data_27398 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; A low-complexity region in the YTH domain protein Mmi1 enhances RNA binding ; _BMRB_accession_number 27398 _BMRB_flat_file_name bmr27398.str _Entry_type original _Submission_date 2018-02-08 _Accession_date 2018-02-08 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Assignments of the USR and YTH domains of Mmi1 in the absence of RNA.' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Stowell James AW . 2 Wagstaff Jane L. . 3 Hill Chris H. . 4 Yu Minmin . . 5 McLaughlin Stephen H. . 6 Freund Stefan MV . 7 Passmore Lori A. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 123 "13C chemical shifts" 393 "15N chemical shifts" 123 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-06-22 update BMRB 'update entry citation' 2018-04-24 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 27399 'USR+YTH domain (RNA complex)' stop_ _Original_release_date 2018-02-08 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; A low-complexity region in the YTH domain protein Mmi1 enhances RNA binding. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29695507 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Stowell James AW . 2 Wagstaff Jane L. . 3 Hill Chris H. . 4 Yu Minmin . . 5 McLaughlin Stephen H. . 6 Freund Stefan MV . 7 Passmore Lori A. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_name_full 'The Journal of biological chemistry' _Journal_volume 293 _Journal_issue 24 _Journal_ISSN 1083-351X _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 9210 _Page_last 9222 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name 'USR+YTH domain (APO)' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'USR+YTH domain' $USR+YTH_domain stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_USR+YTH_domain _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common USR+YTH_domain _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 207 _Mol_residue_sequence ; GAYPEKSSYLLSNSSNDSAS RKEKPKARASTPPPLNFSRA SEHRNEKGERISMINPRVVL DENGISHRSRYFIMLCDNET AIAHAKKTSIWAVKKDSSKR ISDAYKKASVYFIFVAQQTY NALGYAQVVSDLNSTELPFW SDSSHAGGVRIKWIKTCNLF SAEISEIVSHMDHGSEARDG MEMMYDEGSRLCTLINYAIM KRIGRDR ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 282 GLY 2 283 ALA 3 284 TYR 4 285 PRO 5 286 GLU 6 287 LYS 7 288 SER 8 289 SER 9 290 TYR 10 291 LEU 11 292 LEU 12 293 SER 13 294 ASN 14 295 SER 15 296 SER 16 297 ASN 17 298 ASP 18 299 SER 19 300 ALA 20 301 SER 21 302 ARG 22 303 LYS 23 304 GLU 24 305 LYS 25 306 PRO 26 307 LYS 27 308 ALA 28 309 ARG 29 310 ALA 30 311 SER 31 312 THR 32 313 PRO 33 314 PRO 34 315 PRO 35 316 LEU 36 317 ASN 37 318 PHE 38 319 SER 39 320 ARG 40 321 ALA 41 322 SER 42 323 GLU 43 324 HIS 44 325 ARG 45 326 ASN 46 327 GLU 47 328 LYS 48 329 GLY 49 330 GLU 50 331 ARG 51 332 ILE 52 333 SER 53 334 MET 54 335 ILE 55 336 ASN 56 337 PRO 57 338 ARG 58 339 VAL 59 340 VAL 60 341 LEU 61 342 ASP 62 343 GLU 63 344 ASN 64 345 GLY 65 346 ILE 66 347 SER 67 348 HIS 68 349 ARG 69 350 SER 70 351 ARG 71 352 TYR 72 353 PHE 73 354 ILE 74 355 MET 75 356 LEU 76 357 CYS 77 358 ASP 78 359 ASN 79 360 GLU 80 361 THR 81 362 ALA 82 363 ILE 83 364 ALA 84 365 HIS 85 366 ALA 86 367 LYS 87 368 LYS 88 369 THR 89 370 SER 90 371 ILE 91 372 TRP 92 373 ALA 93 374 VAL 94 375 LYS 95 376 LYS 96 377 ASP 97 378 SER 98 379 SER 99 380 LYS 100 381 ARG 101 382 ILE 102 383 SER 103 384 ASP 104 385 ALA 105 386 TYR 106 387 LYS 107 388 LYS 108 389 ALA 109 390 SER 110 391 VAL 111 392 TYR 112 393 PHE 113 394 ILE 114 395 PHE 115 396 VAL 116 397 ALA 117 398 GLN 118 399 GLN 119 400 THR 120 401 TYR 121 402 ASN 122 403 ALA 123 404 LEU 124 405 GLY 125 406 TYR 126 407 ALA 127 408 GLN 128 409 VAL 129 410 VAL 130 411 SER 131 412 ASP 132 413 LEU 133 414 ASN 134 415 SER 135 416 THR 136 417 GLU 137 418 LEU 138 419 PRO 139 420 PHE 140 421 TRP 141 422 SER 142 423 ASP 143 424 SER 144 425 SER 145 426 HIS 146 427 ALA 147 428 GLY 148 429 GLY 149 430 VAL 150 431 ARG 151 432 ILE 152 433 LYS 153 434 TRP 154 435 ILE 155 436 LYS 156 437 THR 157 438 CYS 158 439 ASN 159 440 LEU 160 441 PHE 161 442 SER 162 443 ALA 163 444 GLU 164 445 ILE 165 446 SER 166 447 GLU 167 448 ILE 168 449 VAL 169 450 SER 170 451 HIS 171 452 MET 172 453 ASP 173 454 HIS 174 455 GLY 175 456 SER 176 457 GLU 177 458 ALA 178 459 ARG 179 460 ASP 180 461 GLY 181 462 MET 182 463 GLU 183 464 MET 184 465 MET 185 466 TYR 186 467 ASP 187 468 GLU 188 469 GLY 189 470 SER 190 471 ARG 191 472 LEU 192 473 CYS 193 474 THR 194 475 LEU 195 476 ILE 196 477 ASN 197 478 TYR 198 479 ALA 199 480 ILE 200 481 MET 201 482 LYS 202 483 ARG 203 484 ILE 204 485 GLY 205 486 ARG 206 487 ASP 207 488 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $USR+YTH_domain 'fission yeast' 4896 Eukaryota Fungi Schizosaccharomyces pombe stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $USR+YTH_domain 'recombinant technology' . Escherichia coli . pET28 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $USR+YTH_domain 200 uM '[U-100% 13C; U-100% 15N; U-80% 2H]' D2O 5 % '[U-100% 2H]' 'sodium chloride' 150 mM 'natural abundance' PIPES 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_Topspin _Saveframe_category software _Name Topspin_3.1 _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_qMDD _Saveframe_category software _Name qMDD _Version . loop_ _Vendor _Address _Electronic_address 'Kazimierczuk and Orekhov' . . stop_ loop_ _Task processing stop_ _Details . save_ save_nmrPipe _Saveframe_category software _Name nmrPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_Sparky _Saveframe_category software _Name Sparky _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ ############################# # NMR applied experiments # ############################# save_15N-1H_BEST_TROSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-1H BEST_TROSY' _Sample_label $sample_1 save_ save_3D_trHNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCO' _Sample_label $sample_1 save_ save_3D_trHNCACO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCACO' _Sample_label $sample_1 save_ save_3D_trHNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCA' _Sample_label $sample_1 save_ save_3D_trHNCOCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCOCA' _Sample_label $sample_1 save_ save_3D_trHNCOCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCOCACB' _Sample_label $sample_1 save_ save_3D_trHNCACB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCACB' _Sample_label $sample_1 save_ save_3D_trHNCANNH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCANNH' _Sample_label $sample_1 save_ save_3D_trHNCOCANNH_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D trHNCOCANNH' _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 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_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 TSP C 13 'methyl protons' ppm 0 external indirect . . . 0.251449530 TSP H 1 'methyl protons' ppm 0 external indirect . . . 1.0 TSP N 15 'methyl protons' ppm 0 external indirect . . . 0.101329118 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 _Saveframe_category assigned_chemical_shifts _Details ; Reference offsets by PANAV: CO: -0.35ppm CA: -0.09ppm CB: 0.51ppm N: 0.26ppm ; loop_ _Software_label $Topspin $qMDD $nmrPipe $Sparky stop_ loop_ _Experiment_label '15N-1H BEST_TROSY' '3D trHNCO' '3D trHNCACO' '3D trHNCA' '3D trHNCOCA' '3D trHNCOCACB' '3D trHNCACB' '3D trHNCANNH' '3D trHNCOCANNH' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'USR+YTH domain' _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 1 282 1 GLY H H 8.23 0.02 1 2 282 1 GLY C C 173.7 0.1 1 3 282 1 GLY CA C 45.02 0.04 1 4 282 1 GLY N N 110.48 0.2 1 5 283 2 ALA H H 7.92 0.02 1 6 283 2 ALA C C 177.36 0.1 1 7 283 2 ALA CA C 52.09 0.04 1 8 283 2 ALA CB C 18.89 0.02 1 9 283 2 ALA N N 123.71 0.2 1 10 284 3 TYR H H 8.03 0.02 1 11 284 3 TYR C C 174.42 0.1 1 12 284 3 TYR CA C 55.59 0.04 1 13 284 3 TYR CB C 37.74 0.02 1 14 284 3 TYR N N 120.51 0.2 1 15 297 16 ASN C C 175.46 0.1 1 16 297 16 ASN CA C 53.31 0.04 1 17 297 16 ASN CB C 38.62 0.02 1 18 298 17 ASP H H 8.15 0.02 1 19 298 17 ASP C C 177.16 0.1 1 20 298 17 ASP CA C 54.45 0.04 1 21 298 17 ASP CB C 40.92 0.02 1 22 298 17 ASP N N 121.35 0.2 1 23 299 18 SER H H 8.19 0.02 1 24 299 18 SER C C 175.43 0.1 1 25 299 18 SER CA C 59.13 0.04 1 26 299 18 SER CB C 63.22 0.02 1 27 299 18 SER N N 116.62 0.2 1 28 300 19 ALA H H 8.15 0.02 1 29 300 19 ALA CA C 53.07 0.04 1 30 300 19 ALA CB C 18.43 0.02 1 31 300 19 ALA N N 125.6 0.2 1 32 306 25 PRO C C 177.25 0.1 1 33 306 25 PRO CA C 63 0.04 1 34 306 25 PRO CB C 31.66 0.02 1 35 307 26 LYS H H 8.29 0.02 1 36 307 26 LYS C C 176.74 0.1 1 37 307 26 LYS CA C 56.07 0.04 1 38 307 26 LYS CB C 32.77 0.02 1 39 307 26 LYS N N 122.42 0.2 1 40 308 27 ALA H H 8.18 0.02 1 41 308 27 ALA C C 177.92 0.1 1 42 308 27 ALA CA C 52.27 0.04 1 43 308 27 ALA CB C 18.9 0.02 1 44 308 27 ALA N N 125.8 0.2 1 45 309 28 ARG H H 8.21 0.02 1 46 309 28 ARG C C 178.56 0.1 1 47 309 28 ARG CA C 55.85 0.04 1 48 309 28 ARG CB C 30.71 0.02 1 49 309 28 ARG N N 121.29 0.2 1 50 328 47 LYS C C 177.15 0.1 1 51 328 47 LYS CA C 55.8 0.04 1 52 328 47 LYS CB C 32.04 0.02 1 53 329 48 GLY H H 8.02 0.02 1 54 329 48 GLY C C 174.98 0.1 1 55 329 48 GLY CA C 45.16 0.04 1 56 329 48 GLY N N 107.87 0.2 1 57 330 49 GLU H H 7.93 0.02 1 58 330 49 GLU C C 176.51 0.1 1 59 330 49 GLU CA C 55.09 0.04 1 60 330 49 GLU CB C 29.26 0.02 1 61 330 49 GLU N N 122.89 0.2 1 62 331 50 ARG H H 8.81 0.02 1 63 331 50 ARG C C 177.28 0.1 1 64 331 50 ARG CA C 56.83 0.04 1 65 331 50 ARG CB C 29.52 0.02 1 66 331 50 ARG N N 124.28 0.2 1 67 332 51 ILE H H 7.86 0.02 1 68 332 51 ILE C C 177.49 0.1 1 69 332 51 ILE CA C 62 0.04 1 70 332 51 ILE CB C 37.87 0.02 1 71 332 51 ILE N N 119.96 0.2 1 72 354 73 ILE C C 172.45 0.1 1 73 354 73 ILE CA C 57.05 0.04 1 74 355 74 MET H H 8.29 0.02 1 75 355 74 MET C C 175.28 0.1 1 76 355 74 MET CA C 51.62 0.04 1 77 355 74 MET CB C 32.19 0.02 1 78 355 74 MET N N 125.53 0.2 1 79 356 75 LEU H H 9.15 0.02 1 80 356 75 LEU C C 177.98 0.1 1 81 356 75 LEU CA C 53.12 0.04 1 82 356 75 LEU CB C 42.29 0.02 1 83 356 75 LEU N N 126.08 0.2 1 84 357 76 CYS H H 8.98 0.02 1 85 357 76 CYS C C 175.81 0.1 1 86 357 76 CYS CA C 59.73 0.04 1 87 357 76 CYS CB C 29.1 0.02 1 88 357 76 CYS N N 122.91 0.2 1 89 360 79 GLU C C 178.53 0.1 1 90 360 79 GLU CA C 58.98 0.04 1 91 360 79 GLU CB C 29.02 0.02 1 92 361 80 THR H H 7.99 0.02 1 93 361 80 THR C C 176.41 0.1 1 94 361 80 THR CA C 66.08 0.04 1 95 361 80 THR CB C 68.35 0.02 1 96 361 80 THR N N 117.63 0.2 1 97 362 81 ALA H H 7.21 0.02 1 98 362 81 ALA C C 179.45 0.1 1 99 362 81 ALA CA C 54.55 0.04 1 100 362 81 ALA CB C 16.67 0.02 1 101 362 81 ALA N N 124.3 0.2 1 102 363 82 ILE H H 7.21 0.02 1 103 363 82 ILE C C 177.02 0.1 1 104 363 82 ILE CA C 61.25 0.04 1 105 363 82 ILE CB C 37.23 0.02 1 106 363 82 ILE N N 115.33 0.2 1 107 364 83 ALA H H 7.73 0.02 1 108 364 83 ALA C C 181.81 0.1 1 109 364 83 ALA CA C 55.26 0.04 1 110 364 83 ALA CB C 17.34 0.02 1 111 364 83 ALA N N 125.13 0.2 1 112 365 84 HIS H H 8.08 0.02 1 113 365 84 HIS C C 180.04 0.1 1 114 365 84 HIS CA C 60.66 0.04 1 115 365 84 HIS CB C 30.74 0.02 1 116 365 84 HIS N N 119.29 0.2 1 117 366 85 ALA H H 9.08 0.02 1 118 366 85 ALA C C 182.98 0.1 1 119 366 85 ALA CA C 55.75 0.04 1 120 366 85 ALA CB C 20.09 0.02 1 121 366 85 ALA N N 126.3 0.2 1 122 367 86 LYS H H 8.5 0.02 1 123 367 86 LYS C C 177.47 0.1 1 124 367 86 LYS CA C 60.08 0.04 1 125 367 86 LYS CB C 31.54 0.02 1 126 367 86 LYS N N 121.33 0.2 1 127 368 87 LYS H H 7.43 0.02 1 128 368 87 LYS C C 179.17 0.1 1 129 368 87 LYS CA C 58.3 0.04 1 130 368 87 LYS CB C 33.22 0.02 1 131 368 87 LYS N N 118.39 0.2 1 132 369 88 THR H H 8.51 0.02 1 133 369 88 THR C C 175.48 0.1 1 134 369 88 THR CA C 62.84 0.04 1 135 369 88 THR CB C 71.29 0.02 1 136 369 88 THR N N 108.43 0.2 1 137 370 89 SER H H 8.46 0.02 1 138 370 89 SER C C 173.29 0.1 1 139 370 89 SER CA C 60.96 0.04 1 140 370 89 SER CB C 60.03 0.02 1 141 370 89 SER N N 113.89 0.2 1 142 371 90 ILE H H 7.17 0.02 1 143 371 90 ILE C C 175.01 0.1 1 144 371 90 ILE CA C 59.19 0.04 1 145 371 90 ILE CB C 40.68 0.02 1 146 371 90 ILE N N 117.86 0.2 1 147 372 91 TRP H H 8.96 0.02 1 148 372 91 TRP C C 173.84 0.1 1 149 372 91 TRP CA C 54.51 0.04 1 150 372 91 TRP CB C 34.22 0.02 1 151 372 91 TRP N N 124.77 0.2 1 152 373 92 ALA C C 174.28 0.1 1 153 373 92 ALA CA C 50.54 0.04 1 154 373 92 ALA CB C 18.9 0.02 1 155 374 93 VAL H H 8.04 0.02 1 156 374 93 VAL C C 176.77 0.1 1 157 374 93 VAL CA C 60.3 0.04 1 158 374 93 VAL CB C 33.3 0.02 1 159 374 93 VAL N N 120.16 0.2 1 160 375 94 LYS H H 9.48 0.02 1 161 375 94 LYS C C 178.25 0.1 1 162 375 94 LYS CA C 56.84 0.04 1 163 375 94 LYS CB C 32.87 0.02 1 164 375 94 LYS N N 129.3 0.2 1 165 376 95 LYS H H 8.84 0.02 1 166 376 95 LYS C C 179.32 0.1 1 167 376 95 LYS CA C 59.88 0.04 1 168 376 95 LYS CB C 31.82 0.02 1 169 376 95 LYS N N 121.07 0.2 1 170 377 96 ASP C C 177.14 0.1 1 171 377 96 ASP CA C 56.56 0.04 1 172 377 96 ASP CB C 39.92 0.02 1 173 378 97 SER H H 7.26 0.02 1 174 378 97 SER C C 175.75 0.1 1 175 378 97 SER CA C 57.8 0.04 1 176 378 97 SER CB C 64.44 0.02 1 177 378 97 SER N N 112.06 0.2 1 178 379 98 SER H H 7.55 0.02 1 179 379 98 SER C C 175.77 0.1 1 180 379 98 SER CA C 62.33 0.04 1 181 379 98 SER N N 117.3 0.2 1 182 380 99 LYS H H 8.33 0.02 1 183 380 99 LYS C C 178.89 0.1 1 184 380 99 LYS CA C 59.56 0.04 1 185 380 99 LYS CB C 31.12 0.02 1 186 380 99 LYS N N 124.73 0.2 1 187 381 100 ARG H H 8.04 0.02 1 188 381 100 ARG C C 179.7 0.1 1 189 381 100 ARG CA C 59.17 0.04 1 190 381 100 ARG CB C 29.65 0.02 1 191 381 100 ARG N N 119.56 0.2 1 192 382 101 ILE H H 7.41 0.02 1 193 382 101 ILE C C 177.1 0.1 1 194 382 101 ILE CA C 65.4 0.04 1 195 382 101 ILE CB C 37.46 0.02 1 196 382 101 ILE N N 119.27 0.2 1 197 383 102 SER H H 8.23 0.02 1 198 383 102 SER C C 177.92 0.1 1 199 383 102 SER CA C 61.52 0.04 1 200 383 102 SER CB C 63.18 0.02 1 201 383 102 SER N N 114.86 0.2 1 202 384 103 ASP H H 8.33 0.02 1 203 384 103 ASP C C 179.27 0.1 1 204 384 103 ASP CA C 57.31 0.04 1 205 384 103 ASP CB C 40.73 0.02 1 206 384 103 ASP N N 119.57 0.2 1 207 385 104 ALA H H 7.94 0.02 1 208 385 104 ALA C C 178.8 0.1 1 209 385 104 ALA CA C 55.74 0.04 1 210 385 104 ALA CB C 17.85 0.02 1 211 385 104 ALA N N 121.84 0.2 1 212 386 105 TYR H H 8.34 0.02 1 213 386 105 TYR C C 176.23 0.1 1 214 386 105 TYR CA C 60.42 0.04 1 215 386 105 TYR CB C 38.24 0.02 1 216 386 105 TYR N N 118 0.2 1 217 387 106 LYS H H 7.21 0.02 1 218 387 106 LYS C C 177.94 0.1 1 219 387 106 LYS CA C 58.09 0.04 1 220 387 106 LYS CB C 32.6 0.02 1 221 387 106 LYS N N 114.68 0.2 1 222 388 107 LYS H H 7.27 0.02 1 223 388 107 LYS C C 175.39 0.1 1 224 388 107 LYS CA C 56.13 0.04 1 225 388 107 LYS CB C 35.3 0.02 1 226 388 107 LYS N N 115.26 0.2 1 227 389 108 ALA H H 8.14 0.02 1 228 389 108 ALA C C 177.3 0.1 1 229 389 108 ALA CA C 50.96 0.04 1 230 389 108 ALA CB C 21.42 0.02 1 231 389 108 ALA N N 123.6 0.2 1 232 390 109 SER H H 7.64 0.02 1 233 390 109 SER C C 172.75 0.1 1 234 390 109 SER CA C 59.33 0.04 1 235 390 109 SER CB C 63.56 0.02 1 236 390 109 SER N N 115.42 0.2 1 237 391 110 VAL H H 9.02 0.02 1 238 391 110 VAL C C 173.76 0.1 1 239 391 110 VAL CA C 60.99 0.04 1 240 391 110 VAL CB C 34.01 0.02 1 241 391 110 VAL N N 126.54 0.2 1 242 392 111 TYR H H 8.98 0.02 1 243 392 111 TYR C C 176.42 0.1 1 244 392 111 TYR CA C 55.84 0.04 1 245 392 111 TYR N N 125.1 0.2 1 246 393 112 PHE H H 8.27 0.02 1 247 393 112 PHE CA C 52.21 0.04 1 248 393 112 PHE N N 125.99 0.2 1 249 394 113 ILE C C 174.04 0.1 1 250 394 113 ILE CA C 60.72 0.04 1 251 395 114 PHE H H 8.76 0.02 1 252 395 114 PHE C C 175.25 0.1 1 253 395 114 PHE CA C 57.05 0.04 1 254 395 114 PHE CB C 40.5 0.02 1 255 395 114 PHE N N 126.08 0.2 1 256 396 115 VAL H H 8.83 0.02 1 257 396 115 VAL C C 174.6 0.1 1 258 396 115 VAL CA C 59.29 0.04 1 259 396 115 VAL N N 123.38 0.2 1 260 397 116 ALA H H 9.44 0.02 1 261 397 116 ALA C C 177.33 0.1 1 262 397 116 ALA CA C 51.96 0.04 1 263 397 116 ALA CB C 18.98 0.02 1 264 397 116 ALA N N 130.11 0.2 1 265 398 117 GLN H H 8.12 0.02 1 266 398 117 GLN C C 177.25 0.1 1 267 398 117 GLN CA C 63.2 0.04 1 268 398 117 GLN CB C 28.71 0.02 1 269 398 117 GLN N N 123.79 0.2 1 270 400 119 THR C C 175.75 0.1 1 271 400 119 THR CA C 61.16 0.04 1 272 401 120 TYR H H 7.68 0.02 1 273 401 120 TYR C C 175.6 0.1 1 274 401 120 TYR CA C 56.56 0.04 1 275 401 120 TYR CB C 33.49 0.02 1 276 401 120 TYR N N 113.3 0.2 1 277 402 121 ASN H H 7.92 0.02 1 278 402 121 ASN C C 176.66 0.1 1 279 402 121 ASN CA C 54.4 0.04 1 280 402 121 ASN CB C 37.15 0.02 1 281 402 121 ASN N N 117.67 0.2 1 282 403 122 ALA H H 9.01 0.02 1 283 403 122 ALA C C 177.69 0.1 1 284 403 122 ALA CA C 52.03 0.04 1 285 403 122 ALA CB C 18.82 0.02 1 286 403 122 ALA N N 123.9 0.2 1 287 404 123 LEU C C 179 0.1 1 288 404 123 LEU CA C 53.51 0.04 1 289 405 124 GLY H H 7.25 0.02 1 290 405 124 GLY C C 172.11 0.1 1 291 405 124 GLY CA C 44.46 0.04 1 292 405 124 GLY N N 105.23 0.2 1 293 406 125 TYR H H 9.13 0.02 1 294 406 125 TYR C C 173.84 0.1 1 295 406 125 TYR CA C 57.46 0.04 1 296 406 125 TYR CB C 41.31 0.02 1 297 406 125 TYR N N 113.48 0.2 1 298 407 126 ALA H H 9.34 0.02 1 299 407 126 ALA C C 174.94 0.1 1 300 407 126 ALA CA C 50.7 0.04 1 301 407 126 ALA CB C 25.02 0.02 1 302 407 126 ALA N N 123.22 0.2 1 303 408 127 GLN C C 175.58 0.1 1 304 408 127 GLN CA C 53.83 0.04 1 305 408 127 GLN CB C 33.38 0.02 1 306 409 128 VAL H H 8.53 0.02 1 307 409 128 VAL C C 176.88 0.1 1 308 409 128 VAL CA C 64.1 0.04 1 309 409 128 VAL CB C 31.21 0.02 1 310 409 128 VAL N N 128.75 0.2 1 311 410 129 VAL H H 8.52 0.02 1 312 410 129 VAL C C 175.34 0.1 1 313 410 129 VAL CA C 60.5 0.04 1 314 410 129 VAL CB C 31.54 0.02 1 315 410 129 VAL N N 118.86 0.2 1 316 411 130 SER H H 7.34 0.02 1 317 411 130 SER C C 183.68 0.1 1 318 411 130 SER CA C 58.13 0.04 1 319 411 130 SER CB C 66.28 0.02 1 320 411 130 SER N N 117 0.2 1 321 412 131 ASP H H 7.66 0.02 1 322 412 131 ASP C C 177.11 0.1 1 323 412 131 ASP CA C 51.48 0.04 1 324 412 131 ASP CB C 41.38 0.02 1 325 412 131 ASP N N 114.79 0.2 1 326 413 132 LEU H H 8.93 0.02 1 327 413 132 LEU C C 177.61 0.1 1 328 413 132 LEU CA C 55.83 0.04 1 329 413 132 LEU CB C 41.8 0.02 1 330 413 132 LEU N N 123.3 0.2 1 331 414 133 ASN H H 8.88 0.02 1 332 414 133 ASN CA C 52.36 0.04 1 333 414 133 ASN CB C 39.65 0.02 1 334 414 133 ASN N N 122.32 0.2 1 335 415 134 SER C C 174.89 0.1 1 336 415 134 SER CA C 60.46 0.04 1 337 415 134 SER CB C 59.11 0.02 1 338 416 135 THR H H 7.98 0.02 1 339 416 135 THR C C 174.76 0.1 1 340 416 135 THR CA C 62.33 0.04 1 341 416 135 THR CB C 69.24 0.02 1 342 416 135 THR N N 112.54 0.2 1 343 417 136 GLU H H 7.21 0.02 1 344 417 136 GLU C C 174.68 0.1 1 345 417 136 GLU CA C 55.1 0.04 1 346 417 136 GLU CB C 29.25 0.02 1 347 417 136 GLU N N 123.4 0.2 1 348 418 137 LEU H H 7.45 0.02 1 349 418 137 LEU C C 175.66 0.1 1 350 418 137 LEU CA C 51.9 0.04 1 351 418 137 LEU CB C 41.4 0.02 1 352 418 137 LEU N N 122.95 0.2 1 353 424 143 SER C C 175.15 0.1 1 354 424 143 SER CA C 60.76 0.04 1 355 424 143 SER CB C 62.88 0.02 1 356 425 144 SER H H 9.28 0.02 1 357 425 144 SER C C 175.53 0.1 1 358 425 144 SER CA C 59.91 0.04 1 359 425 144 SER CB C 63.46 0.02 1 360 425 144 SER N N 118.71 0.2 1 361 426 145 HIS H H 7.97 0.02 1 362 426 145 HIS C C 174.81 0.1 1 363 426 145 HIS CA C 59.65 0.04 1 364 426 145 HIS CB C 32.52 0.02 1 365 426 145 HIS N N 122.88 0.2 1 366 427 146 ALA H H 9.13 0.02 1 367 427 146 ALA C C 177.84 0.1 1 368 427 146 ALA CA C 51.84 0.04 1 369 427 146 ALA CB C 21.35 0.02 1 370 427 146 ALA N N 123.34 0.2 1 371 428 147 GLY H H 7.04 0.02 1 372 428 147 GLY C C 170.97 0.1 1 373 428 147 GLY CA C 44.94 0.04 1 374 428 147 GLY N N 101.1 0.2 1 375 429 148 GLY H H 8.24 0.02 1 376 429 148 GLY C C 173.2 0.1 1 377 429 148 GLY CA C 43.28 0.04 1 378 429 148 GLY N N 108.48 0.2 1 379 430 149 VAL H H 8.44 0.02 1 380 430 149 VAL C C 174.51 0.1 1 381 430 149 VAL CA C 59.05 0.04 1 382 430 149 VAL CB C 34.15 0.02 1 383 430 149 VAL N N 113.23 0.2 1 384 431 150 ARG H H 8.04 0.02 1 385 431 150 ARG C C 176.31 0.1 1 386 431 150 ARG CA C 55.12 0.04 1 387 431 150 ARG CB C 30.21 0.02 1 388 431 150 ARG N N 123.01 0.2 1 389 432 151 ILE H H 7.99 0.02 1 390 432 151 ILE C C 173.93 0.1 1 391 432 151 ILE CA C 58.24 0.04 1 392 432 151 ILE CB C 40.73 0.02 1 393 432 151 ILE N N 115.21 0.2 1 394 433 152 LYS H H 9.1 0.02 1 395 433 152 LYS C C 176.9 0.1 1 396 433 152 LYS CA C 53.56 0.04 1 397 433 152 LYS CB C 34.24 0.02 1 398 433 152 LYS N N 123.16 0.2 1 399 434 153 TRP H H 9.14 0.02 1 400 434 153 TRP C C 176.54 0.1 1 401 434 153 TRP CA C 59.68 0.04 1 402 434 153 TRP CB C 28.8 0.02 1 403 434 153 TRP N N 127.91 0.2 1 404 435 154 ILE H H 8.84 0.02 1 405 435 154 ILE C C 177.09 0.1 1 406 435 154 ILE CA C 62.44 0.04 1 407 435 154 ILE CB C 37.3 0.02 1 408 435 154 ILE N N 126.02 0.2 1 409 436 155 LYS H H 6.93 0.02 1 410 436 155 LYS C C 175.86 0.1 1 411 436 155 LYS CA C 53.38 0.04 1 412 436 155 LYS CB C 36.05 0.02 1 413 436 155 LYS N N 114.16 0.2 1 414 437 156 THR H H 8.17 0.02 1 415 437 156 THR C C 172.7 0.1 1 416 437 156 THR CA C 59.52 0.04 1 417 437 156 THR CB C 70.85 0.02 1 418 437 156 THR N N 110.16 0.2 1 419 438 157 CYS H H 7.53 0.02 1 420 438 157 CYS C C 172.34 0.1 1 421 438 157 CYS CA C 56.71 0.04 1 422 438 157 CYS CB C 30.51 0.02 1 423 438 157 CYS N N 115.65 0.2 1 424 439 158 ASN H H 8.2 0.02 1 425 439 158 ASN C C 174.46 0.1 1 426 439 158 ASN CA C 53.79 0.04 1 427 439 158 ASN CB C 36.57 0.02 1 428 439 158 ASN N N 114.51 0.2 1 429 440 159 LEU H H 8.23 0.02 1 430 440 159 LEU C C 174.2 0.1 1 431 440 159 LEU CA C 53.55 0.04 1 432 440 159 LEU CB C 44.14 0.02 1 433 440 159 LEU N N 120.65 0.2 1 434 441 160 PHE H H 8.77 0.02 1 435 441 160 PHE C C 175.17 0.1 1 436 441 160 PHE CA C 57.8 0.04 1 437 441 160 PHE CB C 40.28 0.02 1 438 441 160 PHE N N 122.87 0.2 1 439 442 161 SER H H 8.17 0.02 1 440 442 161 SER C C 175.9 0.1 1 441 442 161 SER CA C 55.39 0.04 1 442 442 161 SER CB C 64.15 0.02 1 443 442 161 SER N N 123.72 0.2 1 444 445 164 ILE C C 177.66 0.1 1 445 445 164 ILE CA C 61.51 0.04 1 446 446 165 SER H H 7.61 0.02 1 447 446 165 SER C C 177.52 0.1 1 448 446 165 SER CA C 61.53 0.04 1 449 446 165 SER CB C 62.79 0.02 1 450 446 165 SER N N 112.9 0.2 1 451 447 166 GLU H H 8.05 0.02 1 452 447 166 GLU C C 179.22 0.1 1 453 447 166 GLU CA C 59.63 0.04 1 454 447 166 GLU CB C 29.11 0.02 1 455 447 166 GLU N N 122.08 0.2 1 456 448 167 ILE H H 7.07 0.02 1 457 448 167 ILE CA C 65.89 0.04 1 458 448 167 ILE CB C 36.3 0.02 1 459 448 167 ILE N N 119.56 0.2 1 460 449 168 VAL C C 178.01 0.1 1 461 449 168 VAL CA C 67.06 0.04 1 462 449 168 VAL CB C 31.23 0.02 1 463 450 169 SER H H 8.26 0.02 1 464 450 169 SER C C 172.87 0.1 1 465 450 169 SER CA C 61.27 0.04 1 466 450 169 SER CB C 63.3 0.02 1 467 450 169 SER N N 113.81 0.2 1 468 451 170 HIS H H 6.74 0.02 1 469 451 170 HIS C C 175.78 0.1 1 470 451 170 HIS CA C 54.74 0.04 1 471 451 170 HIS CB C 29.73 0.02 1 472 451 170 HIS N N 115.06 0.2 1 473 452 171 MET H H 6.83 0.02 1 474 452 171 MET C C 176.08 0.1 1 475 452 171 MET CA C 58.6 0.04 1 476 452 171 MET CB C 35.38 0.02 1 477 452 171 MET N N 122.11 0.2 1 478 453 172 ASP H H 8.65 0.02 1 479 453 172 ASP C C 176.82 0.1 1 480 453 172 ASP CA C 51.32 0.04 1 481 453 172 ASP CB C 39.75 0.02 1 482 453 172 ASP N N 116.66 0.2 1 483 454 173 HIS H H 8.3 0.02 1 484 454 173 HIS C C 175.34 0.1 1 485 454 173 HIS CA C 56.73 0.04 1 486 454 173 HIS CB C 26.66 0.02 1 487 454 173 HIS N N 119.78 0.2 1 488 455 174 GLY H H 7.43 0.02 1 489 455 174 GLY C C 174.55 0.1 1 490 455 174 GLY CA C 45.58 0.04 1 491 455 174 GLY N N 104.83 0.2 1 492 456 175 SER H H 7.46 0.02 1 493 456 175 SER C C 172.87 0.1 1 494 456 175 SER CA C 57.12 0.04 1 495 456 175 SER CB C 64.23 0.02 1 496 456 175 SER N N 118.29 0.2 1 497 457 176 GLU H H 8.43 0.02 1 498 457 176 GLU C C 175.94 0.1 1 499 457 176 GLU CA C 57.5 0.04 1 500 457 176 GLU CB C 29.55 0.02 1 501 457 176 GLU N N 120.83 0.2 1 502 458 177 ALA H H 7.29 0.02 1 503 458 177 ALA C C 176.01 0.1 1 504 458 177 ALA CA C 53.01 0.04 1 505 458 177 ALA CB C 21.34 0.02 1 506 458 177 ALA N N 118.71 0.2 1 507 459 178 ARG H H 6.58 0.02 1 508 459 178 ARG C C 175.9 0.1 1 509 459 178 ARG CA C 53.7 0.04 1 510 459 178 ARG CB C 31.73 0.02 1 511 459 178 ARG N N 118.63 0.2 1 512 460 179 ASP H H 8.64 0.02 1 513 460 179 ASP C C 177.67 0.1 1 514 460 179 ASP CA C 56.87 0.04 1 515 460 179 ASP CB C 41.79 0.02 1 516 460 179 ASP N N 121.45 0.2 1 517 461 180 GLY H H 8.78 0.02 1 518 461 180 GLY C C 173.52 0.1 1 519 461 180 GLY CA C 45.8 0.04 1 520 461 180 GLY N N 118.82 0.2 1 521 462 181 MET H H 7.66 0.02 1 522 462 181 MET C C 173.84 0.1 1 523 462 181 MET CA C 55.97 0.04 1 524 462 181 MET CB C 32.82 0.02 1 525 462 181 MET N N 117.89 0.2 1 526 463 182 GLU H H 8.27 0.02 1 527 463 182 GLU C C 176.5 0.1 1 528 463 182 GLU CA C 55.29 0.04 1 529 463 182 GLU CB C 28.81 0.02 1 530 463 182 GLU N N 122.04 0.2 1 531 464 183 MET H H 8.01 0.02 1 532 464 183 MET C C 174.33 0.1 1 533 464 183 MET CA C 53.07 0.04 1 534 464 183 MET CB C 33.74 0.02 1 535 464 183 MET N N 125.29 0.2 1 536 465 184 MET H H 8.88 0.02 1 537 465 184 MET CA C 56.82 0.04 1 538 465 184 MET CB C 33.56 0.02 1 539 465 184 MET N N 117.05 0.2 1 540 467 186 ASP C C 179.98 0.1 1 541 467 186 ASP CA C 60.79 0.04 1 542 467 186 ASP CB C 40.47 0.02 1 543 468 187 GLU H H 6.47 0.02 1 544 468 187 GLU C C 177.64 0.1 1 545 468 187 GLU CA C 59.3 0.04 1 546 468 187 GLU CB C 29.65 0.02 1 547 468 187 GLU N N 116.91 0.2 1 548 469 188 GLY H H 7.5 0.02 1 549 469 188 GLY C C 175.32 0.1 1 550 469 188 GLY CA C 47.25 0.04 1 551 469 188 GLY N N 106.33 0.2 1 552 470 189 SER H H 8.04 0.02 1 553 470 189 SER C C 174.61 0.1 1 554 470 189 SER CA C 60.74 0.04 1 555 470 189 SER N N 115.28 0.2 1 556 471 190 ARG H H 8.32 0.02 1 557 471 190 ARG C C 178.27 0.1 1 558 471 190 ARG CA C 57.46 0.04 1 559 471 190 ARG CB C 29.72 0.02 1 560 471 190 ARG N N 123.29 0.2 1 561 472 191 LEU H H 8.13 0.02 1 562 472 191 LEU C C 179.03 0.1 1 563 472 191 LEU CA C 58.71 0.04 1 564 472 191 LEU CB C 41.44 0.02 1 565 472 191 LEU N N 118.89 0.2 1 566 473 192 CYS H H 7.58 0.02 1 567 473 192 CYS C C 176.69 0.1 1 568 473 192 CYS CA C 64.21 0.04 1 569 473 192 CYS CB C 25.87 0.02 1 570 473 192 CYS N N 116.19 0.2 1 571 474 193 THR H H 7.69 0.02 1 572 474 193 THR C C 176.46 0.1 1 573 474 193 THR CA C 67.06 0.04 1 574 474 193 THR CB C 68.42 0.02 1 575 474 193 THR N N 118.02 0.2 1 576 475 194 LEU H H 8.58 0.02 1 577 475 194 LEU C C 180.85 0.1 1 578 475 194 LEU CA C 57.88 0.04 1 579 475 194 LEU CB C 41.79 0.02 1 580 475 194 LEU N N 121.89 0.2 1 581 476 195 ILE H H 6.91 0.02 1 582 476 195 ILE N N 113.77 0.2 1 583 477 196 ASN C C 179.07 0.1 1 584 477 196 ASN CA C 56.33 0.04 1 585 477 196 ASN CB C 36.74 0.02 1 586 478 197 TYR H H 8.5 0.02 1 587 478 197 TYR C C 177.77 0.1 1 588 478 197 TYR CA C 60.38 0.04 1 589 478 197 TYR CB C 37.95 0.02 1 590 478 197 TYR N N 119.67 0.2 1 591 479 198 ALA H H 8.29 0.02 1 592 479 198 ALA C C 180.99 0.1 1 593 479 198 ALA CA C 54.77 0.04 1 594 479 198 ALA CB C 17.99 0.02 1 595 479 198 ALA N N 123.03 0.2 1 596 480 199 ILE H H 7.97 0.02 1 597 480 199 ILE C C 178.61 0.1 1 598 480 199 ILE CA C 64.84 0.04 1 599 480 199 ILE CB C 38.36 0.02 1 600 480 199 ILE N N 118.58 0.2 1 601 481 200 MET H H 7.62 0.02 1 602 481 200 MET C C 178.43 0.1 1 603 481 200 MET CA C 57.79 0.04 1 604 481 200 MET CB C 32.01 0.02 1 605 481 200 MET N N 119.22 0.2 1 606 482 201 LYS H H 7.86 0.02 1 607 482 201 LYS C C 177.71 0.1 1 608 482 201 LYS CA C 57.24 0.04 1 609 482 201 LYS CB C 31.64 0.02 1 610 482 201 LYS N N 118.87 0.2 1 611 483 202 ARG H H 7.62 0.02 1 612 483 202 ARG C C 177.28 0.1 1 613 483 202 ARG CA C 56.76 0.04 1 614 483 202 ARG CB C 29.55 0.02 1 615 483 202 ARG N N 119.64 0.2 1 616 484 203 ILE H H 7.86 0.02 1 617 484 203 ILE C C 177.49 0.1 1 618 484 203 ILE CA C 62 0.04 1 619 484 203 ILE CB C 37.87 0.02 1 620 484 203 ILE N N 119.96 0.2 1 621 485 204 GLY H H 8.19 0.02 1 622 485 204 GLY C C 174.4 0.1 1 623 485 204 GLY CA C 45.39 0.04 1 624 485 204 GLY N N 111.88 0.2 1 625 486 205 ARG H H 7.97 0.02 1 626 486 205 ARG C C 176.28 0.1 1 627 486 205 ARG CA C 55.92 0.04 1 628 486 205 ARG CB C 30.52 0.02 1 629 486 205 ARG N N 120.38 0.2 1 630 487 206 ASP H H 8.33 0.02 1 631 487 206 ASP C C 175.42 0.1 1 632 487 206 ASP CA C 54.53 0.04 1 633 487 206 ASP CB C 40.76 0.02 1 634 487 206 ASP N N 121.45 0.2 1 635 488 207 ARG H H 7.67 0.02 1 636 488 207 ARG C C 181.16 0.1 1 637 488 207 ARG CA C 57.18 0.04 1 638 488 207 ARG CB C 30.95 0.02 1 639 488 207 ARG N N 125.41 0.2 1 stop_ save_