 1 . 1 257 257 LEU H H 1 8.807 0.020 . . . . . . . 257 LEU H . 27128 1 887 . 1 . 1 257 257 LEU CA C 13 52.859 0.300 . . . . . . . 257 LEU CA . 27128 1 888 . 1 . 1 257 257 LEU CB C 13 45.553 0.300 . . . . . . . 257 LEU CB . 27128 1 889 . 1 . 1 257 257 LEU N N 15 127.749 0.300 . . . . . . . 257 LEU N . 27128 1 890 . 1 . 1 258 258 THR H H 1 9.466 0.020 . . . . . . . 258 THR H . 27128 1 891 . 1 . 1 258 258 THR CA C 13 61.090 0.300 . . . . . . . 258 THR CA . 27128 1 892 . 1 . 1 258 258 THR CB C 13 71.232 0.300 . . . . . . . 258 THR CB . 27128 1 893 . 1 . 1 258 258 THR N N 15 121.645 0.300 . . . . . . . 258 THR N . 27128 1 894 . 1 . 1 259 259 LEU H H 1 9.220 0.020 . . . . . . . 259 LEU H . 27128 1 895 . 1 . 1 259 259 LEU CA C 13 52.859 0.300 . . . . . . . 259 LEU CA . 27128 1 896 . 1 . 1 259 259 LEU CB C 13 44.864 0.300 . . . . . . . 259 LEU CB . 27128 1 897 . 1 . 1 259 259 LEU N N 15 129.394 0.300 . . . . . . . 259 LEU N . 27128 1 898 . 1 . 1 260 260 SER H H 1 8.815 0.020 . . . . . . . 260 SER H . 27128 1 899 . 1 . 1 260 260 SER CA C 13 56.603 0.300 . . . . . . . 260 SER CA . 27128 1 900 . 1 . 1 260 260 SER CB C 13 66.284 0.300 . . . . . . . 260 SER CB . 27128 1 901 . 1 . 1 260 260 SER N N 15 115.486 0.300 . . . . . . . 260 SER N . 27128 1 902 . 1 . 1 261 261 ALA H H 1 9.539 0.020 . . . . . . . 261 ALA H . 27128 1 903 . 1 . 1 261 261 ALA CA C 13 50.988 0.300 . . . . . . . 261 ALA CA . 27128 1 904 . 1 . 1 261 261 ALA CB C 13 22.316 0.300 . . . . . . . 261 ALA CB . 27128 1 905 . 1 . 1 261 261 ALA N N 15 120.709 0.300 . . . . . . . 261 ALA N . 27128 1 906 . 1 . 1 262 262 LEU H H 1 8.724 0.020 . . . . . . . 262 LEU H . 27128 1 907 . 1 . 1 262 262 LEU CA C 13 52.258 0.300 . . . . . . . 262 LEU CA . 27128 1 908 . 1 . 1 262 262 LEU CB C 13 42.233 0.300 . . . . . . . 262 LEU CB . 27128 1 909 . 1 . 1 262 262 LEU N N 15 124.910 0.300 . . . . . . . 262 LEU N . 27128 1 910 . 1 . 1 263 263 LEU H H 1 9.501 0.020 . . . . . . . 263 LEU H . 27128 1 911 . 1 . 1 263 263 LEU CA C 13 52.091 0.300 . . . . . . . 263 LEU CA . 27128 1 912 . 1 . 1 263 263 LEU CB C 13 43.047 0.300 . . . . . . . 263 LEU CB . 27128 1 913 . 1 . 1 263 263 LEU N N 15 126.237 0.300 . . . . . . . 263 LEU N . 27128 1 914 . 1 . 1 264 264 ASP H H 1 9.939 0.020 . . . . . . . 264 ASP H . 27128 1 915 . 1 . 1 264 264 ASP CA C 13 52.124 0.300 . . . . . . . 264 ASP CA . 27128 1 916 . 1 . 1 264 264 ASP CB C 13 39.352 0.300 . . . . . . . 264 ASP CB . 27128 1 917 . 1 . 1 264 264 ASP N N 15 124.863 0.300 . . . . . . . 264 ASP N . 27128 1 918 . 1 . 1 265 265 GLY H H 1 8.445 0.020 . . . . . . . 265 GLY H . 27128 1 919 . 1 . 1 265 265 GLY CA C 13 45.840 0.300 . . . . . . . 265 GLY CA . 27128 1 920 . 1 . 1 265 265 GLY N N 15 112.518 0.300 . . . . . . . 265 GLY N . 27128 1 921 . 1 . 1 266 266 LYS H H 1 8.119 0.020 . . . . . . . 266 LYS H . 27128 1 922 . 1 . 1 266 266 LYS CA C 13 56.737 0.300 . . . . . . . 266 LYS CA . 27128 1 923 . 1 . 1 266 266 LYS CB C 13 30.959 0.300 . . . . . . . 266 LYS CB . 27128 1 924 . 1 . 1 266 266 LYS N N 15 117.326 0.300 . . . . . . . 266 LYS N . 27128 1 925 . 1 . 1 267 267 ASN H H 1 7.393 0.020 . . . . . . . 267 ASN H . 27128 1 926 . 1 . 1 267 267 ASN CA C 13 51.623 0.300 . . . . . . . 267 ASN CA . 27128 1 927 . 1 . 1 267 267 ASN CB C 13 37.724 0.300 . . . . . . . 267 ASN CB . 27128 1 928 . 1 . 1 267 267 ASN N N 15 117.523 0.300 . . . . . . . 267 ASN N . 27128 1 929 . 1 . 1 268 268 VAL H H 1 8.540 0.020 . . . . . . . 268 VAL H . 27128 1 930 . 1 . 1 268 268 VAL CA C 13 64.993 0.300 . . . . . . . 268 VAL CA . 27128 1 931 . 1 . 1 268 268 VAL CB C 13 30.897 0.300 . . . . . . . 268 VAL CB . 27128 1 932 . 1 . 1 268 268 VAL N N 15 122.308 0.300 . . . . . . . 268 VAL N . 27128 1 933 . 1 . 1 269 269 ASN H H 1 8.335 0.020 . . . . . . . 269 ASN H . 27128 1 934 . 1 . 1 269 269 ASN CA C 13 54.363 0.300 . . . . . . . 269 ASN CA . 27128 1 935 . 1 . 1 269 269 ASN CB C 13 37.974 0.300 . . . . . . . 269 ASN CB . 27128 1 936 . 1 . 1 269 269 ASN N N 15 117.055 0.300 . . . . . . . 269 ASN N . 27128 1 937 . 1 . 1 270 270 ALA H H 1 7.480 0.020 . . . . . . . 270 ALA H . 27128 1 938 . 1 . 1 270 270 ALA CA C 13 51.456 0.300 . . . . . . . 270 ALA CA . 27128 1 939 . 1 . 1 270 270 ALA CB C 13 18.496 0.300 . . . . . . . 270 ALA CB . 27128 1 940 . 1 . 1 270 270 ALA N N 15 120.649 0.300 . . . . . . . 270 ALA N . 27128 1 941 . 1 . 1 271 271 GLY H H 1 7.639 0.020 . . . . . . . 271 GLY H . 27128 1 942 . 1 . 1 271 271 GLY CA C 13 44.637 0.300 . . . . . . . 271 GLY CA . 27128 1 943 . 1 . 1 271 271 GLY N N 15 107.058 0.300 . . . . . . . 271 GLY N . 27128 1 944 . 1 . 1 272 272 GLY H H 1 8.574 0.020 . . . . . . . 272 GLY H . 27128 1 945 . 1 . 1 272 272 GLY CA C 13 45.439 0.300 . . . . . . . 272 GLY CA . 27128 1 946 . 1 . 1 272 272 GLY N N 15 109.435 0.300 . . . . . . . 272 GLY N . 27128 1 947 . 1 . 1 273 273 HIS H H 1 7.227 0.020 . . . . . . . 273 HIS H . 27128 1 948 . 1 . 1 273 273 HIS CA C 13 54.363 0.300 . . . . . . . 273 HIS CA . 27128 1 949 . 1 . 1 273 273 HIS CB C 13 30.772 0.300 . . . . . . . 273 HIS CB . 27128 1 950 . 1 . 1 273 273 HIS N N 15 120.910 0.300 . . . . . . . 273 HIS N . 27128 1 951 . 1 . 1 274 274 LYS H H 1 8.903 0.020 . . . . . . . 274 LYS H . 27128 1 952 . 1 . 1 274 274 LYS CA C 13 54.731 0.300 . . . . . . . 274 LYS CA . 27128 1 953 . 1 . 1 274 274 LYS CB C 13 36.534 0.300 . . . . . . . 274 LYS CB . 27128 1 954 . 1 . 1 274 274 LYS N N 15 119.527 0.300 . . . . . . . 274 LYS N . 27128 1 955 . 1 . 1 275 275 LEU H H 1 8.647 0.020 . . . . . . . 275 LEU H . 27128 1 956 . 1 . 1 275 275 LEU CA C 13 53.361 0.300 . . . . . . . 275 LEU CA . 27128 1 957 . 1 . 1 275 275 LEU CB C 13 45.490 0.300 . . . . . . . 275 LEU CB . 27128 1 958 . 1 . 1 275 275 LEU N N 15 121.477 0.300 . . . . . . . 275 LEU N . 27128 1 959 . 1 . 1 276 276 GLY H H 1 9.092 0.020 . . . . . . . 276 GLY H . 27128 1 960 . 1 . 1 276 276 GLY CA C 13 44.904 0.300 . . . . . . . 276 GLY CA . 27128 1 961 . 1 . 1 276 276 GLY N N 15 111.209 0.300 . . . . . . . 276 GLY N . 27128 1 962 . 1 . 1 277 277 LEU H H 1 8.215 0.020 . . . . . . . 277 LEU H . 27128 1 963 . 1 . 1 277 277 LEU CA C 13 53.662 0.300 . . . . . . . 277 LEU CA . 27128 1 964 . 1 . 1 277 277 LEU CB C 13 46.179 0.300 . . . . . . . 277 LEU CB . 27128 1 965 . 1 . 1 277 277 LEU N N 15 121.043 0.300 . . . . . . . 277 LEU N . 27128 1 966 . 1 . 1 278 278 GLY H H 1 9.584 0.020 . . . . . . . 278 GLY H . 27128 1 967 . 1 . 1 278 278 GLY CA C 13 44.202 0.300 . . . . . . . 278 GLY CA . 27128 1 968 . 1 . 1 278 278 GLY N N 15 116.053 0.300 . . . . . . . 278 GLY N . 27128 1 969 . 1 . 1 279 279 LEU H H 1 8.677 0.020 . . . . . . . 279 LEU H . 27128 1 970 . 1 . 1 279 279 LEU CA C 13 53.127 0.300 . . . . . . . 279 LEU CA . 27128 1 971 . 1 . 1 279 279 LEU CB C 13 45.177 0.300 . . . . . . . 279 LEU CB . 27128 1 972 . 1 . 1 279 279 LEU N N 15 124.880 0.300 . . . . . . . 279 LEU N . 27128 1 973 . 1 . 1 280 280 GLU H H 1 8.664 0.020 . . . . . . . 280 GLU H . 27128 1 974 . 1 . 1 280 280 GLU CA C 13 54.765 0.300 . . . . . . . 280 GLU CA . 27128 1 975 . 1 . 1 280 280 GLU CB C 13 31.210 0.300 . . . . . . . 280 GLU CB . 27128 1 976 . 1 . 1 280 280 GLU N N 15 124.555 0.300 . . . . . . . 280 GLU N . 27128 1 977 . 1 . 1 282 282 GLN H H 1 9.142 0.020 . . . . . . . 282 GLN H . 27128 1 978 . 1 . 1 282 282 GLN CA C 13 53.762 0.300 . . . . . . . 282 GLN CA . 27128 1 979 . 1 . 1 282 282 GLN CB C 13 30.646 0.300 . . . . . . . 282 GLN CB . 27128 1 980 . 1 . 1 282 282 GLN N N 15 124.681 0.300 . . . . . . . 282 GLN N . 27128 1 981 . 1 . 1 283 283 ALA H H 1 8.311 0.020 . . . . . . . 283 ALA H . 27128 1 982 . 1 . 1 283 283 ALA CA C 13 50.921 0.300 . . . . . . . 283 ALA CA . 27128 1 983 . 1 . 1 283 283 ALA CB C 13 18.809 0.300 . . . . . . . 283 ALA CB . 27128 1 984 . 1 . 1 283 283 ALA N N 15 126.800 0.300 . . . . . . . 283 ALA N . 27128 1 985 . 1 . 1 284 284 LEU H H 1 8.330 0.020 . . . . . . . 284 LEU H . 27128 1 986 . 1 . 1 284 284 LEU CA C 13 53.734 0.300 . . . . . . . 284 LEU CA . 27128 1 987 . 1 . 1 284 284 LEU CB C 13 41.769 0.300 . . . . . . . 284 LEU CB . 27128 1 988 . 1 . 1 284 284 LEU N N 15 123.860 0.300 . . . . . . . 284 LEU N . 27128 1 stop_ save_