data_50121 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 15N assignments of single-stranded DNA binding domains from the 70 kDa subunit of Human Replication Protein A bound to ssDNA ; _BMRB_accession_number 50121 _BMRB_flat_file_name bmr50121.str _Entry_type original _Submission_date 2019-12-10 _Accession_date 2019-12-10 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Replication Protein A, RPA70AB (181-422), single-strand DNA binding domains bound to ssDNA' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Arunkumar Alphonse . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 191 "15N chemical shifts" 191 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-12-20 original BMRB . stop_ loop_ _Related_BMRB_accession_number _Relationship 5823 'RPA70(181-422) ssDNA binding domains' stop_ _Original_release_date 2019-12-10 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Independent and Coordinated Functions of Replication Protein A Tandem High Affinity Single-stranded DNA Binding Domains ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 12881520 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Arunkumar Alphonse I. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 278 _Journal_issue 42 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 41077 _Page_last 41082 _Year 2003 _Details . loop_ _Keyword 'RPA70AB ssDNA' stop_ save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name RPA70AB-DNA _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label RPA70AB $entity_1 stop_ _System_molecular_weight 27071 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'DNA replication and repair' stop_ _Database_query_date . _Details 'RPA70AB (single chain polypeptide) bound to 8 nucleotide ssDNA' save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass 27071 _Mol_thiol_state Reduced loop_ _Biological_function 'DNA Replication and Repair' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 242 _Mol_residue_sequence ; QSKVVPIASLTPYQSKWTIC ARVTNKSQIRTWSNSRGEGK LFSLELVDESGEIRATAFNE QVDKFFPLIEVNKVYYFSKG TLKIANKQFTAVKNDYEMTF NNETSVMPCEDDHHLPTVQF DFTGIDDLENKSKDSLVDII GICKSYEDATKITVRSNNAE VAKRNIYLMDTSGKVVTATL WGEDADKFDGSRQPVLAIKG ARVSDFGGRSLSVLSSSTII ANPDIPEAYKLRGYFDAEGG AL ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 181 GLN 2 182 SER 3 183 LYS 4 184 VAL 5 185 VAL 6 186 PRO 7 187 ILE 8 188 ALA 9 189 SER 10 190 LEU 11 191 THR 12 192 PRO 13 193 TYR 14 194 GLN 15 195 SER 16 196 LYS 17 197 TRP 18 198 THR 19 199 ILE 20 200 CYS 21 201 ALA 22 202 ARG 23 203 VAL 24 204 THR 25 205 ASN 26 206 LYS 27 207 SER 28 208 GLN 29 209 ILE 30 210 ARG 31 211 THR 32 212 TRP 33 213 SER 34 214 ASN 35 215 SER 36 216 ARG 37 217 GLY 38 218 GLU 39 219 GLY 40 220 LYS 41 221 LEU 42 222 PHE 43 223 SER 44 224 LEU 45 225 GLU 46 226 LEU 47 227 VAL 48 228 ASP 49 229 GLU 50 230 SER 51 231 GLY 52 232 GLU 53 233 ILE 54 234 ARG 55 235 ALA 56 236 THR 57 237 ALA 58 238 PHE 59 239 ASN 60 240 GLU 61 241 GLN 62 242 VAL 63 243 ASP 64 244 LYS 65 245 PHE 66 246 PHE 67 247 PRO 68 248 LEU 69 249 ILE 70 250 GLU 71 251 VAL 72 252 ASN 73 253 LYS 74 254 VAL 75 255 TYR 76 256 TYR 77 257 PHE 78 258 SER 79 259 LYS 80 260 GLY 81 261 THR 82 262 LEU 83 263 LYS 84 264 ILE 85 265 ALA 86 266 ASN 87 267 LYS 88 268 GLN 89 269 PHE 90 270 THR 91 271 ALA 92 272 VAL 93 273 LYS 94 274 ASN 95 275 ASP 96 276 TYR 97 277 GLU 98 278 MET 99 279 THR 100 280 PHE 101 281 ASN 102 282 ASN 103 283 GLU 104 284 THR 105 285 SER 106 286 VAL 107 287 MET 108 288 PRO 109 289 CYS 110 290 GLU 111 291 ASP 112 292 ASP 113 293 HIS 114 294 HIS 115 295 LEU 116 296 PRO 117 297 THR 118 298 VAL 119 299 GLN 120 300 PHE 121 301 ASP 122 302 PHE 123 303 THR 124 304 GLY 125 305 ILE 126 306 ASP 127 307 ASP 128 308 LEU 129 309 GLU 130 310 ASN 131 311 LYS 132 312 SER 133 313 LYS 134 314 ASP 135 315 SER 136 316 LEU 137 317 VAL 138 318 ASP 139 319 ILE 140 320 ILE 141 321 GLY 142 322 ILE 143 323 CYS 144 324 LYS 145 325 SER 146 326 TYR 147 327 GLU 148 328 ASP 149 329 ALA 150 330 THR 151 331 LYS 152 332 ILE 153 333 THR 154 334 VAL 155 335 ARG 156 336 SER 157 337 ASN 158 338 ASN 159 339 ALA 160 340 GLU 161 341 VAL 162 342 ALA 163 343 LYS 164 344 ARG 165 345 ASN 166 346 ILE 167 347 TYR 168 348 LEU 169 349 MET 170 350 ASP 171 351 THR 172 352 SER 173 353 GLY 174 354 LYS 175 355 VAL 176 356 VAL 177 357 THR 178 358 ALA 179 359 THR 180 360 LEU 181 361 TRP 182 362 GLY 183 363 GLU 184 364 ASP 185 365 ALA 186 366 ASP 187 367 LYS 188 368 PHE 189 369 ASP 190 370 GLY 191 371 SER 192 372 ARG 193 373 GLN 194 374 PRO 195 375 VAL 196 376 LEU 197 377 ALA 198 378 ILE 199 379 LYS 200 380 GLY 201 381 ALA 202 382 ARG 203 383 VAL 204 384 SER 205 385 ASP 206 386 PHE 207 387 GLY 208 388 GLY 209 389 ARG 210 390 SER 211 391 LEU 212 392 SER 213 393 VAL 214 394 LEU 215 395 SER 216 396 SER 217 397 SER 218 398 THR 219 399 ILE 220 400 ILE 221 401 ALA 222 402 ASN 223 403 PRO 224 404 ASP 225 405 ILE 226 406 PRO 227 407 GLU 228 408 ALA 229 409 TYR 230 410 LYS 231 411 LEU 232 412 ARG 233 413 GLY 234 414 TYR 235 415 PHE 236 416 ASP 237 417 ALA 238 418 GLU 239 419 GLY 240 420 GLY 241 421 ALA 242 422 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 1JMC 'RPA 70AB' . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1 'recombinant technology' . Escherichia coli BL21DE3 plasmid pSV281 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '15N RPA70AB + ssDNA' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 50 uM [U-15N] TRIS 20 mM 'natural abundance' 'potassium chloride' 150 mM 'natural abundance' glycerol 10 '% w/v' 'natural abundance' DTT 1 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details 'Bruker 800MHz' save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 170 . mM pH 7.0 . pH pressure 1 . atm temperature 298 1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS H 1 'methyl protons' ppm 0 internal indirect . . . 1 DSS N 15 nitrogen ppm 0 internal indirect . . . 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name RPA70AB _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 183 3 LYS H H 8.065 0.05 1 2 183 3 LYS N N 123.441 0.4 1 3 184 4 VAL H H 7.912 0.05 1 4 184 4 VAL N N 122.255 0.4 1 5 187 7 ILE H H 10.738 0.05 1 6 187 7 ILE N N 130.747 0.4 1 7 188 8 ALA H H 8.737 0.05 1 8 188 8 ALA N N 120.197 0.4 1 9 190 10 LEU H H 7.281 0.05 1 10 190 10 LEU N N 122.931 0.4 1 11 191 11 THR H H 7.286 0.05 1 12 191 11 THR N N 111.932 0.4 1 13 193 13 TYR H H 7.163 0.05 1 14 193 13 TYR N N 115.056 0.4 1 15 194 14 GLN H H 7.111 0.05 1 16 194 14 GLN N N 120.415 0.4 1 17 195 15 SER H H 8.609 0.05 1 18 195 15 SER N N 119.883 0.4 1 19 196 16 LYS H H 8.024 0.05 1 20 196 16 LYS N N 122.535 0.4 1 21 197 17 TRP H H 6.924 0.05 1 22 197 17 TRP N N 118.959 0.4 1 23 198 18 THR H H 7.719 0.05 1 24 198 18 THR N N 117.603 0.4 1 25 199 19 ILE H H 8.899 0.05 1 26 199 19 ILE N N 118.403 0.4 1 27 200 20 CYS H H 9.147 0.05 1 28 200 20 CYS N N 124.505 0.4 1 29 201 21 ALA H H 9.369 0.05 1 30 201 21 ALA N N 127.774 0.4 1 31 202 22 ARG H H 9.148 0.05 1 32 202 22 ARG N N 122.735 0.4 1 33 203 23 VAL H H 8.384 0.05 1 34 203 23 VAL N N 126.930 0.4 1 35 204 24 THR H H 8.987 0.05 1 36 204 24 THR N N 121.288 0.4 1 37 205 25 ASN H H 7.428 0.05 1 38 205 25 ASN N N 118.255 0.4 1 39 206 26 LYS H H 8.176 0.05 1 40 206 26 LYS N N 125.845 0.4 1 41 207 27 SER H H 9.311 0.05 1 42 207 27 SER N N 125.542 0.4 1 43 208 28 GLN H H 8.168 0.05 1 44 208 28 GLN N N 115.219 0.4 1 45 209 29 ILE H H 8.430 0.05 1 46 209 29 ILE N N 123.799 0.4 1 47 210 30 ARG H H 9.177 0.05 1 48 210 30 ARG N N 130.406 0.4 1 49 211 31 THR H H 8.313 0.05 1 50 211 31 THR N N 114.107 0.4 1 51 212 32 TRP H H 8.192 0.05 1 52 212 32 TRP N N 122.251 0.4 1 53 213 33 SER H H 8.357 0.05 1 54 213 33 SER N N 114.837 0.4 1 55 214 34 ASN H H 8.946 0.05 1 56 214 34 ASN N N 124.156 0.4 1 57 217 37 GLY H H 7.746 0.05 1 58 217 37 GLY N N 109.209 0.4 1 59 218 38 GLU H H 7.920 0.05 1 60 218 38 GLU N N 118.599 0.4 1 61 219 39 GLY H H 7.244 0.05 1 62 219 39 GLY N N 109.476 0.4 1 63 220 40 LYS H H 7.916 0.05 1 64 220 40 LYS N N 117.492 0.4 1 65 221 41 LEU H H 9.182 0.05 1 66 221 41 LEU N N 118.924 0.4 1 67 222 42 PHE H H 8.365 0.05 1 68 222 42 PHE N N 115.801 0.4 1 69 223 43 SER H H 9.041 0.05 1 70 223 43 SER N N 115.613 0.4 1 71 224 44 LEU H H 9.208 0.05 1 72 224 44 LEU N N 121.282 0.4 1 73 225 45 GLU H H 8.010 0.05 1 74 225 45 GLU N N 120.495 0.4 1 75 226 46 LEU H H 8.549 0.05 1 76 226 46 LEU N N 124.331 0.4 1 77 227 47 VAL H H 8.899 0.05 1 78 227 47 VAL N N 118.403 0.4 1 79 228 48 ASP H H 8.837 0.05 1 80 228 48 ASP N N 127.210 0.4 1 81 229 49 GLU H H 8.755 0.05 1 82 229 49 GLU N N 116.159 0.4 1 83 231 51 GLY H H 7.469 0.05 1 84 231 51 GLY N N 112.393 0.4 1 85 232 52 GLU H H 8.049 0.05 1 86 232 52 GLU N N 115.514 0.4 1 87 233 53 ILE H H 8.940 0.05 1 88 233 53 ILE N N 119.746 0.4 1 89 234 54 ARG H H 8.872 0.05 1 90 234 54 ARG N N 128.144 0.4 1 91 235 55 ALA H H 8.837 0.05 1 92 235 55 ALA N N 127.210 0.4 1 93 237 57 ALA H H 7.895 0.05 1 94 237 57 ALA N N 128.186 0.4 1 95 238 58 PHE H H 9.164 0.05 1 96 238 58 PHE N N 117.233 0.4 1 97 239 59 ASN H H 9.205 0.05 1 98 239 59 ASN N N 119.736 0.4 1 99 240 60 GLU H H 9.570 0.05 1 100 240 60 GLU N N 125.537 0.4 1 101 241 61 GLN H H 8.481 0.05 1 102 241 61 GLN N N 116.819 0.4 1 103 243 63 ASP H H 7.076 0.05 1 104 243 63 ASP N N 117.061 0.4 1 105 244 64 LYS H H 6.978 0.05 1 106 244 64 LYS N N 115.062 0.4 1 107 245 65 PHE H H 7.588 0.05 1 108 245 65 PHE N N 111.221 0.4 1 109 246 66 PHE H H 8.939 0.05 1 110 246 66 PHE N N 122.742 0.4 1 111 248 68 LEU H H 6.919 0.05 1 112 248 68 LEU N N 115.556 0.4 1 113 249 69 ILE H H 6.503 0.05 1 114 249 69 ILE N N 115.854 0.4 1 115 250 70 GLU H H 8.725 0.05 1 116 250 70 GLU N N 129.235 0.4 1 117 251 71 VAL H H 8.281 0.05 1 118 251 71 VAL N N 121.672 0.4 1 119 252 72 ASN H H 9.318 0.05 1 120 252 72 ASN N N 119.499 0.4 1 121 253 73 LYS H H 7.505 0.05 1 122 253 73 LYS N N 119.922 0.4 1 123 254 74 VAL H H 7.320 0.05 1 124 254 74 VAL N N 119.005 0.4 1 125 255 75 TYR H H 8.817 0.05 1 126 255 75 TYR N N 124.250 0.4 1 127 256 76 TYR H H 9.627 0.05 1 128 256 76 TYR N N 119.550 0.4 1 129 257 77 PHE H H 8.887 0.05 1 130 257 77 PHE N N 122.611 0.4 1 131 258 78 SER H H 8.245 0.05 1 132 258 78 SER N N 115.605 0.4 1 133 261 81 THR H H 8.705 0.05 1 134 261 81 THR N N 117.659 0.4 1 135 262 82 LEU H H 9.016 0.05 1 136 262 82 LEU N N 128.819 0.4 1 137 263 83 LYS H H 8.514 0.05 1 138 263 83 LYS N N 119.159 0.4 1 139 264 84 ILE H H 8.297 0.05 1 140 264 84 ILE N N 122.499 0.4 1 141 265 85 ALA H H 8.564 0.05 1 142 265 85 ALA N N 131.051 0.4 1 143 268 88 GLN H H 8.058 0.05 1 144 268 88 GLN N N 119.461 0.4 1 145 269 89 PHE H H 7.832 0.05 1 146 269 89 PHE N N 118.036 0.4 1 147 270 90 THR H H 7.573 0.05 1 148 270 90 THR N N 113.765 0.4 1 149 273 93 LYS H H 9.016 0.05 1 150 273 93 LYS N N 128.819 0.4 1 151 274 94 ASN H H 7.476 0.05 1 152 274 94 ASN N N 122.221 0.4 1 153 275 95 ASP H H 8.409 0.05 1 154 275 95 ASP N N 125.524 0.4 1 155 276 96 TYR H H 8.845 0.05 1 156 276 96 TYR N N 119.339 0.4 1 157 277 97 GLU H H 8.921 0.05 1 158 277 97 GLU N N 116.424 0.4 1 159 278 98 MET H H 8.808 0.05 1 160 278 98 MET N N 121.473 0.4 1 161 279 99 THR H H 9.549 0.05 1 162 279 99 THR N N 122.073 0.4 1 163 281 101 ASN H H 9.376 0.05 1 164 281 101 ASN N N 121.743 0.4 1 165 283 103 GLU H H 8.851 0.05 1 166 283 103 GLU N N 117.614 0.4 1 167 284 104 THR H H 7.448 0.05 1 168 284 104 THR N N 119.285 0.4 1 169 285 105 SER H H 8.440 0.05 1 170 285 105 SER N N 121.119 0.4 1 171 286 106 VAL H H 8.065 0.05 1 172 286 106 VAL N N 123.441 0.4 1 173 289 109 CYS H H 8.024 0.05 1 174 289 109 CYS N N 122.535 0.4 1 175 290 110 GLU H H 8.015 0.05 1 176 290 110 GLU N N 124.904 0.4 1 177 292 112 ASP H H 7.954 0.05 1 178 292 112 ASP N N 124.661 0.4 1 179 301 121 ASP H H 9.570 0.05 1 180 301 121 ASP N N 125.537 0.4 1 181 303 123 THR H H 8.939 0.05 1 182 303 123 THR N N 122.742 0.4 1 183 304 124 GLY H H 9.075 0.05 1 184 304 124 GLY N N 115.141 0.4 1 185 305 125 ILE H H 8.766 0.05 1 186 305 125 ILE N N 124.845 0.4 1 187 306 126 ASP H H 8.949 0.05 1 188 306 126 ASP N N 116.995 0.4 1 189 307 127 ASP H H 7.505 0.05 1 190 307 127 ASP N N 119.922 0.4 1 191 308 128 LEU H H 7.390 0.05 1 192 308 128 LEU N N 120.760 0.4 1 193 309 129 GLU H H 7.937 0.05 1 194 309 129 GLU N N 116.656 0.4 1 195 310 130 ASN H H 7.533 0.05 1 196 310 130 ASN N N 114.642 0.4 1 197 311 131 LYS H H 7.505 0.05 1 198 311 131 LYS N N 119.922 0.4 1 199 312 132 SER H H 8.469 0.05 1 200 312 132 SER N N 117.147 0.4 1 201 314 134 ASP H H 8.845 0.05 1 202 314 134 ASP N N 119.339 0.4 1 203 315 135 SER H H 7.706 0.05 1 204 315 135 SER N N 116.599 0.4 1 205 316 136 LEU H H 8.297 0.05 1 206 316 136 LEU N N 122.499 0.4 1 207 317 137 VAL H H 9.164 0.05 1 208 317 137 VAL N N 117.233 0.4 1 209 318 138 ASP H H 8.662 0.05 1 210 318 138 ASP N N 122.705 0.4 1 211 319 139 ILE H H 8.977 0.05 1 212 319 139 ILE N N 118.720 0.4 1 213 320 140 ILE H H 8.731 0.05 1 214 320 140 ILE N N 123.197 0.4 1 215 321 141 GLY H H 7.916 0.05 1 216 321 141 GLY N N 108.393 0.4 1 217 322 142 ILE H H 9.208 0.05 1 218 322 142 ILE N N 121.282 0.4 1 219 323 143 CYS H H 8.496 0.05 1 220 323 143 CYS N N 127.110 0.4 1 221 324 144 LYS H H 8.711 0.05 1 222 324 144 LYS N N 134.428 0.4 1 223 325 145 SER H H 8.022 0.05 1 224 325 145 SER N N 109.539 0.4 1 225 326 146 TYR H H 8.245 0.05 1 226 326 146 TYR N N 115.605 0.4 1 227 329 149 ALA H H 8.555 0.05 1 228 329 149 ALA N N 125.145 0.4 1 229 330 150 THR H H 8.947 0.05 1 230 330 150 THR N N 115.389 0.4 1 231 331 151 LYS H H 8.203 0.05 1 232 331 151 LYS N N 120.587 0.4 1 233 332 152 ILE H H 8.808 0.05 1 234 332 152 ILE N N 121.473 0.4 1 235 333 153 THR H H 8.199 0.05 1 236 333 153 THR N N 119.762 0.4 1 237 334 154 VAL H H 8.683 0.05 1 238 334 154 VAL N N 127.454 0.4 1 239 339 159 ALA H H 7.679 0.05 1 240 339 159 ALA N N 118.647 0.4 1 241 340 160 GLU H H 8.348 0.05 1 242 340 160 GLU N N 122.892 0.4 1 243 341 161 VAL H H 9.052 0.05 1 244 341 161 VAL N N 125.296 0.4 1 245 342 162 ALA H H 8.409 0.05 1 246 342 162 ALA N N 128.082 0.4 1 247 344 164 ARG H H 8.276 0.05 1 248 344 164 ARG N N 123.331 0.4 1 249 345 165 ASN H H 8.496 0.05 1 250 345 165 ASN N N 127.110 0.4 1 251 346 166 ILE H H 8.748 0.05 1 252 346 166 ILE N N 117.025 0.4 1 253 347 167 TYR H H 7.911 0.05 1 254 347 167 TYR N N 120.259 0.4 1 255 348 168 LEU H H 8.709 0.05 1 256 348 168 LEU N N 123.846 0.4 1 257 349 169 MET H H 8.602 0.05 1 258 349 169 MET N N 120.677 0.4 1 259 350 170 ASP H H 7.270 0.05 1 260 350 170 ASP N N 125.905 0.4 1 261 351 171 THR H H 6.927 0.05 1 262 351 171 THR N N 103.738 0.4 1 263 352 172 SER H H 7.832 0.05 1 264 352 172 SER N N 118.036 0.4 1 265 353 173 GLY H H 8.350 0.05 1 266 353 173 GLY N N 111.654 0.4 1 267 354 174 LYS H H 7.792 0.05 1 268 354 174 LYS N N 121.799 0.4 1 269 355 175 VAL H H 7.679 0.05 1 270 355 175 VAL N N 118.647 0.4 1 271 356 176 VAL H H 9.133 0.05 1 272 356 176 VAL N N 126.380 0.4 1 273 358 178 ALA H H 8.944 0.05 1 274 358 178 ALA N N 129.922 0.4 1 275 359 179 THR H H 8.199 0.05 1 276 359 179 THR N N 119.762 0.4 1 277 360 180 LEU H H 8.496 0.05 1 278 360 180 LEU N N 127.110 0.4 1 279 361 181 TRP H H 9.059 0.05 1 280 361 181 TRP N N 119.422 0.4 1 281 362 182 GLY H H 9.277 0.05 1 282 362 182 GLY N N 110.631 0.4 1 283 363 183 GLU H H 9.009 0.05 1 284 363 183 GLU N N 126.155 0.4 1 285 364 184 ASP H H 8.083 0.05 1 286 364 184 ASP N N 116.532 0.4 1 287 365 185 ALA H H 6.770 0.05 1 288 365 185 ALA N N 119.513 0.4 1 289 367 187 LYS H H 7.800 0.05 1 290 367 187 LYS N N 115.230 0.4 1 291 368 188 PHE H H 6.806 0.05 1 292 368 188 PHE N N 120.960 0.4 1 293 369 189 ASP H H 7.321 0.05 1 294 369 189 ASP N N 126.149 0.4 1 295 370 190 GLY H H 6.560 0.05 1 296 370 190 GLY N N 112.728 0.4 1 297 372 192 ARG H H 8.281 0.05 1 298 372 192 ARG N N 121.672 0.4 1 299 373 193 GLN H H 7.912 0.05 1 300 373 193 GLN N N 122.255 0.4 1 301 375 195 VAL H H 7.675 0.05 1 302 375 195 VAL N N 119.555 0.4 1 303 376 196 LEU H H 9.016 0.05 1 304 376 196 LEU N N 128.819 0.4 1 305 377 197 ALA H H 8.555 0.05 1 306 377 197 ALA N N 125.145 0.4 1 307 378 198 ILE H H 9.386 0.05 1 308 378 198 ILE N N 122.333 0.4 1 309 379 199 LYS H H 9.309 0.05 1 310 379 199 LYS N N 128.268 0.4 1 311 380 200 GLY H H 9.041 0.05 1 312 380 200 GLY N N 115.613 0.4 1 313 381 201 ALA H H 8.946 0.05 1 314 381 201 ALA N N 124.156 0.4 1 315 382 202 ARG H H 8.609 0.05 1 316 382 202 ARG N N 119.883 0.4 1 317 383 203 VAL H H 8.928 0.05 1 318 383 203 VAL N N 127.583 0.4 1 319 384 204 SER H H 8.870 0.05 1 320 384 204 SER N N 125.953 0.4 1 321 385 205 ASP H H 8.053 0.05 1 322 385 205 ASP N N 121.778 0.4 1 323 386 206 PHE H H 8.348 0.05 1 324 386 206 PHE N N 122.892 0.4 1 325 387 207 GLY H H 8.533 0.05 1 326 387 207 GLY N N 114.800 0.4 1 327 388 208 GLY H H 7.757 0.05 1 328 388 208 GLY N N 110.380 0.4 1 329 389 209 ARG H H 7.761 0.05 1 330 389 209 ARG N N 119.881 0.4 1 331 390 210 SER H H 8.368 0.05 1 332 390 210 SER N N 116.610 0.4 1 333 391 211 LEU H H 8.779 0.05 1 334 391 211 LEU N N 119.359 0.4 1 335 392 212 SER H H 9.438 0.05 1 336 392 212 SER N N 119.020 0.4 1 337 393 213 VAL H H 8.705 0.05 1 338 393 213 VAL N N 128.538 0.4 1 339 394 214 LEU H H 8.078 0.05 1 340 394 214 LEU N N 127.160 0.4 1 341 397 217 SER H H 7.661 0.05 1 342 397 217 SER N N 121.734 0.4 1 343 399 219 ILE H H 8.837 0.05 1 344 399 219 ILE N N 127.210 0.4 1 345 400 220 ILE H H 9.290 0.05 1 346 400 220 ILE N N 129.102 0.4 1 347 401 221 ALA H H 8.652 0.05 1 348 401 221 ALA N N 130.602 0.4 1 349 402 222 ASN H H 9.788 0.05 1 350 402 222 ASN N N 117.726 0.4 1 351 404 224 ASP H H 8.803 0.05 1 352 404 224 ASP N N 124.809 0.4 1 353 405 225 ILE H H 7.143 0.05 1 354 405 225 ILE N N 114.384 0.4 1 355 407 227 GLU H H 10.178 0.05 1 356 407 227 GLU N N 118.411 0.4 1 357 408 228 ALA H H 7.505 0.05 1 358 408 228 ALA N N 119.922 0.4 1 359 409 229 TYR H H 7.016 0.05 1 360 409 229 TYR N N 118.944 0.4 1 361 411 231 LEU H H 7.390 0.05 1 362 411 231 LEU N N 120.760 0.4 1 363 413 233 GLY H H 8.008 0.05 1 364 413 233 GLY N N 105.023 0.4 1 365 414 234 TYR H H 7.884 0.05 1 366 414 234 TYR N N 122.988 0.4 1 367 415 235 PHE H H 8.946 0.05 1 368 415 235 PHE N N 124.156 0.4 1 369 416 236 ASP H H 8.227 0.05 1 370 416 236 ASP N N 118.071 0.4 1 371 417 237 ALA H H 7.217 0.05 1 372 417 237 ALA N N 121.152 0.4 1 373 418 238 GLU H H 7.916 0.05 1 374 418 238 GLU N N 117.492 0.4 1 375 419 239 GLY H H 7.510 0.05 1 376 419 239 GLY N N 108.850 0.4 1 377 420 240 GLY H H 7.790 0.05 1 378 420 240 GLY N N 118.813 0.4 1 379 421 241 ALA H H 7.431 0.05 1 380 421 241 ALA N N 123.097 0.4 1 381 422 242 LEU H H 7.238 0.05 1 382 422 242 LEU N N 126.471 0.4 1 stop_ save_